----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-09 02:49:19]------------------------- 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 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 9.063213880928183 0.000000000000000 0.000000000000000 b 0.000000000000000 6.744419509999999 0.000000000000000 c -0.856429673954030 0.000000000000000 6.516775247632142 Atomic positions (fractional): *1 Lu 0.96769106197271 0.11959957745572 0.27372542809736 174.967 2 Lu 0.96769106197271 0.38040042254428 0.77372542809736 174.967 *3 Lu 0.65300580046577 0.14466342951034 0.53000413464264 174.967 4 Lu 0.65300580046577 0.35533657048966 0.03000413464264 174.967 5 Lu 0.34699419953423 0.64466342951033 0.96999586535736 174.967 6 Lu 0.34699419953423 0.85533657048967 0.46999586535736 174.967 7 Lu 0.03230893802729 0.61959957745572 0.22627457190264 174.967 8 Lu 0.03230893802729 0.88040042254428 0.72627457190264 174.967 *9 Ge 0.69889958588173 0.60474987023962 0.52337562956446 72.640 10 Ge 0.69889958588173 0.89525012976038 0.02337562956446 72.640 11 Ge 0.30110041411827 0.10474987023962 0.97662437043554 72.640 12 Ge 0.30110041411827 0.39525012976038 0.47662437043554 72.640 *13 O 0.89486331056776 0.85245825890812 0.03296507068445 15.999 *14 O 0.89537456526777 0.38110091227567 0.08987067780995 15.999 15 O 0.89486331056776 0.64754174109188 0.53296507068445 15.999 16 O 0.89537456526777 0.11889908772433 0.58987067780995 15.999 *17 O 0.72016230401071 0.07114570902427 0.23037742971925 15.999 *18 O 0.59566597054339 0.67886556900757 0.01637960631953 15.999 19 O 0.72016230401071 0.42885429097573 0.73037742971925 15.999 *20 O 0.63333332989278 0.42403110230875 0.34470986374240 15.999 21 O 0.59566597054339 0.82113443099243 0.51637960631953 15.999 22 O 0.63333332989278 0.07596889769125 0.84470986374240 15.999 23 O 0.36666667010722 0.92403110230875 0.15529013625760 15.999 24 O 0.40433402945661 0.17886556900757 0.48362039368047 15.999 25 O 0.36666667010722 0.57596889769125 0.65529013625760 15.999 26 O 0.27983769598929 0.57114570902427 0.26962257028075 15.999 27 O 0.40433402945661 0.32113443099243 0.98362039368047 15.999 28 O 0.27983769598929 0.92885429097573 0.76962257028075 15.999 29 O 0.10462543473223 0.88110091227567 0.41012932219005 15.999 30 O 0.10513668943224 0.35245825890812 0.46703492931555 15.999 31 O 0.10462543473223 0.61889908772433 0.91012932219005 15.999 32 O 0.10513668943224 0.14754174109188 0.96703492931555 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 9.063213880928183 0.000000000000000 0.000000000000000 b 0.000000000000000 6.744419509999999 0.000000000000000 c -0.856429673954030 0.000000000000000 6.516775247632142 Atomic positions (fractional): *1 Lu 0.96769106197271 0.11959957745572 0.27372542809736 174.967 > 1 2 Lu 0.96769106197271 0.38040042254428 0.77372542809736 174.967 > 2 *3 Lu 0.65300580046577 0.14466342951034 0.53000413464264 174.967 > 3 4 Lu 0.65300580046577 0.35533657048966 0.03000413464264 174.967 > 4 5 Lu 0.34699419953423 0.64466342951033 0.96999586535736 174.967 > 5 6 Lu 0.34699419953423 0.85533657048967 0.46999586535736 174.967 > 6 7 Lu 0.03230893802729 0.61959957745572 0.22627457190264 174.967 > 7 8 Lu 0.03230893802729 0.88040042254428 0.72627457190264 174.967 > 8 *9 Ge 0.69889958588173 0.60474987023962 0.52337562956446 72.640 > 9 10 Ge 0.69889958588173 0.89525012976038 0.02337562956446 72.640 > 10 11 Ge 0.30110041411827 0.10474987023962 0.97662437043554 72.640 > 11 12 Ge 0.30110041411827 0.39525012976038 0.47662437043554 72.640 > 12 *13 O 0.89486331056776 0.85245825890812 0.03296507068445 15.999 > 13 *14 O 0.89537456526777 0.38110091227567 0.08987067780995 15.999 > 14 15 O 0.89486331056776 0.64754174109188 0.53296507068445 15.999 > 15 16 O 0.89537456526777 0.11889908772433 0.58987067780995 15.999 > 16 *17 O 0.72016230401071 0.07114570902427 0.23037742971925 15.999 > 17 *18 O 0.59566597054339 0.67886556900757 0.01637960631953 15.999 > 18 19 O 0.72016230401071 0.42885429097573 0.73037742971925 15.999 > 19 *20 O 0.63333332989278 0.42403110230875 0.34470986374240 15.999 > 20 21 O 0.59566597054339 0.82113443099243 0.51637960631953 15.999 > 21 22 O 0.63333332989278 0.07596889769125 0.84470986374240 15.999 > 22 23 O 0.36666667010722 0.92403110230875 0.15529013625760 15.999 > 23 24 O 0.40433402945661 0.17886556900757 0.48362039368047 15.999 > 24 25 O 0.36666667010722 0.57596889769125 0.65529013625760 15.999 > 25 26 O 0.27983769598929 0.57114570902427 0.26962257028075 15.999 > 26 27 O 0.40433402945661 0.32113443099243 0.98362039368047 15.999 > 27 28 O 0.27983769598929 0.92885429097573 0.76962257028075 15.999 > 28 29 O 0.10462543473223 0.88110091227567 0.41012932219005 15.999 > 29 30 O 0.10513668943224 0.35245825890812 0.46703492931555 15.999 > 30 31 O 0.10462543473223 0.61889908772433 0.91012932219005 15.999 > 31 32 O 0.10513668943224 0.14754174109188 0.96703492931555 15.999 > 32 -------------------------------- super cell -------------------------------- Lattice vectors: a 9.063213880928183 0.000000000000000 0.000000000000000 b 0.000000000000000 13.488839019999999 0.000000000000000 c -1.712859347908060 0.000000000000000 13.033550495264285 Atomic positions (fractional): *1 Lu 0.96769106197271 0.05979978872786 0.13686271404868 174.967 > 1 2 Lu 0.96769106197271 0.55979978872786 0.13686271404868 174.967 > 1 3 Lu 0.96769106197271 0.05979978872786 0.63686271404868 174.967 > 1 4 Lu 0.96769106197271 0.55979978872786 0.63686271404868 174.967 > 1 5 Lu 0.96769106197271 0.19020021127214 0.38686271404868 174.967 > 2 6 Lu 0.96769106197271 0.69020021127214 0.38686271404868 174.967 > 2 7 Lu 0.96769106197271 0.19020021127214 0.88686271404868 174.967 > 2 8 Lu 0.96769106197271 0.69020021127214 0.88686271404868 174.967 > 2 *9 Lu 0.65300580046577 0.07233171475517 0.26500206732132 174.967 > 3 10 Lu 0.65300580046577 0.57233171475517 0.26500206732132 174.967 > 3 11 Lu 0.65300580046577 0.07233171475517 0.76500206732132 174.967 > 3 12 Lu 0.65300580046577 0.57233171475517 0.76500206732132 174.967 > 3 13 Lu 0.65300580046577 0.17766828524483 0.01500206732132 174.967 > 4 14 Lu 0.65300580046577 0.67766828524483 0.01500206732132 174.967 > 4 15 Lu 0.65300580046577 0.17766828524483 0.51500206732132 174.967 > 4 16 Lu 0.65300580046577 0.67766828524483 0.51500206732132 174.967 > 4 17 Lu 0.34699419953423 0.32233171475517 0.48499793267868 174.967 > 5 18 Lu 0.34699419953423 0.82233171475517 0.48499793267868 174.967 > 5 19 Lu 0.34699419953423 0.32233171475517 0.98499793267868 174.967 > 5 20 Lu 0.34699419953423 0.82233171475517 0.98499793267868 174.967 > 5 21 Lu 0.34699419953423 0.42766828524483 0.23499793267868 174.967 > 6 22 Lu 0.34699419953423 0.92766828524483 0.23499793267868 174.967 > 6 23 Lu 0.34699419953423 0.42766828524483 0.73499793267868 174.967 > 6 24 Lu 0.34699419953423 0.92766828524483 0.73499793267868 174.967 > 6 25 Lu 0.03230893802729 0.30979978872786 0.11313728595132 174.967 > 7 26 Lu 0.03230893802729 0.80979978872786 0.11313728595132 174.967 > 7 27 Lu 0.03230893802729 0.30979978872786 0.61313728595132 174.967 > 7 28 Lu 0.03230893802729 0.80979978872786 0.61313728595132 174.967 > 7 29 Lu 0.03230893802729 0.44020021127214 0.36313728595132 174.967 > 8 30 Lu 0.03230893802729 0.94020021127214 0.36313728595132 174.967 > 8 31 Lu 0.03230893802729 0.44020021127214 0.86313728595132 174.967 > 8 32 Lu 0.03230893802729 0.94020021127214 0.86313728595132 174.967 > 8 *33 Ge 0.69889958588173 0.30237493511981 0.26168781478223 72.640 > 9 34 Ge 0.69889958588173 0.80237493511981 0.26168781478223 72.640 > 9 35 Ge 0.69889958588173 0.30237493511981 0.76168781478223 72.640 > 9 36 Ge 0.69889958588173 0.80237493511981 0.76168781478223 72.640 > 9 37 Ge 0.69889958588173 0.44762506488019 0.01168781478223 72.640 > 10 38 Ge 0.69889958588173 0.94762506488019 0.01168781478223 72.640 > 10 39 Ge 0.69889958588173 0.44762506488019 0.51168781478223 72.640 > 10 40 Ge 0.69889958588173 0.94762506488019 0.51168781478223 72.640 > 10 41 Ge 0.30110041411827 0.05237493511981 0.48831218521777 72.640 > 11 42 Ge 0.30110041411827 0.55237493511981 0.48831218521777 72.640 > 11 43 Ge 0.30110041411827 0.05237493511981 0.98831218521777 72.640 > 11 44 Ge 0.30110041411827 0.55237493511981 0.98831218521777 72.640 > 11 45 Ge 0.30110041411827 0.19762506488019 0.23831218521777 72.640 > 12 46 Ge 0.30110041411827 0.69762506488019 0.23831218521777 72.640 > 12 47 Ge 0.30110041411827 0.19762506488019 0.73831218521777 72.640 > 12 48 Ge 0.30110041411827 0.69762506488019 0.73831218521777 72.640 > 12 *49 O 0.89486331056776 0.42622912945406 0.01648253534222 15.999 > 13 50 O 0.89486331056776 0.92622912945406 0.01648253534222 15.999 > 13 51 O 0.89486331056776 0.42622912945406 0.51648253534222 15.999 > 13 52 O 0.89486331056776 0.92622912945406 0.51648253534222 15.999 > 13 *53 O 0.89537456526777 0.19055045613784 0.04493533890498 15.999 > 14 54 O 0.89537456526777 0.69055045613784 0.04493533890498 15.999 > 14 55 O 0.89537456526777 0.19055045613784 0.54493533890498 15.999 > 14 56 O 0.89537456526777 0.69055045613784 0.54493533890498 15.999 > 14 57 O 0.89486331056776 0.32377087054594 0.26648253534222 15.999 > 15 58 O 0.89486331056776 0.82377087054594 0.26648253534222 15.999 > 15 59 O 0.89486331056776 0.32377087054594 0.76648253534222 15.999 > 15 60 O 0.89486331056776 0.82377087054594 0.76648253534222 15.999 > 15 61 O 0.89537456526777 0.05944954386216 0.29493533890498 15.999 > 16 62 O 0.89537456526777 0.55944954386216 0.29493533890498 15.999 > 16 63 O 0.89537456526777 0.05944954386216 0.79493533890498 15.999 > 16 64 O 0.89537456526777 0.55944954386216 0.79493533890498 15.999 > 16 *65 O 0.72016230401071 0.03557285451214 0.11518871485962 15.999 > 17 66 O 0.72016230401071 0.53557285451213 0.11518871485962 15.999 > 17 67 O 0.72016230401071 0.03557285451214 0.61518871485962 15.999 > 17 68 O 0.72016230401071 0.53557285451213 0.61518871485962 15.999 > 17 *69 O 0.59566597054339 0.33943278450378 0.00818980315977 15.999 > 18 70 O 0.59566597054339 0.83943278450378 0.00818980315977 15.999 > 18 71 O 0.59566597054339 0.33943278450378 0.50818980315977 15.999 > 18 72 O 0.59566597054339 0.83943278450378 0.50818980315977 15.999 > 18 73 O 0.72016230401071 0.21442714548787 0.36518871485962 15.999 > 19 74 O 0.72016230401071 0.71442714548787 0.36518871485962 15.999 > 19 75 O 0.72016230401071 0.21442714548787 0.86518871485962 15.999 > 19 76 O 0.72016230401071 0.71442714548787 0.86518871485962 15.999 > 19 *77 O 0.63333332989278 0.21201555115438 0.17235493187120 15.999 > 20 78 O 0.63333332989278 0.71201555115437 0.17235493187120 15.999 > 20 79 O 0.63333332989278 0.21201555115438 0.67235493187120 15.999 > 20 80 O 0.63333332989278 0.71201555115437 0.67235493187120 15.999 > 20 81 O 0.59566597054339 0.41056721549622 0.25818980315977 15.999 > 21 82 O 0.59566597054339 0.91056721549622 0.25818980315977 15.999 > 21 83 O 0.59566597054339 0.41056721549622 0.75818980315977 15.999 > 21 84 O 0.59566597054339 0.91056721549622 0.75818980315977 15.999 > 21 85 O 0.63333332989278 0.03798444884562 0.42235493187120 15.999 > 22 86 O 0.63333332989278 0.53798444884563 0.42235493187120 15.999 > 22 87 O 0.63333332989278 0.03798444884562 0.92235493187120 15.999 > 22 88 O 0.63333332989278 0.53798444884563 0.92235493187120 15.999 > 22 89 O 0.36666667010722 0.46201555115437 0.07764506812880 15.999 > 23 90 O 0.36666667010722 0.96201555115437 0.07764506812880 15.999 > 23 91 O 0.36666667010722 0.46201555115437 0.57764506812880 15.999 > 23 92 O 0.36666667010722 0.96201555115437 0.57764506812880 15.999 > 23 93 O 0.40433402945661 0.08943278450378 0.24181019684023 15.999 > 24 94 O 0.40433402945661 0.58943278450378 0.24181019684023 15.999 > 24 95 O 0.40433402945661 0.08943278450378 0.74181019684023 15.999 > 24 96 O 0.40433402945661 0.58943278450378 0.74181019684023 15.999 > 24 97 O 0.36666667010722 0.28798444884563 0.32764506812880 15.999 > 25 98 O 0.36666667010722 0.78798444884563 0.32764506812880 15.999 > 25 99 O 0.36666667010722 0.28798444884563 0.82764506812880 15.999 > 25 100 O 0.36666667010722 0.78798444884563 0.82764506812880 15.999 > 25 101 O 0.27983769598929 0.28557285451213 0.13481128514038 15.999 > 26 102 O 0.27983769598929 0.78557285451213 0.13481128514038 15.999 > 26 103 O 0.27983769598929 0.28557285451213 0.63481128514038 15.999 > 26 104 O 0.27983769598929 0.78557285451213 0.63481128514038 15.999 > 26 105 O 0.40433402945661 0.16056721549622 0.49181019684023 15.999 > 27 106 O 0.40433402945661 0.66056721549622 0.49181019684023 15.999 > 27 107 O 0.40433402945661 0.16056721549622 0.99181019684023 15.999 > 27 108 O 0.40433402945661 0.66056721549622 0.99181019684023 15.999 > 27 109 O 0.27983769598929 0.46442714548787 0.38481128514038 15.999 > 28 110 O 0.27983769598929 0.96442714548787 0.38481128514038 15.999 > 28 111 O 0.27983769598929 0.46442714548787 0.88481128514038 15.999 > 28 112 O 0.27983769598929 0.96442714548787 0.88481128514038 15.999 > 28 113 O 0.10462543473223 0.44055045613784 0.20506466109502 15.999 > 29 114 O 0.10462543473223 0.94055045613784 0.20506466109502 15.999 > 29 115 O 0.10462543473223 0.44055045613784 0.70506466109502 15.999 > 29 116 O 0.10462543473223 0.94055045613784 0.70506466109502 15.999 > 29 117 O 0.10513668943224 0.17622912945406 0.23351746465778 15.999 > 30 118 O 0.10513668943224 0.67622912945406 0.23351746465778 15.999 > 30 119 O 0.10513668943224 0.17622912945406 0.73351746465778 15.999 > 30 120 O 0.10513668943224 0.67622912945406 0.73351746465778 15.999 > 30 121 O 0.10462543473223 0.30944954386216 0.45506466109502 15.999 > 31 122 O 0.10462543473223 0.80944954386216 0.45506466109502 15.999 > 31 123 O 0.10462543473223 0.30944954386216 0.95506466109502 15.999 > 31 124 O 0.10462543473223 0.80944954386216 0.95506466109502 15.999 > 31 125 O 0.10513668943224 0.07377087054594 0.48351746465778 15.999 > 32 126 O 0.10513668943224 0.57377087054594 0.48351746465778 15.999 > 32 127 O 0.10513668943224 0.07377087054594 0.98351746465778 15.999 > 32 128 O 0.10513668943224 0.57377087054594 0.98351746465778 15.999 > 32 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.8217183 0.0000000 0.0859968 0.0000000 3.9691008 0.0000000 0.0859934 0.0000000 3.8184131 -------------------------- Born effective charges -------------------------- 1 Lu 3.1878413 0.0979691 0.1990336 -0.1273726 3.6833625 -0.1806451 0.1726147 -0.2553909 3.8501653 2 Lu 3.1878413 -0.0979691 0.1990336 0.1273726 3.6833625 0.1806451 0.1726147 0.2553909 3.8501653 3 Lu 3.9457110 0.0947019 -0.0685610 -0.0088920 3.7404110 -0.1539588 -0.1513093 -0.0832264 3.8375816 4 Lu 3.9457110 -0.0947019 -0.0685610 0.0088920 3.7404110 0.1539588 -0.1513093 0.0832264 3.8375816 5 Lu 3.9457110 -0.0947019 -0.0685610 0.0088920 3.7404110 0.1539588 -0.1513093 0.0832264 3.8375816 6 Lu 3.9457110 0.0947019 -0.0685610 -0.0088920 3.7404110 -0.1539588 -0.1513093 -0.0832264 3.8375816 7 Lu 3.1878413 -0.0979691 0.1990336 0.1273726 3.6833625 0.1806451 0.1726147 0.2553909 3.8501653 8 Lu 3.1878413 0.0979691 0.1990336 -0.1273726 3.6833625 -0.1806451 0.1726147 -0.2553909 3.8501653 9 Ge 3.3345640 -0.3366854 0.2193084 -0.1273234 3.6240008 -0.0770691 0.2993503 -0.1030820 2.9096888 10 Ge 3.3345640 0.3366854 0.2193084 0.1273234 3.6240008 0.0770691 0.2993503 0.1030820 2.9096888 11 Ge 3.3345640 0.3366854 0.2193084 0.1273234 3.6240008 0.0770691 0.2993503 0.1030820 2.9096888 12 Ge 3.3345640 -0.3366854 0.2193084 -0.1273234 3.6240008 -0.0770691 0.2993503 -0.1030820 2.9096888 13 O -2.3197729 0.2301885 -0.1413273 0.4114505 -1.8841700 0.0270759 -0.0020569 -0.0084273 -1.8907081 14 O -2.4208298 -0.2241698 -0.1834636 -0.3436438 -2.3828215 0.0837162 -0.1694916 0.0635906 -2.4308014 15 O -2.3197729 -0.2301885 -0.1413273 -0.4114505 -1.8841700 -0.0270759 -0.0020569 0.0084273 -1.8907081 16 O -2.4208298 0.2241698 -0.1834636 0.3436438 -2.3828215 -0.0837162 -0.1694916 -0.0635906 -2.4308014 17 O -1.8717218 0.0470450 0.1172439 0.0219942 -1.9224960 -0.2412623 0.0147348 -0.5069208 -2.4507488 18 O -2.4498347 -0.4601715 -0.1630820 -0.4301062 -2.7001805 -0.0270258 -0.1664410 -0.0148471 -1.2261547 19 O -1.8717218 -0.0470450 0.1172439 -0.0219942 -1.9224960 0.2412623 0.0147348 0.5069208 -2.4507488 20 O -1.4059571 -0.0540231 0.0208479 0.0228906 -2.1581064 -0.1716167 0.0025990 -0.3684379 -2.5990227 21 O -2.4498347 0.4601715 -0.1630820 0.4301062 -2.7001805 0.0270258 -0.1664410 0.0148471 -1.2261547 22 O -1.4059571 0.0540231 0.0208479 -0.0228906 -2.1581064 0.1716167 0.0025990 0.3684379 -2.5990227 23 O -1.4059571 0.0540231 0.0208479 -0.0228906 -2.1581064 0.1716167 0.0025990 0.3684379 -2.5990227 24 O -2.4498347 0.4601715 -0.1630820 0.4301062 -2.7001805 0.0270258 -0.1664410 0.0148471 -1.2261547 25 O -1.4059571 -0.0540231 0.0208479 0.0228906 -2.1581064 -0.1716167 0.0025990 -0.3684379 -2.5990227 26 O -1.8717218 -0.0470450 0.1172439 -0.0219942 -1.9224960 0.2412623 0.0147348 0.5069208 -2.4507488 27 O -2.4498347 -0.4601715 -0.1630820 -0.4301062 -2.7001805 -0.0270258 -0.1664410 -0.0148471 -1.2261547 28 O -1.8717218 0.0470450 0.1172439 0.0219942 -1.9224960 -0.2412623 0.0147348 -0.5069208 -2.4507488 29 O -2.4208298 0.2241698 -0.1834636 0.3436438 -2.3828215 -0.0837162 -0.1694916 -0.0635906 -2.4308014 30 O -2.3197729 -0.2301885 -0.1413273 -0.4114505 -1.8841700 -0.0270759 -0.0020569 0.0084273 -1.8907081 31 O -2.4208298 -0.2241698 -0.1834636 -0.3436438 -2.3828215 0.0837162 -0.1694916 0.0635906 -2.4308014 32 O -2.3197729 0.2301885 -0.1413273 0.4114505 -1.8841700 0.0270759 -0.0020569 -0.0084273 -1.8907081 ---------------------------------------------------------------------------- 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: 18816/18816 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 4704 Number of blocks in projector: 4704 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) 258 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 508 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 16 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) 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) 258 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 508 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 16 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) 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: 4 / 6 --- Block_size: 544 Use submatrix version of eigh solver. (1) Block: 544 / 544 (2) Block: 250 / 544 (2) 242 eigenvectors found. (2) Block: 544 / 544 (2) 286 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found. (1) 536 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: 544 Use submatrix version of eigh solver. (1) Block: 544 / 544 (2) Block: 250 / 544 (2) 242 eigenvectors found. (2) Block: 544 / 544 (2) 286 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found. (1) 536 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: 544 Use submatrix version of eigh solver. (1) Block: 544 / 544 (2) Block: 250 / 544 (2) 242 eigenvectors found. (2) Block: 544 / 544 (2) 286 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found. (1) 536 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: - (4704, 4633), data: False |-- (544, 536), data: False |-- (544, 536), data: False |-- (544, 8), data: (544, 16) @ (16, 8) |-- (294, 286), data: True |-- (250, 242), data: True |-- (544, 536), data: False |-- (544, 536), data: False |-- (544, 8), data: (544, 16) @ (16, 8) |-- (294, 286), data: True |-- (250, 242), data: True |-- (544, 536), data: False |-- (544, 536), data: False |-- (544, 8), data: (544, 16) @ (16, 8) |-- (294, 286), data: True |-- (250, 242), 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, 16), data: (1024, 32) @ (32, 16) |-- (524, 508), data: False |-- (524, 12), data: (524, 28) @ (28, 12) |-- (274, 258), 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, 1008), data: False |-- (1024, 16), data: (1024, 32) @ (32, 16) |-- (524, 508), data: False |-- (524, 12), data: (524, 28) @ (28, 12) |-- (274, 258), 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): 0.003 Solver_block: 100 / 960 - Time: 1.354 Solver_block: 200 / 960 - Time: 1.182 Solver_block: 300 / 960 - Time: 1.173 Solver_block: 400 / 960 - Time: 1.184 Solver_block: 500 / 960 - Time: 1.182 Solver_block: 600 / 960 - Time: 1.190 Solver_block: 700 / 960 - Time: 1.186 Solver_block: 800 / 960 - Time: 1.182 Solver_block: 900 / 960 - Time: 1.181 Solver_block: 960 / 960 - Time: 0.819 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 11.958 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (yy) -0.00000000 (yy) Permutation basis: 384/384 Permutation basis: 18816/18816 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 4704 Number of blocks in projector: 4704 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) 258 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 508 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 16 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) 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) 258 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 508 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 16 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) 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: 4 / 6 --- Block_size: 544 Use submatrix version of eigh solver. (1) Block: 544 / 544 (2) Block: 250 / 544 (2) 242 eigenvectors found. (2) Block: 544 / 544 (2) 286 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found. (1) 536 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: 544 Use submatrix version of eigh solver. (1) Block: 544 / 544 (2) Block: 250 / 544 (2) 242 eigenvectors found. (2) Block: 544 / 544 (2) 286 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found. (1) 536 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: 544 Use submatrix version of eigh solver. (1) Block: 544 / 544 (2) Block: 250 / 544 (2) 242 eigenvectors found. (2) Block: 544 / 544 (2) 286 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found. (1) 536 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: - (4704, 4633), data: False |-- (544, 536), data: False |-- (544, 536), data: False |-- (544, 8), data: (544, 16) @ (16, 8) |-- (294, 286), data: True |-- (250, 242), data: True |-- (544, 536), data: False |-- (544, 536), data: False |-- (544, 8), data: (544, 16) @ (16, 8) |-- (294, 286), data: True |-- (250, 242), data: True |-- (544, 536), data: False |-- (544, 536), data: False |-- (544, 8), data: (544, 16) @ (16, 8) |-- (294, 286), data: True |-- (250, 242), 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, 16), data: (1024, 32) @ (32, 16) |-- (524, 508), data: False |-- (524, 12), data: (524, 28) @ (28, 12) |-- (274, 258), 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, 1008), data: False |-- (1024, 16), data: (1024, 32) @ (32, 16) |-- (524, 508), data: False |-- (524, 12), data: (524, 28) @ (28, 12) |-- (274, 258), 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 (yy) -0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-09 02:50:17]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 02:50:18]------------------------- 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 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 9.063213880928183 0.000000000000000 0.000000000000000 b 0.000000000000000 6.744419509999999 0.000000000000000 c -0.856429673954030 0.000000000000000 6.516775247632142 Atomic positions (fractional): 1 Lu 0.96769106197271 0.11959957745572 0.27372542809736 174.967 2 Lu 0.96769106197271 0.38040042254428 0.77372542809736 174.967 3 Lu 0.65300580046577 0.14466342951034 0.53000413464264 174.967 4 Lu 0.65300580046577 0.35533657048966 0.03000413464264 174.967 5 Lu 0.34699419953423 0.64466342951033 0.96999586535736 174.967 6 Lu 0.34699419953423 0.85533657048967 0.46999586535736 174.967 7 Lu 0.03230893802729 0.61959957745572 0.22627457190264 174.967 8 Lu 0.03230893802729 0.88040042254428 0.72627457190264 174.967 9 Ge 0.69889958588173 0.60474987023962 0.52337562956446 72.640 10 Ge 0.69889958588173 0.89525012976038 0.02337562956446 72.640 11 Ge 0.30110041411827 0.10474987023962 0.97662437043554 72.640 12 Ge 0.30110041411827 0.39525012976038 0.47662437043554 72.640 13 O 0.89486331056776 0.85245825890812 0.03296507068445 15.999 14 O 0.89537456526777 0.38110091227567 0.08987067780995 15.999 15 O 0.89486331056776 0.64754174109188 0.53296507068445 15.999 16 O 0.89537456526777 0.11889908772433 0.58987067780995 15.999 17 O 0.72016230401071 0.07114570902427 0.23037742971925 15.999 18 O 0.59566597054339 0.67886556900757 0.01637960631953 15.999 19 O 0.72016230401071 0.42885429097573 0.73037742971925 15.999 20 O 0.63333332989278 0.42403110230875 0.34470986374240 15.999 21 O 0.59566597054339 0.82113443099243 0.51637960631953 15.999 22 O 0.63333332989278 0.07596889769125 0.84470986374240 15.999 23 O 0.36666667010722 0.92403110230875 0.15529013625760 15.999 24 O 0.40433402945661 0.17886556900757 0.48362039368047 15.999 25 O 0.36666667010722 0.57596889769125 0.65529013625760 15.999 26 O 0.27983769598929 0.57114570902427 0.26962257028075 15.999 27 O 0.40433402945661 0.32113443099243 0.98362039368047 15.999 28 O 0.27983769598929 0.92885429097573 0.76962257028075 15.999 29 O 0.10462543473223 0.88110091227567 0.41012932219005 15.999 30 O 0.10513668943224 0.35245825890812 0.46703492931555 15.999 31 O 0.10462543473223 0.61889908772433 0.91012932219005 15.999 32 O 0.10513668943224 0.14754174109188 0.96703492931555 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.063213880928183 0.000000000000000 0.000000000000000 b 0.000000000000000 13.488839019999999 0.000000000000000 c -1.712859347908060 0.000000000000000 13.033550495264285 Atomic positions (fractional): 1 Lu 0.96769106197271 0.05979978872786 0.13686271404868 174.967 > 1 2 Lu 0.96769106197271 0.55979978872786 0.13686271404868 174.967 > 1 3 Lu 0.96769106197271 0.05979978872786 0.63686271404868 174.967 > 1 4 Lu 0.96769106197271 0.55979978872786 0.63686271404868 174.967 > 1 5 Lu 0.96769106197271 0.19020021127214 0.38686271404868 174.967 > 5 6 Lu 0.96769106197271 0.69020021127214 0.38686271404868 174.967 > 5 7 Lu 0.96769106197271 0.19020021127214 0.88686271404868 174.967 > 5 8 Lu 0.96769106197271 0.69020021127214 0.88686271404868 174.967 > 5 9 Lu 0.65300580046577 0.07233171475517 0.26500206732132 174.967 > 9 10 Lu 0.65300580046577 0.57233171475517 0.26500206732132 174.967 > 9 11 Lu 0.65300580046577 0.07233171475517 0.76500206732132 174.967 > 9 12 Lu 0.65300580046577 0.57233171475517 0.76500206732132 174.967 > 9 13 Lu 0.65300580046577 0.17766828524483 0.01500206732132 174.967 > 13 14 Lu 0.65300580046577 0.67766828524483 0.01500206732132 174.967 > 13 15 Lu 0.65300580046577 0.17766828524483 0.51500206732132 174.967 > 13 16 Lu 0.65300580046577 0.67766828524483 0.51500206732132 174.967 > 13 17 Lu 0.34699419953423 0.32233171475517 0.48499793267868 174.967 > 17 18 Lu 0.34699419953423 0.82233171475517 0.48499793267868 174.967 > 17 19 Lu 0.34699419953423 0.32233171475517 0.98499793267868 174.967 > 17 20 Lu 0.34699419953423 0.82233171475517 0.98499793267868 174.967 > 17 21 Lu 0.34699419953423 0.42766828524483 0.23499793267868 174.967 > 21 22 Lu 0.34699419953423 0.92766828524483 0.23499793267868 174.967 > 21 23 Lu 0.34699419953423 0.42766828524483 0.73499793267868 174.967 > 21 24 Lu 0.34699419953423 0.92766828524483 0.73499793267868 174.967 > 21 25 Lu 0.03230893802729 0.30979978872786 0.11313728595132 174.967 > 25 26 Lu 0.03230893802729 0.80979978872786 0.11313728595132 174.967 > 25 27 Lu 0.03230893802729 0.30979978872786 0.61313728595132 174.967 > 25 28 Lu 0.03230893802729 0.80979978872786 0.61313728595132 174.967 > 25 29 Lu 0.03230893802729 0.44020021127214 0.36313728595132 174.967 > 29 30 Lu 0.03230893802729 0.94020021127214 0.36313728595132 174.967 > 29 31 Lu 0.03230893802729 0.44020021127214 0.86313728595132 174.967 > 29 32 Lu 0.03230893802729 0.94020021127214 0.86313728595132 174.967 > 29 33 Ge 0.69889958588173 0.30237493511981 0.26168781478223 72.640 > 33 34 Ge 0.69889958588173 0.80237493511981 0.26168781478223 72.640 > 33 35 Ge 0.69889958588173 0.30237493511981 0.76168781478223 72.640 > 33 36 Ge 0.69889958588173 0.80237493511981 0.76168781478223 72.640 > 33 37 Ge 0.69889958588173 0.44762506488019 0.01168781478223 72.640 > 37 38 Ge 0.69889958588173 0.94762506488019 0.01168781478223 72.640 > 37 39 Ge 0.69889958588173 0.44762506488019 0.51168781478223 72.640 > 37 40 Ge 0.69889958588173 0.94762506488019 0.51168781478223 72.640 > 37 41 Ge 0.30110041411827 0.05237493511981 0.48831218521777 72.640 > 41 42 Ge 0.30110041411827 0.55237493511981 0.48831218521777 72.640 > 41 43 Ge 0.30110041411827 0.05237493511981 0.98831218521777 72.640 > 41 44 Ge 0.30110041411827 0.55237493511981 0.98831218521777 72.640 > 41 45 Ge 0.30110041411827 0.19762506488019 0.23831218521777 72.640 > 45 46 Ge 0.30110041411827 0.69762506488019 0.23831218521777 72.640 > 45 47 Ge 0.30110041411827 0.19762506488019 0.73831218521777 72.640 > 45 48 Ge 0.30110041411827 0.69762506488019 0.73831218521777 72.640 > 45 49 O 0.89486331056776 0.42622912945406 0.01648253534222 15.999 > 49 50 O 0.89486331056776 0.92622912945406 0.01648253534222 15.999 > 49 51 O 0.89486331056776 0.42622912945406 0.51648253534222 15.999 > 49 52 O 0.89486331056776 0.92622912945406 0.51648253534222 15.999 > 49 53 O 0.89537456526777 0.19055045613784 0.04493533890498 15.999 > 53 54 O 0.89537456526777 0.69055045613784 0.04493533890498 15.999 > 53 55 O 0.89537456526777 0.19055045613784 0.54493533890498 15.999 > 53 56 O 0.89537456526777 0.69055045613784 0.54493533890498 15.999 > 53 57 O 0.89486331056776 0.32377087054594 0.26648253534222 15.999 > 57 58 O 0.89486331056776 0.82377087054594 0.26648253534222 15.999 > 57 59 O 0.89486331056776 0.32377087054594 0.76648253534222 15.999 > 57 60 O 0.89486331056776 0.82377087054594 0.76648253534222 15.999 > 57 61 O 0.89537456526777 0.05944954386216 0.29493533890498 15.999 > 61 62 O 0.89537456526777 0.55944954386216 0.29493533890498 15.999 > 61 63 O 0.89537456526777 0.05944954386216 0.79493533890498 15.999 > 61 64 O 0.89537456526777 0.55944954386216 0.79493533890498 15.999 > 61 65 O 0.72016230401071 0.03557285451214 0.11518871485962 15.999 > 65 66 O 0.72016230401071 0.53557285451213 0.11518871485962 15.999 > 65 67 O 0.72016230401071 0.03557285451214 0.61518871485962 15.999 > 65 68 O 0.72016230401071 0.53557285451213 0.61518871485962 15.999 > 65 69 O 0.59566597054339 0.33943278450378 0.00818980315977 15.999 > 69 70 O 0.59566597054339 0.83943278450378 0.00818980315977 15.999 > 69 71 O 0.59566597054339 0.33943278450378 0.50818980315977 15.999 > 69 72 O 0.59566597054339 0.83943278450378 0.50818980315977 15.999 > 69 73 O 0.72016230401071 0.21442714548787 0.36518871485962 15.999 > 73 74 O 0.72016230401071 0.71442714548787 0.36518871485962 15.999 > 73 75 O 0.72016230401071 0.21442714548787 0.86518871485962 15.999 > 73 76 O 0.72016230401071 0.71442714548787 0.86518871485962 15.999 > 73 77 O 0.63333332989278 0.21201555115438 0.17235493187120 15.999 > 77 78 O 0.63333332989278 0.71201555115437 0.17235493187120 15.999 > 77 79 O 0.63333332989278 0.21201555115438 0.67235493187120 15.999 > 77 80 O 0.63333332989278 0.71201555115437 0.67235493187120 15.999 > 77 81 O 0.59566597054339 0.41056721549622 0.25818980315977 15.999 > 81 82 O 0.59566597054339 0.91056721549622 0.25818980315977 15.999 > 81 83 O 0.59566597054339 0.41056721549622 0.75818980315977 15.999 > 81 84 O 0.59566597054339 0.91056721549622 0.75818980315977 15.999 > 81 85 O 0.63333332989278 0.03798444884562 0.42235493187120 15.999 > 85 86 O 0.63333332989278 0.53798444884563 0.42235493187120 15.999 > 85 87 O 0.63333332989278 0.03798444884562 0.92235493187120 15.999 > 85 88 O 0.63333332989278 0.53798444884563 0.92235493187120 15.999 > 85 89 O 0.36666667010722 0.46201555115437 0.07764506812880 15.999 > 89 90 O 0.36666667010722 0.96201555115437 0.07764506812880 15.999 > 89 91 O 0.36666667010722 0.46201555115437 0.57764506812880 15.999 > 89 92 O 0.36666667010722 0.96201555115437 0.57764506812880 15.999 > 89 93 O 0.40433402945661 0.08943278450378 0.24181019684023 15.999 > 93 94 O 0.40433402945661 0.58943278450378 0.24181019684023 15.999 > 93 95 O 0.40433402945661 0.08943278450378 0.74181019684023 15.999 > 93 96 O 0.40433402945661 0.58943278450378 0.74181019684023 15.999 > 93 97 O 0.36666667010722 0.28798444884563 0.32764506812880 15.999 > 97 98 O 0.36666667010722 0.78798444884563 0.32764506812880 15.999 > 97 99 O 0.36666667010722 0.28798444884563 0.82764506812880 15.999 > 97 100 O 0.36666667010722 0.78798444884563 0.82764506812880 15.999 > 97 101 O 0.27983769598929 0.28557285451213 0.13481128514038 15.999 > 101 102 O 0.27983769598929 0.78557285451213 0.13481128514038 15.999 > 101 103 O 0.27983769598929 0.28557285451213 0.63481128514038 15.999 > 101 104 O 0.27983769598929 0.78557285451213 0.63481128514038 15.999 > 101 105 O 0.40433402945661 0.16056721549622 0.49181019684023 15.999 > 105 106 O 0.40433402945661 0.66056721549622 0.49181019684023 15.999 > 105 107 O 0.40433402945661 0.16056721549622 0.99181019684023 15.999 > 105 108 O 0.40433402945661 0.66056721549622 0.99181019684023 15.999 > 105 109 O 0.27983769598929 0.46442714548787 0.38481128514038 15.999 > 109 110 O 0.27983769598929 0.96442714548787 0.38481128514038 15.999 > 109 111 O 0.27983769598929 0.46442714548787 0.88481128514038 15.999 > 109 112 O 0.27983769598929 0.96442714548787 0.88481128514038 15.999 > 109 113 O 0.10462543473223 0.44055045613784 0.20506466109502 15.999 > 113 114 O 0.10462543473223 0.94055045613784 0.20506466109502 15.999 > 113 115 O 0.10462543473223 0.44055045613784 0.70506466109502 15.999 > 113 116 O 0.10462543473223 0.94055045613784 0.70506466109502 15.999 > 113 117 O 0.10513668943224 0.17622912945406 0.23351746465778 15.999 > 117 118 O 0.10513668943224 0.67622912945406 0.23351746465778 15.999 > 117 119 O 0.10513668943224 0.17622912945406 0.73351746465778 15.999 > 117 120 O 0.10513668943224 0.67622912945406 0.73351746465778 15.999 > 117 121 O 0.10462543473223 0.30944954386216 0.45506466109502 15.999 > 121 122 O 0.10462543473223 0.80944954386216 0.45506466109502 15.999 > 121 123 O 0.10462543473223 0.30944954386216 0.95506466109502 15.999 > 121 124 O 0.10462543473223 0.80944954386216 0.95506466109502 15.999 > 121 125 O 0.10513668943224 0.07377087054594 0.48351746465778 15.999 > 125 126 O 0.10513668943224 0.57377087054594 0.48351746465778 15.999 > 125 127 O 0.10513668943224 0.07377087054594 0.98351746465778 15.999 > 125 128 O 0.10513668943224 0.57377087054594 0.98351746465778 15.999 > 125 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.8217183 0.0000000 0.0859968 0.0000000 3.9691008 0.0000000 0.0859934 0.0000000 3.8184131 -------------------------- Born effective charges -------------------------- 1 Lu 3.1878413 0.0979691 0.1990336 -0.1273726 3.6833625 -0.1806451 0.1726147 -0.2553909 3.8501653 2 Lu 3.1878413 -0.0979691 0.1990336 0.1273726 3.6833625 0.1806451 0.1726147 0.2553909 3.8501653 3 Lu 3.9457110 0.0947019 -0.0685610 -0.0088920 3.7404110 -0.1539588 -0.1513093 -0.0832264 3.8375816 4 Lu 3.9457110 -0.0947019 -0.0685610 0.0088920 3.7404110 0.1539588 -0.1513093 0.0832264 3.8375816 5 Lu 3.9457110 -0.0947019 -0.0685610 0.0088920 3.7404110 0.1539588 -0.1513093 0.0832264 3.8375816 6 Lu 3.9457110 0.0947019 -0.0685610 -0.0088920 3.7404110 -0.1539588 -0.1513093 -0.0832264 3.8375816 7 Lu 3.1878413 -0.0979691 0.1990336 0.1273726 3.6833625 0.1806451 0.1726147 0.2553909 3.8501653 8 Lu 3.1878413 0.0979691 0.1990336 -0.1273726 3.6833625 -0.1806451 0.1726147 -0.2553909 3.8501653 9 Ge 3.3345640 -0.3366854 0.2193084 -0.1273234 3.6240008 -0.0770691 0.2993503 -0.1030820 2.9096888 10 Ge 3.3345640 0.3366854 0.2193084 0.1273234 3.6240008 0.0770691 0.2993503 0.1030820 2.9096888 11 Ge 3.3345640 0.3366854 0.2193084 0.1273234 3.6240008 0.0770691 0.2993503 0.1030820 2.9096888 12 Ge 3.3345640 -0.3366854 0.2193084 -0.1273234 3.6240008 -0.0770691 0.2993503 -0.1030820 2.9096888 13 O -2.3197729 0.2301885 -0.1413273 0.4114505 -1.8841700 0.0270759 -0.0020569 -0.0084273 -1.8907081 14 O -2.4208298 -0.2241698 -0.1834636 -0.3436438 -2.3828215 0.0837162 -0.1694916 0.0635906 -2.4308014 15 O -2.3197729 -0.2301885 -0.1413273 -0.4114505 -1.8841700 -0.0270759 -0.0020569 0.0084273 -1.8907081 16 O -2.4208298 0.2241698 -0.1834636 0.3436438 -2.3828215 -0.0837162 -0.1694916 -0.0635906 -2.4308014 17 O -1.8717218 0.0470450 0.1172439 0.0219942 -1.9224960 -0.2412623 0.0147348 -0.5069208 -2.4507488 18 O -2.4498347 -0.4601715 -0.1630820 -0.4301062 -2.7001805 -0.0270258 -0.1664410 -0.0148471 -1.2261547 19 O -1.8717218 -0.0470450 0.1172439 -0.0219942 -1.9224960 0.2412623 0.0147348 0.5069208 -2.4507488 20 O -1.4059571 -0.0540231 0.0208479 0.0228906 -2.1581064 -0.1716167 0.0025990 -0.3684379 -2.5990227 21 O -2.4498347 0.4601715 -0.1630820 0.4301062 -2.7001805 0.0270258 -0.1664410 0.0148471 -1.2261547 22 O -1.4059571 0.0540231 0.0208479 -0.0228906 -2.1581064 0.1716167 0.0025990 0.3684379 -2.5990227 23 O -1.4059571 0.0540231 0.0208479 -0.0228906 -2.1581064 0.1716167 0.0025990 0.3684379 -2.5990227 24 O -2.4498347 0.4601715 -0.1630820 0.4301062 -2.7001805 0.0270258 -0.1664410 0.0148471 -1.2261547 25 O -1.4059571 -0.0540231 0.0208479 0.0228906 -2.1581064 -0.1716167 0.0025990 -0.3684379 -2.5990227 26 O -1.8717218 -0.0470450 0.1172439 -0.0219942 -1.9224960 0.2412623 0.0147348 0.5069208 -2.4507488 27 O -2.4498347 -0.4601715 -0.1630820 -0.4301062 -2.7001805 -0.0270258 -0.1664410 -0.0148471 -1.2261547 28 O -1.8717218 0.0470450 0.1172439 0.0219942 -1.9224960 -0.2412623 0.0147348 -0.5069208 -2.4507488 29 O -2.4208298 0.2241698 -0.1834636 0.3436438 -2.3828215 -0.0837162 -0.1694916 -0.0635906 -2.4308014 30 O -2.3197729 -0.2301885 -0.1413273 -0.4114505 -1.8841700 -0.0270759 -0.0020569 0.0084273 -1.8907081 31 O -2.4208298 -0.2241698 -0.1834636 -0.3436438 -2.3828215 0.0837162 -0.1694916 0.0635906 -2.4308014 32 O -2.3197729 0.2301885 -0.1413273 0.4114505 -1.8841700 0.0270759 -0.0020569 -0.0084273 -1.8907081 ---------------------------------------------------------------------------- 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] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Computing fc3[ 9, 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] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] 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] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] 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] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Computing fc3[ 65, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Computing fc3[ 69, 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] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Computing fc3[ 77, 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] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000002 (xxx) -0.00000002 (xxx) -0.00000002 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000001 (xz) -0.00000001 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 02:51:03]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 02:51:03]------------------------- 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 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 9.063213880928183 0.000000000000000 0.000000000000000 b 0.000000000000000 6.744419509999999 0.000000000000000 c -0.856429673954030 0.000000000000000 6.516775247632142 Atomic positions (fractional): 1 Lu 0.96769106197271 0.11959957745572 0.27372542809736 174.967 2 Lu 0.96769106197271 0.38040042254428 0.77372542809736 174.967 3 Lu 0.65300580046577 0.14466342951034 0.53000413464264 174.967 4 Lu 0.65300580046577 0.35533657048966 0.03000413464264 174.967 5 Lu 0.34699419953423 0.64466342951033 0.96999586535736 174.967 6 Lu 0.34699419953423 0.85533657048967 0.46999586535736 174.967 7 Lu 0.03230893802729 0.61959957745572 0.22627457190264 174.967 8 Lu 0.03230893802729 0.88040042254428 0.72627457190264 174.967 9 Ge 0.69889958588173 0.60474987023962 0.52337562956446 72.640 10 Ge 0.69889958588173 0.89525012976038 0.02337562956446 72.640 11 Ge 0.30110041411827 0.10474987023962 0.97662437043554 72.640 12 Ge 0.30110041411827 0.39525012976038 0.47662437043554 72.640 13 O 0.89486331056776 0.85245825890812 0.03296507068445 15.999 14 O 0.89537456526777 0.38110091227567 0.08987067780995 15.999 15 O 0.89486331056776 0.64754174109188 0.53296507068445 15.999 16 O 0.89537456526777 0.11889908772433 0.58987067780995 15.999 17 O 0.72016230401071 0.07114570902427 0.23037742971925 15.999 18 O 0.59566597054339 0.67886556900757 0.01637960631953 15.999 19 O 0.72016230401071 0.42885429097573 0.73037742971925 15.999 20 O 0.63333332989278 0.42403110230875 0.34470986374240 15.999 21 O 0.59566597054339 0.82113443099243 0.51637960631953 15.999 22 O 0.63333332989278 0.07596889769125 0.84470986374240 15.999 23 O 0.36666667010722 0.92403110230875 0.15529013625760 15.999 24 O 0.40433402945661 0.17886556900757 0.48362039368047 15.999 25 O 0.36666667010722 0.57596889769125 0.65529013625760 15.999 26 O 0.27983769598929 0.57114570902427 0.26962257028075 15.999 27 O 0.40433402945661 0.32113443099243 0.98362039368047 15.999 28 O 0.27983769598929 0.92885429097573 0.76962257028075 15.999 29 O 0.10462543473223 0.88110091227567 0.41012932219005 15.999 30 O 0.10513668943224 0.35245825890812 0.46703492931555 15.999 31 O 0.10462543473223 0.61889908772433 0.91012932219005 15.999 32 O 0.10513668943224 0.14754174109188 0.96703492931555 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.063213880928183 0.000000000000000 0.000000000000000 b 0.000000000000000 13.488839019999999 0.000000000000000 c -1.712859347908060 0.000000000000000 13.033550495264285 Atomic positions (fractional): 1 Lu 0.96769106197271 0.05979978872786 0.13686271404868 174.967 > 1 2 Lu 0.96769106197271 0.55979978872786 0.13686271404868 174.967 > 1 3 Lu 0.96769106197271 0.05979978872786 0.63686271404868 174.967 > 1 4 Lu 0.96769106197271 0.55979978872786 0.63686271404868 174.967 > 1 5 Lu 0.96769106197271 0.19020021127214 0.38686271404868 174.967 > 5 6 Lu 0.96769106197271 0.69020021127214 0.38686271404868 174.967 > 5 7 Lu 0.96769106197271 0.19020021127214 0.88686271404868 174.967 > 5 8 Lu 0.96769106197271 0.69020021127214 0.88686271404868 174.967 > 5 9 Lu 0.65300580046577 0.07233171475517 0.26500206732132 174.967 > 9 10 Lu 0.65300580046577 0.57233171475517 0.26500206732132 174.967 > 9 11 Lu 0.65300580046577 0.07233171475517 0.76500206732132 174.967 > 9 12 Lu 0.65300580046577 0.57233171475517 0.76500206732132 174.967 > 9 13 Lu 0.65300580046577 0.17766828524483 0.01500206732132 174.967 > 13 14 Lu 0.65300580046577 0.67766828524483 0.01500206732132 174.967 > 13 15 Lu 0.65300580046577 0.17766828524483 0.51500206732132 174.967 > 13 16 Lu 0.65300580046577 0.67766828524483 0.51500206732132 174.967 > 13 17 Lu 0.34699419953423 0.32233171475517 0.48499793267868 174.967 > 17 18 Lu 0.34699419953423 0.82233171475517 0.48499793267868 174.967 > 17 19 Lu 0.34699419953423 0.32233171475517 0.98499793267868 174.967 > 17 20 Lu 0.34699419953423 0.82233171475517 0.98499793267868 174.967 > 17 21 Lu 0.34699419953423 0.42766828524483 0.23499793267868 174.967 > 21 22 Lu 0.34699419953423 0.92766828524483 0.23499793267868 174.967 > 21 23 Lu 0.34699419953423 0.42766828524483 0.73499793267868 174.967 > 21 24 Lu 0.34699419953423 0.92766828524483 0.73499793267868 174.967 > 21 25 Lu 0.03230893802729 0.30979978872786 0.11313728595132 174.967 > 25 26 Lu 0.03230893802729 0.80979978872786 0.11313728595132 174.967 > 25 27 Lu 0.03230893802729 0.30979978872786 0.61313728595132 174.967 > 25 28 Lu 0.03230893802729 0.80979978872786 0.61313728595132 174.967 > 25 29 Lu 0.03230893802729 0.44020021127214 0.36313728595132 174.967 > 29 30 Lu 0.03230893802729 0.94020021127214 0.36313728595132 174.967 > 29 31 Lu 0.03230893802729 0.44020021127214 0.86313728595132 174.967 > 29 32 Lu 0.03230893802729 0.94020021127214 0.86313728595132 174.967 > 29 33 Ge 0.69889958588173 0.30237493511981 0.26168781478223 72.640 > 33 34 Ge 0.69889958588173 0.80237493511981 0.26168781478223 72.640 > 33 35 Ge 0.69889958588173 0.30237493511981 0.76168781478223 72.640 > 33 36 Ge 0.69889958588173 0.80237493511981 0.76168781478223 72.640 > 33 37 Ge 0.69889958588173 0.44762506488019 0.01168781478223 72.640 > 37 38 Ge 0.69889958588173 0.94762506488019 0.01168781478223 72.640 > 37 39 Ge 0.69889958588173 0.44762506488019 0.51168781478223 72.640 > 37 40 Ge 0.69889958588173 0.94762506488019 0.51168781478223 72.640 > 37 41 Ge 0.30110041411827 0.05237493511981 0.48831218521777 72.640 > 41 42 Ge 0.30110041411827 0.55237493511981 0.48831218521777 72.640 > 41 43 Ge 0.30110041411827 0.05237493511981 0.98831218521777 72.640 > 41 44 Ge 0.30110041411827 0.55237493511981 0.98831218521777 72.640 > 41 45 Ge 0.30110041411827 0.19762506488019 0.23831218521777 72.640 > 45 46 Ge 0.30110041411827 0.69762506488019 0.23831218521777 72.640 > 45 47 Ge 0.30110041411827 0.19762506488019 0.73831218521777 72.640 > 45 48 Ge 0.30110041411827 0.69762506488019 0.73831218521777 72.640 > 45 49 O 0.89486331056776 0.42622912945406 0.01648253534222 15.999 > 49 50 O 0.89486331056776 0.92622912945406 0.01648253534222 15.999 > 49 51 O 0.89486331056776 0.42622912945406 0.51648253534222 15.999 > 49 52 O 0.89486331056776 0.92622912945406 0.51648253534222 15.999 > 49 53 O 0.89537456526777 0.19055045613784 0.04493533890498 15.999 > 53 54 O 0.89537456526777 0.69055045613784 0.04493533890498 15.999 > 53 55 O 0.89537456526777 0.19055045613784 0.54493533890498 15.999 > 53 56 O 0.89537456526777 0.69055045613784 0.54493533890498 15.999 > 53 57 O 0.89486331056776 0.32377087054594 0.26648253534222 15.999 > 57 58 O 0.89486331056776 0.82377087054594 0.26648253534222 15.999 > 57 59 O 0.89486331056776 0.32377087054594 0.76648253534222 15.999 > 57 60 O 0.89486331056776 0.82377087054594 0.76648253534222 15.999 > 57 61 O 0.89537456526777 0.05944954386216 0.29493533890498 15.999 > 61 62 O 0.89537456526777 0.55944954386216 0.29493533890498 15.999 > 61 63 O 0.89537456526777 0.05944954386216 0.79493533890498 15.999 > 61 64 O 0.89537456526777 0.55944954386216 0.79493533890498 15.999 > 61 65 O 0.72016230401071 0.03557285451214 0.11518871485962 15.999 > 65 66 O 0.72016230401071 0.53557285451213 0.11518871485962 15.999 > 65 67 O 0.72016230401071 0.03557285451214 0.61518871485962 15.999 > 65 68 O 0.72016230401071 0.53557285451213 0.61518871485962 15.999 > 65 69 O 0.59566597054339 0.33943278450378 0.00818980315977 15.999 > 69 70 O 0.59566597054339 0.83943278450378 0.00818980315977 15.999 > 69 71 O 0.59566597054339 0.33943278450378 0.50818980315977 15.999 > 69 72 O 0.59566597054339 0.83943278450378 0.50818980315977 15.999 > 69 73 O 0.72016230401071 0.21442714548787 0.36518871485962 15.999 > 73 74 O 0.72016230401071 0.71442714548787 0.36518871485962 15.999 > 73 75 O 0.72016230401071 0.21442714548787 0.86518871485962 15.999 > 73 76 O 0.72016230401071 0.71442714548787 0.86518871485962 15.999 > 73 77 O 0.63333332989278 0.21201555115438 0.17235493187120 15.999 > 77 78 O 0.63333332989278 0.71201555115437 0.17235493187120 15.999 > 77 79 O 0.63333332989278 0.21201555115438 0.67235493187120 15.999 > 77 80 O 0.63333332989278 0.71201555115437 0.67235493187120 15.999 > 77 81 O 0.59566597054339 0.41056721549622 0.25818980315977 15.999 > 81 82 O 0.59566597054339 0.91056721549622 0.25818980315977 15.999 > 81 83 O 0.59566597054339 0.41056721549622 0.75818980315977 15.999 > 81 84 O 0.59566597054339 0.91056721549622 0.75818980315977 15.999 > 81 85 O 0.63333332989278 0.03798444884562 0.42235493187120 15.999 > 85 86 O 0.63333332989278 0.53798444884563 0.42235493187120 15.999 > 85 87 O 0.63333332989278 0.03798444884562 0.92235493187120 15.999 > 85 88 O 0.63333332989278 0.53798444884563 0.92235493187120 15.999 > 85 89 O 0.36666667010722 0.46201555115437 0.07764506812880 15.999 > 89 90 O 0.36666667010722 0.96201555115437 0.07764506812880 15.999 > 89 91 O 0.36666667010722 0.46201555115437 0.57764506812880 15.999 > 89 92 O 0.36666667010722 0.96201555115437 0.57764506812880 15.999 > 89 93 O 0.40433402945661 0.08943278450378 0.24181019684023 15.999 > 93 94 O 0.40433402945661 0.58943278450378 0.24181019684023 15.999 > 93 95 O 0.40433402945661 0.08943278450378 0.74181019684023 15.999 > 93 96 O 0.40433402945661 0.58943278450378 0.74181019684023 15.999 > 93 97 O 0.36666667010722 0.28798444884563 0.32764506812880 15.999 > 97 98 O 0.36666667010722 0.78798444884563 0.32764506812880 15.999 > 97 99 O 0.36666667010722 0.28798444884563 0.82764506812880 15.999 > 97 100 O 0.36666667010722 0.78798444884563 0.82764506812880 15.999 > 97 101 O 0.27983769598929 0.28557285451213 0.13481128514038 15.999 > 101 102 O 0.27983769598929 0.78557285451213 0.13481128514038 15.999 > 101 103 O 0.27983769598929 0.28557285451213 0.63481128514038 15.999 > 101 104 O 0.27983769598929 0.78557285451213 0.63481128514038 15.999 > 101 105 O 0.40433402945661 0.16056721549622 0.49181019684023 15.999 > 105 106 O 0.40433402945661 0.66056721549622 0.49181019684023 15.999 > 105 107 O 0.40433402945661 0.16056721549622 0.99181019684023 15.999 > 105 108 O 0.40433402945661 0.66056721549622 0.99181019684023 15.999 > 105 109 O 0.27983769598929 0.46442714548787 0.38481128514038 15.999 > 109 110 O 0.27983769598929 0.96442714548787 0.38481128514038 15.999 > 109 111 O 0.27983769598929 0.46442714548787 0.88481128514038 15.999 > 109 112 O 0.27983769598929 0.96442714548787 0.88481128514038 15.999 > 109 113 O 0.10462543473223 0.44055045613784 0.20506466109502 15.999 > 113 114 O 0.10462543473223 0.94055045613784 0.20506466109502 15.999 > 113 115 O 0.10462543473223 0.44055045613784 0.70506466109502 15.999 > 113 116 O 0.10462543473223 0.94055045613784 0.70506466109502 15.999 > 113 117 O 0.10513668943224 0.17622912945406 0.23351746465778 15.999 > 117 118 O 0.10513668943224 0.67622912945406 0.23351746465778 15.999 > 117 119 O 0.10513668943224 0.17622912945406 0.73351746465778 15.999 > 117 120 O 0.10513668943224 0.67622912945406 0.73351746465778 15.999 > 117 121 O 0.10462543473223 0.30944954386216 0.45506466109502 15.999 > 121 122 O 0.10462543473223 0.80944954386216 0.45506466109502 15.999 > 121 123 O 0.10462543473223 0.30944954386216 0.95506466109502 15.999 > 121 124 O 0.10462543473223 0.80944954386216 0.95506466109502 15.999 > 121 125 O 0.10513668943224 0.07377087054594 0.48351746465778 15.999 > 125 126 O 0.10513668943224 0.57377087054594 0.48351746465778 15.999 > 125 127 O 0.10513668943224 0.07377087054594 0.98351746465778 15.999 > 125 128 O 0.10513668943224 0.57377087054594 0.98351746465778 15.999 > 125 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.8217183 0.0000000 0.0859968 0.0000000 3.9691008 0.0000000 0.0859934 0.0000000 3.8184131 -------------------------- Born effective charges -------------------------- 1 Lu 3.1878413 0.0979691 0.1990336 -0.1273726 3.6833625 -0.1806451 0.1726147 -0.2553909 3.8501653 2 Lu 3.1878413 -0.0979691 0.1990336 0.1273726 3.6833625 0.1806451 0.1726147 0.2553909 3.8501653 3 Lu 3.9457110 0.0947019 -0.0685610 -0.0088920 3.7404110 -0.1539588 -0.1513093 -0.0832264 3.8375816 4 Lu 3.9457110 -0.0947019 -0.0685610 0.0088920 3.7404110 0.1539588 -0.1513093 0.0832264 3.8375816 5 Lu 3.9457110 -0.0947019 -0.0685610 0.0088920 3.7404110 0.1539588 -0.1513093 0.0832264 3.8375816 6 Lu 3.9457110 0.0947019 -0.0685610 -0.0088920 3.7404110 -0.1539588 -0.1513093 -0.0832264 3.8375816 7 Lu 3.1878413 -0.0979691 0.1990336 0.1273726 3.6833625 0.1806451 0.1726147 0.2553909 3.8501653 8 Lu 3.1878413 0.0979691 0.1990336 -0.1273726 3.6833625 -0.1806451 0.1726147 -0.2553909 3.8501653 9 Ge 3.3345640 -0.3366854 0.2193084 -0.1273234 3.6240008 -0.0770691 0.2993503 -0.1030820 2.9096888 10 Ge 3.3345640 0.3366854 0.2193084 0.1273234 3.6240008 0.0770691 0.2993503 0.1030820 2.9096888 11 Ge 3.3345640 0.3366854 0.2193084 0.1273234 3.6240008 0.0770691 0.2993503 0.1030820 2.9096888 12 Ge 3.3345640 -0.3366854 0.2193084 -0.1273234 3.6240008 -0.0770691 0.2993503 -0.1030820 2.9096888 13 O -2.3197729 0.2301885 -0.1413273 0.4114505 -1.8841700 0.0270759 -0.0020569 -0.0084273 -1.8907081 14 O -2.4208298 -0.2241698 -0.1834636 -0.3436438 -2.3828215 0.0837162 -0.1694916 0.0635906 -2.4308014 15 O -2.3197729 -0.2301885 -0.1413273 -0.4114505 -1.8841700 -0.0270759 -0.0020569 0.0084273 -1.8907081 16 O -2.4208298 0.2241698 -0.1834636 0.3436438 -2.3828215 -0.0837162 -0.1694916 -0.0635906 -2.4308014 17 O -1.8717218 0.0470450 0.1172439 0.0219942 -1.9224960 -0.2412623 0.0147348 -0.5069208 -2.4507488 18 O -2.4498347 -0.4601715 -0.1630820 -0.4301062 -2.7001805 -0.0270258 -0.1664410 -0.0148471 -1.2261547 19 O -1.8717218 -0.0470450 0.1172439 -0.0219942 -1.9224960 0.2412623 0.0147348 0.5069208 -2.4507488 20 O -1.4059571 -0.0540231 0.0208479 0.0228906 -2.1581064 -0.1716167 0.0025990 -0.3684379 -2.5990227 21 O -2.4498347 0.4601715 -0.1630820 0.4301062 -2.7001805 0.0270258 -0.1664410 0.0148471 -1.2261547 22 O -1.4059571 0.0540231 0.0208479 -0.0228906 -2.1581064 0.1716167 0.0025990 0.3684379 -2.5990227 23 O -1.4059571 0.0540231 0.0208479 -0.0228906 -2.1581064 0.1716167 0.0025990 0.3684379 -2.5990227 24 O -2.4498347 0.4601715 -0.1630820 0.4301062 -2.7001805 0.0270258 -0.1664410 0.0148471 -1.2261547 25 O -1.4059571 -0.0540231 0.0208479 0.0228906 -2.1581064 -0.1716167 0.0025990 -0.3684379 -2.5990227 26 O -1.8717218 -0.0470450 0.1172439 -0.0219942 -1.9224960 0.2412623 0.0147348 0.5069208 -2.4507488 27 O -2.4498347 -0.4601715 -0.1630820 -0.4301062 -2.7001805 -0.0270258 -0.1664410 -0.0148471 -1.2261547 28 O -1.8717218 0.0470450 0.1172439 0.0219942 -1.9224960 -0.2412623 0.0147348 -0.5069208 -2.4507488 29 O -2.4208298 0.2241698 -0.1834636 0.3436438 -2.3828215 -0.0837162 -0.1694916 -0.0635906 -2.4308014 30 O -2.3197729 -0.2301885 -0.1413273 -0.4114505 -1.8841700 -0.0270759 -0.0020569 0.0084273 -1.8907081 31 O -2.4208298 -0.2241698 -0.1834636 -0.3436438 -2.3828215 0.0837162 -0.1694916 0.0635906 -2.4308014 32 O -2.3197729 0.2301885 -0.1413273 0.4114505 -1.8841700 0.0270759 -0.0020569 -0.0084273 -1.8907081 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000002 (xxx) -0.00000002 (xxx) -0.00000002 (xxx) Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 6 7 8 ] 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: 297, Lambda: 0.12 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/104) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 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 1.942 ( 0.000 0.000 0.000) 0.000 2.078 ( 0.000 0.000 0.000) 0.000 2.391 ( 0.000 0.000 0.000) 0.000 2.491 ( 0.000 0.000 0.000) 0.000 2.569 ( 0.000 0.000 0.000) 0.000 2.662 ( 0.000 0.000 0.000) 0.000 2.765 ( 0.000 0.000 0.000) 0.000 2.943 ( 0.000 0.000 0.000) 0.000 3.349 ( 0.000 0.000 0.000) 0.000 3.375 ( 0.000 0.000 0.000) 0.000 3.468 ( 0.000 0.000 0.000) 0.000 3.682 ( 0.000 0.000 0.000) 0.000 3.746 ( 0.000 0.000 0.000) 0.000 3.996 ( 0.000 0.000 0.000) 0.000 3.998 ( 0.000 0.000 0.000) 0.000 4.012 ( 0.000 0.000 0.000) 0.000 4.023 ( 0.000 0.000 0.000) 0.000 4.291 ( 0.000 0.000 0.000) 0.000 4.558 ( 0.000 0.000 0.000) 0.000 4.784 ( 0.000 0.000 0.000) 0.000 4.836 ( 0.000 0.000 0.000) 0.000 4.857 ( 0.000 0.000 0.000) 0.000 4.960 ( 0.000 0.000 0.000) 0.000 5.294 ( 0.000 0.000 0.000) 0.000 5.364 ( 0.000 0.000 0.000) 0.000 5.453 ( 0.000 0.000 0.000) 0.000 5.557 ( 0.000 0.000 0.000) 0.000 5.892 ( 0.000 0.000 0.000) 0.000 5.901 ( 0.000 0.000 0.000) 0.000 6.128 ( 0.000 0.000 0.000) 0.000 6.437 ( 0.000 0.000 0.000) 0.000 6.524 ( 0.000 0.000 0.000) 0.000 6.570 ( 0.000 0.000 0.000) 0.000 6.710 ( 0.000 0.000 0.000) 0.000 6.903 ( 0.000 0.000 0.000) 0.000 6.987 ( 0.000 0.000 0.000) 0.000 7.221 ( 0.000 0.000 0.000) 0.000 7.798 ( 0.000 0.000 0.000) 0.000 8.013 ( 0.000 0.000 0.000) 0.000 8.252 ( 0.000 0.000 0.000) 0.000 8.284 ( 0.000 0.000 0.000) 0.000 8.521 ( 0.000 0.000 0.000) 0.000 8.671 ( 0.000 0.000 0.000) 0.000 8.953 ( 0.000 0.000 0.000) 0.000 9.007 ( 0.000 0.000 0.000) 0.000 9.041 ( 0.000 0.000 0.000) 0.000 9.231 ( 0.000 0.000 0.000) 0.000 9.666 ( 0.000 0.000 0.000) 0.000 9.773 ( 0.000 0.000 0.000) 0.000 10.027 ( 0.000 0.000 0.000) 0.000 10.643 ( 0.000 0.000 0.000) 0.000 10.713 ( 0.000 0.000 0.000) 0.000 10.991 ( 0.000 0.000 0.000) 0.000 10.993 ( 0.000 0.000 0.000) 0.000 11.011 ( 0.000 0.000 0.000) 0.000 11.271 ( 0.000 0.000 0.000) 0.000 11.554 ( 0.000 0.000 0.000) 0.000 11.649 ( 0.000 0.000 0.000) 0.000 11.728 ( 0.000 0.000 0.000) 0.000 11.935 ( 0.000 0.000 0.000) 0.000 12.133 ( 0.000 0.000 0.000) 0.000 12.386 ( 0.000 0.000 0.000) 0.000 12.695 ( 0.000 0.000 0.000) 0.000 12.794 ( 0.000 0.000 0.000) 0.000 13.098 ( 0.000 0.000 0.000) 0.000 13.416 ( 0.000 0.000 0.000) 0.000 13.780 ( 0.000 0.000 0.000) 0.000 13.842 ( 0.000 0.000 0.000) 0.000 14.206 ( 0.000 0.000 0.000) 0.000 14.347 ( 0.000 0.000 0.000) 0.000 14.667 ( 0.000 0.000 0.000) 0.000 14.768 ( 0.000 0.000 0.000) 0.000 15.201 ( 0.000 0.000 0.000) 0.000 15.855 ( 0.000 0.000 0.000) 0.000 16.078 ( 0.000 0.000 0.000) 0.000 16.452 ( 0.000 0.000 0.000) 0.000 17.224 ( 0.000 0.000 0.000) 0.000 19.769 ( 0.000 0.000 0.000) 0.000 19.930 ( 0.000 0.000 0.000) 0.000 20.046 ( 0.000 0.000 0.000) 0.000 20.085 ( 0.000 0.000 0.000) 0.000 21.059 ( 0.000 0.000 0.000) 0.000 21.721 ( 0.000 0.000 0.000) 0.000 21.761 ( 0.000 0.000 0.000) 0.000 21.784 ( 0.000 0.000 0.000) 0.000 22.584 ( 0.000 0.000 0.000) 0.000 22.718 ( 0.000 0.000 0.000) 0.000 23.132 ( 0.000 0.000 0.000) 0.000 23.501 ( 0.000 0.000 0.000) 0.000 24.085 ( 0.000 0.000 0.000) 0.000 24.513 ( 0.000 0.000 0.000) 0.000 24.809 ( 0.000 0.000 0.000) 0.000 24.910 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/104) ======================= q-point: ( 0.17 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.322 ( 15.693 0.000 6.768) 17.090 0.562 ( 29.689 0.000 4.136) 29.976 0.894 ( 46.486 0.000 9.008) 47.350 1.896 ( -4.478 0.000 -0.316) 4.489 2.067 ( -1.954 0.000 0.482) 2.012 2.375 ( -1.525 0.000 1.159) 1.915 2.490 ( -0.250 0.000 -2.001) 2.016 2.540 ( -8.541 0.000 -6.364) 10.651 2.564 ( -0.603 0.000 0.405) 0.726 2.770 ( -2.643 0.000 5.071) 5.718 2.943 ( -0.211 0.000 -2.835) 2.843 3.248 ( -15.667 0.000 -3.419) 16.035 3.358 ( 0.899 0.000 0.170) 0.915 3.463 ( 1.652 0.000 0.510) 1.729 3.661 ( -2.716 0.000 0.896) 2.860 3.668 ( -1.677 0.000 -0.765) 1.844 3.861 ( -4.283 0.000 1.869) 4.673 3.947 ( -5.350 0.000 0.035) 5.350 4.094 ( 5.916 0.000 -3.003) 6.634 4.219 ( -6.143 0.000 -2.399) 6.595 4.281 ( 11.943 0.000 4.435) 12.740 4.476 ( -10.617 0.000 -3.145) 11.073 4.757 ( -3.925 0.000 -4.967) 6.330 4.810 ( -0.315 0.000 9.006) 9.012 4.896 ( 1.557 0.000 0.654) 1.689 5.017 ( 2.245 0.000 4.403) 4.942 5.408 ( -4.821 0.000 2.114) 5.264 5.409 ( -5.582 0.000 -0.546) 5.608 5.501 ( 0.251 0.000 -1.801) 1.818 5.501 ( 5.167 0.000 -1.846) 5.487 5.983 ( 8.172 0.000 4.335) 9.251 6.116 ( -0.933 0.000 -2.847) 2.996 6.207 ( 7.935 0.000 -2.057) 8.197 6.471 ( 1.059 0.000 -10.820) 10.871 6.528 ( 0.163 0.000 0.548) 0.571 6.721 ( 1.466 0.000 -0.900) 1.720 6.783 ( -3.725 0.000 24.944) 25.220 6.903 ( -0.331 0.000 1.229) 1.273 6.958 ( -3.307 0.000 -0.313) 3.322 7.193 ( -3.060 0.000 -0.459) 3.095 7.867 ( 6.477 0.000 1.241) 6.595 7.878 ( -10.445 0.000 0.305) 10.449 8.394 ( 4.461 0.000 -24.257) 24.664 8.413 ( 9.931 0.000 -1.982) 10.127 8.563 ( -1.588 0.000 -3.312) 3.673 8.660 ( -1.626 0.000 3.394) 3.763 8.827 ( -6.726 0.000 -3.314) 7.499 9.025 ( -1.623 0.000 2.035) 2.603 9.124 ( 6.005 0.000 0.730) 6.050 9.236 ( -1.482 0.000 -6.999) 7.154 9.672 ( 0.931 0.000 -1.462) 1.734 9.800 ( 2.448 0.000 0.764) 2.564 10.001 ( -2.913 0.000 4.195) 5.107 10.647 ( 0.411 0.000 3.688) 3.711 10.702 ( -1.347 0.000 1.367) 1.920 10.903 ( -3.421 0.000 -6.121) 7.012 10.965 ( -2.098 0.000 -1.647) 2.667 11.193 ( 13.042 0.000 -1.237) 13.101 11.500 ( -2.176 0.000 -6.827) 7.165 11.691 ( -3.438 0.000 7.076) 7.867 11.770 ( 8.672 0.000 9.958) 13.205 11.971 ( 2.861 0.000 -3.978) 4.899 12.161 ( 1.428 0.000 7.271) 7.410 12.331 ( -4.311 0.000 -4.299) 6.088 12.647 ( 0.806 0.000 0.932) 1.232 12.750 ( -4.009 0.000 -4.268) 5.856 13.073 ( -3.039 0.000 2.833) 4.155 13.437 ( 1.696 0.000 1.937) 2.575 13.727 ( -7.954 0.000 -1.191) 8.043 13.802 ( 2.267 0.000 -0.852) 2.422 14.011 ( 4.151 0.000 7.783) 8.821 14.310 ( 3.106 0.000 -26.904) 27.082 14.365 ( 0.295 0.000 6.527) 6.534 14.637 ( -2.807 0.000 -1.422) 3.147 15.228 ( 2.489 0.000 1.382) 2.847 15.453 ( -0.164 0.000 6.478) 6.480 15.857 ( 0.197 0.000 0.037) 0.200 16.437 ( -1.373 0.000 -0.334) 1.413 16.534 ( -4.602 0.000 29.912) 30.264 17.228 ( 0.431 0.000 -0.184) 0.468 19.761 ( -0.850 0.000 0.791) 1.161 20.054 ( 0.523 0.000 2.118) 2.181 20.088 ( 0.439 0.000 -0.667) 0.799 20.174 ( 5.688 0.000 -47.474) 47.814 21.715 ( -0.597 0.000 0.642) 0.876 21.766 ( 0.503 0.000 -0.522) 0.725 21.788 ( 0.304 0.000 0.841) 0.895 22.039 ( -2.794 0.000 25.032) 25.187 22.586 ( 0.193 0.000 0.047) 0.198 23.145 ( 1.314 0.000 0.179) 1.326 23.452 ( -3.411 0.000 10.883) 11.405 23.495 ( -0.465 0.000 -0.418) 0.625 24.097 ( 1.105 0.000 0.662) 1.288 24.504 ( -0.842 0.000 -0.393) 0.930 24.814 ( 0.585 0.000 -0.164) 0.608 24.932 ( -1.391 0.000 6.887) 7.027 ======================= Grid point 2 (3/104) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.586 ( 10.620 0.000 4.662) 11.598 1.103 ( 27.839 0.000 2.937) 27.994 1.691 ( 27.079 0.000 -7.083) 27.990 1.838 ( 8.968 0.000 15.814) 18.179 1.947 ( -12.943 0.000 0.546) 12.955 2.367 ( 1.186 0.000 0.474) 1.277 2.411 ( -2.536 0.000 -6.253) 6.748 2.478 ( -0.631 0.000 0.274) 0.688 2.552 ( -0.717 0.000 0.246) 0.758 2.687 ( -6.749 0.000 6.183) 9.152 2.867 ( -9.128 0.000 -7.576) 11.862 2.937 ( -14.071 0.000 -4.254) 14.700 3.372 ( 0.036 0.000 0.652) 0.653 3.478 ( -0.206 0.000 0.262) 0.334 3.596 ( -2.975 0.000 1.509) 3.336 3.653 ( -1.278 0.000 1.400) 1.896 3.796 ( -10.256 0.000 -0.618) 10.274 3.863 ( 2.955 0.000 2.529) 3.889 4.130 ( -1.028 0.000 -3.686) 3.826 4.190 ( 5.291 0.000 -3.063) 6.113 4.286 ( -8.545 0.000 -0.590) 8.565 4.374 ( -1.770 0.000 -1.281) 2.185 4.768 ( 6.504 0.000 -1.193) 6.613 4.837 ( 1.060 0.000 3.524) 3.680 4.915 ( 0.650 0.000 0.060) 0.653 5.027 ( -1.379 0.000 2.290) 2.673 5.217 ( -12.827 0.000 0.146) 12.827 5.279 ( -6.446 0.000 -1.268) 6.569 5.555 ( 5.824 0.000 -0.297) 5.832 5.680 ( 9.277 0.000 2.301) 9.558 6.050 ( -5.602 0.000 -1.250) 5.739 6.144 ( 6.522 0.000 4.056) 7.680 6.391 ( 12.495 0.000 -3.450) 12.963 6.474 ( 1.091 0.000 -4.009) 4.155 6.530 ( -0.119 0.000 1.307) 1.312 6.762 ( 2.209 0.000 0.897) 2.384 6.800 ( 1.567 0.000 5.344) 5.569 6.858 ( -6.627 0.000 -0.109) 6.628 6.892 ( -1.338 0.000 1.233) 1.820 7.103 ( -6.315 0.000 -1.825) 6.574 7.706 ( -7.302 0.000 0.157) 7.304 8.000 ( 6.500 0.000 1.096) 6.592 8.425 ( 3.025 0.000 -8.657) 9.170 8.514 ( -2.426 0.000 -3.690) 4.416 8.559 ( 5.425 0.000 -4.275) 6.907 8.631 ( -2.348 0.000 4.691) 5.246 8.748 ( -0.543 0.000 1.018) 1.154 8.975 ( -4.083 0.000 1.418) 4.322 9.189 ( -1.937 0.000 -2.065) 2.831 9.215 ( 3.772 0.000 -0.680) 3.833 9.691 ( 1.370 0.000 -1.547) 2.066 9.846 ( 1.876 0.000 0.709) 2.005 9.963 ( -2.000 0.000 4.526) 4.948 10.677 ( -1.481 0.000 1.432) 2.060 10.679 ( 1.839 0.000 3.563) 4.009 10.827 ( -3.300 0.000 -4.923) 5.926 10.927 ( -1.276 0.000 -1.399) 1.893 11.440 ( 13.256 0.000 -5.137) 14.216 11.454 ( -1.357 0.000 -3.926) 4.154 11.663 ( -1.578 0.000 7.528) 7.692 11.957 ( 8.070 0.000 7.663) 11.129 12.002 ( 1.625 0.000 -2.483) 2.968 12.133 ( -7.693 0.000 11.159) 13.553 12.298 ( 2.885 0.000 -6.041) 6.694 12.646 ( -5.027 0.000 -5.417) 7.390 12.668 ( 1.616 0.000 -3.528) 3.880 13.007 ( -4.510 0.000 3.878) 5.948 13.474 ( 1.469 0.000 1.714) 2.257 13.593 ( -5.287 0.000 -3.275) 6.219 13.847 ( 2.466 0.000 -0.927) 2.635 14.089 ( 2.991 0.000 0.851) 3.110 14.311 ( 1.830 0.000 -11.170) 11.319 14.377 ( -0.964 0.000 7.868) 7.927 14.577 ( -2.797 0.000 -1.032) 2.982 15.280 ( 2.339 0.000 1.125) 2.596 15.467 ( 0.449 0.000 1.676) 1.735 15.862 ( 0.240 0.000 0.067) 0.249 16.408 ( -1.478 0.000 -0.348) 1.518 16.520 ( -1.979 0.000 9.807) 10.005 17.236 ( 0.442 0.000 -0.184) 0.479 19.746 ( -0.821 0.000 0.758) 1.117 20.072 ( 0.588 0.000 3.350) 3.401 20.095 ( 0.411 0.000 -0.633) 0.755 20.161 ( 1.662 0.000 -18.568) 18.642 21.706 ( -0.460 0.000 0.502) 0.681 21.774 ( 0.365 0.000 -0.382) 0.529 21.797 ( 0.317 0.000 0.835) 0.893 22.049 ( -0.551 0.000 7.812) 7.832 22.591 ( 0.200 0.000 0.050) 0.206 23.178 ( 1.958 0.000 0.093) 1.960 23.407 ( -3.096 0.000 3.749) 4.862 23.485 ( -0.456 0.000 -0.405) 0.610 24.122 ( 1.192 0.000 0.697) 1.381 24.485 ( -0.944 0.000 -0.443) 1.043 24.827 ( 0.713 0.000 -0.237) 0.751 24.921 ( -0.928 0.000 2.451) 2.621 ======================= Grid point 3 (4/104) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 52 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.697 ( 0.000 0.000 0.000) 0.000 1.536 ( -0.000 0.000 -0.000) 0.000 1.650 ( 0.000 0.000 0.000) 0.000 1.720 ( 0.000 0.000 0.000) 0.000 2.332 ( 0.000 0.000 0.000) 0.000 2.386 ( 0.000 0.000 0.000) 0.000 2.404 ( 0.000 0.000 -0.000) 0.000 2.499 ( 0.000 0.000 0.000) 0.000 2.544 ( 0.000 0.000 -0.000) 0.000 2.572 ( -0.000 0.000 -0.000) 0.000 2.616 ( 0.000 0.000 0.000) 0.000 2.784 ( 0.000 0.000 -0.000) 0.000 3.367 ( 0.000 0.000 0.000) 0.000 3.473 ( 0.000 0.000 -0.000) 0.000 3.597 ( 0.000 0.000 0.000) 0.000 3.640 ( 0.000 0.000 -0.000) 0.000 3.659 ( 0.000 0.000 0.000) 0.000 3.905 ( 0.000 0.000 0.000) 0.000 4.161 ( -0.000 0.000 0.000) 0.000 4.167 ( 0.000 0.000 -0.000) 0.000 4.263 ( -0.000 0.000 0.000) 0.000 4.313 ( 0.000 0.000 0.000) 0.000 4.853 ( 0.000 0.000 -0.000) 0.000 4.904 ( -0.000 0.000 0.000) 0.000 4.922 ( 0.000 0.000 0.000) 0.000 4.993 ( 0.000 0.000 -0.000) 0.000 5.043 ( 0.000 0.000 -0.000) 0.000 5.213 ( 0.000 0.000 0.000) 0.000 5.621 ( 0.000 0.000 -0.000) 0.000 5.800 ( 0.000 0.000 0.000) 0.000 5.960 ( 0.000 0.000 0.000) 0.000 6.212 ( 0.000 0.000 0.000) 0.000 6.481 ( 0.000 0.000 0.000) 0.000 6.530 ( 0.000 0.000 -0.000) 0.000 6.583 ( -0.000 0.000 0.000) 0.000 6.681 ( 0.000 0.000 -0.000) 0.000 6.843 ( 0.000 0.000 0.000) 0.000 6.857 ( 0.000 0.000 -0.000) 0.000 6.863 ( 0.000 0.000 0.000) 0.000 7.003 ( 0.000 0.000 0.000) 0.000 7.636 ( 0.000 0.000 0.000) 0.000 8.070 ( 0.000 0.000 0.000) 0.000 8.450 ( 0.000 0.000 -0.000) 0.000 8.477 ( 0.000 0.000 0.000) 0.000 8.591 ( 0.000 0.000 -0.000) 0.000 8.611 ( 0.000 0.000 0.000) 0.000 8.777 ( 0.000 0.000 0.000) 0.000 8.918 ( 0.000 0.000 -0.000) 0.000 9.167 ( 0.000 0.000 0.000) 0.000 9.251 ( 0.000 0.000 0.000) 0.000 9.704 ( 0.000 0.000 -0.000) 0.000 9.865 ( 0.000 0.000 -0.000) 0.000 9.951 ( 0.000 0.000 0.000) 0.000 10.664 ( 0.000 0.000 0.000) 0.000 10.711 ( 0.000 0.000 0.000) 0.000 10.779 ( 0.000 0.000 -0.000) 0.000 10.914 ( 0.000 0.000 0.000) 0.000 11.436 ( 0.000 0.000 0.000) 0.000 11.580 ( -0.000 0.000 0.000) 0.000 11.659 ( 0.000 0.000 -0.000) 0.000 12.023 ( -0.000 0.000 0.000) 0.000 12.042 ( 0.000 0.000 -0.000) 0.000 12.051 ( 0.000 0.000 -0.000) 0.000 12.327 ( 0.000 0.000 0.000) 0.000 12.584 ( 0.000 0.000 0.000) 0.000 12.681 ( 0.000 0.000 0.000) 0.000 12.960 ( 0.000 0.000 0.000) 0.000 13.490 ( 0.000 0.000 0.000) 0.000 13.538 ( 0.000 0.000 -0.000) 0.000 13.872 ( 0.000 0.000 0.000) 0.000 14.118 ( 0.000 0.000 0.000) 0.000 14.316 ( 0.000 0.000 0.000) 0.000 14.375 ( 0.000 0.000 -0.000) 0.000 14.547 ( 0.000 0.000 -0.000) 0.000 15.305 ( 0.000 0.000 0.000) 0.000 15.474 ( 0.000 0.000 -0.000) 0.000 15.865 ( 0.000 0.000 0.000) 0.000 16.392 ( 0.000 0.000 0.000) 0.000 16.513 ( 0.000 0.000 0.000) 0.000 17.240 ( 0.000 0.000 -0.000) 0.000 19.739 ( 0.000 0.000 0.000) 0.000 20.084 ( 0.000 0.000 -0.000) 0.000 20.099 ( 0.000 0.000 -0.000) 0.000 20.152 ( 0.000 0.000 0.000) 0.000 21.702 ( 0.000 0.000 -0.000) 0.000 21.777 ( 0.000 0.000 0.000) 0.000 21.801 ( 0.000 0.000 0.000) 0.000 22.054 ( 0.000 0.000 -0.000) 0.000 22.593 ( 0.000 0.000 0.000) 0.000 23.201 ( 0.000 0.000 0.000) 0.000 23.377 ( 0.000 0.000 0.000) 0.000 23.480 ( 0.000 0.000 -0.000) 0.000 24.136 ( 0.000 0.000 0.000) 0.000 24.474 ( 0.000 0.000 0.000) 0.000 24.834 ( 0.000 0.000 0.000) 0.000 24.915 ( 0.000 0.000 -0.000) 0.000 ======================= Grid point 7 (5/104) ======================= q-point: ( 0.00 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.618 ( 0.000 28.444 0.000) 28.444 0.633 ( 0.000 29.758 0.000) 29.758 1.256 ( 0.000 56.290 0.000) 56.290 2.009 ( 0.000 6.007 0.000) 6.007 2.209 ( 0.000 8.760 0.000) 8.760 2.402 ( 0.000 -2.644 0.000) 2.644 2.511 ( 0.000 2.990 0.000) 2.990 2.552 ( 0.000 3.868 0.000) 3.868 2.776 ( 0.000 6.781 0.000) 6.781 2.872 ( 0.000 10.246 0.000) 10.246 2.981 ( 0.000 2.701 0.000) 2.701 3.197 ( 0.000 -4.483 0.000) 4.483 3.444 ( 0.000 -2.259 0.000) 2.259 3.566 ( 0.000 -11.384 0.000) 11.384 3.604 ( 0.000 8.507 0.000) 8.507 3.740 ( 0.000 2.114 0.000) 2.114 3.907 ( 0.000 -3.467 0.000) 3.467 3.974 ( 0.000 -3.295 0.000) 3.295 4.018 ( 0.000 3.110 0.000) 3.110 4.172 ( 0.000 7.372 0.000) 7.372 4.417 ( 0.000 10.811 0.000) 10.811 4.479 ( 0.000 -6.849 0.000) 6.849 4.740 ( 0.000 -5.462 0.000) 5.462 4.806 ( 0.000 0.423 0.000) 0.423 4.890 ( 0.000 -5.878 0.000) 5.878 4.995 ( 0.000 9.634 0.000) 9.634 5.121 ( 0.000 -10.487 0.000) 10.487 5.376 ( 0.000 1.761 0.000) 1.761 5.518 ( 0.000 2.105 0.000) 2.105 5.542 ( 0.000 -3.180 0.000) 3.180 5.816 ( 0.000 -7.036 0.000) 7.036 6.011 ( 0.000 10.363 0.000) 10.363 6.106 ( 0.000 -2.502 0.000) 2.502 6.455 ( 0.000 0.926 0.000) 0.926 6.487 ( 0.000 -3.201 0.000) 3.201 6.515 ( 0.000 -3.827 0.000) 3.827 6.861 ( 0.000 -4.136 0.000) 4.136 7.011 ( 0.000 -0.282 0.000) 0.282 7.252 ( 0.000 2.681 0.000) 2.681 7.466 ( 0.000 -2.605 0.000) 2.605 7.844 ( 0.000 3.998 0.000) 3.998 7.987 ( 0.000 -1.269 0.000) 1.269 8.259 ( 0.000 0.605 0.000) 0.605 8.345 ( 0.000 -2.478 0.000) 2.478 8.574 ( 0.000 4.299 0.000) 4.299 8.613 ( 0.000 -4.116 0.000) 4.116 8.856 ( 0.000 -7.278 0.000) 7.278 8.979 ( 0.000 -3.071 0.000) 3.071 9.101 ( 0.000 1.984 0.000) 1.984 9.306 ( 0.000 4.357 0.000) 4.357 9.708 ( 0.000 4.920 0.000) 4.920 9.784 ( 0.000 1.440 0.000) 1.440 10.031 ( 0.000 0.293 0.000) 0.293 10.729 ( 0.000 0.917 0.000) 0.917 10.928 ( 0.000 -1.455 0.000) 1.455 10.981 ( 0.000 -2.356 0.000) 2.356 11.026 ( 0.000 2.444 0.000) 2.444 11.277 ( 0.000 0.421 0.000) 0.421 11.481 ( 0.000 -6.588 0.000) 6.588 11.643 ( 0.000 -0.426 0.000) 0.426 11.705 ( 0.000 -4.521 0.000) 4.521 11.729 ( 0.000 0.294 0.000) 0.294 12.048 ( 0.000 -6.416 0.000) 6.416 12.332 ( 0.000 -2.526 0.000) 2.526 12.710 ( 0.000 -0.710 0.000) 0.710 12.718 ( 0.000 1.183 0.000) 1.183 12.845 ( 0.000 4.518 0.000) 4.518 13.091 ( 0.000 -1.193 0.000) 1.193 13.704 ( 0.000 -9.631 0.000) 9.631 13.711 ( 0.000 -5.478 0.000) 5.478 14.239 ( 0.000 -5.293 0.000) 5.293 14.281 ( 0.000 -2.628 0.000) 2.628 14.366 ( 0.000 -2.272 0.000) 2.272 14.667 ( 0.000 11.512 0.000) 11.512 15.193 ( 0.000 21.013 0.000) 21.013 15.805 ( 0.000 -3.273 0.000) 3.273 16.014 ( 0.000 -1.490 0.000) 1.490 16.074 ( 0.000 -0.368 0.000) 0.368 16.605 ( 0.000 5.245 0.000) 5.245 17.193 ( 0.000 -2.866 0.000) 2.866 19.772 ( 0.000 -4.229 0.000) 4.229 19.881 ( 0.000 -3.578 0.000) 3.578 20.152 ( 0.000 7.767 0.000) 7.767 20.169 ( 0.000 6.758 0.000) 6.758 21.051 ( 0.000 -0.891 0.000) 0.891 21.607 ( 0.000 -9.754 0.000) 9.754 21.729 ( 0.000 0.819 0.000) 0.819 21.868 ( 0.000 2.510 0.000) 2.510 22.650 ( 0.000 -5.339 0.000) 5.339 23.028 ( 0.000 -8.260 0.000) 8.260 23.545 ( 0.000 3.833 0.000) 3.833 23.636 ( 0.000 5.372 0.000) 5.372 24.477 ( 0.000 -2.635 0.000) 2.635 24.689 ( 0.000 -8.383 0.000) 8.383 25.016 ( 0.000 8.617 0.000) 8.617 25.272 ( 0.000 7.569 0.000) 7.569 ======================= Grid point 8 (6/104) ======================= q-point: ( 0.17 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.641 ( 10.096 20.337 7.741) 23.989 0.700 ( 7.942 25.010 1.579) 26.288 1.612 ( 28.790 44.337 3.634) 52.989 1.963 ( -4.326 6.201 -2.228) 7.882 2.206 ( -1.100 9.499 0.619) 9.583 2.390 ( -1.091 -0.532 2.497) 2.776 2.465 ( -4.629 0.606 -1.553) 4.920 2.543 ( -0.482 4.350 -2.102) 4.855 2.724 ( -3.633 9.582 -0.634) 10.267 2.820 ( -6.453 3.597 3.460) 8.158 2.996 ( 1.791 5.857 -3.599) 7.104 3.159 ( -6.198 -4.407 -2.701) 8.070 3.416 ( -4.729 5.086 0.741) 6.984 3.507 ( -1.656 -6.615 -0.416) 6.832 3.610 ( 0.187 1.475 0.766) 1.672 3.706 ( -3.104 3.514 1.629) 4.963 3.810 ( -4.377 -2.290 1.404) 5.136 3.973 ( -2.578 0.300 -1.194) 2.856 3.986 ( 0.113 -7.251 -1.449) 7.395 4.197 ( -5.097 1.667 -3.824) 6.586 4.470 ( -0.360 5.138 1.471) 5.356 4.486 ( 6.900 5.940 1.278) 9.194 4.677 ( -4.746 -5.192 0.701) 7.069 4.789 ( -2.913 -0.922 -2.504) 3.951 4.870 ( 1.681 0.093 1.191) 2.063 5.076 ( 4.687 4.334 3.083) 7.089 5.222 ( 5.670 -12.067 0.978) 13.369 5.413 ( -5.767 -2.283 2.007) 6.519 5.449 ( -0.519 1.106 0.077) 1.224 5.527 ( 2.003 -0.152 0.805) 2.164 5.870 ( 3.469 -10.223 -0.097) 10.796 6.074 ( 5.801 7.742 3.060) 10.147 6.157 ( 6.308 -4.472 -2.942) 8.274 6.464 ( 0.146 -0.986 0.467) 1.101 6.489 ( 0.822 -2.321 -0.628) 2.541 6.574 ( 5.429 -3.459 -0.690) 6.474 6.858 ( -0.700 -3.864 1.893) 4.359 6.997 ( -1.539 0.039 -0.686) 1.685 7.091 ( -14.745 5.426 -6.227) 16.900 7.295 ( -9.230 5.711 9.433) 14.381 7.871 ( -1.523 2.878 -0.495) 3.294 7.936 ( -1.499 1.664 2.638) 3.460 8.322 ( 3.935 -6.550 -15.882) 17.625 8.418 ( 6.809 0.475 -0.132) 6.827 8.576 ( -0.551 -0.318 7.828) 7.854 8.603 ( 0.118 0.704 -6.321) 6.362 8.751 ( -5.280 -6.489 -4.364) 9.436 9.066 ( 2.866 -1.786 1.767) 3.811 9.107 ( 2.024 1.018 0.983) 2.470 9.273 ( -3.082 3.135 -1.173) 4.550 9.718 ( 1.281 4.863 -1.982) 5.405 9.806 ( 1.900 1.949 2.718) 3.847 10.024 ( -1.363 1.167 3.217) 3.683 10.688 ( -4.107 -0.130 1.985) 4.563 10.810 ( -6.712 2.971 -0.144) 7.342 10.981 ( -1.210 2.757 -2.924) 4.197 11.063 ( -6.773 10.547 -6.393) 14.070 11.148 ( 8.832 -3.394 0.647) 9.484 11.494 ( 1.005 -1.059 -3.767) 4.039 11.602 ( -3.987 -6.703 5.240) 9.396 11.750 ( 7.892 -2.750 8.357) 11.819 11.901 ( 6.024 -3.266 -0.124) 6.854 12.065 ( 2.508 -7.890 3.520) 8.996 12.298 ( -3.906 -2.871 -2.991) 5.696 12.623 ( -2.973 -2.842 -0.711) 4.174 12.779 ( -5.488 1.514 -1.587) 5.910 13.014 ( 13.820 -11.029 2.676) 17.883 13.091 ( -0.298 -0.065 1.184) 1.222 13.616 ( -3.977 -6.671 -1.289) 7.872 13.796 ( 3.933 -2.924 -1.199) 5.045 14.178 ( -3.090 -2.957 -9.779) 10.674 14.246 ( -0.489 -6.808 -7.749) 10.327 14.369 ( -1.088 10.845 15.204) 18.707 14.881 ( 13.600 -3.874 1.038) 14.179 15.165 ( -2.257 23.621 -4.180) 24.094 15.771 ( -7.721 7.346 2.854) 11.032 15.825 ( 0.346 1.582 -5.143) 5.392 16.253 ( 4.000 -12.562 11.205) 17.302 16.556 ( -4.172 6.115 1.512) 7.556 17.251 ( 3.271 -1.321 2.974) 4.614 19.740 ( -1.897 -1.911 2.142) 3.440 19.931 ( 3.223 -8.498 -8.364) 12.352 20.146 ( 0.480 7.188 0.718) 7.240 20.229 ( 4.397 4.803 -12.591) 14.175 21.273 ( 14.468 -19.333 14.452) 28.141 21.605 ( -0.211 -9.856 -0.467) 9.869 21.746 ( 1.590 0.431 1.231) 2.056 21.865 ( -0.244 2.521 -0.048) 2.533 22.661 ( 1.069 -3.978 -0.244) 4.127 23.036 ( 0.766 -10.933 0.389) 10.967 23.541 ( -0.581 4.874 -0.111) 4.909 23.612 ( -2.601 7.283 0.449) 7.746 24.401 ( -8.050 1.185 -5.399) 9.765 24.617 ( -5.874 -0.524 4.586) 7.471 25.006 ( -1.163 11.176 -3.294) 11.709 25.046 ( -10.467 17.313 4.972) 20.833 ======================= Grid point 9 (7/104) ======================= q-point: ( 0.33 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.852 ( 7.370 20.530 4.256) 22.224 1.053 ( 27.176 2.318 4.986) 27.727 1.858 ( -6.480 5.732 -1.129) 8.724 2.015 ( -6.284 9.919 -3.482) 12.248 2.207 ( 16.734 23.924 4.341) 29.517 2.399 ( 3.503 2.419 2.695) 5.039 2.427 ( 1.868 3.396 -1.323) 4.095 2.536 ( 0.698 7.296 -0.876) 7.381 2.667 ( -4.374 7.037 -0.372) 8.294 2.683 ( -5.883 3.387 4.820) 8.325 2.936 ( -11.643 0.182 -4.414) 12.453 3.002 ( -3.060 10.350 -5.699) 12.205 3.362 ( -1.053 4.556 0.281) 4.684 3.536 ( 3.188 -1.672 2.864) 4.600 3.604 ( -1.300 -3.510 1.102) 3.902 3.646 ( -4.577 5.261 0.920) 7.034 3.732 ( -4.389 -3.739 1.289) 5.909 3.896 ( -6.921 -0.473 -2.445) 7.355 3.968 ( 0.222 -6.692 -0.104) 6.696 4.090 ( -3.132 -5.511 -3.078) 7.047 4.421 ( -2.292 8.020 -0.483) 8.355 4.578 ( 0.118 10.671 -3.852) 11.346 4.635 ( -1.303 -8.976 4.646) 10.191 4.777 ( 5.409 -0.086 -3.692) 6.550 4.920 ( 2.282 2.375 1.608) 3.666 5.093 ( -4.558 -0.985 1.367) 4.860 5.255 ( -6.167 3.829 1.257) 7.367 5.284 ( -1.194 0.166 0.577) 1.336 5.458 ( 3.321 -6.194 0.339) 7.036 5.654 ( 7.569 -2.012 3.224) 8.470 5.887 ( -1.621 -10.411 -0.158) 10.538 6.178 ( 4.228 1.208 2.464) 5.040 6.321 ( 10.196 -5.722 -4.780) 12.631 6.462 ( -0.962 -3.220 3.863) 5.120 6.510 ( 1.934 -1.395 -1.027) 2.597 6.673 ( 4.864 -1.297 -2.577) 5.656 6.824 ( -3.680 -2.561 0.719) 4.541 6.898 ( -3.536 1.739 -1.033) 4.073 6.956 ( -2.362 3.495 -0.535) 4.252 7.156 ( -8.224 3.478 2.754) 9.344 7.745 ( -7.047 3.932 -0.243) 8.073 8.009 ( 4.478 0.328 1.265) 4.664 8.357 ( 3.603 -8.664 -10.846) 14.342 8.470 ( -1.496 -0.857 6.159) 6.395 8.555 ( -1.356 -2.376 -2.058) 3.423 8.586 ( -1.725 1.208 -2.730) 3.448 8.766 ( 7.076 -0.684 -1.614) 7.289 9.031 ( -5.088 2.908 2.809) 6.498 9.184 ( 3.352 -2.613 -1.131) 4.398 9.211 ( -2.332 1.736 -0.484) 2.947 9.741 ( 1.429 4.663 -1.293) 5.045 9.849 ( 1.635 2.121 1.947) 3.311 10.009 ( -0.737 3.611 3.470) 5.063 10.622 ( -3.015 -2.200 1.885) 4.181 10.740 ( -1.605 2.338 0.655) 2.910 10.922 ( -3.528 1.260 -1.923) 4.211 10.995 ( -0.373 11.817 -2.845) 12.160 11.335 ( 9.401 -8.257 -4.135) 13.177 11.478 ( -1.697 -0.078 -1.430) 2.221 11.591 ( 1.498 -4.744 4.737) 6.869 11.915 ( 3.953 -3.900 7.678) 9.476 11.967 ( 4.790 -3.092 -0.187) 5.704 12.124 ( -1.311 -1.901 8.865) 9.161 12.231 ( 1.122 -4.958 -6.737) 8.440 12.536 ( -5.293 -7.421 -5.225) 10.506 12.683 ( -4.095 -2.295 -0.128) 4.696 13.059 ( -1.852 4.329 1.363) 4.902 13.200 ( 5.553 -12.644 1.076) 13.852 13.553 ( -2.340 -2.674 -1.987) 4.071 13.848 ( 2.112 -0.481 -1.038) 2.402 14.113 ( -1.723 -6.095 -4.997) 8.068 14.253 ( 2.761 -5.217 -8.144) 10.058 14.369 ( -2.665 11.144 13.183) 17.467 15.060 ( 5.817 2.575 -3.642) 7.330 15.113 ( -1.801 18.944 -0.115) 19.030 15.704 ( -1.017 11.447 2.952) 11.865 15.841 ( 1.224 -0.605 -1.710) 2.189 16.300 ( 0.093 -14.386 5.154) 15.282 16.486 ( -3.297 5.844 0.349) 6.719 17.297 ( 1.299 2.130 1.705) 3.022 19.718 ( -1.016 -1.958 1.095) 2.463 19.952 ( 1.015 -8.455 -3.669) 9.273 20.163 ( 0.827 7.182 1.109) 7.314 20.252 ( 1.307 5.172 -8.277) 9.847 21.490 ( 6.102 -23.115 7.337) 25.007 21.596 ( -0.537 -10.730 -1.424) 10.837 21.787 ( 2.129 -0.926 2.301) 3.269 21.858 ( -0.475 2.272 -0.634) 2.406 22.681 ( 1.049 -1.060 -0.234) 1.510 23.054 ( 0.922 -16.904 0.380) 16.933 23.514 ( -2.454 12.415 0.238) 12.658 23.566 ( -1.485 5.716 -0.045) 5.906 24.251 ( -5.068 6.227 -1.832) 8.235 24.561 ( -1.792 1.867 2.430) 3.550 24.951 ( -1.252 12.769 -0.323) 12.835 25.000 ( -0.901 7.962 0.994) 8.075 ======================= Grid point 10 (8/104) ======================= q-point: (-0.50 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 91 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.934 ( 0.000 18.922 0.000) 18.922 1.496 ( 0.000 -1.179 -0.000) 1.179 1.650 ( -0.000 0.403 -0.000) 0.403 1.858 ( -0.000 9.872 -0.000) 9.872 2.449 ( 0.000 2.137 -0.000) 2.137 2.452 ( 0.000 7.130 0.000) 7.130 2.457 ( -0.000 5.143 0.000) 5.143 2.485 ( -0.000 -0.095 0.000) 0.095 2.630 ( 0.000 5.382 0.000) 5.382 2.787 ( 0.000 17.180 0.000) 17.180 2.808 ( 0.000 4.573 0.000) 4.573 2.838 ( -0.000 21.589 -0.000) 21.589 3.353 ( 0.000 3.684 0.000) 3.684 3.560 ( 0.000 1.238 -0.000) 1.238 3.593 ( 0.000 -0.923 0.000) 0.923 3.607 ( 0.000 -1.733 -0.000) 1.733 3.693 ( -0.000 5.224 -0.000) 5.224 3.800 ( 0.000 -7.186 0.000) 7.186 3.978 ( 0.000 -8.316 0.000) 8.316 4.057 ( 0.000 -8.184 0.000) 8.184 4.401 ( 0.000 8.229 0.000) 8.229 4.569 ( 0.000 13.611 0.000) 13.611 4.617 ( 0.000 -11.719 -0.000) 11.719 4.893 ( 0.000 1.109 -0.000) 1.109 4.958 ( 0.000 -3.767 0.000) 3.767 4.971 ( -0.000 4.007 -0.000) 4.007 5.182 ( 0.000 3.380 0.000) 3.380 5.279 ( 0.000 7.840 0.000) 7.840 5.508 ( 0.000 -8.737 0.000) 8.737 5.756 ( -0.000 -3.030 0.000) 3.030 5.843 ( 0.000 -9.516 0.000) 9.516 6.226 ( 0.000 -0.094 0.000) 0.094 6.428 ( -0.000 -7.894 0.000) 7.894 6.441 ( 0.000 -3.189 -0.000) 3.189 6.542 ( 0.000 -4.067 0.000) 4.067 6.714 ( 0.000 1.743 0.000) 1.743 6.796 ( 0.000 -3.558 0.000) 3.558 6.869 ( 0.000 2.649 0.000) 2.649 6.944 ( 0.000 4.393 0.000) 4.393 7.049 ( 0.000 2.023 -0.000) 2.023 7.674 ( -0.000 4.026 0.000) 4.026 8.056 ( 0.000 -1.200 0.000) 1.200 8.388 ( 0.000 -11.884 0.000) 11.884 8.445 ( 0.000 -0.034 0.000) 0.034 8.552 ( 0.000 -3.957 0.000) 3.957 8.554 ( -0.000 4.752 -0.000) 4.752 8.891 ( -0.000 -1.585 0.000) 1.585 8.931 ( 0.000 6.093 -0.000) 6.093 9.178 ( 0.000 0.487 0.000) 0.487 9.224 ( 0.000 -2.177 -0.000) 2.177 9.754 ( 0.000 4.486 -0.000) 4.486 9.867 ( 0.000 2.047 -0.000) 2.047 10.010 ( 0.000 5.032 -0.000) 5.032 10.594 ( 0.000 -3.580 -0.000) 3.580 10.730 ( 0.000 1.735 0.000) 1.735 10.885 ( 0.000 1.019 -0.000) 1.019 10.989 ( 0.000 11.776 0.000) 11.776 11.435 ( 0.000 -0.018 -0.000) 0.018 11.442 ( -0.000 -11.773 0.000) 11.773 11.630 ( 0.000 -2.472 0.000) 2.472 11.937 ( 0.000 -5.854 0.000) 5.854 12.032 ( -0.000 0.448 0.000) 0.448 12.105 ( 0.000 0.789 0.000) 0.789 12.261 ( 0.000 -6.175 -0.000) 6.175 12.468 ( 0.000 -8.915 0.000) 8.915 12.637 ( 0.000 -5.331 -0.000) 5.331 13.040 ( -0.000 5.951 0.000) 5.951 13.251 ( 0.000 -11.768 -0.000) 11.768 13.528 ( 0.000 -0.767 -0.000) 0.767 13.867 ( 0.000 -0.358 0.000) 0.358 14.092 ( 0.000 -7.301 -0.000) 7.301 14.279 ( 0.000 -8.660 0.000) 8.660 14.351 ( 0.000 14.512 -0.000) 14.512 15.076 ( 0.000 30.620 -0.000) 30.620 15.126 ( 0.000 -8.129 0.000) 8.129 15.705 ( 0.000 12.712 0.000) 12.712 15.852 ( 0.000 -0.669 -0.000) 0.669 16.305 ( 0.000 -15.023 0.000) 15.023 16.453 ( 0.000 5.551 0.000) 5.551 17.311 ( 0.000 3.221 -0.000) 3.221 19.709 ( 0.000 -2.009 -0.000) 2.009 19.956 ( 0.000 -8.364 0.000) 8.364 20.173 ( 0.000 7.371 -0.000) 7.371 20.251 ( 0.000 5.282 0.000) 5.282 21.559 ( 0.000 -23.079 -0.000) 23.079 21.579 ( 0.000 -9.265 -0.000) 9.265 21.816 ( -0.000 -1.917 -0.000) 1.917 21.849 ( 0.000 2.201 0.000) 2.201 22.692 ( 0.000 0.517 0.000) 0.517 23.064 ( 0.000 -20.615 0.000) 20.615 23.484 ( 0.000 17.230 0.000) 17.230 23.555 ( 0.000 3.921 -0.000) 3.921 24.206 ( 0.000 5.363 -0.000) 5.363 24.548 ( 0.000 1.920 0.000) 1.920 24.943 ( 0.000 10.313 0.000) 10.313 24.992 ( 0.000 8.246 -0.000) 8.246 ======================= Grid point 14 (9/104) ======================= q-point: ( 0.00 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.189 ( 0.000 25.177 0.000) 25.177 1.254 ( 0.000 28.683 0.000) 28.683 2.114 ( 0.000 6.972 0.000) 6.972 2.240 ( 0.000 15.101 0.000) 15.101 2.321 ( 0.000 2.128 0.000) 2.128 2.343 ( 0.000 4.900 0.000) 4.900 2.628 ( 0.000 6.759 0.000) 6.759 2.751 ( 0.000 18.893 0.000) 18.893 2.953 ( 0.000 10.461 0.000) 10.461 2.981 ( 0.000 -2.890 0.000) 2.890 3.124 ( 0.000 4.380 0.000) 4.380 3.210 ( 0.000 11.905 0.000) 11.905 3.324 ( 0.000 -4.231 0.000) 4.231 3.477 ( 0.000 1.082 0.000) 1.082 3.608 ( 0.000 -6.032 0.000) 6.032 3.625 ( 0.000 -9.204 0.000) 9.204 3.850 ( 0.000 -8.357 0.000) 8.357 4.038 ( 0.000 11.520 0.000) 11.520 4.187 ( 0.000 4.476 0.000) 4.476 4.298 ( 0.000 6.035 0.000) 6.035 4.355 ( 0.000 1.200 0.000) 1.200 4.603 ( 0.000 -4.165 0.000) 4.165 4.649 ( 0.000 -12.851 0.000) 12.851 4.706 ( 0.000 12.607 0.000) 12.607 4.791 ( 0.000 -5.951 0.000) 5.951 5.001 ( 0.000 -0.145 0.000) 0.145 5.226 ( 0.000 9.216 0.000) 9.216 5.383 ( 0.000 -3.197 0.000) 3.197 5.500 ( 0.000 -4.263 0.000) 4.263 5.542 ( 0.000 7.266 0.000) 7.266 5.638 ( 0.000 -8.759 0.000) 8.759 6.037 ( 0.000 -3.353 0.000) 3.353 6.279 ( 0.000 13.640 0.000) 13.640 6.404 ( 0.000 -3.895 0.000) 3.895 6.408 ( 0.000 -3.559 0.000) 3.559 6.494 ( 0.000 0.451 0.000) 0.451 6.734 ( 0.000 -7.099 0.000) 7.099 6.940 ( 0.000 -5.479 0.000) 5.479 7.245 ( 0.000 -5.025 0.000) 5.025 7.358 ( 0.000 -8.113 0.000) 8.113 7.949 ( 0.000 5.507 0.000) 5.507 8.017 ( 0.000 4.192 0.000) 4.192 8.279 ( 0.000 1.310 0.000) 1.310 8.301 ( 0.000 -0.749 0.000) 0.749 8.538 ( 0.000 -2.755 0.000) 2.755 8.659 ( 0.000 -0.260 0.000) 0.260 8.704 ( 0.000 -3.174 0.000) 3.174 8.895 ( 0.000 -4.250 0.000) 4.250 9.128 ( 0.000 0.527 0.000) 0.527 9.326 ( 0.000 -2.700 0.000) 2.700 9.845 ( 0.000 4.185 0.000) 4.185 9.913 ( 0.000 13.690 0.000) 13.690 10.036 ( 0.000 0.364 0.000) 0.364 10.726 ( 0.000 -1.887 0.000) 1.887 10.884 ( 0.000 -2.737 0.000) 2.737 10.930 ( 0.000 -2.294 0.000) 2.294 11.068 ( 0.000 1.003 0.000) 1.003 11.256 ( 0.000 -5.122 0.000) 5.122 11.337 ( 0.000 -2.907 0.000) 2.907 11.581 ( 0.000 -6.340 0.000) 6.340 11.645 ( 0.000 0.649 0.000) 0.649 11.746 ( 0.000 1.102 0.000) 1.102 11.926 ( 0.000 -4.033 0.000) 4.033 12.237 ( 0.000 -6.555 0.000) 6.555 12.717 ( 0.000 1.749 0.000) 1.749 12.744 ( 0.000 1.612 0.000) 1.612 12.927 ( 0.000 1.716 0.000) 1.716 13.022 ( 0.000 -5.268 0.000) 5.268 13.549 ( 0.000 -3.997 0.000) 3.997 13.593 ( 0.000 -4.705 0.000) 4.705 14.082 ( 0.000 -3.819 0.000) 3.819 14.229 ( 0.000 -2.670 0.000) 2.670 14.497 ( 0.000 8.183 0.000) 8.183 14.834 ( 0.000 2.905 0.000) 2.905 15.571 ( 0.000 13.952 0.000) 13.952 15.783 ( 0.000 1.753 0.000) 1.753 15.981 ( 0.000 -1.160 0.000) 1.160 16.063 ( 0.000 -0.666 0.000) 0.666 16.724 ( 0.000 5.580 0.000) 5.580 17.104 ( 0.000 -5.423 0.000) 5.423 19.702 ( 0.000 -2.055 0.000) 2.055 19.800 ( 0.000 -3.795 0.000) 3.795 20.328 ( 0.000 8.344 0.000) 8.344 20.341 ( 0.000 8.861 0.000) 8.861 21.016 ( 0.000 -2.270 0.000) 2.270 21.372 ( 0.000 -12.042 0.000) 12.042 21.758 ( 0.000 1.963 0.000) 1.963 21.889 ( 0.000 -0.349 0.000) 0.349 22.550 ( 0.000 -3.005 0.000) 3.005 22.836 ( 0.000 -9.203 0.000) 9.203 23.643 ( 0.000 4.967 0.000) 4.967 23.740 ( 0.000 3.836 0.000) 3.836 24.424 ( 0.000 -2.143 0.000) 2.143 24.522 ( 0.000 -6.762 0.000) 6.762 25.217 ( 0.000 9.387 0.000) 9.387 25.409 ( 0.000 4.654 0.000) 4.654 ======================= Grid point 15 (10/104) ======================= q-point: ( 0.17 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.173 ( -4.428 26.667 3.147) 27.215 1.234 ( 4.332 24.316 0.358) 24.702 2.089 ( -3.609 4.720 0.429) 5.957 2.278 ( 0.528 4.115 -0.797) 4.225 2.330 ( 1.324 1.997 -1.798) 2.996 2.359 ( -0.400 0.386 -0.409) 0.690 2.606 ( -1.449 8.645 -0.090) 8.766 2.799 ( 5.865 23.910 0.301) 24.620 2.865 ( -6.630 3.687 -0.444) 7.599 2.943 ( -2.012 9.765 0.003) 9.970 3.111 ( -2.526 5.573 -1.926) 6.415 3.237 ( 0.157 12.265 -2.351) 12.489 3.342 ( 3.252 -5.037 2.657) 6.558 3.478 ( 0.676 -2.275 1.673) 2.903 3.541 ( -3.362 -5.243 1.393) 6.382 3.695 ( 3.133 -7.311 -0.014) 7.954 3.799 ( -5.291 -9.925 0.204) 11.249 3.924 ( -11.034 15.359 -0.257) 18.913 4.069 ( -5.526 7.213 -1.396) 9.193 4.211 ( -3.037 -0.935 -5.520) 6.370 4.492 ( 2.087 1.040 2.692) 3.561 4.614 ( 4.750 -1.485 -4.200) 6.512 4.638 ( -4.501 0.304 3.469) 5.690 4.709 ( 2.610 -4.415 6.115) 7.981 4.952 ( 10.942 7.534 0.555) 13.296 5.042 ( 4.860 -3.506 1.307) 6.134 5.218 ( -1.795 6.900 -1.833) 7.361 5.331 ( -5.054 -4.497 0.985) 6.836 5.453 ( -0.864 -1.330 0.709) 1.738 5.554 ( 0.004 3.594 2.848) 4.585 5.677 ( 2.804 -7.906 -0.840) 8.431 6.042 ( 1.369 -5.269 -3.033) 6.232 6.283 ( 0.197 10.369 1.647) 10.501 6.393 ( -1.000 -3.582 3.876) 5.372 6.424 ( 1.331 -4.018 -3.258) 5.341 6.576 ( 7.834 2.696 -2.022) 8.528 6.734 ( -0.350 -7.322 0.464) 7.345 6.918 ( -2.152 -5.913 -0.637) 6.325 7.127 ( -9.657 -2.904 -4.937) 11.228 7.302 ( -6.068 -5.043 4.623) 9.145 7.969 ( -1.986 5.416 0.484) 5.789 7.977 ( -0.806 2.843 0.525) 3.001 8.208 ( -1.821 -2.425 -4.322) 5.280 8.428 ( 6.642 0.322 -1.836) 6.899 8.522 ( -2.859 -3.651 0.057) 4.638 8.620 ( -1.784 -4.141 -0.865) 4.591 8.684 ( 1.441 4.041 -0.601) 4.332 8.971 ( 4.993 -5.625 -1.262) 7.627 9.130 ( -0.228 0.526 2.747) 2.806 9.293 ( -3.188 -1.881 -0.441) 3.728 9.845 ( 1.029 5.034 -5.172) 7.290 9.941 ( 1.109 10.608 6.882) 12.694 10.048 ( 1.627 2.359 1.194) 3.104 10.663 ( -5.427 -2.332 1.953) 6.222 10.835 ( -3.327 0.349 -1.166) 3.543 11.003 ( 5.245 -6.997 -0.665) 8.770 11.041 ( -2.455 2.044 -2.914) 4.324 11.239 ( 0.002 2.513 -1.730) 3.051 11.429 ( 5.230 -2.944 4.665) 7.601 11.510 ( -2.536 -2.079 -2.102) 3.895 11.676 ( 4.258 -2.709 4.808) 6.970 11.873 ( 8.456 -2.278 3.863) 9.572 11.894 ( -2.561 -4.747 1.364) 5.564 12.198 ( -3.383 -6.774 -3.235) 8.234 12.561 ( -8.543 -1.912 -2.165) 9.018 12.742 ( -11.179 -4.804 0.095) 12.168 12.946 ( 10.049 1.795 1.066) 10.264 13.115 ( 4.041 1.173 -0.028) 4.208 13.524 ( -0.499 -1.615 -0.470) 1.754 13.698 ( 7.857 -5.594 -0.886) 9.686 14.066 ( -0.945 -5.099 -1.899) 5.522 14.156 ( -5.077 -1.190 -6.567) 8.385 14.570 ( 3.787 7.724 7.823) 11.627 14.870 ( 4.022 0.186 -0.387) 4.044 15.604 ( 3.025 15.526 -1.930) 15.935 15.760 ( -2.195 0.159 2.483) 3.318 15.964 ( -0.147 4.538 -2.322) 5.100 16.063 ( -0.817 -4.893 1.570) 5.204 16.699 ( -2.427 6.768 -0.172) 7.192 17.166 ( 5.111 -6.149 2.440) 8.360 19.696 ( -0.771 -1.678 1.189) 2.196 19.799 ( 0.078 -4.527 -1.427) 4.747 20.322 ( -0.035 8.804 2.192) 9.073 20.366 ( 2.082 7.534 -4.747) 9.145 21.057 ( 3.583 -5.519 3.052) 7.253 21.367 ( -0.436 -12.176 -0.541) 12.196 21.767 ( 0.861 1.584 0.584) 1.895 21.888 ( -0.092 -0.274 -0.462) 0.545 22.560 ( 1.164 -3.782 -0.155) 3.960 22.812 ( -2.479 -9.587 -0.159) 9.903 23.644 ( 0.135 4.959 -0.453) 4.981 23.740 ( -0.187 4.261 0.218) 4.271 24.389 ( -2.992 -1.016 -2.899) 4.288 24.519 ( -0.707 -5.641 2.904) 6.384 25.213 ( -0.474 9.451 0.374) 9.470 25.342 ( -5.790 8.500 -0.465) 10.295 ======================= Grid point 16 (11/104) ======================= q-point: ( 0.33 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.244 ( 11.499 15.040 6.449) 20.001 1.330 ( 5.358 21.912 -0.434) 22.562 1.955 ( -13.021 1.412 0.131) 13.098 2.148 ( -8.298 3.704 -5.546) 10.645 2.367 ( 3.727 0.429 -2.094) 4.297 2.404 ( 4.615 -2.977 3.272) 6.393 2.582 ( -1.577 6.102 -1.067) 6.392 2.679 ( -9.065 1.262 1.093) 9.218 2.830 ( -10.197 4.297 -3.377) 11.569 2.967 ( 2.070 11.979 0.590) 12.171 3.120 ( 7.340 24.916 0.075) 25.975 3.249 ( 2.988 10.493 -3.115) 11.346 3.460 ( 8.100 -0.318 4.205) 9.132 3.490 ( -2.581 -5.009 1.671) 5.877 3.508 ( 1.851 -1.052 2.065) 2.966 3.657 ( -6.708 -5.805 2.722) 9.280 3.751 ( 1.610 -0.360 -0.041) 1.651 3.778 ( -3.987 5.294 -3.572) 7.529 3.986 ( -3.378 7.819 -0.659) 8.543 4.099 ( -8.830 5.731 -3.908) 11.228 4.480 ( -2.086 -1.937 2.010) 3.485 4.557 ( -4.055 0.350 1.398) 4.304 4.697 ( 2.336 -0.890 -1.022) 2.701 4.785 ( 5.417 -0.737 1.758) 5.743 5.060 ( 2.376 4.154 -2.357) 5.335 5.100 ( -4.274 7.949 -2.193) 9.288 5.238 ( 6.631 -1.941 3.748) 7.860 5.263 ( -0.699 -1.593 0.738) 1.890 5.462 ( -0.649 4.507 2.673) 5.280 5.580 ( 2.022 -5.928 3.476) 7.164 5.708 ( 0.837 -4.329 -1.258) 4.585 6.082 ( 3.421 -9.238 -2.774) 10.234 6.297 ( 1.066 3.192 0.843) 3.470 6.382 ( -1.149 -3.288 2.888) 4.525 6.438 ( 0.878 -4.316 -1.982) 4.830 6.688 ( -2.226 -5.631 -0.492) 6.075 6.731 ( 5.253 1.461 -2.102) 5.844 6.888 ( 0.890 -2.566 -1.528) 3.116 6.974 ( -4.507 -2.468 -1.968) 5.502 7.175 ( -8.331 -2.507 3.091) 9.232 7.861 ( -5.941 6.145 -0.095) 8.548 8.012 ( 1.483 0.121 0.639) 1.619 8.182 ( -0.277 -5.237 -3.525) 6.319 8.436 ( -3.844 -6.834 -1.188) 7.930 8.496 ( 1.500 2.400 0.228) 2.839 8.650 ( 2.191 3.485 -2.059) 4.603 8.760 ( 6.805 -0.044 0.597) 6.831 9.005 ( -1.743 -5.006 -0.919) 5.379 9.143 ( 1.354 -0.748 1.630) 2.248 9.227 ( -3.418 -0.881 -0.209) 3.536 9.858 ( 1.327 5.317 -3.580) 6.546 9.965 ( -0.042 6.411 5.511) 8.454 10.104 ( 3.455 6.518 0.920) 7.434 10.574 ( -4.341 -2.273 2.111) 5.335 10.788 ( -1.328 2.091 -0.202) 2.485 10.952 ( -4.735 1.847 -1.775) 5.384 11.094 ( 3.788 -10.386 -1.406) 11.144 11.275 ( 3.455 10.119 -1.722) 10.830 11.444 ( -1.292 -1.822 0.087) 2.235 11.551 ( 3.619 0.887 0.932) 3.841 11.786 ( 2.332 -7.835 8.046) 11.470 11.886 ( 4.388 -4.166 0.941) 6.124 12.038 ( 7.258 -4.958 3.390) 9.420 12.122 ( -3.405 -6.582 -2.561) 7.841 12.380 ( -9.304 -5.725 -5.737) 12.339 12.555 ( -8.884 -8.175 1.188) 12.131 13.097 ( 5.587 1.029 0.431) 5.698 13.156 ( 0.990 3.967 -0.267) 4.097 13.527 ( 0.605 0.626 -0.434) 0.973 13.818 ( 4.552 -2.797 -0.601) 5.376 14.054 ( -1.415 -4.457 -3.298) 5.722 14.056 ( -1.953 -4.848 -2.876) 5.966 14.620 ( 0.210 9.785 5.171) 11.069 14.958 ( 4.494 -3.580 -0.173) 5.748 15.611 ( -1.447 15.652 -4.823) 16.442 15.784 ( 3.948 1.063 8.406) 9.348 15.962 ( -0.574 7.760 -5.594) 9.583 16.046 ( -0.715 -7.460 1.982) 7.751 16.647 ( -2.783 8.722 -0.187) 9.157 17.258 ( 3.565 -5.744 1.938) 7.033 19.683 ( -0.782 -1.119 1.074) 1.737 19.797 ( 0.086 -5.661 -1.238) 5.795 20.337 ( 0.827 8.613 2.696) 9.063 20.380 ( 0.695 7.006 -4.906) 8.581 21.137 ( 3.574 -10.528 2.915) 11.493 21.354 ( -0.762 -12.391 -0.823) 12.441 21.790 ( 1.307 0.753 0.893) 1.753 21.881 ( -0.491 -0.115 -0.721) 0.880 22.595 ( 2.726 -5.327 -0.162) 5.986 22.749 ( -4.063 -10.381 -0.172) 11.150 23.646 ( 0.245 4.877 -0.444) 4.903 23.733 ( -0.487 5.469 0.150) 5.493 24.325 ( -2.634 1.727 -1.691) 3.575 24.512 ( -0.588 -4.465 1.913) 4.893 25.205 ( -0.455 9.827 0.912) 9.880 25.247 ( -3.641 11.472 -0.948) 12.074 ======================= Grid point 17 (12/104) ======================= q-point: (-0.50 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 91 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.376 ( 0.000 21.114 0.000) 21.114 1.525 ( 0.000 3.861 -0.000) 3.861 1.675 ( -0.000 1.841 -0.000) 1.841 2.070 ( -0.000 8.423 -0.000) 8.423 2.441 ( 0.000 -2.382 -0.000) 2.382 2.461 ( -0.000 -1.696 0.000) 1.696 2.540 ( 0.000 3.374 -0.000) 3.374 2.613 ( -0.000 -5.148 -0.000) 5.148 2.661 ( 0.000 11.458 0.000) 11.458 2.979 ( -0.000 11.669 0.000) 11.669 3.189 ( 0.000 12.077 -0.000) 12.077 3.316 ( 0.000 12.537 -0.000) 12.537 3.436 ( 0.000 -3.655 -0.000) 3.655 3.511 ( 0.000 -2.875 -0.000) 2.875 3.549 ( -0.000 -2.538 0.000) 2.538 3.686 ( 0.000 -3.220 0.000) 3.220 3.709 ( -0.000 16.851 -0.000) 16.851 3.858 ( 0.000 10.420 -0.000) 10.420 3.882 ( -0.000 -1.164 0.000) 1.164 3.954 ( 0.000 7.500 -0.000) 7.500 4.458 ( 0.000 -2.045 -0.000) 2.045 4.519 ( 0.000 0.127 0.000) 0.127 4.709 ( 0.000 -0.673 -0.000) 0.673 4.859 ( 0.000 -6.144 0.000) 6.144 5.021 ( 0.000 8.866 -0.000) 8.866 5.107 ( 0.000 7.819 -0.000) 7.819 5.215 ( 0.000 0.765 -0.000) 0.765 5.360 ( 0.000 -1.464 -0.000) 1.464 5.443 ( -0.000 6.439 0.000) 6.439 5.606 ( 0.000 -11.583 0.000) 11.583 5.713 ( 0.000 -0.799 0.000) 0.799 6.120 ( 0.000 -10.544 0.000) 10.544 6.313 ( 0.000 -1.186 0.000) 1.186 6.371 ( 0.000 -2.926 -0.000) 2.926 6.445 ( 0.000 -4.583 0.000) 4.583 6.642 ( 0.000 -7.818 0.000) 7.818 6.781 ( 0.000 1.299 0.000) 1.299 6.903 ( 0.000 -0.638 0.000) 0.638 6.999 ( -0.000 0.164 0.000) 0.164 7.037 ( 0.000 -2.828 -0.000) 2.828 7.799 ( -0.000 6.831 0.000) 6.831 8.026 ( 0.000 -1.420 -0.000) 1.420 8.175 ( 0.000 -6.583 -0.000) 6.583 8.398 ( 0.000 -6.597 0.000) 6.597 8.510 ( 0.000 3.243 0.000) 3.243 8.667 ( 0.000 5.103 -0.000) 5.103 8.865 ( -0.000 -1.174 0.000) 1.174 8.946 ( 0.000 -4.064 0.000) 4.064 9.176 ( 0.000 -0.595 -0.000) 0.595 9.178 ( -0.000 -1.930 -0.000) 1.930 9.868 ( 0.000 5.372 -0.000) 5.372 9.971 ( 0.000 5.684 -0.000) 5.684 10.144 ( 0.000 7.570 -0.000) 7.570 10.532 ( 0.000 -2.033 -0.000) 2.033 10.778 ( 0.000 2.501 0.000) 2.501 10.901 ( 0.000 1.728 0.000) 1.728 11.125 ( 0.000 -10.643 -0.000) 10.643 11.318 ( 0.000 12.338 -0.000) 12.338 11.427 ( -0.000 -1.717 0.000) 1.717 11.590 ( 0.000 -0.005 0.000) 0.005 11.798 ( 0.000 -7.094 0.000) 7.094 12.007 ( -0.000 -4.403 0.000) 4.403 12.068 ( 0.000 -4.312 0.000) 4.312 12.088 ( -0.000 -8.558 -0.000) 8.558 12.290 ( 0.000 -6.352 -0.000) 6.352 12.449 ( -0.000 -10.530 0.000) 10.530 13.150 ( 0.000 0.721 -0.000) 0.721 13.162 ( -0.000 4.810 0.000) 4.810 13.533 ( 0.000 1.793 -0.000) 1.793 13.858 ( 0.000 -1.003 0.000) 1.003 14.013 ( 0.000 -1.385 -0.000) 1.385 14.061 ( 0.000 -9.898 0.000) 9.898 14.625 ( 0.000 10.584 0.000) 10.584 15.003 ( 0.000 -4.391 0.000) 4.391 15.585 ( 0.000 14.310 0.000) 14.310 15.886 ( 0.000 5.756 0.000) 5.756 15.898 ( -0.000 1.721 -0.000) 1.721 16.049 ( 0.000 -4.338 0.000) 4.338 16.617 ( 0.000 9.692 0.000) 9.692 17.294 ( 0.000 -5.151 -0.000) 5.151 19.677 ( 0.000 -0.913 -0.000) 0.913 19.797 ( 0.000 -6.111 0.000) 6.111 20.354 ( 0.000 8.864 -0.000) 8.864 20.375 ( 0.000 6.654 0.000) 6.654 21.178 ( 0.000 -12.420 0.000) 12.420 21.343 ( 0.000 -12.421 -0.000) 12.421 21.807 ( -0.000 0.239 0.000) 0.239 21.873 ( 0.000 0.031 -0.000) 0.031 22.643 ( 0.000 -3.882 -0.000) 3.882 22.687 ( -0.000 -13.002 0.000) 13.002 23.648 ( 0.000 4.756 -0.000) 4.756 23.728 ( 0.000 6.298 -0.000) 6.298 24.298 ( 0.000 2.894 -0.000) 2.894 24.509 ( 0.000 -4.098 0.000) 4.098 25.206 ( 0.000 11.809 0.000) 11.809 25.208 ( -0.000 9.969 -0.000) 9.969 ======================= Grid point 21 (13/104) ======================= q-point: ( 0.00 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.670 ( 0.000 19.845 0.000) 19.845 1.831 ( 0.000 25.098 0.000) 25.098 2.015 ( 0.000 -12.296 0.000) 12.296 2.249 ( 0.000 -9.371 0.000) 9.371 2.343 ( 0.000 0.441 0.000) 0.441 2.358 ( 0.000 -3.632 0.000) 3.632 2.763 ( 0.000 5.653 0.000) 5.653 2.861 ( 0.000 -4.006 0.000) 4.006 3.135 ( 0.000 7.206 0.000) 7.206 3.163 ( 0.000 1.433 0.000) 1.433 3.233 ( 0.000 8.077 0.000) 8.077 3.397 ( 0.000 -4.078 0.000) 4.078 3.483 ( 0.000 1.805 0.000) 1.805 3.490 ( 0.000 1.333 0.000) 1.333 3.499 ( 0.000 3.017 0.000) 3.017 3.618 ( 0.000 26.860 0.000) 26.860 3.631 ( 0.000 -11.084 0.000) 11.084 4.117 ( 0.000 -10.179 0.000) 10.179 4.210 ( 0.000 3.893 0.000) 3.893 4.316 ( 0.000 -12.251 0.000) 12.251 4.482 ( 0.000 6.565 0.000) 6.565 4.491 ( 0.000 1.561 0.000) 1.561 4.528 ( 0.000 2.100 0.000) 2.100 4.667 ( 0.000 -5.210 0.000) 5.210 4.987 ( 0.000 11.611 0.000) 11.611 5.043 ( 0.000 3.339 0.000) 3.339 5.216 ( 0.000 -4.439 0.000) 4.439 5.318 ( 0.000 -11.379 0.000) 11.379 5.424 ( 0.000 4.055 0.000) 4.055 5.502 ( 0.000 -4.201 0.000) 4.201 5.779 ( 0.000 12.025 0.000) 12.025 5.962 ( 0.000 -4.912 0.000) 4.912 6.349 ( 0.000 -1.140 0.000) 1.140 6.350 ( 0.000 -1.279 0.000) 1.279 6.498 ( 0.000 0.052 0.000) 0.052 6.504 ( 0.000 2.302 0.000) 2.302 6.661 ( 0.000 5.546 0.000) 5.546 6.822 ( 0.000 -5.649 0.000) 5.649 7.094 ( 0.000 -5.597 0.000) 5.597 7.150 ( 0.000 -9.378 0.000) 9.378 8.058 ( 0.000 4.181 0.000) 4.181 8.095 ( 0.000 1.343 0.000) 1.343 8.315 ( 0.000 1.851 0.000) 1.851 8.319 ( 0.000 1.551 0.000) 1.551 8.494 ( 0.000 -1.023 0.000) 1.023 8.537 ( 0.000 -5.198 0.000) 5.198 8.758 ( 0.000 2.930 0.000) 2.930 8.817 ( 0.000 -3.040 0.000) 3.040 9.149 ( 0.000 2.155 0.000) 2.155 9.230 ( 0.000 -5.137 0.000) 5.137 9.939 ( 0.000 4.097 0.000) 4.097 10.003 ( 0.000 -1.817 0.000) 1.817 10.270 ( 0.000 16.920 0.000) 16.920 10.589 ( 0.000 -11.764 0.000) 11.764 10.852 ( 0.000 0.439 0.000) 0.439 10.884 ( 0.000 -2.049 0.000) 2.049 11.076 ( 0.000 0.542 0.000) 0.542 11.124 ( 0.000 -4.580 0.000) 4.580 11.358 ( 0.000 3.143 0.000) 3.143 11.452 ( 0.000 -5.487 0.000) 5.487 11.682 ( 0.000 2.671 0.000) 2.671 11.740 ( 0.000 -2.172 0.000) 2.172 11.925 ( 0.000 4.374 0.000) 4.374 12.071 ( 0.000 -8.308 0.000) 8.308 12.783 ( 0.000 3.965 0.000) 3.965 12.792 ( 0.000 2.826 0.000) 2.826 12.899 ( 0.000 -3.451 0.000) 3.451 12.903 ( 0.000 -4.872 0.000) 4.872 13.516 ( 0.000 0.041 0.000) 0.041 13.531 ( 0.000 -1.399 0.000) 1.399 14.081 ( 0.000 2.802 0.000) 2.802 14.160 ( 0.000 -3.875 0.000) 3.875 14.664 ( 0.000 7.361 0.000) 7.361 14.800 ( 0.000 -4.953 0.000) 4.953 15.776 ( 0.000 5.695 0.000) 5.695 15.829 ( 0.000 0.554 0.000) 0.554 15.990 ( 0.000 2.281 0.000) 2.281 16.041 ( 0.000 -1.716 0.000) 1.716 16.842 ( 0.000 5.758 0.000) 5.758 16.974 ( 0.000 -6.547 0.000) 6.547 19.689 ( 0.000 0.720 0.000) 0.720 19.728 ( 0.000 -2.833 0.000) 2.833 20.482 ( 0.000 5.308 0.000) 5.308 20.500 ( 0.000 4.427 0.000) 4.427 20.990 ( 0.000 1.427 0.000) 1.427 21.124 ( 0.000 -10.402 0.000) 10.402 21.809 ( 0.000 2.621 0.000) 2.621 21.861 ( 0.000 -2.089 0.000) 2.089 22.547 ( 0.000 2.812 0.000) 2.812 22.658 ( 0.000 -7.211 0.000) 7.211 23.739 ( 0.000 3.670 0.000) 3.670 23.782 ( 0.000 -0.101 0.000) 0.101 24.394 ( 0.000 -0.425 0.000) 0.425 24.418 ( 0.000 -2.933 0.000) 2.933 25.383 ( 0.000 5.865 0.000) 5.865 25.454 ( 0.000 -0.620 0.000) 0.620 ======================= Grid point 22 (14/104) ======================= q-point: ( 0.17 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.684 ( -1.875 19.693 4.651) 20.321 1.734 ( -4.625 23.430 -4.610) 24.323 2.019 ( -1.470 -11.048 3.600) 11.713 2.159 ( -8.054 -14.090 -3.828) 16.675 2.342 ( -0.240 0.299 -0.137) 0.407 2.347 ( 0.470 -0.082 -1.809) 1.870 2.744 ( -2.092 5.310 -0.104) 5.708 2.820 ( -4.386 -1.842 -1.706) 5.054 3.113 ( -1.670 7.059 -1.062) 7.331 3.164 ( -2.433 7.850 -1.123) 8.295 3.242 ( 1.406 -3.365 1.440) 3.920 3.316 ( -6.179 -5.849 -3.166) 9.078 3.445 ( -2.436 3.784 6.303) 7.745 3.477 ( -1.028 3.334 -4.429) 5.638 3.565 ( 2.934 -4.201 -6.522) 8.294 3.576 ( -4.710 -9.019 3.469) 10.750 3.710 ( 9.801 29.621 3.778) 31.428 4.144 ( 2.327 -3.450 0.687) 4.217 4.219 ( 0.087 1.743 -2.190) 2.801 4.249 ( -4.549 5.305 -1.003) 7.060 4.426 ( -1.590 -0.631 5.159) 5.435 4.524 ( 1.612 -2.926 3.656) 4.953 4.575 ( 0.650 -3.161 0.400) 3.251 4.654 ( -0.240 -5.019 0.787) 5.086 5.053 ( 2.288 3.580 1.154) 4.402 5.128 ( 7.380 2.062 2.612) 8.095 5.220 ( 4.507 2.226 -2.494) 5.611 5.314 ( -3.553 -0.971 -0.816) 3.773 5.418 ( 0.602 -0.431 1.221) 1.428 5.492 ( 1.618 -6.871 -0.540) 7.080 5.755 ( -2.499 10.824 0.487) 11.119 5.937 ( -2.238 -5.751 -1.879) 6.451 6.345 ( -0.572 -0.703 1.671) 1.901 6.357 ( 0.422 -1.888 -1.436) 2.409 6.464 ( -1.984 6.135 -0.059) 6.448 6.579 ( 1.557 -5.854 -1.307) 6.197 6.675 ( 4.422 5.556 0.019) 7.101 6.793 ( -2.121 -5.312 0.328) 5.729 7.028 ( -5.449 -2.581 -2.416) 6.495 7.125 ( -2.944 -9.490 0.318) 9.942 8.038 ( -1.772 2.354 -1.152) 3.164 8.051 ( -3.766 1.560 -0.715) 4.138 8.243 ( -3.849 4.780 -0.124) 6.138 8.365 ( -2.349 -6.032 -1.122) 6.569 8.503 ( 3.237 2.516 0.477) 4.128 8.563 ( 4.052 -2.491 1.314) 4.935 8.764 ( 0.996 3.743 -1.592) 4.188 8.855 ( 3.025 -4.967 -2.434) 6.305 9.150 ( -0.341 1.918 2.332) 3.038 9.219 ( -1.449 -4.177 1.091) 4.554 9.939 ( 0.619 3.795 -2.970) 4.858 9.999 ( -0.233 -1.680 0.433) 1.751 10.287 ( 1.102 14.857 3.024) 15.201 10.553 ( -3.413 -9.122 2.217) 9.989 10.843 ( -0.506 0.888 -0.786) 1.290 10.883 ( -0.099 -3.323 -0.220) 3.331 11.083 ( 0.427 2.650 -1.982) 3.337 11.178 ( 5.174 -5.737 -1.264) 7.828 11.437 ( 6.688 1.932 2.980) 7.572 11.473 ( 2.937 -1.496 -0.172) 3.300 11.677 ( -0.626 2.632 3.152) 4.153 11.758 ( 1.262 -4.682 3.805) 6.164 11.920 ( -0.386 3.338 1.450) 3.660 12.036 ( -3.147 -7.397 -2.211) 8.337 12.557 ( -12.435 1.558 -2.316) 12.744 12.628 ( -13.748 -4.937 -1.365) 14.671 13.019 ( 10.056 4.418 0.749) 11.009 13.103 ( 8.264 -2.669 -0.047) 8.684 13.530 ( 1.929 1.725 0.013) 2.588 13.590 ( 5.561 -4.044 -0.040) 6.876 14.047 ( -2.766 2.251 -2.723) 4.487 14.112 ( -3.824 -2.976 -4.351) 6.512 14.714 ( 3.740 6.081 4.319) 8.343 14.826 ( 2.440 -4.156 0.983) 4.918 15.773 ( -1.053 2.889 4.392) 5.361 15.809 ( -1.501 0.812 -1.372) 2.190 16.005 ( 1.578 3.154 0.149) 3.530 16.055 ( 1.715 0.023 -3.677) 4.057 16.845 ( 0.278 7.268 0.111) 7.274 17.010 ( 3.386 -8.054 1.119) 8.808 19.684 ( -0.469 0.666 0.460) 0.935 19.722 ( -0.590 -2.790 0.159) 2.856 20.486 ( 0.366 5.596 1.119) 5.719 20.507 ( 0.772 4.163 -1.007) 4.352 20.994 ( 0.402 0.525 0.314) 0.732 21.118 ( -0.564 -10.306 -0.478) 10.333 21.811 ( 0.225 2.404 0.009) 2.415 21.861 ( 0.008 -2.069 -0.428) 2.113 22.540 ( -0.646 2.080 -0.209) 2.188 22.637 ( -2.024 -6.737 -0.315) 7.042 23.739 ( 0.114 3.706 -0.299) 3.720 23.784 ( 0.167 -0.143 -0.021) 0.221 24.380 ( -1.095 0.533 -0.874) 1.499 24.420 ( -0.060 -3.347 1.071) 3.515 25.377 ( -0.598 5.567 0.136) 5.601 25.433 ( -1.924 0.549 -0.173) 2.009 ======================= Grid point 23 (15/104) ======================= q-point: ( 0.33 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.591 ( -2.383 16.151 2.465) 16.511 1.761 ( 2.789 17.616 -2.251) 17.977 1.875 ( -12.304 -8.378 2.479) 15.091 2.086 ( 0.145 -10.736 -2.731) 11.079 2.363 ( 2.631 -0.094 0.390) 2.662 2.365 ( 2.211 -0.376 -2.419) 3.299 2.676 ( -5.879 2.620 0.093) 6.437 2.691 ( -7.958 1.308 -3.265) 8.700 2.998 ( -7.719 10.442 -1.122) 13.034 3.157 ( 1.940 6.043 -0.423) 6.361 3.203 ( -3.549 -7.415 -0.285) 8.226 3.302 ( 1.999 -8.264 0.257) 8.506 3.379 ( -4.145 1.772 4.815) 6.596 3.462 ( -1.135 -0.101 -2.474) 2.724 3.506 ( -1.675 -3.321 1.450) 3.992 3.576 ( -0.436 -5.618 -2.626) 6.217 3.956 ( 14.072 25.796 0.987) 29.401 4.123 ( -3.489 9.215 -1.270) 9.935 4.210 ( 0.669 14.293 3.494) 14.729 4.233 ( -0.318 3.680 -1.911) 4.159 4.432 ( 0.264 -3.902 2.597) 4.695 4.511 ( -2.526 -0.103 -0.837) 2.663 4.594 ( 0.849 -9.645 7.593) 12.305 4.653 ( -0.392 -10.635 -4.520) 11.562 5.114 ( 3.964 1.609 1.837) 4.656 5.183 ( 0.583 -4.121 3.419) 5.386 5.221 ( -3.624 6.589 -2.674) 7.981 5.374 ( 0.875 -6.466 -0.258) 6.530 5.425 ( 7.670 10.513 0.348) 13.018 5.602 ( 6.511 -2.489 0.256) 6.976 5.700 ( -3.120 7.074 1.238) 7.830 5.887 ( -2.184 -8.748 -1.596) 9.157 6.336 ( -0.730 -0.144 1.383) 1.570 6.359 ( 0.168 -2.293 -0.883) 2.463 6.394 ( -4.399 4.564 -1.286) 6.468 6.523 ( -5.100 -7.475 -1.693) 9.206 6.777 ( 1.936 0.262 0.885) 2.145 6.815 ( 5.496 -3.757 -0.357) 6.667 6.930 ( -2.938 2.284 -2.381) 4.418 7.057 ( -4.132 -7.460 0.331) 8.534 7.968 ( -3.919 3.553 -0.676) 5.333 8.010 ( -1.472 -0.623 -0.097) 1.601 8.171 ( -3.151 3.388 -1.250) 4.793 8.284 ( -3.835 -6.714 -1.325) 7.845 8.585 ( 4.008 5.276 1.793) 6.864 8.678 ( 6.703 -2.220 1.443) 7.207 8.779 ( 0.951 3.011 -1.624) 3.551 8.878 ( -0.306 -5.912 -3.527) 6.891 9.146 ( -0.423 1.105 2.172) 2.473 9.186 ( -2.107 -2.373 1.125) 3.367 9.951 ( 1.302 3.484 -3.144) 4.870 10.006 ( 0.805 -1.402 0.657) 1.746 10.313 ( 0.766 10.952 2.837) 11.340 10.501 ( -2.465 -5.920 2.589) 6.915 10.829 ( -0.511 1.840 -0.317) 1.936 10.888 ( 0.147 -4.881 -0.446) 4.904 11.071 ( -0.674 7.350 -1.270) 7.489 11.268 ( 4.081 -8.779 -2.339) 9.960 11.536 ( 4.522 6.102 -0.383) 7.605 11.585 ( 6.025 1.000 2.176) 6.484 11.692 ( 0.657 1.625 7.847) 8.041 11.790 ( 1.551 -4.987 2.241) 5.683 11.939 ( 1.985 -3.490 1.670) 4.348 11.965 ( -2.937 -6.077 -3.360) 7.540 12.328 ( -10.717 0.675 -3.816) 11.396 12.399 ( -10.504 -5.780 -0.486) 11.999 13.157 ( 4.664 3.312 0.123) 5.722 13.200 ( 2.843 -0.132 -0.390) 2.873 13.580 ( 2.845 4.269 0.260) 5.137 13.702 ( 5.482 -6.916 0.267) 8.829 13.990 ( -2.252 1.108 -2.331) 3.425 14.030 ( -3.298 -1.759 -3.783) 5.318 14.780 ( 1.819 5.728 3.295) 6.853 14.881 ( 2.774 -4.066 0.736) 4.977 15.746 ( -1.954 2.310 0.731) 3.113 15.799 ( 0.120 -2.277 2.568) 3.434 16.036 ( 1.579 4.747 -1.795) 5.316 16.078 ( 1.386 1.754 -1.875) 2.917 16.850 ( 0.249 10.517 0.118) 10.521 17.079 ( 3.114 -10.392 1.034) 10.898 19.676 ( -0.469 0.562 0.501) 0.887 19.710 ( -0.606 -2.736 0.104) 2.804 20.500 ( 0.680 5.638 1.588) 5.897 20.517 ( 0.471 4.326 -1.484) 4.598 21.005 ( 0.634 -1.568 0.471) 1.756 21.103 ( -0.766 -9.970 -0.623) 10.018 21.817 ( 0.413 1.736 0.135) 1.789 21.858 ( -0.196 -1.829 -0.557) 1.922 22.530 ( -0.119 0.075 -0.175) 0.224 22.591 ( -2.555 -5.219 -0.332) 5.821 23.742 ( 0.160 3.738 -0.277) 3.752 23.787 ( 0.131 -0.127 -0.048) 0.189 24.359 ( -0.881 1.971 -0.470) 2.210 24.420 ( -0.203 -3.800 0.695) 3.868 25.367 ( -0.445 4.903 0.246) 4.929 25.395 ( -1.837 2.564 -0.269) 3.165 ======================= Grid point 24 (16/104) ======================= q-point: (-0.50 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 91 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.631 ( 0.000 4.997 -0.000) 4.997 1.688 ( -0.000 0.543 -0.000) 0.543 1.800 ( 0.000 16.348 0.000) 16.348 2.086 ( 0.000 -8.420 -0.000) 8.420 2.397 ( 0.000 -0.893 -0.000) 0.893 2.412 ( -0.000 -2.190 0.000) 2.190 2.572 ( 0.000 2.240 -0.000) 2.240 2.598 ( 0.000 1.300 -0.000) 1.300 2.922 ( 0.000 12.655 -0.000) 12.655 3.167 ( 0.000 -6.348 -0.000) 6.348 3.192 ( -0.000 2.652 0.000) 2.652 3.295 ( 0.000 -6.090 0.000) 6.090 3.362 ( 0.000 0.899 -0.000) 0.899 3.451 ( 0.000 -5.313 0.000) 5.313 3.492 ( -0.000 1.240 -0.000) 1.240 3.565 ( 0.000 -5.853 0.000) 5.853 4.085 ( 0.000 10.885 0.000) 10.885 4.134 ( -0.000 10.045 -0.000) 10.045 4.200 ( 0.000 20.216 -0.000) 20.216 4.224 ( 0.000 17.143 0.000) 17.143 4.431 ( 0.000 -3.721 -0.000) 3.721 4.485 ( 0.000 1.180 0.000) 1.180 4.615 ( 0.000 -7.194 -0.000) 7.194 4.631 ( 0.000 -16.231 0.000) 16.231 5.152 ( 0.000 0.146 -0.000) 0.146 5.194 ( -0.000 -3.211 0.000) 3.211 5.198 ( -0.000 7.146 -0.000) 7.146 5.355 ( 0.000 -8.604 0.000) 8.604 5.555 ( 0.000 14.672 -0.000) 14.672 5.609 ( -0.000 6.502 0.000) 6.502 5.702 ( 0.000 -1.196 0.000) 1.196 5.863 ( 0.000 -13.132 0.000) 13.132 6.335 ( -0.000 3.070 -0.000) 3.070 6.335 ( 0.000 -0.225 0.000) 0.225 6.364 ( 0.000 -2.598 0.000) 2.598 6.460 ( 0.000 -8.160 0.000) 8.160 6.797 ( -0.000 0.337 0.000) 0.337 6.838 ( 0.000 -3.953 0.000) 3.953 6.971 ( -0.000 -1.314 0.000) 1.314 6.979 ( 0.000 -1.912 -0.000) 1.912 7.926 ( -0.000 4.709 0.000) 4.709 7.995 ( 0.000 -1.946 -0.000) 1.946 8.139 ( 0.000 2.610 -0.000) 2.610 8.246 ( 0.000 -6.801 0.000) 6.801 8.630 ( 0.000 7.343 0.000) 7.343 8.753 ( 0.000 1.648 -0.000) 1.648 8.816 ( -0.000 -6.015 -0.000) 6.015 8.830 ( -0.000 -2.187 0.000) 2.187 9.152 ( 0.000 -0.382 -0.000) 0.382 9.159 ( -0.000 -0.845 0.000) 0.845 9.961 ( 0.000 3.519 -0.000) 3.519 10.018 ( 0.000 -1.245 0.000) 1.245 10.324 ( 0.000 8.930 -0.000) 8.930 10.481 ( 0.000 -4.629 0.000) 4.629 10.825 ( 0.000 1.944 0.000) 1.944 10.885 ( 0.000 -4.545 -0.000) 4.545 11.063 ( 0.000 8.900 -0.000) 8.900 11.303 ( 0.000 -10.462 0.000) 10.462 11.587 ( -0.000 10.249 0.000) 10.249 11.647 ( 0.000 3.711 0.000) 3.711 11.706 ( 0.000 0.713 0.000) 0.713 11.827 ( 0.000 -9.225 -0.000) 9.225 11.949 ( -0.000 -5.567 0.000) 5.567 11.949 ( 0.000 -5.531 -0.000) 5.531 12.221 ( 0.000 -0.326 -0.000) 0.326 12.272 ( -0.000 -5.311 0.000) 5.311 13.198 ( 0.000 2.547 -0.000) 2.547 13.223 ( -0.000 0.711 0.000) 0.711 13.611 ( 0.000 5.502 0.000) 5.502 13.758 ( 0.000 -7.777 0.000) 7.777 13.965 ( 0.000 0.495 0.000) 0.495 13.992 ( 0.000 -1.170 -0.000) 1.170 14.799 ( 0.000 6.262 0.000) 6.262 14.910 ( 0.000 -4.626 0.000) 4.626 15.727 ( 0.000 3.292 0.000) 3.292 15.806 ( 0.000 -4.776 -0.000) 4.776 16.048 ( 0.000 5.963 0.000) 5.963 16.090 ( -0.000 1.712 -0.000) 1.712 16.853 ( 0.000 12.269 -0.000) 12.269 17.111 ( 0.000 -11.286 -0.000) 11.286 19.672 ( 0.000 0.518 -0.000) 0.518 19.704 ( 0.000 -2.730 0.000) 2.730 20.514 ( 0.000 5.118 0.000) 5.118 20.515 ( -0.000 5.030 -0.000) 5.030 21.013 ( 0.000 -2.824 0.000) 2.824 21.093 ( 0.000 -9.667 -0.000) 9.667 21.823 ( -0.000 1.195 0.000) 1.195 21.854 ( 0.000 -1.522 -0.000) 1.522 22.534 ( 0.000 -2.006 0.000) 2.006 22.559 ( -0.000 -3.364 -0.000) 3.364 23.743 ( 0.000 3.736 -0.000) 3.736 23.788 ( 0.000 -0.072 0.000) 0.072 24.350 ( 0.000 2.561 -0.000) 2.561 24.418 ( 0.000 -3.949 0.000) 3.949 25.365 ( 0.000 4.298 0.000) 4.298 25.375 ( -0.000 3.681 -0.000) 3.681 ======================= Grid point 49 (17/104) ======================= q-point: ( 0.00 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.393 ( 11.768 0.000 23.980) 26.712 0.571 ( 1.109 0.000 29.379) 29.400 0.921 ( -0.150 0.000 45.463) 45.463 2.009 ( 0.999 0.000 -6.480) 6.557 2.201 ( -3.941 0.000 22.897) 23.234 2.426 ( 0.354 0.000 3.322) 3.341 2.543 ( 0.183 0.000 -0.715) 0.738 2.643 ( -4.973 0.000 0.897) 5.053 2.729 ( -2.348 0.000 6.319) 6.741 2.874 ( 3.079 0.000 7.216) 7.846 2.989 ( -4.629 0.000 5.408) 7.119 3.270 ( 1.101 0.000 -7.889) 7.966 3.366 ( -2.086 0.000 -0.940) 2.288 3.470 ( 0.800 0.000 0.568) 0.981 3.639 ( 1.040 0.000 -4.277) 4.401 3.669 ( -6.583 0.000 -6.693) 9.388 3.954 ( 1.100 0.000 0.641) 1.273 3.972 ( -0.888 0.000 -3.160) 3.282 4.044 ( 1.405 0.000 4.005) 4.244 4.170 ( 5.148 0.000 8.032) 9.540 4.252 ( -1.823 0.000 -2.265) 2.908 4.545 ( -1.693 0.000 -3.280) 3.691 4.797 ( -4.875 0.000 -1.574) 5.123 4.876 ( 0.939 0.000 1.262) 1.573 4.935 ( 9.074 0.000 -3.349) 9.672 5.065 ( 4.053 0.000 7.296) 8.346 5.256 ( 2.265 0.000 -0.285) 2.283 5.358 ( -2.356 0.000 -7.351) 7.719 5.463 ( -2.215 0.000 6.475) 6.844 5.534 ( -0.701 0.000 -3.678) 3.744 5.897 ( -2.391 0.000 -0.569) 2.458 5.926 ( 4.672 0.000 3.253) 5.693 6.130 ( -1.899 0.000 0.265) 1.918 6.452 ( -5.506 0.000 -0.568) 5.535 6.608 ( 2.194 0.000 7.790) 8.093 6.691 ( -0.788 0.000 -1.761) 1.930 6.868 ( 2.587 0.000 -2.706) 3.744 7.000 ( -1.173 0.000 1.056) 1.579 7.050 ( 10.757 0.000 1.035) 10.806 7.218 ( 0.037 0.000 -0.396) 0.398 7.769 ( 0.376 0.000 -2.859) 2.884 7.974 ( 1.539 0.000 -3.816) 4.115 8.300 ( -2.302 0.000 1.542) 2.771 8.377 ( 1.174 0.000 -6.719) 6.821 8.662 ( -8.489 0.000 -4.402) 9.562 8.768 ( -4.291 0.000 6.586) 7.861 8.835 ( -5.764 0.000 -9.127) 10.795 9.029 ( 5.680 0.000 0.371) 5.692 9.087 ( -0.693 0.000 3.786) 3.849 9.298 ( -6.264 0.000 0.778) 6.312 9.763 ( 1.550 0.000 -0.807) 1.748 10.020 ( 5.007 0.000 -0.662) 5.050 10.612 ( 4.227 0.000 -2.984) 5.174 10.675 ( 0.873 0.000 -3.621) 3.725 10.942 ( -7.817 0.000 -2.499) 8.207 10.942 ( -34.621 0.000 -3.084) 34.758 11.022 ( -41.500 0.000 1.498) 41.527 11.094 ( -0.873 0.000 5.253) 5.325 11.404 ( -3.620 0.000 -8.153) 8.921 11.686 ( 11.232 0.000 -3.497) 11.764 11.817 ( 2.673 0.000 10.029) 10.379 11.855 ( -2.757 0.000 -11.163) 11.499 12.032 ( 2.039 0.000 -2.340) 3.104 12.494 ( 50.172 0.000 -3.364) 50.284 12.546 ( -2.922 0.000 10.621) 11.015 12.790 ( 8.209 0.000 -7.514) 11.129 12.808 ( -4.861 0.000 1.779) 5.176 13.107 ( 10.480 0.000 0.576) 10.496 13.436 ( 2.082 0.000 1.997) 2.886 13.794 ( -1.064 0.000 1.338) 1.709 13.822 ( -2.106 0.000 -1.791) 2.764 14.200 ( -10.564 0.000 -8.139) 13.336 14.644 ( -2.364 0.000 10.482) 10.745 14.647 ( -1.429 0.000 -1.840) 2.329 15.180 ( 13.492 0.000 -5.582) 14.601 15.202 ( 1.543 0.000 0.107) 1.546 15.943 ( 4.935 0.000 7.637) 9.093 16.259 ( 16.891 0.000 1.752) 16.982 16.446 ( -0.233 0.000 -0.659) 0.699 17.187 ( 0.271 0.000 -3.784) 3.794 19.797 ( 0.556 0.000 2.849) 2.902 20.097 ( -0.395 0.000 3.780) 3.801 20.120 ( -1.239 0.000 3.619) 3.825 20.508 ( -45.392 0.000 5.822) 45.764 21.764 ( 3.930 0.000 -1.528) 4.216 21.812 ( -0.350 0.000 8.589) 8.597 21.832 ( -1.694 0.000 7.648) 7.833 22.579 ( 0.112 0.000 -0.612) 0.622 22.640 ( -13.204 0.000 -2.377) 13.416 22.766 ( 44.035 0.000 -1.948) 44.078 23.210 ( 2.701 0.000 6.777) 7.296 23.499 ( -0.424 0.000 -0.161) 0.454 24.079 ( 0.852 0.000 -0.676) 1.088 24.502 ( -0.340 0.000 -1.020) 1.075 24.757 ( 0.620 0.000 -5.360) 5.396 25.021 ( 6.095 0.000 -5.320) 8.090 ======================= Grid point 50 (18/104) ======================= q-point: ( 0.17 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.817 ( 14.534 0.000 24.085) 28.130 0.853 ( 18.818 0.000 22.274) 29.159 1.233 ( 24.180 0.000 29.618) 38.235 2.027 ( 2.177 0.000 -4.670) 5.153 2.169 ( -3.800 0.000 23.934) 24.234 2.404 ( -4.137 0.000 0.959) 4.247 2.487 ( -10.163 0.000 2.400) 10.442 2.538 ( -0.605 0.000 0.036) 0.606 2.675 ( -4.549 0.000 13.553) 14.296 2.896 ( -2.471 0.000 6.306) 6.773 2.904 ( -5.022 0.000 -0.462) 5.043 3.141 ( -17.255 0.000 -6.739) 18.524 3.292 ( 2.930 0.000 -6.376) 7.016 3.491 ( 1.098 0.000 2.570) 2.795 3.623 ( -1.378 0.000 -4.580) 4.783 3.679 ( 6.235 0.000 1.607) 6.439 3.903 ( -4.704 0.000 1.320) 4.885 3.939 ( -2.117 0.000 -1.628) 2.670 4.061 ( 2.357 0.000 1.497) 2.792 4.119 ( -10.324 0.000 -5.067) 11.501 4.368 ( 5.611 0.000 3.885) 6.825 4.389 ( -9.965 0.000 -5.760) 11.510 4.725 ( -0.244 0.000 1.860) 1.876 4.901 ( 0.371 0.000 0.490) 0.614 5.013 ( -0.969 0.000 4.926) 5.020 5.123 ( -1.418 0.000 5.515) 5.694 5.337 ( 2.982 0.000 -5.338) 6.114 5.337 ( 3.104 0.000 -1.533) 3.462 5.435 ( -6.517 0.000 -5.226) 8.353 5.469 ( 2.780 0.000 -3.241) 4.270 5.917 ( 3.096 0.000 -5.192) 6.045 6.084 ( 9.830 0.000 5.553) 11.290 6.161 ( 4.925 0.000 -2.288) 5.431 6.419 ( 1.731 0.000 -0.832) 1.921 6.653 ( 0.586 0.000 10.022) 10.039 6.694 ( 1.994 0.000 -1.603) 2.558 6.888 ( -0.040 0.000 -2.707) 2.707 6.960 ( -3.298 0.000 0.005) 3.298 7.117 ( -4.934 0.000 4.579) 6.732 7.180 ( -4.170 0.000 -0.870) 4.260 7.810 ( 5.027 0.000 -5.107) 7.166 7.862 ( -9.606 0.000 -1.772) 9.768 8.293 ( -6.402 0.000 5.266) 8.290 8.379 ( 7.198 0.000 -1.249) 7.305 8.478 ( -2.788 0.000 -2.845) 3.984 8.720 ( -2.684 0.000 -7.738) 8.190 8.771 ( 0.389 0.000 3.295) 3.318 9.070 ( -2.628 0.000 2.440) 3.586 9.124 ( 4.335 0.000 -0.546) 4.369 9.186 ( -3.989 0.000 -0.636) 4.039 9.808 ( 2.477 0.000 1.116) 2.717 10.021 ( -23.722 0.000 21.522) 32.030 10.075 ( 0.460 0.000 3.454) 3.485 10.697 ( 4.373 0.000 -0.164) 4.377 10.698 ( -0.587 0.000 -1.440) 1.555 10.811 ( -5.232 0.000 -2.224) 5.685 10.927 ( -2.395 0.000 -2.015) 3.130 11.148 ( 6.314 0.000 -3.166) 7.063 11.371 ( 0.967 0.000 -5.970) 6.047 11.755 ( -2.400 0.000 -4.089) 4.741 11.902 ( 7.422 0.000 0.267) 7.427 11.944 ( 7.325 0.000 7.597) 10.553 12.088 ( 6.058 0.000 -5.845) 8.418 12.456 ( -9.002 0.000 7.702) 11.848 12.548 ( -2.961 0.000 -10.172) 10.595 12.704 ( -5.866 0.000 0.496) 5.887 13.032 ( 2.425 0.000 -6.880) 7.295 13.485 ( 2.065 0.000 2.934) 3.587 13.648 ( 17.189 0.000 -13.643) 21.945 13.713 ( -1.203 0.000 -3.262) 3.476 13.803 ( 1.657 0.000 1.016) 1.943 14.114 ( 2.082 0.000 -4.980) 5.398 14.608 ( -2.073 0.000 -1.275) 2.434 14.688 ( 0.386 0.000 15.847) 15.852 15.239 ( 2.154 0.000 -0.369) 2.185 15.290 ( 3.455 0.000 -13.511) 13.945 15.996 ( -0.165 0.000 10.592) 10.593 16.429 ( -1.350 0.000 -0.643) 1.495 16.518 ( 6.013 0.000 -13.451) 14.734 17.188 ( 0.877 0.000 -3.878) 3.976 19.805 ( -0.654 0.000 3.588) 3.647 19.977 ( -6.244 0.000 6.417) 8.953 20.111 ( -0.472 0.000 3.101) 3.136 20.214 ( 0.445 0.000 14.038) 14.045 21.780 ( -0.199 0.000 -0.312) 0.370 21.817 ( -1.964 0.000 8.297) 8.526 21.826 ( -0.339 0.000 7.750) 7.758 22.367 ( -11.291 0.000 8.968) 14.419 22.581 ( 0.274 0.000 -0.649) 0.704 23.142 ( 4.611 0.000 -4.285) 6.295 23.358 ( 6.274 0.000 -6.195) 8.817 23.489 ( -0.469 0.000 -0.118) 0.483 24.100 ( 1.429 0.000 -0.391) 1.481 24.486 ( -0.962 0.000 -1.380) 1.682 24.757 ( 0.932 0.000 -5.595) 5.672 24.999 ( -4.028 0.000 -2.617) 4.804 ======================= Grid point 51 (19/104) ======================= q-point: ( 0.33 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.034 ( 3.144 0.000 30.026) 30.190 1.283 ( 21.853 0.000 14.939) 26.471 1.678 ( 12.448 0.000 9.053) 15.392 1.992 ( -10.684 0.000 3.520) 11.249 2.279 ( -1.292 0.000 -5.375) 5.528 2.310 ( 15.262 0.000 27.307) 31.282 2.394 ( -2.252 0.000 0.787) 2.385 2.524 ( -0.637 0.000 -0.931) 1.128 2.642 ( -2.047 0.000 15.044) 15.183 2.752 ( -12.870 0.000 -4.080) 13.501 2.807 ( -12.517 0.000 2.698) 12.804 2.861 ( -5.877 0.000 -0.424) 5.892 3.322 ( 1.051 0.000 -5.443) 5.544 3.499 ( -0.688 0.000 2.026) 2.140 3.584 ( -0.940 0.000 -3.496) 3.620 3.733 ( -2.728 0.000 6.162) 6.739 3.782 ( -13.159 0.000 -0.007) 13.159 3.894 ( 1.855 0.000 0.475) 1.915 4.019 ( 2.154 0.000 -6.990) 7.315 4.134 ( 7.176 0.000 -1.953) 7.437 4.223 ( -6.228 0.000 -5.139) 8.075 4.371 ( -2.656 0.000 1.640) 3.121 4.806 ( 6.085 0.000 4.193) 7.390 4.898 ( -0.386 0.000 -0.608) 0.720 4.993 ( -2.622 0.000 8.052) 8.468 5.070 ( -3.464 0.000 1.019) 3.611 5.204 ( -11.590 0.000 -0.516) 11.601 5.288 ( -4.498 0.000 3.093) 5.459 5.497 ( 7.726 0.000 -5.667) 9.582 5.581 ( 7.751 0.000 -11.345) 13.741 5.925 ( -0.741 0.000 -4.484) 4.545 6.205 ( 2.240 0.000 1.398) 2.641 6.337 ( 13.123 0.000 -1.124) 13.171 6.479 ( 3.483 0.000 -0.006) 3.483 6.683 ( -0.380 0.000 12.341) 12.347 6.769 ( 6.146 0.000 0.213) 6.150 6.853 ( -2.096 0.000 -2.389) 3.178 6.872 ( -6.546 0.000 0.823) 6.598 7.012 ( -6.312 0.000 10.076) 11.890 7.066 ( -7.089 0.000 -2.011) 7.368 7.693 ( -7.235 0.000 -1.389) 7.367 7.903 ( 6.040 0.000 -10.435) 12.057 8.285 ( 2.601 0.000 -0.185) 2.608 8.453 ( 0.180 0.000 -2.627) 2.633 8.482 ( 4.597 0.000 -3.328) 5.675 8.732 ( 4.937 0.000 -3.389) 5.988 8.769 ( -1.622 0.000 4.798) 5.065 8.986 ( -6.592 0.000 0.126) 6.593 9.148 ( -0.256 0.000 -2.142) 2.157 9.191 ( 3.196 0.000 -1.327) 3.460 9.817 ( -2.803 0.000 10.747) 11.107 9.877 ( -0.338 0.000 3.100) 3.118 10.056 ( -3.579 0.000 4.805) 5.991 10.665 ( -2.258 0.000 -2.239) 3.180 10.727 ( -2.966 0.000 -0.576) 3.022 10.763 ( 2.398 0.000 0.098) 2.400 10.901 ( -0.020 0.000 -1.118) 1.118 11.289 ( 9.454 0.000 -9.782) 13.604 11.397 ( 2.725 0.000 -2.213) 3.510 11.730 ( 0.890 0.000 -2.830) 2.967 11.945 ( -1.642 0.000 -1.262) 2.071 12.055 ( 1.438 0.000 2.138) 2.576 12.210 ( -0.441 0.000 -1.379) 1.448 12.291 ( -3.091 0.000 2.602) 4.040 12.510 ( 2.723 0.000 -11.850) 12.159 12.636 ( -1.272 0.000 5.033) 5.192 13.010 ( -3.057 0.000 -3.163) 4.399 13.512 ( 0.006 0.000 2.149) 2.149 13.574 ( -3.382 0.000 0.958) 3.516 13.850 ( 2.797 0.000 1.320) 3.093 13.888 ( 6.856 0.000 -11.666) 13.531 14.177 ( 4.716 0.000 -3.775) 6.041 14.573 ( -1.436 0.000 0.774) 1.631 14.702 ( -2.990 0.000 16.647) 16.913 15.270 ( 1.266 0.000 -2.220) 2.555 15.301 ( 1.803 0.000 -13.780) 13.898 16.011 ( -1.069 0.000 11.326) 11.377 16.402 ( -1.136 0.000 -0.326) 1.182 16.488 ( -3.592 0.000 -9.406) 10.069 17.198 ( 1.091 0.000 -3.732) 3.888 19.792 ( -1.614 0.000 3.761) 4.092 19.967 ( 1.792 0.000 0.289) 1.815 20.118 ( 0.303 0.000 3.074) 3.089 20.300 ( 4.434 0.000 15.084) 15.722 21.766 ( -1.088 0.000 -1.918) 2.205 21.802 ( -1.883 0.000 8.584) 8.788 21.837 ( -0.465 0.000 7.126) 7.141 22.235 ( -6.355 0.000 8.725) 10.795 22.584 ( 0.251 0.000 -0.690) 0.734 23.190 ( 2.239 0.000 -1.072) 2.482 23.363 ( -2.366 0.000 -4.428) 5.021 23.484 ( -0.106 0.000 0.363) 0.378 24.121 ( 0.767 0.000 -0.870) 1.160 24.468 ( -0.521 0.000 -1.286) 1.388 24.764 ( 1.208 0.000 -6.044) 6.163 24.929 ( -2.745 0.000 -2.458) 3.685 ======================= Grid point 52 (20/104) ======================= q-point: (-0.50 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.065 ( -7.496 0.000 28.809) 29.768 1.617 ( -13.927 0.000 7.849) 15.987 1.729 ( 8.206 0.000 8.255) 11.640 1.816 ( 3.476 0.000 9.507) 10.123 2.351 ( -27.693 0.000 1.230) 27.721 2.367 ( 4.047 0.000 -1.323) 4.257 2.374 ( 3.541 0.000 -4.598) 5.804 2.512 ( 0.448 0.000 -2.544) 2.583 2.569 ( 0.945 0.000 12.548) 12.583 2.604 ( -5.964 0.000 1.342) 6.113 2.838 ( 16.704 0.000 20.813) 26.687 2.847 ( 2.698 0.000 4.492) 5.241 3.308 ( -0.148 0.000 -5.669) 5.670 3.487 ( -0.830 0.000 1.287) 1.532 3.545 ( -2.831 0.000 -4.298) 5.147 3.664 ( 2.583 0.000 -0.557) 2.642 3.693 ( -2.273 0.000 4.261) 4.829 3.879 ( -2.314 0.000 -0.742) 2.431 4.077 ( 4.208 0.000 -7.035) 8.197 4.154 ( 1.267 0.000 -1.194) 1.740 4.273 ( 2.720 0.000 0.904) 2.866 4.350 ( 2.337 0.000 2.915) 3.736 4.884 ( -1.597 0.000 0.556) 1.691 4.920 ( 1.187 0.000 1.305) 1.764 4.963 ( -1.801 0.000 4.903) 5.224 5.004 ( -2.658 0.000 -1.790) 3.205 5.055 ( -0.429 0.000 4.175) 4.197 5.245 ( -0.682 0.000 2.344) 2.441 5.563 ( 0.509 0.000 -5.602) 5.626 5.644 ( 1.317 0.000 -11.749) 11.822 5.912 ( 1.333 0.000 -1.229) 1.813 6.188 ( -3.918 0.000 -2.431) 4.611 6.512 ( 0.188 0.000 0.173) 0.255 6.566 ( 9.721 0.000 -1.184) 9.793 6.696 ( -1.007 0.000 12.579) 12.619 6.707 ( -9.719 0.000 1.968) 9.917 6.840 ( 0.830 0.000 -1.938) 2.108 6.864 ( -0.275 0.000 0.732) 0.781 6.927 ( -5.862 0.000 7.337) 9.391 7.009 ( 5.114 0.000 0.531) 5.142 7.617 ( -0.138 0.000 -1.921) 1.926 7.955 ( 2.017 0.000 -11.372) 11.549 8.309 ( 0.114 0.000 -4.345) 4.346 8.503 ( 5.726 0.000 1.572) 5.938 8.562 ( 5.319 0.000 -2.219) 5.764 8.744 ( -2.056 0.000 5.788) 6.142 8.822 ( -2.612 0.000 3.669) 4.504 8.857 ( 0.141 0.000 -5.882) 5.883 9.159 ( 1.920 0.000 -0.824) 2.089 9.227 ( 0.857 0.000 -2.331) 2.483 9.816 ( -0.478 0.000 7.970) 7.984 9.894 ( 1.301 0.000 5.762) 5.907 9.974 ( -5.633 0.000 2.181) 6.040 10.622 ( -1.181 0.000 -3.566) 3.757 10.671 ( -2.699 0.000 -2.387) 3.603 10.827 ( 4.226 0.000 3.255) 5.334 10.915 ( 1.475 0.000 0.173) 1.486 11.405 ( 5.303 0.000 -12.485) 13.565 11.456 ( 3.625 0.000 1.285) 3.846 11.740 ( -3.467 0.000 1.110) 3.640 11.865 ( -3.358 0.000 -8.802) 9.421 11.981 ( -7.854 0.000 -6.806) 10.393 12.061 ( -5.084 0.000 -1.780) 5.386 12.376 ( 3.685 0.000 4.469) 5.792 12.586 ( 6.549 0.000 -8.758) 10.936 12.690 ( 4.445 0.000 9.602) 10.581 12.925 ( -4.229 0.000 -3.478) 5.476 13.496 ( -1.949 0.000 0.650) 2.055 13.582 ( 3.113 0.000 3.647) 4.795 13.892 ( 0.765 0.000 2.017) 2.157 13.921 ( 0.197 0.000 -12.498) 12.500 14.247 ( 3.371 0.000 -1.415) 3.656 14.567 ( 0.670 0.000 2.096) 2.200 14.679 ( -3.050 0.000 16.519) 16.798 15.269 ( -0.643 0.000 -3.592) 3.649 15.289 ( 0.352 0.000 -14.690) 14.694 16.006 ( -2.415 0.000 9.819) 10.111 16.385 ( -4.876 0.000 -9.121) 10.343 16.394 ( 0.342 0.000 -0.033) 0.343 17.206 ( 0.685 0.000 -3.495) 3.561 19.772 ( -1.293 0.000 3.221) 3.470 20.006 ( 2.081 0.000 -0.196) 2.090 20.132 ( 0.236 0.000 3.538) 3.546 20.451 ( 7.627 0.000 20.344) 21.727 21.724 ( -2.654 0.000 -5.785) 6.365 21.791 ( -1.486 0.000 8.858) 8.982 21.843 ( -0.650 0.000 6.704) 6.736 22.154 ( -5.006 0.000 7.823) 9.287 22.586 ( 0.056 0.000 -0.697) 0.699 23.222 ( 1.251 0.000 -0.947) 1.569 23.290 ( -3.797 0.000 -4.982) 6.264 23.487 ( 0.323 0.000 0.810) 0.872 24.119 ( -0.627 0.000 -1.718) 1.828 24.466 ( 0.684 0.000 -0.758) 1.021 24.770 ( 0.959 0.000 -6.295) 6.368 24.886 ( -1.238 0.000 -3.350) 3.571 ======================= Grid point 53 (21/104) ======================= q-point: (-0.33 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.931 ( -13.496 0.000 27.860) 30.957 1.175 ( -27.181 0.000 9.595) 28.825 1.598 ( -34.022 0.000 -0.243) 34.023 1.976 ( 7.345 0.000 3.074) 7.962 2.067 ( 0.956 0.000 21.956) 21.976 2.329 ( 0.081 0.000 -2.998) 2.999 2.506 ( 6.651 0.000 2.093) 6.972 2.521 ( 1.094 0.000 -2.422) 2.658 2.608 ( 0.977 0.000 12.215) 12.254 2.657 ( 7.194 0.000 4.680) 8.583 2.996 ( 12.934 0.000 1.652) 13.039 3.040 ( 1.034 0.000 10.346) 10.398 3.305 ( 0.398 0.000 -5.616) 5.630 3.477 ( -0.586 0.000 -0.150) 0.605 3.542 ( 3.266 0.000 -4.267) 5.374 3.672 ( -0.728 0.000 2.281) 2.394 3.796 ( 10.005 0.000 0.230) 10.007 3.846 ( -0.759 0.000 2.375) 2.494 4.110 ( 3.151 0.000 -5.175) 6.059 4.221 ( -5.775 0.000 -0.257) 5.780 4.295 ( 11.578 0.000 1.206) 11.641 4.401 ( -1.790 0.000 1.708) 2.474 4.833 ( -3.660 0.000 1.240) 3.864 4.842 ( -3.118 0.000 4.237) 5.261 4.953 ( -1.120 0.000 3.674) 3.841 5.010 ( -0.210 0.000 0.744) 0.773 5.196 ( 11.194 0.000 -0.852) 11.226 5.262 ( 1.729 0.000 -4.368) 4.698 5.516 ( -2.670 0.000 -3.879) 4.709 5.588 ( -3.744 0.000 -3.998) 5.478 5.962 ( 3.246 0.000 -2.885) 4.343 6.065 ( -7.845 0.000 -4.057) 8.832 6.448 ( -12.918 0.000 2.326) 13.126 6.512 ( 0.275 0.000 1.249) 1.279 6.725 ( 1.096 0.000 11.164) 11.217 6.726 ( 1.911 0.000 -2.613) 3.237 6.794 ( -7.626 0.000 2.772) 8.114 6.868 ( -0.060 0.000 -0.272) 0.278 6.890 ( 5.013 0.000 2.904) 5.793 7.133 ( 5.231 0.000 1.204) 5.368 7.681 ( 7.317 0.000 -2.564) 7.753 7.914 ( -3.693 0.000 -7.587) 8.438 8.305 ( 1.808 0.000 -7.768) 7.976 8.622 ( -5.854 0.000 1.564) 6.059 8.631 ( 5.799 0.000 3.142) 6.595 8.715 ( 3.289 0.000 -2.051) 3.877 8.739 ( 0.620 0.000 7.291) 7.317 8.940 ( 4.170 0.000 -1.799) 4.541 9.203 ( -3.038 0.000 -1.804) 3.534 9.218 ( 4.593 0.000 0.761) 4.655 9.807 ( -1.835 0.000 1.720) 2.515 9.896 ( -1.720 0.000 -2.232) 2.818 9.999 ( 8.373 0.000 23.228) 24.691 10.616 ( -2.437 0.000 -2.742) 3.668 10.616 ( 1.690 0.000 -3.778) 4.139 10.931 ( 5.361 0.000 5.792) 7.893 10.951 ( 2.070 0.000 0.986) 2.292 11.404 ( -3.829 0.000 -10.899) 11.552 11.529 ( 3.468 0.000 2.513) 4.283 11.558 ( -9.310 0.000 -0.873) 9.351 11.782 ( -10.397 0.000 -9.588) 14.144 11.870 ( 4.016 0.000 -14.857) 15.390 12.036 ( 0.330 0.000 0.779) 0.846 12.443 ( 2.661 0.000 8.119) 8.544 12.629 ( -1.207 0.000 -7.100) 7.202 12.800 ( 3.880 0.000 9.913) 10.645 12.890 ( 2.602 0.000 -7.105) 7.566 13.452 ( -2.568 0.000 -0.468) 2.610 13.669 ( 3.387 0.000 2.978) 4.510 13.828 ( -6.341 0.000 -16.704) 17.867 13.880 ( -2.431 0.000 2.293) 3.342 14.295 ( 2.178 0.000 0.177) 2.185 14.608 ( 2.738 0.000 2.043) 3.416 14.699 ( 1.425 0.000 16.966) 17.026 15.222 ( -4.300 0.000 -18.578) 19.069 15.233 ( -2.028 0.000 -3.528) 4.069 15.965 ( -3.974 0.000 4.488) 5.994 16.268 ( -5.702 0.000 -6.567) 8.697 16.412 ( 1.511 0.000 -0.098) 1.514 17.205 ( 0.072 0.000 -3.395) 3.396 19.765 ( -0.148 0.000 2.570) 2.574 20.041 ( 1.555 0.000 1.534) 2.184 20.140 ( -0.465 0.000 3.967) 3.994 20.707 ( 14.920 0.000 29.977) 33.484 21.629 ( -5.820 0.000 -13.701) 14.886 21.790 ( -0.958 0.000 9.047) 9.097 21.845 ( -0.918 0.000 6.704) 6.767 22.081 ( -5.031 0.000 8.765) 10.106 22.583 ( -0.105 0.000 -0.658) 0.667 23.203 ( -4.256 0.000 -6.808) 8.029 23.223 ( -0.954 0.000 -2.994) 3.142 23.497 ( 0.398 0.000 0.797) 0.891 24.096 ( -1.137 0.000 -1.989) 2.291 24.484 ( 1.206 0.000 -0.444) 1.286 24.767 ( 0.392 0.000 -6.010) 6.023 24.868 ( 0.369 0.000 -3.384) 3.404 ======================= Grid point 54 (22/104) ======================= q-point: (-0.17 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.668 ( -25.444 0.000 13.090) 28.614 0.735 ( -22.247 0.000 18.555) 28.969 1.006 ( -23.544 0.000 30.351) 38.412 2.018 ( -0.034 0.000 -4.484) 4.485 2.170 ( 1.389 0.000 23.493) 23.534 2.380 ( 3.573 0.000 2.078) 4.134 2.535 ( 0.894 0.000 -1.805) 2.015 2.633 ( 5.242 0.000 1.881) 5.569 2.679 ( 3.694 0.000 10.215) 10.863 2.780 ( 4.605 0.000 6.707) 8.136 3.030 ( -2.580 0.000 7.224) 7.671 3.271 ( 13.064 0.000 -0.462) 13.073 3.285 ( -0.402 0.000 -7.299) 7.310 3.456 ( -1.080 0.000 -0.293) 1.119 3.599 ( 3.713 0.000 -4.843) 6.103 3.701 ( 3.664 0.000 1.853) 4.106 3.878 ( 3.546 0.000 4.327) 5.594 3.944 ( 4.824 0.000 -0.395) 4.840 4.077 ( -8.558 0.000 -4.301) 9.578 4.197 ( 6.529 0.000 -2.496) 6.989 4.278 ( -10.230 0.000 3.748) 10.895 4.494 ( 6.816 0.000 -1.171) 6.916 4.806 ( 2.372 0.000 4.874) 5.421 4.844 ( 0.249 0.000 1.560) 1.580 4.920 ( -3.394 0.000 1.822) 3.852 5.005 ( 0.130 0.000 3.921) 3.923 5.246 ( -0.876 0.000 -9.298) 9.339 5.361 ( 5.388 0.000 -3.766) 6.574 5.502 ( 2.319 0.000 -2.152) 3.163 5.530 ( -3.101 0.000 2.479) 3.970 5.926 ( -4.829 0.000 -1.577) 5.080 5.970 ( -2.273 0.000 -3.165) 3.896 6.240 ( -9.588 0.000 1.433) 9.695 6.542 ( 2.323 0.000 4.236) 4.831 6.615 ( -10.420 0.000 -0.276) 10.423 6.717 ( -1.205 0.000 -1.449) 1.884 6.806 ( 3.853 0.000 7.175) 8.144 6.890 ( 3.441 0.000 2.250) 4.111 6.985 ( 2.885 0.000 2.357) 3.725 7.196 ( 2.080 0.000 -0.234) 2.093 7.815 ( -4.283 0.000 -4.026) 5.878 7.845 ( 10.196 0.000 -3.211) 10.690 8.340 ( 3.790 0.000 -8.923) 9.695 8.444 ( -10.645 0.000 1.074) 10.699 8.685 ( 1.134 0.000 -0.586) 1.276 8.807 ( 1.994 0.000 6.305) 6.613 8.846 ( 7.245 0.000 -1.575) 7.415 8.975 ( 0.333 0.000 -3.626) 3.641 9.122 ( -4.457 0.000 1.681) 4.764 9.315 ( 4.073 0.000 0.918) 4.175 9.770 ( -1.764 0.000 -0.660) 1.883 9.922 ( 4.975 0.000 -3.815) 6.270 10.488 ( 38.065 0.000 36.145) 52.492 10.581 ( -0.106 0.000 -2.975) 2.977 10.687 ( 12.978 0.000 12.495) 18.015 10.986 ( 1.160 0.000 0.566) 1.290 11.015 ( 1.092 0.000 4.326) 4.461 11.207 ( -11.988 0.000 1.188) 12.047 11.528 ( -5.821 0.000 -8.514) 10.313 11.531 ( 5.906 0.000 -9.221) 10.950 11.652 ( 1.428 0.000 2.172) 2.600 11.900 ( 2.444 0.000 -15.946) 16.132 12.027 ( -1.371 0.000 1.899) 2.342 12.502 ( -12.142 0.000 -12.114) 17.152 12.518 ( 2.367 0.000 10.808) 11.064 12.853 ( -0.695 0.000 6.397) 6.434 12.948 ( 3.823 0.000 -9.388) 10.136 13.412 ( -30.236 0.000 -26.185) 39.998 13.417 ( -0.597 0.000 0.049) 0.599 13.801 ( 3.352 0.000 -0.507) 3.390 13.830 ( -3.028 0.000 1.942) 3.597 14.326 ( 0.454 0.000 -1.866) 1.920 14.653 ( 1.268 0.000 0.199) 1.283 14.804 ( 1.080 0.000 5.265) 5.374 15.010 ( -9.244 0.000 -11.759) 14.957 15.196 ( -0.800 0.000 -1.743) 1.918 15.891 ( -3.189 0.000 1.135) 3.385 16.167 ( -3.675 0.000 4.858) 6.091 16.439 ( 1.151 0.000 -0.405) 1.220 17.195 ( -0.128 0.000 -3.539) 3.541 19.777 ( 0.739 0.000 2.379) 2.491 20.072 ( 1.220 0.000 3.472) 3.680 20.134 ( -1.164 0.000 4.013) 4.178 21.138 ( 7.416 0.000 17.042) 18.585 21.458 ( 5.693 0.000 -10.773) 12.185 21.799 ( -0.539 0.000 8.990) 9.006 21.842 ( -1.291 0.000 7.098) 7.215 22.055 ( 3.328 0.000 18.742) 19.035 22.580 ( -0.073 0.000 -0.615) 0.620 23.035 ( -13.015 0.000 -17.472) 21.786 23.196 ( -1.533 0.000 4.600) 4.849 23.503 ( 0.015 0.000 0.308) 0.308 24.076 ( -0.352 0.000 -1.444) 1.486 24.501 ( 0.653 0.000 -0.597) 0.885 24.759 ( 0.450 0.000 -5.415) 5.433 24.896 ( 4.157 0.000 -1.198) 4.326 ======================= Grid point 55 (23/104) ======================= q-point: ( 0.00 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.741 ( 6.759 24.919 11.980) 28.464 0.827 ( -1.908 20.254 18.708) 27.638 1.548 ( 0.476 44.558 25.885) 51.533 2.072 ( 0.476 4.390 -5.421) 6.992 2.256 ( -3.474 4.070 16.464) 17.312 2.463 ( 0.459 1.933 3.949) 4.420 2.567 ( -2.603 5.472 1.526) 6.249 2.646 ( 0.059 -3.041 9.783) 10.245 2.801 ( -0.922 7.533 2.964) 8.148 2.889 ( 2.824 6.510 1.611) 7.277 3.006 ( -5.277 0.123 1.633) 5.526 3.181 ( -1.477 -2.340 -0.820) 2.886 3.448 ( 2.819 -2.509 0.338) 3.789 3.531 ( -1.542 -7.769 -2.999) 8.469 3.584 ( 1.436 10.412 -2.197) 10.737 3.707 ( 0.024 3.354 -2.666) 4.284 3.904 ( -5.068 -0.552 -2.767) 5.801 3.951 ( 0.126 -2.351 -0.665) 2.446 4.032 ( -2.194 -1.026 3.577) 4.319 4.213 ( 1.764 2.245 3.487) 4.507 4.365 ( 4.906 10.098 -3.153) 11.661 4.486 ( -2.053 -4.881 -0.516) 5.320 4.780 ( -0.300 -2.144 3.668) 4.259 4.888 ( 0.863 -0.042 2.293) 2.450 4.917 ( -3.576 0.763 1.587) 3.986 5.013 ( 3.817 -3.311 3.558) 6.180 5.113 ( 2.529 -5.873 -0.308) 6.402 5.413 ( 2.953 1.351 1.371) 3.525 5.470 ( 1.837 0.856 -2.121) 2.934 5.519 ( -3.306 -1.104 -2.590) 4.343 5.811 ( -0.776 -6.540 -0.474) 6.603 6.028 ( 2.222 6.150 0.794) 6.587 6.106 ( -1.669 -0.642 0.999) 2.048 6.451 ( -2.749 -0.426 -0.179) 2.788 6.538 ( 1.097 -5.255 4.238) 6.839 6.613 ( -1.303 -3.861 6.690) 7.833 6.893 ( 1.878 -3.573 2.855) 4.944 6.993 ( 0.245 3.335 -3.500) 4.841 7.082 ( -2.031 1.340 -9.591) 9.895 7.351 ( 6.160 4.114 -3.480) 8.184 7.818 ( 0.559 4.390 -2.435) 5.051 7.960 ( 1.058 -0.541 -3.001) 3.228 8.304 ( -3.184 0.275 1.660) 3.602 8.398 ( -0.709 0.570 -4.395) 4.489 8.531 ( -3.654 -6.169 -0.428) 7.183 8.720 ( -3.901 -3.031 5.745) 7.577 8.842 ( -7.315 -2.522 -4.268) 8.837 9.005 ( 3.642 -5.185 2.663) 6.873 9.122 ( 0.830 3.277 2.688) 4.319 9.301 ( -2.044 2.458 -0.137) 3.199 9.732 ( 0.581 -2.677 -1.256) 3.014 10.004 ( 5.179 -3.748 3.484) 7.281 10.062 ( -6.954 -9.784 15.955) 19.966 10.694 ( 3.673 0.763 -3.476) 5.114 10.920 ( -5.098 -1.884 -1.560) 5.655 10.944 ( -5.755 -2.059 -1.614) 6.322 11.013 ( -1.383 2.254 -2.257) 3.476 11.234 ( -6.412 1.346 -4.467) 7.930 11.405 ( -0.410 -1.189 -3.830) 4.031 11.605 ( 11.592 -4.736 -2.398) 12.750 11.738 ( -4.456 -6.821 -3.973) 9.064 11.833 ( 7.970 -0.189 8.258) 11.478 11.946 ( 3.747 -2.874 -2.766) 5.473 12.450 ( -5.541 -6.024 7.259) 10.940 12.674 ( 11.703 7.512 -4.152) 14.512 12.717 ( -4.822 -1.257 -0.010) 4.983 12.881 ( -1.479 0.657 3.357) 3.727 13.009 ( 3.605 -0.950 -6.369) 7.380 13.674 ( -0.190 -5.545 -2.834) 6.231 13.719 ( -0.590 -5.303 0.345) 5.347 13.973 ( -0.532 11.290 -11.677) 16.251 14.176 ( -6.965 -3.949 -8.354) 11.571 14.497 ( 7.530 -0.659 5.477) 9.335 14.794 ( 0.854 3.415 9.230) 9.878 15.133 ( -2.905 15.354 -5.154) 16.455 15.646 ( 0.204 13.421 -16.438) 21.222 15.911 ( 3.375 -2.101 7.375) 8.378 16.206 ( 7.116 -3.615 4.137) 8.990 16.539 ( 0.764 6.706 -3.293) 7.510 17.167 ( 2.332 -2.386 -3.482) 4.822 19.777 ( 0.904 -1.642 3.156) 3.671 20.042 ( -3.577 -5.963 5.899) 9.119 20.178 ( -0.963 5.262 3.145) 6.205 20.422 ( -20.951 -2.297 15.672) 26.265 21.352 ( 14.618 -21.982 23.521) 35.357 21.644 ( -1.598 -10.885 4.660) 11.948 21.831 ( -0.149 -0.104 9.869) 9.871 21.907 ( -0.709 2.988 4.572) 5.507 22.648 ( -0.265 -5.304 -0.230) 5.315 22.993 ( 1.035 -6.202 -3.609) 7.250 23.540 ( 0.082 4.247 -0.500) 4.277 23.604 ( 0.676 9.861 -2.528) 10.202 24.361 ( -3.305 3.147 -12.542) 13.346 24.583 ( 5.299 0.523 -5.971) 8.001 24.881 ( 1.356 14.855 -9.911) 17.909 25.107 ( 2.738 8.314 -8.671) 12.321 ======================= Grid point 56 (24/104) ======================= q-point: ( 0.17 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.870 ( 11.831 11.195 19.419) 25.346 1.013 ( 8.596 15.829 20.253) 27.104 1.781 ( 13.132 34.881 14.464) 39.979 2.096 ( 3.298 6.303 0.201) 7.116 2.222 ( -2.517 3.394 13.952) 14.578 2.460 ( -2.158 1.692 2.269) 3.559 2.468 ( -6.745 6.120 2.685) 9.495 2.654 ( -1.886 -0.489 12.375) 12.527 2.749 ( -4.750 12.253 4.027) 13.745 2.883 ( -3.781 -0.637 1.262) 4.037 2.948 ( -0.680 5.951 -1.610) 6.203 3.092 ( -9.829 -3.460 -1.948) 10.600 3.384 ( -7.072 6.214 -5.211) 10.760 3.508 ( 3.213 -1.878 1.196) 3.909 3.632 ( 2.583 -0.585 0.620) 2.720 3.696 ( -1.048 6.481 -1.526) 6.741 3.810 ( -3.117 -5.352 -2.595) 6.715 3.931 ( -0.715 -4.302 -1.399) 4.580 4.027 ( -1.705 -1.926 5.269) 5.863 4.139 ( -8.767 2.388 -1.536) 9.216 4.401 ( -4.215 1.369 -4.883) 6.594 4.502 ( 5.157 8.463 -0.215) 9.913 4.736 ( -1.972 0.719 2.993) 3.656 4.845 ( -5.279 -3.646 6.981) 9.482 4.915 ( 1.506 -0.617 0.862) 1.842 5.130 ( 5.136 -1.739 1.971) 5.770 5.229 ( 7.948 -6.570 1.037) 10.364 5.396 ( -7.365 -0.334 -3.427) 8.130 5.440 ( -2.850 2.065 0.675) 3.584 5.504 ( 5.017 3.066 -4.653) 7.498 5.828 ( 2.054 -7.245 -1.877) 7.761 6.096 ( 5.028 -5.055 -2.900) 7.697 6.154 ( 5.542 5.665 4.769) 9.249 6.443 ( 2.448 1.614 -0.951) 3.082 6.587 ( 2.647 -7.018 3.427) 8.246 6.611 ( -0.399 -4.632 6.005) 7.594 6.922 ( 0.091 -0.959 1.824) 2.063 6.955 ( -5.235 2.019 -2.545) 6.161 6.987 ( -3.569 -3.136 -1.472) 4.974 7.354 ( -5.275 3.600 -2.474) 6.849 7.833 ( -0.774 3.705 -3.354) 5.057 7.908 ( -2.271 2.392 -4.429) 5.522 8.229 ( -3.955 -3.264 4.159) 6.602 8.422 ( 3.017 0.616 -0.724) 3.164 8.490 ( 0.990 1.212 -4.898) 5.141 8.672 ( -1.422 -2.348 -2.760) 3.893 8.724 ( -3.896 -3.947 3.983) 6.828 9.059 ( 1.289 -4.097 -1.138) 4.444 9.151 ( 1.728 3.937 2.573) 5.010 9.241 ( -3.357 3.916 -1.825) 5.471 9.757 ( 1.422 -3.415 1.485) 3.986 9.956 ( -5.708 0.651 12.694) 13.934 10.084 ( 1.676 -0.357 3.041) 3.490 10.693 ( -3.316 -0.185 -1.068) 3.488 10.809 ( -5.045 0.324 -0.473) 5.078 10.890 ( 2.055 5.732 -6.410) 8.841 10.951 ( -3.961 3.654 -4.896) 7.281 11.141 ( 0.970 0.510 -1.305) 1.704 11.404 ( 1.662 2.828 -4.477) 5.550 11.657 ( -2.280 -8.238 -2.545) 8.919 11.847 ( 11.017 -4.360 3.042) 12.233 11.965 ( 3.048 0.608 5.451) 6.275 11.997 ( 6.253 -6.138 -3.745) 9.529 12.351 ( -6.581 -6.759 2.221) 9.692 12.586 ( -7.284 -1.760 -2.916) 8.040 12.730 ( -3.873 3.735 -2.249) 5.832 13.039 ( 4.025 -1.033 -5.003) 6.504 13.095 ( 10.487 -11.161 4.719) 16.025 13.606 ( -4.468 -5.409 0.129) 7.017 13.775 ( 3.771 -3.186 -0.689) 4.985 13.968 ( 2.870 5.674 -9.162) 11.152 14.095 ( -0.278 -1.989 -6.412) 6.719 14.626 ( 2.537 3.210 7.419) 8.472 14.865 ( 4.867 1.592 1.068) 5.231 15.094 ( 0.125 13.008 -3.667) 13.515 15.612 ( -0.072 13.514 -9.855) 16.726 15.953 ( 0.235 -3.084 9.981) 10.450 16.314 ( 2.314 -11.734 -2.154) 12.152 16.522 ( -1.737 5.705 -3.299) 6.815 17.223 ( 3.672 0.117 -5.304) 6.452 19.797 ( -0.103 -1.358 3.468) 3.726 19.944 ( -5.154 -2.798 7.349) 9.402 20.171 ( -0.294 5.683 1.972) 6.023 20.290 ( -0.741 6.217 12.419) 13.908 21.598 ( 5.898 -26.166 16.671) 31.581 21.627 ( -1.451 -11.068 3.028) 11.566 21.862 ( 0.582 -1.650 9.481) 9.641 21.907 ( -0.434 1.334 5.021) 5.213 22.655 ( 1.045 -3.782 -0.366) 3.940 23.004 ( 0.957 -9.929 -3.626) 10.614 23.537 ( -0.365 4.291 -0.092) 4.307 23.590 ( -1.495 9.950 -2.099) 10.279 24.259 ( -4.147 4.771 -7.985) 10.184 24.600 ( -1.118 1.581 -3.914) 4.367 24.875 ( 0.615 14.141 -8.241) 16.378 25.056 ( -4.047 6.429 -4.196) 8.678 ======================= Grid point 57 (25/104) ======================= q-point: ( 0.33 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.157 ( 4.625 9.753 22.344) 24.815 1.273 ( 20.578 4.137 16.736) 26.845 1.909 ( 0.362 14.162 7.110) 15.851 2.028 ( -17.525 1.527 3.356) 17.909 2.239 ( 4.540 0.346 -4.026) 6.078 2.455 ( 0.142 5.139 0.227) 5.146 2.522 ( 8.648 11.987 14.461) 20.678 2.652 ( -2.450 6.210 3.585) 7.578 2.687 ( 0.891 11.570 11.674) 16.460 2.800 ( -6.936 1.383 6.939) 9.908 2.856 ( -6.538 1.054 -3.160) 7.337 2.923 ( -4.151 11.340 -1.719) 12.198 3.326 ( -0.240 4.214 -4.254) 5.993 3.565 ( 2.384 0.107 -0.919) 2.557 3.642 ( -2.788 7.883 -0.859) 8.406 3.674 ( -0.359 -4.584 5.955) 7.524 3.746 ( -4.092 -3.935 -0.007) 5.677 3.852 ( -10.312 -2.351 -0.724) 10.601 3.944 ( -0.613 -4.977 -2.505) 5.605 4.059 ( -1.391 -2.754 0.114) 3.087 4.343 ( -0.424 7.163 -5.975) 9.337 4.536 ( 1.889 9.202 0.279) 9.398 4.739 ( -2.826 -4.570 3.418) 6.368 4.806 ( 2.241 -3.375 6.022) 7.258 4.944 ( 1.537 2.979 0.423) 3.378 5.128 ( -5.953 -3.092 2.541) 7.173 5.249 ( -5.510 3.400 -2.387) 6.901 5.340 ( 0.042 1.505 5.498) 5.701 5.430 ( 3.397 -1.673 -2.907) 4.773 5.588 ( 5.364 0.559 -9.835) 11.217 5.839 ( -0.613 -7.505 -1.458) 7.670 6.191 ( 4.821 -4.501 -1.585) 6.784 6.279 ( 6.032 -0.910 1.252) 6.228 6.535 ( 6.548 2.667 1.145) 7.163 6.613 ( -0.203 -5.113 8.776) 10.159 6.652 ( 2.279 -7.470 0.242) 7.814 6.819 ( -5.183 -1.777 -1.149) 5.599 6.925 ( -1.358 -2.573 3.776) 4.767 6.951 ( -1.144 2.714 0.163) 2.950 7.203 ( -9.531 4.749 1.700) 10.783 7.723 ( -6.529 3.751 -2.021) 7.796 7.932 ( 3.710 1.808 -9.113) 10.004 8.227 ( 2.175 -4.340 0.312) 4.865 8.460 ( 2.502 -1.336 -2.848) 4.020 8.515 ( 1.892 3.392 -3.193) 5.028 8.652 ( -2.273 -6.060 4.718) 8.009 8.736 ( 4.929 -0.667 -1.306) 5.143 9.029 ( -3.796 -0.179 -2.869) 4.762 9.179 ( -0.947 1.901 -1.194) 2.436 9.206 ( 1.675 2.635 1.311) 3.386 9.787 ( 1.447 -2.102 3.993) 4.738 9.915 ( -1.996 5.249 5.780) 8.059 10.085 ( -2.444 1.738 4.169) 5.136 10.614 ( -4.054 -2.494 -2.298) 5.285 10.742 ( -2.269 1.235 -0.391) 2.613 10.888 ( -1.402 0.543 -1.570) 2.174 10.930 ( 2.687 9.695 -4.205) 10.904 11.216 ( 6.616 -5.033 -7.111) 10.939 11.437 ( 2.527 2.266 -2.681) 4.325 11.643 ( 1.232 -7.251 -1.621) 7.532 11.910 ( -2.334 -2.944 -2.114) 4.310 12.042 ( 1.882 -2.161 3.295) 4.367 12.160 ( 9.565 -5.437 0.195) 11.004 12.211 ( -8.497 -3.215 -1.699) 9.242 12.463 ( -2.856 -6.129 -3.445) 7.589 12.672 ( -2.048 1.594 1.700) 3.102 13.030 ( -1.605 2.001 -3.748) 4.542 13.243 ( 3.913 -12.802 3.067) 13.733 13.549 ( -1.415 -1.778 1.224) 2.581 13.834 ( 2.842 -0.893 -0.467) 3.016 14.017 ( 3.756 -0.189 -5.247) 6.455 14.102 ( 1.857 -1.559 -4.999) 5.556 14.617 ( -4.732 2.872 9.744) 11.206 14.954 ( 4.824 6.886 -4.657) 9.611 15.113 ( 1.968 9.794 -1.436) 10.092 15.593 ( 0.104 13.595 -8.452) 16.008 15.981 ( -0.094 -2.150 10.075) 10.302 16.299 ( -2.230 -12.887 -3.453) 13.526 16.474 ( -2.253 5.427 -1.329) 6.024 17.256 ( 1.375 2.301 -5.526) 6.142 19.780 ( -2.281 -0.935 4.786) 5.383 19.931 ( 1.231 -3.569 2.961) 4.798 20.175 ( 0.125 5.694 1.658) 5.931 20.351 ( 3.166 4.243 12.879) 13.925 21.599 ( -2.349 -12.516 1.717) 12.850 21.680 ( 0.406 -18.535 11.821) 21.988 21.873 ( -1.348 0.937 5.292) 5.541 21.922 ( 0.032 -3.465 7.831) 8.563 22.678 ( 1.331 -0.717 -0.169) 1.522 23.008 ( 0.540 -15.656 -4.810) 16.387 23.517 ( -1.959 11.149 0.217) 11.322 23.561 ( -0.645 6.207 -0.218) 6.245 24.193 ( -1.500 4.534 -3.604) 5.983 24.556 ( -2.199 2.149 -2.527) 3.980 24.871 ( 0.987 11.485 -6.810) 13.388 24.990 ( -2.006 6.503 -3.159) 7.503 ======================= Grid point 58 (26/104) ======================= q-point: (-0.50 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.185 ( -6.750 10.265 21.475) 24.741 1.564 ( -22.019 -1.506 5.192) 22.673 1.736 ( 14.386 1.217 10.487) 17.844 1.958 ( 4.054 10.747 9.448) 14.872 2.370 ( 8.634 0.017 -5.190) 10.074 2.426 ( -3.783 5.180 -3.366) 7.244 2.521 ( -7.513 1.213 3.711) 8.467 2.592 ( -4.366 6.335 7.113) 10.478 2.642 ( 0.418 8.834 4.255) 9.814 2.745 ( -10.783 18.065 1.160) 21.070 2.849 ( 3.382 2.012 3.539) 5.293 3.029 ( 12.439 14.544 14.976) 24.301 3.309 ( -0.300 4.189 -4.557) 6.197 3.552 ( -3.845 0.622 -3.404) 5.173 3.584 ( -1.553 4.489 1.512) 4.985 3.650 ( -2.362 -3.209 2.909) 4.934 3.666 ( -1.016 0.404 -1.245) 1.657 3.833 ( 5.455 -2.188 4.284) 7.273 3.932 ( 0.488 -8.070 -3.228) 8.706 4.063 ( 2.471 -4.989 -0.476) 5.588 4.337 ( 0.430 5.177 -4.571) 6.920 4.591 ( 2.370 7.427 2.328) 8.136 4.694 ( -1.965 -3.999 5.039) 6.726 4.900 ( 5.074 -0.972 0.329) 5.177 4.980 ( -1.509 -0.250 0.549) 1.625 5.003 ( -2.377 2.288 5.060) 6.041 5.160 ( -2.975 3.989 -2.463) 5.553 5.332 ( -1.791 6.615 4.007) 7.939 5.458 ( -0.606 -8.445 -4.720) 9.693 5.622 ( 0.266 -1.386 -10.159) 10.256 5.829 ( 0.579 -7.023 0.468) 7.063 6.205 ( -2.714 0.019 -2.252) 3.527 6.379 ( 4.019 -7.282 -0.687) 8.346 6.589 ( -5.224 -4.876 4.579) 8.486 6.617 ( -0.565 -5.327 7.991) 9.620 6.690 ( 3.217 1.551 -2.032) 4.109 6.811 ( 2.594 -3.150 1.631) 4.395 6.914 ( 0.767 1.386 2.540) 2.994 6.937 ( -2.242 3.659 0.851) 4.375 7.073 ( -2.144 2.774 2.385) 4.241 7.658 ( 0.588 4.140 -1.619) 4.484 7.958 ( 1.265 0.226 -10.076) 10.157 8.271 ( 2.272 -4.035 -2.035) 5.058 8.520 ( 3.822 -3.315 -1.399) 5.249 8.549 ( 3.116 4.151 -0.413) 5.207 8.617 ( -2.639 -6.576 7.571) 10.369 8.829 ( 3.398 -1.574 -5.048) 6.286 8.941 ( -3.035 3.450 -0.615) 4.636 9.172 ( 1.071 1.386 -0.714) 1.891 9.238 ( 0.488 1.113 0.892) 1.507 9.825 ( 0.762 -3.533 5.072) 6.228 9.891 ( -1.973 6.233 4.750) 8.081 10.024 ( -4.146 3.949 1.339) 5.880 10.551 ( -1.660 -3.963 -3.955) 5.840 10.714 ( -0.602 2.026 -1.319) 2.491 10.893 ( 2.004 -0.250 0.555) 2.095 10.975 ( 3.236 10.002 -1.455) 10.613 11.305 ( 4.166 -7.755 -9.740) 13.129 11.474 ( 1.853 0.653 0.995) 2.203 11.650 ( -2.345 -7.116 -1.321) 7.608 11.830 ( -4.719 -3.154 -6.822) 8.875 11.989 ( -3.490 0.581 -4.997) 6.123 12.053 ( -7.636 -1.272 -4.275) 8.843 12.314 ( 5.430 -5.433 4.460) 8.883 12.497 ( 6.246 -7.525 -1.424) 9.883 12.657 ( -1.161 -3.713 5.227) 6.516 12.999 ( -0.084 5.693 -3.449) 6.656 13.271 ( -1.409 -11.401 1.843) 11.635 13.560 ( 1.722 -1.611 2.548) 3.472 13.872 ( 0.983 -0.988 0.119) 1.398 14.068 ( 2.949 1.795 -6.931) 7.743 14.132 ( 2.499 -2.895 -1.104) 3.981 14.533 ( -6.180 1.158 8.864) 10.868 15.015 ( 2.714 4.020 -5.268) 7.161 15.143 ( 1.486 15.833 0.843) 15.925 15.565 ( -0.785 12.232 -9.505) 15.511 15.982 ( -2.513 -1.549 6.713) 7.334 16.243 ( -2.519 -10.318 -2.773) 10.977 16.451 ( 0.201 5.121 -0.306) 5.135 17.252 ( -0.316 2.142 -5.486) 5.898 19.753 ( -1.659 -1.244 4.202) 4.685 19.970 ( 1.969 -4.226 2.532) 5.305 20.182 ( 0.098 5.293 2.222) 5.741 20.459 ( 4.821 1.065 16.574) 17.293 21.537 ( -5.116 -14.587 -0.633) 15.471 21.695 ( -1.267 -14.833 9.697) 17.767 21.851 ( -2.106 1.268 4.956) 5.533 21.932 ( -1.000 -2.019 7.198) 7.542 22.695 ( 0.279 1.216 0.249) 1.272 23.002 ( 0.255 -18.428 -6.006) 19.384 23.490 ( -0.471 15.753 0.723) 15.776 23.560 ( 0.191 4.245 0.558) 4.286 24.183 ( 1.164 4.832 -2.431) 5.533 24.516 ( -1.400 1.103 -2.953) 3.449 24.874 ( 0.879 9.813 -6.465) 11.784 24.964 ( -0.010 7.869 -3.559) 8.637 ======================= Grid point 59 (27/104) ======================= q-point: (-0.33 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.987 ( -22.575 0.881 10.576) 24.945 1.131 ( -16.837 12.610 15.760) 26.284 1.966 ( -1.064 12.193 10.198) 15.931 2.101 ( 6.242 9.518 2.400) 11.632 2.272 ( -15.573 23.655 10.291) 30.133 2.323 ( -0.145 -0.153 -1.633) 1.646 2.510 ( 1.865 0.855 4.818) 5.237 2.595 ( 4.147 5.327 -3.170) 7.458 2.644 ( 2.752 5.240 8.006) 9.957 2.718 ( 2.646 6.283 5.683) 8.875 3.003 ( 11.588 -0.094 2.131) 11.783 3.141 ( -1.894 7.837 9.082) 12.145 3.320 ( 2.745 5.380 -4.007) 7.248 3.486 ( -1.817 -1.939 -2.065) 3.366 3.575 ( 0.451 -1.021 -4.642) 4.774 3.635 ( 0.168 0.437 0.967) 1.075 3.729 ( 5.331 -4.342 2.989) 7.498 3.928 ( 3.775 3.728 1.637) 5.552 3.972 ( 3.302 -5.093 0.611) 6.101 4.166 ( 7.638 -5.699 4.291) 10.452 4.330 ( 0.629 6.170 -7.263) 9.551 4.582 ( -3.915 1.739 -0.841) 4.366 4.702 ( 0.847 0.885 5.837) 5.964 4.902 ( -2.396 -2.152 7.631) 8.282 4.919 ( -2.672 3.559 1.398) 4.664 5.076 ( 1.742 3.850 0.388) 4.244 5.191 ( 7.373 -0.612 -4.390) 8.603 5.266 ( -4.834 -1.644 -3.578) 6.235 5.437 ( 0.565 -4.147 -1.238) 4.365 5.557 ( -4.144 -1.832 -3.884) 5.968 5.852 ( 1.005 -7.612 -0.922) 7.733 6.122 ( -4.591 2.922 -3.044) 6.236 6.373 ( -7.743 -6.456 1.114) 10.143 6.471 ( -2.910 -3.716 3.072) 5.631 6.610 ( -1.808 -4.194 5.636) 7.254 6.735 ( -2.053 -0.592 3.001) 3.684 6.820 ( 0.101 -0.810 0.577) 1.000 6.889 ( 1.129 2.596 -1.973) 3.450 7.003 ( 5.707 5.443 4.017) 8.851 7.124 ( 4.490 -0.668 -0.287) 4.549 7.731 ( 7.015 4.279 -1.771) 8.405 7.925 ( -2.374 1.010 -7.377) 7.815 8.300 ( 1.974 -1.971 -4.923) 5.659 8.545 ( -1.285 -5.001 2.241) 5.628 8.602 ( -1.222 -2.112 1.945) 3.121 8.642 ( 5.396 -0.375 3.099) 6.234 8.804 ( -0.516 -3.125 2.121) 3.812 8.971 ( 3.394 2.396 -2.946) 5.092 9.207 ( -1.282 2.780 -0.016) 3.062 9.223 ( 1.213 -0.538 1.533) 2.028 9.812 ( -2.454 -2.782 -0.391) 3.730 9.871 ( -1.595 1.750 6.448) 6.869 9.997 ( 1.427 3.167 6.872) 7.700 10.544 ( 2.376 -2.766 -5.901) 6.937 10.723 ( 2.486 3.844 -0.557) 4.612 10.952 ( 3.710 0.227 0.948) 3.836 11.049 ( 4.375 9.758 2.904) 11.081 11.286 ( -3.847 -10.145 -9.447) 14.387 11.516 ( -1.464 -1.933 2.562) 3.528 11.534 ( -3.477 -1.295 -1.748) 4.102 11.721 ( -6.040 -4.673 -11.321) 13.656 11.900 ( -2.404 0.923 -11.359) 11.648 11.979 ( -1.292 -3.797 -0.585) 4.053 12.392 ( 2.491 -4.728 9.116) 10.567 12.626 ( 1.872 -1.218 -4.948) 5.429 12.654 ( 5.224 -8.475 5.010) 11.145 13.009 ( 1.020 6.217 -2.219) 6.680 13.199 ( -6.909 -11.005 0.545) 13.005 13.606 ( 2.116 -4.576 2.761) 5.748 13.861 ( -2.175 -0.874 -0.674) 2.439 14.072 ( 0.090 7.528 -12.101) 14.251 14.205 ( 4.734 -4.257 3.537) 7.283 14.453 ( -4.257 -1.669 7.765) 9.011 14.989 ( -4.714 -4.771 -6.176) 9.117 15.188 ( 2.488 25.335 2.568) 25.586 15.538 ( 1.734 11.729 -10.985) 16.163 15.920 ( -4.700 -2.779 0.603) 5.494 16.197 ( -2.572 -4.946 1.198) 5.702 16.475 ( 2.259 5.517 -0.732) 6.006 17.220 ( -1.637 0.219 -5.380) 5.627 19.744 ( -0.357 -1.461 3.461) 3.774 20.010 ( 1.532 -4.237 3.470) 5.687 20.187 ( -0.288 4.992 3.112) 5.890 20.613 ( 6.787 -6.669 23.445) 25.302 21.384 ( -11.608 -15.299 -3.609) 19.541 21.686 ( -2.005 -12.870 8.123) 15.351 21.828 ( -1.766 0.756 6.540) 6.817 21.923 ( -1.491 0.969 6.150) 6.402 22.687 ( -1.073 -0.703 0.338) 1.327 22.992 ( 0.323 -14.380 -5.773) 15.499 23.505 ( 1.721 15.066 -0.373) 15.168 23.567 ( 0.556 4.906 0.366) 4.951 24.235 ( 5.899 7.915 -3.869) 10.603 24.488 ( -0.965 -0.550 -3.755) 3.915 24.871 ( 0.738 10.077 -6.966) 12.273 24.973 ( 1.869 9.441 -3.309) 10.177 ======================= Grid point 60 (28/104) ======================= q-point: (-0.17 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.651 ( -8.854 16.014 10.671) 21.183 0.945 ( -10.953 18.235 19.677) 28.977 1.706 ( -20.145 41.828 14.522) 48.645 2.093 ( -1.363 5.009 -4.627) 6.953 2.242 ( 0.235 6.632 17.995) 19.179 2.410 ( 4.682 2.800 3.536) 6.502 2.558 ( 2.180 0.889 5.181) 5.691 2.618 ( 0.403 2.014 3.655) 4.193 2.763 ( 4.049 6.356 4.167) 8.612 2.799 ( 5.500 3.251 2.103) 6.726 3.091 ( -4.635 4.333 6.252) 8.907 3.170 ( 3.995 -2.668 -1.305) 4.978 3.392 ( 4.470 4.574 -1.422) 6.552 3.490 ( 3.120 -5.496 -2.468) 6.784 3.579 ( 0.853 0.988 -3.906) 4.119 3.671 ( 3.833 3.054 -0.226) 4.906 3.826 ( 5.562 -3.079 4.721) 7.919 4.001 ( 2.615 -0.416 0.447) 2.686 4.007 ( 0.188 -2.080 0.982) 2.308 4.267 ( -2.140 0.292 2.728) 3.480 4.322 ( 1.130 8.615 -7.329) 11.367 4.495 ( -2.044 -0.047 -0.693) 2.158 4.741 ( 1.981 -3.178 4.792) 6.081 4.869 ( -1.124 3.603 3.577) 5.200 4.934 ( 1.960 -5.277 7.288) 9.209 5.044 ( -5.894 6.664 -1.054) 8.958 5.133 ( -3.003 -8.560 -6.094) 10.929 5.374 ( 8.510 -1.383 -3.063) 9.150 5.415 ( -2.553 -1.081 -0.331) 2.792 5.531 ( 1.263 -1.085 0.476) 1.732 5.844 ( -1.515 -7.136 -1.120) 7.381 6.039 ( -3.373 6.789 -0.927) 7.637 6.199 ( -8.352 -3.379 1.577) 9.147 6.473 ( 0.407 -5.219 2.901) 5.985 6.575 ( -4.383 -0.666 3.746) 5.804 6.641 ( -4.705 -3.358 5.446) 7.942 6.852 ( 1.904 -2.987 0.885) 3.651 6.957 ( 5.077 4.759 -6.306) 9.391 7.088 ( 2.738 3.934 -2.746) 5.524 7.220 ( 6.334 2.407 1.918) 7.043 7.847 ( -1.183 3.137 -3.234) 4.659 7.878 ( 5.801 2.202 -3.278) 7.017 8.322 ( 1.470 -1.642 -4.962) 5.430 8.477 ( -5.747 2.066 -2.566) 6.624 8.570 ( -1.429 -6.567 1.374) 6.860 8.731 ( 2.059 -3.116 6.100) 7.152 8.879 ( 4.880 -6.147 5.383) 9.517 8.987 ( -1.485 0.178 -4.670) 4.904 9.131 ( -3.717 1.569 2.907) 4.972 9.288 ( 3.093 0.942 0.707) 3.310 9.757 ( -2.617 -1.687 -1.768) 3.580 9.900 ( 4.083 -1.582 1.682) 4.691 10.074 ( 1.305 -8.162 18.149) 19.943 10.612 ( 5.882 -0.480 -5.763) 8.248 10.843 ( 10.162 2.768 4.576) 11.483 11.011 ( 1.962 2.296 0.365) 3.042 11.085 ( -4.865 -1.446 -4.064) 6.502 11.198 ( 1.084 1.964 4.756) 5.258 11.439 ( -1.340 -5.338 -6.580) 8.578 11.532 ( -1.908 -1.655 -8.580) 8.944 11.647 ( 4.400 -0.926 2.428) 5.110 11.859 ( -1.590 -4.042 -13.651) 14.325 11.932 ( -2.813 -3.624 2.498) 5.223 12.461 ( 1.733 -4.755 10.082) 11.281 12.600 ( -1.050 4.131 -3.053) 5.243 12.792 ( 5.308 -3.207 -0.292) 6.208 12.974 ( -8.210 -5.781 -2.196) 10.278 13.032 ( -6.456 0.274 -2.867) 7.069 13.644 ( 1.703 -6.429 1.237) 6.765 13.792 ( -4.391 -1.324 -3.033) 5.498 14.026 ( -1.457 11.059 -12.848) 17.014 14.282 ( 1.195 -4.086 -1.216) 4.428 14.416 ( -1.318 -5.592 5.646) 8.055 14.841 ( -7.944 0.237 0.443) 7.960 15.197 ( -1.980 18.911 -2.233) 19.146 15.613 ( 8.598 16.794 -15.883) 24.662 15.846 ( -1.895 -2.482 2.577) 4.049 16.155 ( -2.247 -0.852 6.258) 6.704 16.516 ( 2.180 6.367 -1.810) 6.969 17.174 ( -1.555 -2.198 -4.345) 5.112 19.755 ( 0.610 -1.602 3.158) 3.593 20.042 ( 0.791 -4.382 4.434) 6.284 20.186 ( -0.732 5.057 3.595) 6.248 20.759 ( -6.021 -28.010 25.161) 38.130 21.140 ( -6.170 -1.330 4.856) 7.964 21.665 ( -2.047 -11.461 6.407) 13.289 21.820 ( -1.045 0.315 8.503) 8.572 21.912 ( -1.157 2.778 5.214) 6.020 22.664 ( -1.302 -4.115 0.059) 4.316 22.988 ( 0.625 -8.071 -4.600) 9.311 23.533 ( 1.060 8.558 -0.979) 8.679 23.585 ( 1.461 8.741 -1.239) 8.948 24.381 ( 9.367 10.419 -14.288) 20.011 24.467 ( 1.301 -2.493 -0.130) 2.815 24.873 ( 1.621 12.655 -8.774) 15.484 25.023 ( 4.906 10.733 -3.556) 12.326 ======================= Grid point 61 (29/104) ======================= q-point: ( 0.00 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.277 ( 6.012 22.847 7.280) 24.721 1.315 ( -5.087 25.911 8.187) 27.646 2.130 ( 1.448 -0.310 -4.910) 5.129 2.309 ( -0.470 8.266 12.653) 15.121 2.398 ( -5.529 15.033 9.475) 18.610 2.447 ( -0.568 -2.191 6.425) 6.812 2.680 ( -0.386 5.952 5.467) 8.091 2.797 ( -1.120 20.061 5.249) 20.767 2.944 ( 0.455 9.813 -1.373) 9.919 2.974 ( -0.470 -1.518 -1.102) 1.934 3.110 ( -1.019 -0.138 -0.902) 1.368 3.181 ( -2.053 9.149 -1.008) 9.431 3.325 ( 2.614 -3.691 -0.759) 4.586 3.480 ( 1.603 0.541 0.314) 1.721 3.640 ( -0.437 -3.879 1.430) 4.157 3.683 ( 1.416 -4.209 4.821) 6.555 3.866 ( -2.735 -6.134 1.501) 6.882 4.024 ( 0.421 8.527 0.363) 8.545 4.115 ( -2.473 6.224 -5.399) 8.603 4.267 ( -5.225 5.074 -1.703) 7.480 4.398 ( -0.528 -0.958 3.502) 3.669 4.586 ( 4.272 5.796 -2.351) 7.575 4.715 ( 2.184 -6.349 7.787) 10.282 4.786 ( 3.734 -2.545 7.887) 9.090 4.895 ( 0.973 -1.225 7.577) 7.737 4.977 ( 1.598 1.156 -2.364) 3.079 5.185 ( -1.009 5.739 -4.677) 7.472 5.397 ( -0.278 -1.703 1.536) 2.310 5.479 ( -3.197 -1.676 -1.866) 4.064 5.543 ( 4.249 5.376 -0.334) 6.861 5.646 ( -0.210 -7.945 0.805) 7.989 5.988 ( -2.496 -4.190 -4.106) 6.375 6.284 ( 2.314 10.734 0.706) 11.004 6.376 ( 0.459 -3.617 -0.060) 3.647 6.501 ( -2.164 -2.126 3.203) 4.412 6.531 ( -1.797 -1.303 5.063) 5.528 6.777 ( 0.533 -6.473 4.161) 7.713 6.946 ( -0.719 -5.388 0.804) 5.495 7.138 ( -3.033 0.169 -9.850) 10.308 7.305 ( 3.872 -7.381 -2.793) 8.790 7.931 ( 0.709 5.123 -1.507) 5.387 7.989 ( 0.388 3.561 -3.477) 4.992 8.315 ( -3.610 0.964 2.399) 4.440 8.348 ( -1.334 -2.969 2.312) 3.993 8.496 ( 0.249 0.468 -4.386) 4.417 8.673 ( -1.996 -2.382 2.223) 3.821 8.746 ( -3.873 -4.428 2.872) 6.547 8.870 ( 1.538 -5.884 -1.684) 6.311 9.171 ( 1.862 1.296 4.186) 4.762 9.344 ( -0.735 -1.011 1.166) 1.710 9.742 ( -0.912 4.950 -6.254) 8.028 9.991 ( 4.212 1.115 -0.131) 4.359 10.052 ( -0.291 5.343 5.911) 7.973 10.695 ( 4.061 -1.247 -3.191) 5.313 10.860 ( -2.123 -3.754 -2.924) 5.210 10.906 ( -2.032 -1.517 -1.285) 2.843 11.036 ( -4.151 -0.130 -3.488) 5.424 11.193 ( -0.947 -4.709 -5.651) 7.417 11.366 ( 5.888 -1.226 2.033) 6.349 11.546 ( 7.798 -0.423 -3.776) 8.674 11.587 ( -6.130 -6.900 -3.239) 9.782 11.778 ( 7.447 -4.486 -1.207) 8.777 11.948 ( 1.318 2.777 6.973) 7.621 12.319 ( -5.782 -6.543 5.476) 10.307 12.715 ( -9.575 1.179 -0.199) 9.649 12.773 ( 9.813 2.593 1.759) 10.301 12.902 ( -0.310 0.923 -1.994) 2.219 12.972 ( 1.064 -3.504 -4.145) 5.531 13.554 ( -0.194 -3.778 0.531) 3.820 13.600 ( -1.318 -4.946 0.524) 5.145 14.027 ( -1.405 -1.549 -4.985) 5.405 14.125 ( -5.235 -0.740 -7.722) 9.359 14.575 ( 6.907 5.990 4.838) 10.344 14.866 ( -0.973 1.104 3.493) 3.790 15.472 ( 0.577 14.388 -7.572) 16.269 15.826 ( 2.048 4.769 -10.716) 11.907 15.886 ( -0.187 0.879 7.924) 7.975 16.136 ( -1.223 -2.943 4.013) 5.125 16.678 ( 0.423 6.172 -3.770) 7.245 17.081 ( 2.533 -5.545 -2.943) 6.769 19.745 ( 0.320 -0.963 4.578) 4.689 19.901 ( -2.017 -6.002 8.242) 10.394 20.327 ( -0.134 8.228 1.021) 8.292 20.465 ( -4.229 4.320 9.517) 11.275 21.127 ( 2.126 -4.882 11.154) 12.360 21.407 ( -1.336 -11.579 3.814) 12.264 21.842 ( -0.458 1.031 8.111) 8.189 21.938 ( -1.224 0.044 5.233) 5.374 22.551 ( -0.186 -2.647 0.233) 2.664 22.830 ( -0.134 -8.214 -0.389) 8.225 23.639 ( -0.447 4.925 -0.303) 4.955 23.738 ( 0.210 3.950 -0.248) 3.963 24.361 ( -2.129 -0.784 -6.039) 6.451 24.496 ( 3.252 -5.452 -2.450) 6.804 25.150 ( 1.315 10.031 -6.903) 12.248 25.290 ( 1.046 6.833 -10.601) 12.656 ======================= Grid point 62 (30/104) ======================= q-point: ( 0.17 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.251 ( -1.190 21.762 9.342) 23.713 1.404 ( 4.968 19.437 11.767) 23.259 2.147 ( 0.959 2.712 -1.788) 3.387 2.266 ( -6.816 0.770 6.373) 9.363 2.330 ( -6.602 6.095 4.124) 9.887 2.459 ( 0.227 -3.053 6.261) 6.970 2.664 ( -2.268 6.811 6.542) 9.712 2.838 ( 1.315 15.763 0.954) 15.846 2.897 ( -4.458 1.963 4.378) 6.549 2.944 ( 0.027 8.438 0.838) 8.480 3.055 ( -0.948 8.608 -1.159) 8.737 3.204 ( 0.617 13.432 -1.010) 13.484 3.363 ( 2.451 -3.754 -0.716) 4.540 3.512 ( 2.025 -2.949 1.646) 3.938 3.606 ( -2.226 -1.444 3.306) 4.239 3.711 ( -1.338 -7.144 0.521) 7.287 3.798 ( -3.684 -5.829 -0.589) 6.920 3.891 ( -8.901 13.611 -2.703) 16.486 4.071 ( -2.515 6.674 3.490) 7.940 4.162 ( -4.621 1.322 1.498) 5.035 4.475 ( 4.585 4.503 -4.340) 7.754 4.596 ( -2.200 -0.219 2.343) 3.221 4.721 ( -2.837 -3.904 6.110) 7.786 4.873 ( 0.634 4.465 7.621) 8.856 4.975 ( 5.227 5.670 0.110) 7.713 5.082 ( 7.746 -4.747 5.209) 10.473 5.161 ( -0.189 3.438 -4.579) 5.729 5.336 ( -4.909 -3.070 -0.406) 5.804 5.470 ( 3.430 -0.185 0.587) 3.484 5.592 ( 1.601 5.002 -0.473) 5.273 5.653 ( -0.092 -8.362 -0.023) 8.363 5.964 ( 1.415 -6.060 -4.008) 7.402 6.319 ( 0.392 8.649 1.907) 8.866 6.391 ( 2.068 -5.064 -0.534) 5.496 6.498 ( -0.738 -5.108 4.953) 7.153 6.561 ( 5.107 3.534 1.085) 6.304 6.783 ( -2.110 -8.281 3.920) 9.401 6.906 ( -3.093 -4.384 -0.406) 5.381 7.030 ( -5.126 -0.142 -4.035) 6.525 7.304 ( -2.983 -7.186 -2.992) 8.336 7.943 ( -3.936 3.497 -3.678) 6.423 7.951 ( 1.564 3.827 -2.509) 4.836 8.197 ( -5.641 0.686 3.031) 6.440 8.390 ( 1.052 -2.461 -2.759) 3.844 8.513 ( 2.712 0.427 -1.769) 3.266 8.621 ( -3.216 -2.186 0.806) 3.971 8.686 ( 0.177 0.716 0.997) 1.240 8.926 ( 2.755 -7.514 -2.489) 8.381 9.216 ( 1.394 1.668 5.407) 5.827 9.299 ( -3.786 0.750 0.338) 3.875 9.744 ( 2.136 2.503 -4.729) 5.761 10.051 ( 2.299 -2.868 0.240) 3.683 10.081 ( 1.323 10.315 5.977) 11.994 10.674 ( -4.649 -1.704 -0.276) 4.959 10.808 ( -2.464 -0.361 -1.985) 3.185 10.929 ( 4.345 -1.403 -6.132) 7.645 10.960 ( -2.765 -0.984 -5.451) 6.191 11.175 ( 1.263 -0.210 -5.050) 5.210 11.460 ( 0.541 -0.291 -2.917) 2.981 11.499 ( 0.870 -2.361 1.100) 2.746 11.743 ( 11.090 -4.435 3.685) 12.500 11.854 ( 1.362 -5.476 -2.239) 6.071 12.002 ( 3.226 1.399 7.267) 8.073 12.198 ( -6.274 -7.229 1.184) 9.645 12.519 ( -12.116 -2.483 -2.715) 12.662 12.757 ( -8.405 -3.483 1.294) 9.190 12.971 ( 9.250 0.712 1.782) 9.447 13.070 ( 4.646 0.946 -3.982) 6.192 13.528 ( -0.662 -1.368 0.895) 1.764 13.682 ( 7.195 -4.859 -0.686) 8.709 13.997 ( -0.238 -2.728 -4.625) 5.375 14.025 ( -3.143 -0.874 -6.079) 6.899 14.718 ( 5.057 4.499 5.817) 8.925 14.859 ( 0.607 0.096 -0.090) 0.622 15.485 ( 2.361 17.221 -7.263) 18.838 15.840 ( 1.740 7.414 -7.701) 10.831 15.901 ( 0.311 -0.744 8.896) 8.933 16.107 ( -2.626 -7.193 1.650) 7.833 16.660 ( -1.372 6.814 -3.225) 7.663 17.155 ( 5.330 -6.062 -3.815) 8.928 19.759 ( -0.201 -1.492 5.094) 5.312 19.871 ( -2.978 -3.831 7.502) 8.935 20.329 ( 0.203 8.511 0.009) 8.514 20.437 ( -1.073 6.844 8.959) 11.325 21.210 ( 2.948 -10.573 12.350) 16.522 21.391 ( -1.181 -11.650 2.920) 12.068 21.858 ( -0.000 0.482 8.338) 8.352 21.928 ( -1.178 -0.083 4.709) 4.855 22.558 ( 1.018 -3.400 0.111) 3.551 22.803 ( -2.610 -8.654 -0.579) 9.057 23.635 ( 0.113 4.889 -0.320) 4.900 23.738 ( -0.203 4.285 -0.457) 4.314 24.307 ( -2.043 1.228 -5.285) 5.797 24.522 ( 0.325 -5.725 -2.218) 6.149 25.152 ( 0.710 10.093 -6.634) 12.098 25.241 ( -2.940 8.480 -8.763) 12.544 ======================= Grid point 63 (31/104) ======================= q-point: ( 0.33 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.365 ( 9.409 11.224 10.636) 18.100 1.520 ( 4.680 15.471 13.702) 21.190 2.011 ( -19.727 -1.659 3.528) 20.108 2.153 ( -1.059 6.735 5.601) 8.823 2.286 ( 2.610 3.172 -2.739) 4.937 2.505 ( 3.461 -3.400 4.743) 6.785 2.617 ( -4.712 2.405 3.737) 6.477 2.758 ( -10.490 1.657 -2.533) 10.918 2.763 ( -5.507 2.757 7.300) 9.550 2.966 ( 0.739 9.624 -1.026) 9.706 3.170 ( 8.113 18.739 6.059) 21.300 3.196 ( -0.227 10.485 -1.972) 10.671 3.447 ( 4.903 -0.238 -4.309) 6.532 3.532 ( -2.573 -2.818 1.209) 4.002 3.598 ( 4.369 0.561 2.510) 5.070 3.660 ( -3.905 -5.037 -3.618) 7.328 3.739 ( -1.513 -3.444 6.597) 7.594 3.795 ( -1.582 9.881 1.026) 10.059 4.001 ( -5.575 10.463 3.163) 12.271 4.087 ( -5.187 6.320 3.448) 8.873 4.462 ( -2.018 2.844 -8.074) 8.795 4.550 ( -4.015 -0.943 4.778) 6.311 4.740 ( 2.087 -4.040 4.647) 6.502 4.877 ( 0.879 9.080 3.365) 9.723 5.033 ( 0.572 -0.762 1.889) 2.115 5.105 ( -2.735 5.858 1.282) 6.591 5.214 ( 3.250 -3.506 -5.479) 7.272 5.313 ( 1.473 0.438 4.101) 4.380 5.515 ( -0.885 5.147 2.471) 5.777 5.615 ( 1.211 0.856 -7.461) 7.607 5.642 ( -0.293 -9.046 2.915) 9.509 6.026 ( 5.498 -8.914 -2.190) 10.700 6.317 ( -0.719 2.679 0.692) 2.859 6.446 ( 2.760 -5.841 2.362) 6.878 6.491 ( -1.097 -5.785 6.413) 8.706 6.688 ( 2.360 2.578 -0.160) 3.498 6.703 ( -0.150 -4.398 -0.551) 4.435 6.878 ( 0.079 -2.635 1.114) 2.862 6.959 ( -2.117 -2.817 0.131) 3.526 7.210 ( -6.357 -3.893 0.881) 7.506 7.841 ( -5.431 6.078 -2.058) 8.407 7.964 ( 0.968 1.543 -5.959) 6.231 8.148 ( -0.496 -2.152 1.959) 2.952 8.383 ( 0.635 -5.714 -4.006) 7.007 8.551 ( -0.631 -0.573 4.243) 4.328 8.610 ( 2.365 3.546 -2.014) 4.714 8.742 ( 5.063 0.583 -2.175) 5.541 8.939 ( -0.460 -6.964 -4.277) 8.186 9.220 ( -2.702 1.372 2.369) 3.846 9.254 ( -0.362 0.911 4.427) 4.534 9.780 ( 2.551 1.841 -3.644) 4.814 10.075 ( -0.804 -0.460 4.064) 4.168 10.114 ( 1.559 9.747 1.311) 9.958 10.573 ( -5.585 -1.187 -1.670) 5.949 10.770 ( -1.092 1.250 -1.684) 2.364 10.895 ( -2.069 1.060 -3.760) 4.421 11.000 ( 4.382 -5.872 -7.515) 10.496 11.216 ( 3.788 4.761 -4.765) 7.728 11.453 ( 0.655 -1.478 -0.041) 1.617 11.536 ( 1.509 1.282 -2.645) 3.304 11.833 ( -2.834 -3.925 -0.615) 4.881 11.932 ( 7.616 -6.044 2.548) 10.052 12.088 ( 2.017 -3.372 1.971) 4.396 12.123 ( -1.997 -6.545 0.873) 6.899 12.296 ( -7.880 -6.091 -2.385) 10.242 12.612 ( -8.032 -6.981 4.766) 11.660 13.090 ( 3.413 2.850 -2.560) 5.131 13.127 ( 3.031 0.736 -1.008) 3.278 13.536 ( 0.791 0.948 1.150) 1.687 13.800 ( 4.875 -2.645 -1.269) 5.689 13.987 ( 0.895 -0.905 -2.110) 2.464 14.007 ( 1.619 -6.089 -3.027) 6.990 14.725 ( -4.043 5.962 5.108) 8.831 14.923 ( 4.855 -1.927 -2.936) 5.992 15.515 ( 2.706 16.826 -5.030) 17.769 15.835 ( -1.329 8.327 -7.069) 11.004 15.950 ( 2.703 -0.322 7.684) 8.152 16.061 ( -2.097 -7.792 0.733) 8.102 16.621 ( -1.740 8.234 -2.103) 8.675 17.225 ( 2.890 -5.334 -5.175) 7.974 19.756 ( -1.725 -1.191 5.804) 6.171 19.847 ( -1.064 -3.776 5.963) 7.138 20.332 ( 0.139 8.409 -0.349) 8.418 20.461 ( 0.971 5.652 8.854) 10.549 21.266 ( -0.462 -12.778 9.762) 16.087 21.387 ( 0.038 -12.138 4.461) 12.932 21.875 ( -0.570 0.126 7.389) 7.412 21.920 ( -0.632 -0.079 5.032) 5.072 22.593 ( 2.845 -5.198 -0.016) 5.926 22.738 ( -4.053 -8.815 -0.645) 9.723 23.641 ( 0.568 4.806 0.035) 4.839 23.730 ( -0.444 5.355 -0.518) 5.399 24.269 ( -0.669 2.770 -3.808) 4.756 24.507 ( -1.116 -4.732 -2.332) 5.392 25.144 ( 0.004 10.962 -7.272) 13.155 25.175 ( -1.398 9.400 -5.839) 11.154 ======================= Grid point 64 (32/104) ======================= q-point: (-0.50 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.418 ( -9.272 9.953 5.500) 14.672 1.658 ( -14.235 10.512 10.106) 20.378 1.757 ( 14.667 0.555 9.536) 17.503 2.184 ( 2.861 8.350 9.823) 13.206 2.369 ( 4.544 0.414 -3.815) 5.948 2.481 ( -5.906 -1.180 0.444) 6.039 2.597 ( -0.081 5.537 3.568) 6.587 2.629 ( 0.237 -2.369 2.685) 3.589 2.751 ( 3.351 5.179 8.935) 10.857 2.969 ( -0.257 10.509 -1.316) 10.594 3.181 ( -1.056 12.751 -1.800) 12.921 3.306 ( 4.492 7.117 2.840) 8.882 3.405 ( -3.326 -3.318 -3.607) 5.923 3.524 ( -0.475 -4.071 0.365) 4.115 3.558 ( -3.956 -4.276 -1.953) 6.144 3.635 ( -1.754 0.136 -3.454) 3.876 3.743 ( -4.366 12.273 3.936) 13.608 3.902 ( -3.775 6.916 2.192) 8.179 3.945 ( 14.749 11.129 8.614) 20.386 4.002 ( -3.454 6.069 4.733) 8.436 4.431 ( 0.494 2.470 -6.746) 7.201 4.492 ( -2.403 -3.276 2.917) 5.001 4.756 ( -0.295 -4.245 4.680) 6.325 4.929 ( -1.465 0.788 4.110) 4.434 5.032 ( 3.406 5.650 1.093) 6.688 5.108 ( 1.931 5.508 1.137) 5.947 5.198 ( -2.467 -1.011 -4.883) 5.563 5.329 ( -2.486 2.559 0.074) 3.568 5.455 ( -3.844 3.997 0.514) 5.569 5.590 ( -2.268 -3.967 -2.534) 5.225 5.667 ( 1.941 -4.432 -1.456) 5.053 6.101 ( 1.890 -9.352 -1.578) 9.671 6.303 ( -0.314 0.003 0.469) 0.565 6.460 ( -3.808 -5.176 5.616) 8.534 6.497 ( 0.954 -5.585 4.072) 6.978 6.653 ( 1.684 -6.391 1.304) 6.736 6.785 ( 0.972 1.324 0.434) 1.698 6.922 ( 3.810 -1.226 1.805) 4.391 6.974 ( 4.380 -0.741 -1.296) 4.627 7.080 ( -7.578 -2.096 3.147) 8.469 7.786 ( 0.611 7.074 -1.398) 7.236 7.963 ( 0.687 0.366 -6.791) 6.836 8.170 ( 2.002 -4.003 1.573) 4.744 8.415 ( 3.212 -7.575 -0.544) 8.245 8.528 ( -1.951 0.158 3.402) 3.924 8.658 ( 2.232 5.176 -1.247) 5.773 8.795 ( -0.548 -1.997 -6.055) 6.399 8.922 ( 1.509 -3.896 -1.910) 4.594 9.196 ( 0.109 0.527 1.422) 1.520 9.255 ( -1.349 -0.383 6.344) 6.497 9.810 ( 1.542 2.596 -3.837) 4.883 10.037 ( -4.284 3.505 4.675) 7.245 10.134 ( -0.086 7.920 -0.605) 7.943 10.482 ( -2.554 -1.648 -4.543) 5.467 10.757 ( 0.309 1.972 -1.953) 2.793 10.888 ( 2.191 0.719 -1.244) 2.620 11.048 ( 2.651 -8.488 -7.260) 11.480 11.274 ( 2.945 9.300 -4.328) 10.672 11.450 ( -1.630 -4.884 -0.141) 5.151 11.546 ( 0.728 1.122 -3.998) 4.216 11.751 ( -5.881 -3.513 -2.225) 7.203 11.959 ( -6.038 -4.978 -3.700) 8.657 12.006 ( -3.088 -2.656 -5.344) 6.720 12.169 ( 4.318 -7.917 6.641) 11.200 12.327 ( 7.095 -6.693 1.957) 9.948 12.515 ( -2.854 -8.760 6.620) 11.344 13.121 ( 1.392 4.980 -3.350) 6.161 13.154 ( -0.607 -0.375 -0.064) 0.716 13.549 ( 0.154 1.162 1.317) 1.763 13.847 ( 0.727 -1.831 -1.149) 2.281 14.025 ( 2.009 -4.673 -1.909) 5.433 14.046 ( 3.798 -3.446 1.536) 5.353 14.646 ( -5.019 7.378 2.014) 9.148 14.971 ( 0.767 -2.406 -2.394) 3.480 15.571 ( 4.464 14.736 -2.505) 15.599 15.751 ( -5.348 5.036 -7.075) 10.199 15.983 ( -1.398 2.096 -2.650) 3.657 16.068 ( 2.327 -4.268 7.574) 9.000 16.602 ( 0.322 8.964 -1.479) 9.091 17.230 ( -0.776 -4.649 -6.010) 7.638 19.733 ( -1.837 -0.537 5.402) 5.731 19.857 ( 0.368 -5.303 5.884) 7.930 20.332 ( -0.103 8.123 0.189) 8.126 20.504 ( 1.126 3.090 9.215) 9.784 21.239 ( -4.049 -10.890 6.078) 13.113 21.408 ( 0.306 -12.717 6.807) 14.427 21.865 ( -1.935 0.479 5.727) 6.064 21.934 ( 0.196 -0.012 6.358) 6.361 22.658 ( -0.627 -3.529 1.559) 3.909 22.664 ( 1.076 -11.289 -2.085) 11.530 23.653 ( 0.468 4.605 0.509) 4.656 23.723 ( -0.062 6.159 -0.446) 6.175 24.269 ( 1.665 3.000 -2.847) 4.458 24.477 ( -1.301 -3.721 -3.070) 4.996 25.122 ( 0.140 11.292 -7.354) 13.477 25.168 ( 1.444 9.435 -5.216) 10.877 ======================= Grid point 65 (33/104) ======================= q-point: (-0.33 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.184 ( -10.692 15.864 2.257) 19.263 1.492 ( -8.400 18.991 13.556) 24.799 2.039 ( 10.289 -3.181 6.378) 12.517 2.266 ( 1.127 3.860 1.363) 4.246 2.361 ( 2.180 4.562 8.437) 9.836 2.463 ( -0.996 -1.017 5.090) 5.286 2.619 ( 1.452 4.773 0.403) 5.005 2.719 ( 8.094 3.578 5.740) 10.548 2.888 ( 5.563 6.191 2.624) 8.727 2.956 ( -0.517 10.357 -0.479) 10.381 3.124 ( -4.183 21.626 0.342) 22.029 3.307 ( -2.866 4.368 3.109) 6.079 3.376 ( -3.213 -3.279 -3.521) 5.786 3.459 ( -4.437 -0.508 -1.330) 4.660 3.532 ( 0.296 -2.265 0.382) 2.316 3.622 ( 5.270 -5.219 2.319) 7.771 3.708 ( 2.525 12.045 -1.915) 12.455 3.903 ( 0.401 -4.050 7.052) 8.142 3.997 ( 2.261 6.733 0.121) 7.104 4.200 ( 9.237 7.693 6.267) 13.557 4.438 ( 2.022 2.995 -6.685) 7.599 4.479 ( 0.165 -3.864 0.693) 3.930 4.765 ( -0.531 -5.125 6.302) 8.141 4.838 ( -7.160 0.734 3.895) 8.184 5.093 ( -4.611 -2.009 -2.163) 5.475 5.142 ( -5.484 8.572 -0.476) 10.187 5.171 ( 8.898 3.240 0.844) 9.507 5.227 ( -3.008 1.583 -1.196) 3.603 5.423 ( -0.511 0.592 -1.735) 1.903 5.533 ( -2.224 0.104 -0.849) 2.383 5.690 ( 0.666 -6.172 -1.258) 6.334 6.095 ( -1.435 -7.352 -1.326) 7.607 6.299 ( -1.338 2.042 1.218) 2.728 6.389 ( -3.260 -2.986 2.481) 5.069 6.515 ( -0.096 -4.842 4.756) 6.788 6.717 ( 1.692 -3.621 2.469) 4.698 6.768 ( -2.423 -1.576 1.113) 3.097 6.918 ( -4.017 -0.764 1.450) 4.339 7.023 ( 5.363 -3.155 2.202) 6.601 7.114 ( 6.679 -1.157 -1.991) 7.065 7.847 ( 5.527 6.217 -1.623) 8.475 7.956 ( 0.058 1.793 -5.413) 5.703 8.216 ( 2.420 -3.773 1.412) 4.700 8.485 ( 3.641 -7.222 1.262) 8.186 8.512 ( -0.444 -0.221 3.113) 3.152 8.670 ( -1.292 1.937 -0.555) 2.393 8.722 ( -3.333 -2.324 -2.470) 4.755 8.969 ( 2.433 -2.377 -3.010) 4.542 9.193 ( -3.186 -1.276 4.828) 5.923 9.260 ( 2.129 -0.427 3.049) 3.744 9.821 ( 1.001 4.761 -5.786) 7.560 9.955 ( -4.795 3.934 2.294) 6.613 10.104 ( -2.882 6.508 2.539) 7.557 10.485 ( 4.344 -2.295 -6.845) 8.426 10.784 ( 3.208 2.173 -0.273) 3.884 10.964 ( 5.790 0.969 -0.240) 5.875 11.041 ( -2.267 -10.962 -6.362) 12.876 11.276 ( -1.208 10.073 -2.057) 10.351 11.430 ( -0.623 -5.278 -4.186) 6.765 11.532 ( -0.526 0.476 -0.505) 0.871 11.606 ( -7.796 -5.184 -7.531) 12.015 11.855 ( -3.702 -4.374 -3.929) 6.948 11.935 ( -3.440 -1.035 -3.674) 5.139 12.252 ( 3.231 -8.039 9.222) 12.653 12.494 ( 8.463 -5.985 4.806) 11.425 12.551 ( 5.882 -5.473 0.803) 8.074 13.086 ( -6.136 0.850 -0.857) 6.254 13.131 ( -0.644 3.450 -2.345) 4.221 13.547 ( -0.621 -0.451 1.472) 1.660 13.817 ( -3.936 -3.766 -1.100) 5.557 14.045 ( 1.090 -4.685 -2.163) 5.274 14.143 ( 5.142 -2.112 3.042) 6.337 14.558 ( -4.567 8.206 -0.597) 9.411 14.943 ( -2.976 -1.673 -0.708) 3.487 15.609 ( -4.263 10.862 -7.317) 13.773 15.687 ( 5.205 5.171 -2.400) 7.719 15.924 ( -3.231 3.430 -3.779) 6.040 16.125 ( 1.115 -1.119 7.631) 7.793 16.625 ( 2.371 8.200 -2.265) 8.831 17.173 ( -3.480 -4.882 -5.966) 8.458 19.722 ( -0.687 -0.423 4.693) 4.762 19.881 ( 0.454 -6.382 6.751) 9.301 20.330 ( -0.277 7.839 1.144) 7.927 20.537 ( -0.457 -0.093 9.821) 9.832 21.163 ( -5.210 -6.517 5.769) 10.144 21.422 ( -0.562 -12.333 6.353) 13.884 21.844 ( -1.667 1.006 6.208) 6.507 21.947 ( -0.463 0.222 6.245) 6.266 22.598 ( -2.678 -5.481 0.067) 6.100 22.745 ( 4.342 -8.141 -0.314) 9.232 23.657 ( -0.202 4.661 0.701) 4.718 23.726 ( 0.429 5.589 -0.501) 5.628 24.321 ( 4.643 1.341 -2.585) 5.481 24.445 ( -1.214 -3.002 -4.184) 5.291 25.120 ( 1.613 10.988 -7.580) 13.446 25.197 ( 3.185 9.623 -5.958) 11.758 ======================= Grid point 66 (34/104) ======================= q-point: (-0.17 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.143 ( 4.747 25.445 3.117) 26.071 1.390 ( -6.149 22.364 12.873) 26.526 2.125 ( 0.585 -1.646 -2.572) 3.109 2.283 ( 0.599 6.913 8.755) 11.171 2.438 ( -0.022 -0.869 5.174) 5.247 2.472 ( -1.579 6.186 11.207) 12.898 2.644 ( 1.980 6.884 3.172) 7.834 2.845 ( -4.761 18.944 4.605) 20.069 2.890 ( 5.392 7.921 1.574) 9.711 2.938 ( 0.468 12.495 -0.316) 12.508 3.125 ( 0.449 4.015 0.060) 4.040 3.263 ( -0.874 6.132 -0.380) 6.205 3.292 ( -3.399 -6.770 -1.593) 7.741 3.450 ( 1.520 -0.294 -0.707) 1.701 3.570 ( 3.784 -4.693 2.429) 6.500 3.690 ( 0.611 -2.737 -0.594) 2.867 3.845 ( 6.755 -1.330 5.387) 8.742 3.940 ( 4.263 5.485 2.351) 7.334 4.065 ( 4.986 5.519 -1.851) 7.665 4.300 ( 0.885 0.886 2.594) 2.881 4.478 ( -1.346 -0.386 2.621) 2.971 4.488 ( 4.675 4.436 -8.063) 10.322 4.716 ( -5.934 -0.626 5.726) 8.270 4.761 ( -1.460 -8.898 7.724) 11.873 4.954 ( -8.260 1.537 -1.056) 8.468 5.012 ( -4.501 3.972 -0.290) 6.010 5.212 ( -0.661 3.088 -3.456) 4.681 5.330 ( 6.559 0.484 2.084) 6.899 5.451 ( 4.586 0.568 0.145) 4.623 5.517 ( -0.461 3.200 -0.924) 3.363 5.676 ( -2.049 -8.254 -0.386) 8.513 6.050 ( -2.868 -5.497 -2.012) 6.519 6.268 ( -1.063 9.180 0.349) 9.248 6.369 ( -0.061 -3.713 1.010) 3.849 6.520 ( -0.865 -4.338 5.683) 7.202 6.624 ( -8.162 1.621 2.499) 8.688 6.762 ( 0.002 -5.227 2.992) 6.023 6.928 ( 2.292 -5.780 0.234) 6.222 7.136 ( 6.019 -0.388 -7.622) 9.720 7.214 ( 4.608 -4.085 1.266) 6.286 7.934 ( 0.950 4.622 -2.882) 5.529 7.949 ( 3.199 4.549 -2.825) 6.237 8.266 ( 2.791 -2.501 1.713) 4.121 8.477 ( -5.902 -3.143 0.581) 6.712 8.508 ( -0.676 0.839 -2.107) 2.367 8.680 ( 3.231 -9.147 6.324) 11.580 8.701 ( 0.572 0.622 1.135) 1.415 8.949 ( -4.572 -3.594 -3.338) 6.705 9.147 ( -1.205 0.382 4.432) 4.608 9.319 ( 2.722 -1.434 1.560) 3.450 9.798 ( -2.373 6.844 -6.850) 9.969 9.922 ( 1.988 2.549 0.159) 3.237 10.063 ( -2.259 4.161 5.261) 7.078 10.586 ( 7.492 -1.904 -5.905) 9.728 10.865 ( 3.637 -0.271 2.240) 4.280 10.957 ( -3.608 -7.325 -4.825) 9.485 11.062 ( 3.116 1.605 -0.690) 3.572 11.238 ( -2.644 -1.155 -2.657) 3.922 11.351 ( -4.356 -1.058 -2.583) 5.174 11.480 ( -1.085 -2.468 -7.179) 7.669 11.613 ( 7.598 -1.896 0.629) 7.856 11.743 ( -6.504 -6.299 -9.377) 13.035 11.913 ( 0.592 1.560 4.678) 4.967 12.331 ( 1.973 -7.416 8.869) 11.729 12.620 ( 6.076 -1.069 3.721) 7.204 12.731 ( 11.252 -3.082 -1.825) 11.808 12.921 ( -10.666 1.432 -1.443) 10.858 13.080 ( -4.610 1.616 -3.100) 5.785 13.542 ( -0.088 -2.372 1.334) 2.723 13.704 ( -7.233 -5.815 -0.640) 9.302 14.052 ( 0.092 -2.268 -3.175) 3.903 14.204 ( -0.117 -2.732 -2.852) 3.951 14.498 ( -0.519 8.292 1.564) 8.454 14.887 ( -2.533 0.497 2.168) 3.371 15.512 ( -2.996 10.704 -7.664) 13.501 15.793 ( 5.577 2.443 -7.654) 9.780 15.872 ( -1.418 5.474 2.308) 6.108 16.142 ( -0.853 -0.371 6.288) 6.356 16.663 ( 2.126 6.853 -3.368) 7.926 17.095 ( -2.775 -5.229 -4.415) 7.385 19.729 ( 0.184 -0.582 4.406) 4.448 19.902 ( -0.285 -6.842 7.732) 10.329 20.328 ( -0.305 7.844 1.624) 8.016 20.523 ( -3.750 -0.682 10.029) 10.729 21.103 ( -2.336 -2.218 7.987) 8.612 21.420 ( -1.133 -11.812 5.119) 12.923 21.836 ( -1.003 1.252 7.298) 7.472 21.947 ( -1.109 0.234 5.784) 5.894 22.563 ( -1.222 -3.505 0.231) 3.719 22.809 ( 2.508 -8.118 -0.297) 8.501 23.650 ( -0.612 4.883 0.220) 4.926 23.733 ( 0.399 4.466 -0.341) 4.496 24.409 ( -1.194 -2.162 -6.500) 6.953 24.416 ( 5.409 -2.536 -1.499) 6.159 25.137 ( 1.951 10.399 -7.442) 12.936 25.254 ( 4.506 8.577 -8.518) 12.900 ======================= Grid point 67 (35/104) ======================= q-point: ( 0.00 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.704 ( 1.967 17.295 3.496) 17.754 1.843 ( -3.152 19.939 2.640) 20.358 2.037 ( 2.394 -5.739 0.634) 6.251 2.299 ( -2.188 -11.561 4.325) 12.536 2.406 ( -2.038 -0.387 5.694) 6.060 2.420 ( -3.083 -2.902 6.762) 7.979 2.819 ( -0.501 5.814 6.226) 8.533 2.908 ( -1.317 -2.734 4.612) 5.521 3.107 ( -2.565 4.098 -2.642) 5.510 3.119 ( 0.907 3.332 -4.400) 5.594 3.205 ( 0.116 7.448 -2.188) 7.763 3.308 ( -0.912 -0.832 -4.831) 4.986 3.387 ( 2.230 2.279 -2.157) 3.849 3.470 ( -2.361 -5.208 -3.158) 6.532 3.650 ( 1.633 5.363 2.739) 6.240 3.661 ( -1.865 3.804 7.761) 8.842 3.801 ( -1.450 11.766 13.366) 17.866 4.127 ( 0.743 1.626 -1.206) 2.157 4.169 ( -0.311 -0.392 -2.336) 2.389 4.300 ( -1.978 -15.358 1.641) 15.571 4.418 ( 6.253 4.854 -2.030) 8.171 4.507 ( 3.294 -4.005 4.030) 6.567 4.667 ( -4.197 6.157 8.876) 11.589 4.805 ( 4.665 -3.519 10.749) 12.235 5.000 ( 3.624 10.261 1.053) 10.933 5.045 ( -0.565 4.190 -0.112) 4.229 5.183 ( -1.603 -2.476 -3.638) 4.683 5.315 ( -2.575 -11.338 -0.306) 11.631 5.439 ( -0.051 2.981 1.376) 3.284 5.506 ( 1.544 -4.018 0.503) 4.334 5.750 ( 0.257 10.340 -2.592) 10.663 5.909 ( -1.848 -4.409 -4.714) 6.714 6.317 ( 0.284 0.479 -0.855) 1.021 6.372 ( 0.654 -4.000 0.445) 4.078 6.547 ( -0.974 4.920 2.834) 5.760 6.554 ( -1.722 1.232 4.125) 4.637 6.690 ( -0.119 2.014 3.671) 4.189 6.823 ( 0.323 -6.027 0.685) 6.075 7.072 ( -3.319 -3.766 -2.646) 5.674 7.117 ( 1.270 -7.919 -2.292) 8.341 8.020 ( -0.520 3.488 -3.195) 4.759 8.056 ( -0.366 0.924 -3.584) 3.720 8.328 ( 0.912 0.884 0.378) 1.325 8.340 ( -1.645 0.691 1.655) 2.434 8.507 ( -0.635 1.049 0.629) 1.378 8.570 ( -0.081 -5.087 3.319) 6.075 8.730 ( -0.961 1.189 -2.060) 2.565 8.774 ( -1.554 -3.178 -4.047) 5.376 9.201 ( 1.720 2.154 4.848) 5.577 9.272 ( 0.783 -4.313 3.805) 5.805 9.872 ( -1.945 5.690 -6.117) 8.578 9.963 ( 0.490 -2.869 -3.950) 4.907 10.287 ( 2.951 14.286 1.305) 14.646 10.575 ( 3.112 -11.010 -1.710) 11.569 10.817 ( 0.168 0.795 -3.537) 3.629 10.864 ( -1.425 -2.678 -1.887) 3.572 11.034 ( -2.766 0.843 -3.945) 4.891 11.087 ( -0.052 -4.130 -3.649) 5.511 11.379 ( 3.316 2.321 1.008) 4.172 11.458 ( -1.345 -5.007 -1.175) 5.316 11.583 ( 4.864 3.405 -4.889) 7.691 11.675 ( 5.613 -4.890 -3.997) 8.450 12.039 ( -0.009 5.528 9.043) 10.599 12.173 ( -3.254 -6.941 7.440) 10.683 12.769 ( -12.804 3.817 -1.316) 13.426 12.826 ( 11.567 2.844 1.631) 12.022 12.865 ( -12.964 -4.739 -1.946) 13.940 12.891 ( 12.123 -2.981 -1.267) 12.548 13.518 ( 0.081 -0.128 0.239) 0.283 13.533 ( -0.425 -1.574 0.183) 1.641 14.033 ( -2.514 2.092 -4.576) 5.625 14.090 ( -3.658 -2.563 -6.235) 7.670 14.707 ( 3.758 6.141 3.601) 8.050 14.823 ( 0.783 -4.424 2.456) 5.120 15.713 ( 3.206 8.119 -5.123) 10.121 15.823 ( 2.670 -2.775 -3.762) 5.383 15.985 ( -1.994 5.319 2.395) 6.165 16.074 ( -3.622 -3.202 2.743) 5.558 16.805 ( 0.675 6.138 -3.507) 7.101 16.945 ( 1.500 -6.883 -3.107) 7.700 19.747 ( -0.285 1.233 5.788) 5.925 19.799 ( -0.702 -3.661 6.847) 7.796 20.491 ( 0.272 6.114 0.387) 6.132 20.541 ( -0.576 1.577 3.447) 3.834 21.076 ( -0.843 0.551 8.747) 8.805 21.180 ( -1.405 -8.892 5.977) 10.806 21.874 ( -0.770 1.938 6.408) 6.739 21.916 ( -1.154 -1.806 5.584) 5.981 22.557 ( -0.410 3.108 1.217) 3.363 22.667 ( -0.526 -6.838 1.174) 6.958 23.734 ( -0.292 3.627 -0.467) 3.669 23.778 ( -0.006 -0.239 -0.422) 0.485 24.357 ( -0.432 0.715 -3.441) 3.541 24.400 ( 1.363 -3.354 -2.005) 4.139 25.315 ( 1.088 5.325 -6.948) 8.822 25.368 ( 0.986 0.497 -8.453) 8.525 ======================= Grid point 68 (36/104) ======================= q-point: ( 0.17 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.705 ( -5.257 18.967 2.602) 19.853 1.784 ( -0.214 14.849 5.071) 15.692 2.082 ( 1.949 -7.166 1.065) 7.502 2.175 ( -10.905 -10.944 5.022) 16.245 2.365 ( -3.083 0.731 4.446) 5.460 2.393 ( -1.155 -2.130 4.818) 5.393 2.793 ( -4.225 4.932 5.471) 8.491 2.848 ( -6.207 -1.024 5.364) 8.267 3.053 ( -1.839 8.465 -4.779) 9.894 3.130 ( 0.257 6.169 -2.625) 6.709 3.245 ( 3.234 -3.690 -1.289) 5.073 3.261 ( -1.785 -1.733 -0.805) 2.615 3.386 ( -4.145 0.562 -3.521) 5.468 3.447 ( 3.663 -4.217 -4.581) 7.224 3.581 ( -6.425 -0.049 5.059) 8.178 3.641 ( -4.156 -4.531 1.659) 6.368 3.884 ( 6.888 23.904 12.411) 27.801 4.129 ( -1.315 5.821 -2.382) 6.425 4.180 ( 1.950 2.243 -0.763) 3.068 4.276 ( -0.367 -0.849 5.404) 5.483 4.503 ( 0.826 -0.316 -0.126) 0.893 4.528 ( -0.960 -1.864 0.422) 2.138 4.645 ( -0.594 0.714 9.107) 9.154 4.826 ( -2.552 -10.239 11.393) 15.529 5.043 ( 1.012 4.091 -1.893) 4.620 5.141 ( 0.053 -3.320 -4.451) 5.553 5.205 ( 13.440 9.723 3.941) 17.050 5.340 ( -2.839 0.825 3.026) 4.230 5.432 ( 5.456 -2.105 -0.113) 5.849 5.496 ( -2.200 -6.385 1.244) 6.867 5.734 ( -1.184 7.790 -2.435) 8.247 5.863 ( -1.410 -4.214 -4.943) 6.647 6.333 ( 1.346 0.106 -0.756) 1.548 6.387 ( 0.211 -4.211 1.905) 4.627 6.482 ( -4.279 5.828 0.839) 7.279 6.596 ( -0.663 -5.300 1.921) 5.677 6.706 ( 3.144 5.379 3.769) 7.281 6.809 ( -1.030 -4.293 2.065) 4.874 6.982 ( -5.125 -0.981 -2.249) 5.682 7.102 ( -1.791 -10.259 -2.207) 10.645 7.993 ( -1.848 2.402 -3.084) 4.324 8.019 ( -1.710 0.693 -2.000) 2.721 8.251 ( -5.644 3.618 -0.085) 6.704 8.327 ( -3.675 -3.449 -2.631) 5.686 8.537 ( 3.716 2.633 2.433) 5.163 8.595 ( 3.313 -1.622 1.850) 4.126 8.710 ( 0.344 1.559 -3.312) 3.677 8.779 ( 1.442 -5.465 -4.475) 7.209 9.239 ( 0.620 1.193 6.218) 6.362 9.277 ( -1.558 -2.080 4.340) 5.059 9.838 ( 0.366 5.655 -6.868) 8.904 9.960 ( 0.668 -5.383 -4.216) 6.870 10.346 ( 2.231 13.232 2.562) 13.661 10.585 ( -1.745 -8.049 0.976) 8.293 10.805 ( -0.046 0.887 -3.259) 3.378 10.851 ( 0.369 -3.198 -2.933) 4.355 10.997 ( -0.489 3.205 -6.359) 7.138 11.095 ( 2.869 -5.630 -6.817) 9.295 11.458 ( 2.956 2.064 -2.198) 4.223 11.501 ( 7.640 -1.031 1.957) 7.953 11.698 ( 6.726 0.556 2.225) 7.106 11.755 ( 3.659 -4.083 -0.734) 5.531 12.026 ( -3.908 1.213 5.507) 6.861 12.077 ( -7.383 -3.869 4.507) 9.476 12.520 ( -13.722 2.847 -1.538) 14.098 12.629 ( -11.842 -6.774 1.714) 13.749 13.024 ( 9.028 3.095 -0.219) 9.546 13.074 ( 7.684 -1.172 -2.680) 8.222 13.535 ( 2.204 1.601 0.534) 2.776 13.590 ( 5.646 -3.533 0.023) 6.660 13.973 ( -2.198 0.935 -4.570) 5.156 14.006 ( -3.051 -1.527 -5.828) 6.753 14.798 ( 4.128 3.005 3.589) 6.241 14.846 ( 0.963 -1.495 1.230) 2.162 15.758 ( 1.895 8.217 -3.925) 9.301 15.853 ( 1.189 -1.903 2.182) 3.130 15.978 ( 1.150 2.839 -2.353) 3.863 16.011 ( -2.962 -2.034 0.830) 3.688 16.813 ( 0.946 7.861 -3.173) 8.530 16.992 ( 3.919 -8.681 -3.113) 10.020 19.751 ( -0.857 0.865 6.125) 6.244 19.795 ( -1.557 -3.075 6.825) 7.646 20.497 ( 0.314 6.250 -0.153) 6.259 20.544 ( -0.087 2.195 3.692) 4.296 21.087 ( -0.397 -1.299 9.108) 9.208 21.167 ( -1.445 -8.389 5.659) 10.222 21.877 ( -0.574 1.331 6.581) 6.739 21.909 ( -1.063 -1.456 5.297) 5.596 22.546 ( -0.885 2.297 1.107) 2.699 22.642 ( -2.264 -6.357 1.049) 6.829 23.731 ( 0.118 3.750 -0.555) 3.793 23.778 ( 0.152 -0.386 -0.584) 0.716 24.340 ( -0.506 2.243 -3.133) 3.886 24.410 ( 0.330 -4.414 -2.011) 4.862 25.312 ( 0.494 4.896 -6.716) 8.326 25.350 ( -0.563 1.569 -8.071) 8.241 ======================= Grid point 69 (37/104) ======================= q-point: ( 0.33 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.630 ( -1.599 12.472 4.291) 13.286 1.783 ( -4.345 3.724 2.631) 6.298 1.984 ( -6.579 2.820 8.408) 11.042 2.145 ( 2.183 -6.719 5.415) 8.901 2.342 ( 0.452 1.738 1.464) 2.317 2.401 ( 1.113 -4.249 2.986) 5.311 2.681 ( -7.772 4.299 2.887) 9.339 2.741 ( -6.596 -0.450 6.923) 9.573 2.983 ( -4.067 12.198 -0.529) 12.869 3.138 ( 1.450 6.378 -0.958) 6.610 3.231 ( -3.488 -8.814 2.252) 9.743 3.271 ( 2.326 -5.496 -1.454) 6.143 3.384 ( 2.202 3.507 -3.641) 5.514 3.453 ( -3.783 -2.047 0.970) 4.410 3.507 ( 1.661 -4.450 -2.447) 5.343 3.545 ( -6.164 -6.011 -0.772) 8.644 4.066 ( 7.645 20.215 8.992) 23.408 4.078 ( -2.162 11.620 -2.656) 12.115 4.221 ( 1.864 3.521 0.675) 4.041 4.271 ( -1.551 11.825 3.554) 12.445 4.484 ( -1.765 0.024 -3.413) 3.843 4.503 ( -0.540 -5.379 4.432) 6.991 4.646 ( -2.439 -2.050 7.504) 8.153 4.809 ( -2.270 -12.594 10.163) 16.342 5.091 ( 3.685 5.263 -2.976) 7.081 5.151 ( -0.277 -0.710 -4.064) 4.134 5.252 ( -2.883 3.896 2.381) 5.400 5.391 ( -0.165 -4.451 2.866) 5.296 5.461 ( 5.859 5.792 2.679) 8.663 5.604 ( 7.019 -1.976 -0.552) 7.313 5.689 ( -3.310 6.694 -1.963) 7.721 5.845 ( 0.687 -7.868 -2.116) 8.176 6.354 ( 0.105 0.009 -0.246) 0.268 6.384 ( -1.252 -2.327 2.030) 3.332 6.408 ( -2.149 2.024 3.511) 4.587 6.522 ( -5.053 -7.541 1.262) 9.165 6.809 ( 1.446 0.377 2.660) 3.052 6.825 ( 5.105 -1.103 1.307) 5.384 6.896 ( -2.780 2.713 -1.123) 4.043 7.061 ( -2.244 -9.044 0.536) 9.333 7.944 ( -2.341 3.728 -1.680) 4.712 7.990 ( -1.236 -0.145 -2.068) 2.413 8.158 ( -3.377 2.875 0.080) 4.436 8.251 ( -2.330 -5.759 -2.481) 6.689 8.606 ( 1.675 5.250 0.801) 5.568 8.678 ( 4.768 1.902 -1.259) 5.285 8.740 ( 3.949 -0.937 -2.489) 4.761 8.778 ( -0.312 -6.975 -5.147) 8.674 9.237 ( -2.772 0.528 5.235) 5.947 9.251 ( -1.685 -0.719 5.738) 6.024 9.855 ( 2.857 4.882 -6.334) 8.492 9.977 ( 2.137 -6.169 -3.854) 7.581 10.364 ( -1.055 10.844 2.317) 11.138 10.533 ( -3.822 -4.409 0.875) 5.900 10.800 ( 0.145 1.795 -3.000) 3.499 10.857 ( 0.862 -4.075 -2.528) 4.872 10.979 ( 0.712 5.765 -7.579) 9.550 11.149 ( 4.626 -8.542 -9.337) 13.474 11.540 ( 5.169 7.448 0.072) 9.067 11.617 ( 3.205 2.860 0.886) 4.386 11.784 ( -0.508 -0.086 2.358) 2.414 11.832 ( 5.222 -3.484 2.011) 6.592 11.935 ( -3.374 -6.503 0.314) 7.333 11.971 ( -5.396 -6.717 -0.123) 8.617 12.300 ( -8.213 4.664 1.765) 9.608 12.441 ( -9.302 -8.047 4.698) 13.167 13.144 ( 4.359 2.218 -1.574) 5.138 13.163 ( 3.269 0.772 -3.213) 4.648 13.589 ( 2.682 4.020 0.618) 4.872 13.701 ( 5.168 -6.042 -0.493) 7.966 13.945 ( 0.214 0.260 -2.157) 2.184 13.969 ( 0.341 -1.199 -2.347) 2.658 14.827 ( -1.226 3.576 1.666) 4.131 14.885 ( 2.373 -2.049 0.003) 3.135 15.753 ( -1.101 6.525 -0.520) 6.638 15.858 ( -2.685 -4.210 1.441) 5.197 15.989 ( 2.960 3.486 -0.865) 4.654 16.022 ( 2.473 0.812 -3.494) 4.357 16.822 ( 0.708 10.579 -2.901) 10.992 17.051 ( 2.807 -10.324 -3.865) 11.375 19.745 ( -1.377 0.502 6.290) 6.458 19.779 ( -1.708 -2.541 6.563) 7.242 20.500 ( 0.064 6.434 -0.607) 6.462 20.553 ( 0.130 1.832 3.141) 3.639 21.099 ( -0.837 -2.860 9.036) 9.515 21.159 ( -0.783 -8.079 6.558) 10.436 21.883 ( -0.630 0.705 6.359) 6.429 21.905 ( -0.648 -1.153 5.301) 5.464 22.537 ( -0.224 0.474 1.100) 1.219 22.600 ( -2.370 -4.868 1.413) 5.596 23.735 ( 0.429 3.667 -0.343) 3.708 23.780 ( 0.243 -0.227 -0.597) 0.683 24.326 ( -0.133 2.995 -2.723) 4.050 24.405 ( -0.269 -4.427 -2.146) 4.927 25.304 ( 0.437 4.278 -6.664) 7.931 25.318 ( -0.507 3.131 -7.372) 8.025 ======================= Grid point 70 (38/104) ======================= q-point: (-0.50 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.604 ( -5.634 7.643 1.114) 9.560 1.723 ( 3.267 -3.227 3.701) 5.898 1.951 ( -2.375 14.032 11.590) 18.354 2.195 ( 1.032 -7.202 8.471) 11.167 2.392 ( 3.328 0.553 0.754) 3.457 2.428 ( 0.145 -3.347 1.566) 3.698 2.615 ( 1.817 4.442 4.838) 6.814 2.678 ( -0.310 0.390 7.288) 7.305 2.946 ( 0.404 11.458 2.156) 11.666 3.157 ( 0.475 1.296 -2.845) 3.163 3.197 ( -0.172 -3.684 2.059) 4.223 3.292 ( -3.346 -3.884 0.343) 5.137 3.337 ( 0.827 -0.115 -0.047) 0.836 3.424 ( -5.064 -6.025 -3.223) 8.505 3.491 ( 3.522 0.799 -1.040) 3.759 3.554 ( 3.443 -4.845 -1.337) 6.093 4.038 ( -0.050 11.848 -4.365) 12.626 4.137 ( -0.118 4.467 -1.637) 4.758 4.244 ( -5.478 17.502 5.553) 19.162 4.289 ( 3.437 13.366 6.790) 15.381 4.438 ( -2.945 -1.687 -0.513) 3.433 4.492 ( -0.919 0.554 1.280) 1.670 4.620 ( -1.408 -4.134 7.180) 8.404 4.795 ( -1.517 -12.288 8.439) 14.984 5.105 ( -0.350 0.727 -4.218) 4.294 5.109 ( -2.346 -0.761 -4.032) 4.727 5.257 ( 0.737 4.270 2.256) 4.885 5.369 ( -0.407 -6.825 1.752) 7.058 5.576 ( 3.051 13.895 1.336) 14.288 5.600 ( -4.805 5.058 -1.098) 7.062 5.657 ( -0.443 -0.238 -3.450) 3.486 5.870 ( 1.501 -12.306 0.576) 12.410 6.328 ( -0.400 2.109 0.831) 2.302 6.388 ( -1.040 -3.241 2.287) 4.101 6.412 ( 1.222 -0.192 4.760) 4.918 6.495 ( 2.211 -7.030 3.602) 8.203 6.808 ( -1.702 0.780 1.288) 2.272 6.854 ( 1.259 -3.876 1.684) 4.410 6.959 ( 5.489 0.548 -0.331) 5.526 7.008 ( -4.067 -3.711 2.083) 5.886 7.918 ( 0.502 4.772 -0.928) 4.887 7.971 ( 0.231 -0.295 -2.769) 2.794 8.144 ( 1.496 1.986 1.068) 2.706 8.248 ( 2.111 -7.169 -0.001) 7.473 8.594 ( -1.877 5.291 -2.353) 6.087 8.717 ( -3.287 -5.194 -5.484) 8.238 8.757 ( 3.089 3.726 -1.793) 5.162 8.833 ( 4.678 -3.738 -0.845) 6.047 9.204 ( -1.627 0.502 3.950) 4.302 9.227 ( -2.482 -1.613 6.549) 7.187 9.898 ( 2.964 4.873 -5.657) 8.034 10.003 ( 0.996 -4.615 -2.686) 5.432 10.326 ( -3.051 8.555 0.490) 9.096 10.460 ( -3.366 -3.043 -1.770) 4.870 10.800 ( 0.779 2.339 -2.549) 3.546 10.868 ( 0.965 -4.464 -1.710) 4.877 10.989 ( 2.209 7.295 -7.010) 10.355 11.208 ( 3.790 -10.999 -9.349) 14.925 11.568 ( -3.058 11.038 -2.540) 11.733 11.635 ( -0.471 5.623 -1.264) 5.783 11.709 ( -7.264 -1.144 0.063) 7.354 11.798 ( -5.299 -9.182 -2.852) 10.978 11.932 ( 2.260 -2.717 -1.138) 3.713 11.993 ( 3.524 -7.538 5.195) 9.810 12.268 ( 3.663 0.941 4.182) 5.638 12.346 ( -0.930 -6.217 6.638) 9.142 13.181 ( 0.180 1.872 -1.857) 2.643 13.193 ( 0.925 1.271 -3.033) 3.416 13.613 ( -0.405 4.829 0.281) 4.854 13.746 ( -0.236 -7.030 -1.148) 7.127 13.969 ( 2.420 0.943 0.314) 2.616 14.008 ( 3.696 -1.902 1.200) 4.327 14.790 ( -2.860 6.019 -0.334) 6.672 14.901 ( -0.638 -4.403 -0.439) 4.471 15.735 ( -0.629 3.588 -0.156) 3.646 15.788 ( -3.572 -1.257 -2.923) 4.783 16.043 ( 1.041 3.101 -1.599) 3.641 16.066 ( 3.663 1.061 0.484) 3.844 16.823 ( 0.189 11.557 -2.949) 11.929 17.064 ( -0.366 -10.405 -4.597) 11.381 19.734 ( -1.380 0.718 6.026) 6.223 19.770 ( -0.905 -2.850 6.422) 7.084 20.497 ( -0.249 6.486 -0.562) 6.515 20.560 ( -0.189 0.837 2.374) 2.525 21.097 ( -1.662 -2.155 8.530) 8.954 21.170 ( -0.190 -8.619 7.859) 11.666 21.881 ( -1.075 1.165 5.672) 5.889 21.913 ( -0.081 -1.643 5.909) 6.134 22.541 ( -0.004 -0.936 0.915) 1.309 22.579 ( 0.180 -3.489 2.163) 4.109 23.742 ( 0.333 3.470 -0.017) 3.486 23.783 ( 0.156 0.028 -0.469) 0.495 24.325 ( 0.693 2.697 -2.458) 3.714 24.393 ( -0.323 -3.768 -2.472) 4.518 25.294 ( 0.476 4.560 -7.172) 8.512 25.309 ( 1.280 3.184 -6.706) 7.534 ======================= Grid point 71 (39/104) ======================= q-point: (-0.33 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.551 ( 1.433 16.930 0.397) 16.995 1.831 ( 4.560 -1.719 2.739) 5.590 1.932 ( -0.704 8.025 8.923) 12.022 2.219 ( -0.199 -9.680 8.299) 12.752 2.417 ( -0.360 0.598 6.847) 6.883 2.434 ( -0.538 -1.162 4.767) 4.936 2.713 ( 4.822 5.352 3.833) 8.160 2.779 ( 7.298 0.515 5.335) 9.055 3.020 ( 6.497 8.565 0.701) 10.773 3.140 ( -0.760 5.977 -2.455) 6.506 3.236 ( 4.038 -8.671 -1.065) 9.624 3.260 ( -0.856 -4.738 0.874) 4.893 3.307 ( -0.531 2.581 -1.574) 3.069 3.430 ( 3.931 -7.697 -1.529) 8.777 3.537 ( 1.945 4.138 -0.226) 4.578 3.617 ( 2.911 -2.378 2.279) 4.396 4.033 ( -10.924 20.046 5.394) 23.458 4.077 ( 0.154 14.236 -2.882) 14.525 4.135 ( 0.763 4.228 -3.912) 5.810 4.318 ( -2.168 1.007 6.566) 6.988 4.411 ( -0.556 -2.924 -1.122) 3.180 4.476 ( -1.342 -3.760 -0.248) 4.000 4.614 ( -1.113 -1.437 7.441) 7.660 4.784 ( -2.319 -8.493 7.015) 11.257 5.045 ( -2.224 0.942 -4.418) 5.035 5.111 ( 1.146 -3.744 -3.019) 4.944 5.285 ( 2.552 4.203 3.322) 5.934 5.373 ( 0.054 -3.881 -0.159) 3.885 5.436 ( -10.262 10.414 0.446) 14.628 5.596 ( -4.942 -4.657 -1.355) 6.925 5.660 ( 4.184 10.929 -1.074) 11.752 5.897 ( 1.721 -10.381 -0.271) 10.526 6.341 ( 0.272 0.990 1.528) 1.841 6.377 ( -0.233 -0.994 0.722) 1.250 6.461 ( 2.915 3.001 5.085) 6.584 6.587 ( 5.387 -6.958 4.462) 9.866 6.766 ( -3.024 0.884 -0.173) 3.155 6.839 ( -5.842 -5.699 2.126) 8.434 6.978 ( 2.986 0.983 2.265) 3.874 7.048 ( 4.011 -4.402 -0.282) 5.962 7.960 ( 3.932 3.692 -1.700) 5.655 7.989 ( 2.157 0.756 -2.635) 3.488 8.201 ( 3.656 2.642 2.026) 4.945 8.315 ( 4.400 -7.400 1.844) 8.804 8.550 ( -2.022 2.971 -1.079) 3.752 8.624 ( -4.932 -3.737 -3.371) 7.047 8.781 ( -0.194 4.992 -1.790) 5.307 8.889 ( 1.121 -4.805 -1.819) 5.259 9.182 ( -2.273 0.401 4.897) 5.413 9.215 ( 0.348 -2.545 3.748) 4.544 9.928 ( 1.851 4.105 -5.367) 7.006 9.987 ( -2.092 -1.147 -1.651) 2.901 10.274 ( -2.176 9.041 -0.622) 9.320 10.432 ( 1.760 -4.535 -4.217) 6.438 10.822 ( 2.115 1.596 -0.839) 2.779 10.870 ( -0.690 -4.073 -2.425) 4.791 11.028 ( 3.610 5.674 -4.810) 8.268 11.217 ( -1.284 -10.592 -7.476) 13.028 11.506 ( -1.421 5.138 -10.120) 11.438 11.542 ( -6.659 0.724 -3.309) 7.471 11.564 ( -6.231 3.562 2.234) 7.517 11.731 ( -4.386 -7.537 -3.336) 9.336 11.946 ( 1.049 3.191 2.877) 4.422 12.074 ( 3.714 -8.098 7.530) 11.665 12.417 ( 9.638 -1.202 4.700) 10.790 12.444 ( 9.092 -3.637 3.594) 10.431 13.137 ( -4.750 3.048 -2.018) 5.993 13.175 ( -2.437 0.102 -2.939) 3.820 13.581 ( -2.715 3.532 0.460) 4.478 13.693 ( -4.867 -6.633 -0.711) 8.258 14.023 ( 2.938 2.234 0.820) 3.780 14.089 ( 4.099 -3.151 1.587) 5.408 14.726 ( -3.613 7.385 -1.266) 8.318 14.866 ( -2.707 -5.549 -0.095) 6.175 15.707 ( -1.811 3.032 -3.714) 5.125 15.755 ( 1.058 -0.729 -3.730) 3.945 16.041 ( -0.748 5.927 0.007) 5.974 16.118 ( 1.114 -1.145 2.842) 3.260 16.815 ( -0.097 9.697 -3.339) 10.256 17.021 ( -2.768 -9.068 -4.649) 10.559 19.729 ( -0.642 1.149 5.649) 5.801 19.776 ( -0.232 -3.481 6.493) 7.371 20.490 ( -0.301 6.346 -0.037) 6.353 20.557 ( -0.701 0.184 2.117) 2.237 21.085 ( -1.767 -0.237 8.649) 8.831 21.183 ( -0.499 -9.124 7.706) 11.953 21.876 ( -0.953 1.978 5.761) 6.166 21.923 ( -0.494 -2.179 5.959) 6.365 22.543 ( 0.209 0.830 1.325) 1.578 22.612 ( 2.245 -4.958 1.975) 5.789 23.745 ( -0.052 3.335 0.145) 3.339 23.783 ( -0.052 0.133 -0.375) 0.401 24.341 ( 1.687 1.209 -2.334) 3.124 24.382 ( -0.175 -2.636 -2.892) 3.917 25.294 ( 1.404 5.091 -7.188) 8.919 25.326 ( 2.347 2.250 -7.197) 7.897 ======================= Grid point 72 (40/104) ======================= q-point: (-0.17 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.634 ( 5.487 19.921 0.107) 20.663 1.853 ( -0.844 18.348 7.362) 19.787 1.991 ( 3.033 -8.253 0.218) 8.795 2.261 ( 3.026 -11.612 5.739) 13.302 2.425 ( -1.494 -0.169 6.598) 6.767 2.433 ( -0.676 -2.280 8.824) 9.139 2.788 ( 2.343 6.580 4.521) 8.320 2.885 ( 2.561 -2.053 4.619) 5.666 3.094 ( 1.669 5.821 -3.003) 6.759 3.162 ( -0.162 5.538 -1.718) 5.801 3.204 ( 0.737 -0.507 -2.184) 2.360 3.316 ( 1.200 -0.370 -5.880) 6.013 3.368 ( 3.302 -3.128 3.212) 5.568 3.475 ( 1.496 -5.927 -2.930) 6.779 3.578 ( 2.888 12.461 -0.344) 12.796 3.664 ( 0.797 1.612 6.758) 6.993 3.840 ( -7.600 14.510 13.596) 21.287 4.117 ( 1.308 4.990 -4.170) 6.633 4.180 ( 4.143 2.581 -6.183) 7.878 4.265 ( -1.603 -5.790 4.811) 7.696 4.412 ( -1.404 -6.709 -4.216) 8.047 4.440 ( 0.360 -6.935 5.268) 8.717 4.650 ( 3.541 4.594 7.414) 9.414 4.745 ( -3.069 -1.211 7.068) 7.800 5.008 ( -1.140 4.292 -3.193) 5.469 5.104 ( -3.078 -2.266 -0.584) 3.866 5.241 ( -6.864 6.692 -0.339) 9.592 5.356 ( 2.247 -1.708 2.867) 4.023 5.406 ( 1.961 -0.266 0.219) 1.991 5.497 ( -3.658 -7.907 -0.396) 8.722 5.726 ( 3.008 11.780 -1.855) 12.299 5.927 ( 1.141 -6.807 -2.329) 7.284 6.330 ( -1.229 0.699 0.120) 1.419 6.373 ( -0.516 -2.068 0.262) 2.147 6.521 ( 1.311 6.404 4.878) 8.157 6.645 ( -3.344 -4.685 4.236) 7.147 6.685 ( -3.001 3.070 1.358) 4.503 6.788 ( 2.030 -6.257 0.150) 6.579 7.063 ( 4.475 -3.437 0.374) 5.655 7.098 ( 1.124 -5.442 -1.210) 5.687 8.020 ( 1.654 2.862 -3.120) 4.545 8.031 ( 3.425 2.114 -2.820) 4.914 8.269 ( 3.063 3.104 2.314) 4.937 8.378 ( 0.338 -6.121 0.522) 6.152 8.523 ( -1.077 0.896 1.322) 1.927 8.556 ( -0.926 -2.747 1.762) 3.392 8.754 ( -1.550 3.989 -2.611) 5.013 8.853 ( -4.095 -5.011 -2.468) 6.926 9.169 ( 0.128 2.133 4.047) 4.576 9.242 ( 1.389 -4.401 3.008) 5.509 9.925 ( -1.910 3.427 -4.939) 6.307 9.956 ( 0.807 0.182 -3.078) 3.188 10.253 ( 0.323 12.623 -0.165) 12.628 10.495 ( 5.333 -8.221 -3.804) 10.512 10.833 ( -1.325 -0.243 -2.697) 3.015 10.869 ( 1.767 -2.035 -0.635) 2.769 11.073 ( 1.150 0.444 -2.298) 2.608 11.135 ( -4.698 -5.672 -5.316) 9.083 11.407 ( -5.656 4.216 -1.547) 7.222 11.457 ( 0.098 -0.251 -3.136) 3.148 11.578 ( 4.597 -1.047 -3.722) 6.007 11.616 ( -4.722 -4.975 -7.947) 10.497 11.995 ( 2.180 6.049 7.226) 9.672 12.156 ( 2.408 -8.560 8.434) 12.256 12.612 ( 10.734 0.895 3.217) 11.241 12.659 ( 12.534 -3.266 1.197) 13.007 12.992 ( -10.302 4.417 -2.071) 11.399 13.073 ( -8.178 -2.487 -2.990) 9.056 13.535 ( -2.064 1.289 0.482) 2.481 13.591 ( -5.132 -4.137 0.039) 6.592 14.061 ( 0.671 2.772 -1.486) 3.216 14.137 ( 0.394 -3.709 -2.227) 4.344 14.674 ( -1.081 7.893 0.841) 8.011 14.823 ( -1.530 -5.784 1.276) 6.117 15.686 ( 0.890 6.231 -5.181) 8.152 15.781 ( 2.675 -2.825 -5.000) 6.336 16.019 ( -1.974 6.690 2.464) 7.398 16.118 ( -1.793 -2.533 3.426) 4.622 16.807 ( 0.143 6.999 -3.641) 7.890 16.960 ( -2.039 -7.214 -3.906) 8.453 19.736 ( -0.117 1.341 5.563) 5.723 19.789 ( -0.129 -3.798 6.670) 7.677 20.488 ( -0.033 6.161 0.455) 6.178 20.547 ( -0.867 0.560 2.643) 2.838 21.076 ( -1.425 0.992 8.676) 8.848 21.187 ( -1.015 -9.172 6.841) 11.487 21.874 ( -0.833 2.222 6.104) 6.549 21.923 ( -1.021 -2.135 5.810) 6.273 22.554 ( 0.364 2.592 1.399) 2.968 22.654 ( 1.529 -6.356 1.572) 6.724 23.741 ( -0.362 3.407 -0.095) 3.427 23.780 ( -0.127 0.028 -0.340) 0.364 24.370 ( 0.893 -1.056 -3.830) 4.072 24.373 ( 0.957 -1.202 -1.636) 2.244 25.306 ( 1.628 5.354 -7.127) 9.061 25.354 ( 2.446 1.026 -8.022) 8.450 ======================= Grid point 91 (41/104) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.877 ( 7.856 0.000 24.829) 26.042 1.118 ( 2.226 0.000 27.349) 27.439 1.685 ( 1.958 0.000 32.612) 32.671 1.866 ( 0.635 0.000 -7.588) 7.614 2.456 ( -1.629 0.000 0.232) 1.645 2.503 ( -1.385 0.000 4.457) 4.667 2.711 ( -2.573 0.000 5.538) 6.107 2.735 ( 1.995 0.000 15.433) 15.561 2.883 ( -4.976 0.000 14.503) 15.333 2.950 ( -0.318 0.000 -0.707) 0.776 3.063 ( 1.034 0.000 -9.511) 9.567 3.205 ( -3.696 0.000 14.926) 15.377 3.330 ( -8.313 0.000 -3.175) 8.899 3.496 ( 3.216 0.000 0.678) 3.287 3.531 ( 0.479 0.000 -6.505) 6.522 3.584 ( -0.419 0.000 1.317) 1.382 3.869 ( -1.236 0.000 -6.398) 6.516 3.989 ( -2.781 0.000 1.714) 3.267 4.149 ( 5.176 0.000 6.610) 8.396 4.260 ( -2.647 0.000 3.215) 4.165 4.311 ( 4.789 0.000 6.785) 8.305 4.457 ( -7.458 0.000 -6.107) 9.640 4.801 ( -3.392 0.000 1.824) 3.851 4.825 ( 4.490 0.000 -6.400) 7.818 4.889 ( 2.583 0.000 -0.432) 2.619 5.083 ( 6.092 0.000 -7.825) 9.917 5.275 ( -6.786 0.000 -2.082) 7.099 5.282 ( 6.514 0.000 1.457) 6.674 5.453 ( -1.143 0.000 -1.325) 1.750 5.578 ( -4.896 0.000 4.949) 6.961 5.869 ( -2.012 0.000 -2.420) 3.148 5.984 ( 5.119 0.000 1.579) 5.357 6.152 ( -1.536 0.000 2.884) 3.267 6.435 ( -4.799 0.000 -1.108) 4.926 6.649 ( -0.470 0.000 -2.601) 2.643 6.745 ( 2.664 0.000 2.341) 3.546 6.859 ( 1.083 0.000 4.809) 4.930 7.013 ( -3.041 0.000 0.174) 3.046 7.062 ( 6.222 0.000 0.108) 6.223 7.205 ( 0.182 0.000 -0.939) 0.957 7.702 ( 0.037 0.000 -3.539) 3.540 7.883 ( 3.357 0.000 -5.301) 6.274 8.277 ( 3.375 0.000 -3.185) 4.641 8.334 ( -3.158 0.000 1.552) 3.519 8.560 ( -2.405 0.000 -5.442) 5.949 8.645 ( -6.429 0.000 -9.640) 11.587 8.871 ( -4.279 0.000 3.697) 5.654 9.019 ( 5.993 0.000 -1.450) 6.166 9.169 ( -2.290 0.000 4.553) 5.096 9.327 ( -5.814 0.000 2.061) 6.168 9.758 ( 1.728 0.000 0.853) 1.927 10.009 ( 9.192 0.000 -0.300) 9.197 10.547 ( 2.614 0.000 -3.250) 4.171 10.599 ( 3.269 0.000 -3.589) 4.855 10.859 ( -16.786 0.000 -5.626) 17.704 10.878 ( -4.689 0.000 -4.715) 6.650 11.041 ( -17.394 0.000 0.253) 17.396 11.190 ( -7.125 0.000 4.126) 8.233 11.290 ( -5.044 0.000 -3.491) 6.134 11.574 ( 2.715 0.000 -14.281) 14.537 11.649 ( 17.076 0.000 -1.047) 17.108 11.969 ( -0.635 0.000 4.859) 4.900 12.031 ( -1.059 0.000 0.749) 1.297 12.388 ( 12.234 0.000 -7.558) 14.380 12.643 ( 10.154 0.000 -6.331) 11.966 12.686 ( -5.926 0.000 3.034) 6.657 12.892 ( -7.293 0.000 7.292) 10.313 13.123 ( 15.098 0.000 1.229) 15.148 13.490 ( 3.023 0.000 3.499) 4.624 13.780 ( -1.859 0.000 -2.564) 3.167 13.828 ( -1.141 0.000 2.095) 2.385 14.073 ( -6.449 0.000 -5.224) 8.299 14.613 ( -1.560 0.000 -1.271) 2.012 14.781 ( 3.700 0.000 2.436) 4.430 15.096 ( 2.425 0.000 -1.650) 2.933 15.201 ( 1.561 0.000 -0.331) 1.595 16.085 ( 5.517 0.000 6.064) 8.199 16.343 ( 0.608 0.000 7.604) 7.629 16.420 ( 0.019 0.000 -2.201) 2.201 17.083 ( 0.486 0.000 -6.817) 6.834 19.870 ( 0.895 0.000 4.471) 4.560 20.137 ( -2.261 0.000 0.090) 2.263 20.221 ( -1.968 0.000 6.792) 7.072 20.651 ( -17.355 0.000 6.753) 18.622 21.770 ( 4.217 0.000 3.670) 5.590 21.995 ( -1.926 0.000 10.548) 10.722 22.061 ( -1.450 0.000 14.064) 14.138 22.563 ( 0.024 0.000 -0.856) 0.857 22.582 ( -1.184 0.000 -3.313) 3.518 22.739 ( 11.929 0.000 -0.971) 11.968 23.350 ( 1.070 0.000 7.098) 7.179 23.497 ( -0.351 0.000 0.011) 0.351 24.064 ( 1.213 0.000 -0.572) 1.341 24.480 ( -0.790 0.000 -1.056) 1.319 24.608 ( 1.096 0.000 -9.927) 9.987 24.878 ( 3.637 0.000 -9.161) 9.856 ======================= Grid point 92 (42/104) ======================= q-point: ( 0.17 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.210 ( 17.568 0.000 18.549) 25.548 1.322 ( 11.711 0.000 25.418) 27.986 1.849 ( 6.420 0.000 28.718) 29.427 1.909 ( 6.043 0.000 -6.954) 9.213 2.426 ( -7.987 0.000 1.685) 8.163 2.436 ( -0.046 0.000 0.740) 0.741 2.589 ( -11.567 0.000 6.074) 13.065 2.773 ( -2.380 0.000 23.604) 23.723 2.832 ( -2.824 0.000 1.316) 3.115 2.898 ( -4.065 0.000 -6.630) 7.777 3.032 ( -4.634 0.000 9.903) 10.933 3.090 ( -12.192 0.000 2.147) 12.379 3.198 ( 1.049 0.000 4.337) 4.462 3.496 ( -1.292 0.000 -8.132) 8.234 3.546 ( 1.294 0.000 2.568) 2.875 3.737 ( 12.367 0.000 4.853) 13.285 3.855 ( 1.375 0.000 -5.992) 6.148 3.904 ( -5.618 0.000 -0.418) 5.634 4.096 ( -15.034 0.000 1.930) 15.157 4.164 ( -3.330 0.000 8.228) 8.876 4.267 ( -8.812 0.000 -6.568) 10.991 4.431 ( 1.650 0.000 2.570) 3.054 4.805 ( 3.920 0.000 5.644) 6.872 4.851 ( 0.970 0.000 -4.810) 4.907 5.037 ( 8.780 0.000 0.038) 8.780 5.140 ( -4.754 0.000 -5.841) 7.531 5.204 ( 6.525 0.000 -8.990) 11.108 5.340 ( 0.640 0.000 -2.809) 2.881 5.370 ( -6.080 0.000 1.816) 6.346 5.473 ( -6.790 0.000 4.014) 7.888 5.880 ( 2.755 0.000 0.426) 2.788 6.098 ( 7.011 0.000 -2.629) 7.488 6.210 ( 5.517 0.000 5.790) 7.998 6.405 ( 1.443 0.000 -0.525) 1.535 6.663 ( 3.261 0.000 -1.592) 3.629 6.777 ( 0.951 0.000 -3.520) 3.646 6.892 ( 0.292 0.000 8.500) 8.505 6.948 ( -3.725 0.000 -1.255) 3.931 7.144 ( 2.214 0.000 0.217) 2.224 7.160 ( -4.940 0.000 -1.325) 5.114 7.705 ( 1.092 0.000 -5.948) 6.047 7.819 ( -7.776 0.000 -2.530) 8.178 8.310 ( 0.399 0.000 -0.604) 0.724 8.370 ( 4.820 0.000 0.107) 4.821 8.493 ( -3.577 0.000 1.725) 3.971 8.548 ( -0.068 0.000 -9.294) 9.295 8.810 ( -1.760 0.000 1.526) 2.330 9.084 ( -0.855 0.000 -1.254) 1.518 9.137 ( 0.070 0.000 2.296) 2.297 9.187 ( -7.184 0.000 0.981) 7.251 9.835 ( 5.118 0.000 2.070) 5.520 10.138 ( 3.418 0.000 3.347) 4.784 10.320 ( -24.048 0.000 9.533) 25.869 10.624 ( 6.434 0.000 -6.256) 8.975 10.664 ( -0.715 0.000 -1.760) 1.900 10.798 ( -3.385 0.000 -1.277) 3.618 10.904 ( -2.626 0.000 0.091) 2.627 11.103 ( -2.404 0.000 -0.635) 2.487 11.276 ( 2.810 0.000 -4.156) 5.017 11.566 ( 1.520 0.000 -12.019) 12.115 11.979 ( 11.650 0.000 5.401) 12.841 12.018 ( 3.912 0.000 -1.742) 4.282 12.038 ( 5.327 0.000 1.550) 5.548 12.306 ( -6.080 0.000 -13.731) 15.017 12.504 ( -13.095 0.000 -1.508) 13.181 12.793 ( -4.538 0.000 7.076) 8.406 12.885 ( 8.022 0.000 -6.295) 10.197 13.494 ( 17.865 0.000 -3.631) 18.230 13.545 ( 1.575 0.000 3.247) 3.609 13.699 ( -4.790 0.000 -0.844) 4.864 13.841 ( 1.799 0.000 2.949) 3.455 14.022 ( 2.393 0.000 -4.299) 4.920 14.599 ( 0.070 0.000 0.527) 0.531 14.873 ( 4.585 0.000 1.159) 4.730 15.097 ( -1.153 0.000 -3.599) 3.779 15.214 ( 0.187 0.000 -2.138) 2.146 16.171 ( 1.902 0.000 4.939) 5.293 16.380 ( 1.178 0.000 1.975) 2.300 16.406 ( -0.852 0.000 -1.887) 2.071 17.084 ( 1.362 0.000 -6.803) 6.938 19.889 ( -0.316 0.000 4.861) 4.871 20.056 ( -4.886 0.000 1.609) 5.144 20.207 ( -1.106 0.000 6.858) 6.946 20.517 ( -1.266 0.000 13.963) 14.020 21.801 ( -0.895 0.000 3.676) 3.784 21.986 ( -1.737 0.000 10.137) 10.284 22.060 ( -2.198 0.000 13.742) 13.917 22.460 ( -6.977 0.000 1.883) 7.226 22.563 ( 0.289 0.000 -0.944) 0.987 22.973 ( 9.801 0.000 -9.153) 13.411 23.381 ( 0.293 0.000 4.489) 4.498 23.494 ( 0.028 0.000 0.718) 0.719 24.085 ( 1.073 0.000 -0.937) 1.425 24.458 ( -1.090 0.000 -1.306) 1.701 24.604 ( 1.182 0.000 -10.112) 10.181 24.879 ( -0.843 0.000 -8.730) 8.771 ======================= Grid point 93 (43/104) ======================= q-point: ( 0.33 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.502 ( 8.000 0.000 17.416) 19.166 1.633 ( 15.254 0.000 20.500) 25.553 1.993 ( 2.351 0.000 19.706) 19.846 2.034 ( 5.198 0.000 -0.550) 5.227 2.229 ( -10.687 0.000 0.961) 10.730 2.384 ( -9.086 0.000 -2.533) 9.433 2.452 ( 0.889 0.000 -0.970) 1.316 2.675 ( -12.016 0.000 -1.303) 12.086 2.781 ( -7.599 0.000 -0.092) 7.599 2.863 ( 1.716 0.000 18.003) 18.084 2.939 ( -4.922 0.000 3.624) 6.112 3.050 ( 5.690 0.000 26.247) 26.857 3.221 ( -0.046 0.000 -1.397) 1.397 3.460 ( -0.610 0.000 -8.339) 8.361 3.552 ( -1.316 0.000 3.319) 3.570 3.799 ( -4.893 0.000 -0.459) 4.914 3.805 ( -14.468 0.000 1.792) 14.579 3.883 ( 3.150 0.000 -6.486) 7.211 3.967 ( 5.390 0.000 8.326) 9.919 4.128 ( 3.482 0.000 1.378) 3.745 4.131 ( -3.928 0.000 -3.656) 5.366 4.425 ( -1.723 0.000 3.055) 3.507 4.862 ( 1.285 0.000 -2.582) 2.884 4.901 ( 3.684 0.000 5.193) 6.367 5.025 ( -5.567 0.000 -5.213) 7.627 5.101 ( -2.487 0.000 2.923) 3.837 5.200 ( -4.363 0.000 -3.375) 5.516 5.351 ( -2.134 0.000 -5.009) 5.445 5.382 ( 5.927 0.000 -2.667) 6.499 5.388 ( 2.007 0.000 -0.379) 2.043 5.936 ( 2.099 0.000 5.132) 5.545 6.182 ( 1.063 0.000 -3.027) 3.209 6.361 ( 9.935 0.000 2.682) 10.290 6.450 ( 2.642 0.000 -2.563) 3.681 6.775 ( 0.693 0.000 -4.554) 4.607 6.777 ( 8.743 0.000 0.645) 8.767 6.871 ( -4.493 0.000 -1.136) 4.635 6.900 ( -1.687 0.000 7.912) 8.090 7.029 ( -7.751 0.000 -1.756) 7.947 7.137 ( -3.281 0.000 2.859) 4.352 7.659 ( -7.514 0.000 -1.921) 7.755 7.710 ( 1.712 0.000 -8.909) 9.071 8.313 ( 0.031 0.000 2.125) 2.125 8.442 ( 3.631 0.000 -0.808) 3.720 8.475 ( 1.239 0.000 5.048) 5.198 8.618 ( 8.074 0.000 -7.646) 11.120 8.802 ( -0.248 0.000 -0.493) 0.552 8.994 ( -6.824 0.000 0.567) 6.847 9.112 ( -0.777 0.000 -1.330) 1.541 9.168 ( 1.406 0.000 -1.157) 1.821 9.936 ( 4.410 0.000 5.449) 7.010 10.042 ( -9.257 0.000 9.121) 12.996 10.140 ( -4.076 0.000 3.946) 5.673 10.626 ( -2.718 0.000 -0.670) 2.799 10.706 ( 0.201 0.000 -0.504) 0.543 10.758 ( 2.410 0.000 -3.097) 3.925 10.891 ( 0.738 0.000 0.114) 0.747 11.106 ( 3.477 0.000 -7.608) 8.364 11.347 ( 5.453 0.000 -3.695) 6.587 11.579 ( 2.404 0.000 -10.155) 10.436 11.965 ( -3.228 0.000 1.792) 3.692 12.032 ( -7.756 0.000 -4.411) 8.922 12.150 ( -8.632 0.000 -5.475) 10.222 12.267 ( 6.893 0.000 -12.208) 14.020 12.347 ( 5.065 0.000 4.696) 6.907 12.787 ( 2.275 0.000 8.951) 9.236 12.929 ( -1.254 0.000 -4.127) 4.313 13.555 ( -1.222 0.000 2.356) 2.654 13.593 ( -0.186 0.000 0.206) 0.278 13.730 ( 4.524 0.000 -5.860) 7.403 13.897 ( 2.935 0.000 3.387) 4.481 14.108 ( 6.659 0.000 -3.432) 7.492 14.609 ( 0.336 0.000 2.932) 2.951 14.924 ( -0.194 0.000 4.317) 4.322 15.058 ( -0.935 0.000 -8.361) 8.413 15.202 ( -0.478 0.000 -4.596) 4.621 16.176 ( -2.417 0.000 2.488) 3.468 16.384 ( -1.130 0.000 3.903) 4.063 16.387 ( -0.655 0.000 -1.559) 1.691 17.098 ( 1.731 0.000 -6.574) 6.798 19.879 ( -1.924 0.000 5.008) 5.364 20.012 ( -0.404 0.000 2.273) 2.309 20.215 ( 0.044 0.000 7.103) 7.103 20.604 ( 6.237 0.000 13.721) 15.072 21.764 ( -4.109 0.000 2.977) 5.074 21.983 ( -1.177 0.000 9.892) 9.962 22.049 ( -2.518 0.000 13.279) 13.516 22.358 ( -4.993 0.000 4.189) 6.517 22.568 ( 0.349 0.000 -0.745) 0.823 23.063 ( 3.142 0.000 -9.420) 9.930 23.374 ( -1.979 0.000 3.731) 4.224 23.500 ( 0.291 0.000 1.312) 1.344 24.092 ( -0.046 0.000 -1.820) 1.820 24.442 ( -0.088 0.000 -1.069) 1.073 24.604 ( 1.434 0.000 -10.356) 10.455 24.829 ( -1.949 0.000 -7.468) 7.718 ======================= Grid point 94 (44/104) ======================= q-point: (-0.50 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.560 ( -6.534 0.000 20.127) 21.160 1.802 ( -20.327 0.000 10.634) 22.940 1.955 ( 9.929 0.000 14.427) 17.513 2.032 ( -5.655 0.000 10.990) 12.359 2.251 ( -1.324 0.000 -6.598) 6.730 2.340 ( 11.854 0.000 -1.571) 11.958 2.413 ( -10.294 0.000 1.337) 10.381 2.470 ( 0.542 0.000 2.927) 2.977 2.675 ( -1.694 0.000 5.222) 5.490 2.891 ( -1.455 0.000 16.037) 16.103 2.912 ( 0.836 0.000 1.808) 1.992 3.188 ( -2.370 0.000 -1.898) 3.036 3.282 ( 5.398 0.000 18.556) 19.325 3.432 ( -0.259 0.000 -4.883) 4.890 3.519 ( -2.674 0.000 2.127) 3.417 3.676 ( 2.887 0.000 4.015) 4.946 3.729 ( -2.497 0.000 -0.205) 2.505 3.933 ( 3.686 0.000 -7.490) 8.348 3.968 ( -2.317 0.000 9.350) 9.633 4.135 ( 5.544 0.000 -0.607) 5.577 4.288 ( 4.730 0.000 0.209) 4.734 4.389 ( -0.610 0.000 0.413) 0.737 4.878 ( 0.198 0.000 -0.823) 0.846 4.920 ( -3.765 0.000 -3.064) 4.854 4.960 ( 1.603 0.000 -0.397) 1.652 5.040 ( -2.905 0.000 2.665) 3.942 5.165 ( 1.517 0.000 4.360) 4.616 5.247 ( -5.882 0.000 -4.181) 7.217 5.447 ( 1.552 0.000 -3.961) 4.254 5.489 ( 6.087 0.000 -2.088) 6.436 5.974 ( 0.316 0.000 6.394) 6.402 6.122 ( -5.631 0.000 -4.242) 7.050 6.481 ( 2.236 0.000 -2.356) 3.249 6.551 ( 8.394 0.000 -0.319) 8.400 6.733 ( -10.682 0.000 0.369) 10.689 6.796 ( 2.219 0.000 -1.621) 2.748 6.866 ( -3.446 0.000 3.154) 4.671 6.880 ( 0.852 0.000 0.702) 1.103 7.018 ( 8.566 0.000 0.344) 8.573 7.046 ( -7.242 0.000 3.432) 8.014 7.567 ( -1.308 0.000 -3.080) 3.346 7.731 ( 2.844 0.000 -10.086) 10.479 8.292 ( -2.990 0.000 1.649) 3.414 8.530 ( 6.347 0.000 -0.748) 6.391 8.569 ( 6.474 0.000 5.045) 8.207 8.721 ( 2.081 0.000 -7.491) 7.775 8.789 ( -0.401 0.000 -0.126) 0.421 8.884 ( -2.998 0.000 2.199) 3.718 9.137 ( 3.259 0.000 -1.343) 3.525 9.173 ( -0.100 0.000 -2.878) 2.880 9.919 ( -4.155 0.000 6.201) 7.465 10.024 ( -8.601 0.000 2.796) 9.044 10.100 ( 9.005 0.000 9.600) 13.162 10.588 ( -0.549 0.000 2.358) 2.421 10.652 ( -3.808 0.000 0.913) 3.915 10.865 ( 8.050 0.000 -1.004) 8.113 10.920 ( 2.160 0.000 0.319) 2.183 11.155 ( 3.057 0.000 -11.735) 12.127 11.437 ( 4.647 0.000 -4.763) 6.654 11.579 ( 0.353 0.000 -12.857) 12.862 11.812 ( -13.658 0.000 -1.286) 13.718 11.838 ( -10.146 0.000 -6.284) 11.935 12.018 ( -0.082 0.000 -1.807) 1.809 12.385 ( 7.403 0.000 -11.445) 13.631 12.479 ( 5.518 0.000 6.021) 8.167 12.848 ( -5.290 0.000 -4.055) 6.665 12.902 ( 5.938 0.000 11.677) 13.100 13.517 ( -3.210 0.000 1.487) 3.538 13.637 ( 4.261 0.000 1.417) 4.490 13.720 ( -4.028 0.000 -9.133) 9.982 13.943 ( 0.672 0.000 3.177) 3.247 14.212 ( 4.916 0.000 -2.594) 5.559 14.625 ( 0.744 0.000 3.873) 3.944 14.900 ( -2.654 0.000 5.847) 6.421 15.022 ( -1.132 0.000 -11.135) 11.192 15.179 ( -0.633 0.000 -5.502) 5.539 16.101 ( -5.531 0.000 0.621) 5.566 16.372 ( -1.764 0.000 8.471) 8.652 16.380 ( 0.463 0.000 -1.578) 1.644 17.110 ( 1.239 0.000 -6.364) 6.484 19.852 ( -2.051 0.000 4.763) 5.186 20.036 ( 2.074 0.000 1.902) 2.814 20.236 ( 0.057 0.000 7.279) 7.279 20.804 ( 12.078 0.000 12.765) 17.573 21.657 ( -8.315 0.000 1.446) 8.439 21.992 ( -0.437 0.000 10.091) 10.100 22.034 ( -2.467 0.000 13.115) 13.345 22.292 ( -3.581 0.000 5.815) 6.829 22.571 ( 0.143 0.000 -0.465) 0.487 23.057 ( -1.138 0.000 -10.044) 10.108 23.341 ( -2.340 0.000 4.994) 5.515 23.509 ( 0.212 0.000 1.238) 1.256 24.076 ( -0.966 0.000 -2.322) 2.515 24.451 ( 1.128 0.000 -0.631) 1.292 24.607 ( 1.601 0.000 -10.382) 10.505 24.784 ( -0.837 0.000 -7.048) 7.097 ======================= Grid point 95 (45/104) ======================= q-point: (-0.33 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.354 ( -21.304 0.000 15.907) 26.588 1.423 ( -21.498 0.000 15.014) 26.222 1.787 ( -16.262 0.000 15.659) 22.576 2.013 ( -4.740 0.000 -0.693) 4.791 2.320 ( 8.200 0.000 4.322) 9.269 2.413 ( 4.267 0.000 5.904) 7.285 2.520 ( 3.400 0.000 8.669) 9.312 2.540 ( 8.419 0.000 2.206) 8.703 2.791 ( 8.959 0.000 7.353) 11.590 2.908 ( -1.021 0.000 16.225) 16.257 2.997 ( 10.251 0.000 -1.435) 10.351 3.142 ( -2.092 0.000 -3.376) 3.971 3.287 ( -4.366 0.000 7.595) 8.760 3.434 ( 2.347 0.000 -4.253) 4.858 3.477 ( -1.994 0.000 0.635) 2.093 3.709 ( 0.225 0.000 1.614) 1.629 3.845 ( 7.109 0.000 3.687) 8.008 3.971 ( 0.104 0.000 9.360) 9.361 4.010 ( 8.312 0.000 -2.556) 8.696 4.188 ( -10.067 0.000 -2.784) 10.445 4.303 ( 10.885 0.000 -0.328) 10.890 4.427 ( -0.614 0.000 -0.021) 0.615 4.857 ( -1.552 0.000 1.137) 1.924 4.874 ( -1.163 0.000 -0.078) 1.165 4.976 ( 1.455 0.000 -5.112) 5.315 5.013 ( -2.725 0.000 1.358) 3.045 5.139 ( -3.032 0.000 -6.796) 7.441 5.266 ( 6.880 0.000 5.422) 8.759 5.439 ( -0.960 0.000 -1.626) 1.888 5.576 ( 3.213 0.000 2.088) 3.832 5.977 ( -1.076 0.000 2.115) 2.373 5.994 ( -6.212 0.000 -3.015) 6.905 6.478 ( -12.775 0.000 0.782) 12.799 6.545 ( 4.454 0.000 2.585) 5.150 6.671 ( 1.951 0.000 -2.993) 3.573 6.779 ( -6.683 0.000 -1.864) 6.938 6.847 ( 3.586 0.000 0.792) 3.673 6.910 ( -6.743 0.000 2.325) 7.132 6.949 ( 5.658 0.000 2.829) 6.326 7.146 ( 3.726 0.000 0.042) 3.727 7.609 ( 6.725 0.000 -4.695) 8.202 7.750 ( 1.044 0.000 -7.729) 7.800 8.236 ( -2.335 0.000 -0.315) 2.356 8.610 ( -5.750 0.000 -2.460) 6.254 8.648 ( 0.207 0.000 -1.540) 1.554 8.682 ( 5.794 0.000 -1.085) 5.895 8.833 ( 4.627 0.000 4.062) 6.157 8.901 ( 1.081 0.000 -2.883) 3.078 9.171 ( 0.875 0.000 -1.072) 1.384 9.218 ( 5.731 0.000 -0.799) 5.786 9.862 ( -4.059 0.000 5.424) 6.775 9.881 ( -5.845 0.000 0.807) 5.901 10.332 ( 12.339 0.000 2.572) 12.604 10.588 ( -3.183 0.000 0.181) 3.188 10.693 ( 13.364 0.000 16.895) 21.541 10.963 ( 2.220 0.000 0.448) 2.265 11.040 ( 9.317 0.000 4.543) 10.366 11.130 ( -1.072 0.000 -15.606) 15.643 11.448 ( -2.795 0.000 -11.325) 11.665 11.536 ( -5.921 0.000 -7.041) 9.200 11.588 ( -4.220 0.000 -8.912) 9.860 11.690 ( -3.152 0.000 0.742) 3.238 12.041 ( 1.331 0.000 -0.317) 1.368 12.439 ( 0.066 0.000 -11.417) 11.417 12.595 ( 5.515 0.000 7.605) 9.394 12.769 ( -0.814 0.000 -5.156) 5.220 13.008 ( 1.579 0.000 11.381) 11.490 13.458 ( -2.889 0.000 1.105) 3.093 13.512 ( -16.402 0.000 -13.767) 21.414 13.724 ( 4.301 0.000 0.091) 4.302 13.928 ( -2.863 0.000 2.532) 3.822 14.264 ( 1.135 0.000 -4.072) 4.228 14.652 ( 0.796 0.000 2.528) 2.650 14.868 ( -3.316 0.000 0.057) 3.316 14.966 ( -0.582 0.000 -4.375) 4.414 15.158 ( -0.020 0.000 -3.904) 3.904 16.008 ( -4.253 0.000 3.822) 5.718 16.356 ( -2.460 0.000 10.168) 10.462 16.394 ( 1.386 0.000 -1.937) 2.382 17.110 ( 0.380 0.000 -6.366) 6.378 19.835 ( -0.811 0.000 4.407) 4.481 20.086 ( 2.589 0.000 2.020) 3.284 20.247 ( -0.830 0.000 7.174) 7.222 21.104 ( 16.645 0.000 2.969) 16.908 21.464 ( -12.307 0.000 5.979) 13.683 22.009 ( -0.809 0.000 9.662) 9.695 22.027 ( -1.546 0.000 14.275) 14.358 22.261 ( -0.975 0.000 8.179) 8.237 22.570 ( -0.113 0.000 -0.376) 0.393 22.974 ( -5.270 0.000 -9.865) 11.184 23.320 ( -1.354 0.000 6.277) 6.421 23.512 ( -0.183 0.000 0.527) 0.557 24.054 ( -0.609 0.000 -1.848) 1.946 24.473 ( 1.220 0.000 -0.482) 1.312 24.611 ( 1.463 0.000 -10.087) 10.193 24.771 ( 1.522 0.000 -6.799) 6.967 ======================= Grid point 96 (46/104) ======================= q-point: (-0.17 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.953 ( -20.757 0.000 18.523) 27.820 1.146 ( -12.067 0.000 22.448) 25.486 1.644 ( -5.974 0.000 29.067) 29.675 1.914 ( -3.861 0.000 -5.461) 6.688 2.459 ( 4.643 0.000 5.944) 7.542 2.469 ( 0.708 0.000 0.320) 0.777 2.633 ( 4.809 0.000 13.870) 14.680 2.671 ( 4.927 0.000 2.642) 5.590 2.914 ( 3.422 0.000 5.113) 6.152 2.919 ( -2.760 0.000 17.706) 17.919 3.089 ( -1.312 0.000 -11.160) 11.237 3.234 ( -3.633 0.000 13.567) 14.045 3.253 ( 13.112 0.000 -0.953) 13.146 3.458 ( 0.196 0.000 0.538) 0.572 3.493 ( 4.452 0.000 -5.444) 7.033 3.716 ( -3.575 0.000 0.038) 3.575 3.899 ( 0.552 0.000 -4.762) 4.793 4.009 ( -2.152 0.000 3.379) 4.006 4.012 ( 0.375 0.000 2.736) 2.762 4.192 ( 8.198 0.000 3.405) 8.877 4.350 ( -6.365 0.000 3.215) 7.130 4.466 ( 5.962 0.000 -1.476) 6.142 4.839 ( -1.786 0.000 -3.116) 3.591 4.852 ( -1.873 0.000 0.682) 1.993 4.915 ( -4.844 0.000 -2.286) 5.356 5.009 ( 3.796 0.000 -6.313) 7.367 5.150 ( 5.107 0.000 -0.441) 5.126 5.381 ( -1.700 0.000 6.131) 6.362 5.412 ( 3.100 0.000 -6.317) 7.037 5.614 ( -0.309 0.000 5.007) 5.017 5.926 ( -0.138 0.000 1.635) 1.640 5.937 ( -3.366 0.000 -2.007) 3.919 6.261 ( -9.998 0.000 0.869) 10.036 6.570 ( -7.011 0.000 -2.577) 7.470 6.672 ( -0.714 0.000 -3.081) 3.163 6.679 ( 1.483 0.000 6.670) 6.833 6.846 ( -0.930 0.000 0.602) 1.108 6.940 ( 6.112 0.000 1.228) 6.234 7.035 ( 1.404 0.000 2.552) 2.913 7.181 ( 1.701 0.000 -1.378) 2.189 7.728 ( -1.441 0.000 -3.983) 4.236 7.758 ( 9.632 0.000 -5.580) 11.131 8.228 ( 2.001 0.000 -3.065) 3.660 8.456 ( -8.638 0.000 0.166) 8.639 8.613 ( -2.068 0.000 -5.361) 5.746 8.763 ( -1.281 0.000 -6.219) 6.350 8.901 ( 0.580 0.000 3.854) 3.897 8.910 ( 4.352 0.000 -2.860) 5.208 9.186 ( -0.508 0.000 4.120) 4.152 9.326 ( 4.801 0.000 -0.017) 4.801 9.789 ( -4.575 0.000 3.452) 5.731 9.865 ( 4.751 0.000 -1.728) 5.056 10.501 ( 7.516 0.000 -5.426) 9.270 10.543 ( -1.355 0.000 -0.705) 1.527 10.972 ( -0.334 0.000 -1.484) 1.521 10.994 ( -6.052 0.000 -7.137) 9.358 11.167 ( 16.649 0.000 9.434) 19.136 11.290 ( 7.158 0.000 6.533) 9.691 11.348 ( 1.192 0.000 -6.556) 6.664 11.372 ( -1.305 0.000 -5.533) 5.685 11.584 ( 2.936 0.000 -16.522) 16.781 11.752 ( 12.385 0.000 8.787) 15.186 12.047 ( -0.571 0.000 0.246) 0.622 12.304 ( -11.704 0.000 -7.990) 14.171 12.698 ( 2.614 0.000 7.455) 7.900 12.760 ( -3.081 0.000 -9.484) 9.972 12.996 ( -5.188 0.000 8.575) 10.022 13.103 ( -16.760 0.000 -9.015) 19.031 13.441 ( 0.876 0.000 2.367) 2.524 13.781 ( 1.929 0.000 -1.821) 2.652 13.869 ( -3.515 0.000 1.939) 4.015 14.216 ( -5.166 0.000 -7.245) 8.898 14.649 ( -1.467 0.000 -0.364) 1.512 14.773 ( -3.909 0.000 0.777) 3.985 15.021 ( 4.985 0.000 0.672) 5.030 15.168 ( 1.685 0.000 -1.049) 1.985 15.991 ( 1.430 0.000 7.672) 7.804 16.337 ( -2.015 0.000 10.269) 10.465 16.414 ( 1.137 0.000 -2.232) 2.505 17.096 ( -0.004 0.000 -6.589) 6.589 19.844 ( 0.557 0.000 4.264) 4.300 20.133 ( 1.689 0.000 1.763) 2.441 20.240 ( -1.735 0.000 6.931) 7.145 21.039 ( -19.717 0.000 -10.618) 22.394 21.570 ( 15.685 0.000 12.141) 19.835 22.005 ( -1.903 0.000 10.618) 10.787 22.046 ( -0.683 0.000 14.016) 14.033 22.349 ( 10.301 0.000 9.270) 13.858 22.566 ( -0.173 0.000 -0.568) 0.593 22.822 ( -8.535 0.000 -6.479) 10.716 23.323 ( -0.162 0.000 7.427) 7.429 23.505 ( -0.483 0.000 -0.108) 0.495 24.049 ( 0.449 0.000 -0.980) 1.078 24.487 ( 0.307 0.000 -0.671) 0.738 24.611 ( 1.207 0.000 -9.880) 9.953 24.812 ( 4.567 0.000 -7.183) 8.512 ======================= Grid point 97 (47/104) ======================= q-point: ( 0.00 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.056 ( 8.470 15.357 18.735) 25.663 1.238 ( -1.838 11.428 22.739) 25.515 1.926 ( 0.293 4.941 -7.264) 8.790 2.060 ( 1.282 28.990 22.968) 37.008 2.496 ( -1.605 4.302 1.673) 4.887 2.610 ( -5.966 -0.009 7.642) 9.695 2.636 ( 1.053 7.316 10.789) 13.078 2.769 ( 4.818 -4.033 -1.772) 6.528 2.849 ( -1.512 -1.173 1.988) 2.760 2.968 ( -0.860 5.488 9.552) 11.050 3.092 ( -4.878 0.140 8.254) 9.589 3.218 ( -1.457 0.634 6.740) 6.925 3.403 ( -3.747 -1.941 -5.790) 7.164 3.478 ( 0.340 2.467 -2.011) 3.201 3.548 ( 3.723 5.168 -1.701) 6.592 3.687 ( -0.600 3.045 1.889) 3.633 3.778 ( -5.452 0.011 -6.426) 8.428 4.009 ( -3.778 -0.358 2.849) 4.746 4.128 ( 2.410 -1.382 6.086) 6.690 4.279 ( -2.396 -1.123 4.383) 5.120 4.352 ( 9.384 5.818 1.058) 11.091 4.463 ( -5.674 1.430 -0.963) 5.930 4.831 ( 1.706 1.917 -4.023) 4.772 4.870 ( -1.915 3.123 3.327) 4.949 4.916 ( 0.950 4.278 -1.113) 4.522 5.055 ( 6.228 -2.116 -4.500) 7.969 5.143 ( -1.367 -7.564 4.251) 8.784 5.376 ( 1.534 4.355 -3.852) 6.013 5.423 ( -1.106 -2.445 -1.758) 3.208 5.547 ( -1.900 -1.659 4.175) 4.878 5.797 ( -0.737 -5.639 -0.937) 5.764 6.011 ( 0.247 -1.284 -2.283) 2.631 6.164 ( 1.164 3.656 4.514) 5.925 6.434 ( -3.357 -0.301 -1.399) 3.649 6.600 ( -1.863 -6.259 1.225) 6.644 6.714 ( 0.512 -1.653 1.905) 2.574 6.875 ( 1.141 3.025 -1.520) 3.572 6.964 ( 4.418 -4.445 2.027) 6.587 7.034 ( -2.995 -0.506 0.817) 3.145 7.299 ( 1.731 3.066 -2.395) 4.258 7.758 ( 0.330 5.293 -3.235) 6.212 7.898 ( 1.968 1.048 -3.270) 3.958 8.289 ( 4.215 1.769 -3.751) 5.913 8.346 ( -4.403 0.874 0.597) 4.529 8.464 ( -2.204 -5.687 -4.535) 7.600 8.693 ( -6.077 1.326 -7.896) 10.051 8.835 ( -3.886 -2.966 4.012) 6.324 9.024 ( 3.615 -1.494 -0.878) 4.009 9.196 ( -1.005 2.962 4.419) 5.414 9.315 ( -3.743 -0.325 1.580) 4.076 9.711 ( 1.594 -4.013 -0.176) 4.322 9.991 ( 8.650 -1.757 -1.217) 8.910 10.312 ( -5.947 -12.369 6.789) 15.312 10.613 ( 6.466 0.217 -4.301) 7.769 10.851 ( -3.582 -2.587 -5.356) 6.944 10.915 ( -9.482 2.301 -5.849) 11.376 10.983 ( -10.728 -3.352 3.253) 11.701 11.140 ( -1.893 -2.298 -4.003) 4.988 11.350 ( 0.152 1.432 -2.726) 3.083 11.525 ( 0.703 -4.154 -13.268) 13.920 11.613 ( 17.620 -2.270 2.985) 18.015 11.948 ( 3.012 -5.423 3.818) 7.284 12.014 ( -0.136 3.390 5.290) 6.284 12.464 ( -7.878 -1.685 -6.882) 10.596 12.595 ( 8.620 4.296 -3.123) 10.125 12.712 ( -4.823 -0.038 -0.509) 4.850 12.927 ( -1.864 1.813 2.447) 3.570 12.982 ( 8.531 -6.591 3.642) 11.379 13.622 ( 0.849 1.616 -1.686) 2.485 13.718 ( 1.792 -4.949 -0.459) 5.283 13.862 ( -2.225 4.527 -1.979) 5.419 14.042 ( -5.143 -2.801 -5.617) 8.114 14.559 ( 4.308 0.415 2.310) 4.906 14.969 ( 1.010 3.846 8.298) 9.202 15.016 ( -2.591 8.188 -6.830) 10.973 15.423 ( 3.656 11.887 -7.940) 14.755 16.060 ( 3.762 -1.684 6.953) 8.083 16.295 ( -0.889 -3.250 5.774) 6.685 16.492 ( 0.148 5.078 -1.678) 5.350 17.064 ( 1.603 -2.107 -6.956) 7.442 19.863 ( 0.750 -0.447 5.289) 5.361 20.129 ( -2.515 -1.463 2.775) 4.020 20.243 ( -1.496 2.580 4.325) 5.254 20.642 ( -11.629 -0.864 7.157) 13.682 21.633 ( 6.070 -11.386 8.393) 15.392 21.867 ( -0.164 -23.961 15.230) 28.392 22.051 ( -1.845 2.523 9.972) 10.450 22.057 ( -0.601 -1.162 12.442) 12.511 22.642 ( -0.407 -5.057 -0.349) 5.085 22.901 ( 1.806 0.165 -5.500) 5.791 23.537 ( 0.312 5.335 0.478) 5.366 23.572 ( -0.244 10.510 -0.669) 10.534 24.158 ( 0.064 5.437 -6.599) 8.550 24.501 ( 2.482 -1.019 -4.148) 4.940 24.701 ( 1.375 11.002 -9.043) 14.308 24.936 ( 2.112 5.345 -9.740) 11.309 ======================= Grid point 98 (48/104) ======================= q-point: ( 0.17 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.290 ( 12.439 7.213 21.110) 25.542 1.384 ( 9.174 7.949 19.547) 23.009 1.949 ( 4.136 5.096 -5.305) 8.439 2.158 ( 1.613 20.269 15.303) 25.449 2.437 ( -9.696 1.665 2.963) 10.274 2.477 ( -5.564 1.593 1.337) 5.940 2.680 ( 0.873 9.977 12.688) 16.165 2.800 ( -0.408 -0.915 -3.855) 3.983 2.841 ( -1.028 -1.814 6.098) 6.444 2.946 ( -2.884 7.878 2.813) 8.848 3.009 ( -5.186 3.588 19.142) 20.154 3.168 ( -11.511 0.159 8.555) 14.343 3.236 ( -1.865 5.877 -7.588) 9.777 3.503 ( 0.135 1.409 -4.654) 4.865 3.595 ( 4.193 2.393 -0.037) 4.828 3.718 ( 0.995 -6.070 -3.035) 6.858 3.742 ( 1.961 0.726 1.799) 2.758 3.931 ( -3.809 -1.250 1.688) 4.350 4.148 ( -6.145 3.810 3.284) 7.941 4.168 ( -6.221 0.093 6.272) 8.835 4.311 ( -7.479 4.107 -3.037) 9.057 4.512 ( 3.642 6.511 1.314) 7.576 4.797 ( -1.636 1.655 2.170) 3.182 4.879 ( 3.179 -0.044 -2.549) 4.075 4.955 ( -1.064 -1.029 3.537) 3.834 5.130 ( 3.661 -5.221 -5.330) 8.311 5.215 ( 7.639 2.340 -1.416) 8.114 5.325 ( -5.875 -1.776 -1.957) 6.442 5.394 ( -0.748 3.376 -5.231) 6.271 5.509 ( -2.750 2.183 4.688) 5.857 5.823 ( 2.980 -5.226 1.235) 6.142 6.047 ( 4.567 -4.980 -2.234) 7.116 6.248 ( 4.769 3.608 4.707) 7.610 6.421 ( 2.908 1.464 -1.118) 3.442 6.597 ( 1.551 -7.001 -1.095) 7.254 6.712 ( -0.757 -3.526 0.863) 3.708 6.869 ( -1.940 -0.786 -0.682) 2.202 6.988 ( -1.668 -0.091 1.781) 2.442 7.020 ( 0.189 -3.211 3.148) 4.500 7.289 ( -1.923 2.959 -3.171) 4.745 7.749 ( -1.050 4.529 -5.093) 6.896 7.845 ( -5.538 2.006 -2.136) 6.266 8.289 ( -1.849 -1.846 1.328) 2.931 8.383 ( 4.958 1.332 -1.844) 5.455 8.430 ( 0.266 -3.232 -2.133) 3.881 8.594 ( -1.844 1.782 -4.675) 5.333 8.776 ( -2.076 -2.801 1.941) 3.990 9.047 ( -1.773 -3.943 -0.314) 4.334 9.183 ( -1.865 4.227 0.691) 4.672 9.229 ( -2.755 3.476 1.093) 4.568 9.779 ( 4.470 -4.726 1.567) 6.691 10.111 ( 1.344 -2.259 2.693) 3.763 10.199 ( -5.538 -5.556 7.869) 11.111 10.659 ( -4.338 0.076 -2.307) 4.914 10.747 ( 1.338 5.407 -7.812) 9.595 10.786 ( -2.663 -1.051 -1.986) 3.484 10.886 ( -2.467 -1.253 -1.197) 3.015 11.101 ( -1.241 -0.801 -2.933) 3.284 11.337 ( 0.356 5.089 -2.531) 5.695 11.510 ( 1.398 -4.574 -9.884) 10.981 11.926 ( 14.010 -5.117 2.322) 15.095 11.959 ( -0.880 -3.516 2.618) 4.471 12.062 ( 4.337 1.647 1.572) 4.898 12.286 ( -8.728 -3.038 -7.313) 11.785 12.518 ( -9.983 0.288 -3.643) 10.630 12.730 ( 1.067 -1.285 1.163) 2.035 12.956 ( 2.603 3.163 -1.854) 4.497 13.187 ( 9.529 -12.097 4.112) 15.939 13.608 ( -2.569 -3.280 -0.030) 4.167 13.764 ( 3.037 -2.221 -1.040) 3.903 13.867 ( 4.113 4.720 -1.582) 6.457 13.996 ( 1.041 -2.310 -4.048) 4.776 14.661 ( 5.633 4.948 0.133) 7.499 14.943 ( -3.378 -5.273 1.196) 6.375 15.023 ( 2.467 13.241 -1.015) 13.507 15.451 ( 1.313 12.778 -7.075) 14.664 16.120 ( 0.861 -3.610 5.583) 6.704 16.296 ( -0.524 -6.008 2.695) 6.605 16.479 ( -1.026 5.078 -0.913) 5.260 17.091 ( 2.936 -0.358 -7.968) 8.500 19.886 ( 0.071 -0.325 5.398) 5.408 20.059 ( -4.641 -0.243 3.800) 6.003 20.232 ( -0.883 2.747 4.608) 5.437 20.550 ( -1.301 2.640 11.574) 11.943 21.686 ( -0.886 -8.675 5.166) 10.135 21.913 ( 0.221 -23.929 13.998) 27.723 22.037 ( -2.149 2.186 10.171) 10.623 22.080 ( -0.176 -2.862 10.687) 11.065 22.646 ( 0.945 -3.290 -0.594) 3.474 22.911 ( 0.593 -4.896 -5.543) 7.419 23.542 ( -0.162 4.519 0.677) 4.572 23.562 ( -0.298 10.102 -0.383) 10.113 24.140 ( -0.385 3.545 -4.123) 5.452 24.511 ( -0.034 0.068 -5.280) 5.280 24.706 ( 1.474 11.581 -9.041) 14.766 24.922 ( -0.870 4.471 -8.987) 10.076 ======================= Grid point 99 (49/104) ======================= q-point: ( 0.33 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.572 ( 4.871 5.576 17.291) 18.809 1.620 ( 16.820 0.545 19.867) 26.037 2.052 ( 6.396 4.065 -1.666) 7.759 2.119 ( -15.019 2.227 8.479) 17.390 2.206 ( -5.105 5.368 6.855) 10.093 2.417 ( -2.462 5.628 -4.149) 7.413 2.642 ( -5.466 7.551 1.013) 9.377 2.724 ( -6.846 2.962 0.789) 7.501 2.854 ( -4.563 -0.050 2.200) 5.066 2.882 ( -0.564 7.829 1.609) 8.013 2.995 ( -4.455 8.231 14.609) 17.350 3.118 ( 6.523 3.510 16.829) 18.387 3.243 ( 2.694 5.791 3.158) 7.125 3.474 ( -0.753 1.196 -7.563) 7.694 3.656 ( 0.020 8.181 2.379) 8.520 3.703 ( -1.397 -6.111 -3.194) 7.036 3.792 ( 0.668 -6.898 4.713) 8.381 3.898 ( -1.859 -1.518 0.172) 2.406 3.930 ( -8.184 5.217 6.002) 11.412 4.084 ( -8.430 2.351 2.472) 9.094 4.242 ( 2.734 3.600 -3.561) 5.755 4.570 ( 2.834 10.018 2.462) 10.698 4.798 ( -0.771 -3.261 2.228) 4.024 4.872 ( -1.312 -4.853 0.216) 5.031 4.977 ( 1.901 4.232 3.185) 5.628 5.148 ( -2.277 -1.460 -7.949) 8.397 5.181 ( -4.862 -2.655 2.312) 6.003 5.332 ( 1.783 1.314 -6.406) 6.778 5.400 ( 3.464 2.768 -5.666) 7.195 5.472 ( -1.609 4.398 4.801) 6.707 5.878 ( 1.537 -5.473 5.326) 7.790 6.147 ( 4.759 -4.672 -2.843) 7.249 6.312 ( 2.321 -1.382 1.434) 3.059 6.529 ( 7.093 5.615 -0.899) 9.091 6.640 ( 2.313 -8.270 -1.719) 8.757 6.729 ( 3.600 -5.382 2.367) 6.894 6.807 ( -3.619 -4.008 0.163) 5.403 6.966 ( -2.763 2.589 0.890) 3.890 6.991 ( -2.281 -2.554 2.434) 4.201 7.220 ( -5.075 3.943 0.067) 6.427 7.673 ( -4.992 3.169 -3.081) 6.667 7.765 ( -1.092 3.448 -6.980) 7.861 8.286 ( 0.541 -2.491 4.206) 4.918 8.421 ( 2.539 -2.784 -1.363) 4.007 8.486 ( 3.494 1.997 0.860) 4.115 8.630 ( 5.863 0.627 -4.393) 7.353 8.755 ( -1.563 -3.714 1.108) 4.179 8.980 ( -4.243 -2.228 -1.266) 4.957 9.140 ( -1.001 2.619 -2.199) 3.563 9.230 ( 0.611 5.337 0.419) 5.389 9.864 ( 3.849 -5.910 4.615) 8.429 10.043 ( -4.754 1.818 5.597) 7.565 10.175 ( -3.553 1.190 5.407) 6.578 10.560 ( -4.298 -3.551 -2.674) 6.184 10.736 ( -2.648 0.027 -0.248) 2.660 10.808 ( 5.245 3.172 -8.311) 10.327 10.868 ( 0.712 -0.788 -0.246) 1.090 11.096 ( 1.962 -0.477 -5.112) 5.496 11.372 ( 4.052 2.248 -4.209) 6.260 11.525 ( 1.836 -4.766 -8.491) 9.909 11.922 ( -3.663 -3.004 2.500) 5.356 12.027 ( -7.363 -3.271 -5.577) 9.799 12.105 ( -5.700 -3.771 -7.269) 9.978 12.180 ( 7.304 -1.037 0.258) 7.382 12.406 ( 0.758 -0.540 -0.449) 1.033 12.774 ( 3.212 -0.385 7.242) 7.931 12.953 ( -2.034 1.728 -3.563) 4.452 13.301 ( 2.644 -12.751 2.514) 13.263 13.573 ( -0.388 -1.765 0.829) 1.989 13.815 ( 2.656 -0.349 -2.122) 3.418 13.946 ( 3.217 3.115 -1.091) 4.609 14.044 ( 4.711 -3.761 -2.004) 6.353 14.725 ( -0.603 6.439 2.838) 7.063 14.900 ( 0.057 -5.001 -1.381) 5.189 15.069 ( 2.911 12.869 -3.090) 13.551 15.437 ( -0.826 13.408 -7.674) 15.471 16.110 ( -3.082 -4.864 2.135) 6.142 16.294 ( -0.158 -6.011 4.658) 7.606 16.457 ( -1.089 4.804 0.501) 4.952 17.120 ( 2.037 0.790 -8.134) 8.422 19.882 ( -1.992 0.202 5.610) 5.957 20.017 ( -0.659 -0.210 4.294) 4.349 20.235 ( -0.038 2.502 4.699) 5.324 20.612 ( 4.223 0.491 11.304) 12.077 21.654 ( -3.821 -8.703 5.158) 10.814 21.928 ( -1.882 -17.518 11.898) 21.260 22.022 ( -2.188 0.875 10.785) 11.039 22.096 ( -0.798 -3.081 9.588) 10.102 22.671 ( 1.756 0.093 -0.755) 1.913 22.895 ( -0.627 -10.994 -6.188) 12.632 23.527 ( -1.240 9.922 0.793) 10.031 23.569 ( 0.540 5.299 1.134) 5.446 24.127 ( -0.112 2.850 -2.943) 4.098 24.484 ( -1.359 0.227 -4.814) 5.008 24.712 ( 1.627 10.713 -9.123) 14.165 24.879 ( -1.154 5.104 -7.968) 9.533 ======================= Grid point 100 (50/104) ======================= q-point: (-0.50 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.582 ( -11.777 -2.384 16.555) 20.456 1.705 ( -18.803 3.091 10.405) 21.711 2.003 ( 14.845 1.019 15.622) 21.574 2.158 ( -1.093 7.262 6.624) 9.890 2.266 ( 7.507 2.108 -2.567) 8.209 2.360 ( 0.257 6.406 -2.064) 6.736 2.580 ( -7.241 8.163 1.006) 10.958 2.633 ( 4.328 5.506 3.019) 7.626 2.744 ( -7.052 12.249 2.793) 14.407 2.886 ( 0.534 -0.555 2.506) 2.622 2.979 ( -1.177 6.898 15.977) 17.442 3.183 ( 1.389 1.311 -5.261) 5.597 3.353 ( 0.641 4.958 8.336) 9.720 3.472 ( 0.892 3.544 1.790) 4.069 3.602 ( -6.687 4.061 1.299) 7.931 3.641 ( -2.249 -1.730 0.211) 2.845 3.747 ( 1.260 1.570 6.605) 6.905 3.892 ( 2.365 -5.598 -0.761) 6.124 3.993 ( -1.104 3.309 4.998) 6.095 4.019 ( 8.376 -0.370 2.836) 8.851 4.289 ( 1.600 0.549 -0.501) 1.764 4.594 ( -1.223 6.788 -2.891) 7.478 4.782 ( -0.192 -0.775 4.175) 4.251 4.900 ( 3.370 -0.481 -0.969) 3.539 4.982 ( -1.670 2.317 -0.079) 2.857 5.108 ( -3.311 1.286 -2.240) 4.199 5.122 ( 2.210 -1.632 4.655) 5.406 5.280 ( -4.958 1.791 -7.515) 9.180 5.415 ( -0.350 -0.978 -0.778) 1.297 5.510 ( 3.026 1.421 0.168) 3.347 5.896 ( -1.024 -6.786 5.487) 8.787 6.142 ( -3.297 0.128 -4.047) 5.221 6.381 ( 4.151 -5.246 0.908) 6.751 6.629 ( -0.819 -0.006 0.588) 1.008 6.650 ( 1.995 -1.128 -1.827) 2.930 6.720 ( -2.603 -7.574 2.552) 8.405 6.834 ( -0.374 -2.105 -0.155) 2.144 6.922 ( 3.461 2.608 0.019) 4.334 6.995 ( 0.317 -0.125 2.590) 2.612 7.117 ( -4.482 2.733 1.057) 5.355 7.618 ( 0.447 4.580 -2.422) 5.200 7.755 ( 1.664 2.170 -9.289) 9.684 8.297 ( -0.970 -0.572 3.480) 3.658 8.489 ( 4.216 -3.148 -1.281) 5.415 8.568 ( 5.487 0.441 2.377) 5.996 8.700 ( -3.523 -2.463 -2.754) 5.105 8.736 ( 4.732 -3.796 -0.284) 6.073 8.919 ( -1.259 0.966 -1.061) 1.909 9.148 ( 2.085 2.162 -1.689) 3.446 9.236 ( 0.296 5.036 -1.253) 5.198 9.897 ( -2.934 -4.507 4.652) 7.111 10.054 ( 0.307 0.548 2.960) 3.025 10.070 ( -2.658 3.070 8.547) 9.463 10.488 ( -3.219 -6.068 -0.776) 6.912 10.700 ( -0.497 1.481 0.216) 1.577 10.883 ( 4.246 -1.864 -4.603) 6.534 10.927 ( 6.429 2.762 -1.787) 7.221 11.124 ( 1.456 -1.507 -7.152) 7.452 11.437 ( 3.092 -0.461 -7.057) 7.719 11.509 ( -0.757 -5.731 -9.680) 11.275 11.782 ( -11.399 -2.085 -0.466) 11.597 11.865 ( -8.091 1.936 -6.377) 10.482 11.985 ( -1.816 -2.885 -2.096) 4.002 12.345 ( 9.350 -2.771 -5.349) 11.123 12.468 ( 4.119 -2.240 4.005) 6.166 12.794 ( -4.814 -4.687 4.928) 8.333 12.956 ( 4.503 4.270 1.392) 6.360 13.308 ( -2.606 -11.025 1.600) 11.441 13.599 ( 2.451 -2.601 1.305) 3.804 13.830 ( -0.743 1.637 -5.333) 5.628 13.975 ( 0.377 2.924 -0.616) 3.012 14.137 ( 5.203 -3.966 -0.539) 6.564 14.658 ( -5.954 0.470 4.798) 7.661 14.927 ( 1.666 -0.063 -2.490) 2.997 15.115 ( 3.274 15.505 -4.376) 16.440 15.385 ( -2.505 12.297 -8.931) 15.404 16.031 ( -5.149 -4.833 1.677) 7.258 16.313 ( 0.336 -3.854 6.457) 7.527 16.447 ( -0.215 4.530 1.132) 4.674 17.123 ( 0.446 0.360 -7.611) 7.632 19.852 ( -2.357 0.159 5.669) 6.141 20.042 ( 1.794 -0.457 3.802) 4.229 20.250 ( 0.260 2.088 4.943) 5.372 20.747 ( 7.540 -4.735 9.757) 13.209 21.566 ( -7.267 -7.291 5.791) 11.811 21.912 ( -2.619 -14.903 10.874) 18.633 22.012 ( -1.770 -0.370 11.656) 11.796 22.096 ( -1.702 -1.141 9.481) 9.700 22.696 ( 0.823 3.159 -0.251) 3.274 22.867 ( -0.300 -14.011 -7.156) 15.735 23.512 ( -0.477 12.170 1.542) 12.277 23.579 ( 0.143 4.631 1.401) 4.840 24.123 ( 0.554 3.697 -3.271) 4.967 24.449 ( -1.029 -0.974 -3.947) 4.193 24.718 ( 1.232 9.402 -9.158) 13.183 24.852 ( 0.516 6.528 -7.738) 10.137 ======================= Grid point 101 (51/104) ======================= q-point: (-0.33 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.209 ( -22.888 -3.495 13.664) 26.885 1.514 ( -11.887 10.050 19.756) 25.152 2.068 ( -6.440 5.342 -3.316) 9.000 2.208 ( -4.624 18.902 10.851) 22.280 2.338 ( 7.217 5.500 5.862) 10.802 2.470 ( 6.224 3.959 -0.229) 7.380 2.547 ( 5.175 3.564 6.086) 8.748 2.649 ( -2.930 9.806 6.849) 12.315 2.756 ( 5.232 1.210 3.104) 6.203 2.923 ( 1.434 -1.326 9.401) 9.602 3.044 ( 4.696 3.056 7.525) 9.381 3.215 ( 3.934 6.904 -6.395) 10.200 3.332 ( -2.362 4.368 5.911) 7.720 3.447 ( -1.531 2.011 0.602) 2.598 3.501 ( -2.988 -1.651 0.317) 3.429 3.646 ( 1.269 -2.093 0.677) 2.540 3.851 ( 4.912 -2.461 7.302) 9.138 3.942 ( 3.375 -2.748 -0.466) 4.377 4.035 ( 3.172 3.497 6.118) 7.728 4.155 ( 2.950 1.865 -3.657) 5.055 4.321 ( 3.463 0.863 6.083) 7.053 4.520 ( -4.676 3.243 -5.745) 8.086 4.803 ( 0.675 1.524 4.465) 4.766 4.942 ( -2.321 0.993 -0.213) 2.533 4.947 ( 1.300 2.305 -3.696) 4.546 5.082 ( 1.295 -0.509 -0.009) 1.392 5.134 ( -6.903 1.661 -7.165) 10.087 5.237 ( 6.292 -0.900 7.494) 9.826 5.402 ( -0.545 -1.964 -1.497) 2.529 5.544 ( 0.629 -2.013 1.094) 2.376 5.875 ( -2.018 -7.123 2.323) 7.759 6.066 ( -3.130 3.169 -2.752) 5.235 6.395 ( -6.743 -5.257 1.236) 8.639 6.535 ( -1.950 -3.605 3.347) 5.292 6.662 ( -1.247 -1.949 0.509) 2.369 6.762 ( 4.893 -0.091 -0.999) 4.994 6.803 ( -2.891 -0.922 -0.871) 3.157 6.888 ( -5.719 0.248 0.178) 5.727 7.057 ( 4.747 3.955 1.505) 6.359 7.132 ( 4.018 -1.066 0.545) 4.192 7.678 ( 6.409 5.427 -3.624) 9.146 7.767 ( 1.456 1.873 -7.509) 7.875 8.269 ( -2.070 2.286 0.737) 3.171 8.531 ( 0.125 -5.714 -1.840) 6.005 8.593 ( -6.393 -1.680 -2.406) 7.034 8.692 ( 7.193 -1.895 1.505) 7.589 8.837 ( 4.796 -2.741 1.041) 5.621 8.918 ( 1.113 1.045 -2.425) 2.865 9.191 ( 2.284 3.984 -1.005) 4.701 9.248 ( 1.623 2.143 0.321) 2.707 9.819 ( -5.367 -4.322 1.995) 7.174 9.918 ( -6.448 2.751 2.272) 7.369 10.263 ( 10.892 -4.564 10.222) 15.619 10.440 ( -1.489 -7.094 -1.427) 7.388 10.760 ( 8.038 2.425 5.684) 10.139 10.952 ( 4.012 -1.113 -1.636) 4.473 11.053 ( 1.801 -5.711 -12.023) 13.431 11.104 ( 3.810 4.003 1.990) 5.874 11.402 ( -2.932 -5.141 -12.799) 14.101 11.506 ( 1.494 -1.974 -8.524) 8.876 11.563 ( -11.175 -0.758 -1.706) 11.330 11.738 ( -2.814 2.731 -2.340) 4.567 11.986 ( 0.596 -3.381 0.969) 3.568 12.470 ( 5.165 1.470 -9.119) 10.582 12.571 ( 5.060 -2.724 8.302) 10.097 12.715 ( -1.990 -4.289 0.110) 4.730 13.028 ( 0.779 1.352 4.599) 4.857 13.205 ( -9.087 -9.297 -0.372) 13.006 13.646 ( 1.679 -4.512 1.458) 5.030 13.757 ( -4.540 5.407 -8.851) 11.322 13.961 ( -1.702 3.293 -0.565) 3.750 14.211 ( 2.310 -3.380 -3.153) 5.167 14.566 ( -4.959 -3.073 4.641) 7.455 14.924 ( -1.226 2.115 0.671) 2.535 15.156 ( 1.074 16.274 -5.163) 17.107 15.325 ( -0.059 10.782 -9.978) 14.691 15.961 ( -2.702 -2.739 5.468) 6.686 16.325 ( -1.172 -2.072 7.797) 8.152 16.456 ( 1.164 4.540 -0.403) 4.705 17.102 ( -0.743 -1.121 -6.994) 7.123 19.833 ( -1.054 -0.023 5.389) 5.491 20.089 ( 2.086 -0.754 3.827) 4.424 20.262 ( -0.316 2.099 4.853) 5.297 20.914 ( 7.031 -14.316 3.026) 16.234 21.428 ( -8.342 -2.740 11.632) 14.574 21.887 ( -2.913 -15.376 11.319) 19.313 22.016 ( -0.947 -0.859 12.269) 12.336 22.083 ( -2.201 1.114 9.885) 10.188 22.691 ( -1.300 -0.105 -0.137) 1.311 22.860 ( 1.431 -8.034 -7.082) 10.805 23.516 ( 0.381 12.969 1.659) 13.081 23.580 ( -0.289 4.940 0.739) 5.003 24.135 ( 1.913 5.943 -4.978) 7.985 24.433 ( 0.291 -2.642 -2.618) 3.731 24.711 ( 0.606 8.613 -9.182) 12.603 24.863 ( 2.521 7.708 -7.802) 11.253 ======================= Grid point 102 (52/104) ======================= q-point: (-0.17 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.962 ( -6.207 8.414 19.313) 21.962 1.333 ( -11.931 13.513 19.944) 26.883 1.965 ( -3.072 5.503 -5.321) 8.248 2.071 ( -8.123 30.057 17.877) 35.903 2.481 ( 3.690 2.838 4.139) 6.229 2.571 ( 3.784 5.970 5.864) 9.184 2.646 ( -0.242 3.830 9.545) 10.288 2.667 ( 5.110 -0.588 1.901) 5.483 2.838 ( 3.378 -1.893 -0.314) 3.885 2.953 ( -1.479 1.749 15.321) 15.491 3.114 ( 1.707 -0.298 -3.128) 3.576 3.232 ( -1.934 1.425 6.967) 7.369 3.391 ( 4.314 6.171 2.303) 7.874 3.453 ( 3.248 1.674 -0.670) 3.715 3.485 ( 0.869 -1.197 -3.076) 3.413 3.687 ( 1.948 -1.695 0.850) 2.718 3.942 ( -3.829 2.094 -1.744) 4.700 3.979 ( 2.681 -1.846 5.128) 6.074 4.035 ( 2.606 3.575 1.550) 4.688 4.225 ( 5.495 3.202 0.354) 6.370 4.335 ( -5.214 -1.475 1.834) 5.720 4.485 ( 2.386 2.822 1.070) 3.847 4.827 ( 1.192 0.458 3.332) 3.569 4.880 ( -3.934 2.728 -4.270) 6.415 4.952 ( -0.093 -2.946 -2.523) 3.880 5.012 ( -2.221 3.854 -4.177) 6.102 5.128 ( 1.980 -1.873 3.827) 4.699 5.358 ( 2.525 -1.854 4.185) 5.228 5.398 ( 2.236 -0.118 -3.917) 4.512 5.552 ( -0.042 -3.185 2.237) 3.893 5.837 ( -2.479 -6.331 0.133) 6.800 6.023 ( -1.110 3.947 -1.007) 4.222 6.227 ( -8.313 -1.645 1.607) 8.625 6.513 ( -3.363 -4.674 -0.006) 5.759 6.655 ( -2.757 -1.866 4.950) 5.965 6.701 ( -2.373 -1.035 -0.451) 2.628 6.844 ( 3.405 2.662 -3.067) 5.300 6.875 ( 3.296 -2.353 1.052) 4.184 7.079 ( -1.615 -0.388 0.747) 1.821 7.234 ( 5.502 3.222 -0.486) 6.395 7.765 ( 0.073 3.664 -3.985) 5.414 7.806 ( 7.572 3.600 -4.360) 9.450 8.250 ( 0.716 2.304 -2.410) 3.410 8.453 ( -6.714 -0.341 -0.050) 6.722 8.515 ( -1.831 -5.951 -5.144) 8.076 8.819 ( -2.012 -2.764 -1.151) 3.607 8.822 ( 2.462 0.648 -2.581) 3.625 8.968 ( 2.690 -0.242 -0.200) 2.708 9.204 ( -0.949 2.839 4.087) 5.066 9.304 ( 3.462 -0.987 0.795) 3.687 9.740 ( -3.716 -4.417 0.724) 5.817 9.873 ( 2.567 0.734 -1.078) 2.879 10.372 ( -2.481 -12.043 8.415) 14.900 10.488 ( 8.068 -1.177 -6.140) 10.207 10.945 ( -4.462 -4.119 -6.620) 8.983 10.986 ( 2.502 0.846 -2.026) 3.329 11.051 ( 9.801 -6.277 10.968) 15.993 11.218 ( -1.127 -2.852 -3.097) 4.358 11.327 ( 1.025 -2.616 -7.434) 7.948 11.377 ( -1.821 0.856 -2.507) 3.214 11.541 ( 3.125 -3.559 -15.059) 15.787 11.782 ( 8.225 0.234 6.785) 10.665 11.998 ( 0.269 -0.822 3.930) 4.024 12.478 ( -0.263 8.757 -7.537) 11.556 12.635 ( -1.236 -4.918 3.178) 5.985 12.763 ( 3.937 -0.273 -0.267) 3.955 12.954 ( -10.851 -6.171 -0.286) 12.487 13.011 ( -6.338 0.051 1.341) 6.478 13.634 ( -1.953 4.850 -3.504) 6.294 13.700 ( 0.469 -3.522 -1.970) 4.063 13.915 ( -2.741 3.805 -1.529) 4.933 14.173 ( -5.174 -3.584 -7.118) 9.501 14.515 ( -0.964 -2.904 4.626) 5.547 14.925 ( 0.872 4.562 6.659) 8.119 15.101 ( -4.137 10.803 -6.702) 13.369 15.360 ( 4.986 11.994 -9.228) 15.933 15.975 ( 2.347 -0.616 8.295) 8.643 16.309 ( -2.253 -1.694 8.112) 8.588 16.481 ( 1.415 4.806 -1.656) 5.277 17.071 ( -0.464 -2.418 -6.583) 7.028 19.839 ( 0.291 -0.225 5.211) 5.224 20.130 ( 1.038 -1.235 3.749) 4.082 20.260 ( -1.182 2.379 4.362) 5.107 20.882 ( -11.124 -12.978 -3.318) 17.412 21.448 ( 7.202 -7.081 18.014) 20.652 21.863 ( -2.667 -17.601 12.804) 21.929 22.034 ( -0.480 -0.987 12.534) 12.582 22.066 ( -2.205 2.433 10.354) 10.862 22.661 ( -1.490 -4.416 -0.393) 4.677 22.878 ( 2.033 -0.508 -6.091) 6.442 23.529 ( 0.435 10.258 1.055) 10.321 23.575 ( -0.189 7.312 -0.153) 7.316 24.159 ( 1.818 7.238 -7.398) 10.508 24.454 ( 2.636 -2.682 -1.926) 4.225 24.702 ( 0.874 9.342 -9.142) 13.100 24.901 ( 3.546 7.221 -8.537) 11.730 ======================= Grid point 103 (53/104) ======================= q-point: ( 0.00 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.442 ( 8.375 19.038 10.022) 23.088 1.562 ( -6.878 18.192 15.773) 25.040 2.019 ( 0.964 2.956 -5.466) 6.289 2.532 ( -3.116 1.769 4.795) 5.985 2.557 ( 0.127 -1.743 8.432) 8.611 2.587 ( -4.978 5.052 8.057) 10.734 2.767 ( -1.321 7.191 -3.294) 8.020 2.876 ( 0.402 4.663 -1.382) 4.880 2.963 ( -5.264 15.085 8.242) 17.978 3.021 ( 4.382 4.139 8.330) 10.282 3.137 ( 2.211 1.230 4.102) 4.820 3.220 ( -4.051 4.150 6.570) 8.763 3.307 ( 3.355 -3.261 0.472) 4.703 3.486 ( 1.293 -2.237 0.927) 2.745 3.601 ( -0.567 -2.375 -5.317) 5.850 3.704 ( 1.106 2.127 -4.453) 5.058 3.927 ( -7.063 5.205 4.964) 10.081 4.022 ( -5.598 3.175 1.004) 6.514 4.142 ( 4.712 2.673 6.288) 8.300 4.256 ( -1.309 2.639 0.952) 3.096 4.476 ( -4.829 4.850 4.742) 8.327 4.576 ( 6.379 8.086 1.713) 10.441 4.860 ( 2.191 -5.890 4.038) 7.470 4.897 ( 1.976 4.084 -0.399) 4.555 4.974 ( 0.107 -2.013 6.126) 6.449 5.030 ( 9.017 2.743 4.450) 10.423 5.070 ( -3.793 1.231 -3.507) 5.310 5.391 ( -1.724 0.905 -3.426) 3.941 5.459 ( -3.467 0.553 -1.265) 3.732 5.520 ( 3.284 0.569 -0.600) 3.386 5.669 ( 0.058 -5.086 1.417) 5.280 5.910 ( -2.159 -6.124 -3.662) 7.454 6.307 ( 2.869 6.627 1.455) 7.366 6.377 ( -1.728 -3.147 -0.161) 3.593 6.537 ( -2.984 0.588 0.981) 3.196 6.625 ( -0.915 -5.104 3.584) 6.303 6.857 ( 1.124 -5.426 2.725) 6.175 6.963 ( -1.704 3.146 -6.613) 7.519 6.989 ( 0.778 -3.688 3.469) 5.122 7.259 ( 0.099 -6.393 -2.092) 6.727 7.903 ( 0.891 7.124 -2.316) 7.544 7.922 ( 0.556 1.531 -1.203) 2.025 8.320 ( -5.563 -3.519 -4.850) 8.176 8.349 ( 3.177 2.394 -0.811) 4.060 8.417 ( -0.545 2.675 -0.671) 2.812 8.679 ( -5.371 -2.222 -4.635) 7.434 8.765 ( -3.706 -3.317 2.283) 5.472 8.895 ( 2.561 -9.254 2.801) 10.002 9.269 ( 1.368 2.332 5.354) 5.999 9.351 ( -1.170 2.716 -0.261) 2.969 9.644 ( 0.247 -0.023 -3.499) 3.508 9.943 ( 5.285 -2.591 -3.430) 6.812 10.191 ( -1.651 0.686 6.354) 6.601 10.613 ( 8.040 -0.579 -5.042) 9.508 10.768 ( -1.119 -4.889 -6.337) 8.081 10.910 ( -8.531 -2.717 -1.534) 9.084 10.944 ( -5.139 -0.487 -2.129) 5.584 11.080 ( -1.883 -3.465 -5.285) 6.594 11.344 ( 5.445 -1.150 -4.278) 7.019 11.425 ( 0.594 -4.632 -10.354) 11.359 11.584 ( 14.294 -0.179 6.467) 15.690 11.824 ( 3.827 -6.091 5.230) 8.894 12.101 ( 0.534 4.496 6.841) 8.203 12.367 ( -10.032 -4.698 -1.275) 11.150 12.683 ( -6.817 0.332 -4.216) 8.022 12.752 ( 1.862 4.752 -3.245) 6.048 12.890 ( 8.317 -1.758 1.479) 8.629 12.942 ( -0.627 -1.342 1.726) 2.275 13.571 ( -1.118 -3.229 1.150) 3.605 13.607 ( 0.034 -4.805 0.275) 4.813 13.924 ( -1.439 0.381 -5.093) 5.306 13.989 ( -4.668 -1.500 -6.132) 7.851 14.647 ( 5.305 6.291 3.417) 8.911 14.949 ( -2.429 -1.747 4.001) 4.996 15.332 ( 1.206 15.074 -6.257) 16.366 15.626 ( 4.721 6.815 -9.674) 12.741 16.041 ( 0.526 0.339 7.602) 7.628 16.224 ( -3.710 -3.411 5.589) 7.526 16.604 ( 0.619 5.255 -3.770) 6.497 16.986 ( 2.428 -5.209 -6.702) 8.829 19.862 ( 0.182 0.496 6.990) 7.010 20.061 ( -1.975 -4.610 7.774) 9.251 20.338 ( -0.533 6.089 0.012) 6.112 20.620 ( -2.667 -1.102 4.682) 5.500 21.396 ( 2.392 -8.079 15.076) 17.270 21.535 ( -3.428 -10.918 9.909) 15.138 22.031 ( -0.225 -1.103 10.237) 10.299 22.081 ( -2.278 -0.419 8.856) 9.154 22.566 ( -0.326 -0.838 1.784) 1.998 22.829 ( -0.374 -5.067 0.446) 5.101 23.637 ( -0.571 4.686 0.144) 4.723 23.729 ( -0.154 4.136 -0.837) 4.223 24.232 ( -0.690 2.278 -6.156) 6.600 24.433 ( 2.473 -4.293 -4.149) 6.462 24.967 ( 2.320 11.079 -11.193) 15.919 25.071 ( 1.237 6.243 -11.523) 13.164 ======================= Grid point 104 (54/104) ======================= q-point: ( 0.17 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.524 ( 0.646 14.293 17.411) 22.536 1.624 ( 6.997 13.092 10.834) 18.378 2.045 ( 3.248 3.258 -6.168) 7.695 2.406 ( -12.866 -2.627 5.353) 14.181 2.489 ( -5.830 6.485 10.422) 13.589 2.558 ( -2.210 0.834 4.603) 5.174 2.741 ( 0.046 4.025 -7.640) 8.636 2.829 ( -6.562 2.307 5.770) 9.038 2.929 ( -0.035 6.998 -0.438) 7.012 3.054 ( -2.952 -2.008 11.737) 12.268 3.185 ( 0.867 6.935 -0.224) 6.993 3.247 ( 4.683 14.800 17.536) 23.419 3.329 ( -1.182 0.858 -2.069) 2.533 3.526 ( 2.898 -8.196 -1.610) 8.841 3.565 ( -1.810 1.806 -6.226) 6.731 3.657 ( -2.641 2.132 -4.095) 5.319 3.834 ( -3.581 5.400 2.497) 6.944 3.918 ( -4.258 4.521 6.993) 9.353 4.178 ( -2.067 1.428 5.226) 5.798 4.256 ( -0.227 6.705 6.245) 9.165 4.401 ( -6.165 3.747 -1.431) 7.355 4.650 ( 1.894 5.166 2.951) 6.244 4.845 ( -3.896 -0.714 5.472) 6.755 4.910 ( -1.496 4.198 -1.422) 4.678 5.015 ( 3.213 -3.095 -8.535) 9.631 5.039 ( 4.023 6.648 5.307) 9.410 5.219 ( 1.477 -0.635 5.133) 5.379 5.329 ( 0.445 1.626 0.548) 1.773 5.450 ( 2.420 1.099 -3.503) 4.397 5.554 ( 0.666 2.106 -1.657) 2.761 5.682 ( 1.534 -6.834 2.011) 7.287 5.911 ( 2.771 -7.014 -1.556) 7.701 6.335 ( -1.658 1.965 -0.450) 2.610 6.396 ( 5.325 -1.524 0.907) 5.613 6.539 ( 2.489 0.021 0.745) 2.598 6.618 ( -0.160 -2.292 2.721) 3.561 6.811 ( -6.008 -5.273 -1.436) 8.122 6.928 ( -0.183 -2.214 2.298) 3.196 7.005 ( -1.336 -2.003 1.116) 2.654 7.250 ( -0.166 -6.053 -1.677) 6.283 7.876 ( -3.283 5.137 -2.814) 6.714 7.899 ( -2.372 4.413 -2.378) 5.546 8.233 ( -2.216 -3.272 -0.498) 3.983 8.357 ( -3.085 -2.598 0.407) 4.053 8.459 ( 5.686 4.339 -3.193) 7.832 8.605 ( -0.669 -0.364 -2.924) 3.022 8.715 ( -1.973 -2.508 1.690) 3.611 8.914 ( -0.970 -8.079 1.318) 8.243 9.285 ( -4.200 4.136 -1.541) 6.093 9.316 ( 1.632 4.395 4.403) 6.432 9.683 ( 3.594 -2.985 -1.276) 4.843 10.024 ( 3.670 -6.685 -2.386) 7.991 10.189 ( 0.155 5.203 4.172) 6.671 10.658 ( -4.646 -0.451 -1.952) 5.059 10.741 ( -0.564 -2.859 -5.408) 6.143 10.812 ( 1.288 0.672 -5.039) 5.244 10.863 ( -2.405 -0.578 -2.969) 3.865 11.052 ( 0.929 -3.977 -7.050) 8.147 11.367 ( 1.607 -2.585 -6.625) 7.291 11.488 ( 3.790 2.920 -1.157) 4.922 11.828 ( 7.800 -3.160 3.746) 9.212 11.877 ( 1.026 -3.884 4.610) 6.115 12.062 ( -2.266 -2.029 -2.231) 3.772 12.230 ( -4.121 -1.984 2.385) 5.159 12.468 ( -12.803 -2.218 -1.994) 13.145 12.765 ( -1.113 0.872 -0.612) 1.541 12.987 ( 2.545 0.311 -1.432) 2.936 13.031 ( 6.435 -2.928 1.585) 7.246 13.548 ( -0.540 -1.431 0.953) 1.803 13.675 ( 5.765 -4.588 -0.067) 7.368 13.914 ( 1.404 -0.247 -3.569) 3.844 13.933 ( 0.215 -2.628 -3.624) 4.482 14.768 ( 6.688 4.617 1.205) 8.215 14.895 ( -4.191 -0.404 2.758) 5.033 15.357 ( 2.739 16.172 -6.178) 17.527 15.679 ( 3.095 8.078 -8.846) 12.373 16.055 ( -0.987 -1.986 6.196) 6.581 16.170 ( -3.015 -5.378 5.982) 8.590 16.596 ( -0.391 5.871 -3.068) 6.635 17.037 ( 4.377 -4.876 -7.856) 10.230 19.880 ( -0.124 0.060 7.061) 7.062 20.026 ( -3.502 -2.863 7.747) 8.971 20.332 ( -0.169 6.376 0.056) 6.378 20.599 ( -0.787 1.302 5.720) 5.919 21.484 ( 2.192 -10.522 10.677) 15.150 21.497 ( -2.543 -12.209 12.833) 17.894 22.052 ( -0.125 -1.297 10.280) 10.362 22.059 ( -2.445 -0.395 8.476) 8.830 22.571 ( 0.472 -1.525 1.608) 2.266 22.800 ( -2.711 -5.279 0.541) 5.959 23.636 ( 0.407 4.507 0.546) 4.558 23.721 ( -0.308 4.432 -1.288) 4.625 24.207 ( -0.519 2.901 -4.480) 5.362 24.450 ( 0.598 -4.492 -4.920) 6.689 24.973 ( 1.269 10.964 -10.970) 15.561 25.051 ( -0.269 6.487 -10.665) 12.485 ======================= Grid point 105 (55/104) ======================= q-point: ( 0.33 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.651 ( 5.503 4.790 17.409) 18.876 1.757 ( 5.405 8.472 10.414) 14.472 2.077 ( -7.844 -0.753 0.438) 7.892 2.159 ( -3.385 3.948 0.483) 5.223 2.419 ( -4.436 7.380 11.560) 14.415 2.551 ( 0.835 2.488 -0.284) 2.639 2.677 ( -6.734 2.210 2.128) 7.400 2.731 ( -3.551 0.682 2.226) 4.246 2.920 ( -0.461 6.492 -0.867) 6.566 3.016 ( -4.067 2.294 13.195) 13.997 3.172 ( -1.045 8.313 -0.139) 8.380 3.282 ( 0.338 6.033 -2.603) 6.579 3.407 ( 4.517 4.114 6.585) 8.983 3.495 ( -3.109 -0.057 -6.176) 6.915 3.564 ( 0.947 -6.965 -1.443) 7.176 3.618 ( -2.786 -5.967 1.201) 6.694 3.815 ( 0.817 6.646 1.497) 6.861 3.942 ( 4.450 9.538 11.494) 15.585 4.129 ( -5.584 11.390 8.981) 15.542 4.172 ( -7.851 5.091 2.076) 9.584 4.328 ( 0.757 4.827 -3.409) 5.958 4.638 ( -5.323 0.248 3.316) 6.276 4.833 ( 0.666 -0.812 4.340) 4.465 4.896 ( 2.231 8.711 0.633) 9.015 5.048 ( 2.312 -5.713 -7.511) 9.716 5.114 ( -2.974 5.174 -2.217) 6.367 5.136 ( -0.483 2.107 5.590) 5.993 5.387 ( 0.358 3.041 0.950) 3.206 5.479 ( 1.187 3.934 -4.279) 5.933 5.546 ( -1.010 2.751 0.506) 2.974 5.714 ( 0.164 -9.199 4.826) 10.389 5.998 ( 5.880 -8.141 -1.244) 10.119 6.317 ( -0.019 0.989 -0.189) 1.007 6.488 ( 3.724 -4.721 1.528) 6.204 6.585 ( 0.607 -7.174 2.870) 7.751 6.682 ( 6.584 8.114 -0.165) 10.450 6.699 ( -3.870 -6.458 0.070) 7.529 6.925 ( -1.089 -3.411 2.771) 4.528 6.962 ( -1.867 -3.039 0.038) 3.567 7.231 ( -2.862 -3.304 1.132) 4.516 7.793 ( -4.195 6.886 -2.483) 8.437 7.840 ( -1.925 3.995 -5.844) 7.336 8.227 ( -0.087 -2.722 5.223) 5.891 8.323 ( 1.438 -5.894 -1.611) 6.277 8.557 ( 4.985 3.967 -2.216) 6.745 8.617 ( 0.755 -1.585 0.272) 1.777 8.693 ( -0.619 -1.654 -1.822) 2.538 8.890 ( -0.919 -5.693 -0.222) 5.771 9.217 ( -2.127 4.343 -1.530) 5.072 9.347 ( 0.576 4.482 3.365) 5.634 9.743 ( 2.736 -4.224 0.338) 5.044 10.058 ( 0.859 -5.751 -2.878) 6.488 10.206 ( -0.059 6.570 5.034) 8.277 10.526 ( -7.409 0.766 -2.958) 8.014 10.715 ( -0.787 -1.892 -4.849) 5.264 10.818 ( 0.280 -0.103 -4.439) 4.449 10.867 ( 2.792 -1.504 -3.340) 4.606 11.079 ( 3.865 -3.040 -9.207) 10.438 11.416 ( 4.552 0.530 -3.912) 6.025 11.479 ( -3.987 5.025 -2.540) 6.899 11.855 ( -3.940 -4.525 0.177) 6.002 11.900 ( 2.599 -4.419 -3.254) 6.072 12.040 ( -5.445 -4.149 -4.506) 8.195 12.205 ( 1.649 -0.768 5.559) 5.849 12.297 ( -2.590 -5.061 1.885) 5.990 12.726 ( -3.955 -5.715 6.746) 9.685 13.011 ( 1.948 3.799 -4.514) 6.213 13.124 ( 3.409 -3.722 -0.264) 5.054 13.557 ( 0.904 0.678 0.874) 1.429 13.770 ( 4.060 -3.157 -1.802) 5.449 13.953 ( 2.500 -2.061 -1.455) 3.551 13.972 ( 4.658 -2.512 -0.668) 5.334 14.807 ( -5.702 2.426 3.695) 7.215 14.885 ( 5.106 1.790 -0.069) 5.412 15.398 ( 3.554 15.529 -7.811) 17.743 15.681 ( -0.915 8.644 -9.067) 12.561 16.022 ( -3.373 -2.611 2.745) 5.073 16.170 ( 1.057 -5.313 8.157) 9.792 16.580 ( -0.600 6.824 -1.784) 7.079 17.086 ( 2.720 -4.293 -8.540) 9.937 19.884 ( -1.570 0.051 7.187) 7.357 19.989 ( -1.968 -2.230 7.883) 8.425 20.332 ( 0.208 6.276 0.034) 6.279 20.615 ( 0.858 -0.383 5.094) 5.180 21.454 ( -3.529 -8.842 10.009) 13.814 21.563 ( 1.341 -13.786 13.206) 19.138 22.032 ( -2.615 -0.391 8.081) 8.503 22.076 ( 0.062 -1.278 10.077) 10.158 22.595 ( 1.804 -3.664 0.445) 4.108 22.742 ( -3.536 -4.309 1.324) 5.730 23.651 ( 0.917 4.371 1.050) 4.587 23.714 ( -0.093 5.111 -1.052) 5.219 24.194 ( 0.221 3.263 -3.566) 4.839 24.435 ( -0.811 -3.863 -4.801) 6.215 24.961 ( 0.389 10.675 -10.815) 15.201 25.023 ( 0.312 7.194 -9.762) 12.131 ======================= Grid point 106 (56/104) ======================= q-point: (-0.50 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.569 ( -15.993 3.309 9.608) 18.949 1.890 ( -7.568 10.004 13.202) 18.211 1.961 ( 10.813 -2.516 9.234) 14.440 2.265 ( 6.862 3.172 -1.303) 7.671 2.387 ( 0.522 5.671 2.232) 6.116 2.540 ( -0.149 7.535 8.854) 11.627 2.663 ( -3.634 5.507 3.492) 7.465 2.689 ( 5.878 -2.239 3.082) 7.004 2.918 ( 0.013 8.201 -2.735) 8.645 2.977 ( -2.575 3.039 10.317) 11.059 3.165 ( -0.382 8.630 2.105) 8.892 3.306 ( 2.941 6.009 -4.710) 8.181 3.398 ( -4.649 -0.408 -3.044) 5.572 3.457 ( 0.043 -4.236 -1.225) 4.410 3.566 ( -0.631 -4.789 0.065) 4.831 3.590 ( -0.017 -4.748 5.075) 6.950 3.832 ( -1.896 5.048 4.904) 7.289 3.958 ( -2.694 9.986 2.126) 10.559 4.068 ( -4.441 8.631 3.358) 10.271 4.195 ( 8.443 13.639 14.371) 21.537 4.338 ( 0.661 3.835 -2.013) 4.382 4.540 ( -3.992 -3.499 1.116) 5.424 4.858 ( 1.017 -2.793 4.664) 5.531 4.951 ( -0.022 7.318 -1.157) 7.409 5.044 ( -0.097 -2.730 -3.562) 4.489 5.054 ( 0.041 -1.288 -3.660) 3.880 5.179 ( 2.243 7.726 4.677) 9.305 5.341 ( -4.552 5.550 -0.388) 7.188 5.448 ( -3.427 2.389 -0.576) 4.217 5.537 ( -0.303 1.520 -1.901) 2.453 5.714 ( -0.938 -8.971 4.914) 10.272 6.062 ( 1.179 -7.331 -2.707) 7.903 6.332 ( 1.195 0.394 2.479) 2.780 6.527 ( -3.395 -4.579 1.319) 5.851 6.563 ( 0.166 -6.274 2.841) 6.890 6.686 ( 2.791 -3.228 1.709) 4.597 6.790 ( 1.102 1.368 -0.285) 1.780 6.953 ( 6.062 -0.352 0.466) 6.090 6.972 ( 2.161 -2.422 1.639) 3.636 7.128 ( -7.924 -1.837 0.990) 8.195 7.750 ( 0.802 7.349 -2.171) 7.705 7.818 ( 1.043 3.707 -6.733) 7.757 8.243 ( 0.574 -3.777 5.483) 6.682 8.397 ( 5.678 -5.858 -0.543) 8.176 8.602 ( -2.610 -2.856 2.568) 4.644 8.624 ( 2.631 2.729 -1.388) 4.037 8.676 ( -0.031 -2.665 -5.365) 5.991 8.897 ( 1.445 -2.672 -0.531) 3.084 9.208 ( 1.275 3.010 -0.507) 3.308 9.353 ( -0.694 4.220 2.536) 4.972 9.769 ( -0.651 -4.446 0.363) 4.508 10.051 ( -1.320 -3.712 -2.957) 4.926 10.202 ( -1.083 8.198 7.226) 10.981 10.393 ( -5.582 -0.826 -3.754) 6.778 10.707 ( 1.898 -0.712 -3.946) 4.436 10.838 ( 3.163 -1.551 -5.309) 6.371 10.915 ( 3.060 -3.240 -2.751) 5.238 11.141 ( 5.082 -0.963 -9.561) 10.871 11.353 ( -6.955 -1.685 -7.420) 10.309 11.484 ( 2.263 2.287 -4.543) 5.567 11.748 ( -8.029 -1.186 0.608) 8.139 11.881 ( -7.492 -2.734 -6.090) 10.034 11.915 ( 0.397 -1.479 -0.129) 1.537 12.302 ( 7.290 -1.310 3.425) 8.160 12.353 ( 5.280 -7.787 3.995) 10.221 12.656 ( -4.790 -8.124 6.609) 11.516 13.050 ( 2.684 4.045 -3.343) 5.894 13.150 ( -0.771 -3.571 -0.586) 3.700 13.575 ( 0.567 0.689 1.335) 1.606 13.807 ( 0.380 -2.663 -3.132) 4.128 13.987 ( 1.512 -1.647 -1.102) 2.493 14.071 ( 5.345 -2.517 0.081) 5.909 14.702 ( -6.453 4.306 4.109) 8.779 14.952 ( 1.917 0.708 1.173) 2.356 15.447 ( 3.832 13.263 -10.133) 17.125 15.601 ( -4.848 7.169 -9.069) 12.535 15.973 ( -2.246 0.523 3.234) 3.972 16.225 ( 2.310 -4.167 7.401) 8.802 16.570 ( -0.042 7.200 -1.273) 7.312 17.089 ( -0.221 -4.081 -8.274) 9.228 19.861 ( -2.466 0.629 7.326) 7.756 19.996 ( 0.364 -3.361 7.854) 8.551 20.339 ( 0.490 5.902 0.216) 5.926 20.646 ( 1.170 -4.012 3.536) 5.474 21.410 ( -4.226 -6.401 12.037) 14.273 21.597 ( -0.853 -12.950 12.091) 17.737 22.007 ( -2.059 -0.430 8.111) 8.379 22.099 ( -0.313 -0.909 9.903) 9.950 22.622 ( 0.111 -6.831 -1.687) 7.037 22.704 ( 0.117 -1.531 3.083) 3.444 23.670 ( 0.665 4.177 1.335) 4.436 23.712 ( 0.122 5.712 -0.599) 5.745 24.200 ( 1.517 3.298 -3.789) 5.247 24.403 ( -1.237 -3.044 -4.317) 5.425 24.942 ( 0.526 10.312 -10.708) 14.875 25.019 ( 1.749 7.656 -9.795) 12.554 ======================= Grid point 107 (57/104) ======================= q-point: (-0.33 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.320 ( -10.315 12.110 10.842) 19.251 1.789 ( -8.017 14.914 16.071) 23.345 2.075 ( 0.146 -4.551 -1.799) 4.896 2.347 ( 5.059 3.494 7.418) 9.634 2.514 ( 7.443 1.907 2.154) 7.980 2.608 ( 0.072 3.214 4.220) 5.306 2.635 ( 4.692 10.511 8.311) 14.197 2.835 ( 6.291 1.927 3.375) 7.395 2.892 ( 0.388 3.986 -2.254) 4.595 2.983 ( -0.555 8.795 3.778) 9.588 3.153 ( -1.800 12.320 3.867) 13.038 3.296 ( -3.142 -2.760 -3.501) 5.454 3.376 ( -0.281 -1.897 2.566) 3.203 3.457 ( 3.133 -1.218 -3.966) 5.199 3.545 ( -5.516 3.883 10.020) 12.079 3.594 ( 2.864 -0.505 -5.482) 6.206 3.826 ( 3.735 5.011 10.618) 12.321 3.974 ( 2.279 4.099 -1.566) 4.945 4.046 ( 0.542 0.308 6.906) 6.934 4.309 ( 1.601 10.247 1.194) 10.440 4.362 ( 0.599 2.376 2.721) 3.662 4.525 ( 2.297 -0.921 3.369) 4.181 4.872 ( -2.142 -2.705 2.228) 4.108 4.908 ( -1.565 3.922 3.330) 5.378 4.980 ( -4.541 -4.331 -3.874) 7.375 5.093 ( 1.418 1.551 -6.257) 6.600 5.207 ( -4.574 9.094 3.743) 10.845 5.290 ( 2.881 4.138 4.938) 7.057 5.389 ( -0.910 -0.647 -1.835) 2.148 5.520 ( -0.594 0.627 -0.960) 1.291 5.712 ( -0.681 -6.580 3.250) 7.371 6.050 ( -1.460 -5.725 -3.236) 6.737 6.341 ( -2.203 1.416 2.754) 3.800 6.436 ( -3.974 -3.977 2.379) 6.105 6.592 ( 1.209 -4.194 3.160) 5.389 6.756 ( -1.338 -3.400 -2.032) 4.181 6.768 ( 2.426 -0.196 2.209) 3.287 6.931 ( -6.391 1.962 -0.837) 6.738 7.040 ( 0.887 -3.780 0.519) 3.917 7.120 ( 7.664 -1.578 1.268) 7.926 7.802 ( 4.692 5.743 -3.082) 8.031 7.837 ( 2.455 4.590 -5.363) 7.474 8.270 ( 1.036 -2.403 3.783) 4.600 8.472 ( 0.782 -1.130 -2.157) 2.557 8.541 ( -3.989 -2.979 -1.043) 5.087 8.643 ( 2.862 -1.038 -1.055) 3.222 8.719 ( 3.917 -5.866 2.206) 7.391 8.915 ( 0.356 -1.846 -2.582) 3.193 9.250 ( 2.819 1.046 0.457) 3.042 9.330 ( -2.703 2.791 3.211) 5.041 9.726 ( -2.538 -1.265 -3.198) 4.275 9.968 ( -6.152 0.707 -0.351) 6.203 10.236 ( -0.242 1.356 10.014) 10.108 10.340 ( 3.526 -1.128 -7.325) 8.208 10.789 ( 7.718 -0.104 -0.378) 7.728 10.875 ( 0.740 -5.558 -7.482) 9.350 10.964 ( 3.469 -1.244 -0.326) 3.699 11.204 ( 1.273 5.173 -4.816) 7.182 11.235 ( -0.512 -9.805 -13.202) 16.453 11.469 ( -1.229 -1.672 -7.222) 7.515 11.571 ( -10.521 1.148 0.856) 10.618 11.762 ( -4.227 -0.914 -2.349) 4.922 11.952 ( 3.074 0.930 3.793) 4.969 12.440 ( 3.898 -7.596 9.246) 12.586 12.483 ( 9.014 -1.838 -3.707) 9.918 12.620 ( 0.786 -4.636 3.736) 6.005 13.056 ( -3.169 1.289 -2.200) 4.067 13.092 ( -4.112 -1.695 -1.350) 4.648 13.581 ( -0.386 -1.059 2.039) 2.330 13.764 ( -3.819 -2.833 -4.217) 6.356 14.000 ( 0.129 0.001 -1.979) 1.983 14.141 ( 1.764 -3.058 -2.869) 4.550 14.605 ( -4.731 6.033 5.029) 9.169 14.967 ( -0.553 0.137 3.565) 3.611 15.448 ( -3.418 10.032 -9.055) 13.939 15.523 ( 2.081 7.289 -11.909) 14.116 15.964 ( 0.172 3.665 6.003) 7.035 16.272 ( 0.424 -2.966 6.944) 7.563 16.574 ( 0.997 6.574 -2.457) 7.088 17.045 ( -2.144 -4.485 -7.364) 8.885 19.841 ( -1.400 0.875 7.179) 7.366 20.029 ( 0.836 -4.464 7.988) 9.189 20.348 ( 0.258 5.573 0.358) 5.590 20.668 ( 0.241 -7.359 2.179) 7.678 21.362 ( -4.182 -3.247 14.399) 15.341 21.595 ( -2.302 -11.955 11.196) 16.540 21.999 ( -0.959 -0.591 8.783) 8.855 22.109 ( -1.294 -0.536 9.622) 9.724 22.595 ( -1.674 -4.127 -0.048) 4.454 22.754 ( 3.390 -3.298 1.472) 4.954 23.673 ( -0.740 4.353 0.943) 4.515 23.719 ( 0.633 5.369 -0.190) 5.409 24.231 ( 2.768 2.802 -5.570) 6.822 24.376 ( -0.382 -2.649 -3.209) 4.179 24.934 ( 1.590 10.642 -11.027) 15.407 25.036 ( 2.630 7.392 -10.163) 12.839 ======================= Grid point 108 (58/104) ======================= q-point: (-0.17 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.290 ( 3.531 19.427 11.093) 22.647 1.674 ( -8.573 17.886 15.861) 25.397 2.038 ( -1.611 1.076 -4.399) 4.807 2.474 ( 5.627 -1.792 6.435) 8.734 2.554 ( -1.344 3.761 7.073) 8.123 2.637 ( -0.626 3.776 3.237) 5.013 2.760 ( 3.627 8.238 8.204) 12.179 2.868 ( 2.172 5.770 -3.620) 7.150 2.928 ( -0.723 10.067 1.657) 10.228 3.009 ( 1.663 10.943 8.948) 14.234 3.122 ( -1.539 6.075 -0.044) 6.267 3.247 ( -0.757 -1.959 1.688) 2.694 3.307 ( -4.406 -5.194 2.558) 7.276 3.485 ( -2.186 1.608 4.511) 5.264 3.572 ( 5.657 -2.991 -0.169) 6.401 3.650 ( 4.138 2.851 -5.360) 7.347 3.988 ( 8.700 3.983 8.500) 12.799 4.019 ( 0.492 4.012 1.106) 4.191 4.047 ( -1.488 -2.386 4.964) 5.705 4.319 ( -4.389 1.116 -0.562) 4.563 4.394 ( 8.848 10.811 -1.042) 14.009 4.569 ( -1.827 2.761 6.404) 7.209 4.825 ( -1.393 -2.468 4.573) 5.380 4.895 ( -1.299 -0.483 -3.500) 3.764 4.914 ( -0.434 -1.875 5.793) 6.104 5.035 ( -4.874 4.849 0.014) 6.876 5.131 ( -2.534 -1.082 -1.114) 2.972 5.379 ( 3.547 2.931 0.849) 4.679 5.430 ( 4.681 1.515 -2.798) 5.660 5.521 ( -0.287 2.678 2.064) 3.393 5.685 ( -2.604 -7.676 1.428) 8.230 5.988 ( -4.087 -5.891 -4.061) 8.240 6.290 ( -1.798 6.158 1.681) 6.632 6.403 ( -1.411 -4.032 1.961) 4.701 6.616 ( -0.656 -3.732 4.210) 5.664 6.647 ( -6.458 -0.930 -0.739) 6.566 6.821 ( 1.300 -2.654 2.316) 3.755 6.908 ( 4.110 -0.277 -2.948) 5.066 7.035 ( -1.780 -1.800 -0.857) 2.673 7.231 ( 3.712 -3.946 0.059) 5.418 7.871 ( 2.988 5.562 -3.626) 7.281 7.884 ( 3.663 3.616 -2.500) 5.723 8.301 ( 1.781 0.746 1.677) 2.558 8.423 ( -3.661 -0.453 -6.085) 7.116 8.458 ( -3.940 0.478 -1.021) 4.098 8.732 ( 2.841 -3.918 2.123) 5.285 8.779 ( 2.269 -6.589 1.115) 7.057 8.883 ( -2.934 -4.823 -2.047) 6.006 9.260 ( -2.264 0.565 6.195) 6.620 9.327 ( 2.722 1.419 -0.609) 3.129 9.683 ( -1.829 1.980 -4.669) 5.391 9.890 ( -0.341 0.564 -2.123) 2.223 10.215 ( -2.708 -1.967 7.757) 8.448 10.463 ( 9.040 -0.858 -5.792) 10.770 10.819 ( -2.450 -6.746 -8.075) 10.803 10.959 ( 5.452 -2.632 6.938) 9.208 11.019 ( 0.308 0.522 -3.872) 3.920 11.138 ( -3.155 -5.589 -6.499) 9.134 11.264 ( 3.248 -1.630 -6.757) 7.673 11.416 ( -1.444 2.297 1.597) 3.148 11.460 ( 0.558 -3.173 -13.072) 13.463 11.737 ( 2.097 -4.105 5.151) 6.912 12.032 ( 3.817 3.732 6.988) 8.794 12.477 ( -1.564 -7.000 4.626) 8.535 12.626 ( 7.008 2.634 -6.234) 9.742 12.722 ( 8.181 -3.296 4.453) 9.880 12.900 ( -10.905 1.066 -0.812) 10.987 13.015 ( -4.796 -0.048 -3.085) 5.702 13.574 ( -0.619 -3.100 1.906) 3.692 13.669 ( -4.789 -3.369 -2.658) 6.430 13.975 ( -2.031 1.012 -4.162) 4.740 14.101 ( -4.551 -2.612 -6.223) 8.140 14.577 ( 0.657 6.904 5.387) 8.781 14.965 ( -0.836 -1.072 5.460) 5.627 15.359 ( -2.479 11.849 -7.912) 14.461 15.564 ( 4.566 6.631 -11.637) 14.150 16.001 ( 1.585 3.297 7.445) 8.296 16.268 ( -2.458 -2.383 6.623) 7.455 16.592 ( 1.523 5.528 -3.676) 6.811 16.992 ( -1.216 -5.043 -6.490) 8.308 19.844 ( -0.238 0.809 7.009) 7.060 20.058 ( 0.033 -5.065 8.011) 9.478 20.348 ( -0.362 5.621 0.147) 5.635 20.659 ( -1.946 -6.342 2.615) 7.131 21.345 ( -1.183 -3.303 15.751) 16.137 21.571 ( -3.083 -11.297 10.464) 15.705 22.011 ( -0.313 -0.845 9.676) 9.718 22.100 ( -2.066 -0.439 9.212) 9.451 22.573 ( -0.874 -1.698 1.215) 2.263 22.810 ( 2.174 -4.440 0.662) 4.988 23.654 ( -1.246 4.710 0.285) 4.881 23.728 ( 0.351 4.490 -0.218) 4.509 24.252 ( 0.759 2.051 -7.438) 7.753 24.389 ( 2.517 -3.191 -2.513) 4.778 24.947 ( 2.585 11.100 -11.332) 16.072 25.061 ( 2.605 6.767 -10.964) 13.145 ======================= Grid point 109 (59/104) ======================= q-point: ( 0.00 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.791 ( 4.235 13.138 5.016) 14.686 1.939 ( -4.292 7.694 5.458) 10.364 2.053 ( 0.123 8.001 3.271) 8.645 2.391 ( -3.090 -14.029 5.468) 15.371 2.515 ( -3.045 0.577 4.579) 5.530 2.570 ( -4.279 -4.046 7.397) 9.455 2.940 ( -0.455 6.478 -4.679) 8.004 2.984 ( 1.456 1.909 2.765) 3.662 3.032 ( 1.087 3.619 2.637) 4.607 3.130 ( -6.084 -0.574 7.434) 9.623 3.174 ( 2.357 4.965 -1.053) 5.596 3.235 ( 2.883 -2.105 -2.765) 4.515 3.394 ( -2.719 -3.640 -1.846) 4.904 3.416 ( -3.253 -2.518 2.679) 4.909 3.655 ( 1.813 7.828 -1.254) 8.133 3.740 ( -2.909 0.172 -0.192) 2.921 4.035 ( 0.295 12.425 8.458) 15.033 4.117 ( 1.351 3.074 1.110) 3.537 4.175 ( 1.782 1.986 6.225) 6.773 4.375 ( -0.630 0.118 1.787) 1.899 4.475 ( 2.318 -3.978 9.297) 10.375 4.614 ( 2.067 -8.640 5.931) 10.681 4.818 ( -3.808 10.586 5.725) 12.623 4.990 ( 1.330 -0.160 1.370) 1.916 5.021 ( 8.541 3.081 6.572) 11.208 5.043 ( 1.810 1.319 -0.775) 2.370 5.107 ( 0.008 4.166 -0.607) 4.210 5.307 ( -4.803 -11.591 -0.547) 12.559 5.441 ( 0.776 3.127 -1.971) 3.777 5.520 ( 2.323 -3.598 -0.011) 4.283 5.698 ( -0.849 6.740 -2.409) 7.208 5.811 ( -2.907 -3.688 -4.999) 6.859 6.315 ( -0.519 1.131 0.633) 1.396 6.387 ( 0.728 -3.821 1.148) 4.056 6.559 ( -3.794 3.595 -0.195) 5.230 6.606 ( 0.386 0.451 0.128) 0.607 6.787 ( 0.575 1.159 5.040) 5.203 6.883 ( 1.569 -5.364 5.259) 7.674 6.999 ( -2.462 0.890 -4.160) 4.916 7.086 ( -2.177 -7.929 -1.144) 8.302 7.966 ( 0.397 2.450 -1.875) 3.110 7.998 ( 1.104 0.736 -1.197) 1.787 8.292 ( -4.134 2.169 -4.602) 6.555 8.360 ( -1.998 -2.035 -0.360) 2.875 8.509 ( 0.738 5.207 0.346) 5.271 8.616 ( -2.134 -3.981 -0.435) 4.538 8.703 ( -2.485 -2.068 -0.633) 3.294 8.724 ( 1.920 -4.774 1.192) 5.281 9.305 ( 2.356 1.699 5.210) 5.965 9.349 ( 1.911 -2.134 3.718) 4.694 9.739 ( -2.695 6.892 -7.072) 10.236 9.868 ( 0.205 -4.797 -5.667) 7.428 10.305 ( 3.008 9.063 0.393) 9.558 10.516 ( 5.271 -9.146 -4.320) 11.406 10.727 ( 1.377 2.252 -5.426) 6.034 10.817 ( -2.879 -5.290 -3.742) 7.091 10.957 ( -4.002 1.648 -2.301) 4.901 11.008 ( -2.912 -3.019 -3.714) 5.602 11.328 ( 3.835 -0.003 -6.051) 7.164 11.351 ( 2.467 -2.233 -7.766) 8.449 11.612 ( 9.551 2.873 6.795) 12.068 11.701 ( 5.711 -5.270 5.939) 9.781 12.195 ( -1.964 4.190 5.776) 7.401 12.279 ( -6.671 -3.869 2.311) 8.051 12.711 ( -7.604 2.906 -4.066) 9.099 12.783 ( -0.927 -2.373 -3.279) 4.152 12.883 ( 6.940 0.676 1.000) 7.044 12.902 ( 1.392 -1.387 2.915) 3.516 13.528 ( 0.105 -0.699 0.829) 1.090 13.539 ( -0.531 -1.658 0.395) 1.785 13.929 ( -2.944 0.873 -5.717) 6.489 13.960 ( -3.833 -1.649 -6.698) 7.891 14.780 ( 2.823 5.870 4.070) 7.681 14.887 ( -0.232 -4.082 3.839) 5.608 15.595 ( 3.650 8.922 -6.898) 11.854 15.695 ( 5.032 -0.576 -8.212) 9.648 16.079 ( -2.728 3.001 6.322) 7.511 16.151 ( -4.546 -3.481 5.395) 7.867 16.719 ( 1.218 5.848 -5.281) 7.973 16.855 ( 1.986 -6.760 -6.123) 9.334 19.890 ( -0.477 2.310 8.559) 8.878 19.961 ( -1.061 -4.279 9.286) 10.280 20.478 ( 0.316 6.356 -2.040) 6.683 20.581 ( 0.392 -3.125 -0.233) 3.158 21.303 ( -1.452 -0.998 13.974) 14.085 21.355 ( -2.766 -5.820 11.827) 13.469 22.021 ( -0.478 0.392 7.532) 7.558 22.048 ( -1.359 -1.955 6.848) 7.250 22.609 ( -0.969 4.159 4.774) 6.405 22.715 ( -1.129 -5.449 4.168) 6.953 23.725 ( -0.477 3.330 -0.412) 3.389 23.766 ( -0.255 -0.340 -0.808) 0.913 24.280 ( 0.106 2.528 -4.088) 4.808 24.345 ( 1.249 -3.694 -3.389) 5.167 25.132 ( 1.967 4.530 -11.471) 12.489 25.161 ( 1.548 1.714 -12.103) 12.321 ======================= Grid point 110 (60/104) ======================= q-point: ( 0.17 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.828 ( -4.119 11.783 9.083) 15.437 1.884 ( 0.161 9.162 5.234) 10.553 2.083 ( 2.235 2.170 0.090) 3.116 2.272 ( -9.133 -10.617 5.363) 14.997 2.484 ( -2.258 -1.732 5.722) 6.391 2.506 ( -4.134 -3.105 6.466) 8.279 2.930 ( -2.902 9.259 1.316) 9.792 2.958 ( -4.785 8.271 0.655) 9.578 3.008 ( -3.930 -0.421 7.683) 8.640 3.088 ( 3.397 3.152 0.689) 4.685 3.234 ( 1.342 -1.843 0.664) 2.375 3.274 ( 2.279 -0.727 0.691) 2.490 3.329 ( -3.137 -5.645 -1.854) 6.719 3.384 ( 0.024 -5.251 -1.737) 5.531 3.616 ( -5.066 1.555 -0.308) 5.309 3.649 ( -6.279 -1.462 1.249) 6.567 4.088 ( -1.514 11.934 0.916) 12.064 4.138 ( 4.527 14.604 8.676) 17.580 4.207 ( 0.665 1.553 3.896) 4.246 4.390 ( 1.262 2.184 3.133) 4.023 4.469 ( -5.407 2.778 1.238) 6.204 4.626 ( -1.289 -9.425 6.772) 11.677 4.802 ( -0.475 3.864 6.085) 7.224 4.953 ( -2.714 -5.403 -1.631) 6.262 5.018 ( 1.175 4.204 -0.056) 4.366 5.106 ( 0.207 -2.810 5.086) 5.815 5.281 ( 11.256 7.522 3.254) 13.923 5.398 ( -3.731 5.193 1.762) 6.633 5.423 ( 11.475 -4.228 0.308) 12.233 5.512 ( -2.462 -4.934 -1.014) 5.607 5.671 ( -0.809 4.654 -3.834) 6.083 5.778 ( 0.583 -5.369 -3.571) 6.475 6.325 ( 1.326 1.682 0.226) 2.154 6.416 ( 1.814 -5.430 1.282) 5.866 6.489 ( -3.698 4.554 0.342) 5.877 6.605 ( -1.550 -5.087 -0.838) 5.384 6.806 ( 0.757 6.654 5.385) 8.593 6.881 ( -1.765 -1.958 3.973) 4.768 6.945 ( -3.220 -1.507 -1.421) 3.829 7.068 ( 1.124 -10.008 -0.619) 10.090 7.949 ( -1.794 3.335 -0.730) 3.856 7.993 ( -1.553 0.963 -0.355) 1.862 8.198 ( -3.316 1.769 -4.801) 6.098 8.285 ( -5.218 -4.498 -2.169) 7.222 8.560 ( 4.229 4.632 -0.773) 6.320 8.608 ( 1.239 0.632 -0.399) 1.447 8.673 ( -1.027 -1.022 -0.201) 1.463 8.744 ( 0.124 -6.955 1.752) 7.174 9.346 ( -0.408 2.008 3.351) 3.927 9.371 ( -0.048 0.175 5.875) 5.878 9.701 ( 0.852 4.998 -6.742) 8.436 9.856 ( 0.536 -8.473 -6.218) 10.524 10.368 ( 3.211 10.272 -0.529) 10.775 10.573 ( 1.260 -8.059 -2.694) 8.590 10.723 ( -1.203 1.900 -5.213) 5.678 10.782 ( 0.922 -2.878 -4.696) 5.585 10.882 ( -2.810 2.168 -3.834) 5.224 10.952 ( -1.088 -4.486 -6.342) 7.844 11.379 ( 6.023 3.821 -5.391) 8.941 11.480 ( 9.637 -3.957 -3.399) 10.958 11.799 ( 6.795 -0.142 7.111) 9.837 11.813 ( 4.199 -1.801 6.518) 7.960 12.047 ( -11.573 2.202 -2.565) 12.057 12.144 ( -8.872 -5.662 0.471) 10.535 12.520 ( -10.298 6.391 2.077) 12.296 12.680 ( -7.237 -7.442 3.071) 10.825 13.009 ( 5.834 1.289 -2.051) 6.317 13.018 ( 6.227 0.221 -2.093) 6.573 13.549 ( 2.384 1.173 0.768) 2.766 13.593 ( 5.144 -2.987 0.342) 5.959 13.890 ( 0.213 -0.156 -3.683) 3.692 13.906 ( -0.044 -1.182 -4.403) 4.559 14.847 ( 3.154 2.794 2.335) 4.817 14.886 ( -0.899 -0.939 2.789) 3.077 15.647 ( 3.360 10.252 -7.654) 13.228 15.764 ( 4.086 -0.580 -8.722) 9.649 16.041 ( -2.826 0.536 5.997) 6.651 16.078 ( -3.950 -3.089 6.533) 8.236 16.734 ( 1.634 7.246 -4.808) 8.849 16.897 ( 3.813 -7.759 -6.407) 10.760 19.898 ( -0.986 1.767 8.611) 8.846 19.955 ( -2.022 -3.367 9.125) 9.934 20.477 ( 0.178 6.636 -2.244) 7.007 20.584 ( 0.022 -2.992 -0.384) 3.016 21.320 ( -0.628 -3.263 14.237) 14.620 21.337 ( -2.027 -4.554 11.743) 12.757 22.029 ( -0.647 -0.495 7.745) 7.788 22.037 ( -1.607 -1.106 6.745) 7.021 22.598 ( -1.364 3.444 4.851) 6.103 22.691 ( -2.395 -4.973 4.394) 7.055 23.722 ( 0.275 3.269 -0.285) 3.293 23.762 ( 0.113 -0.263 -1.040) 1.078 24.271 ( 0.035 3.353 -3.582) 4.907 24.353 ( 0.472 -4.339 -3.616) 5.668 25.134 ( 1.197 4.141 -11.355) 12.146 25.152 ( 0.638 2.325 -11.717) 11.963 ======================= Grid point 111 (61/104) ======================= q-point: ( 0.33 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.784 ( -2.690 6.683 10.796) 12.979 1.869 ( -4.997 0.340 6.122) 7.910 2.116 ( 0.773 4.429 3.493) 5.693 2.193 ( 2.168 -1.242 2.070) 3.244 2.445 ( -3.213 -1.308 6.445) 7.319 2.475 ( -0.378 -4.554 5.332) 7.022 2.806 ( -7.516 7.438 8.949) 13.853 2.888 ( -5.092 4.554 4.827) 8.365 2.986 ( -0.402 5.868 2.052) 6.229 3.154 ( 1.133 8.483 2.683) 8.969 3.211 ( -2.002 -8.819 -0.938) 9.092 3.296 ( 2.309 0.437 -3.922) 4.572 3.344 ( 2.205 -4.747 1.642) 5.486 3.399 ( 2.288 -5.059 -4.666) 7.252 3.508 ( -5.701 -0.564 2.253) 6.156 3.533 ( -6.346 -3.021 3.888) 8.032 4.019 ( -3.630 10.537 -2.707) 11.469 4.170 ( -5.695 -2.596 -3.335) 7.092 4.286 ( 6.511 15.349 8.898) 18.899 4.366 ( -0.615 7.802 5.064) 9.322 4.446 ( 2.094 5.833 -0.365) 6.208 4.627 ( -1.307 -6.668 7.172) 9.880 4.779 ( -3.335 0.675 4.883) 5.952 4.908 ( -1.943 -7.891 -0.526) 8.144 5.062 ( 1.711 5.959 0.773) 6.247 5.126 ( -1.608 -0.593 3.329) 3.745 5.285 ( -1.474 7.173 1.299) 7.437 5.448 ( -2.706 -5.814 1.275) 6.538 5.502 ( 5.480 4.304 0.569) 6.991 5.572 ( 3.639 -1.053 -1.237) 3.985 5.649 ( -0.720 6.154 -1.927) 6.489 5.819 ( 4.064 -8.744 -0.711) 9.668 6.350 ( 0.568 2.607 0.625) 2.741 6.432 ( -0.137 -3.877 3.072) 4.948 6.469 ( 1.077 -0.145 1.941) 2.224 6.552 ( -2.433 -6.379 1.504) 6.991 6.850 ( 2.001 1.235 1.011) 2.559 6.876 ( -0.073 -2.902 2.479) 3.817 6.888 ( -0.620 6.234 1.520) 6.446 7.090 ( -0.211 -9.221 2.134) 9.468 7.911 ( -1.565 4.272 -1.492) 4.788 7.937 ( -3.410 3.130 -2.990) 5.510 8.174 ( 0.474 -1.698 1.323) 2.204 8.204 ( -1.493 -4.303 -1.169) 4.702 8.598 ( -0.537 1.485 -2.811) 3.224 8.651 ( -1.066 -2.636 -4.462) 5.290 8.661 ( 4.042 4.554 0.995) 6.170 8.766 ( 2.319 -5.501 1.980) 6.290 9.312 ( -2.731 4.339 2.657) 5.775 9.381 ( -1.129 -1.427 6.532) 6.781 9.728 ( 3.152 3.253 -6.287) 7.749 9.869 ( 2.571 -9.303 -6.817) 11.816 10.397 ( -0.510 9.105 0.935) 9.167 10.537 ( -4.527 -2.756 -0.561) 5.330 10.697 ( 0.572 2.637 -8.265) 8.694 10.795 ( 1.431 -4.010 -4.874) 6.472 10.849 ( 0.308 2.154 -3.222) 3.888 10.948 ( 2.737 -7.070 -9.628) 12.254 11.508 ( 7.691 7.334 -3.863) 11.308 11.630 ( 3.077 3.445 0.618) 4.660 11.733 ( -7.829 -1.426 -8.622) 11.733 11.871 ( -2.334 -3.237 1.565) 4.286 11.935 ( -5.694 -2.670 -0.252) 6.294 12.024 ( 3.191 -8.784 7.922) 12.251 12.378 ( -5.830 7.310 4.823) 10.521 12.555 ( -7.026 -9.060 6.406) 13.133 13.081 ( 3.315 2.141 -4.729) 6.160 13.099 ( 3.383 -0.040 -3.400) 4.797 13.600 ( 2.337 3.219 0.494) 4.008 13.686 ( 4.059 -4.534 -0.919) 6.154 13.915 ( 2.840 -0.040 -0.778) 2.945 13.938 ( 3.864 -1.552 -0.960) 4.273 14.862 ( -2.210 2.593 2.635) 4.307 14.901 ( 1.764 -0.706 2.189) 2.899 15.666 ( 0.808 9.144 -8.878) 12.770 15.771 ( -1.618 -0.489 -9.194) 9.348 16.015 ( -0.440 1.670 4.161) 4.505 16.074 ( 1.366 -3.735 7.191) 8.217 16.750 ( 1.144 9.070 -4.279) 10.094 16.944 ( 2.589 -8.618 -6.784) 11.269 19.895 ( -1.666 1.189 8.692) 8.929 19.936 ( -2.173 -2.499 9.094) 9.679 20.474 ( 0.142 6.454 -2.432) 6.898 20.581 ( -0.206 -3.262 -1.001) 3.419 21.325 ( -1.901 -2.688 13.572) 13.965 21.356 ( -0.021 -5.712 13.478) 14.638 22.020 ( -1.783 -0.169 6.487) 6.730 22.038 ( -0.440 -1.750 7.102) 7.327 22.588 ( -0.919 2.377 4.755) 5.395 22.659 ( -2.019 -3.805 5.093) 6.670 23.732 ( 0.742 2.981 0.080) 3.073 23.766 ( 0.469 0.082 -0.877) 0.998 24.265 ( 0.213 3.540 -3.267) 4.822 24.347 ( -0.141 -4.145 -3.569) 5.472 25.122 ( 0.591 4.148 -11.603) 12.337 25.136 ( 0.847 2.704 -11.149) 11.503 ======================= Grid point 112 (62/104) ======================= q-point: (-0.50 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.694 ( -8.153 7.257 7.567) 13.281 1.839 ( 0.638 -6.079 7.519) 9.690 2.157 ( 0.347 11.285 8.744) 14.280 2.299 ( 6.483 -1.023 2.286) 6.950 2.433 ( 1.740 0.636 2.907) 3.447 2.508 ( 2.135 -6.849 6.828) 9.904 2.753 ( 0.219 7.354 8.547) 11.278 2.835 ( -1.652 3.922 7.863) 8.941 2.991 ( 0.912 3.739 2.464) 4.570 3.111 ( -4.206 3.555 -2.159) 5.915 3.189 ( -0.646 -2.167 -2.321) 3.240 3.309 ( -2.294 -5.741 -3.830) 7.272 3.355 ( -0.251 1.494 3.008) 3.368 3.440 ( 2.763 2.410 -3.181) 4.854 3.462 ( -0.030 -5.991 10.766) 12.320 3.511 ( 4.402 -2.818 -1.592) 5.464 3.965 ( -1.264 7.487 -2.369) 7.954 4.064 ( -3.140 -0.522 -5.387) 6.257 4.363 ( 0.305 11.925 5.354) 13.075 4.420 ( 1.204 4.344 3.762) 5.871 4.462 ( -2.024 7.935 3.749) 9.006 4.560 ( -5.291 5.187 4.699) 8.774 4.757 ( -0.175 -4.781 5.933) 7.622 4.878 ( -1.181 -10.179 -0.173) 10.249 5.059 ( -1.975 2.427 0.244) 3.138 5.079 ( -2.325 0.718 1.894) 3.084 5.306 ( 1.301 4.837 2.962) 5.819 5.398 ( -2.596 -3.539 0.414) 4.408 5.535 ( -0.433 4.658 -4.315) 6.364 5.573 ( -2.736 -0.299 -1.622) 3.195 5.659 ( 1.451 8.017 2.978) 8.674 5.876 ( 1.561 -9.948 -0.258) 10.073 6.361 ( 0.813 2.156 2.641) 3.505 6.430 ( -1.741 -4.434 2.490) 5.375 6.496 ( 1.836 0.476 3.364) 3.862 6.568 ( 2.802 -5.692 3.038) 7.034 6.845 ( -2.298 2.188 2.315) 3.928 6.897 ( 2.845 -3.386 2.526) 5.093 6.958 ( 5.018 2.000 0.092) 5.402 7.047 ( -4.667 -5.146 1.307) 7.069 7.887 ( -0.367 4.409 -2.482) 5.073 7.900 ( 0.763 3.032 -3.305) 4.550 8.187 ( 1.658 -0.464 3.169) 3.606 8.255 ( 4.927 -6.353 1.123) 8.118 8.567 ( -1.736 0.510 -0.757) 1.961 8.609 ( -1.566 -2.996 -4.547) 5.666 8.722 ( 2.067 4.846 -1.865) 5.588 8.820 ( 2.562 -4.280 -0.213) 4.993 9.278 ( -1.625 3.793 3.099) 5.161 9.359 ( -2.900 -3.060 6.353) 7.624 9.770 ( 2.881 4.138 -6.916) 8.559 9.905 ( 2.678 -7.898 -6.860) 10.799 10.356 ( -3.736 5.933 2.722) 7.521 10.432 ( -5.689 0.359 -0.899) 5.771 10.712 ( 3.297 3.418 -7.877) 9.198 10.808 ( 1.075 -2.909 -4.917) 5.814 10.876 ( 3.228 1.291 -1.765) 3.899 10.992 ( 4.214 -8.919 -11.195) 14.920 11.468 ( -9.775 8.155 -7.884) 14.974 11.550 ( -4.132 2.367 -8.508) 9.750 11.705 ( -3.002 -2.312 0.336) 3.804 11.764 ( -1.631 -6.248 -0.952) 6.528 11.958 ( 2.561 5.312 4.775) 7.588 12.130 ( 5.069 -10.125 8.400) 14.098 12.351 ( 2.468 4.024 3.732) 6.018 12.478 ( -2.175 -7.751 6.112) 10.108 13.113 ( 1.248 1.686 -5.013) 5.434 13.126 ( 0.274 0.065 -3.865) 3.875 13.622 ( -0.225 3.632 0.681) 3.702 13.720 ( -0.166 -5.118 -1.446) 5.321 13.973 ( 3.137 1.193 0.126) 3.358 14.020 ( 4.441 -2.545 -0.192) 5.123 14.816 ( -3.530 5.713 3.616) 7.627 14.920 ( -0.436 -3.663 3.045) 4.784 15.642 ( -0.557 5.238 -9.929) 11.240 15.683 ( -4.493 0.959 -8.163) 9.367 16.042 ( 1.775 4.658 3.280) 5.967 16.137 ( 3.141 -4.235 5.515) 7.630 16.751 ( 0.065 9.584 -4.201) 10.464 16.951 ( -0.141 -8.585 -6.828) 10.970 19.881 ( -1.956 1.442 8.719) 9.052 19.926 ( -1.190 -2.864 9.212) 9.720 20.472 ( 0.287 5.978 -2.363) 6.434 20.573 ( -0.190 -3.585 -1.514) 3.896 21.324 ( -2.011 -1.155 14.378) 14.564 21.383 ( -0.828 -6.820 13.601) 15.238 22.006 ( -1.333 0.751 6.031) 6.223 22.047 ( -0.335 -2.988 6.524) 7.184 22.587 ( -0.387 2.095 4.542) 5.017 22.651 ( -0.083 -3.171 5.611) 6.446 23.745 ( 0.542 2.673 0.392) 2.755 23.772 ( 0.387 0.405 -0.554) 0.788 24.265 ( 0.738 3.038 -3.308) 4.551 24.333 ( -0.306 -3.359 -3.444) 4.820 25.107 ( 1.016 4.663 -11.650) 12.589 25.131 ( 1.591 2.337 -11.264) 11.613 ======================= Grid point 113 (63/104) ======================= q-point: (-0.33 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.622 ( -0.663 14.553 6.410) 15.916 1.892 ( 3.308 -10.187 3.285) 11.203 2.136 ( -4.503 14.847 11.629) 19.389 2.367 ( -0.272 -3.785 7.568) 8.466 2.517 ( 4.261 -0.157 2.752) 5.075 2.571 ( 2.281 -5.779 6.407) 8.924 2.835 ( 4.199 7.408 8.310) 11.898 2.880 ( 5.385 4.406 4.839) 8.475 3.013 ( -0.995 2.737 -2.206) 3.654 3.068 ( 2.793 2.923 -2.973) 5.018 3.165 ( -2.214 -4.857 -3.892) 6.606 3.261 ( 0.627 -6.637 -3.057) 7.334 3.386 ( 1.690 3.171 8.809) 9.514 3.483 ( 2.115 3.507 2.910) 5.024 3.508 ( 1.513 -0.337 2.453) 2.902 3.621 ( 6.849 -2.142 -2.286) 7.532 3.971 ( 2.820 4.946 -1.832) 5.981 4.032 ( 0.820 0.003 -5.854) 5.911 4.256 ( -11.352 17.393 11.247) 23.619 4.397 ( -0.724 3.523 0.579) 3.643 4.462 ( -1.270 -3.798 6.664) 7.775 4.527 ( -1.089 3.748 3.678) 5.363 4.765 ( -0.716 -4.677 7.513) 8.879 4.867 ( 0.264 -7.445 -0.769) 7.490 5.004 ( -3.541 4.203 2.753) 6.147 5.074 ( 0.575 -1.959 -0.831) 2.204 5.334 ( 1.521 1.548 1.003) 2.391 5.371 ( 0.117 -0.410 0.029) 0.427 5.432 ( -9.152 7.798 -0.550) 12.036 5.543 ( -0.374 -1.854 -2.314) 2.989 5.692 ( 0.714 6.732 2.920) 7.373 5.882 ( -0.069 -9.018 -1.477) 9.139 6.383 ( -0.189 0.504 2.853) 2.903 6.397 ( -1.860 -0.046 1.569) 2.433 6.544 ( 2.474 1.611 2.902) 4.139 6.644 ( 4.209 -6.130 0.469) 7.451 6.791 ( -3.802 2.454 2.693) 5.266 6.883 ( -6.362 -5.557 1.651) 8.607 7.006 ( 2.310 1.100 0.791) 2.678 7.057 ( 4.372 -3.388 1.239) 5.668 7.906 ( 2.765 3.542 -3.491) 5.691 7.923 ( 2.241 2.225 -3.171) 4.475 8.248 ( 3.561 1.778 2.408) 4.652 8.354 ( 4.487 -7.297 2.050) 8.808 8.538 ( -1.015 1.530 -0.777) 1.994 8.596 ( 0.771 -3.843 1.284) 4.124 8.721 ( -1.192 5.294 -3.821) 6.637 8.839 ( -0.493 -5.064 -2.988) 5.901 9.269 ( -0.260 1.113 3.176) 3.375 9.310 ( -3.494 -2.637 5.366) 6.925 9.795 ( 1.838 5.670 -7.759) 9.784 9.914 ( -0.498 -5.041 -5.569) 7.529 10.299 ( -2.950 4.714 2.659) 6.164 10.369 ( 0.248 0.087 -1.451) 1.475 10.757 ( 1.770 0.592 -8.111) 8.323 10.817 ( 2.010 -2.156 -1.447) 3.283 10.956 ( 5.455 0.436 -1.270) 5.618 11.030 ( 2.215 -7.780 -9.602) 12.555 11.320 ( -3.624 5.502 -9.181) 11.300 11.420 ( -4.589 -3.522 -9.090) 10.775 11.612 ( -7.215 3.219 2.332) 8.237 11.701 ( -5.460 -4.348 0.138) 6.981 12.042 ( 4.929 7.349 6.717) 11.109 12.236 ( 4.018 -10.191 8.816) 14.061 12.472 ( 8.922 0.755 0.915) 9.000 12.523 ( 5.415 -3.952 3.647) 7.632 13.081 ( -4.327 1.250 -3.664) 5.806 13.094 ( -2.230 0.316 -5.045) 5.525 13.596 ( -2.566 2.381 1.039) 3.651 13.675 ( -4.018 -4.699 -1.093) 6.279 14.016 ( 1.226 2.105 -1.459) 2.839 14.077 ( 1.507 -3.164 -2.566) 4.343 14.759 ( -3.220 7.639 4.848) 9.603 14.904 ( -1.965 -5.527 4.473) 7.377 15.592 ( -2.291 4.037 -8.153) 9.382 15.619 ( 0.752 1.618 -9.962) 10.121 16.081 ( 1.227 6.101 4.152) 7.482 16.194 ( 1.303 -4.459 4.910) 6.759 16.734 ( -0.504 8.399 -4.712) 9.644 16.912 ( -1.997 -7.810 -6.471) 10.337 19.872 ( -1.216 2.105 8.670) 9.004 19.935 ( -0.459 -3.867 9.364) 10.141 20.473 ( 0.410 5.628 -2.115) 6.026 20.569 ( 0.158 -3.585 -1.393) 3.850 21.317 ( -2.507 -0.045 14.674) 14.886 21.389 ( -1.951 -6.960 13.106) 14.967 22.003 ( -0.629 1.201 6.194) 6.341 22.054 ( -0.627 -3.409 6.272) 7.167 22.595 ( 0.053 3.124 4.707) 5.649 22.678 ( 1.224 -3.976 5.135) 6.609 23.749 ( -0.268 2.639 0.296) 2.669 23.775 ( 0.058 0.409 -0.330) 0.529 24.276 ( 1.273 1.951 -3.859) 4.508 24.322 ( 0.102 -2.407 -3.151) 3.967 25.106 ( 1.953 5.003 -11.757) 12.926 25.139 ( 2.250 1.842 -11.595) 11.955 ======================= Grid point 114 (64/104) ======================= q-point: (-0.17 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.687 ( 5.073 16.611 4.814) 18.024 1.952 ( 1.786 -6.617 1.448) 7.006 2.078 ( -4.164 16.300 10.132) 19.639 2.380 ( 0.570 -8.708 6.895) 11.122 2.551 ( -1.240 -0.242 5.201) 5.352 2.605 ( -0.895 -4.877 7.179) 8.725 2.926 ( 3.318 5.938 8.029) 10.523 2.968 ( 0.574 0.584 1.545) 1.749 2.996 ( 1.444 5.114 -6.273) 8.221 3.121 ( 0.458 2.144 -1.025) 2.420 3.144 ( 4.824 -2.415 -3.008) 6.176 3.258 ( -2.648 -2.205 -0.147) 3.449 3.430 ( 0.352 -2.577 0.092) 2.602 3.473 ( -4.461 -1.535 6.906) 8.364 3.572 ( 5.903 13.665 -0.258) 14.887 3.728 ( 4.344 0.184 -1.297) 4.538 4.029 ( 1.444 2.735 -0.979) 3.244 4.076 ( 4.822 0.106 -3.175) 5.774 4.133 ( -3.707 11.397 13.586) 18.117 4.383 ( -0.596 5.095 1.655) 5.390 4.436 ( -2.194 -10.464 10.500) 14.985 4.550 ( 2.322 -5.639 4.931) 7.843 4.806 ( 3.839 4.320 7.802) 9.710 4.891 ( 2.043 -1.000 4.846) 5.354 4.946 ( -2.275 5.559 -0.002) 6.006 5.071 ( -0.753 -4.307 -2.751) 5.166 5.224 ( -10.084 10.701 -0.963) 14.735 5.398 ( 3.398 0.773 -2.281) 4.165 5.406 ( 1.071 -3.443 1.888) 4.070 5.494 ( -3.761 -9.664 0.823) 10.402 5.701 ( 0.518 10.155 -0.747) 10.196 5.870 ( -1.304 -5.636 -3.440) 6.730 6.344 ( -2.671 1.032 1.331) 3.158 6.388 ( -0.790 -1.420 1.435) 2.168 6.587 ( 0.980 3.374 1.542) 3.837 6.648 ( -3.891 -0.536 -2.238) 4.520 6.769 ( -0.269 -1.174 4.464) 4.624 6.821 ( 1.892 -5.342 2.897) 6.365 7.035 ( -0.003 1.131 -1.473) 1.857 7.108 ( 0.491 -5.919 1.041) 6.030 7.949 ( 2.118 2.407 -3.583) 4.808 7.962 ( 2.945 1.866 -2.972) 4.581 8.309 ( 2.195 2.127 0.990) 3.212 8.391 ( -0.935 -3.931 0.649) 4.093 8.525 ( -1.241 4.402 -0.310) 4.585 8.628 ( 1.321 -5.913 4.021) 7.272 8.694 ( 0.216 1.614 -2.528) 3.007 8.781 ( -4.426 -5.159 -4.357) 8.074 9.268 ( -0.311 0.792 5.263) 5.332 9.302 ( 1.628 -2.253 2.715) 3.886 9.797 ( -0.450 5.765 -7.479) 9.454 9.878 ( -0.781 -2.018 -4.899) 5.356 10.274 ( -0.106 6.784 1.744) 7.006 10.423 ( 5.216 -4.813 -3.111) 7.749 10.735 ( -0.620 1.048 -6.803) 6.911 10.855 ( 0.631 -7.743 -2.614) 8.197 11.013 ( -0.765 -0.054 -3.403) 3.488 11.038 ( 1.090 -2.389 -2.236) 3.449 11.288 ( 1.611 3.184 -7.653) 8.443 11.369 ( 0.447 -3.980 -9.217) 10.049 11.510 ( -1.941 4.919 2.316) 5.773 11.627 ( -0.861 -5.799 4.235) 7.232 12.148 ( 3.971 6.991 7.924) 11.288 12.312 ( 1.412 -8.105 6.833) 10.695 12.649 ( 9.692 0.273 -2.637) 10.048 12.666 ( 8.789 -1.624 2.201) 9.205 12.951 ( -8.577 2.880 -1.922) 9.249 13.001 ( -6.509 -1.540 -3.878) 7.732 13.548 ( -2.431 0.550 0.866) 2.639 13.590 ( -4.336 -3.251 -0.107) 5.420 13.998 ( -2.368 1.855 -4.482) 5.398 14.049 ( -3.219 -2.570 -5.850) 7.154 14.739 ( -0.014 7.677 5.392) 9.382 14.885 ( -1.050 -5.801 5.007) 7.735 15.564 ( 1.234 6.794 -7.381) 10.107 15.635 ( 3.454 0.035 -9.147) 9.778 16.099 ( -0.712 5.259 5.362) 7.544 16.201 ( -1.992 -4.069 5.165) 6.870 16.718 ( 0.197 6.505 -5.282) 8.382 16.863 ( -1.157 -6.870 -6.134) 9.282 19.878 ( -0.509 2.443 8.589) 8.944 19.951 ( -0.390 -4.463 9.408) 10.420 20.476 ( 0.398 5.822 -1.983) 6.164 20.573 ( 0.515 -3.391 -0.724) 3.506 21.305 ( -2.433 0.191 14.313) 14.520 21.377 ( -2.668 -6.625 12.360) 14.275 22.010 ( -0.338 1.001 6.878) 6.958 22.054 ( -1.050 -2.852 6.513) 7.187 22.608 ( -0.146 4.058 4.768) 6.263 22.709 ( 0.611 -5.021 4.465) 6.747 23.738 ( -0.803 3.025 -0.151) 3.134 23.773 ( -0.242 -0.006 -0.414) 0.479 24.285 ( 0.595 1.568 -4.464) 4.769 24.327 ( 1.269 -2.491 -2.909) 4.035 25.119 ( 2.408 4.913 -11.719) 12.934 25.154 ( 2.309 1.566 -11.971) 12.291 ======================= Grid point 133 (65/104) ======================= q-point: ( 0.00 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.294 ( 4.614 0.000 17.629) 18.223 1.580 ( 5.666 0.000 15.425) 16.433 1.762 ( -2.643 0.000 1.711) 3.149 2.133 ( 2.477 0.000 12.559) 12.801 2.433 ( 1.319 0.000 -0.493) 1.408 2.592 ( -4.188 0.000 4.660) 6.266 2.791 ( 3.052 0.000 -5.809) 6.562 2.803 ( 1.844 0.000 -2.675) 3.249 2.862 ( -9.061 0.000 -1.716) 9.222 2.907 ( 2.053 0.000 -0.755) 2.187 3.256 ( -5.369 0.000 -3.513) 6.416 3.264 ( -0.685 0.000 8.773) 8.800 3.442 ( -4.208 0.000 3.800) 5.670 3.502 ( 3.807 0.000 0.743) 3.878 3.548 ( -2.584 0.000 14.579) 14.806 3.696 ( 3.630 0.000 7.235) 8.095 3.816 ( -1.809 0.000 5.006) 5.323 4.014 ( -4.301 0.000 1.016) 4.420 4.233 ( 10.295 0.000 0.547) 10.309 4.297 ( -7.596 0.000 -7.026) 10.348 4.367 ( -7.659 0.000 4.319) 8.793 4.443 ( 1.828 0.000 6.315) 6.575 4.735 ( 2.736 0.000 -2.285) 3.565 4.818 ( 1.359 0.000 -4.059) 4.280 4.863 ( 6.448 0.000 -1.923) 6.729 4.924 ( 1.481 0.000 -3.295) 3.613 5.150 ( -5.162 0.000 -7.452) 9.066 5.275 ( 3.577 0.000 -2.981) 4.656 5.511 ( -2.554 0.000 3.948) 4.702 5.607 ( -4.267 0.000 -2.287) 4.842 5.849 ( 0.004 0.000 1.698) 1.698 5.969 ( 1.058 0.000 -2.537) 2.748 6.255 ( 1.184 0.000 7.223) 7.320 6.415 ( -1.937 0.000 -0.928) 2.148 6.598 ( 0.673 0.000 -2.262) 2.361 6.699 ( -1.983 0.000 -5.078) 5.452 6.992 ( 6.044 0.000 5.291) 8.032 7.012 ( -4.838 0.000 0.017) 4.838 7.064 ( 3.471 0.000 1.164) 3.661 7.180 ( 0.021 0.000 -1.818) 1.818 7.662 ( -3.235 0.000 -0.148) 3.238 7.782 ( 5.511 0.000 -5.060) 7.481 8.250 ( 4.772 0.000 -0.009) 4.772 8.332 ( -4.165 0.000 -2.394) 4.804 8.485 ( 0.132 0.000 -1.875) 1.879 8.510 ( -6.202 0.000 -3.628) 7.185 8.913 ( -4.377 0.000 1.167) 4.530 8.978 ( 6.075 0.000 -2.516) 6.575 9.255 ( -3.286 0.000 4.307) 5.418 9.356 ( -2.503 0.000 0.234) 2.514 9.814 ( -1.884 0.000 5.102) 5.439 10.000 ( 11.414 0.000 -1.342) 11.493 10.506 ( -2.611 0.000 -0.586) 2.675 10.558 ( 6.104 0.000 -0.824) 6.159 10.742 ( -12.232 0.000 -5.707) 13.498 10.770 ( 0.302 0.000 -5.649) 5.657 11.035 ( -6.482 0.000 -0.237) 6.487 11.212 ( -4.188 0.000 -4.412) 6.083 11.266 ( -6.027 0.000 0.508) 6.048 11.332 ( 2.024 0.000 -7.151) 7.432 11.705 ( 17.586 0.000 6.046) 18.596 11.977 ( -4.893 0.000 -3.912) 6.264 12.051 ( -0.028 0.000 1.499) 1.499 12.227 ( -2.110 0.000 -8.295) 8.559 12.591 ( 14.533 0.000 0.892) 14.560 12.691 ( -10.024 0.000 -1.655) 10.160 13.040 ( -9.341 0.000 6.892) 11.608 13.147 ( 15.311 0.000 0.798) 15.332 13.565 ( 2.843 0.000 4.227) 5.094 13.722 ( -1.628 0.000 -3.543) 3.899 13.872 ( 0.278 0.000 2.458) 2.473 13.989 ( -4.573 0.000 -3.783) 5.935 14.611 ( -0.860 0.000 1.209) 1.484 14.745 ( 1.406 0.000 -4.421) 4.639 15.118 ( 1.956 0.000 2.605) 3.258 15.189 ( 0.389 0.000 -0.955) 1.032 16.182 ( 1.821 0.000 4.675) 5.017 16.360 ( 0.444 0.000 -3.987) 4.012 16.531 ( -1.393 0.000 10.992) 11.080 16.930 ( 0.715 0.000 -9.027) 9.056 19.960 ( 1.174 0.000 4.674) 4.820 20.110 ( -2.233 0.000 -2.658) 3.471 20.375 ( -2.009 0.000 9.054) 9.274 20.685 ( -4.513 0.000 -3.511) 5.718 21.933 ( 1.033 0.000 12.280) 12.324 22.185 ( -1.683 0.000 7.218) 7.411 22.286 ( -1.061 0.000 7.505) 7.579 22.513 ( 0.353 0.000 -4.200) 4.214 22.574 ( -1.001 0.000 3.363) 3.509 22.720 ( 4.594 0.000 -1.361) 4.791 23.461 ( -0.304 0.000 4.130) 4.141 23.500 ( 0.519 0.000 0.342) 0.622 24.077 ( 0.422 0.000 2.641) 2.674 24.392 ( 1.286 0.000 -11.895) 11.964 24.476 ( -1.380 0.000 1.084) 1.755 24.691 ( 2.856 0.000 -9.576) 9.992 ======================= Grid point 134 (66/104) ======================= q-point: ( 0.17 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.500 ( 11.903 0.000 10.842) 16.101 1.770 ( 9.828 0.000 -5.703) 11.363 1.799 ( 7.046 0.000 21.688) 22.804 2.181 ( 1.206 0.000 2.089) 2.412 2.451 ( -11.262 0.000 -0.396) 11.269 2.492 ( 2.728 0.000 8.917) 9.325 2.612 ( -13.375 0.000 -4.446) 14.094 2.832 ( 0.012 0.000 2.258) 2.258 2.847 ( 1.219 0.000 0.497) 1.316 2.883 ( -2.916 0.000 -3.646) 4.669 3.125 ( -8.154 0.000 1.408) 8.274 3.258 ( -2.185 0.000 -3.282) 3.943 3.394 ( 0.056 0.000 16.216) 16.216 3.530 ( -2.704 0.000 13.558) 13.824 3.583 ( 3.574 0.000 1.351) 3.821 3.786 ( -2.668 0.000 2.487) 3.648 3.827 ( 6.292 0.000 2.084) 6.628 3.928 ( -3.031 0.000 3.704) 4.786 4.097 ( -10.706 0.000 -3.975) 11.420 4.213 ( -9.209 0.000 3.554) 9.871 4.327 ( -2.917 0.000 7.214) 7.782 4.453 ( -0.026 0.000 -0.371) 0.372 4.772 ( 2.440 0.000 -2.719) 3.654 4.881 ( 4.382 0.000 -1.804) 4.739 4.964 ( 4.847 0.000 -11.818) 12.773 5.027 ( 9.430 0.000 -1.061) 9.489 5.048 ( -4.283 0.000 -0.983) 4.394 5.261 ( -3.080 0.000 -5.945) 6.695 5.451 ( -3.471 0.000 4.936) 6.035 5.505 ( -5.463 0.000 0.270) 5.469 5.939 ( 7.199 0.000 4.790) 8.647 6.041 ( 6.355 0.000 -3.360) 7.189 6.317 ( 3.338 0.000 5.214) 6.191 6.400 ( -0.015 0.000 -0.031) 0.034 6.643 ( 5.239 0.000 0.036) 5.239 6.667 ( -0.001 0.000 -6.688) 6.688 6.918 ( -5.001 0.000 -1.723) 5.289 7.037 ( -1.542 0.000 5.334) 5.553 7.128 ( -5.049 0.000 -2.137) 5.483 7.142 ( 3.472 0.000 -0.533) 3.513 7.598 ( -2.688 0.000 -4.310) 5.079 7.770 ( -5.685 0.000 -2.535) 6.225 8.332 ( 3.203 0.000 2.616) 4.136 8.333 ( 5.697 0.000 -5.524) 7.936 8.436 ( -1.175 0.000 -0.448) 1.258 8.524 ( 3.684 0.000 2.255) 4.320 8.826 ( -4.453 0.000 0.051) 4.453 9.046 ( 1.237 0.000 -2.430) 2.727 9.188 ( -3.898 0.000 2.854) 4.831 9.225 ( -9.376 0.000 2.530) 9.711 9.885 ( 6.976 0.000 2.478) 7.403 10.195 ( 7.184 0.000 1.350) 7.309 10.435 ( -16.851 0.000 4.282) 17.387 10.475 ( 1.503 0.000 -8.123) 8.261 10.646 ( 2.099 0.000 0.038) 2.099 10.773 ( 0.746 0.000 -0.102) 0.753 10.932 ( -3.751 0.000 2.513) 4.515 11.103 ( -5.925 0.000 -0.834) 5.984 11.214 ( 0.416 0.000 -1.763) 1.811 11.372 ( 3.616 0.000 -6.580) 7.508 11.965 ( 3.766 0.000 -10.339) 11.004 12.009 ( 4.934 0.000 0.968) 5.028 12.080 ( 8.094 0.000 4.339) 9.184 12.097 ( -7.216 0.000 -5.510) 9.079 12.455 ( -12.278 0.000 -2.632) 12.557 12.819 ( 7.948 0.000 -0.961) 8.006 12.914 ( -4.224 0.000 4.878) 6.453 13.438 ( 13.016 0.000 -3.425) 13.459 13.609 ( 0.662 0.000 3.428) 3.491 13.660 ( -3.297 0.000 -3.194) 4.590 13.911 ( 2.640 0.000 4.179) 4.943 13.956 ( 2.572 0.000 -2.559) 3.628 14.631 ( 2.186 0.000 2.779) 3.536 14.786 ( 3.877 0.000 -6.102) 7.230 15.119 ( -2.455 0.000 2.187) 3.288 15.163 ( -2.406 0.000 -3.082) 3.910 16.210 ( 0.013 0.000 2.020) 2.020 16.351 ( -0.277 0.000 -3.882) 3.892 16.543 ( -0.321 0.000 11.256) 11.261 16.933 ( 1.839 0.000 -8.881) 9.069 19.983 ( -0.158 0.000 4.806) 4.808 20.054 ( -2.515 0.000 -1.529) 2.943 20.371 ( -0.856 0.000 10.038) 10.074 20.657 ( 1.568 0.000 0.125) 1.573 21.952 ( -1.960 0.000 11.518) 11.684 22.164 ( -2.137 0.000 6.251) 6.606 22.277 ( -1.748 0.000 7.188) 7.397 22.459 ( -3.513 0.000 -1.795) 3.945 22.574 ( 0.127 0.000 3.336) 3.338 22.834 ( 6.461 0.000 -5.810) 8.689 23.457 ( -1.036 0.000 2.765) 2.953 23.514 ( 0.632 0.000 0.981) 1.167 24.086 ( -0.160 0.000 1.923) 1.930 24.387 ( 1.274 0.000 -11.921) 11.989 24.450 ( -1.392 0.000 0.945) 1.683 24.698 ( 0.398 0.000 -9.307) 9.315 ======================= Grid point 135 (67/104) ======================= q-point: ( 0.33 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.723 ( 8.998 0.000 6.677) 11.204 1.965 ( 14.756 0.000 -1.611) 14.843 2.047 ( 10.968 0.000 17.125) 20.336 2.210 ( 1.926 0.000 -0.496) 1.989 2.242 ( -8.977 0.000 -3.837) 9.762 2.345 ( -15.668 0.000 2.914) 15.936 2.549 ( 0.268 0.000 11.520) 11.523 2.650 ( -15.488 0.000 -0.761) 15.507 2.827 ( -1.748 0.000 3.739) 4.127 2.925 ( 2.137 0.000 -4.693) 5.157 2.975 ( -7.363 0.000 0.923) 7.421 3.184 ( -2.581 0.000 -10.670) 10.978 3.490 ( -2.659 0.000 16.390) 16.604 3.575 ( 9.196 0.000 19.564) 21.617 3.618 ( -0.693 0.000 3.380) 3.450 3.748 ( 0.045 0.000 -2.767) 2.767 3.779 ( -5.068 0.000 -1.468) 5.276 3.900 ( -10.402 0.000 6.423) 12.225 4.068 ( 11.217 0.000 -0.605) 11.234 4.108 ( -2.204 0.000 2.029) 2.995 4.219 ( -7.270 0.000 7.629) 10.538 4.455 ( -1.915 0.000 -0.546) 1.991 4.817 ( 3.024 0.000 -1.644) 3.441 4.889 ( -0.836 0.000 -6.639) 6.692 4.991 ( -1.572 0.000 -0.703) 1.721 5.044 ( 4.581 0.000 -5.991) 7.542 5.129 ( -0.913 0.000 0.333) 0.972 5.184 ( -1.344 0.000 -9.059) 9.158 5.447 ( 1.422 0.000 6.732) 6.881 5.449 ( 0.118 0.000 3.612) 3.613 6.063 ( 3.384 0.000 5.602) 6.545 6.108 ( 0.177 0.000 -4.532) 4.536 6.407 ( 1.287 0.000 -0.711) 1.470 6.422 ( 7.356 0.000 3.842) 8.299 6.681 ( 3.464 0.000 -5.259) 6.297 6.793 ( 9.846 0.000 0.869) 9.884 6.829 ( -3.780 0.000 -2.903) 4.766 6.983 ( -5.217 0.000 1.557) 5.444 6.997 ( -7.603 0.000 -1.772) 7.807 7.152 ( -2.460 0.000 -0.428) 2.497 7.559 ( 0.358 0.000 -6.464) 6.474 7.626 ( -7.716 0.000 -1.280) 7.822 8.381 ( 0.737 0.000 4.588) 4.646 8.449 ( 4.099 0.000 0.224) 4.105 8.475 ( 7.828 0.000 -5.517) 9.577 8.597 ( 2.794 0.000 6.738) 7.295 8.772 ( -1.120 0.000 -2.366) 2.618 8.994 ( -5.377 0.000 -0.823) 5.439 9.105 ( -2.951 0.000 0.638) 3.019 9.151 ( -1.050 0.000 -0.326) 1.099 10.037 ( 8.259 0.000 2.449) 8.614 10.195 ( -10.346 0.000 9.696) 14.179 10.206 ( -5.291 0.000 2.857) 6.013 10.560 ( 9.171 0.000 -13.417) 16.252 10.668 ( 0.544 0.000 4.775) 4.806 10.780 ( -1.572 0.000 5.674) 5.887 10.904 ( -0.050 0.000 1.305) 1.306 11.022 ( -1.548 0.000 -2.423) 2.875 11.247 ( 3.249 0.000 -6.011) 6.833 11.401 ( 0.257 0.000 -7.784) 7.788 11.907 ( -7.210 0.000 -8.269) 10.971 12.002 ( -2.485 0.000 2.504) 3.528 12.014 ( -12.290 0.000 -8.179) 14.763 12.078 ( 5.932 0.000 -6.648) 8.910 12.462 ( 7.565 0.000 6.723) 10.121 12.868 ( -1.921 0.000 -2.517) 3.166 12.950 ( 6.488 0.000 7.879) 10.206 13.566 ( 3.974 0.000 -3.621) 5.376 13.603 ( -2.043 0.000 2.705) 3.390 13.623 ( -0.612 0.000 -5.447) 5.481 13.974 ( 2.612 0.000 4.468) 5.175 14.050 ( 6.794 0.000 -2.555) 7.259 14.682 ( 1.857 0.000 4.577) 4.939 14.841 ( 3.381 0.000 -5.879) 6.782 15.048 ( -5.292 0.000 1.128) 5.411 15.103 ( -2.327 0.000 -5.437) 5.914 16.190 ( -2.417 0.000 1.886) 3.066 16.336 ( -0.244 0.000 -3.765) 3.773 16.566 ( -0.411 0.000 11.439) 11.446 16.951 ( 2.245 0.000 -8.651) 8.938 19.973 ( -2.007 0.000 4.632) 5.048 20.028 ( 0.103 0.000 -0.664) 0.672 20.390 ( -0.086 0.000 10.972) 10.972 20.727 ( 5.774 0.000 -1.441) 5.951 21.917 ( -4.963 0.000 12.159) 13.133 22.145 ( -1.147 0.000 5.004) 5.134 22.262 ( -1.638 0.000 7.148) 7.334 22.399 ( -2.692 0.000 0.127) 2.695 22.590 ( 0.428 0.000 4.445) 4.466 22.901 ( 2.508 0.000 -7.321) 7.738 23.441 ( -1.279 0.000 2.647) 2.940 23.524 ( 0.154 0.000 0.594) 0.613 24.079 ( -1.016 0.000 1.516) 1.825 24.383 ( 1.542 0.000 -11.997) 12.096 24.438 ( -0.033 0.000 0.998) 0.999 24.669 ( -0.962 0.000 -8.414) 8.469 ======================= Grid point 136 (68/104) ======================= q-point: (-0.50 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.832 ( -0.832 0.000 9.539) 9.576 1.999 ( -18.171 0.000 8.540) 20.078 2.098 ( -5.669 0.000 -2.940) 6.386 2.183 ( -12.928 0.000 4.454) 13.674 2.291 ( 17.408 0.000 5.668) 18.308 2.322 ( 10.681 0.000 8.661) 13.751 2.347 ( -3.222 0.000 -5.032) 5.975 2.644 ( 3.815 0.000 9.821) 10.535 2.786 ( -1.417 0.000 6.310) 6.467 2.910 ( -1.643 0.000 -8.707) 8.860 2.910 ( 0.029 0.000 -1.944) 1.944 3.147 ( 2.176 0.000 -12.035) 12.230 3.436 ( -5.593 0.000 16.790) 17.697 3.574 ( -4.167 0.000 3.792) 5.635 3.691 ( -4.488 0.000 13.919) 14.625 3.722 ( -0.834 0.000 -0.743) 1.117 3.797 ( 0.028 0.000 -3.970) 3.970 3.888 ( 12.019 0.000 15.657) 19.738 4.140 ( -2.770 0.000 5.293) 5.974 4.148 ( 6.039 0.000 2.694) 6.612 4.249 ( 7.492 0.000 -4.812) 8.905 4.347 ( -7.996 0.000 -4.538) 9.194 4.866 ( 2.015 0.000 -0.251) 2.031 4.867 ( -1.005 0.000 -1.147) 1.525 4.951 ( -1.857 0.000 -0.855) 2.045 5.062 ( -3.607 0.000 -1.218) 3.807 5.116 ( -4.752 0.000 -6.736) 8.244 5.128 ( 6.026 0.000 -5.356) 8.062 5.501 ( 1.779 0.000 6.613) 6.848 5.522 ( 5.305 0.000 3.355) 6.277 6.045 ( -4.424 0.000 -2.989) 5.339 6.066 ( -3.213 0.000 1.284) 3.460 6.479 ( 6.353 0.000 3.419) 7.214 6.558 ( 4.863 0.000 1.268) 5.025 6.712 ( -9.746 0.000 -2.741) 10.124 6.753 ( 4.206 0.000 -3.880) 5.722 6.863 ( -6.741 0.000 -1.221) 6.850 6.883 ( 2.151 0.000 -0.435) 2.195 7.022 ( 9.616 0.000 0.137) 9.617 7.057 ( -7.247 0.000 -1.241) 7.352 7.515 ( -3.342 0.000 -1.793) 3.793 7.584 ( 3.610 0.000 -5.533) 6.607 8.357 ( -4.457 0.000 4.758) 6.520 8.534 ( 4.980 0.000 0.103) 4.981 8.593 ( 4.959 0.000 -4.771) 6.881 8.643 ( -0.656 0.000 0.738) 0.988 8.790 ( 4.608 0.000 1.671) 4.901 8.894 ( -4.383 0.000 -1.197) 4.543 9.115 ( 3.102 0.000 -0.790) 3.201 9.128 ( -0.758 0.000 -1.653) 1.818 10.076 ( -8.620 0.000 2.601) 9.004 10.080 ( -4.043 0.000 8.773) 9.660 10.191 ( 5.733 0.000 3.040) 6.489 10.677 ( 3.761 0.000 -8.817) 9.586 10.745 ( -0.401 0.000 0.401) 0.567 10.747 ( 7.794 0.000 12.234) 14.506 10.927 ( 2.071 0.000 0.396) 2.109 11.044 ( 3.638 0.000 -1.153) 3.817 11.267 ( 0.206 0.000 -11.160) 11.162 11.325 ( -4.563 0.000 -13.253) 14.017 11.773 ( -5.044 0.000 -1.157) 5.175 11.774 ( -10.573 0.000 -1.772) 10.721 12.002 ( 0.989 0.000 0.161) 1.002 12.175 ( 6.065 0.000 -9.713) 11.451 12.597 ( 6.065 0.000 5.970) 8.510 12.776 ( -5.720 0.000 -3.567) 6.741 13.124 ( 7.593 0.000 11.398) 13.695 13.537 ( -7.801 0.000 -9.890) 12.596 13.552 ( -3.925 0.000 2.156) 4.478 13.637 ( 4.386 0.000 -1.496) 4.634 14.009 ( -0.383 0.000 3.520) 3.541 14.148 ( 3.975 0.000 -3.774) 5.481 14.711 ( 0.038 0.000 4.925) 4.925 14.880 ( 2.456 0.000 -3.785) 4.513 14.947 ( -5.460 0.000 0.040) 5.460 15.070 ( 0.382 0.000 -5.583) 5.596 16.145 ( -2.821 0.000 4.256) 5.106 16.329 ( 0.523 0.000 -3.778) 3.814 16.576 ( -1.541 0.000 11.280) 11.385 16.966 ( 1.584 0.000 -8.567) 8.712 19.942 ( -2.272 0.000 4.405) 4.957 20.050 ( 2.237 0.000 -0.652) 2.330 20.410 ( -0.726 0.000 10.795) 10.819 20.843 ( 7.160 0.000 -7.182) 10.142 21.838 ( -6.518 0.000 15.031) 16.384 22.150 ( 0.327 0.000 4.744) 4.755 22.254 ( -1.050 0.000 7.598) 7.670 22.363 ( -1.362 0.000 1.475) 2.008 22.605 ( -0.230 0.000 5.444) 5.449 22.894 ( -1.204 0.000 -7.144) 7.245 23.429 ( -0.722 0.000 3.828) 3.896 23.520 ( -0.483 0.000 -0.484) 0.684 24.062 ( -1.049 0.000 1.962) 2.225 24.386 ( 1.898 0.000 -12.076) 12.224 24.453 ( 1.118 0.000 1.110) 1.575 24.634 ( -0.439 0.000 -7.904) 7.916 ======================= Grid point 137 (69/104) ======================= q-point: (-0.33 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.624 ( -21.752 0.000 13.010) 25.345 1.698 ( -15.443 0.000 11.731) 19.393 1.984 ( -6.909 0.000 0.088) 6.910 2.021 ( -2.002 0.000 7.892) 8.142 2.398 ( 4.327 0.000 -2.707) 5.104 2.482 ( 6.031 0.000 10.518) 12.124 2.593 ( 10.337 0.000 3.378) 10.875 2.732 ( 3.056 0.000 8.700) 9.221 2.845 ( -1.502 0.000 -14.273) 14.352 2.894 ( 6.852 0.000 2.092) 7.164 2.961 ( 10.738 0.000 -0.962) 10.781 3.202 ( 5.319 0.000 -9.000) 10.454 3.403 ( -2.095 0.000 19.833) 19.943 3.513 ( -3.197 0.000 3.068) 4.431 3.624 ( -5.505 0.000 15.765) 16.699 3.734 ( 2.024 0.000 0.662) 2.129 3.815 ( 1.746 0.000 -3.819) 4.200 4.102 ( -8.537 0.000 -4.311) 9.564 4.126 ( 10.376 0.000 10.812) 14.986 4.137 ( -4.311 0.000 2.975) 5.237 4.310 ( 9.152 0.000 1.958) 9.359 4.369 ( 4.165 0.000 -5.949) 7.262 4.832 ( -1.547 0.000 -4.031) 4.318 4.854 ( -3.967 0.000 -2.004) 4.444 4.931 ( -0.869 0.000 2.379) 2.533 4.963 ( -6.648 0.000 -5.096) 8.377 5.071 ( 2.564 0.000 -0.737) 2.668 5.226 ( 5.308 0.000 -6.016) 8.022 5.522 ( -1.261 0.000 4.524) 4.697 5.619 ( 4.022 0.000 1.100) 4.170 5.982 ( -1.590 0.000 2.767) 3.192 5.994 ( -4.273 0.000 0.056) 4.273 6.483 ( -12.290 0.000 -0.081) 12.291 6.609 ( 0.759 0.000 -3.361) 3.445 6.621 ( 3.294 0.000 4.600) 5.658 6.681 ( -3.018 0.000 -7.057) 7.675 6.879 ( 4.741 0.000 2.210) 5.231 6.906 ( -7.349 0.000 -1.550) 7.510 6.988 ( 7.221 0.000 1.161) 7.314 7.140 ( 2.145 0.000 -0.405) 2.183 7.520 ( 4.917 0.000 -3.899) 6.276 7.649 ( 4.049 0.000 -3.014) 5.048 8.266 ( -5.626 0.000 3.115) 6.431 8.547 ( -3.627 0.000 -3.799) 5.252 8.589 ( -3.500 0.000 -4.006) 5.320 8.681 ( 5.516 0.000 1.068) 5.619 8.824 ( -3.067 0.000 -4.850) 5.739 8.906 ( 5.188 0.000 3.404) 6.205 9.155 ( 4.636 0.000 -0.945) 4.731 9.192 ( 5.510 0.000 -1.685) 5.762 9.927 ( -7.599 0.000 3.751) 8.474 10.026 ( -5.709 0.000 11.371) 12.724 10.290 ( 6.201 0.000 -2.936) 6.861 10.632 ( -4.522 0.000 4.237) 6.197 10.792 ( 3.970 0.000 -17.696) 18.136 10.947 ( 2.046 0.000 1.568) 2.577 11.058 ( 17.560 0.000 13.315) 22.038 11.126 ( 5.298 0.000 2.674) 5.935 11.198 ( -3.454 0.000 -13.032) 13.482 11.250 ( 1.555 0.000 -15.742) 15.818 11.600 ( -8.939 0.000 4.262) 9.903 11.740 ( 1.903 0.000 4.176) 4.589 12.026 ( 1.375 0.000 -1.026) 1.716 12.229 ( 1.612 0.000 -9.802) 9.933 12.684 ( -2.939 0.000 -4.256) 5.172 12.726 ( 5.867 0.000 5.840) 8.278 13.227 ( -0.275 0.000 11.288) 11.291 13.273 ( -17.321 0.000 -10.832) 20.429 13.492 ( -2.169 0.000 2.333) 3.185 13.704 ( 3.075 0.000 -1.994) 3.665 13.973 ( -3.886 0.000 2.080) 4.408 14.163 ( -1.076 0.000 -5.496) 5.600 14.703 ( -2.172 0.000 2.745) 3.500 14.848 ( -4.805 0.000 -1.648) 5.079 14.940 ( 4.553 0.000 0.580) 4.590 15.094 ( 3.151 0.000 -2.644) 4.113 16.120 ( -1.152 0.000 6.797) 6.894 16.337 ( 1.332 0.000 -3.895) 4.117 16.564 ( -2.589 0.000 11.031) 11.331 16.965 ( 0.506 0.000 -8.696) 8.710 19.921 ( -0.962 0.000 4.281) 4.387 20.096 ( 2.628 0.000 -1.071) 2.838 20.412 ( -1.814 0.000 9.790) 9.957 20.910 ( 1.609 0.000 -14.721) 14.809 21.790 ( -2.065 0.000 19.258) 19.369 22.173 ( 0.497 0.000 5.592) 5.614 22.261 ( -0.274 0.000 7.981) 7.986 22.363 ( 1.246 0.000 2.327) 2.640 22.605 ( -1.192 0.000 5.553) 5.679 22.829 ( -3.843 0.000 -5.849) 6.998 23.434 ( 0.020 0.000 5.096) 5.096 23.507 ( -0.644 0.000 -1.160) 1.327 24.055 ( -0.323 0.000 2.731) 2.750 24.393 ( 1.904 0.000 -12.070) 12.219 24.477 ( 0.994 0.000 1.202) 1.560 24.623 ( 1.518 0.000 -7.963) 8.107 ======================= Grid point 138 (70/104) ======================= q-point: (-0.17 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.317 ( -12.541 0.000 17.769) 21.749 1.533 ( -5.270 0.000 15.234) 16.120 1.853 ( -6.892 0.000 1.272) 7.008 2.053 ( 1.716 0.000 14.414) 14.516 2.435 ( 0.442 0.000 -3.791) 3.817 2.590 ( 2.672 0.000 6.961) 7.457 2.729 ( 5.120 0.000 2.957) 5.913 2.770 ( 0.664 0.000 -3.902) 3.958 2.846 ( 4.212 0.000 -4.661) 6.282 2.943 ( 0.381 0.000 -1.443) 1.493 3.232 ( 11.362 0.000 -2.254) 11.584 3.252 ( 0.940 0.000 2.323) 2.506 3.449 ( 1.188 0.000 12.885) 12.940 3.475 ( -1.231 0.000 1.702) 2.101 3.571 ( -4.060 0.000 13.272) 13.879 3.726 ( -5.927 0.000 0.720) 5.970 3.829 ( -0.072 0.000 0.996) 0.999 3.992 ( 4.507 0.000 -0.260) 4.514 4.117 ( -0.849 0.000 1.135) 1.418 4.306 ( 5.496 0.000 6.949) 8.859 4.404 ( 1.070 0.000 1.543) 1.878 4.440 ( 2.975 0.000 -1.131) 3.182 4.733 ( -5.022 0.000 -4.981) 7.073 4.814 ( 0.962 0.000 -6.977) 7.043 4.855 ( -3.376 0.000 -3.757) 5.051 4.922 ( -0.770 0.000 2.648) 2.757 5.167 ( 6.838 0.000 0.497) 6.856 5.248 ( -1.855 0.000 -8.917) 9.108 5.510 ( 0.081 0.000 4.056) 4.057 5.655 ( -0.205 0.000 -2.346) 2.355 5.910 ( -4.974 0.000 0.833) 5.043 5.983 ( -0.603 0.000 3.471) 3.522 6.289 ( -7.417 0.000 2.949) 7.982 6.496 ( -6.453 0.000 -4.557) 7.900 6.605 ( -0.171 0.000 -3.590) 3.594 6.768 ( -4.045 0.000 -0.788) 4.121 6.832 ( 8.462 0.000 0.629) 8.485 6.987 ( 4.712 0.000 4.212) 6.320 7.078 ( -0.791 0.000 2.039) 2.187 7.147 ( 2.288 0.000 -1.967) 3.018 7.648 ( 8.965 0.000 -5.429) 10.481 7.693 ( 0.422 0.000 0.348) 0.547 8.203 ( -0.627 0.000 0.182) 0.653 8.442 ( -6.205 0.000 -1.869) 6.480 8.519 ( -2.676 0.000 -3.975) 4.792 8.655 ( -7.165 0.000 -4.366) 8.391 8.857 ( 6.998 0.000 -2.560) 7.451 8.957 ( -0.424 0.000 2.266) 2.306 9.251 ( 3.458 0.000 2.192) 4.094 9.304 ( 6.391 0.000 -2.284) 6.787 9.864 ( 1.644 0.000 1.547) 2.258 9.913 ( -8.546 0.000 9.156) 12.524 10.421 ( 8.320 0.000 -2.477) 8.681 10.563 ( -3.809 0.000 2.630) 4.629 10.787 ( 0.423 0.000 -12.622) 12.629 10.912 ( -5.219 0.000 -4.778) 7.075 11.115 ( -2.317 0.000 -5.555) 6.019 11.232 ( 4.186 0.000 -9.534) 10.412 11.304 ( 6.396 0.000 -8.967) 11.015 11.330 ( 3.881 0.000 0.081) 3.882 11.494 ( -1.385 0.000 11.168) 11.253 11.955 ( 19.208 0.000 10.360) 21.824 12.043 ( 0.702 0.000 -0.351) 0.785 12.166 ( -5.732 0.000 -6.674) 8.798 12.584 ( -8.445 0.000 -8.683) 12.112 12.795 ( -0.893 0.000 2.760) 2.901 13.005 ( -3.211 0.000 -2.201) 3.893 13.175 ( -7.003 0.000 9.494) 11.797 13.503 ( 2.131 0.000 3.967) 4.503 13.735 ( 0.871 0.000 -2.855) 2.985 13.900 ( -3.621 0.000 1.255) 3.832 14.094 ( -4.596 0.000 -5.499) 7.167 14.651 ( -3.305 0.000 0.933) 3.434 14.767 ( -2.887 0.000 -2.346) 3.720 15.041 ( 5.286 0.000 2.289) 5.761 15.154 ( 3.202 0.000 -0.485) 3.238 16.137 ( 1.046 0.000 7.083) 7.159 16.353 ( 1.284 0.000 -3.986) 4.188 16.542 ( -2.539 0.000 10.922) 11.213 16.947 ( 0.044 0.000 -8.926) 8.926 19.929 ( 0.653 0.000 4.381) 4.429 20.128 ( 0.907 0.000 -2.005) 2.201 20.395 ( -2.346 0.000 8.978) 9.280 20.820 ( -6.485 0.000 -12.141) 13.764 21.856 ( 3.112 0.000 16.182) 16.479 22.188 ( -0.544 0.000 6.857) 6.878 22.278 ( -0.170 0.000 7.793) 7.795 22.433 ( 5.879 0.000 0.435) 5.895 22.590 ( -1.646 0.000 4.600) 4.886 22.739 ( -4.191 0.000 -3.130) 5.231 23.450 ( 0.199 0.000 5.285) 5.288 23.497 ( -0.119 0.000 -0.722) 0.732 24.062 ( 0.315 0.000 3.012) 3.028 24.395 ( 1.546 0.000 -11.959) 12.059 24.488 ( -0.168 0.000 1.221) 1.232 24.651 ( 3.447 0.000 -8.710) 9.368 ======================= Grid point 139 (71/104) ======================= q-point: ( 0.00 0.14 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.389 ( 6.052 8.744 14.848) 18.263 1.645 ( 1.229 6.714 15.025) 16.502 1.816 ( -1.753 5.117 -0.048) 5.409 2.320 ( -1.226 12.133 -0.941) 12.231 2.523 ( -0.677 9.413 4.319) 10.379 2.660 ( 3.291 -4.241 -2.909) 6.106 2.717 ( -3.617 9.688 6.301) 12.110 2.804 ( 0.289 -1.032 4.473) 4.599 2.886 ( 3.683 1.370 0.888) 4.029 3.079 ( -1.735 9.169 -4.761) 10.476 3.176 ( -3.814 -2.810 0.760) 4.798 3.327 ( 0.682 -0.053 -3.750) 3.812 3.425 ( -4.294 1.516 9.083) 10.160 3.512 ( 2.583 0.501 0.942) 2.794 3.538 ( -2.194 0.341 8.572) 8.855 3.690 ( -2.602 -6.382 4.705) 8.345 3.822 ( -1.753 6.749 7.138) 9.979 4.043 ( -3.122 1.702 0.456) 3.585 4.206 ( 2.922 -1.381 1.342) 3.499 4.310 ( -1.765 -0.763 -3.274) 3.797 4.413 ( 3.785 5.566 6.256) 9.189 4.507 ( -3.688 5.850 4.944) 8.501 4.754 ( 2.612 1.950 -2.322) 4.002 4.832 ( -0.426 1.508 -6.434) 6.622 4.947 ( 4.411 5.835 2.219) 7.644 4.983 ( 2.630 5.512 -0.543) 6.132 5.130 ( -3.890 -0.998 -4.944) 6.369 5.261 ( 1.377 -0.897 -6.564) 6.767 5.470 ( -2.588 -3.561 4.196) 6.082 5.586 ( -1.000 -1.451 -0.813) 1.941 5.803 ( -0.280 -4.182 2.437) 4.848 5.953 ( 0.355 -2.558 -3.652) 4.473 6.263 ( 2.127 1.791 5.611) 6.263 6.408 ( -2.255 -0.811 -1.315) 2.733 6.588 ( -2.781 -3.664 -1.690) 4.900 6.661 ( 0.754 0.021 -4.892) 4.949 6.922 ( -0.988 -3.507 3.152) 4.817 6.983 ( 4.649 -3.991 0.126) 6.129 7.084 ( -1.228 1.711 4.218) 4.714 7.251 ( 0.794 2.456 -2.968) 3.933 7.721 ( -2.477 5.625 -0.152) 6.149 7.829 ( 4.519 4.092 -3.974) 7.278 8.245 ( 3.924 0.249 -0.813) 4.015 8.311 ( -3.786 -2.339 -3.543) 5.689 8.439 ( -0.882 -1.239 1.396) 2.064 8.556 ( -4.622 1.580 -5.647) 7.466 8.895 ( -4.194 -1.963 2.376) 5.205 8.986 ( 4.608 -0.216 -2.617) 5.304 9.275 ( -2.320 2.210 3.616) 4.832 9.344 ( -1.966 -0.812 0.734) 2.251 9.750 ( -0.742 -5.373 4.563) 7.088 9.958 ( 9.483 -3.779 -2.802) 10.586 10.391 ( -5.174 -7.174 3.267) 9.429 10.545 ( 7.140 -1.513 -3.031) 7.903 10.732 ( -1.258 -2.518 -5.648) 6.310 10.785 ( -6.602 1.225 -6.505) 9.349 11.024 ( -6.877 -0.911 -0.076) 6.937 11.132 ( -7.533 -4.689 1.950) 9.085 11.258 ( 1.094 -2.122 -7.414) 7.789 11.329 ( 5.122 -0.724 -4.389) 6.784 11.720 ( 17.060 1.073 7.522) 18.676 11.998 ( -3.141 -1.161 -0.726) 3.426 12.055 ( -2.149 3.397 0.938) 4.128 12.292 ( -5.749 3.274 -9.271) 11.389 12.566 ( 9.369 -0.607 1.146) 9.458 12.686 ( -7.546 -0.656 -2.416) 7.951 13.009 ( -4.564 -2.509 4.550) 6.916 13.048 ( 9.573 -5.549 2.566) 11.358 13.619 ( 1.335 1.410 1.189) 2.277 13.698 ( 0.955 -2.687 -1.759) 3.351 13.854 ( -1.071 -0.624 0.848) 1.502 13.953 ( -3.481 -2.935 -3.914) 6.004 14.619 ( 2.183 2.858 4.336) 5.633 14.871 ( -1.695 8.107 -7.803) 11.380 15.110 ( -0.495 2.388 6.144) 6.610 15.305 ( 3.507 7.676 -5.041) 9.831 16.174 ( 1.416 -0.462 5.424) 5.625 16.354 ( -0.801 -0.734 -1.919) 2.205 16.536 ( -0.953 0.604 7.884) 7.964 16.909 ( 1.252 -2.164 -9.077) 9.415 19.967 ( 0.904 0.787 5.314) 5.448 20.128 ( -1.980 1.659 -2.301) 3.459 20.370 ( -1.613 -0.521 8.411) 8.580 20.672 ( -2.789 -1.480 -3.729) 4.886 21.828 ( 0.751 -7.816 11.641) 14.042 22.054 ( 0.369 -16.854 3.405) 17.199 22.260 ( -1.101 -1.772 10.559) 10.763 22.289 ( -1.842 -2.234 10.751) 11.134 22.639 ( -0.447 -3.211 0.371) 3.263 22.795 ( 1.826 4.876 -5.590) 7.639 23.553 ( 0.348 4.190 0.910) 4.301 23.572 ( -0.640 7.767 0.470) 7.808 24.107 ( 0.118 2.436 1.162) 2.701 24.378 ( 1.432 -1.310 -9.201) 9.404 24.576 ( 0.578 8.468 -2.593) 8.875 24.744 ( 1.783 4.687 -9.560) 10.795 ======================= Grid point 140 (72/104) ======================= q-point: ( 0.17 0.14 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.579 ( 10.501 7.142 9.788) 16.034 1.776 ( 8.512 1.168 7.631) 11.491 1.840 ( 4.284 4.596 6.875) 9.314 2.295 ( -0.050 8.704 -5.957) 10.548 2.472 ( -7.379 6.296 5.432) 11.117 2.581 ( -10.771 1.973 7.418) 13.226 2.687 ( -0.213 -1.381 -3.372) 3.650 2.850 ( -0.745 9.336 6.824) 11.588 2.887 ( -1.988 5.353 -2.481) 6.226 2.992 ( -4.228 4.894 -3.484) 7.347 3.083 ( -5.083 0.817 0.130) 5.150 3.288 ( -3.679 -0.765 -6.139) 7.198 3.423 ( 0.973 4.061 17.233) 17.732 3.514 ( 1.718 0.601 8.125) 8.327 3.618 ( 2.532 -3.139 0.264) 4.042 3.694 ( 1.460 -2.202 9.460) 9.822 3.796 ( -0.973 -0.428 1.445) 1.794 4.003 ( -1.683 3.065 4.672) 5.835 4.138 ( -7.492 2.306 -5.731) 9.710 4.226 ( -5.056 3.950 3.631) 7.372 4.391 ( -10.760 3.352 6.680) 13.101 4.543 ( 5.359 7.944 1.798) 9.749 4.788 ( 1.246 2.491 -1.077) 2.987 4.841 ( 3.774 -2.344 -4.036) 6.002 4.943 ( -0.344 0.018 -7.455) 7.463 5.033 ( -1.242 0.535 2.066) 2.469 5.168 ( 7.464 8.218 -3.312) 11.585 5.250 ( -0.258 -0.566 -6.501) 6.531 5.394 ( -6.096 -2.202 4.499) 7.890 5.554 ( -1.649 1.510 0.266) 2.252 5.883 ( 7.128 -5.283 4.330) 9.873 6.002 ( 4.803 -3.829 -2.750) 6.730 6.325 ( 0.966 0.574 3.008) 3.211 6.410 ( 4.251 0.915 0.272) 4.356 6.562 ( 0.514 -4.639 -1.841) 5.018 6.669 ( 1.802 -0.741 -3.147) 3.702 6.874 ( -3.769 -3.746 0.123) 5.316 7.038 ( 0.771 -3.910 0.063) 3.985 7.057 ( -3.430 0.762 3.228) 4.772 7.243 ( -0.694 3.310 -2.009) 3.934 7.658 ( -3.407 5.630 -3.615) 7.508 7.808 ( -5.662 3.211 -2.199) 6.870 8.290 ( 2.425 -3.010 -1.040) 4.003 8.345 ( 6.710 1.040 -2.258) 7.155 8.432 ( -0.688 -0.249 2.472) 2.578 8.533 ( 2.903 0.292 -0.579) 2.975 8.805 ( -4.655 -1.929 0.946) 5.127 9.029 ( -0.368 -2.214 -1.638) 2.778 9.212 ( -6.232 1.795 2.568) 6.976 9.258 ( -3.750 3.694 1.352) 5.434 9.825 ( 6.429 -5.081 2.912) 8.697 10.132 ( 7.666 -6.077 -1.647) 9.920 10.284 ( -5.614 -6.211 1.828) 8.569 10.587 ( -8.464 2.958 -4.617) 10.085 10.642 ( 2.793 0.452 -1.814) 3.361 10.757 ( 1.771 -1.523 -0.745) 2.451 10.911 ( -4.082 -1.731 3.207) 5.473 11.044 ( -3.210 -3.812 -1.868) 5.322 11.262 ( 1.060 0.570 -6.093) 6.211 11.386 ( 1.630 3.135 -1.601) 3.880 11.870 ( 0.511 -5.291 -8.779) 10.263 12.043 ( 3.474 0.487 -0.118) 3.510 12.053 ( 0.705 -1.898 3.847) 4.347 12.175 ( -2.413 4.591 -2.840) 5.914 12.462 ( -9.260 0.508 -1.982) 9.484 12.750 ( 6.047 -2.654 1.385) 6.748 12.963 ( -1.028 1.815 1.319) 2.468 13.235 ( 7.741 -11.325 0.484) 13.726 13.606 ( -2.434 -1.955 -0.194) 3.128 13.729 ( 2.538 0.721 -2.143) 3.399 13.882 ( 4.244 -1.069 2.183) 4.891 13.939 ( 2.160 -1.757 -1.679) 3.252 14.697 ( 4.850 5.580 3.854) 8.337 14.851 ( 1.207 4.692 -6.807) 8.355 15.077 ( -3.965 2.530 3.249) 5.716 15.329 ( 0.513 9.520 -5.836) 11.178 16.189 ( -1.157 -1.542 3.540) 4.031 16.334 ( -0.697 -1.667 -1.861) 2.594 16.545 ( -0.284 0.423 8.537) 8.552 16.924 ( 2.687 -1.116 -9.336) 9.779 19.991 ( 0.040 0.731 5.329) 5.379 20.080 ( -2.189 2.333 -1.204) 3.418 20.362 ( -1.361 -0.680 8.755) 8.886 20.653 ( 1.247 -0.685 -1.076) 1.784 21.843 ( -1.774 -7.953 10.285) 13.122 22.067 ( -0.044 -14.178 2.081) 14.330 22.266 ( -1.376 -5.032 11.678) 12.790 22.282 ( -1.389 0.120 9.602) 9.703 22.635 ( 0.137 -1.378 -0.338) 1.425 22.805 ( 0.557 0.001 -5.520) 5.548 23.554 ( -0.816 6.541 0.323) 6.599 23.575 ( 1.081 4.986 1.365) 5.281 24.108 ( -0.336 1.937 1.171) 2.288 24.374 ( 0.695 -0.840 -9.341) 9.404 24.574 ( 0.079 9.576 -3.359) 10.149 24.739 ( 0.144 3.881 -9.276) 10.056 ======================= Grid point 141 (73/104) ======================= q-point: ( 0.33 0.14 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.784 ( 8.527 5.193 6.142) 11.721 1.940 ( 9.729 -1.794 -5.633) 11.384 2.015 ( 8.084 -0.748 17.179) 19.000 2.239 ( -13.290 0.298 2.211) 13.476 2.310 ( -1.963 5.949 -1.637) 6.475 2.431 ( -5.250 10.699 8.574) 14.681 2.662 ( 0.056 3.646 -1.006) 3.783 2.746 ( -10.488 10.566 5.518) 15.878 2.878 ( 1.479 2.482 -2.303) 3.695 2.897 ( -6.823 -2.080 1.308) 7.252 3.016 ( -2.064 6.709 -2.996) 7.632 3.212 ( -2.241 1.407 -8.105) 8.526 3.445 ( -2.960 -2.211 10.830) 11.443 3.606 ( -0.303 -5.157 7.323) 8.962 3.656 ( 5.896 3.756 5.918) 9.159 3.734 ( 1.604 7.015 7.402) 10.323 3.846 ( 3.411 -3.923 2.798) 5.903 3.957 ( -4.913 0.638 -0.408) 4.971 3.987 ( -7.933 7.888 6.535) 12.956 4.170 ( 1.131 3.885 1.199) 4.220 4.240 ( -4.540 2.258 5.198) 7.262 4.590 ( -1.487 7.714 -0.963) 7.915 4.827 ( 2.211 1.747 1.349) 3.124 4.851 ( -0.534 -2.280 -2.090) 3.139 4.939 ( 2.511 -3.289 -10.427) 11.218 5.031 ( -0.579 2.104 1.331) 2.556 5.198 ( -2.197 4.470 -3.662) 6.182 5.247 ( -0.638 1.675 -1.154) 2.132 5.360 ( 2.872 0.228 2.471) 3.795 5.537 ( -0.504 2.185 2.212) 3.150 5.994 ( 1.808 -6.218 4.749) 8.030 6.076 ( 2.727 -3.690 -4.506) 6.431 6.343 ( 2.259 -1.814 2.572) 3.874 6.526 ( 6.550 6.111 1.168) 9.034 6.590 ( 3.117 -5.860 -3.101) 7.326 6.743 ( 5.880 -4.525 0.044) 7.419 6.807 ( -2.555 -3.356 -0.548) 4.253 6.959 ( -6.218 0.192 -1.575) 6.417 7.031 ( -1.901 -0.325 1.999) 2.778 7.199 ( -4.095 3.359 -2.210) 5.739 7.596 ( -1.663 4.074 -4.329) 6.172 7.679 ( -6.051 4.150 -2.473) 7.743 8.351 ( 3.121 -2.546 2.001) 4.497 8.437 ( 1.785 -1.653 2.805) 3.713 8.478 ( 6.632 1.171 -2.895) 7.330 8.608 ( 3.951 0.159 4.044) 5.656 8.746 ( -1.798 -2.319 -1.698) 3.390 8.971 ( -4.571 -2.221 -0.726) 5.134 9.118 ( -2.632 1.878 0.633) 3.295 9.222 ( -1.379 5.737 -0.982) 5.982 9.964 ( 7.324 -6.516 4.403) 10.747 10.119 ( -5.546 -3.082 3.605) 7.297 10.267 ( -2.706 0.280 3.441) 4.387 10.480 ( 1.112 -4.176 -8.571) 9.599 10.660 ( -0.104 -1.334 -0.150) 1.346 10.787 ( 0.107 -0.147 2.909) 2.915 10.891 ( 1.037 -0.597 3.057) 3.283 11.001 ( -0.019 -2.286 -4.577) 5.116 11.275 ( 1.568 2.347 -5.792) 6.443 11.378 ( -1.838 -1.442 -6.403) 6.816 11.850 ( -1.623 -5.538 -10.523) 12.001 11.970 ( -9.635 -1.286 -4.484) 10.705 11.995 ( -2.643 -0.697 2.214) 3.518 12.146 ( -0.106 4.380 -3.188) 5.418 12.464 ( 5.421 -1.018 5.391) 7.713 12.875 ( 3.946 1.557 -0.384) 4.260 12.939 ( 0.497 -1.803 5.138) 5.468 13.323 ( 2.542 -12.892 -0.620) 13.154 13.577 ( 0.077 -0.900 -0.206) 0.926 13.755 ( 0.448 1.816 -3.513) 3.980 13.969 ( 2.748 -0.225 2.712) 3.868 14.010 ( 5.886 -2.639 -1.560) 6.637 14.782 ( 1.583 7.039 3.363) 7.960 14.874 ( 2.668 1.315 -1.970) 3.568 15.006 ( -2.690 4.795 -2.068) 5.874 15.297 ( -2.162 10.874 -7.042) 13.134 16.154 ( -3.176 -2.658 3.706) 5.558 16.322 ( 0.021 -1.420 -2.849) 3.183 16.564 ( -0.218 0.165 9.795) 9.799 16.952 ( 2.455 -0.396 -9.317) 9.643 19.988 ( -1.838 1.217 5.173) 5.623 20.057 ( 0.090 2.487 -0.255) 2.502 20.368 ( -0.398 -1.596 9.166) 9.312 20.698 ( 3.724 -2.731 -2.344) 5.178 21.822 ( -3.191 -7.082 11.203) 13.633 22.059 ( -1.171 -10.462 1.936) 10.704 22.263 ( -1.728 -5.325 11.446) 12.741 22.284 ( -1.240 0.469 9.762) 9.852 22.647 ( 1.537 0.578 -1.461) 2.198 22.787 ( -1.080 -5.495 -5.198) 7.641 23.543 ( -0.387 7.566 0.834) 7.622 23.597 ( 0.703 5.000 1.329) 5.221 24.101 ( -0.699 1.986 1.054) 2.355 24.360 ( 0.233 -0.940 -8.496) 8.551 24.569 ( 0.492 9.424 -4.247) 10.348 24.711 ( -0.520 4.074 -8.649) 9.574 ======================= Grid point 142 (74/104) ======================= q-point: (-0.50 0.14 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.819 ( -17.720 -6.989 10.236) 21.624 1.910 ( -3.195 6.448 8.836) 11.396 2.099 ( 0.492 -1.648 -5.148) 5.428 2.209 ( 6.938 1.392 -5.681) 9.075 2.328 ( 7.530 2.958 16.060) 17.983 2.474 ( -1.029 15.084 8.784) 17.485 2.579 ( -2.575 12.558 -0.471) 12.828 2.706 ( 3.879 3.891 3.968) 6.777 2.775 ( -5.233 -1.914 -0.668) 5.612 2.898 ( 0.060 3.872 0.760) 3.946 2.999 ( 2.877 6.712 -7.389) 10.389 3.183 ( 2.040 2.610 -10.050) 10.581 3.394 ( -4.723 -2.840 14.371) 15.392 3.612 ( -1.293 -5.547 1.608) 5.918 3.648 ( -3.319 0.885 1.221) 3.645 3.786 ( -5.637 7.186 15.546) 18.030 3.837 ( -0.675 3.255 -4.454) 5.558 3.944 ( 3.121 0.704 11.148) 11.599 3.982 ( 6.011 -2.167 4.720) 7.944 4.220 ( -0.129 3.609 2.398) 4.335 4.283 ( 8.333 4.172 3.142) 9.834 4.492 ( -6.522 6.199 -6.631) 11.178 4.846 ( -0.221 -0.260 1.497) 1.535 4.862 ( 0.714 0.248 -1.597) 1.767 4.956 ( 1.333 0.875 -3.471) 3.820 5.017 ( -0.812 -1.442 -5.262) 5.516 5.140 ( -2.517 4.760 1.138) 5.503 5.244 ( 0.734 5.515 -1.393) 5.735 5.428 ( 2.672 -3.075 3.880) 5.626 5.543 ( 0.372 -0.799 1.282) 1.556 5.977 ( -3.266 -6.455 2.072) 7.525 6.062 ( -2.090 -0.835 -3.926) 4.526 6.429 ( 4.811 -2.707 4.307) 7.002 6.606 ( 0.904 -2.467 -3.146) 4.099 6.648 ( 1.175 1.899 2.102) 3.067 6.748 ( -2.107 -4.284 0.676) 4.822 6.813 ( -1.220 -2.264 -1.323) 2.892 6.894 ( 1.102 1.883 -3.212) 3.883 7.029 ( 1.669 0.401 1.404) 2.218 7.102 ( -3.278 1.960 -2.039) 4.329 7.573 ( -0.558 4.907 -1.931) 5.303 7.620 ( 1.376 3.614 -4.997) 6.319 8.371 ( -2.234 0.848 3.739) 4.437 8.487 ( 2.149 -3.722 0.352) 4.312 8.572 ( 4.426 -1.062 -2.056) 4.994 8.655 ( -1.484 -0.397 -0.204) 1.549 8.759 ( 5.122 -3.217 2.107) 6.405 8.895 ( -2.801 0.033 -2.114) 3.510 9.124 ( 2.468 2.007 -0.170) 3.186 9.197 ( -0.370 5.400 -2.541) 5.979 10.018 ( -6.073 -5.043 6.609) 10.295 10.106 ( 2.261 -4.968 3.325) 6.391 10.162 ( -3.526 4.461 1.991) 6.025 10.551 ( 4.721 -10.178 0.022) 11.220 10.647 ( -0.111 -2.797 -3.156) 4.218 10.813 ( 4.067 0.180 3.643) 5.463 10.940 ( 2.442 0.720 1.774) 3.103 11.033 ( 4.431 -1.409 -3.530) 5.838 11.231 ( -4.715 -2.914 -10.936) 12.260 11.323 ( -0.781 0.156 -10.915) 10.944 11.764 ( -8.298 -0.712 -0.988) 8.387 11.783 ( -5.017 0.723 -2.257) 5.549 11.985 ( 0.386 -1.137 1.994) 2.328 12.196 ( 5.870 1.921 -8.270) 10.321 12.584 ( 6.290 -1.546 6.514) 9.186 12.784 ( -6.736 -0.159 -3.478) 7.583 13.085 ( 6.374 -3.396 8.996) 11.537 13.315 ( -3.741 -10.513 -1.352) 11.240 13.613 ( 3.294 -1.437 0.439) 3.621 13.712 ( -3.904 4.202 -5.783) 8.145 13.999 ( -0.237 -0.520 2.210) 2.282 14.101 ( 3.897 -2.862 -2.736) 5.556 14.742 ( -5.379 1.554 4.497) 7.182 14.932 ( 2.855 3.958 0.649) 4.923 15.006 ( 3.216 8.944 -3.902) 10.275 15.224 ( -3.479 10.053 -8.016) 13.320 16.108 ( -2.691 -2.555 5.759) 6.851 16.324 ( 1.185 -0.606 -3.731) 3.961 16.576 ( -1.263 0.181 10.233) 10.312 16.963 ( 1.125 -0.665 -9.082) 9.175 19.958 ( -2.372 1.440 5.112) 5.817 20.079 ( 2.068 2.358 -0.246) 3.147 20.385 ( -0.429 -2.012 9.161) 9.389 20.765 ( 4.267 -6.450 -6.414) 10.047 21.780 ( -4.557 -4.689 14.050) 15.497 22.044 ( -0.786 -9.979 2.476) 10.311 22.262 ( -1.641 -6.201 12.157) 13.745 22.282 ( -1.349 2.375 9.217) 9.613 22.678 ( 1.756 4.057 -1.655) 4.720 22.747 ( -1.360 -9.824 -5.216) 11.205 23.546 ( 0.357 8.662 1.918) 8.878 23.601 ( -0.511 5.406 0.407) 5.445 24.091 ( -0.506 2.522 1.086) 2.792 24.347 ( 0.616 -1.665 -7.446) 7.655 24.569 ( 0.526 8.102 -4.575) 9.319 24.690 ( 0.711 5.168 -8.366) 9.859 ======================= Grid point 143 (75/104) ======================= q-point: (-0.33 0.14 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.489 ( -17.035 -3.031 14.533) 22.596 1.834 ( -9.617 8.768 13.118) 18.478 1.996 ( -6.166 3.054 -2.718) 7.398 2.366 ( -4.858 20.770 5.322) 21.984 2.412 ( 11.450 2.327 -3.741) 12.268 2.493 ( 4.457 1.221 8.617) 9.778 2.655 ( 4.467 5.400 5.452) 8.879 2.713 ( -0.556 -3.353 -6.111) 6.993 2.785 ( 2.045 3.854 3.454) 5.565 2.945 ( 5.970 -0.222 -0.161) 5.977 3.097 ( 8.758 10.141 -5.503) 14.485 3.229 ( 3.779 1.906 -7.217) 8.367 3.377 ( -0.239 -1.940 16.429) 16.545 3.524 ( -5.893 0.105 3.971) 7.106 3.649 ( 0.135 -4.437 0.084) 4.440 3.711 ( -3.662 4.343 15.084) 16.119 3.875 ( 4.960 3.228 -1.465) 6.097 4.003 ( -0.075 -2.881 4.033) 4.957 4.132 ( 6.012 0.793 2.904) 6.723 4.176 ( -3.865 2.762 4.084) 6.265 4.363 ( -1.430 0.677 -7.136) 7.309 4.465 ( 6.311 9.073 5.002) 12.131 4.834 ( -0.593 0.037 -3.383) 3.434 4.851 ( -1.467 1.108 -1.963) 2.689 4.921 ( -5.570 1.558 -3.561) 6.792 5.000 ( 1.236 -0.091 -1.385) 1.858 5.128 ( 0.811 6.369 1.745) 6.653 5.269 ( 2.084 3.792 -3.936) 5.849 5.471 ( 0.551 -5.125 6.817) 8.546 5.548 ( 0.566 -3.960 -1.571) 4.297 5.919 ( -3.432 -5.700 2.446) 7.089 6.024 ( -0.930 1.164 -1.137) 1.874 6.417 ( -8.316 -3.726 0.947) 9.162 6.575 ( -1.467 -4.215 -0.650) 4.510 6.643 ( -2.171 1.539 -2.024) 3.343 6.739 ( 3.982 3.762 -0.251) 5.484 6.810 ( -3.262 -4.203 0.667) 5.362 6.856 ( -0.879 -1.540 -1.502) 2.324 7.085 ( 5.451 3.934 1.565) 6.902 7.127 ( 2.388 -1.014 -1.001) 2.781 7.601 ( 4.811 6.643 -3.959) 9.108 7.669 ( 4.033 2.306 -2.708) 5.377 8.304 ( -5.213 3.361 2.723) 6.774 8.474 ( -2.455 -5.131 -4.131) 7.029 8.565 ( -4.918 -2.138 -0.167) 5.365 8.693 ( 6.588 -0.493 -0.780) 6.653 8.826 ( -3.234 -0.406 -3.633) 4.881 8.895 ( 5.868 -1.581 1.186) 6.192 9.182 ( 3.767 3.075 0.204) 4.867 9.225 ( 4.153 3.083 -2.495) 5.743 9.894 ( -7.934 -4.558 5.129) 10.490 10.005 ( -7.793 -1.235 7.198) 10.681 10.256 ( 7.049 -2.368 -3.544) 8.237 10.548 ( -4.046 -7.316 7.057) 10.940 10.715 ( 6.549 -4.553 -14.180) 16.270 10.948 ( 0.729 -0.645 0.934) 1.349 11.014 ( 13.597 -2.929 9.503) 16.845 11.127 ( 4.341 -3.262 -6.832) 8.727 11.141 ( -0.246 -1.783 -4.672) 5.007 11.268 ( -1.239 0.905 -13.587) 13.674 11.579 ( -11.035 -0.628 2.541) 11.341 11.769 ( 2.850 1.380 3.792) 4.940 12.013 ( 2.174 -0.127 1.791) 2.819 12.282 ( 4.914 3.702 -9.616) 11.416 12.666 ( -4.287 -1.917 -3.099) 5.626 12.729 ( 6.593 -0.289 6.040) 8.946 13.149 ( -3.012 -6.826 5.900) 9.512 13.167 ( -10.569 -5.709 -2.893) 12.356 13.615 ( -3.614 6.292 -4.332) 8.451 13.672 ( 2.257 -2.685 0.833) 3.605 13.969 ( -3.265 -0.013 0.782) 3.357 14.122 ( -0.843 -2.728 -4.984) 5.744 14.655 ( -4.774 -0.294 4.963) 6.892 14.990 ( 3.254 4.590 3.880) 6.835 15.037 ( -1.181 12.127 -5.607) 13.412 15.170 ( 1.569 5.983 -5.984) 8.606 16.094 ( -0.386 -1.467 7.466) 7.618 16.345 ( 1.860 0.322 -3.940) 4.369 16.566 ( -2.417 0.239 9.909) 10.202 16.950 ( -0.133 -1.558 -8.844) 8.981 19.936 ( -1.167 1.398 5.061) 5.378 20.121 ( 2.302 2.029 -0.707) 3.149 20.390 ( -1.332 -1.742 8.469) 8.749 20.803 ( 1.373 -8.642 -10.560) 13.714 21.742 ( -2.901 -3.820 16.683) 17.359 22.042 ( -0.374 -11.631 3.763) 12.231 22.259 ( -1.571 -3.861 10.472) 11.271 22.285 ( -0.997 0.618 11.383) 11.443 22.675 ( -1.431 -0.966 -1.654) 2.391 22.742 ( 2.026 -2.092 -4.902) 5.702 23.560 ( 0.331 8.919 2.512) 9.272 23.584 ( -1.076 5.646 -0.555) 5.774 24.091 ( 0.141 3.045 1.189) 3.271 24.350 ( 1.559 -2.346 -7.070) 7.611 24.565 ( 0.353 6.917 -4.192) 8.096 24.699 ( 2.276 6.220 -8.359) 10.665 ======================= Grid point 144 (76/104) ======================= q-point: (-0.17 0.14 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.325 ( -4.466 4.331 17.346) 18.428 1.681 ( -8.454 11.129 13.967) 19.759 1.886 ( -5.277 3.926 -0.306) 6.584 2.331 ( -1.216 19.293 7.193) 20.626 2.514 ( 1.435 8.514 -1.776) 8.815 2.595 ( 4.265 -3.496 -0.445) 5.533 2.707 ( 1.674 5.946 2.933) 6.839 2.767 ( 6.552 -2.964 -1.714) 7.392 2.818 ( 0.283 1.986 4.270) 4.718 3.051 ( 4.847 3.196 -2.532) 6.334 3.195 ( 0.628 -3.537 3.464) 4.990 3.302 ( 5.299 5.874 -4.703) 9.203 3.419 ( 0.593 -2.128 2.338) 3.216 3.478 ( -0.645 0.512 12.301) 12.328 3.607 ( -3.963 0.979 2.714) 4.902 3.733 ( -0.392 -4.722 10.433) 11.459 3.888 ( -8.808 10.371 -1.870) 13.735 4.028 ( 10.522 3.338 1.458) 11.135 4.096 ( -1.362 -0.558 0.490) 1.551 4.297 ( 4.374 -0.017 4.688) 6.412 4.345 ( 1.725 -2.801 0.419) 3.316 4.559 ( 0.685 8.214 5.498) 9.908 4.763 ( -4.418 2.791 -4.789) 7.088 4.830 ( 0.798 0.125 -2.886) 2.996 4.856 ( 1.406 1.941 -6.762) 7.175 5.008 ( -1.328 4.709 4.289) 6.506 5.167 ( 1.971 2.319 0.111) 3.045 5.265 ( -0.733 1.315 -8.567) 8.698 5.485 ( -0.637 -4.751 6.003) 7.682 5.571 ( 2.191 -3.343 -1.449) 4.251 5.853 ( -4.374 -4.926 2.158) 6.932 5.998 ( -2.533 -0.877 -1.573) 3.108 6.273 ( -5.201 -0.001 3.349) 6.186 6.483 ( -5.333 -1.382 -2.507) 6.053 6.639 ( 0.380 2.095 -4.590) 5.060 6.689 ( -5.193 -5.455 -2.053) 7.806 6.850 ( 6.420 1.143 1.569) 6.707 6.914 ( 3.125 -4.176 4.194) 6.693 7.106 ( -1.720 -0.077 1.945) 2.597 7.209 ( 4.640 3.476 -1.944) 6.115 7.713 ( 7.783 5.604 -4.887) 10.764 7.728 ( 1.919 3.489 0.164) 3.985 8.227 ( -2.295 2.672 0.020) 3.522 8.402 ( -4.081 -3.986 -4.679) 7.378 8.479 ( -3.884 -1.842 1.014) 4.417 8.688 ( -6.632 1.677 -6.612) 9.513 8.847 ( 6.775 -1.524 -0.653) 6.975 8.964 ( 0.513 -0.560 0.622) 0.982 9.261 ( 3.592 1.653 1.640) 4.280 9.306 ( 4.186 0.478 -0.879) 4.304 9.801 ( -3.454 -6.432 5.006) 8.852 9.889 ( -4.262 -1.276 3.231) 5.498 10.383 ( 7.136 -3.876 -3.329) 8.776 10.490 ( -3.240 -5.103 4.420) 7.488 10.749 ( 1.108 -3.349 -10.819) 11.379 10.912 ( -3.977 -0.260 -5.938) 7.152 11.094 ( -1.111 -1.982 -5.011) 5.502 11.209 ( 3.066 -2.355 -6.238) 7.339 11.251 ( 3.895 -2.644 -11.011) 11.975 11.348 ( 1.006 -9.253 14.360) 17.112 11.386 ( 4.470 3.452 0.787) 5.703 11.915 ( 9.155 -2.326 6.158) 11.276 12.077 ( 3.607 2.641 3.952) 5.967 12.314 ( 1.982 8.777 -8.503) 12.380 12.568 ( -6.839 -2.039 -6.586) 9.711 12.802 ( -2.965 1.297 0.865) 3.350 12.956 ( -3.099 -3.303 1.077) 4.656 13.090 ( -5.339 -6.599 5.872) 10.322 13.588 ( 0.922 4.772 -0.442) 4.881 13.694 ( 0.206 -3.746 0.064) 3.752 13.899 ( -3.666 0.178 -0.408) 3.693 14.053 ( -4.813 -2.980 -5.345) 7.785 14.604 ( -1.781 0.479 4.989) 5.319 14.950 ( -4.490 10.773 -7.372) 13.805 15.067 ( 3.046 3.017 6.185) 7.526 15.234 ( 5.022 6.398 -4.407) 9.250 16.126 ( 1.638 -0.455 7.261) 7.458 16.363 ( 0.731 0.460 -3.188) 3.303 16.544 ( -2.130 0.324 8.926) 9.182 16.923 ( -0.227 -2.314 -8.821) 9.122 19.941 ( 0.336 1.158 5.117) 5.257 20.148 ( 0.563 1.609 -1.721) 2.423 20.381 ( -1.707 -1.173 8.093) 8.354 20.755 ( -3.453 -5.606 -9.122) 11.250 21.769 ( 1.285 -6.458 15.156) 16.525 22.045 ( -0.378 -14.485 4.473) 15.165 22.257 ( -1.230 -1.381 9.643) 9.819 22.293 ( -1.458 -2.134 12.108) 12.381 22.649 ( -0.822 -3.830 -0.632) 3.968 22.771 ( 2.147 4.724 -5.076) 7.259 23.556 ( -0.795 5.198 0.522) 5.284 23.577 ( -0.040 8.299 0.966) 8.355 24.099 ( 0.389 3.017 1.132) 3.246 24.366 ( 1.975 -2.106 -7.983) 8.489 24.568 ( 0.865 7.155 -3.050) 7.826 24.725 ( 2.588 5.926 -8.926) 11.022 ======================= Grid point 145 (77/104) ======================= q-point: ( 0.00 0.29 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.632 ( 6.727 13.021 9.121) 17.263 1.845 ( -4.034 10.431 6.437) 12.904 1.963 ( -1.821 8.766 5.933) 10.741 2.528 ( 1.748 6.106 -12.648) 14.154 2.609 ( -2.103 1.856 4.309) 5.142 2.702 ( -3.148 -4.990 4.760) 7.580 2.745 ( -4.480 6.291 3.808) 8.611 2.850 ( 1.753 0.112 -1.080) 2.062 3.080 ( -0.783 11.716 3.209) 12.172 3.113 ( 2.307 0.274 2.792) 3.632 3.202 ( 0.564 -3.984 1.193) 4.196 3.296 ( 4.910 4.958 -1.129) 7.069 3.431 ( -2.385 -8.286 -7.065) 11.147 3.514 ( -0.084 1.805 13.517) 13.637 3.568 ( -0.627 4.915 -3.048) 5.817 3.670 ( -1.568 4.841 13.319) 14.258 3.999 ( -7.688 9.266 1.592) 12.145 4.083 ( -1.789 1.749 2.421) 3.481 4.204 ( 2.958 2.336 0.354) 3.786 4.290 ( -0.621 0.300 0.807) 1.061 4.580 ( 6.246 8.926 6.047) 12.460 4.653 ( -4.910 5.738 4.462) 8.771 4.820 ( 0.913 2.537 -2.941) 3.990 4.854 ( 1.473 2.613 -3.410) 4.542 5.045 ( -1.862 2.356 4.328) 5.267 5.112 ( 11.371 5.534 3.512) 13.125 5.140 ( -3.350 -0.838 3.513) 4.926 5.260 ( -0.143 3.072 -9.380) 9.872 5.427 ( -1.754 0.747 0.307) 1.931 5.526 ( -1.557 -5.119 -0.668) 5.393 5.696 ( -0.985 -4.611 1.797) 5.046 5.844 ( 0.690 -7.028 -3.773) 8.006 6.333 ( 2.066 2.210 1.325) 3.303 6.373 ( -2.643 -0.117 -0.161) 2.650 6.541 ( -1.241 0.685 0.257) 1.440 6.646 ( -0.859 -2.767 -2.153) 3.610 6.864 ( -2.522 -2.277 0.174) 3.402 6.909 ( 3.696 -1.724 -0.152) 4.081 7.068 ( -0.477 -3.172 4.102) 5.207 7.219 ( -0.129 -5.217 -2.481) 5.779 7.873 ( 0.444 6.811 0.115) 6.826 7.928 ( 0.827 5.466 0.169) 5.531 8.222 ( -1.245 -4.479 -3.233) 5.663 8.297 ( 0.253 3.116 -3.504) 4.696 8.454 ( -0.470 2.324 2.430) 3.395 8.566 ( -4.313 -0.038 -5.434) 6.938 8.824 ( -3.720 -4.517 3.287) 6.712 8.917 ( 3.287 -6.504 -0.653) 7.317 9.344 ( -0.661 1.063 1.537) 1.982 9.359 ( -0.549 5.254 1.581) 5.514 9.629 ( 0.809 -4.809 2.492) 5.476 9.860 ( 4.612 -5.005 -5.503) 8.752 10.288 ( -3.183 -1.814 4.573) 5.859 10.508 ( 7.818 -1.929 -5.982) 10.032 10.655 ( 0.396 -4.060 -3.908) 5.649 10.774 ( -4.887 -2.392 -7.964) 9.645 11.000 ( -5.980 -1.318 -0.035) 6.123 11.049 ( -7.789 -3.101 5.303) 9.920 11.200 ( 1.325 -2.508 -8.563) 9.021 11.290 ( 10.078 -2.766 -4.600) 11.419 11.743 ( 15.313 1.235 9.470) 18.047 11.940 ( 2.349 -3.717 5.963) 7.409 12.143 ( -8.978 3.448 -3.041) 10.087 12.294 ( -5.489 -1.905 -5.572) 8.050 12.599 ( 3.504 2.329 -1.578) 4.494 12.698 ( -6.095 2.828 -2.823) 7.288 12.945 ( 2.966 -2.538 3.321) 5.125 12.984 ( 3.005 -1.821 1.688) 3.898 13.592 ( -2.245 -2.678 1.018) 3.640 13.614 ( 2.195 -4.250 0.362) 4.797 13.848 ( -0.736 -0.621 -2.588) 2.762 13.890 ( -3.281 -2.540 -4.174) 5.886 14.732 ( 2.866 6.798 5.763) 9.362 14.969 ( -3.086 1.134 -2.827) 4.336 15.267 ( 0.424 10.801 0.304) 10.813 15.459 ( 4.912 6.172 -7.722) 11.039 16.174 ( 0.040 0.659 6.452) 6.485 16.324 ( -2.889 -2.111 2.768) 4.524 16.560 ( 0.177 1.738 0.924) 1.976 16.836 ( 1.938 -4.669 -8.692) 10.055 19.997 ( 0.216 2.092 6.822) 7.139 20.163 ( -1.528 0.701 1.249) 2.094 20.361 ( -0.680 0.478 4.127) 4.210 20.618 ( 0.172 -3.577 -4.360) 5.643 21.663 ( 0.232 -6.886 12.050) 13.881 21.742 ( -2.398 -10.927 9.183) 14.474 22.185 ( -0.005 -4.099 5.303) 6.703 22.224 ( -1.262 -5.041 4.423) 6.824 22.647 ( -0.706 3.843 6.951) 7.974 22.841 ( -0.344 0.283 0.026) 0.446 23.646 ( -0.132 4.177 0.786) 4.252 23.703 ( -0.712 4.003 -1.768) 4.434 24.165 ( -0.157 2.823 -0.264) 2.840 24.337 ( 1.434 -2.388 -5.824) 6.456 24.775 ( 1.933 8.884 -7.342) 11.687 24.860 ( 1.045 5.317 -9.884) 11.272 ======================= Grid point 146 (78/104) ======================= q-point: ( 0.17 0.29 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.775 ( 6.141 10.365 6.662) 13.767 1.848 ( 2.927 5.147 5.105) 7.817 1.975 ( 1.555 7.727 7.023) 10.557 2.495 ( -3.830 4.548 -2.953) 6.639 2.534 ( -8.935 3.377 -1.009) 9.605 2.647 ( -1.265 -1.941 3.536) 4.227 2.685 ( -1.643 5.201 5.384) 7.664 2.854 ( -1.618 -0.817 -1.084) 2.113 3.011 ( -4.628 6.461 7.240) 10.751 3.153 ( -0.048 1.049 -2.838) 3.026 3.213 ( -1.907 4.355 2.335) 5.297 3.288 ( -4.243 7.531 -5.171) 10.073 3.404 ( 0.949 -8.679 -4.149) 9.666 3.479 ( -2.666 -5.564 -2.457) 6.641 3.615 ( 3.047 5.559 13.280) 14.715 3.725 ( 2.433 5.196 14.177) 15.294 3.875 ( -4.596 7.132 2.497) 8.844 4.074 ( 1.292 5.803 6.150) 8.553 4.181 ( -3.603 2.624 -4.564) 6.379 4.314 ( 1.034 2.428 1.764) 3.174 4.469 ( -12.746 3.857 3.325) 13.726 4.714 ( 2.614 7.104 4.396) 8.753 4.847 ( 3.594 1.756 -4.299) 5.872 4.857 ( 0.031 3.121 -2.560) 4.037 4.971 ( -5.333 2.979 3.270) 6.929 5.108 ( 1.614 6.765 0.392) 6.966 5.235 ( 0.026 0.527 -3.559) 3.598 5.319 ( 1.916 4.049 -2.003) 4.907 5.417 ( 2.593 4.868 2.929) 6.245 5.529 ( 1.643 -3.949 -1.625) 4.575 5.727 ( 5.064 -8.797 2.723) 10.509 5.882 ( 3.242 -7.148 -2.377) 8.201 6.329 ( -1.307 -0.242 0.390) 1.385 6.412 ( 5.159 0.388 0.792) 5.234 6.550 ( 1.865 0.861 0.625) 2.148 6.634 ( 0.678 -0.808 -1.025) 1.471 6.786 ( -4.922 -3.459 -0.080) 6.016 6.962 ( 1.264 -3.062 0.413) 3.338 7.030 ( -3.916 -3.301 1.951) 5.481 7.236 ( 1.683 -4.161 -0.696) 4.543 7.820 ( -4.800 8.951 -2.612) 10.487 7.883 ( -5.143 3.731 0.149) 6.355 8.212 ( 1.533 -4.299 -0.874) 4.647 8.356 ( 4.045 -2.348 -1.109) 4.807 8.453 ( 1.003 3.665 3.224) 4.984 8.542 ( 1.939 1.497 -2.589) 3.564 8.746 ( -4.131 -3.488 1.470) 5.603 8.939 ( -1.079 -6.148 0.358) 6.252 9.268 ( -5.682 3.941 0.559) 6.938 9.367 ( 0.415 5.755 0.718) 5.815 9.700 ( 4.981 -5.986 2.863) 8.297 9.948 ( 5.304 -10.400 -5.997) 13.124 10.236 ( -2.042 1.748 1.234) 2.957 10.588 ( -1.809 -1.139 -4.462) 4.948 10.649 ( -0.529 -2.043 -2.538) 3.301 10.706 ( 2.280 -2.984 -6.446) 7.460 10.881 ( -4.578 -0.643 3.853) 6.018 10.969 ( -3.033 -3.003 -0.114) 4.270 11.233 ( 4.290 -1.102 -6.718) 8.047 11.467 ( 8.149 1.402 -1.310) 8.372 11.789 ( -11.259 -0.789 -8.811) 14.318 11.999 ( -0.322 -2.468 6.788) 7.230 12.029 ( 1.789 -1.301 0.762) 2.339 12.242 ( 0.851 -0.963 -0.119) 1.290 12.454 ( -10.746 1.200 -0.130) 10.814 12.765 ( 6.471 2.429 1.392) 7.051 12.968 ( -0.830 -0.894 -0.577) 1.349 13.050 ( 2.813 -5.974 -0.586) 6.629 13.563 ( -0.766 -1.350 0.645) 1.680 13.673 ( 3.798 -3.948 -0.310) 5.487 13.868 ( 3.530 -0.867 -1.194) 3.826 13.888 ( 3.086 -2.724 -0.663) 4.169 14.822 ( 5.231 5.421 4.830) 8.949 14.921 ( -1.940 1.997 -0.878) 2.920 15.253 ( -1.233 11.859 -3.859) 12.532 15.509 ( 2.360 6.637 -8.686) 11.183 16.163 ( -2.920 -0.670 5.827) 6.552 16.284 ( -1.758 -2.859 3.305) 4.710 16.570 ( 0.597 2.142 1.761) 2.837 16.871 ( 3.793 -4.025 -9.164) 10.703 20.016 ( -0.123 1.667 6.771) 6.975 20.131 ( -2.028 1.588 1.882) 3.190 20.356 ( -0.933 0.734 3.802) 3.983 20.614 ( 0.560 -3.121 -3.776) 4.930 21.678 ( -1.601 -6.868 10.280) 12.466 21.756 ( 1.146 -12.086 10.384) 15.975 22.184 ( -1.501 -3.741 4.621) 6.132 22.219 ( -0.342 -5.482 4.886) 7.351 22.646 ( -1.074 3.543 6.627) 7.591 22.817 ( -2.124 0.271 0.331) 2.167 23.657 ( 0.818 3.869 1.433) 4.207 23.691 ( -0.002 4.217 -1.613) 4.515 24.160 ( -0.296 2.820 0.132) 2.838 24.342 ( 0.661 -2.232 -6.242) 6.662 24.782 ( 0.771 8.782 -7.608) 11.645 24.846 ( 0.195 5.394 -9.893) 11.269 ======================= Grid point 147 (79/104) ======================= q-point: ( 0.33 0.29 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.903 ( 4.568 4.902 4.046) 7.827 1.925 ( 3.770 0.767 2.638) 4.665 2.046 ( 3.053 3.737 7.401) 8.835 2.273 ( -12.489 2.858 7.751) 14.974 2.469 ( -2.130 6.910 -3.591) 8.074 2.638 ( 0.493 2.875 6.732) 7.336 2.718 ( 2.603 4.167 1.506) 5.139 2.802 ( -4.091 2.704 3.166) 5.837 2.935 ( -4.620 6.387 5.132) 9.406 3.111 ( -6.043 9.330 -1.590) 11.229 3.150 ( 0.398 6.208 -6.916) 9.302 3.236 ( 0.341 1.984 -2.314) 3.067 3.386 ( -4.823 -4.982 -0.180) 6.936 3.443 ( 0.703 -8.577 -2.072) 8.852 3.665 ( -1.008 -2.726 7.032) 7.609 3.788 ( 0.322 -0.017 15.619) 15.622 3.872 ( 2.488 4.801 5.610) 7.792 4.044 ( -8.779 4.331 -6.471) 11.735 4.169 ( 4.450 10.490 7.168) 13.462 4.300 ( -0.838 6.137 3.807) 7.271 4.328 ( -1.462 4.763 -0.199) 4.987 4.661 ( -7.871 2.821 0.125) 8.362 4.864 ( 1.502 2.756 -0.941) 3.277 4.926 ( 3.017 0.876 -4.090) 5.157 4.936 ( 1.361 7.629 3.174) 8.374 5.086 ( -3.034 1.106 -0.226) 3.237 5.253 ( 0.607 3.819 5.697) 6.886 5.302 ( 0.778 4.485 -5.545) 7.174 5.468 ( 0.937 6.916 -0.398) 6.990 5.533 ( -1.190 -2.249 -1.861) 3.152 5.813 ( 1.117 -10.279 4.727) 11.368 5.954 ( 4.609 -7.069 -3.657) 9.197 6.340 ( 2.214 1.283 2.889) 3.859 6.493 ( 3.413 -2.572 -0.552) 4.309 6.617 ( 3.120 -5.227 1.024) 6.173 6.683 ( 5.288 4.389 0.059) 6.872 6.710 ( -2.520 -2.964 1.203) 4.072 6.934 ( -2.394 -2.654 -1.390) 3.835 6.996 ( -0.885 -2.689 3.052) 4.162 7.225 ( -3.544 -1.919 -2.139) 4.563 7.729 ( -3.268 7.589 -3.298) 8.896 7.783 ( -4.489 5.857 -0.886) 7.432 8.279 ( 5.211 -4.401 0.235) 6.825 8.367 ( -1.357 -4.699 5.318) 7.225 8.538 ( 4.979 3.962 -0.453) 6.379 8.588 ( 3.179 -1.359 0.323) 3.472 8.683 ( -3.357 -3.289 -0.445) 4.720 8.904 ( -1.885 -4.007 0.119) 4.430 9.192 ( -2.074 5.121 0.033) 5.525 9.362 ( -0.837 6.720 -1.579) 6.953 9.796 ( 3.990 -8.380 4.373) 10.260 9.991 ( 0.473 -11.135 -4.152) 11.893 10.256 ( 4.189 3.127 -0.540) 5.255 10.469 ( -7.571 1.614 -2.713) 8.203 10.619 ( -2.140 -2.605 -1.797) 3.820 10.752 ( 2.111 -3.192 -4.219) 5.696 10.876 ( 2.674 -1.635 2.504) 4.012 10.933 ( -0.308 -3.027 -2.054) 3.671 11.309 ( 4.802 1.449 -6.925) 8.550 11.419 ( -11.533 5.765 -5.194) 13.900 11.714 ( 5.118 -6.525 -7.949) 11.487 11.934 ( -8.073 -3.634 -5.883) 10.629 11.989 ( -2.061 1.278 7.225) 7.621 12.266 ( -3.472 7.073 -0.617) 7.903 12.375 ( 4.528 -7.434 6.576) 10.909 12.849 ( -3.857 -6.943 4.600) 9.178 12.936 ( 3.634 3.329 -2.239) 5.413 13.102 ( 3.031 -6.941 -2.087) 7.856 13.571 ( 1.334 0.777 0.837) 1.756 13.730 ( 2.270 -2.728 -2.323) 4.242 13.950 ( 2.890 -1.782 1.176) 3.593 13.962 ( 5.755 -1.778 -0.383) 6.035 14.879 ( -3.296 2.727 3.659) 5.630 14.934 ( 5.056 3.970 4.958) 8.118 15.222 ( 0.228 12.462 -9.496) 15.669 15.496 ( -1.455 6.930 -9.907) 12.177 16.112 ( -3.470 -0.703 6.311) 7.237 16.277 ( 0.245 -2.694 1.446) 3.068 16.588 ( 0.431 2.404 3.844) 4.554 16.913 ( 2.791 -3.524 -9.363) 10.386 20.019 ( -1.421 1.702 6.640) 7.000 20.109 ( -0.779 1.557 3.115) 3.569 20.351 ( -0.386 0.710 3.169) 3.270 20.617 ( 0.731 -4.625 -4.388) 6.417 21.674 ( -1.464 -6.082 11.639) 13.213 21.801 ( 0.481 -11.427 9.632) 14.952 22.159 ( -2.099 -4.369 4.846) 6.854 22.231 ( 0.381 -5.985 4.254) 7.353 22.641 ( -0.954 2.559 5.164) 5.842 22.776 ( -2.101 1.284 1.242) 2.758 23.676 ( 0.932 4.296 0.789) 4.466 23.698 ( 0.722 4.119 -0.014) 4.182 24.155 ( -0.229 2.967 0.170) 2.980 24.332 ( -0.068 -1.884 -5.831) 6.128 24.770 ( 0.014 8.443 -7.864) 11.538 24.826 ( 0.436 5.828 -9.854) 11.456 ======================= Grid point 148 (80/104) ======================= q-point: (-0.50 0.29 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.768 ( -15.390 1.874 10.564) 18.761 2.042 ( 4.090 -2.857 -1.487) 5.206 2.088 ( 0.178 8.939 7.062) 11.394 2.266 ( 7.974 2.927 -1.199) 8.579 2.438 ( 0.258 5.888 7.525) 9.558 2.694 ( -1.209 -1.394 0.934) 2.068 2.752 ( 5.075 7.623 5.615) 10.742 2.769 ( 0.016 6.466 7.363) 9.799 2.854 ( -5.193 10.003 -1.465) 11.365 3.046 ( -1.072 5.757 -0.859) 5.918 3.178 ( 5.319 8.302 -6.856) 12.009 3.232 ( -1.072 1.201 -9.183) 9.323 3.317 ( -0.801 -3.741 6.640) 7.663 3.444 ( -0.213 -8.328 -1.562) 8.475 3.625 ( -4.324 -1.614 7.201) 8.553 3.822 ( -0.662 -2.783 14.560) 14.839 3.914 ( -3.069 3.175 -5.050) 6.709 3.950 ( 3.288 1.531 7.815) 8.616 4.173 ( -2.879 14.627 6.170) 16.135 4.298 ( -0.855 3.979 -3.690) 5.494 4.428 ( 8.326 6.716 6.358) 12.444 4.513 ( -6.019 -0.681 -3.081) 6.797 4.899 ( 1.483 2.959 0.605) 3.365 4.915 ( -2.138 3.275 0.344) 3.926 4.981 ( 2.573 5.169 -2.576) 6.323 5.045 ( -2.099 -0.050 0.402) 2.138 5.267 ( 0.068 7.845 4.100) 8.852 5.331 ( 2.280 2.450 0.159) 3.351 5.441 ( -3.898 3.802 -0.551) 5.473 5.495 ( -1.087 -2.341 -2.905) 3.886 5.811 ( -1.682 -7.964 4.693) 9.396 5.991 ( 0.758 -5.770 -4.596) 7.416 6.400 ( 2.184 0.202 4.330) 4.854 6.524 ( -0.966 -2.785 -1.419) 3.271 6.616 ( -0.924 -5.088 2.909) 5.933 6.713 ( 1.382 -5.023 0.460) 5.230 6.781 ( 2.132 4.735 0.797) 5.253 6.940 ( 2.828 1.113 -2.334) 3.832 7.009 ( 2.757 -2.436 2.023) 4.199 7.105 ( -6.724 -1.667 -2.758) 7.456 7.702 ( 0.882 6.839 -2.125) 7.216 7.737 ( 0.087 7.028 -2.464) 7.448 8.349 ( -0.899 -3.994 4.324) 5.955 8.393 ( 4.945 -4.735 0.223) 6.850 8.576 ( -0.334 0.883 -2.500) 2.673 8.615 ( -3.042 -1.739 -0.115) 3.506 8.672 ( 4.974 -4.109 3.738) 7.456 8.882 ( -0.657 -1.816 -2.338) 3.033 9.195 ( 1.936 4.577 0.439) 4.989 9.339 ( -0.605 7.109 -3.458) 7.928 9.827 ( -3.149 -10.505 4.963) 12.037 9.986 ( 0.926 -8.495 -3.226) 9.134 10.290 ( -4.851 7.067 0.307) 8.577 10.393 ( 2.910 -2.752 2.332) 4.634 10.581 ( 0.105 -3.281 -4.772) 5.792 10.789 ( 3.811 -2.336 -1.015) 4.583 10.937 ( 1.440 -0.852 3.127) 3.547 10.958 ( 4.493 -5.251 -5.707) 8.962 11.207 ( -7.981 1.693 -7.676) 11.202 11.335 ( -0.207 0.851 -10.293) 10.330 11.745 ( -3.200 -1.320 -0.376) 3.481 11.788 ( -4.543 -0.739 -3.216) 5.615 11.986 ( 0.424 2.196 6.434) 6.812 12.256 ( 4.176 3.703 -5.314) 7.706 12.504 ( 6.678 -6.497 8.449) 12.578 12.721 ( -7.355 -6.325 -0.594) 9.718 13.024 ( 3.046 -1.338 1.194) 3.534 13.126 ( -0.502 -6.525 -1.963) 6.833 13.606 ( 1.608 0.846 2.079) 2.761 13.733 ( -1.220 -1.137 -4.173) 4.494 13.986 ( 0.613 -0.899 0.820) 1.363 14.050 ( 3.517 -2.194 -1.887) 4.555 14.810 ( -5.407 5.086 7.128) 10.291 15.019 ( 2.786 2.954 4.770) 6.264 15.232 ( 3.575 10.559 -10.397) 15.244 15.411 ( -4.784 6.597 -10.320) 13.149 16.083 ( -1.317 0.874 7.126) 7.299 16.299 ( 1.914 -1.904 -0.837) 2.827 16.597 ( -0.757 2.216 5.204) 5.706 16.921 ( 0.508 -3.548 -9.121) 9.800 19.998 ( -2.285 2.230 6.708) 7.429 20.121 ( 0.996 0.729 3.558) 3.766 20.357 ( 0.138 0.303 3.000) 3.019 20.618 ( 0.785 -6.485 -5.589) 8.597 21.674 ( -2.235 -4.739 13.628) 14.600 21.815 ( -1.235 -10.218 8.650) 13.444 22.139 ( -1.243 -4.965 5.408) 7.446 22.248 ( 0.181 -6.505 3.572) 7.424 22.636 ( -0.882 1.719 3.995) 4.438 22.760 ( 0.144 2.492 1.841) 3.101 23.696 ( 0.875 4.332 0.784) 4.489 23.705 ( 0.040 4.486 0.181) 4.490 24.155 ( 0.194 3.183 -0.068) 3.190 24.315 ( -0.197 -1.637 -5.003) 5.268 24.749 ( 0.043 8.166 -7.953) 11.399 24.821 ( 1.691 6.089 -9.788) 11.651 ======================= Grid point 149 (81/104) ======================= q-point: (-0.33 0.29 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.555 ( -8.942 8.172 12.663) 17.524 2.026 ( -3.701 1.208 -0.260) 3.902 2.075 ( -4.244 10.735 10.491) 15.599 2.441 ( 7.232 2.398 -3.100) 8.226 2.522 ( 8.182 0.955 4.566) 9.418 2.665 ( -0.564 2.092 1.152) 2.454 2.750 ( -3.235 9.184 -2.529) 10.060 2.816 ( 2.377 7.419 3.791) 8.664 2.910 ( 9.018 3.233 2.512) 9.904 3.009 ( -3.496 8.706 -0.563) 9.399 3.184 ( -0.083 0.033 -4.200) 4.201 3.307 ( 4.343 -1.448 2.475) 5.204 3.362 ( 5.655 6.435 -3.912) 9.418 3.439 ( 0.177 -9.501 0.233) 9.505 3.561 ( -4.169 0.562 7.757) 8.824 3.799 ( -5.125 0.660 11.813) 12.894 3.922 ( 4.198 1.529 0.691) 4.520 4.025 ( 3.357 2.830 8.260) 9.354 4.180 ( 2.036 6.304 5.464) 8.587 4.276 ( -0.083 4.674 -3.820) 6.037 4.401 ( -4.417 4.446 -1.753) 6.508 4.600 ( 7.480 2.306 3.480) 8.567 4.864 ( -2.149 0.886 -1.909) 3.007 4.914 ( -1.200 5.102 2.192) 5.681 4.986 ( -4.514 4.398 -1.629) 6.509 5.018 ( 2.033 2.380 0.277) 3.142 5.258 ( -2.057 4.240 0.713) 4.767 5.349 ( -3.940 1.249 -1.327) 4.340 5.383 ( 1.835 -0.303 4.742) 5.094 5.502 ( 2.608 0.738 -1.395) 3.048 5.785 ( -2.527 -5.583 4.129) 7.390 5.973 ( -1.719 -6.025 -4.525) 7.728 6.387 ( -4.319 1.230 1.766) 4.826 6.484 ( -2.362 -3.248 1.949) 4.464 6.629 ( 1.120 -3.144 0.473) 3.371 6.712 ( -2.472 -3.892 -2.245) 5.128 6.807 ( 2.442 1.110 2.865) 3.925 6.871 ( -5.902 2.390 -5.023) 8.111 7.062 ( 1.173 -3.432 1.380) 3.881 7.133 ( 6.725 -0.845 0.278) 6.783 7.743 ( 3.898 5.851 -2.204) 7.368 7.771 ( 3.961 7.166 -2.186) 8.474 8.332 ( -1.324 -4.199 1.530) 4.661 8.416 ( -3.345 2.398 -2.659) 4.900 8.522 ( -3.617 -1.336 0.291) 3.867 8.642 ( 5.939 -3.335 0.233) 6.815 8.771 ( 2.890 -4.474 2.499) 5.883 8.852 ( -0.776 -2.613 -4.281) 5.075 9.246 ( 3.195 2.807 0.472) 4.279 9.337 ( 1.179 6.181 -2.587) 6.804 9.732 ( -6.599 -8.370 4.064) 11.407 9.954 ( -4.872 -5.307 -1.145) 7.295 10.235 ( 1.189 1.573 -3.173) 3.736 10.425 ( -1.416 -2.500 8.627) 9.093 10.629 ( 5.026 -3.782 -10.339) 12.102 10.900 ( 5.680 -5.869 -2.433) 8.523 10.964 ( 2.921 -0.601 -0.657) 3.054 11.018 ( 3.928 -3.543 -0.404) 5.305 11.139 ( 1.516 0.375 -1.129) 1.928 11.272 ( -2.478 -0.748 -11.619) 11.903 11.593 ( -10.519 1.744 1.258) 10.737 11.770 ( 1.275 -1.318 2.242) 2.897 12.049 ( 4.522 3.835 5.664) 8.199 12.358 ( 7.428 3.437 -7.763) 11.281 12.577 ( -4.268 -6.953 0.824) 8.200 12.686 ( 7.014 -4.115 5.827) 10.004 13.027 ( -3.420 -3.340 -0.509) 4.808 13.063 ( -5.300 -3.755 -1.956) 6.784 13.620 ( -1.024 -1.490 1.436) 2.309 13.680 ( -2.578 0.140 -3.396) 4.266 13.972 ( -2.180 0.086 -0.999) 2.399 14.066 ( -1.170 -2.608 -4.229) 5.104 14.732 ( -4.541 6.857 7.878) 11.388 15.064 ( 0.669 1.301 4.950) 5.161 15.282 ( -0.337 9.693 -6.700) 11.788 15.305 ( 1.107 6.244 -10.193) 12.005 16.098 ( 0.900 2.229 7.271) 7.658 16.336 ( 2.167 -1.391 -1.649) 3.058 16.584 ( -1.899 1.867 4.980) 5.648 16.891 ( -1.196 -4.062 -8.612) 9.597 19.979 ( -1.435 2.551 6.785) 7.390 20.152 ( 1.266 -0.012 3.233) 3.472 20.364 ( -0.248 0.198 2.920) 2.937 20.621 ( 1.028 -7.271 -6.027) 9.500 21.655 ( -3.193 -3.903 14.085) 14.960 21.803 ( -2.232 -9.922 8.715) 13.393 22.143 ( 0.100 -5.032 5.790) 7.672 22.251 ( -0.797 -6.226 3.294) 7.088 22.632 ( -0.531 2.645 4.845) 5.546 22.787 ( 2.101 1.951 1.092) 3.068 23.687 ( -1.419 4.216 0.273) 4.457 23.717 ( 0.616 4.676 -0.126) 4.718 24.161 ( 0.505 3.224 -0.591) 3.316 24.307 ( 0.709 -1.801 -4.316) 4.730 24.740 ( 1.099 8.511 -7.810) 11.603 24.837 ( 2.354 5.817 -9.639) 11.502 ======================= Grid point 150 (82/104) ======================= q-point: (-0.17 0.29 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.521 ( 1.484 12.739 11.977) 17.548 1.936 ( -6.096 9.208 3.034) 11.452 2.007 ( -4.758 9.424 8.965) 13.850 2.508 ( 2.699 -1.158 -4.922) 5.732 2.627 ( 0.208 7.810 -1.273) 7.916 2.689 ( 1.540 0.196 5.753) 5.958 2.783 ( 6.598 -0.739 -3.021) 7.294 2.827 ( -2.821 8.624 -0.629) 9.095 2.975 ( 2.180 7.496 2.972) 8.353 3.085 ( 8.668 1.561 1.369) 8.913 3.179 ( -0.770 8.613 2.291) 8.946 3.281 ( -3.975 -5.923 0.494) 7.150 3.456 ( 1.087 -7.778 3.132) 8.455 3.499 ( 4.657 4.164 -4.943) 7.966 3.521 ( -0.207 2.362 5.684) 6.159 3.726 ( -5.763 1.189 12.375) 13.702 4.032 ( 5.296 0.953 2.853) 6.090 4.103 ( 2.650 3.016 1.690) 4.356 4.157 ( -4.365 5.705 2.136) 7.494 4.318 ( -1.203 0.963 1.099) 1.893 4.397 ( 9.454 10.655 0.836) 14.269 4.708 ( 1.027 3.187 6.573) 7.377 4.824 ( -1.193 0.540 -1.922) 2.326 4.872 ( -4.000 7.353 -0.619) 8.393 4.928 ( 3.332 4.010 -1.102) 5.329 5.050 ( 0.444 0.996 3.215) 3.395 5.210 ( -3.156 -3.367 3.305) 5.676 5.293 ( -1.420 1.437 -5.220) 5.598 5.427 ( 1.560 3.076 1.503) 3.762 5.559 ( 1.579 1.748 0.271) 2.371 5.722 ( -4.285 -7.277 2.358) 8.768 5.901 ( -4.295 -7.010 -4.731) 9.485 6.324 ( -1.798 3.977 1.663) 4.670 6.431 ( -3.475 -2.513 0.764) 4.356 6.603 ( -4.614 -1.773 -2.765) 5.664 6.660 ( -0.377 -1.877 -0.806) 2.077 6.833 ( 2.622 -1.419 -1.361) 3.277 6.872 ( 2.399 -0.385 1.630) 2.926 7.067 ( -0.706 -3.111 2.459) 4.028 7.217 ( 2.069 -2.824 -1.349) 3.752 7.820 ( 4.465 4.644 -1.748) 6.675 7.859 ( 5.348 6.995 -0.096) 8.805 8.296 ( -4.123 -3.578 -5.988) 8.103 8.325 ( -2.734 4.527 0.791) 5.347 8.470 ( -2.119 1.150 1.702) 2.951 8.699 ( -6.644 -0.949 -6.658) 9.454 8.778 ( 6.759 -4.926 1.059) 8.431 8.885 ( 1.395 -6.522 1.218) 6.780 9.311 ( 3.522 1.293 0.240) 3.759 9.351 ( 0.197 4.001 1.521) 4.285 9.652 ( -2.847 -5.228 2.411) 6.422 9.854 ( -3.560 -2.544 -1.876) 4.761 10.287 ( 3.140 -3.039 -0.488) 4.397 10.423 ( 0.919 -1.212 2.408) 2.848 10.659 ( 1.017 -4.662 -7.404) 8.808 10.877 ( -3.318 -4.017 -9.607) 10.929 11.043 ( 2.052 -2.143 -2.955) 4.188 11.110 ( 3.528 -5.907 1.486) 7.039 11.212 ( 0.676 -1.968 -2.169) 3.006 11.224 ( -0.871 -1.825 -1.470) 2.500 11.473 ( 4.613 4.897 3.801) 7.727 11.847 ( 5.160 -4.398 6.144) 9.150 12.154 ( 4.349 4.535 4.632) 7.807 12.446 ( -1.368 2.091 -7.773) 8.164 12.499 ( 1.485 -2.022 -4.686) 5.315 12.839 ( 5.640 -1.585 5.814) 8.253 12.878 ( -9.205 -1.484 -0.920) 9.369 12.982 ( -2.972 -2.401 -0.225) 3.827 13.597 ( -0.414 -3.098 -0.505) 3.166 13.635 ( -2.407 -1.445 0.263) 2.820 13.905 ( -3.967 0.164 -2.934) 4.937 13.991 ( -5.163 -2.699 -5.028) 7.696 14.697 ( -0.925 7.311 7.214) 10.312 15.042 ( -3.637 -0.509 -0.204) 3.678 15.247 ( 0.895 10.854 -1.496) 10.994 15.378 ( 5.618 6.289 -7.475) 11.269 16.140 ( 1.516 2.032 6.925) 7.375 16.355 ( -0.360 -1.487 0.208) 1.544 16.563 ( -1.114 1.660 2.795) 3.437 16.848 ( -0.828 -4.663 -8.358) 9.607 19.980 ( -0.278 2.488 6.796) 7.242 20.173 ( 0.076 -0.128 2.155) 2.160 20.363 ( -0.571 0.372 3.370) 3.438 20.623 ( 0.606 -5.889 -5.401) 8.014 21.641 ( -1.601 -4.976 13.428) 14.410 21.775 ( -3.064 -10.222 8.919) 13.908 22.165 ( 0.563 -4.670 5.789) 7.459 22.238 ( -1.316 -5.406 3.667) 6.664 22.639 ( -0.296 3.601 6.212) 7.186 22.827 ( 1.688 0.935 0.306) 1.954 23.660 ( -1.376 4.415 0.135) 4.626 23.718 ( -0.346 4.166 -0.978) 4.293 24.166 ( 0.165 2.997 -0.756) 3.096 24.320 ( 1.660 -2.198 -4.730) 5.473 24.753 ( 2.191 8.884 -7.457) 11.804 24.855 ( 1.997 5.497 -9.682) 11.311 ======================= Grid point 151 (83/104) ======================= q-point: ( 0.00 0.43 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.881 ( 4.233 9.148 4.200) 10.920 1.976 ( -0.661 0.832 -0.408) 1.138 2.217 ( -5.290 14.332 11.615) 19.191 2.498 ( -2.280 -10.244 4.117) 11.274 2.579 ( -2.760 1.180 2.410) 3.849 2.675 ( -4.143 -6.715 2.365) 8.237 2.806 ( 1.532 9.375 -4.889) 10.684 2.919 ( 2.442 0.601 -4.293) 4.976 3.121 ( 0.440 -0.429 -1.510) 1.631 3.138 ( 3.306 -0.143 -0.780) 3.399 3.215 ( 1.737 1.794 0.666) 2.584 3.247 ( -0.243 -4.953 1.109) 5.082 3.385 ( -4.044 2.880 1.813) 5.285 3.488 ( -5.501 -4.908 -0.257) 7.377 3.708 ( 0.530 6.608 9.801) 11.833 3.777 ( -0.224 1.406 7.848) 7.976 4.129 ( 2.645 3.734 1.851) 4.936 4.147 ( 1.278 2.311 0.672) 2.725 4.307 ( -0.161 7.460 3.377) 8.190 4.374 ( -1.375 5.142 -1.957) 5.671 4.649 ( -2.875 -2.123 6.364) 7.299 4.704 ( 4.127 -3.647 3.705) 6.638 4.877 ( -0.106 6.546 2.145) 6.890 4.959 ( -2.563 1.515 -1.154) 3.193 5.046 ( -0.975 3.463 4.201) 5.531 5.154 ( 4.956 4.705 4.747) 8.321 5.204 ( 9.288 1.053 6.111) 11.168 5.300 ( -5.040 -12.584 0.687) 13.573 5.361 ( 1.631 4.718 -6.131) 7.907 5.466 ( 0.061 -2.394 -5.013) 5.556 5.663 ( -2.413 1.492 -1.624) 3.269 5.718 ( -1.921 -3.680 -4.854) 6.386 6.345 ( -0.961 2.193 2.482) 3.449 6.405 ( 0.322 -1.303 0.325) 1.381 6.563 ( -2.691 0.852 0.579) 2.881 6.595 ( 0.257 -1.263 -0.399) 1.349 6.849 ( 1.797 2.615 1.316) 3.435 6.914 ( 1.977 0.008 -2.826) 3.449 6.986 ( -1.829 -2.381 3.192) 4.382 7.068 ( -2.975 -7.670 -1.005) 8.288 7.967 ( 2.705 3.655 2.294) 5.093 8.032 ( 2.506 -0.128 4.461) 5.118 8.174 ( -5.600 3.424 -6.708) 9.385 8.295 ( -4.897 -4.590 -6.069) 9.049 8.541 ( 0.233 5.788 2.540) 6.325 8.593 ( -0.647 2.178 -0.674) 2.370 8.724 ( -2.277 -4.143 1.790) 5.055 8.757 ( 2.951 -6.953 1.128) 7.638 9.380 ( 1.749 2.160 3.005) 4.093 9.422 ( 2.772 -0.782 3.972) 4.906 9.618 ( -2.133 4.632 -5.168) 7.261 9.745 ( -0.246 -6.029 -7.197) 9.392 10.316 ( 0.641 4.083 1.406) 4.366 10.431 ( 4.228 -5.646 -3.838) 8.031 10.621 ( 1.425 1.675 -5.121) 5.573 10.696 ( -1.821 -4.415 -7.676) 9.040 10.978 ( -4.610 -0.388 1.546) 4.878 10.994 ( -5.452 -1.905 4.825) 7.526 11.182 ( 2.533 0.933 -7.684) 8.145 11.226 ( 7.246 -2.896 -5.961) 9.820 11.782 ( 11.089 2.617 10.179) 15.278 11.854 ( 6.201 -4.010 9.272) 11.854 12.198 ( -10.369 2.280 -5.665) 12.033 12.248 ( -6.154 -2.371 -5.248) 8.428 12.669 ( 0.418 4.383 0.565) 4.439 12.742 ( -1.610 -0.839 -1.309) 2.238 12.913 ( 3.373 0.101 1.840) 3.843 12.944 ( 1.304 -1.990 1.163) 2.649 13.547 ( -0.559 -1.156 0.942) 1.593 13.550 ( 0.540 -1.542 0.767) 1.805 13.833 ( -1.787 -0.181 -3.815) 4.216 13.848 ( -2.725 -1.472 -4.571) 5.521 14.868 ( 0.899 5.459 4.969) 7.436 14.953 ( -1.505 -2.456 2.375) 3.734 15.471 ( 2.577 7.076 -5.111) 9.102 15.538 ( 4.456 0.699 -7.474) 8.729 16.207 ( -2.115 2.396 6.642) 7.371 16.268 ( -3.505 -3.049 5.794) 7.426 16.618 ( 1.281 3.858 -4.508) 6.071 16.722 ( 1.964 -5.637 -7.331) 9.454 20.055 ( -0.508 3.344 8.199) 8.869 20.130 ( -1.115 -3.279 7.519) 8.279 20.419 ( 0.427 4.596 -3.315) 5.683 20.526 ( 0.988 -4.947 -5.096) 7.171 21.565 ( -1.360 -1.892 11.964) 12.189 21.588 ( -2.570 -4.025 10.811) 11.818 22.117 ( 0.406 -1.618 2.179) 2.745 22.131 ( -0.345 -2.861 1.395) 3.201 22.746 ( -1.208 4.558 8.492) 9.714 22.820 ( -1.162 -2.278 5.597) 6.153 23.719 ( -0.364 2.505 -0.225) 2.541 23.745 ( -0.516 0.169 -1.388) 1.490 24.224 ( 0.125 2.778 -1.174) 3.019 24.282 ( 0.773 -2.696 -2.899) 4.034 24.915 ( 1.839 3.929 -9.703) 10.628 24.938 ( 1.357 1.599 -10.176) 10.390 ======================= Grid point 152 (84/104) ======================= q-point: ( 0.17 0.43 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.952 ( 2.087 4.119 2.975) 5.493 1.954 ( -0.796 4.080 -0.100) 4.158 2.171 ( -2.750 11.103 10.763) 15.706 2.404 ( -7.782 -8.805 8.408) 14.450 2.573 ( -1.106 -2.162 3.680) 4.408 2.595 ( -3.083 -2.490 1.365) 4.192 2.846 ( 3.237 12.582 -2.791) 13.288 2.960 ( 2.018 6.113 -3.532) 7.343 3.101 ( -2.476 -3.383 1.124) 4.341 3.143 ( -0.603 -6.981 0.969) 7.073 3.202 ( -2.492 3.123 -4.049) 5.689 3.274 ( 2.501 1.888 1.285) 3.387 3.341 ( -2.660 -3.337 -0.800) 4.342 3.383 ( -5.243 -3.999 2.230) 6.961 3.706 ( -2.875 3.673 10.613) 11.593 3.766 ( -3.075 -1.428 11.312) 11.809 4.084 ( -5.725 8.962 -0.065) 10.635 4.172 ( -0.766 0.039 -3.215) 3.305 4.303 ( 1.230 7.110 -0.843) 7.265 4.381 ( 1.649 3.006 -1.667) 3.812 4.532 ( -8.923 5.622 3.774) 11.201 4.753 ( 0.224 -8.704 5.447) 10.270 4.872 ( -0.773 5.031 2.815) 5.817 4.923 ( -1.304 1.066 0.312) 1.713 5.061 ( 2.359 7.089 4.617) 8.783 5.229 ( 0.753 -4.935 5.476) 7.410 5.293 ( 1.194 7.816 -2.869) 8.411 5.359 ( 4.418 2.414 -4.589) 6.812 5.436 ( 1.062 -2.863 -5.413) 6.215 5.486 ( 9.416 -4.591 3.317) 10.988 5.606 ( -0.814 2.903 -2.106) 3.677 5.729 ( 2.942 -6.770 -1.394) 7.512 6.355 ( 1.172 3.172 2.745) 4.355 6.431 ( 2.576 -1.562 0.206) 3.020 6.509 ( -2.783 0.440 1.655) 3.268 6.593 ( -0.974 -4.912 0.111) 5.009 6.843 ( -1.242 7.520 -1.594) 7.786 6.919 ( -0.915 -0.952 -0.926) 1.613 6.953 ( -1.750 -1.917 3.476) 4.338 7.083 ( 3.211 -9.363 1.350) 9.990 7.963 ( -4.832 4.366 0.222) 6.516 8.000 ( -4.675 4.961 1.213) 6.924 8.130 ( 1.589 -1.160 -1.156) 2.282 8.240 ( 0.377 -7.354 -0.949) 7.424 8.554 ( 0.452 4.374 1.010) 4.512 8.602 ( 0.931 2.124 -0.182) 2.326 8.684 ( -1.711 -0.200 0.579) 1.818 8.791 ( 0.565 -7.200 1.736) 7.428 9.380 ( -2.440 6.072 0.813) 6.595 9.460 ( 0.778 1.086 2.242) 2.610 9.609 ( 2.051 -0.514 -1.770) 2.758 9.727 ( 0.484 -9.509 -7.159) 11.913 10.339 ( 2.203 7.246 -1.722) 7.766 10.506 ( 4.098 -7.453 -3.176) 9.079 10.608 ( -2.451 0.450 -5.532) 6.068 10.645 ( -0.693 -2.669 -8.001) 8.463 10.887 ( -4.299 1.021 3.334) 5.535 10.918 ( -3.418 -1.897 2.294) 4.533 11.268 ( 7.892 4.582 -5.888) 10.860 11.397 ( 11.480 -6.392 -5.136) 14.108 11.861 ( -11.868 5.687 -4.482) 13.903 11.952 ( -0.531 -2.633 3.650) 4.532 12.020 ( -0.623 1.480 4.389) 4.673 12.122 ( -2.589 -7.392 1.349) 7.948 12.572 ( -7.796 8.007 1.978) 11.349 12.736 ( -2.106 -6.056 2.559) 6.903 12.959 ( 1.732 0.842 -2.397) 3.075 12.983 ( 2.683 -1.277 -2.182) 3.687 13.561 ( 2.069 1.039 0.452) 2.359 13.601 ( 3.858 -2.681 0.302) 4.708 13.844 ( 3.085 -0.984 -0.966) 3.379 13.847 ( 3.365 -0.972 -1.386) 3.767 14.912 ( 2.360 2.920 4.488) 5.851 14.943 ( -0.230 -0.056 2.874) 2.884 15.485 ( 0.596 8.608 -8.265) 11.948 15.582 ( 2.148 -0.306 -9.548) 9.791 16.169 ( -3.437 1.400 7.146) 8.052 16.219 ( -2.749 -3.057 6.829) 7.971 16.643 ( 2.359 4.766 -3.984) 6.645 16.761 ( 3.763 -5.914 -7.382) 10.180 20.063 ( -0.911 2.707 8.112) 8.600 20.121 ( -1.815 -2.294 7.376) 7.935 20.416 ( 0.119 4.648 -3.451) 5.790 20.525 ( 0.292 -5.062 -5.349) 7.370 21.575 ( -1.202 -2.469 11.493) 11.816 21.587 ( -0.100 -3.981 12.194) 12.828 22.118 ( -1.184 -1.913 1.320) 2.609 22.123 ( -0.475 -2.609 1.582) 3.088 22.738 ( -1.811 4.157 8.701) 9.811 22.802 ( -2.052 -1.806 5.974) 6.569 23.722 ( 0.624 2.115 0.277) 2.222 23.740 ( 0.341 0.555 -1.149) 1.321 24.223 ( 0.016 3.018 -1.020) 3.186 24.286 ( 0.398 -2.892 -3.052) 4.223 24.916 ( 0.844 3.575 -9.877) 10.538 24.931 ( 0.646 1.997 -10.333) 10.544 ======================= Grid point 153 (85/104) ======================= q-point: ( 0.33 0.43 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.957 ( 0.188 1.639 2.980) 3.406 1.967 ( -2.031 1.102 3.421) 4.128 2.166 ( 0.569 6.776 6.042) 9.096 2.286 ( -5.223 -3.153 6.683) 9.049 2.545 ( -1.074 2.106 5.043) 5.569 2.601 ( 1.193 -2.744 6.283) 6.960 2.881 ( -0.041 10.337 -0.755) 10.365 2.959 ( -0.871 7.427 1.509) 7.629 3.051 ( -2.380 1.975 4.344) 5.333 3.133 ( -1.380 -4.271 -4.911) 6.653 3.206 ( 2.491 -0.673 -1.783) 3.136 3.243 ( -4.361 -5.891 -2.421) 7.719 3.299 ( -0.896 -1.309 -1.105) 1.934 3.317 ( -1.483 0.112 -2.753) 3.129 3.673 ( -3.284 2.624 12.073) 12.784 3.740 ( -2.754 -3.398 14.734) 15.369 3.995 ( -3.233 6.117 1.388) 7.056 4.074 ( -7.052 -1.142 -4.813) 8.613 4.346 ( 2.793 2.044 -5.829) 6.779 4.375 ( 0.253 0.171 -6.291) 6.298 4.482 ( 1.717 14.328 6.496) 15.825 4.746 ( -3.057 -3.992 4.316) 6.626 4.849 ( -1.990 -0.100 3.658) 4.166 4.916 ( -0.387 -0.094 1.935) 1.976 5.105 ( 0.604 7.342 2.475) 7.772 5.180 ( -5.153 3.500 0.936) 6.299 5.320 ( 2.942 3.290 2.360) 5.005 5.393 ( 0.964 3.748 -5.483) 6.711 5.460 ( 0.730 -3.259 -4.336) 5.473 5.566 ( 0.593 -7.414 -1.415) 7.571 5.663 ( 4.280 5.736 4.006) 8.202 5.809 ( 4.556 -6.456 -0.454) 7.915 6.393 ( 1.700 3.755 3.598) 5.471 6.485 ( 2.219 0.190 0.268) 2.244 6.498 ( 0.836 -3.757 3.448) 5.168 6.572 ( -0.119 -5.652 0.581) 5.683 6.850 ( 2.763 4.320 -0.880) 5.203 6.880 ( -0.718 -1.556 -0.369) 1.754 6.958 ( -0.763 2.550 3.531) 4.422 7.113 ( -1.143 -7.993 -0.204) 8.077 7.873 ( -3.291 5.661 -1.969) 6.838 7.913 ( -4.052 3.868 -0.055) 5.602 8.188 ( 4.094 -2.086 1.403) 4.804 8.251 ( -0.276 -5.904 4.500) 7.428 8.562 ( 0.420 0.382 0.354) 0.669 8.594 ( -1.881 -1.988 -1.464) 3.104 8.681 ( 1.025 5.218 0.145) 5.320 8.803 ( 0.613 -5.501 0.721) 5.582 9.337 ( -1.731 8.327 0.504) 8.520 9.464 ( -0.857 0.488 0.989) 1.397 9.647 ( 1.886 -3.524 -1.101) 4.145 9.737 ( 2.408 -10.064 -6.465) 12.202 10.390 ( 3.533 7.897 -2.166) 8.918 10.517 ( -4.059 1.897 -2.008) 4.910 10.542 ( -1.494 -3.505 -4.055) 5.564 10.638 ( 2.704 -6.853 -9.491) 12.015 10.855 ( -0.043 0.595 2.825) 2.887 10.887 ( -0.549 -1.905 2.801) 3.431 11.388 ( 4.663 5.829 -8.439) 11.267 11.511 ( -7.511 -2.868 -13.415) 15.640 11.645 ( 2.204 4.924 0.688) 5.438 11.811 ( -7.710 -7.731 -4.043) 11.643 12.053 ( 0.846 4.741 8.803) 10.034 12.193 ( 3.955 -8.361 8.953) 12.872 12.441 ( -5.952 9.378 1.190) 11.171 12.655 ( -6.601 -10.375 3.002) 12.658 12.993 ( 2.711 1.913 -3.768) 5.021 13.025 ( 2.494 -1.584 -3.828) 4.836 13.608 ( 2.507 2.464 0.451) 3.544 13.668 ( 2.997 -2.994 -0.967) 4.345 13.918 ( 3.978 -0.522 1.024) 4.141 13.930 ( 4.993 -1.335 0.153) 5.171 14.942 ( -0.525 2.855 5.492) 6.212 14.978 ( 2.425 -0.049 5.717) 6.210 15.456 ( -0.841 8.654 -11.763) 14.627 15.562 ( -1.571 -1.005 -11.590) 11.739 16.135 ( -1.691 2.727 7.266) 7.943 16.209 ( -0.107 -3.683 5.841) 6.905 16.674 ( 1.630 5.596 -2.916) 6.517 16.806 ( 2.612 -6.203 -7.301) 9.930 20.060 ( -1.510 2.157 8.118) 8.534 20.104 ( -1.735 -1.662 7.709) 8.075 20.409 ( 0.206 4.387 -3.719) 5.754 20.513 ( -0.013 -5.059 -5.579) 7.531 21.588 ( -0.574 -1.611 12.663) 12.778 21.622 ( 0.247 -5.035 12.561) 13.535 22.092 ( -1.622 -1.421 0.729) 2.277 22.115 ( -0.569 -3.689 0.523) 3.769 22.725 ( -1.710 3.973 8.483) 9.522 22.782 ( -1.633 -1.138 6.340) 6.645 23.739 ( 1.013 1.826 0.534) 2.156 23.751 ( 0.898 0.842 -0.457) 1.313 24.220 ( -0.006 3.069 -0.918) 3.203 24.282 ( -0.000 -2.715 -2.853) 3.939 24.901 ( 0.292 3.624 -10.074) 10.710 24.917 ( 0.680 2.082 -10.553) 10.778 ======================= Grid point 154 (86/104) ======================= q-point: (-0.50 0.43 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.856 ( -8.533 5.341 8.359) 13.084 1.964 ( -1.632 -4.461 4.378) 6.460 2.253 ( 6.713 5.588 1.668) 8.892 2.310 ( 7.210 0.231 -1.152) 7.305 2.543 ( -1.682 5.154 8.976) 10.486 2.650 ( 1.322 -3.570 7.586) 8.487 2.872 ( 0.696 7.255 2.950) 7.863 2.956 ( -0.509 6.782 2.249) 7.163 3.031 ( -2.004 -4.451 -1.240) 5.037 3.055 ( -4.303 7.411 1.631) 8.724 3.140 ( -2.667 -6.503 -5.228) 8.760 3.229 ( -2.238 -5.477 0.566) 5.944 3.329 ( 5.258 2.284 -6.945) 9.005 3.352 ( 6.315 0.499 -4.414) 7.721 3.651 ( -2.557 3.486 12.563) 13.286 3.740 ( -1.283 -4.451 15.196) 15.887 3.959 ( -2.794 1.532 -1.479) 3.513 3.976 ( -0.578 0.298 1.866) 1.976 4.357 ( 1.024 2.762 -7.239) 7.815 4.394 ( 2.118 0.238 -6.741) 7.070 4.547 ( 2.290 11.302 5.569) 12.806 4.645 ( -6.843 8.565 2.783) 11.311 4.844 ( -0.430 -6.888 4.088) 8.021 4.901 ( -1.557 -4.851 2.729) 5.780 5.096 ( -2.216 4.262 2.903) 5.613 5.124 ( -0.767 3.737 1.939) 4.279 5.352 ( -1.195 1.089 0.537) 1.704 5.370 ( -0.951 0.168 -2.946) 3.100 5.476 ( 2.575 3.265 -0.805) 4.235 5.541 ( -3.483 0.066 -1.601) 3.834 5.728 ( 1.890 2.849 3.918) 5.200 5.853 ( 0.599 -6.629 -2.089) 6.976 6.428 ( 0.985 2.169 4.000) 4.655 6.486 ( -1.825 -2.491 2.829) 4.188 6.535 ( 2.011 -0.389 1.124) 2.336 6.596 ( 1.657 -5.001 0.032) 5.269 6.884 ( -1.809 3.804 1.631) 4.517 6.942 ( 4.334 -2.670 1.853) 5.417 6.954 ( 3.647 1.300 -0.528) 3.908 7.036 ( -5.494 -4.515 -2.316) 7.479 7.842 ( 0.009 5.514 -0.906) 5.588 7.870 ( -0.344 3.747 -0.849) 3.858 8.252 ( 0.548 -2.810 3.150) 4.257 8.285 ( 4.986 -4.918 1.297) 7.123 8.553 ( -1.499 -0.290 0.151) 1.535 8.585 ( 2.099 -2.930 1.933) 4.090 8.690 ( -0.323 5.362 -1.458) 5.566 8.808 ( -0.370 -5.017 -2.123) 5.460 9.319 ( -0.784 6.988 1.986) 7.306 9.436 ( -2.281 -0.690 0.773) 2.506 9.664 ( 0.499 -1.684 -3.048) 3.518 9.775 ( 2.892 -9.374 -6.096) 11.550 10.398 ( -4.170 3.313 0.108) 5.327 10.448 ( -2.878 2.614 3.512) 5.239 10.529 ( 3.822 1.865 -8.824) 9.796 10.680 ( 3.581 -7.865 -8.475) 12.104 10.893 ( 3.333 -0.212 2.750) 4.326 10.913 ( 2.366 -1.353 4.549) 5.303 11.281 ( -9.112 4.242 -10.848) 14.789 11.342 ( -5.225 -0.937 -12.136) 13.246 11.720 ( 0.239 -0.294 0.897) 0.973 11.748 ( -0.550 -2.469 -0.699) 2.625 12.095 ( 2.034 7.738 8.484) 11.662 12.279 ( 4.157 -7.300 5.104) 9.830 12.400 ( 1.472 3.625 2.442) 4.612 12.550 ( -4.016 -8.591 0.672) 9.507 13.022 ( 0.983 0.648 -3.640) 3.826 13.045 ( 0.386 -1.785 -3.977) 4.376 13.639 ( 0.249 2.164 1.087) 2.434 13.692 ( -0.297 -2.517 -1.506) 2.948 13.976 ( 1.887 0.427 0.230) 1.948 14.005 ( 2.766 -1.992 -1.107) 3.583 14.933 ( -2.410 5.752 8.383) 10.448 15.025 ( 0.625 -2.393 7.544) 7.939 15.415 ( 0.111 6.201 -12.508) 13.961 15.482 ( -3.288 0.013 -11.773) 12.223 16.145 ( 0.691 4.368 6.300) 7.697 16.238 ( 1.720 -3.885 3.822) 5.715 16.682 ( -0.209 5.626 -2.196) 6.043 16.814 ( 0.151 -6.211 -7.075) 9.416 20.048 ( -1.782 2.465 8.257) 8.800 20.100 ( -0.819 -2.189 8.104) 8.435 20.408 ( 0.614 3.909 -3.771) 5.466 20.501 ( 0.320 -4.790 -5.606) 7.381 21.606 ( -1.316 -1.100 13.604) 13.712 21.646 ( -1.047 -5.135 12.382) 13.446 22.071 ( -0.645 -1.026 0.523) 1.320 22.109 ( 0.020 -4.740 -0.412) 4.758 22.720 ( -0.998 4.230 8.171) 9.255 22.778 ( -0.404 -0.958 6.252) 6.338 23.756 ( 0.499 1.641 0.556) 1.803 23.764 ( 0.580 1.005 -0.260) 1.189 24.219 ( 0.164 2.850 -0.925) 3.000 24.274 ( -0.140 -2.269 -2.518) 3.392 24.885 ( 0.761 4.055 -10.121) 10.930 24.910 ( 1.387 1.714 -10.611) 10.837 ======================= Grid point 155 (87/104) ======================= q-point: (-0.33 0.43 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.766 ( -2.595 10.274 7.871) 13.200 1.951 ( -0.040 -6.647 2.822) 7.221 2.338 ( 0.083 11.316 7.336) 13.486 2.492 ( 9.542 -3.464 -0.412) 10.159 2.522 ( -1.127 5.206 3.667) 6.467 2.665 ( -0.552 -4.841 4.027) 6.321 2.911 ( -1.800 5.612 -3.471) 6.839 2.943 ( 0.010 4.908 0.989) 5.006 2.961 ( 1.584 4.266 1.367) 4.751 3.075 ( -1.402 0.873 -0.478) 1.719 3.105 ( 3.433 -7.411 1.031) 8.232 3.210 ( 0.777 -9.600 -1.644) 9.771 3.426 ( 5.887 7.287 -3.480) 9.994 3.476 ( 7.585 2.318 -6.884) 10.502 3.629 ( -3.090 5.422 12.788) 14.230 3.746 ( -2.052 -4.547 11.633) 12.657 3.951 ( 2.752 1.558 -0.231) 3.171 4.007 ( 2.815 -3.113 5.107) 6.610 4.350 ( -0.608 4.613 -4.077) 6.186 4.397 ( -0.390 4.322 -4.973) 6.600 4.531 ( -0.980 8.942 3.929) 9.816 4.631 ( 1.297 2.434 6.647) 7.197 4.834 ( -0.524 -3.017 0.658) 3.132 4.893 ( -0.150 -7.489 5.308) 9.181 5.073 ( -0.974 4.370 2.313) 5.039 5.116 ( -1.750 2.367 5.431) 6.177 5.314 ( -0.742 1.727 -2.343) 3.004 5.359 ( -2.723 2.330 -1.465) 3.872 5.427 ( -5.150 2.754 -0.367) 5.852 5.528 ( 1.482 -2.306 0.292) 2.757 5.742 ( -2.057 2.577 2.041) 3.878 5.837 ( -0.973 -5.382 -2.982) 6.230 6.435 ( -1.744 1.910 2.201) 3.396 6.448 ( -2.598 -0.399 3.303) 4.222 6.570 ( 1.679 -0.656 -0.038) 1.803 6.622 ( 0.924 -4.299 -1.999) 4.830 6.828 ( -2.343 1.532 1.018) 2.979 6.879 ( -6.104 -2.367 -1.868) 6.808 7.023 ( 2.702 1.025 0.767) 2.990 7.080 ( 4.745 -3.434 0.798) 5.911 7.858 ( 1.935 4.397 -1.057) 4.919 7.889 ( 2.317 2.420 -0.349) 3.368 8.273 ( 1.340 0.945 -0.264) 1.661 8.373 ( 3.399 -6.356 -0.524) 7.227 8.551 ( 0.497 3.760 2.523) 4.555 8.632 ( 1.156 0.011 -0.426) 1.232 8.677 ( 0.788 -1.267 2.108) 2.582 8.767 ( -3.047 -5.219 -4.943) 7.808 9.314 ( -0.136 3.755 2.504) 4.515 9.392 ( -2.669 -2.228 2.828) 4.482 9.660 ( 0.565 3.105 -5.333) 6.197 9.795 ( 0.617 -8.116 -6.281) 10.282 10.320 ( -3.035 5.279 -0.094) 6.090 10.408 ( -2.078 -1.726 4.084) 4.897 10.587 ( 3.124 1.908 -7.841) 8.653 10.721 ( 2.839 -8.997 -8.225) 12.516 10.976 ( 2.687 0.840 2.191) 3.568 10.988 ( 5.039 -0.374 5.189) 7.243 11.167 ( -0.763 2.482 -5.187) 5.801 11.232 ( -2.476 -2.943 -9.263) 10.029 11.645 ( -6.727 3.131 1.071) 7.497 11.718 ( -2.268 -3.353 1.377) 4.276 12.179 ( 4.598 8.182 6.553) 11.447 12.369 ( 2.944 -7.983 2.398) 8.840 12.460 ( 4.441 2.714 -1.037) 5.307 12.568 ( 6.117 -6.159 2.051) 8.919 13.001 ( -2.522 0.120 -3.668) 4.453 13.014 ( -2.646 -1.151 -3.207) 4.314 13.616 ( -2.814 1.066 0.880) 3.135 13.653 ( -3.090 -2.029 -1.012) 3.833 13.979 ( -1.546 0.899 -2.111) 2.766 14.014 ( -1.391 -2.251 -3.501) 4.389 14.895 ( -3.577 7.618 8.589) 12.025 15.028 ( -2.367 -4.424 7.392) 8.934 15.412 ( 1.767 3.299 -10.480) 11.128 15.420 ( 0.905 3.001 -8.586) 9.141 16.180 ( 1.320 4.908 5.475) 7.471 16.279 ( 1.598 -3.966 2.751) 5.084 16.658 ( -1.618 5.040 -2.310) 5.776 16.781 ( -1.688 -6.025 -6.828) 9.261 20.040 ( -1.195 3.196 8.370) 9.039 20.111 ( -0.262 -3.228 8.214) 8.829 20.412 ( 0.767 3.751 -3.651) 5.290 20.501 ( 1.130 -4.570 -5.319) 7.103 21.599 ( -2.820 -0.752 13.133) 13.453 21.642 ( -2.511 -4.958 11.724) 12.974 22.075 ( 0.770 -0.934 1.138) 1.662 22.115 ( 0.610 -4.771 -0.156) 4.813 22.728 ( -0.369 4.613 8.020) 9.260 22.794 ( 0.466 -1.427 5.804) 5.995 23.754 ( -0.754 2.001 -0.015) 2.138 23.769 ( -0.021 0.635 -0.420) 0.762 24.222 ( 0.319 2.494 -1.149) 2.765 24.268 ( 0.271 -1.957 -2.275) 3.013 24.883 ( 1.767 4.439 -9.965) 11.051 24.917 ( 2.065 1.306 -10.406) 10.689 ======================= Grid point 156 (88/104) ======================= q-point: (-0.17 0.43 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.795 ( 3.170 11.694 5.897) 13.475 1.970 ( 1.041 -4.041 0.874) 4.263 2.297 ( -5.766 14.170 11.392) 19.074 2.500 ( -0.772 -1.737 3.687) 4.148 2.609 ( 1.132 -2.293 1.124) 2.793 2.693 ( 2.114 -5.996 0.758) 6.403 2.836 ( -3.136 6.777 -5.572) 9.318 2.917 ( -1.392 -1.462 -3.504) 4.044 3.046 ( 5.253 6.086 -0.898) 8.090 3.090 ( 2.807 0.786 1.405) 3.236 3.169 ( 2.498 -3.771 2.072) 4.976 3.241 ( 1.738 -9.253 -1.595) 9.549 3.457 ( -2.374 7.346 -1.817) 7.930 3.557 ( 0.046 -2.186 -3.630) 4.237 3.639 ( 2.663 9.637 11.045) 14.898 3.746 ( 0.274 -0.138 8.990) 8.995 4.037 ( 5.392 1.115 2.653) 6.112 4.094 ( 4.352 -2.633 3.277) 6.051 4.316 ( -1.979 7.968 2.097) 8.474 4.387 ( 0.490 3.571 -2.760) 4.540 4.587 ( 5.464 3.444 0.437) 6.474 4.657 ( -0.430 -5.236 10.657) 11.881 4.856 ( 2.043 2.708 0.022) 3.392 4.936 ( 4.403 -4.011 3.346) 6.832 5.050 ( -2.888 7.135 4.914) 9.132 5.101 ( -0.363 2.315 7.276) 7.644 5.207 ( -8.521 6.881 -0.398) 10.960 5.325 ( 1.760 3.123 -4.575) 5.812 5.413 ( -0.258 -5.458 -1.325) 5.622 5.505 ( -4.537 -12.401 -0.394) 13.211 5.684 ( -1.928 7.638 -1.415) 8.003 5.798 ( -3.195 -3.216 -3.851) 5.949 6.381 ( -3.380 1.679 2.314) 4.427 6.416 ( -1.629 -0.495 0.956) 1.953 6.587 ( 0.195 0.347 -1.973) 2.012 6.610 ( -1.480 -1.561 -0.423) 2.192 6.813 ( 0.514 0.087 0.622) 0.811 6.851 ( 3.083 -2.371 0.268) 3.899 7.032 ( -1.857 1.360 0.604) 2.380 7.117 ( -0.840 -5.554 -0.364) 5.629 7.905 ( 3.257 3.439 -0.507) 4.764 7.951 ( 4.143 0.360 1.699) 4.493 8.274 ( -1.894 3.585 -4.669) 6.184 8.378 ( -2.290 -2.589 -2.406) 4.212 8.543 ( -1.241 5.756 2.394) 6.356 8.651 ( -4.655 -2.738 -2.776) 6.073 8.680 ( 4.483 -2.603 0.370) 5.197 8.739 ( 0.523 -6.245 1.729) 6.501 9.336 ( 1.845 1.372 2.471) 3.375 9.373 ( 0.263 -1.692 4.684) 4.987 9.659 ( 0.119 4.809 -6.316) 7.939 9.772 ( -1.017 -4.997 -6.102) 7.952 10.300 ( 0.455 3.849 0.829) 3.964 10.394 ( 0.193 -3.227 0.262) 3.244 10.607 ( 1.350 1.759 -5.618) 6.039 10.731 ( 0.310 -8.290 -8.382) 11.793 11.017 ( 1.371 -0.307 -0.038) 1.405 11.031 ( -0.802 -1.712 1.523) 2.428 11.188 ( 0.324 -0.106 -1.532) 1.570 11.200 ( -0.496 -0.963 -6.071) 6.167 11.593 ( 3.779 6.280 5.626) 9.239 11.730 ( 3.605 -6.368 6.418) 9.734 12.259 ( 1.852 5.134 1.935) 5.791 12.366 ( -3.228 -5.065 -2.244) 6.411 12.575 ( 7.454 5.526 -3.313) 9.853 12.711 ( 6.663 -6.988 3.102) 10.142 12.918 ( -4.583 2.194 -1.280) 5.240 12.954 ( -2.539 -1.178 -0.927) 2.949 13.562 ( -2.434 0.086 0.467) 2.480 13.590 ( -3.305 -2.170 0.242) 3.961 13.911 ( -4.446 0.687 -4.201) 6.155 13.941 ( -4.852 -2.031 -5.068) 7.304 14.861 ( -1.758 7.283 6.737) 10.076 14.987 ( -2.998 -4.423 4.385) 6.912 15.428 ( 2.919 5.536 -5.574) 8.381 15.469 ( 4.658 1.611 -7.169) 8.700 16.209 ( 0.157 4.161 5.728) 7.081 16.298 ( -0.742 -3.736 3.824) 5.398 16.624 ( -0.889 4.193 -3.531) 5.554 16.734 ( -1.166 -5.773 -6.962) 9.119 20.045 ( -0.582 3.560 8.322) 9.070 20.125 ( -0.415 -3.719 7.957) 8.793 20.417 ( 0.675 4.183 -3.464) 5.473 20.514 ( 1.486 -4.731 -5.036) 7.068 21.575 ( -2.774 -0.837 12.223) 12.562 21.616 ( -3.126 -4.749 10.990) 12.374 22.098 ( 1.087 -1.158 1.954) 2.518 22.127 ( 0.425 -3.852 0.810) 3.959 22.741 ( -0.475 4.763 8.131) 9.436 22.815 ( 0.122 -2.084 5.507) 5.890 23.734 ( -1.104 2.499 -0.390) 2.760 23.760 ( -0.680 0.162 -1.003) 1.222 24.224 ( 0.233 2.486 -1.295) 2.812 24.273 ( 0.807 -2.219 -2.460) 3.410 24.899 ( 2.316 4.374 -9.746) 10.931 24.931 ( 2.048 1.264 -10.188) 10.468 ======================= Grid point 175 (89/104) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 56 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.543 ( -0.329 0.000 -8.919) 8.926 1.543 ( 0.329 0.000 8.919) 8.926 2.053 ( -2.159 0.000 -16.114) 16.258 2.053 ( 2.159 0.000 16.114) 16.258 2.586 ( -9.129 0.000 -13.232) 16.075 2.586 ( 9.129 0.000 13.232) 16.075 2.682 ( 4.580 0.000 -4.713) 6.572 2.682 ( -4.580 0.000 4.713) 6.572 2.913 ( 1.814 0.000 -1.041) 2.091 2.913 ( -1.814 0.000 1.041) 2.091 3.236 ( 0.242 0.000 -2.219) 2.233 3.236 ( -0.242 0.000 2.219) 2.233 3.516 ( -2.364 0.000 -0.107) 2.366 3.516 ( 2.364 0.000 0.107) 2.366 3.751 ( 4.120 0.000 -4.721) 6.266 3.751 ( -4.120 0.000 4.721) 6.266 3.999 ( -2.091 0.000 -5.438) 5.826 3.999 ( 2.091 0.000 5.438) 5.826 4.193 ( -12.131 0.000 0.441) 12.139 4.193 ( 12.131 0.000 -0.441) 12.139 4.468 ( 5.610 0.000 -4.086) 6.941 4.468 ( -5.610 0.000 4.086) 6.941 4.736 ( 0.918 0.000 -1.541) 1.793 4.736 ( -0.918 0.000 1.541) 1.793 4.861 ( -7.743 0.000 -3.605) 8.541 4.861 ( 7.743 0.000 3.605) 8.541 5.159 ( 0.809 0.000 -7.245) 7.290 5.159 ( -0.809 0.000 7.245) 7.290 5.561 ( 0.200 0.000 -1.785) 1.796 5.561 ( -0.200 0.000 1.785) 1.796 5.908 ( -0.415 0.000 -3.526) 3.550 5.908 ( 0.415 0.000 3.526) 3.550 6.379 ( -0.086 0.000 -4.082) 4.083 6.379 ( 0.086 0.000 4.082) 4.083 6.599 ( -2.650 0.000 -3.443) 4.345 6.599 ( 2.650 0.000 3.443) 4.345 7.018 ( -6.893 0.000 0.428) 6.907 7.018 ( 6.893 0.000 -0.428) 6.907 7.129 ( -0.482 0.000 -3.620) 3.652 7.129 ( 0.482 0.000 3.620) 3.652 7.697 ( 6.036 0.000 -3.477) 6.966 7.697 ( -6.036 0.000 3.477) 6.966 8.273 ( -5.742 0.000 -2.510) 6.267 8.273 ( 5.742 0.000 2.510) 6.267 8.479 ( -3.124 0.000 -0.653) 3.191 8.479 ( 3.124 0.000 0.653) 3.191 8.936 ( -5.467 0.000 1.604) 5.697 8.936 ( 5.467 0.000 -1.604) 5.697 9.327 ( 1.928 0.000 -2.969) 3.540 9.327 ( -1.928 0.000 2.969) 3.540 9.931 ( 8.033 0.000 -5.855) 9.940 9.931 ( -8.033 0.000 5.855) 9.940 10.530 ( 6.166 0.000 -2.450) 6.635 10.530 ( -6.166 0.000 2.450) 6.635 10.695 ( -6.741 0.000 1.457) 6.896 10.695 ( 6.741 0.000 -1.457) 6.896 11.075 ( 2.741 0.000 -5.391) 6.048 11.075 ( -2.741 0.000 5.391) 6.048 11.286 ( 2.915 0.000 -1.112) 3.120 11.286 ( -2.915 0.000 1.112) 3.120 11.850 ( -11.023 0.000 -8.156) 13.713 11.850 ( 11.023 0.000 8.156) 13.713 12.103 ( -2.381 0.000 -4.346) 4.956 12.103 ( 2.381 0.000 4.346) 4.956 12.640 ( -12.971 0.000 -3.247) 13.371 12.640 ( 12.971 0.000 3.247) 13.371 13.133 ( -12.790 0.000 2.660) 13.064 13.133 ( 12.790 0.000 -2.660) 13.064 13.647 ( -2.167 0.000 -4.165) 4.695 13.647 ( 2.167 0.000 4.165) 4.695 13.924 ( -2.580 0.000 -3.045) 3.991 13.924 ( 2.580 0.000 3.045) 3.991 14.660 ( 0.410 0.000 -3.824) 3.845 14.660 ( -0.410 0.000 3.824) 3.845 15.163 ( -1.105 0.000 -1.818) 2.127 15.163 ( 1.105 0.000 1.818) 2.127 16.273 ( 0.196 0.000 -4.841) 4.845 16.273 ( -0.196 0.000 4.841) 4.845 16.741 ( 1.058 0.000 -10.602) 10.655 16.741 ( -1.058 0.000 10.602) 10.655 20.044 ( -1.623 0.000 -4.023) 4.338 20.044 ( 1.623 0.000 4.023) 4.338 20.554 ( 0.666 0.000 -8.989) 9.014 20.554 ( -0.666 0.000 8.989) 9.014 22.159 ( -0.183 0.000 -8.997) 8.999 22.159 ( 0.183 0.000 8.997) 8.999 22.412 ( 0.829 0.000 -6.388) 6.442 22.412 ( -0.829 0.000 6.388) 6.442 22.669 ( 2.476 0.000 -4.380) 5.031 22.669 ( -2.476 0.000 4.380) 5.031 23.503 ( 1.030 0.000 -0.489) 1.140 23.503 ( -1.030 0.000 0.489) 1.140 24.186 ( 0.864 0.000 -8.743) 8.786 24.186 ( -0.864 0.000 8.743) 8.786 24.539 ( 2.119 0.000 -5.748) 6.126 24.539 ( -2.119 0.000 5.748) 6.126 ======================= Grid point 177 (90/104) ======================= q-point: ( 0.17 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.598 ( 9.601 0.000 -11.359) 14.873 1.627 ( 6.733 0.000 2.693) 7.252 2.032 ( 3.427 0.000 -13.108) 13.549 2.169 ( 5.045 0.000 10.402) 11.561 2.358 ( -9.876 0.000 -4.136) 10.707 2.610 ( -5.774 0.000 5.112) 7.711 2.655 ( -0.746 0.000 3.420) 3.501 2.779 ( 1.854 0.000 -3.554) 4.008 2.868 ( -2.286 0.000 -0.348) 2.313 2.912 ( -1.433 0.000 1.744) 2.257 3.174 ( -6.987 0.000 0.609) 7.013 3.179 ( -6.416 0.000 4.607) 7.899 3.530 ( 3.164 0.000 -2.723) 4.175 3.598 ( 5.131 0.000 -0.236) 5.136 3.696 ( -0.649 0.000 5.621) 5.658 3.772 ( -0.300 0.000 -8.325) 8.330 3.954 ( -1.148 0.000 -4.600) 4.741 3.965 ( -10.132 0.000 6.341) 11.952 4.059 ( 1.160 0.000 3.022) 3.236 4.335 ( -8.566 0.000 7.594) 11.447 4.383 ( 6.974 0.000 -0.479) 6.991 4.442 ( -7.121 0.000 -1.137) 7.212 4.748 ( -0.053 0.000 -7.585) 7.585 4.751 ( 1.843 0.000 0.141) 1.848 4.810 ( 5.071 0.000 -0.929) 5.155 4.999 ( 5.360 0.000 -2.821) 6.057 5.130 ( -3.946 0.000 4.571) 6.039 5.148 ( -0.004 0.000 -1.758) 1.758 5.527 ( -2.522 0.000 1.365) 2.867 5.554 ( -0.204 0.000 6.096) 6.099 5.968 ( 5.488 0.000 -4.056) 6.824 6.008 ( 7.082 0.000 1.445) 7.227 6.376 ( 1.395 0.000 -3.978) 4.216 6.409 ( 2.935 0.000 4.487) 5.361 6.568 ( -0.134 0.000 -1.452) 1.458 6.686 ( 5.815 0.000 4.406) 7.296 6.880 ( -7.446 0.000 -2.429) 7.832 7.071 ( -4.699 0.000 -3.850) 6.075 7.104 ( -3.861 0.000 1.987) 4.342 7.119 ( 3.943 0.000 -1.447) 4.200 7.572 ( -6.984 0.000 1.780) 7.207 7.723 ( -3.056 0.000 -2.276) 3.810 8.236 ( 3.588 0.000 -3.485) 5.002 8.390 ( 5.182 0.000 3.128) 6.053 8.462 ( 0.775 0.000 2.171) 2.305 8.584 ( 7.238 0.000 3.554) 8.063 8.826 ( -6.344 0.000 0.520) 6.365 8.999 ( 1.405 0.000 -2.311) 2.705 9.247 ( -5.984 0.000 3.272) 6.820 9.262 ( -7.787 0.000 0.941) 7.843 9.900 ( 3.871 0.000 -1.160) 4.041 10.109 ( 11.749 0.000 -9.755) 15.271 10.399 ( -8.095 0.000 -0.021) 8.095 10.551 ( -6.993 0.000 8.294) 10.849 10.636 ( 3.531 0.000 -1.416) 3.805 10.813 ( 5.880 0.000 4.289) 7.278 11.024 ( -3.853 0.000 8.346) 9.193 11.070 ( -2.602 0.000 -0.875) 2.745 11.221 ( -3.969 0.000 2.268) 4.571 11.324 ( 0.988 0.000 0.089) 0.992 11.727 ( -0.124 0.000 -12.813) 12.813 12.046 ( -2.659 0.000 -1.000) 2.841 12.058 ( 4.423 0.000 4.162) 6.073 12.099 ( -7.970 0.000 -3.537) 8.720 12.454 ( 1.306 0.000 3.758) 3.979 12.817 ( 5.043 0.000 -0.028) 5.043 12.975 ( -2.501 0.000 1.787) 3.073 13.338 ( 9.178 0.000 -7.096) 11.601 13.585 ( -2.762 0.000 -4.323) 5.130 13.675 ( -0.150 0.000 3.357) 3.360 13.922 ( 3.236 0.000 -1.207) 3.454 13.997 ( 3.613 0.000 4.734) 5.956 14.692 ( 3.629 0.000 -3.470) 5.021 14.699 ( 3.260 0.000 4.051) 5.200 15.100 ( -4.629 0.000 -3.383) 5.734 15.145 ( -3.226 0.000 0.694) 3.300 16.259 ( -0.226 0.000 -5.648) 5.652 16.272 ( -1.160 0.000 4.149) 4.308 16.747 ( 2.292 0.000 -10.332) 10.583 16.757 ( -0.136 0.000 10.706) 10.707 20.005 ( -1.236 0.000 -3.377) 3.597 20.068 ( -0.323 0.000 3.954) 3.967 20.565 ( 2.684 0.000 -8.034) 8.471 20.585 ( 1.025 0.000 12.021) 12.065 22.122 ( -1.037 0.000 -9.920) 9.974 22.167 ( -1.662 0.000 8.477) 8.639 22.387 ( -2.827 0.000 4.796) 5.567 22.392 ( -0.977 0.000 -5.145) 5.237 22.670 ( 1.200 0.000 4.716) 4.867 22.721 ( 3.853 0.000 -6.772) 7.791 23.485 ( -0.936 0.000 0.567) 1.094 23.514 ( 0.303 0.000 -1.402) 1.434 24.178 ( 0.757 0.000 -8.982) 9.013 24.187 ( -1.304 0.000 8.723) 8.820 24.509 ( -2.226 0.000 5.414) 5.853 24.551 ( 0.553 0.000 -5.570) 5.598 ======================= Grid point 178 (91/104) ======================= q-point: ( 0.33 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.793 ( 10.400 0.000 0.824) 10.432 1.844 ( 18.942 0.000 -9.299) 21.101 2.090 ( 5.133 0.000 -9.065) 10.417 2.134 ( -5.595 0.000 -5.270) 7.686 2.318 ( -2.629 0.000 6.894) 7.378 2.531 ( -1.470 0.000 16.183) 16.250 2.613 ( -8.209 0.000 -2.507) 8.584 2.690 ( -5.768 0.000 -3.157) 6.575 2.845 ( 0.205 0.000 -2.857) 2.864 2.871 ( -3.786 0.000 1.422) 4.044 3.003 ( -7.631 0.000 -5.683) 9.515 3.041 ( -9.278 0.000 6.756) 11.477 3.590 ( 4.484 0.000 -4.655) 6.464 3.663 ( 1.670 0.000 -2.785) 3.247 3.707 ( -3.239 0.000 4.701) 5.709 3.724 ( -2.728 0.000 -1.958) 3.357 3.945 ( 7.525 0.000 10.886) 13.234 3.947 ( 2.892 0.000 -11.718) 12.070 4.076 ( -1.650 0.000 9.791) 9.929 4.222 ( -4.865 0.000 8.546) 9.833 4.283 ( -7.556 0.000 -3.173) 8.195 4.393 ( -5.008 0.000 -5.520) 7.453 4.800 ( 3.473 0.000 -0.325) 3.488 4.811 ( 6.317 0.000 0.122) 6.318 4.905 ( 4.555 0.000 -0.587) 4.592 5.023 ( -0.427 0.000 -6.901) 6.914 5.060 ( -3.321 0.000 1.064) 3.487 5.139 ( -2.416 0.000 1.939) 3.098 5.523 ( 1.672 0.000 3.257) 3.661 5.577 ( 0.341 0.000 5.510) 5.520 6.023 ( 1.363 0.000 -3.504) 3.760 6.073 ( -0.158 0.000 -4.270) 4.273 6.451 ( 6.644 0.000 3.849) 7.678 6.523 ( 6.889 0.000 6.892) 9.745 6.591 ( 3.366 0.000 -2.848) 4.410 6.737 ( -5.030 0.000 -5.313) 7.316 6.840 ( 7.520 0.000 2.865) 8.047 6.952 ( -5.951 0.000 -3.071) 6.696 6.996 ( -7.772 0.000 0.210) 7.775 7.140 ( -2.185 0.000 -0.520) 2.246 7.485 ( -1.670 0.000 -0.857) 1.877 7.618 ( -6.629 0.000 0.481) 6.646 8.348 ( 7.967 0.000 -5.330) 9.585 8.469 ( 1.970 0.000 4.349) 4.774 8.511 ( 3.652 0.000 3.766) 5.246 8.711 ( -4.571 0.000 1.665) 4.865 8.729 ( 5.283 0.000 1.578) 5.514 8.962 ( -4.667 0.000 -2.419) 5.257 9.130 ( -4.965 0.000 1.583) 5.211 9.161 ( -3.701 0.000 1.262) 3.910 10.008 ( 6.999 0.000 -3.977) 8.050 10.246 ( -7.658 0.000 0.796) 7.699 10.283 ( 9.415 0.000 -13.671) 16.599 10.456 ( -5.808 0.000 16.370) 17.370 10.719 ( 6.153 0.000 -2.229) 6.544 10.930 ( 4.786 0.000 7.449) 8.854 10.990 ( -1.893 0.000 9.780) 9.962 10.992 ( -5.333 0.000 1.732) 5.607 11.163 ( -2.613 0.000 -2.280) 3.468 11.267 ( -7.309 0.000 -7.488) 10.464 11.732 ( 2.476 0.000 -8.916) 9.254 11.856 ( -9.035 0.000 -7.721) 11.885 12.016 ( -0.095 0.000 -0.562) 0.570 12.078 ( -2.313 0.000 5.787) 6.232 12.587 ( 5.630 0.000 5.949) 8.191 12.815 ( -4.151 0.000 -3.452) 5.399 13.097 ( 12.477 0.000 7.906) 14.770 13.431 ( 2.420 0.000 -9.555) 9.856 13.545 ( 0.239 0.000 -3.156) 3.165 13.657 ( -2.591 0.000 2.771) 3.793 14.009 ( 5.427 0.000 -1.845) 5.732 14.064 ( 2.001 0.000 4.907) 5.299 14.758 ( 3.924 0.000 -3.214) 5.072 14.776 ( 3.161 0.000 4.915) 5.844 15.002 ( -3.928 0.000 -4.863) 6.252 15.061 ( -5.505 0.000 0.822) 5.566 16.243 ( 0.157 0.000 -5.792) 5.794 16.255 ( -1.613 0.000 4.324) 4.615 16.769 ( 2.564 0.000 -10.180) 10.498 16.779 ( -0.494 0.000 10.532) 10.544 19.992 ( 0.695 0.000 -2.931) 3.012 20.051 ( -2.254 0.000 3.356) 4.043 20.604 ( 3.543 0.000 -9.497) 10.137 20.630 ( -0.071 0.000 13.886) 13.887 22.089 ( 0.577 0.000 -10.583) 10.599 22.140 ( -3.312 0.000 8.640) 9.253 22.354 ( -1.507 0.000 3.059) 3.410 22.363 ( -0.806 0.000 -3.763) 3.848 22.716 ( 1.797 0.000 6.709) 6.945 22.759 ( 2.063 0.000 -8.228) 8.483 23.477 ( -0.089 0.000 1.579) 1.582 23.507 ( -0.531 0.000 -2.420) 2.478 24.172 ( 1.015 0.000 -9.216) 9.271 24.180 ( -1.671 0.000 8.999) 9.153 24.494 ( -0.691 0.000 4.964) 5.012 24.534 ( -0.742 0.000 -5.088) 5.141 ======================= Grid point 179 (92/104) ======================= q-point: (-0.50 0.00 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 52 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.973 ( -6.546 0.000 -5.914) 8.822 1.973 ( 6.546 0.000 5.914) 8.822 2.184 ( 6.782 0.000 -5.841) 8.950 2.184 ( -6.782 0.000 5.841) 8.950 2.276 ( -20.402 0.000 0.018) 20.402 2.276 ( 20.402 0.000 -0.018) 20.402 2.628 ( -3.535 0.000 -14.445) 14.871 2.628 ( 3.535 0.000 14.445) 14.871 2.840 ( -0.361 0.000 -4.551) 4.565 2.840 ( 0.361 0.000 4.551) 4.565 2.931 ( 2.245 0.000 -9.129) 9.401 2.931 ( -2.245 0.000 9.129) 9.401 3.664 ( 4.133 0.000 -4.367) 6.013 3.664 ( -4.133 0.000 4.367) 6.013 3.668 ( 1.094 0.000 -5.180) 5.294 3.668 ( -1.094 0.000 5.180) 5.294 4.002 ( 5.697 0.000 -14.507) 15.586 4.002 ( -5.697 0.000 14.507) 15.586 4.160 ( -6.086 0.000 -9.474) 11.261 4.160 ( 6.086 0.000 9.474) 11.261 4.243 ( -6.438 0.000 -5.887) 8.724 4.243 ( 6.438 0.000 5.887) 8.724 4.861 ( -2.074 0.000 0.259) 2.090 4.861 ( 2.074 0.000 -0.259) 2.090 4.977 ( -2.994 0.000 -4.168) 5.132 4.977 ( 2.994 0.000 4.168) 5.132 5.069 ( -4.135 0.000 0.318) 4.147 5.069 ( 4.135 0.000 -0.318) 4.147 5.571 ( -1.923 0.000 -0.390) 1.963 5.571 ( 1.923 0.000 0.390) 1.963 6.038 ( -1.331 0.000 -2.161) 2.538 6.038 ( 1.331 0.000 2.161) 2.538 6.575 ( -4.025 0.000 -3.097) 5.078 6.575 ( 4.025 0.000 3.097) 5.078 6.665 ( 3.574 0.000 -1.914) 4.054 6.665 ( -3.574 0.000 1.914) 4.054 6.866 ( -3.506 0.000 1.056) 3.662 6.866 ( 3.506 0.000 -1.056) 3.662 7.031 ( -8.594 0.000 -0.998) 8.652 7.031 ( 8.594 0.000 0.998) 8.652 7.513 ( 4.452 0.000 -1.764) 4.789 7.513 ( -4.452 0.000 1.764) 4.789 8.458 ( 4.566 0.000 -5.497) 7.146 8.458 ( -4.566 0.000 5.497) 7.146 8.606 ( -5.343 0.000 -3.057) 6.156 8.606 ( 5.343 0.000 3.057) 6.156 8.848 ( -6.135 0.000 -3.270) 6.952 8.848 ( 6.135 0.000 3.270) 6.952 9.110 ( -1.754 0.000 -0.313) 1.782 9.110 ( 1.754 0.000 0.313) 1.782 10.119 ( -6.282 0.000 1.665) 6.499 10.119 ( 6.282 0.000 -1.665) 6.499 10.394 ( 6.187 0.000 -15.145) 16.361 10.394 ( -6.187 0.000 15.145) 16.361 10.861 ( 9.272 0.000 -4.978) 10.524 10.861 ( -9.272 0.000 4.978) 10.524 11.003 ( 0.632 0.000 -7.181) 7.209 11.003 ( -0.632 0.000 7.181) 7.209 11.127 ( -1.431 0.000 -1.639) 2.176 11.127 ( 1.431 0.000 1.639) 2.176 11.762 ( -2.208 0.000 0.257) 2.223 11.762 ( 2.208 0.000 -0.257) 2.223 12.038 ( 2.755 0.000 -4.240) 5.056 12.038 ( -2.755 0.000 4.240) 5.056 12.700 ( -6.008 0.000 -4.641) 7.592 12.700 ( 6.008 0.000 4.641) 7.592 13.337 ( -8.910 0.000 -10.818) 14.015 13.337 ( 8.910 0.000 10.818) 14.015 13.597 ( 4.345 0.000 -2.409) 4.969 13.597 ( -4.345 0.000 2.409) 4.969 14.077 ( 2.073 0.000 -3.604) 4.158 14.077 ( -2.073 0.000 3.604) 4.158 14.806 ( 1.676 0.000 -4.593) 4.889 14.806 ( -1.676 0.000 4.593) 4.889 14.978 ( 2.980 0.000 -3.577) 4.656 14.978 ( -2.980 0.000 3.577) 4.656 16.241 ( 1.032 0.000 -5.160) 5.262 16.241 ( -1.032 0.000 5.160) 5.262 16.785 ( 1.687 0.000 -10.277) 10.415 16.785 ( -1.687 0.000 10.277) 10.415 20.014 ( 2.295 0.000 -2.958) 3.744 20.014 ( -2.295 0.000 2.958) 3.744 20.637 ( 2.568 0.000 -12.308) 12.573 20.637 ( -2.568 0.000 12.308) 12.573 22.099 ( 3.078 0.000 -9.757) 10.231 22.099 ( -3.078 0.000 9.757) 10.231 22.347 ( 0.049 0.000 -2.989) 2.990 22.347 ( -0.049 0.000 2.989) 2.990 22.755 ( -0.280 0.000 -8.071) 8.076 22.755 ( 0.280 0.000 8.071) 8.076 23.488 ( -0.648 0.000 -2.517) 2.599 23.488 ( 0.648 0.000 2.517) 2.599 24.173 ( 1.475 0.000 -9.251) 9.368 24.173 ( -1.475 0.000 9.251) 9.368 24.507 ( -0.694 0.000 -4.813) 4.863 24.507 ( 0.694 0.000 4.813) 4.863 ======================= Grid point 183 (93/104) ======================= q-point: ( 0.00 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.611 ( -2.352 6.150 -8.504) 10.755 1.611 ( 2.352 6.150 8.504) 10.755 2.092 ( -1.233 4.403 -17.491) 18.079 2.092 ( 1.233 4.403 17.491) 18.079 2.626 ( 1.465 3.631 -3.148) 5.024 2.626 ( -1.465 3.631 3.148) 5.024 2.850 ( -1.566 6.538 -2.234) 7.084 2.850 ( 1.566 6.538 2.234) 7.084 2.907 ( -6.791 5.888 -7.133) 11.475 2.907 ( 6.791 5.888 7.133) 11.475 3.228 ( 1.265 -0.796 -4.753) 4.982 3.228 ( -1.265 -0.796 4.753) 4.982 3.485 ( -2.189 -3.049 -1.607) 4.082 3.485 ( 2.189 -3.049 1.607) 4.082 3.755 ( 1.462 0.704 -6.016) 6.231 3.755 ( -1.462 0.704 6.016) 6.231 3.970 ( 1.377 -0.321 -8.105) 8.227 3.970 ( -1.377 -0.321 8.105) 8.227 4.240 ( -3.144 1.521 -2.873) 4.522 4.240 ( 3.144 1.521 2.873) 4.522 4.523 ( -2.878 6.172 -4.047) 7.922 4.523 ( 2.878 6.172 4.047) 7.922 4.756 ( -1.731 1.706 -1.917) 3.096 4.756 ( 1.731 1.706 1.917) 3.096 4.959 ( -10.432 8.118 -2.634) 13.479 4.959 ( 10.432 8.118 2.634) 13.479 5.132 ( 0.268 -1.702 -6.279) 6.511 5.132 ( -0.268 -1.702 6.279) 6.511 5.542 ( 0.848 -1.959 -3.116) 3.777 5.542 ( -0.848 -1.959 3.116) 3.777 5.875 ( 0.181 -3.395 -4.258) 5.449 5.875 ( -0.181 -3.395 4.258) 5.449 6.363 ( -2.105 -0.998 -4.021) 4.647 6.363 ( 2.105 -0.998 4.021) 4.647 6.583 ( 1.012 -0.940 -2.108) 2.520 6.583 ( -1.012 -0.940 2.108) 2.520 6.966 ( -1.032 -3.507 -0.900) 3.765 6.966 ( 1.032 -3.507 0.900) 3.765 7.177 ( 0.078 1.823 -4.622) 4.969 7.177 ( -0.078 1.823 4.622) 4.969 7.755 ( 4.874 5.446 -3.263) 8.004 7.755 ( -4.874 5.446 3.263) 8.004 8.255 ( -4.157 -1.292 -1.912) 4.755 8.255 ( 4.157 -1.292 1.912) 4.755 8.479 ( -1.385 0.053 -2.704) 3.039 8.479 ( 1.385 0.053 2.704) 3.039 8.937 ( 0.381 -0.530 -1.277) 1.434 8.937 ( -0.381 -0.530 1.277) 1.434 9.330 ( 1.252 0.554 -1.979) 2.407 9.330 ( -1.252 0.554 1.979) 2.407 9.866 ( 5.267 -5.477 -6.320) 9.883 9.866 ( -5.267 -5.477 6.320) 9.883 10.469 ( 2.879 -4.421 -4.088) 6.675 10.469 ( -2.879 -4.421 4.088) 6.675 10.695 ( -3.832 -0.667 -1.867) 4.315 10.695 ( 3.832 -0.667 1.867) 4.315 11.059 ( 2.489 -1.217 -4.737) 5.488 11.059 ( -2.489 -1.217 4.737) 5.488 11.261 ( 7.848 -2.229 -3.641) 8.934 11.261 ( -7.848 -2.229 3.641) 8.934 11.881 ( -14.100 2.222 -8.467) 16.596 11.881 ( 14.100 2.222 8.467) 16.596 12.138 ( -3.236 2.537 -6.461) 7.658 12.138 ( 3.236 2.537 6.461) 7.658 12.623 ( -10.628 -1.095 -3.594) 11.272 12.623 ( 10.628 -1.095 3.594) 11.272 13.065 ( -8.028 -4.530 1.002) 9.272 13.065 ( 8.028 -4.530 -1.002) 9.272 13.656 ( -1.520 -0.441 -2.175) 2.690 13.656 ( 1.520 -0.441 2.175) 2.690 13.889 ( -1.818 -2.649 -2.639) 4.158 13.889 ( 1.818 -2.649 2.639) 4.158 14.728 ( -1.700 5.714 -6.821) 9.059 14.728 ( 1.700 5.714 6.821) 9.059 15.213 ( 1.813 4.439 -4.764) 6.759 15.213 ( -1.813 4.439 4.764) 6.759 16.276 ( -0.180 0.294 -5.092) 5.103 16.276 ( 0.180 0.294 5.092) 5.103 16.722 ( 1.247 -1.821 -10.178) 10.414 16.722 ( -1.247 -1.821 10.178) 10.414 20.061 ( -1.318 1.652 -4.368) 4.853 20.061 ( 1.318 1.652 4.368) 4.853 20.541 ( 0.693 -1.350 -8.706) 8.837 20.541 ( -0.693 -1.350 8.706) 8.837 22.018 ( 0.049 -10.135 -6.639) 12.116 22.018 ( -0.049 -10.135 6.639) 12.116 22.391 ( -1.199 -4.870 -1.483) 5.230 22.391 ( 1.199 -4.870 1.483) 5.230 22.686 ( 1.010 3.540 -4.965) 6.181 22.686 ( -1.010 3.540 4.965) 6.181 23.571 ( -1.069 5.026 -0.772) 5.196 23.571 ( 1.069 5.026 0.772) 5.196 24.198 ( 0.947 1.019 -7.949) 8.070 24.198 ( -0.947 1.019 7.949) 8.070 24.600 ( 0.728 5.302 -4.748) 7.154 24.600 ( -0.728 5.302 4.748) 7.154 ======================= Grid point 185 (94/104) ======================= q-point: ( 0.17 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( 4.531 3.023 -10.499) 11.828 1.734 ( 8.383 6.923 3.014) 11.282 2.070 ( 2.588 5.354 -13.095) 14.382 2.205 ( 5.955 2.615 15.864) 17.146 2.546 ( -7.633 12.774 -0.384) 14.885 2.600 ( -2.800 3.172 -3.144) 5.272 2.707 ( -9.627 -1.277 3.293) 10.254 2.788 ( -1.418 4.274 -4.062) 6.065 2.905 ( -0.159 3.425 -4.407) 5.584 3.005 ( -0.089 6.641 4.879) 8.241 3.155 ( -7.055 0.230 5.380) 8.875 3.193 ( -3.742 0.555 0.494) 3.815 3.491 ( 2.523 -4.851 -4.058) 6.810 3.560 ( 3.991 -1.948 1.866) 4.817 3.723 ( -1.095 -2.286 -4.039) 4.768 3.813 ( 4.121 7.434 5.055) 9.890 3.925 ( -1.760 1.465 0.297) 2.309 4.013 ( 1.527 -1.971 3.448) 4.255 4.078 ( -7.902 4.540 -1.688) 9.269 4.283 ( -2.556 1.340 2.893) 4.087 4.420 ( -7.822 -0.962 -3.739) 8.723 4.598 ( 2.398 12.135 2.796) 12.682 4.748 ( 1.314 0.130 -3.091) 3.361 4.798 ( 1.060 0.372 -1.056) 1.542 4.806 ( -1.183 5.161 -1.871) 5.616 5.092 ( -1.263 0.981 -1.423) 2.140 5.133 ( 4.748 2.253 1.853) 5.573 5.150 ( 1.315 4.791 -0.111) 4.970 5.497 ( -3.865 -2.359 5.400) 7.047 5.548 ( 0.377 -1.003 -0.982) 1.453 5.920 ( 5.423 -4.706 -3.420) 7.953 5.963 ( 5.799 -4.234 1.590) 7.354 6.337 ( 0.979 -1.686 -2.168) 2.916 6.436 ( 4.834 0.910 2.135) 5.362 6.562 ( -0.817 0.343 2.498) 2.651 6.643 ( 4.865 -3.136 1.094) 5.890 6.869 ( -5.623 -1.831 -0.619) 5.946 6.999 ( -1.429 -3.493 -3.508) 5.152 7.120 ( -2.578 -0.019 2.063) 3.302 7.197 ( -0.766 3.550 -2.097) 4.194 7.640 ( -6.641 6.150 1.937) 9.256 7.760 ( -3.981 3.626 -2.526) 5.947 8.249 ( 4.715 0.846 -2.171) 5.259 8.340 ( 3.744 -2.679 1.608) 4.877 8.480 ( 1.740 0.597 1.459) 2.348 8.576 ( 6.869 -0.710 4.607) 8.301 8.822 ( -6.704 -0.773 1.167) 6.849 8.993 ( 0.278 -1.433 -1.953) 2.438 9.265 ( -4.852 1.846 1.990) 5.559 9.277 ( -6.206 1.588 1.024) 6.487 9.859 ( 4.363 -3.846 -0.258) 5.822 10.017 ( 10.566 -7.787 -8.735) 15.766 10.328 ( -7.734 -4.846 2.844) 9.560 10.557 ( -1.267 -1.272 -0.249) 1.813 10.614 ( -0.552 -0.972 0.176) 1.132 10.791 ( 4.654 -2.316 5.004) 7.216 11.010 ( -3.753 -1.481 7.288) 8.330 11.048 ( -3.191 -1.201 2.205) 4.060 11.186 ( -0.487 -2.675 -0.483) 2.762 11.384 ( 1.823 4.288 0.235) 4.665 11.634 ( -5.420 -6.232 -14.168) 16.400 12.013 ( -5.178 -1.615 -4.129) 6.817 12.104 ( 0.518 2.639 2.293) 3.534 12.195 ( -2.661 6.021 3.230) 7.332 12.463 ( 1.039 0.263 2.995) 3.181 12.785 ( 6.560 -1.071 1.875) 6.906 12.975 ( -1.332 -0.444 -0.340) 1.445 13.197 ( 5.868 -10.078 -4.321) 12.437 13.597 ( -2.618 0.236 -0.766) 2.737 13.699 ( 1.601 -0.127 -0.760) 1.777 13.899 ( 3.657 -1.728 -0.288) 4.055 13.964 ( 4.073 -2.317 3.831) 6.053 14.713 ( 1.861 4.252 -6.167) 7.719 14.810 ( 4.951 6.925 6.460) 10.687 15.128 ( -6.315 3.448 1.586) 7.368 15.224 ( -0.839 5.970 -4.542) 7.548 16.247 ( -1.254 -0.412 -3.898) 4.115 16.281 ( -1.126 0.294 3.184) 3.390 16.723 ( 1.100 -1.933 -0.558) 2.293 16.749 ( 1.677 -1.173 0.644) 2.145 20.028 ( -0.866 2.151 -3.745) 4.405 20.086 ( -0.101 1.601 4.232) 4.526 20.523 ( 0.143 -2.694 -0.214) 2.706 20.580 ( 1.665 -1.677 2.741) 3.619 21.977 ( -1.342 -9.839 -2.794) 10.315 22.047 ( 0.580 -8.670 0.860) 8.732 22.371 ( -0.484 -2.828 -0.993) 3.036 22.417 ( 0.899 -6.058 1.443) 6.292 22.649 ( -1.848 4.032 1.018) 4.550 22.710 ( 0.731 0.765 -2.009) 2.271 23.555 ( -0.289 5.346 -0.039) 5.354 23.593 ( 0.943 5.563 0.082) 5.643 24.190 ( -0.148 0.965 -2.454) 2.641 24.199 ( -0.477 1.065 2.132) 2.430 24.572 ( -1.581 5.448 0.388) 5.686 24.610 ( -0.130 5.098 -1.000) 5.196 ======================= Grid point 186 (95/104) ======================= q-point: ( 0.33 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.735 ( 12.836 -1.386 -10.346) 16.545 1.907 ( 8.714 4.208 2.360) 9.961 2.089 ( 1.241 5.259 -9.381) 10.826 2.294 ( -8.424 -1.270 8.447) 11.997 2.429 ( 1.802 13.601 2.601) 13.965 2.523 ( -1.589 4.895 7.615) 9.190 2.618 ( -0.160 1.389 -3.502) 3.771 2.776 ( -2.530 6.498 -5.412) 8.827 2.835 ( -3.883 -1.841 -2.649) 5.048 2.947 ( -6.719 6.008 5.038) 10.326 3.016 ( -6.112 3.502 -0.795) 7.089 3.101 ( -6.688 3.219 3.014) 8.010 3.543 ( 3.578 -6.006 -2.824) 7.540 3.609 ( 0.280 -4.356 2.894) 5.237 3.678 ( -0.634 0.419 -6.553) 6.597 3.815 ( -5.321 4.946 -0.656) 7.295 3.984 ( 4.631 2.017 4.119) 6.517 4.026 ( 3.870 5.908 -7.647) 10.409 4.052 ( 1.579 -0.342 10.536) 10.660 4.204 ( -6.758 3.773 6.387) 10.035 4.287 ( -2.455 -0.234 -2.275) 3.355 4.543 ( -6.961 8.276 -3.705) 11.432 4.797 ( 3.879 -0.520 0.855) 4.006 4.837 ( 2.343 3.720 -1.816) 4.757 4.855 ( 4.328 -0.958 1.074) 4.561 5.030 ( -4.265 0.666 -1.694) 4.637 5.150 ( 0.865 5.304 -0.460) 5.394 5.212 ( 0.953 7.086 -0.419) 7.162 5.467 ( 0.259 -3.787 6.188) 7.259 5.555 ( -0.192 -2.639 -1.111) 2.870 5.980 ( 2.045 -4.058 -4.174) 6.170 6.030 ( 0.293 -4.217 -0.874) 4.316 6.409 ( 6.298 -2.264 2.815) 7.260 6.545 ( 2.792 -3.077 -0.355) 4.170 6.583 ( 5.766 4.483 4.074) 8.363 6.748 ( 2.433 -2.483 0.044) 3.476 6.790 ( 0.395 -2.017 -0.202) 2.065 6.907 ( -5.994 -1.415 -3.826) 7.250 7.073 ( -4.123 2.147 2.341) 5.205 7.146 ( -3.526 1.185 -2.829) 4.673 7.553 ( -2.480 5.977 0.357) 6.481 7.650 ( -6.095 3.314 -0.477) 6.955 8.368 ( 7.053 1.037 -2.875) 7.686 8.406 ( 3.084 -3.081 1.552) 4.628 8.534 ( 3.044 0.098 3.781) 4.855 8.703 ( -2.371 -1.781 -1.807) 3.473 8.720 ( 2.902 -0.130 6.099) 6.755 8.938 ( -4.971 -2.419 -2.400) 6.027 9.162 ( -4.469 2.727 3.238) 6.156 9.200 ( -3.091 3.839 -1.118) 5.054 9.976 ( 7.582 -3.498 -2.670) 8.766 10.170 ( 4.230 -8.873 -3.827) 10.548 10.225 ( -0.301 -2.661 -4.478) 5.218 10.449 ( -8.189 0.015 10.222) 13.097 10.676 ( 5.437 -3.466 -3.810) 7.490 10.865 ( 0.098 -5.158 8.202) 9.690 10.957 ( -2.080 -2.090 1.258) 3.205 11.029 ( -0.022 1.635 10.112) 10.243 11.175 ( -1.459 0.534 -3.712) 4.024 11.246 ( -10.505 -1.294 -8.891) 13.823 11.670 ( 6.886 -3.700 -7.324) 10.712 11.860 ( -7.379 -0.171 -5.434) 9.166 12.050 ( -2.446 2.423 -1.028) 3.593 12.128 ( -4.355 4.087 5.018) 7.801 12.576 ( 5.592 -1.463 5.699) 8.118 12.827 ( -4.298 0.922 -3.780) 5.797 13.061 ( 10.452 -2.985 6.318) 12.572 13.270 ( 2.945 -11.311 -4.848) 12.654 13.576 ( 0.803 1.799 0.411) 2.012 13.699 ( -1.566 0.958 -2.136) 2.817 13.986 ( 4.869 -1.526 -1.024) 5.204 14.035 ( 2.146 -1.967 4.053) 4.990 14.758 ( 4.315 3.427 -5.393) 7.711 14.908 ( 1.589 7.539 5.674) 9.569 15.021 ( -3.325 3.509 2.578) 5.479 15.168 ( -3.520 7.453 -5.777) 10.065 16.222 ( -0.176 -1.062 -3.804) 3.954 16.255 ( -2.209 -0.379 3.065) 3.797 16.752 ( 1.812 -1.389 -0.377) 2.314 16.776 ( 0.811 -0.758 0.478) 1.209 20.019 ( 0.865 2.459 -3.400) 4.284 20.075 ( -2.015 2.062 3.734) 4.717 20.545 ( 1.987 -4.240 0.035) 4.683 20.602 ( -0.232 -3.324 2.671) 4.271 21.967 ( 1.133 -8.077 -2.910) 8.659 22.039 ( -1.652 -7.144 0.940) 7.392 22.371 ( 0.718 -1.476 -0.524) 1.723 22.420 ( -0.990 -3.623 0.823) 3.845 22.638 ( 0.616 0.278 1.192) 1.370 22.702 ( -1.026 -1.887 -2.089) 2.997 23.562 ( 0.798 6.218 1.254) 6.393 23.600 ( -0.118 6.413 -1.186) 6.523 24.183 ( 0.018 0.942 -2.005) 2.215 24.192 ( -0.766 1.065 1.635) 2.096 24.555 ( -0.180 5.335 0.243) 5.343 24.593 ( -1.327 5.018 -0.771) 5.248 ======================= Grid point 187 (96/104) ======================= q-point: (-0.50 0.14 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 91 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.979 ( 3.902 -2.774 -4.359) 6.474 1.979 ( -3.902 -2.774 4.359) 6.474 2.075 ( 4.755 2.673 -6.615) 8.574 2.075 ( -4.755 2.673 6.615) 8.574 2.558 ( -6.309 14.044 -2.067) 15.534 2.558 ( 6.309 14.044 2.067) 15.534 2.626 ( -5.973 0.976 -11.326) 12.842 2.626 ( 5.973 0.976 11.326) 12.842 2.839 ( 3.574 2.193 -6.995) 8.156 2.839 ( -3.574 2.193 6.995) 8.156 2.997 ( 2.041 4.524 -7.385) 8.898 2.997 ( -2.041 4.524 7.385) 8.898 3.588 ( 1.602 -7.057 -4.640) 8.596 3.588 ( -1.602 -7.057 4.640) 8.596 3.717 ( 2.553 3.790 -5.668) 7.280 3.717 ( -2.553 3.790 5.668) 7.280 4.052 ( 1.370 2.956 -8.857) 9.437 4.052 ( -1.370 2.956 8.857) 9.437 4.100 ( -0.851 0.190 -3.958) 4.053 4.100 ( 0.851 0.190 3.958) 4.053 4.376 ( -8.489 6.856 -4.433) 11.778 4.376 ( 8.489 6.856 4.433) 11.778 4.849 ( -0.917 -0.106 -1.298) 1.593 4.849 ( 0.917 -0.106 1.298) 1.593 4.942 ( -4.501 0.316 -2.874) 5.350 4.942 ( 4.501 0.316 2.874) 5.350 5.185 ( -0.015 7.666 -3.304) 8.347 5.185 ( 0.015 7.666 3.304) 8.347 5.520 ( -2.737 -4.282 -3.930) 6.424 5.520 ( 2.737 -4.282 3.930) 6.424 6.004 ( -0.099 -3.349 -1.841) 3.823 6.004 ( 0.099 -3.349 1.841) 3.823 6.524 ( -2.900 -3.171 -4.922) 6.534 6.524 ( 2.900 -3.171 4.922) 6.534 6.717 ( -3.021 2.472 -3.965) 5.564 6.717 ( 3.021 2.472 3.965) 5.564 6.825 ( -0.936 -2.105 -2.839) 3.656 6.825 ( 0.936 -2.105 2.839) 3.656 7.061 ( -3.299 1.344 -1.803) 3.993 7.061 ( 3.299 1.344 1.803) 3.993 7.561 ( -1.638 4.519 -0.619) 4.846 7.561 ( 1.638 4.519 0.619) 4.846 8.441 ( 0.956 -1.413 -3.749) 4.119 8.441 ( -0.956 -1.413 3.749) 4.119 8.608 ( -4.142 -0.364 -3.973) 5.751 8.608 ( 4.142 -0.364 3.973) 5.751 8.830 ( -5.336 -1.674 -4.279) 7.042 8.830 ( 5.336 -1.674 4.279) 7.042 9.148 ( -1.578 3.538 -2.275) 4.492 9.148 ( 1.578 3.538 2.275) 4.492 10.099 ( 1.128 -3.365 -1.756) 3.960 10.099 ( -1.128 -3.365 1.756) 3.960 10.329 ( 7.713 -3.992 -13.318) 15.900 10.329 ( -7.713 -3.992 13.318) 15.900 10.793 ( 4.617 -5.328 -8.242) 10.846 10.793 ( -4.617 -5.328 8.242) 10.846 10.999 ( -3.636 -0.837 -2.921) 4.739 10.999 ( 3.636 -0.837 2.921) 4.739 11.134 ( -1.913 0.706 -5.059) 5.454 11.134 ( 1.913 0.707 5.059) 5.454 11.759 ( -3.649 -0.257 0.001) 3.658 11.759 ( 3.649 -0.257 -0.001) 3.658 12.058 ( 2.060 1.969 -5.575) 6.261 12.058 ( -2.060 1.969 5.575) 6.261 12.699 ( -6.707 -0.504 -5.277) 8.549 12.699 ( 6.707 -0.504 5.277) 8.549 13.240 ( -5.279 -7.694 -6.464) 11.351 13.240 ( 5.279 -7.694 6.464) 11.351 13.633 ( -4.231 2.045 -2.263) 5.216 13.633 ( 4.231 2.045 2.263) 5.216 14.047 ( 1.766 -1.948 -2.722) 3.785 14.047 ( -1.766 -1.948 2.722) 3.785 14.843 ( 2.956 4.008 -5.736) 7.596 14.843 ( -2.956 4.008 5.736) 7.596 15.077 ( -3.913 7.505 -7.000) 10.983 15.077 ( 3.913 7.505 7.000) 10.983 16.226 ( 1.344 -1.029 -6.031) 6.264 16.226 ( -1.344 -1.029 6.031) 6.264 16.777 ( 1.354 -0.865 -10.254) 10.379 16.777 ( -1.354 -0.865 10.254) 10.379 20.041 ( 2.252 2.411 -3.402) 4.739 20.041 ( -2.252 2.411 3.402) 4.739 20.584 ( 1.522 -4.526 -10.883) 11.884 20.584 ( -1.522 -4.526 10.883) 11.884 21.999 ( 1.306 -6.847 -7.217) 10.034 21.999 ( -1.306 -6.847 7.217) 10.034 22.394 ( -1.210 -1.345 0.113) 1.812 22.394 ( 1.210 -1.345 -0.113) 1.812 22.669 ( -1.596 -2.611 -2.152) 3.741 22.669 ( 1.596 -2.611 2.152) 3.741 23.585 ( -1.001 6.747 -1.876) 7.074 23.585 ( 1.001 6.747 1.876) 7.074 24.183 ( 1.099 0.993 -7.988) 8.124 24.183 ( -1.099 0.993 7.988) 8.124 24.566 ( 0.199 5.113 -3.733) 6.334 24.566 ( -0.199 5.113 3.733) 6.334 ======================= Grid point 191 (97/104) ======================= q-point: ( 0.00 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.782 ( -4.037 9.111 -6.417) 11.853 1.782 ( 4.037 9.111 6.417) 11.853 2.244 ( 2.046 9.243 -16.136) 18.708 2.244 ( -2.046 9.243 16.136) 18.708 2.694 ( -1.184 0.702 -3.597) 3.852 2.694 ( 1.184 0.702 3.597) 3.852 2.825 ( 2.300 -0.694 -2.744) 3.647 2.825 ( -2.300 -0.694 2.744) 3.647 3.137 ( -6.339 2.932 -2.967) 7.588 3.137 ( 6.339 2.932 2.967) 7.588 3.222 ( -0.338 2.326 -3.911) 4.563 3.222 ( 0.338 2.326 3.911) 4.563 3.415 ( -0.921 -1.636 -5.169) 5.499 3.415 ( 0.921 -1.636 5.169) 5.499 3.812 ( -3.865 4.909 -6.248) 8.836 3.812 ( 3.865 4.909 6.248) 8.836 4.023 ( 1.362 4.869 -5.383) 7.385 4.023 ( -1.362 4.869 5.383) 7.385 4.251 ( -3.634 0.954 -3.650) 5.238 4.251 ( 3.634 0.954 3.650) 5.238 4.674 ( -9.188 5.218 -1.782) 10.716 4.674 ( 9.188 5.218 1.782) 10.716 4.820 ( -0.052 5.357 -2.938) 6.110 4.820 ( 0.052 5.357 2.938) 6.110 5.106 ( 0.643 1.577 -3.013) 3.461 5.106 ( -0.643 1.577 3.013) 3.461 5.161 ( -12.188 7.290 -1.153) 14.248 5.161 ( 12.188 7.290 1.153) 14.248 5.478 ( -1.025 -3.805 -3.687) 5.397 5.478 ( 1.025 -3.805 3.687) 5.397 5.758 ( 0.413 -7.117 -4.362) 8.358 5.758 ( -0.413 -7.117 4.362) 8.358 6.361 ( -2.103 1.019 -1.246) 2.649 6.361 ( 2.103 1.019 1.246) 2.649 6.577 ( -0.271 0.306 -3.510) 3.533 6.577 ( 0.271 0.306 3.510) 3.533 6.892 ( 0.250 -3.023 -0.910) 3.167 6.892 ( -0.250 -3.023 0.910) 3.167 7.151 ( -0.672 -4.137 -4.152) 5.900 7.151 ( 0.672 -4.137 4.152) 5.900 7.903 ( -1.948 7.471 -2.084) 7.997 7.903 ( 1.948 7.471 2.084) 7.997 8.227 ( -4.182 -1.707 -2.856) 5.344 8.227 ( 4.182 -1.707 2.856) 5.344 8.495 ( -1.168 2.044 -2.280) 3.277 8.495 ( 1.168 2.044 2.280) 3.277 8.883 ( 1.215 -4.825 -2.021) 5.371 8.883 ( -1.215 -4.825 2.021) 5.371 9.365 ( -0.251 2.899 -0.765) 3.009 9.365 ( 0.251 2.899 0.765) 3.009 9.733 ( 1.129 -6.488 -7.102) 9.685 9.733 ( -1.129 -6.488 7.102) 9.685 10.389 ( 1.919 -2.534 -5.420) 6.283 10.389 ( -1.919 -2.534 5.420) 6.283 10.653 ( -2.691 -3.218 -3.680) 5.580 10.653 ( 2.691 -3.218 3.680) 5.580 11.039 ( 1.838 -0.359 -4.463) 4.840 11.039 ( -1.838 -0.359 4.463) 4.840 11.194 ( 6.620 -3.952 -4.762) 9.062 11.194 ( -6.620 -3.952 4.762) 9.062 11.925 ( -12.816 1.887 -8.217) 15.341 11.925 ( 12.816 1.887 8.217) 15.341 12.159 ( -0.456 -1.186 -6.921) 7.037 12.159 ( 0.456 -1.186 6.921) 7.037 12.634 ( -9.286 2.665 -3.288) 10.205 12.634 ( 9.286 2.665 3.288) 10.205 12.991 ( 0.269 -2.537 -0.845) 2.687 12.991 ( -0.269 -2.537 0.845) 2.687 13.611 ( -1.185 -3.110 -0.030) 3.328 13.611 ( 1.185 -3.110 0.030) 3.328 13.835 ( -1.524 -2.280 -1.276) 3.025 13.835 ( 1.524 -2.280 1.276) 3.025 14.861 ( -1.978 5.932 -7.121) 9.477 14.861 ( 1.978 5.932 7.121) 9.477 15.331 ( 2.704 6.106 -5.418) 8.600 15.331 ( -2.704 6.106 5.418) 8.600 16.288 ( -0.249 0.861 -5.045) 5.124 16.288 ( 0.249 0.861 5.045) 5.124 16.666 ( 1.461 -3.273 -8.430) 9.161 16.666 ( -1.461 -3.273 8.430) 9.161 20.114 ( -0.564 3.165 -5.023) 5.964 20.114 ( 0.564 3.165 5.023) 5.964 20.491 ( 1.019 -3.302 -7.810) 8.540 20.491 ( -1.019 -3.302 7.810) 8.540 21.814 ( -0.915 -7.998 -2.428) 8.408 21.814 ( 0.915 -7.998 2.428) 8.408 22.245 ( -0.042 -7.184 -1.339) 7.308 22.245 ( 0.042 -7.184 1.339) 7.308 22.789 ( 0.420 4.868 -5.966) 7.711 22.789 ( -0.420 4.868 5.966) 7.711 23.669 ( -0.748 3.704 -1.626) 4.114 23.669 ( 0.748 3.704 1.626) 4.114 24.221 ( 0.845 0.991 -5.460) 5.613 24.221 ( -0.845 0.991 5.460) 5.613 24.728 ( -0.287 5.878 -2.763) 6.501 24.728 ( 0.287 5.878 2.763) 6.501 ======================= Grid point 193 (98/104) ======================= q-point: ( 0.17 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.726 ( 0.661 8.136 -9.029) 12.172 1.889 ( 5.616 7.021 3.797) 9.760 2.233 ( 0.307 7.896 0.407) 7.912 2.314 ( 4.841 8.689 2.029) 10.151 2.623 ( -4.484 -2.076 2.609) 5.588 2.688 ( -9.324 4.045 2.081) 10.375 2.773 ( 3.116 2.853 3.169) 5.281 2.823 ( -2.478 -0.197 -2.448) 3.489 3.056 ( -1.123 3.511 -5.351) 6.498 3.125 ( -7.644 6.339 -0.152) 9.932 3.179 ( -2.407 4.202 -1.444) 5.053 3.265 ( 1.866 3.011 4.138) 5.447 3.370 ( -1.803 -2.963 0.569) 3.515 3.446 ( -0.140 -7.560 0.420) 7.573 3.727 ( -1.174 2.842 -4.458) 5.416 3.917 ( 3.684 1.333 -3.996) 5.596 4.014 ( -2.629 5.250 8.918) 10.677 4.047 ( 1.386 4.670 4.091) 6.361 4.161 ( -0.495 3.631 -2.216) 4.283 4.329 ( 1.422 2.470 0.563) 2.905 4.446 ( -13.507 3.537 -3.677) 14.439 4.784 ( 3.340 3.786 -1.638) 5.308 4.823 ( -5.027 4.702 1.541) 7.054 4.830 ( 3.154 5.999 0.790) 6.824 4.969 ( -2.546 9.318 -3.009) 10.118 5.097 ( -0.941 0.569 -1.028) 1.505 5.154 ( 3.565 2.242 0.092) 4.212 5.311 ( 3.539 4.144 -1.258) 5.593 5.474 ( 0.774 -0.559 -2.062) 2.272 5.511 ( -1.146 0.458 3.788) 3.984 5.764 ( 6.091 -10.142 -0.494) 11.840 5.836 ( 3.771 -6.732 0.275) 7.721 6.342 ( 0.737 2.171 0.167) 2.298 6.430 ( 4.316 -0.749 0.816) 4.456 6.568 ( 1.080 -1.932 1.070) 2.458 6.620 ( 3.024 2.225 1.155) 3.928 6.804 ( -4.824 -3.020 1.399) 5.861 6.931 ( -0.318 -2.992 -3.050) 4.285 7.082 ( -2.599 -3.476 1.859) 4.722 7.208 ( 1.057 -2.772 -1.311) 3.243 7.797 ( -6.203 7.286 0.323) 9.574 7.876 ( -5.664 7.277 -1.144) 9.292 8.213 ( 3.425 -3.885 1.892) 5.514 8.347 ( 5.908 1.429 -0.790) 6.130 8.494 ( 1.068 2.057 -0.324) 2.340 8.565 ( 5.132 0.063 5.839) 7.774 8.772 ( -6.520 -4.089 1.193) 7.788 8.920 ( -0.684 -5.194 -1.944) 5.588 9.305 ( -4.928 2.517 2.174) 5.945 9.355 ( -1.546 4.953 -1.001) 5.285 9.742 ( 3.861 -6.779 -2.426) 8.170 9.829 ( 6.812 -9.113 -2.296) 11.607 10.260 ( -5.678 -0.545 1.489) 5.895 10.505 ( 4.625 -2.579 -4.883) 7.203 10.587 ( -3.424 -2.223 -1.102) 4.229 10.710 ( 1.831 -5.189 6.408) 8.446 10.975 ( -4.970 -1.162 5.083) 7.204 11.030 ( -3.108 -1.161 5.797) 6.679 11.135 ( 3.491 -1.030 -2.571) 4.456 11.406 ( 12.478 -4.466 -6.665) 14.834 11.586 ( -17.977 4.053 -9.406) 20.690 11.966 ( -5.712 -3.183 -5.745) 8.704 12.147 ( -1.392 1.477 5.817) 6.161 12.303 ( 6.591 2.251 6.030) 9.213 12.444 ( -7.324 0.422 0.134) 7.338 12.816 ( 9.049 2.603 3.258) 9.964 12.948 ( -3.441 -2.608 -2.439) 4.959 13.007 ( 1.456 -6.286 -2.936) 7.089 13.577 ( -0.719 -1.508 0.910) 1.903 13.658 ( 2.491 -2.923 -1.284) 4.050 13.866 ( 4.551 -1.190 1.027) 4.815 13.913 ( 4.871 -2.579 2.971) 6.261 14.840 ( 1.538 6.651 -6.884) 9.695 14.944 ( 4.920 4.941 7.184) 10.012 15.242 ( -6.363 6.804 2.284) 9.592 15.356 ( 0.353 5.731 -6.435) 8.624 16.255 ( -1.753 1.196 -3.572) 4.155 16.284 ( -2.013 0.184 4.763) 5.174 16.671 ( 1.272 -2.799 2.859) 4.199 16.704 ( 2.915 -2.981 -3.417) 5.391 20.092 ( -0.243 3.728 -4.415) 5.783 20.133 ( -0.061 2.668 4.688) 5.394 20.463 ( -1.345 -2.964 1.083) 3.430 20.510 ( 0.506 -4.495 -0.901) 4.612 21.794 ( 0.132 -6.718 -0.729) 6.759 21.858 ( 2.237 -8.230 0.444) 8.540 22.234 ( -0.618 -8.213 -0.823) 8.277 22.247 ( -0.232 -7.286 0.824) 7.336 22.771 ( -0.698 5.068 -5.433) 7.463 22.782 ( -1.796 4.978 5.432) 7.584 23.662 ( 0.473 4.201 -0.472) 4.254 23.693 ( 1.210 3.466 1.509) 3.969 24.213 ( -0.708 1.095 2.178) 2.539 24.224 ( 0.298 1.049 -2.611) 2.830 24.706 ( -1.043 6.278 -2.452) 6.821 24.732 ( -0.713 5.516 1.683) 5.811 ======================= Grid point 194 (99/104) ======================= q-point: ( 0.33 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.779 ( 7.871 4.957 -10.206) 13.809 1.989 ( 3.714 2.523 2.641) 5.209 2.228 ( -1.906 5.514 0.718) 5.878 2.325 ( -9.429 5.381 2.996) 11.262 2.524 ( 1.289 4.055 8.334) 9.357 2.639 ( 1.247 0.519 -3.387) 3.647 2.777 ( -0.928 6.060 -0.008) 6.131 2.830 ( 1.511 3.973 1.889) 4.652 2.983 ( -4.986 10.194 -4.025) 12.041 3.043 ( 0.690 3.226 -4.529) 5.603 3.130 ( -5.936 5.523 1.161) 8.191 3.176 ( -6.908 5.626 6.683) 11.137 3.397 ( 1.965 -6.738 -2.342) 7.399 3.422 ( -2.015 -10.950 1.297) 11.209 3.734 ( 2.122 2.709 -2.608) 4.317 3.872 ( -5.372 0.632 -5.785) 7.920 4.010 ( 1.405 2.020 3.884) 4.598 4.085 ( 0.211 2.688 9.168) 9.556 4.194 ( -0.579 6.388 -3.164) 7.152 4.255 ( -2.175 -1.030 -5.827) 6.305 4.347 ( 1.919 6.927 3.637) 8.056 4.653 ( -10.273 4.025 -2.287) 11.268 4.858 ( 4.578 6.294 -1.502) 7.926 4.894 ( 3.821 4.053 3.783) 6.733 4.988 ( -0.243 8.922 0.807) 8.962 5.054 ( -2.405 0.934 -3.714) 4.523 5.234 ( 5.264 2.079 0.467) 5.679 5.349 ( 1.186 3.937 1.537) 4.390 5.460 ( -3.177 2.073 0.750) 3.867 5.475 ( -0.775 -1.497 -3.647) 4.017 5.870 ( 3.585 -5.608 -4.637) 8.112 5.890 ( 1.583 -8.423 3.885) 9.410 6.395 ( 4.517 1.275 1.509) 4.931 6.490 ( 1.430 -1.546 0.471) 2.159 6.632 ( 4.620 -3.040 0.272) 5.537 6.681 ( 1.265 -2.841 0.409) 3.136 6.765 ( 2.369 2.306 4.703) 5.749 6.885 ( -2.163 -1.346 -3.813) 4.585 7.054 ( -1.887 -2.721 2.450) 4.119 7.164 ( -5.134 -1.030 -3.250) 6.163 7.709 ( -3.102 7.700 1.030) 8.365 7.763 ( -5.216 7.236 -1.041) 8.980 8.303 ( 4.957 -4.512 2.541) 7.169 8.417 ( 1.521 -0.435 -0.828) 1.786 8.528 ( 2.645 1.288 0.434) 2.974 8.649 ( -2.486 -2.960 0.067) 3.866 8.700 ( 2.692 -1.898 6.305) 7.114 8.865 ( -3.802 -4.182 -3.549) 6.674 9.239 ( -2.158 4.555 3.724) 6.267 9.310 ( -2.810 5.942 -2.708) 7.108 9.833 ( 6.051 -9.476 -3.600) 11.806 9.930 ( 3.055 -12.585 0.225) 12.953 10.220 ( 2.179 2.995 -1.424) 3.968 10.462 ( -7.106 1.007 3.177) 7.848 10.595 ( 3.969 -4.099 -6.079) 8.337 10.729 ( -2.247 -7.332 7.555) 10.765 10.922 ( -0.600 -0.686 3.000) 3.135 11.038 ( 0.625 -1.100 8.774) 8.865 11.178 ( 1.031 0.674 -5.536) 5.671 11.245 ( -13.327 0.822 -11.585) 17.677 11.622 ( 10.006 -0.557 -2.232) 10.267 11.834 ( -5.601 -2.556 -4.321) 7.522 12.114 ( -2.100 3.675 2.525) 4.929 12.237 ( -7.515 6.344 1.297) 9.920 12.505 ( 6.351 -5.397 6.224) 10.402 12.814 ( -8.118 -3.990 -5.688) 10.686 12.989 ( 6.999 -3.030 4.306) 8.758 13.057 ( 3.222 -6.957 -1.974) 7.917 13.598 ( 2.502 0.665 2.045) 3.299 13.685 ( 0.552 -1.526 -2.247) 2.771 13.960 ( 4.440 -0.963 0.247) 4.550 13.994 ( 2.554 -2.060 3.187) 4.574 14.881 ( 4.423 7.142 -5.755) 10.183 15.046 ( 1.243 4.909 5.467) 7.452 15.141 ( -2.291 6.987 4.262) 8.499 15.316 ( -2.724 5.482 -8.072) 10.131 16.220 ( -0.767 1.094 -3.118) 3.392 16.248 ( -2.692 0.074 4.231) 5.015 16.712 ( 1.925 -2.232 3.399) 4.499 16.741 ( 1.762 -2.451 -3.836) 4.881 20.088 ( 0.960 3.822 -4.154) 5.725 20.129 ( -1.470 2.836 4.326) 5.377 20.455 ( 0.156 -3.850 2.149) 4.412 20.503 ( -0.861 -5.339 -1.921) 5.739 21.816 ( 2.194 -5.646 0.087) 6.058 21.884 ( 0.195 -6.969 -0.392) 6.982 22.224 ( -0.021 -9.741 -0.991) 9.791 22.241 ( -0.649 -8.528 1.102) 8.624 22.746 ( -0.474 5.483 -4.784) 7.293 22.756 ( -2.096 5.352 4.708) 7.430 23.681 ( 1.363 4.453 0.538) 4.688 23.712 ( 0.338 3.701 0.563) 3.759 24.208 ( -0.460 1.279 2.754) 3.071 24.219 ( -0.020 1.261 -3.263) 3.498 24.687 ( -0.138 6.261 -2.523) 6.752 24.714 ( -1.556 5.505 1.792) 5.995 ======================= Grid point 195 (100/104) ======================= q-point: (-0.50 0.29 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 91 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.948 ( 10.701 0.644 -7.575) 13.126 1.948 ( -10.701 0.644 7.575) 13.126 2.196 ( -1.449 6.007 -4.801) 7.825 2.196 ( 1.449 6.007 4.801) 7.825 2.616 ( -2.642 1.728 -8.155) 8.744 2.616 ( 2.642 1.728 8.155) 8.744 2.809 ( -3.354 6.640 -0.723) 7.474 2.809 ( 3.354 6.640 0.723) 7.474 2.982 ( 5.904 8.981 -8.063) 13.436 2.982 ( -5.904 8.981 8.063) 13.436 3.094 ( -1.331 4.376 -2.263) 5.104 3.094 ( 1.331 4.376 2.263) 5.104 3.405 ( 0.342 -8.923 -2.831) 9.367 3.405 ( -0.342 -8.923 2.831) 9.367 3.781 ( 0.322 2.022 -7.687) 7.955 3.781 ( -0.322 2.022 7.687) 7.955 4.058 ( 1.006 0.205 -5.562) 5.656 4.058 ( -1.006 0.205 5.562) 5.656 4.209 ( -1.306 4.686 -4.533) 6.649 4.209 ( 1.306 4.686 4.533) 6.649 4.467 ( -8.022 4.127 -2.924) 9.484 4.467 ( 8.022 4.127 2.924) 9.484 4.933 ( 4.234 4.636 -2.133) 6.631 4.933 ( -4.234 4.636 2.133) 6.631 4.990 ( -3.373 5.646 -5.741) 8.730 4.990 ( 3.373 5.646 5.741) 8.730 5.333 ( 3.855 3.778 -1.802) 5.690 5.333 ( -3.855 3.778 1.802) 5.690 5.439 ( -0.149 -0.638 -1.510) 1.646 5.439 ( 0.149 -0.638 1.510) 1.646 5.899 ( 1.132 -6.015 -4.728) 7.734 5.899 ( -1.132 -6.015 4.728) 7.734 6.477 ( -1.423 -0.818 -3.272) 3.661 6.477 ( 1.423 -0.818 3.272) 3.661 6.678 ( 0.963 -4.774 -3.189) 5.822 6.678 ( -0.963 -4.774 3.189) 5.821 6.857 ( -1.814 3.434 -5.566) 6.787 6.857 ( 1.814 3.434 5.566) 6.787 7.052 ( -3.416 -2.219 -2.476) 4.767 7.052 ( 3.416 -2.219 2.476) 4.767 7.697 ( -1.140 7.754 -1.386) 7.959 7.697 ( 1.140 7.754 1.386) 7.959 8.392 ( -3.141 -3.800 -0.931) 5.017 8.392 ( 3.141 -3.800 0.931) 5.017 8.583 ( -2.446 -1.109 -2.386) 3.592 8.583 ( 2.446 -1.109 2.386) 3.592 8.785 ( -3.324 -2.525 -6.827) 8.002 8.785 ( 3.324 -2.525 6.827) 8.002 9.251 ( -1.565 5.926 -4.750) 7.755 9.251 ( 1.565 5.926 4.750) 7.755 9.921 ( 1.907 -11.947 -3.946) 12.726 9.921 ( -1.907 -11.947 3.946) 12.726 10.323 ( 4.160 2.974 -3.960) 6.468 10.323 ( -4.160 2.974 3.960) 6.468 10.668 ( 3.853 -6.143 -8.881) 11.465 10.668 ( -3.853 -6.143 8.881) 11.465 10.982 ( -5.887 -0.220 -3.880) 7.054 10.982 ( 5.887 -0.220 3.880) 7.054 11.148 ( -1.618 0.306 -6.270) 6.483 11.148 ( 1.618 0.306 6.270) 6.483 11.750 ( -3.753 -0.659 -0.754) 3.884 11.750 ( 3.753 -0.659 0.754) 3.884 12.127 ( 0.776 4.619 -7.496) 8.839 12.127 ( -0.776 4.619 7.496) 8.839 12.648 ( -7.634 -5.045 -6.174) 11.038 12.648 ( 7.634 -5.045 6.174) 11.038 13.075 ( -1.075 -6.438 -3.154) 7.250 13.075 ( 1.075 -6.438 3.154) 7.250 13.658 ( -2.295 0.486 -3.399) 4.130 13.658 ( 2.295 0.486 3.399) 4.130 14.012 ( 1.182 -1.473 -1.805) 2.612 14.012 ( -1.182 -1.473 1.805) 2.612 14.970 ( 2.334 7.252 -8.745) 11.598 14.970 ( -2.334 7.252 8.745) 11.598 15.223 ( -4.845 5.185 -8.404) 10.999 15.223 ( 4.845 5.185 8.404) 10.999 16.218 ( 1.292 0.611 -6.390) 6.548 16.218 ( -1.292 0.611 6.390) 6.548 16.745 ( 0.782 -2.137 -9.020) 9.302 16.745 ( -0.782 -2.137 9.020) 9.302 20.106 ( 1.895 3.417 -4.083) 5.651 20.106 ( -1.895 3.417 4.083) 5.651 20.476 ( 0.480 -5.021 -8.124) 9.563 20.476 ( -0.480 -5.021 8.124) 9.563 21.862 ( -0.143 -5.677 -4.371) 7.166 21.862 ( 0.143 -5.677 4.371) 7.166 22.229 ( 0.673 -9.950 -3.986) 10.740 22.229 ( -0.673 -9.950 3.986) 10.740 22.738 ( 0.909 5.665 -4.410) 7.236 22.738 ( -0.909 5.665 4.410) 7.236 23.706 ( -0.920 4.193 -0.497) 4.322 23.706 ( 0.920 4.193 0.497) 4.322 24.211 ( 0.448 1.388 -5.259) 5.458 24.211 ( -0.448 1.388 5.259) 5.458 24.691 ( 1.054 5.849 -2.498) 6.446 24.691 ( -1.054 5.849 2.498) 6.446 ======================= Grid point 199 (101/104) ======================= q-point: ( 0.00 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.947 ( -2.383 5.028 -2.536) 6.115 1.947 ( 2.383 5.028 2.536) 6.115 2.435 ( 3.340 7.068 -9.701) 12.459 2.435 ( -3.340 7.068 9.701) 12.459 2.641 ( 1.992 -3.396 -3.311) 5.144 2.641 ( -1.992 -3.396 3.311) 5.144 2.836 ( 1.410 -0.223 -4.319) 4.549 2.836 ( -1.410 -0.223 4.319) 4.549 3.100 ( -1.783 -1.728 -1.153) 2.737 3.100 ( 1.783 -1.728 1.153) 2.737 3.240 ( -1.347 -0.604 -1.426) 2.052 3.240 ( 1.347 -0.604 1.426) 2.052 3.430 ( -1.193 1.001 -3.425) 3.763 3.430 ( 1.193 1.001 3.425) 3.763 3.907 ( -0.202 2.605 -2.636) 3.712 3.907 ( 0.202 2.605 2.636) 3.712 4.111 ( -0.068 1.938 -0.377) 1.976 4.111 ( 0.068 1.938 0.377) 1.976 4.330 ( -5.047 5.114 -1.754) 7.396 4.330 ( 5.047 5.114 1.754) 7.396 4.726 ( -4.057 1.062 -1.168) 4.353 4.726 ( 4.057 1.062 1.168) 4.353 4.938 ( -0.827 2.617 -2.929) 4.014 4.938 ( 0.827 2.617 2.929) 4.014 5.154 ( 2.210 5.371 -5.551) 8.034 5.154 ( -2.210 5.371 5.551) 8.034 5.270 ( -4.442 1.034 -1.950) 4.960 5.270 ( 4.442 1.034 1.950) 4.960 5.364 ( -0.401 -6.734 -4.785) 8.271 5.364 ( 0.401 -6.734 4.785) 8.271 5.649 ( -1.846 -1.749 -0.715) 2.642 5.649 ( 1.846 -1.749 0.715) 2.642 6.392 ( 0.506 1.262 -1.767) 2.230 6.392 ( -0.506 1.262 1.767) 2.230 6.582 ( -0.205 -0.044 -1.017) 1.038 6.582 ( 0.205 -0.044 1.017) 1.038 6.869 ( -1.093 1.097 -1.354) 2.057 6.869 ( 1.093 1.097 1.354) 2.057 7.036 ( -1.838 -5.188 -2.022) 5.863 7.036 ( 1.838 -5.188 2.022) 5.863 8.045 ( -5.539 5.966 -5.175) 9.647 8.045 ( 5.539 5.966 5.175) 9.647 8.161 ( -6.102 -4.593 -6.874) 10.275 8.161 ( 6.102 -4.593 6.874) 10.275 8.580 ( -0.051 5.265 -1.191) 5.398 8.580 ( 0.051 5.265 1.191) 5.398 8.756 ( -0.470 -6.111 -0.254) 6.134 8.756 ( 0.470 -6.111 0.254) 6.134 9.442 ( -0.990 3.620 -2.854) 4.715 9.442 ( 0.990 3.620 2.854) 4.715 9.609 ( -0.803 -4.603 -5.493) 7.212 9.609 ( 0.803 -4.603 5.493) 7.212 10.367 ( 0.483 0.026 -3.106) 3.143 10.367 ( -0.483 0.026 3.106) 3.143 10.583 ( -1.084 -2.412 -2.520) 3.653 10.583 ( 1.084 -2.412 2.520) 3.653 11.051 ( 1.531 1.606 -5.320) 5.764 11.051 ( -1.531 1.606 5.320) 5.764 11.109 ( 2.789 -3.657 -5.527) 7.190 11.109 ( -2.789 -3.657 5.527) 7.190 11.962 ( -6.059 1.350 -4.954) 7.942 11.962 ( 6.059 1.350 4.954) 7.942 12.114 ( -0.357 -1.956 -4.558) 4.973 12.114 ( 0.357 -1.956 4.558) 4.973 12.708 ( -4.777 2.989 -2.130) 6.024 12.708 ( 4.777 2.989 2.130) 6.024 12.944 ( -0.705 -1.778 -1.074) 2.193 12.944 ( 0.705 -1.778 1.074) 2.193 13.559 ( -1.151 -1.345 0.117) 1.774 13.559 ( 1.151 -1.345 -0.117) 1.774 13.798 ( -0.558 -1.036 -0.408) 1.245 13.798 ( 0.558 -1.036 0.408) 1.245 14.951 ( -0.774 2.242 -2.801) 3.670 14.951 ( 0.774 2.242 2.801) 3.670 15.437 ( 1.104 3.072 -2.137) 3.901 15.437 ( -1.104 3.072 2.137) 3.901 16.309 ( 0.089 0.824 -2.656) 2.782 16.309 ( -0.089 0.824 2.656) 2.782 16.601 ( 0.857 -2.152 -3.841) 4.486 16.601 ( -0.857 -2.152 3.841) 4.486 20.181 ( -0.001 2.456 -3.508) 4.282 20.181 ( 0.001 2.456 3.508) 4.282 20.419 ( 0.621 -2.677 -4.463) 5.242 20.419 ( -0.621 -2.677 4.463) 5.242 21.700 ( -0.571 -2.678 -0.611) 2.806 21.700 ( 0.571 -2.678 0.611) 2.806 22.130 ( -0.236 -3.005 -0.310) 3.030 22.130 ( 0.236 -3.005 0.310) 3.030 22.865 ( 0.077 1.932 -2.211) 2.937 22.865 ( -0.077 1.932 2.211) 2.937 23.721 ( -0.250 1.247 -0.747) 1.474 23.721 ( 0.250 1.247 0.747) 1.474 24.236 ( 0.338 0.395 -1.908) 1.977 24.236 ( -0.338 0.395 1.908) 1.977 24.820 ( -0.167 2.354 -0.870) 2.515 24.820 ( 0.167 2.354 0.870) 2.515 ======================= Grid point 201 (102/104) ======================= q-point: ( 0.17 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.898 ( -1.245 7.057 -4.617) 8.524 1.980 ( 0.773 0.278 0.195) 0.844 2.392 ( -3.253 8.154 8.444) 12.181 2.517 ( 6.211 6.221 -4.299) 9.786 2.587 ( -6.781 -3.909 7.094) 10.563 2.618 ( -1.664 -3.096 0.732) 3.590 2.848 ( 3.353 2.987 -0.199) 4.495 2.888 ( 3.002 3.379 -2.100) 4.984 3.045 ( -2.888 -2.088 -3.753) 5.175 3.107 ( -0.873 -4.053 -0.279) 4.155 3.197 ( -1.963 -0.138 -0.778) 2.116 3.247 ( -1.782 -5.328 -2.197) 6.032 3.390 ( -2.109 4.802 4.451) 6.879 3.442 ( -2.874 0.944 5.060) 5.895 3.834 ( -3.620 6.012 -2.874) 7.584 3.915 ( -1.222 -1.599 -3.505) 4.042 4.096 ( -1.679 3.084 0.038) 3.511 4.136 ( 1.243 0.697 1.330) 1.949 4.220 ( -3.852 5.130 0.683) 6.451 4.336 ( -5.263 -3.424 -0.304) 6.287 4.596 ( -5.221 9.932 1.138) 11.278 4.793 ( 1.367 -6.358 -2.208) 6.868 4.903 ( -2.731 4.212 -2.747) 5.723 4.941 ( 0.184 2.546 2.310) 3.442 5.155 ( 0.755 8.710 3.086) 9.272 5.183 ( -2.238 7.681 -6.990) 10.623 5.234 ( 6.669 5.401 -3.386) 9.225 5.307 ( -0.498 -2.252 -3.566) 4.247 5.365 ( 1.971 -7.584 2.079) 8.107 5.494 ( 6.459 -14.381 -0.341) 15.769 5.636 ( 3.107 6.681 3.454) 8.138 5.736 ( 4.634 -3.170 2.159) 6.016 6.402 ( 1.560 2.488 1.278) 3.203 6.425 ( 3.347 0.032 -0.777) 3.436 6.545 ( -1.636 0.742 2.101) 2.765 6.604 ( -0.135 -3.558 0.566) 3.605 6.815 ( -1.501 3.298 -0.477) 3.655 6.877 ( -1.493 -2.317 -2.507) 3.726 7.019 ( 0.561 -0.349 2.402) 2.492 7.101 ( 2.343 -6.219 0.830) 6.698 7.926 ( -5.360 5.294 -2.293) 7.875 8.004 ( -6.665 0.684 -2.605) 7.188 8.165 ( 4.259 2.968 5.248) 7.381 8.298 ( 4.635 -5.902 5.375) 9.230 8.579 ( 0.715 2.966 0.125) 3.054 8.601 ( 1.161 3.667 0.889) 3.948 8.685 ( -3.484 -1.557 -0.248) 3.824 8.788 ( 0.282 -6.942 -1.995) 7.228 9.384 ( -2.924 4.836 -1.400) 5.822 9.446 ( -0.580 1.902 -2.347) 3.076 9.609 ( 1.437 -3.951 -2.861) 5.085 9.656 ( 1.924 -6.480 5.235) 8.550 10.315 ( -1.047 5.208 -0.935) 5.394 10.437 ( 3.919 -4.965 -4.018) 7.494 10.548 ( -2.371 -0.029 -0.196) 2.380 10.598 ( -0.475 -4.409 4.123) 6.055 10.969 ( -4.332 0.450 4.398) 6.190 10.993 ( -3.177 -1.779 4.509) 5.796 11.169 ( 6.406 3.816 -3.603) 8.281 11.279 ( 8.329 -6.181 -6.995) 12.510 11.721 ( -11.956 7.279 -7.695) 15.973 11.868 ( -8.205 -6.097 -7.511) 12.685 12.182 ( 1.910 2.160 8.545) 9.018 12.248 ( 6.713 -4.122 8.456) 11.556 12.571 ( -8.293 8.896 -1.570) 12.263 12.761 ( -2.052 -8.078 -0.725) 8.366 12.918 ( 0.414 1.571 -1.505) 2.215 12.952 ( 0.886 -1.321 -0.665) 1.724 13.566 ( 1.921 0.650 0.048) 2.028 13.599 ( 2.971 -2.332 -0.451) 3.804 13.850 ( 5.010 -0.227 1.920) 5.370 13.864 ( 5.055 -1.666 2.684) 5.961 14.959 ( 2.266 4.052 -2.121) 5.104 15.001 ( 3.678 0.277 3.159) 4.856 15.381 ( -4.265 5.301 -1.180) 6.905 15.433 ( -1.360 0.800 -4.576) 4.840 16.286 ( -1.761 1.228 -0.655) 2.244 16.292 ( -2.288 0.424 4.319) 4.906 16.622 ( 2.275 -1.224 1.456) 2.966 16.638 ( 3.255 -2.598 -3.223) 5.266 20.170 ( -0.098 3.002 -3.249) 4.425 20.186 ( -0.389 1.672 3.028) 3.481 20.405 ( -0.984 -1.918 0.621) 2.243 20.419 ( -0.310 -3.287 -1.017) 3.455 21.705 ( 1.209 -1.576 0.258) 2.003 21.728 ( 1.983 -3.727 0.898) 4.316 22.113 ( -1.462 -2.790 -0.667) 3.220 22.123 ( -1.072 -3.612 -0.137) 3.770 22.852 ( -0.788 2.356 -1.464) 2.883 22.860 ( -0.968 1.748 1.754) 2.659 23.726 ( 0.803 1.775 0.151) 1.954 23.737 ( 1.036 0.726 1.112) 1.685 24.233 ( -0.287 0.666 0.952) 1.197 24.238 ( 0.198 0.218 -1.327) 1.359 24.807 ( -0.874 2.794 -1.208) 3.166 24.815 ( -0.803 1.958 0.540) 2.184 ======================= Grid point 202 (103/104) ======================= q-point: ( 0.33 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.902 ( 3.423 5.729 -5.872) 8.890 1.991 ( 0.929 -2.271 -1.005) 2.651 2.329 ( -5.746 4.770 7.739) 10.754 2.407 ( -11.365 -0.928 4.940) 12.427 2.632 ( 6.295 5.387 -0.992) 8.344 2.661 ( 4.111 2.186 2.427) 5.251 2.894 ( -0.115 2.956 3.772) 4.794 2.927 ( 1.799 6.857 -3.710) 8.001 2.991 ( -1.191 -3.518 -5.104) 6.312 3.106 ( 1.982 -0.990 -1.021) 2.440 3.152 ( -4.727 -3.943 -3.808) 7.238 3.206 ( 1.471 -6.822 -1.270) 7.094 3.324 ( -8.332 5.283 6.577) 11.857 3.363 ( -4.625 1.980 3.853) 6.337 3.799 ( 0.150 3.816 -0.532) 3.856 3.862 ( -2.656 -1.598 -4.240) 5.252 4.066 ( -0.303 3.287 -3.045) 4.491 4.126 ( -3.475 -0.084 4.855) 5.971 4.201 ( 0.764 -0.873 -2.133) 2.428 4.239 ( -3.110 -2.093 2.614) 4.570 4.569 ( 1.433 12.537 1.309) 12.686 4.752 ( -4.885 1.485 -4.140) 6.574 4.875 ( 1.219 -2.249 -1.651) 3.045 4.947 ( -0.638 -2.846 0.113) 2.919 5.119 ( -1.049 8.214 -1.544) 8.423 5.186 ( -0.611 5.374 -0.566) 5.438 5.291 ( 1.438 2.097 -1.709) 3.064 5.364 ( 1.940 -2.434 -3.529) 4.705 5.393 ( 4.524 1.611 2.980) 5.652 5.542 ( 0.363 -4.611 -1.011) 4.735 5.741 ( 4.682 0.272 3.058) 5.599 5.801 ( 1.666 -2.431 -0.120) 2.950 6.452 ( 2.846 3.368 1.266) 4.588 6.486 ( 2.058 0.772 -0.401) 2.234 6.551 ( 1.776 -2.896 1.740) 3.817 6.585 ( -1.475 -4.753 1.393) 5.167 6.840 ( 4.187 1.960 0.333) 4.635 6.859 ( 1.616 -0.506 -1.358) 2.171 7.013 ( -2.571 0.804 1.964) 3.333 7.094 ( -3.461 -4.901 -1.049) 6.091 7.853 ( -1.975 5.711 -0.249) 6.047 7.901 ( -3.948 3.043 -1.126) 5.110 8.236 ( 2.645 0.354 3.032) 4.039 8.334 ( -1.508 -6.264 3.429) 7.298 8.591 ( 0.102 1.818 0.500) 1.889 8.605 ( -1.337 -0.511 1.616) 2.159 8.673 ( 2.232 1.455 1.695) 3.158 8.765 ( -1.448 -5.176 -4.397) 6.944 9.357 ( 0.271 6.407 0.449) 6.429 9.424 ( -1.276 3.243 -2.824) 4.486 9.638 ( 2.532 -6.544 -3.061) 7.656 9.688 ( 0.113 -8.981 4.423) 10.012 10.334 ( 3.337 6.956 -2.135) 8.004 10.476 ( -0.761 -3.910 -1.832) 4.384 10.508 ( 0.225 0.008 -1.644) 1.659 10.583 ( -2.348 -5.565 5.232) 7.991 10.938 ( 0.247 2.070 5.127) 5.535 10.993 ( 0.942 -2.695 6.731) 7.312 11.213 ( -1.038 2.189 -8.120) 8.473 11.249 ( -7.872 -0.833 -12.418) 14.727 11.654 ( 4.926 3.554 0.125) 6.076 11.751 ( -2.001 -4.878 -2.238) 5.728 12.209 ( 0.006 5.335 5.472) 7.643 12.332 ( -1.116 -4.291 4.165) 6.083 12.437 ( -3.006 6.633 0.349) 7.291 12.642 ( -7.950 -10.378 -4.000) 13.671 12.962 ( 2.810 0.128 0.528) 2.862 12.980 ( 1.785 -1.596 -0.286) 2.411 13.619 ( 3.237 1.331 0.562) 3.545 13.650 ( 2.286 -1.594 -0.711) 2.876 13.944 ( 3.918 -0.358 1.380) 4.169 13.954 ( 3.282 -1.351 2.568) 4.381 15.020 ( 4.570 5.358 -0.778) 7.086 15.090 ( 4.320 -0.857 3.559) 5.663 15.290 ( -4.401 6.260 -1.566) 7.811 15.370 ( -3.812 -0.714 -6.066) 7.200 16.255 ( -1.264 1.461 0.223) 1.945 16.261 ( -1.817 0.736 3.097) 3.665 16.671 ( 2.190 -1.077 1.839) 3.056 16.685 ( 2.296 -2.243 -3.223) 4.549 20.165 ( 0.356 2.834 -2.999) 4.142 20.181 ( -0.891 1.435 2.744) 3.223 20.392 ( -0.606 -1.781 1.272) 2.271 20.405 ( -0.654 -3.198 -1.635) 3.651 21.740 ( 2.209 -1.283 0.788) 2.673 21.766 ( 1.589 -3.655 0.537) 4.021 22.081 ( -1.443 -3.191 -0.600) 3.554 22.095 ( -1.691 -4.286 -0.361) 4.622 22.835 ( -0.558 2.606 -1.081) 2.876 22.842 ( -1.136 2.016 1.369) 2.688 23.746 ( 1.111 1.756 0.521) 2.143 23.757 ( 0.702 0.729 0.766) 1.269 24.231 ( -0.131 0.793 1.139) 1.394 24.237 ( 0.058 0.317 -1.546) 1.579 24.788 ( -0.589 2.830 -1.260) 3.153 24.797 ( -1.121 1.978 0.586) 2.348 ======================= Grid point 203 (104/104) ======================= q-point: (-0.50 0.43 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 5.87e-04 5.87e-04 5.87e-04 5.87e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 91 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.977 ( 4.075 1.211 -3.293) 5.377 1.977 ( -4.075 1.211 3.293) 5.377 2.276 ( -1.540 1.467 -1.635) 2.683 2.276 ( 1.540 1.467 1.635) 2.683 2.711 ( 1.330 5.983 -5.334) 8.125 2.711 ( -1.330 5.983 5.334) 8.125 2.901 ( -1.369 1.613 -4.377) 4.862 2.901 ( 1.369 1.613 4.377) 4.862 3.035 ( -5.477 -3.307 -1.127) 6.496 3.035 ( 5.477 -3.307 1.127) 6.496 3.187 ( 2.354 4.273 -6.819) 8.385 3.187 ( -2.354 4.273 6.819) 8.385 3.276 ( 5.120 -3.232 -3.258) 6.876 3.276 ( -5.120 -3.232 3.258) 6.876 3.818 ( -0.426 1.353 -4.686) 4.896 3.818 ( 0.426 1.353 4.686) 4.896 4.077 ( 2.196 1.513 -5.789) 6.374 4.077 ( -2.196 1.513 5.789) 6.374 4.214 ( 1.412 -2.356 -4.596) 5.354 4.214 ( -1.412 -2.356 4.596) 5.354 4.641 ( -5.148 9.882 -3.091) 11.563 4.641 ( 5.148 9.882 3.091) 11.563 4.913 ( 0.128 -4.861 -1.849) 5.203 4.913 ( -0.128 -4.861 1.849) 5.203 5.143 ( -1.789 4.693 0.109) 5.024 5.143 ( 1.789 4.693 -0.109) 5.024 5.331 ( -2.429 -0.684 -0.167) 2.529 5.331 ( 2.429 -0.684 0.167) 2.529 5.504 ( -4.183 2.846 -2.320) 5.566 5.504 ( 4.183 2.846 2.320) 5.566 5.800 ( -0.858 -2.310 -3.366) 4.171 5.800 ( 0.858 -2.310 3.366) 4.171 6.492 ( -0.341 1.934 -2.116) 2.887 6.492 ( 0.341 1.934 2.116) 2.887 6.573 ( 0.498 -4.302 -2.317) 4.912 6.573 ( -0.498 -4.302 2.317) 4.912 6.920 ( 1.730 2.630 -1.892) 3.673 6.920 ( -1.730 2.630 1.892) 3.673 6.985 ( -5.231 -3.467 -2.205) 6.652 6.985 ( 5.231 -3.467 2.205) 6.652 7.850 ( -0.818 5.267 -1.140) 5.451 7.850 ( 0.818 5.267 1.140) 5.451 8.290 ( -2.019 -4.195 0.073) 4.657 8.290 ( 2.019 -4.195 -0.073) 4.657 8.591 ( 0.064 1.436 -2.720) 3.077 8.591 ( -0.064 1.436 2.720) 3.077 8.724 ( -1.808 -2.692 -5.480) 6.368 8.724 ( 1.808 -2.692 5.480) 6.368 9.385 ( -0.650 5.990 -4.522) 7.534 9.385 ( 0.650 5.990 4.522) 7.534 9.678 ( 2.050 -9.160 -3.732) 10.101 9.678 ( -2.050 -9.160 3.732) 10.101 10.410 ( 3.647 4.509 -2.486) 6.310 10.410 ( -3.647 4.509 2.486) 6.310 10.543 ( 3.158 -5.295 -5.634) 8.352 10.543 ( -3.158 -5.295 5.634) 8.352 10.996 ( -3.401 1.032 -2.967) 4.630 10.996 ( 3.401 1.032 2.967) 4.630 11.144 ( -1.311 -0.427 -3.772) 4.016 11.144 ( 1.311 -0.427 3.772) 4.016 11.735 ( -1.516 -0.506 -0.593) 1.705 11.735 ( 1.516 -0.506 0.593) 1.705 12.248 ( -1.439 6.057 -6.358) 8.898 12.248 ( 1.439 6.057 6.358) 8.898 12.497 ( -5.222 -7.438 -5.473) 10.609 12.497 ( 5.222 -7.438 5.473) 10.609 12.995 ( -0.151 -1.502 -0.845) 1.730 12.995 ( 0.151 -1.502 0.845) 1.730 13.663 ( -0.568 0.085 -1.377) 1.492 13.663 ( 0.568 0.085 1.377) 1.492 13.985 ( 0.359 -0.827 -0.787) 1.196 13.985 ( -0.359 -0.827 0.787) 1.196 15.106 ( 0.116 4.371 -6.265) 7.640 15.106 ( -0.116 4.371 6.265) 7.640 15.280 ( -2.641 0.566 -5.769) 6.370 15.280 ( 2.641 0.566 5.769) 6.370 16.245 ( 0.476 1.302 -3.197) 3.485 16.245 ( -0.476 1.302 3.197) 3.485 16.699 ( 0.261 -1.586 -4.145) 4.446 16.699 ( -0.261 -1.586 4.145) 4.446 20.170 ( 0.892 2.060 -2.755) 3.554 20.170 ( -0.892 2.060 2.755) 3.554 20.392 ( 0.302 -2.459 -3.964) 4.675 20.392 ( -0.302 -2.459 3.964) 4.675 21.775 ( -0.221 -2.237 -1.518) 2.712 21.775 ( 0.221 -2.237 1.518) 2.712 22.070 ( 0.118 -4.156 -1.502) 4.421 22.070 ( -0.118 -4.156 1.502) 4.421 22.830 ( 0.369 2.449 -1.810) 3.067 22.830 ( -0.369 2.449 1.810) 3.067 23.762 ( -0.285 1.232 -0.111) 1.270 23.762 ( 0.285 1.232 0.111) 1.270 24.234 ( 0.091 0.621 -1.837) 1.941 24.234 ( -0.091 0.621 1.837) 1.941 24.784 ( 0.425 2.409 -0.937) 2.620 24.784 ( -0.425 2.409 0.937) 2.620 =================== 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 3/32256 10.0 1278.211 1478.495 1236.571 0.000 164.733 0.000 3/32256 20.0 183.105 300.733 208.371 0.000 19.260 0.000 3/32256 30.0 70.345 117.708 79.537 0.000 5.853 0.000 3/32256 40.0 38.101 63.225 43.856 0.000 2.784 0.000 3/32256 50.0 24.702 40.702 28.939 0.000 1.680 0.000 3/32256 60.0 17.813 29.199 21.138 0.000 1.166 0.000 3/32256 70.0 13.750 22.446 16.462 0.000 0.883 0.000 3/32256 80.0 11.121 18.086 13.397 0.000 0.707 0.000 3/32256 90.0 9.302 15.076 11.255 0.000 0.588 0.000 3/32256 100.0 7.980 12.890 9.686 0.000 0.504 0.000 3/32256 110.0 6.981 11.241 8.494 0.000 0.441 0.000 3/32256 120.0 6.203 9.958 7.562 0.000 0.392 0.000 3/32256 130.0 5.581 8.935 6.814 0.000 0.353 0.000 3/32256 140.0 5.073 8.101 6.203 0.000 0.321 0.000 3/32256 150.0 4.651 7.411 5.695 0.000 0.295 0.000 3/32256 160.0 4.295 6.830 5.266 0.000 0.272 0.000 3/32256 170.0 3.991 6.335 4.899 0.000 0.253 0.000 3/32256 180.0 3.728 5.909 4.583 0.000 0.237 0.000 3/32256 190.0 3.498 5.537 4.306 0.000 0.222 0.000 3/32256 200.0 3.296 5.211 4.063 0.000 0.209 0.000 3/32256 210.0 3.117 4.923 3.847 0.000 0.198 0.000 3/32256 220.0 2.956 4.666 3.655 0.000 0.187 0.000 3/32256 230.0 2.812 4.436 3.481 0.000 0.178 0.000 3/32256 240.0 2.681 4.228 3.325 0.000 0.169 0.000 3/32256 250.0 2.563 4.039 3.183 0.000 0.162 0.000 3/32256 260.0 2.454 3.867 3.053 0.000 0.154 0.000 3/32256 270.0 2.355 3.710 2.933 0.000 0.148 0.000 3/32256 280.0 2.264 3.566 2.824 0.000 0.142 0.000 3/32256 290.0 2.179 3.433 2.722 0.000 0.136 0.000 3/32256 300.0 2.101 3.309 2.629 0.000 0.131 0.000 3/32256 310.0 2.029 3.195 2.541 0.000 0.126 0.000 3/32256 320.0 1.961 3.089 2.460 0.000 0.122 0.000 3/32256 330.0 1.898 2.989 2.384 0.000 0.118 0.000 3/32256 340.0 1.839 2.896 2.312 0.000 0.114 0.000 3/32256 350.0 1.783 2.809 2.245 0.000 0.110 0.000 3/32256 360.0 1.731 2.727 2.182 0.000 0.107 0.000 3/32256 370.0 1.682 2.650 2.122 0.000 0.103 0.000 3/32256 380.0 1.636 2.578 2.066 0.000 0.100 0.000 3/32256 390.0 1.592 2.509 2.013 0.000 0.098 0.000 3/32256 400.0 1.550 2.444 1.962 0.000 0.095 0.000 3/32256 410.0 1.511 2.382 1.914 0.000 0.092 0.000 3/32256 420.0 1.473 2.324 1.869 0.000 0.090 0.000 3/32256 430.0 1.438 2.268 1.825 0.000 0.087 0.000 3/32256 440.0 1.404 2.215 1.784 0.000 0.085 0.000 3/32256 450.0 1.372 2.164 1.744 0.000 0.083 0.000 3/32256 460.0 1.341 2.116 1.706 0.000 0.081 0.000 3/32256 470.0 1.312 2.070 1.670 0.000 0.079 0.000 3/32256 480.0 1.283 2.026 1.635 0.000 0.077 0.000 3/32256 490.0 1.257 1.984 1.602 0.000 0.076 0.000 3/32256 500.0 1.231 1.943 1.570 0.000 0.074 0.000 3/32256 510.0 1.206 1.904 1.540 0.000 0.072 0.000 3/32256 520.0 1.182 1.867 1.510 0.000 0.071 0.000 3/32256 530.0 1.159 1.831 1.482 0.000 0.070 0.000 3/32256 540.0 1.137 1.797 1.455 0.000 0.068 0.000 3/32256 550.0 1.116 1.764 1.428 0.000 0.067 0.000 3/32256 560.0 1.096 1.732 1.403 0.000 0.065 0.000 3/32256 570.0 1.076 1.701 1.379 0.000 0.064 0.000 3/32256 580.0 1.057 1.671 1.355 0.000 0.063 0.000 3/32256 590.0 1.039 1.642 1.332 0.000 0.062 0.000 3/32256 600.0 1.021 1.615 1.310 0.000 0.061 0.000 3/32256 610.0 1.004 1.588 1.289 0.000 0.060 0.000 3/32256 620.0 0.988 1.562 1.268 0.000 0.059 0.000 3/32256 630.0 0.972 1.537 1.248 0.000 0.058 0.000 3/32256 640.0 0.956 1.513 1.229 0.000 0.057 0.000 3/32256 650.0 0.941 1.489 1.210 0.000 0.056 0.000 3/32256 660.0 0.927 1.466 1.192 0.000 0.055 0.000 3/32256 670.0 0.913 1.444 1.174 0.000 0.054 0.000 3/32256 680.0 0.899 1.423 1.157 0.000 0.053 0.000 3/32256 690.0 0.886 1.402 1.141 0.000 0.052 0.000 3/32256 700.0 0.873 1.382 1.124 0.000 0.052 0.000 3/32256 710.0 0.861 1.362 1.109 0.000 0.051 0.000 3/32256 720.0 0.849 1.343 1.093 0.000 0.050 0.000 3/32256 730.0 0.837 1.325 1.079 0.000 0.049 0.000 3/32256 740.0 0.825 1.307 1.064 0.000 0.049 0.000 3/32256 750.0 0.814 1.289 1.050 0.000 0.048 0.000 3/32256 760.0 0.803 1.272 1.036 0.000 0.047 0.000 3/32256 770.0 0.793 1.255 1.023 0.000 0.047 0.000 3/32256 780.0 0.783 1.239 1.010 0.000 0.046 0.000 3/32256 790.0 0.773 1.224 0.997 0.000 0.045 0.000 3/32256 800.0 0.763 1.208 0.985 0.000 0.045 0.000 3/32256 810.0 0.753 1.193 0.973 0.000 0.044 0.000 3/32256 820.0 0.744 1.179 0.961 0.000 0.044 0.000 3/32256 830.0 0.735 1.164 0.949 0.000 0.043 0.000 3/32256 840.0 0.726 1.150 0.938 0.000 0.043 0.000 3/32256 850.0 0.718 1.137 0.927 0.000 0.042 0.000 3/32256 860.0 0.709 1.123 0.917 0.000 0.041 0.000 3/32256 870.0 0.701 1.111 0.906 0.000 0.041 0.000 3/32256 880.0 0.693 1.098 0.896 0.000 0.041 0.000 3/32256 890.0 0.685 1.085 0.886 0.000 0.040 0.000 3/32256 900.0 0.677 1.073 0.876 0.000 0.040 0.000 3/32256 910.0 0.670 1.062 0.867 0.000 0.039 0.000 3/32256 920.0 0.663 1.050 0.857 0.000 0.039 0.000 3/32256 930.0 0.655 1.039 0.848 0.000 0.038 0.000 3/32256 940.0 0.648 1.028 0.839 0.000 0.038 0.000 3/32256 950.0 0.641 1.017 0.830 0.000 0.037 0.000 3/32256 960.0 0.635 1.006 0.822 0.000 0.037 0.000 3/32256 970.0 0.628 0.996 0.813 0.000 0.037 0.000 3/32256 980.0 0.622 0.985 0.805 0.000 0.036 0.000 3/32256 990.0 0.615 0.975 0.797 0.000 0.036 0.000 3/32256 1000.0 0.609 0.966 0.789 0.000 0.035 0.000 3/32256 Thermal conductivity related properties were written into "kappa-m678.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 03:02:14]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|