----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 14:32:19]------------------------- 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: [2 2 1] 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 5.392238050282745 0.000000000000000 0.000000000000000 b 0.000000000000000 6.163597620000002 0.000000000000000 c -4.317918974199862 0.000000000000000 9.893519258797626 Atomic positions (fractional): *1 Li 0.08100164894105 0.86609823002144 0.43095387895144 6.941 2 Li 0.91899835105895 0.36609823002144 0.06904612104856 6.941 3 Li 0.91899835105895 0.13390176997856 0.56904612104856 6.941 4 Li 0.08100164894105 0.63390176997856 0.93095387895144 6.941 *5 Y 0.55330550683912 0.88238955900116 0.84771151599436 88.906 6 Y 0.44669449316088 0.11761044099884 0.15228848400564 88.906 7 Y 0.44669449316088 0.38238955900116 0.65228848400564 88.906 8 Y 0.55330550683912 0.61761044099884 0.34771151599436 88.906 *9 Si 0.09483041647742 0.34925783385222 0.35882894081006 28.085 10 Si 0.90516958352258 0.65074216614778 0.64117105918994 28.085 11 Si 0.90516958352258 0.84925783385222 0.14117105918994 28.085 12 Si 0.09483041647742 0.15074216614777 0.85882894081006 28.085 *13 O 0.76639380188892 0.13933673665132 0.77527101829204 15.999 14 O 0.76639380188892 0.36066326334868 0.27527101829204 15.999 *15 O 0.81450033082841 0.83704913611608 0.52372704226353 15.999 *16 O 0.24083104129844 0.16077478150393 0.75098320974107 15.999 17 O 0.23360619811108 0.86066326334868 0.22472898170796 15.999 *18 O 0.77206758056811 0.42685550738401 0.55427548215743 15.999 19 O 0.24083104129844 0.33922521849607 0.25098320974107 15.999 20 O 0.22793241943189 0.57314449261599 0.44572451784257 15.999 21 O 0.22793241943189 0.92685550738401 0.94572451784257 15.999 22 O 0.18549966917159 0.33704913611608 0.97627295773647 15.999 23 O 0.75916895870156 0.83922521849607 0.24901679025893 15.999 24 O 0.77206758056811 0.07314449261599 0.05427548215743 15.999 25 O 0.81450033082841 0.66295086388392 0.02372704226353 15.999 26 O 0.75916895870156 0.66077478150393 0.74901679025893 15.999 27 O 0.23360619811108 0.63933673665132 0.72472898170796 15.999 28 O 0.18549966917159 0.16295086388392 0.47627295773647 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.392238050282745 0.000000000000000 0.000000000000000 b 0.000000000000000 6.163597620000002 0.000000000000000 c -4.317918974199862 0.000000000000000 9.893519258797626 Atomic positions (fractional): *1 Li 0.08100164894105 0.86609823002144 0.43095387895144 6.941 > 1 2 Li 0.91899835105895 0.36609823002144 0.06904612104856 6.941 > 2 3 Li 0.91899835105895 0.13390176997856 0.56904612104856 6.941 > 3 4 Li 0.08100164894105 0.63390176997856 0.93095387895144 6.941 > 4 *5 Y 0.55330550683912 0.88238955900116 0.84771151599436 88.906 > 5 6 Y 0.44669449316088 0.11761044099884 0.15228848400564 88.906 > 6 7 Y 0.44669449316088 0.38238955900116 0.65228848400564 88.906 > 7 8 Y 0.55330550683912 0.61761044099884 0.34771151599436 88.906 > 8 *9 Si 0.09483041647742 0.34925783385222 0.35882894081006 28.085 > 9 10 Si 0.90516958352258 0.65074216614778 0.64117105918994 28.085 > 10 11 Si 0.90516958352258 0.84925783385222 0.14117105918994 28.085 > 11 12 Si 0.09483041647742 0.15074216614777 0.85882894081006 28.085 > 12 *13 O 0.76639380188892 0.13933673665132 0.77527101829204 15.999 > 13 14 O 0.76639380188892 0.36066326334868 0.27527101829204 15.999 > 14 *15 O 0.81450033082841 0.83704913611608 0.52372704226353 15.999 > 15 *16 O 0.24083104129844 0.16077478150393 0.75098320974107 15.999 > 16 17 O 0.23360619811108 0.86066326334868 0.22472898170796 15.999 > 17 *18 O 0.77206758056811 0.42685550738401 0.55427548215743 15.999 > 18 19 O 0.24083104129844 0.33922521849607 0.25098320974107 15.999 > 19 20 O 0.22793241943189 0.57314449261599 0.44572451784257 15.999 > 20 21 O 0.22793241943189 0.92685550738401 0.94572451784257 15.999 > 21 22 O 0.18549966917159 0.33704913611608 0.97627295773647 15.999 > 22 23 O 0.75916895870156 0.83922521849607 0.24901679025893 15.999 > 23 24 O 0.77206758056811 0.07314449261599 0.05427548215743 15.999 > 24 25 O 0.81450033082841 0.66295086388392 0.02372704226353 15.999 > 25 26 O 0.75916895870156 0.66077478150393 0.74901679025893 15.999 > 26 27 O 0.23360619811108 0.63933673665132 0.72472898170796 15.999 > 27 28 O 0.18549966917159 0.16295086388392 0.47627295773647 15.999 > 28 -------------------------------- super cell -------------------------------- Lattice vectors: a 10.784476100565490 0.000000000000000 0.000000000000000 b 0.000000000000000 12.327195240000004 0.000000000000000 c -4.317918974199862 0.000000000000000 9.893519258797626 Atomic positions (fractional): *1 Li 0.04050082447053 0.43304911501072 0.43095387895144 6.941 > 1 2 Li 0.54050082447053 0.43304911501072 0.43095387895144 6.941 > 1 3 Li 0.04050082447053 0.93304911501072 0.43095387895144 6.941 > 1 4 Li 0.54050082447053 0.93304911501072 0.43095387895144 6.941 > 1 5 Li 0.45949917552947 0.18304911501072 0.06904612104856 6.941 > 2 6 Li 0.95949917552947 0.18304911501072 0.06904612104856 6.941 > 2 7 Li 0.45949917552947 0.68304911501072 0.06904612104856 6.941 > 2 8 Li 0.95949917552947 0.68304911501072 0.06904612104856 6.941 > 2 9 Li 0.45949917552947 0.06695088498928 0.56904612104856 6.941 > 3 10 Li 0.95949917552947 0.06695088498928 0.56904612104856 6.941 > 3 11 Li 0.45949917552947 0.56695088498928 0.56904612104856 6.941 > 3 12 Li 0.95949917552947 0.56695088498928 0.56904612104856 6.941 > 3 13 Li 0.04050082447053 0.31695088498928 0.93095387895144 6.941 > 4 14 Li 0.54050082447053 0.31695088498928 0.93095387895144 6.941 > 4 15 Li 0.04050082447053 0.81695088498928 0.93095387895144 6.941 > 4 16 Li 0.54050082447053 0.81695088498928 0.93095387895144 6.941 > 4 *17 Y 0.27665275341956 0.44119477950058 0.84771151599436 88.906 > 5 18 Y 0.77665275341956 0.44119477950058 0.84771151599436 88.906 > 5 19 Y 0.27665275341956 0.94119477950058 0.84771151599436 88.906 > 5 20 Y 0.77665275341956 0.94119477950058 0.84771151599436 88.906 > 5 21 Y 0.22334724658044 0.05880522049942 0.15228848400564 88.906 > 6 22 Y 0.72334724658044 0.05880522049942 0.15228848400564 88.906 > 6 23 Y 0.22334724658044 0.55880522049942 0.15228848400564 88.906 > 6 24 Y 0.72334724658044 0.55880522049942 0.15228848400564 88.906 > 6 25 Y 0.22334724658044 0.19119477950058 0.65228848400564 88.906 > 7 26 Y 0.72334724658044 0.19119477950058 0.65228848400564 88.906 > 7 27 Y 0.22334724658044 0.69119477950058 0.65228848400564 88.906 > 7 28 Y 0.72334724658044 0.69119477950058 0.65228848400564 88.906 > 7 29 Y 0.27665275341956 0.30880522049942 0.34771151599436 88.906 > 8 30 Y 0.77665275341956 0.30880522049942 0.34771151599436 88.906 > 8 31 Y 0.27665275341956 0.80880522049942 0.34771151599436 88.906 > 8 32 Y 0.77665275341956 0.80880522049942 0.34771151599436 88.906 > 8 *33 Si 0.04741520823871 0.17462891692611 0.35882894081006 28.085 > 9 34 Si 0.54741520823871 0.17462891692611 0.35882894081006 28.085 > 9 35 Si 0.04741520823871 0.67462891692611 0.35882894081006 28.085 > 9 36 Si 0.54741520823871 0.67462891692611 0.35882894081006 28.085 > 9 37 Si 0.45258479176129 0.32537108307389 0.64117105918994 28.085 > 10 38 Si 0.95258479176129 0.32537108307389 0.64117105918994 28.085 > 10 39 Si 0.45258479176129 0.82537108307389 0.64117105918994 28.085 > 10 40 Si 0.95258479176129 0.82537108307389 0.64117105918994 28.085 > 10 41 Si 0.45258479176129 0.42462891692611 0.14117105918994 28.085 > 11 42 Si 0.95258479176129 0.42462891692611 0.14117105918994 28.085 > 11 43 Si 0.45258479176129 0.92462891692611 0.14117105918994 28.085 > 11 44 Si 0.95258479176129 0.92462891692611 0.14117105918994 28.085 > 11 45 Si 0.04741520823871 0.07537108307389 0.85882894081006 28.085 > 12 46 Si 0.54741520823871 0.07537108307389 0.85882894081006 28.085 > 12 47 Si 0.04741520823871 0.57537108307389 0.85882894081006 28.085 > 12 48 Si 0.54741520823871 0.57537108307389 0.85882894081006 28.085 > 12 *49 O 0.38319690094446 0.06966836832566 0.77527101829204 15.999 > 13 50 O 0.88319690094446 0.06966836832566 0.77527101829204 15.999 > 13 51 O 0.38319690094446 0.56966836832566 0.77527101829204 15.999 > 13 52 O 0.88319690094446 0.56966836832566 0.77527101829204 15.999 > 13 53 O 0.38319690094446 0.18033163167434 0.27527101829204 15.999 > 14 54 O 0.88319690094446 0.18033163167434 0.27527101829204 15.999 > 14 55 O 0.38319690094446 0.68033163167434 0.27527101829204 15.999 > 14 56 O 0.88319690094446 0.68033163167434 0.27527101829204 15.999 > 14 *57 O 0.40725016541420 0.41852456805804 0.52372704226353 15.999 > 15 58 O 0.90725016541420 0.41852456805804 0.52372704226353 15.999 > 15 59 O 0.40725016541420 0.91852456805804 0.52372704226353 15.999 > 15 60 O 0.90725016541420 0.91852456805804 0.52372704226353 15.999 > 15 *61 O 0.12041552064922 0.08038739075196 0.75098320974107 15.999 > 16 62 O 0.62041552064922 0.08038739075196 0.75098320974107 15.999 > 16 63 O 0.12041552064922 0.58038739075196 0.75098320974107 15.999 > 16 64 O 0.62041552064922 0.58038739075196 0.75098320974107 15.999 > 16 65 O 0.11680309905554 0.43033163167434 0.22472898170796 15.999 > 17 66 O 0.61680309905554 0.43033163167434 0.22472898170796 15.999 > 17 67 O 0.11680309905554 0.93033163167434 0.22472898170796 15.999 > 17 68 O 0.61680309905554 0.93033163167434 0.22472898170796 15.999 > 17 *69 O 0.38603379028405 0.21342775369201 0.55427548215743 15.999 > 18 70 O 0.88603379028405 0.21342775369201 0.55427548215743 15.999 > 18 71 O 0.38603379028405 0.71342775369201 0.55427548215743 15.999 > 18 72 O 0.88603379028405 0.71342775369201 0.55427548215743 15.999 > 18 73 O 0.12041552064922 0.16961260924804 0.25098320974107 15.999 > 19 74 O 0.62041552064922 0.16961260924804 0.25098320974107 15.999 > 19 75 O 0.12041552064922 0.66961260924804 0.25098320974107 15.999 > 19 76 O 0.62041552064922 0.66961260924804 0.25098320974107 15.999 > 19 77 O 0.11396620971595 0.28657224630799 0.44572451784257 15.999 > 20 78 O 0.61396620971595 0.28657224630799 0.44572451784257 15.999 > 20 79 O 0.11396620971595 0.78657224630799 0.44572451784257 15.999 > 20 80 O 0.61396620971595 0.78657224630799 0.44572451784257 15.999 > 20 81 O 0.11396620971595 0.46342775369201 0.94572451784257 15.999 > 21 82 O 0.61396620971595 0.46342775369201 0.94572451784257 15.999 > 21 83 O 0.11396620971595 0.96342775369201 0.94572451784257 15.999 > 21 84 O 0.61396620971595 0.96342775369201 0.94572451784257 15.999 > 21 85 O 0.09274983458580 0.16852456805804 0.97627295773647 15.999 > 22 86 O 0.59274983458580 0.16852456805804 0.97627295773647 15.999 > 22 87 O 0.09274983458580 0.66852456805804 0.97627295773647 15.999 > 22 88 O 0.59274983458580 0.66852456805804 0.97627295773647 15.999 > 22 89 O 0.37958447935078 0.41961260924804 0.24901679025893 15.999 > 23 90 O 0.87958447935078 0.41961260924804 0.24901679025893 15.999 > 23 91 O 0.37958447935078 0.91961260924804 0.24901679025893 15.999 > 23 92 O 0.87958447935078 0.91961260924804 0.24901679025893 15.999 > 23 93 O 0.38603379028405 0.03657224630799 0.05427548215743 15.999 > 24 94 O 0.88603379028405 0.03657224630799 0.05427548215743 15.999 > 24 95 O 0.38603379028405 0.53657224630799 0.05427548215743 15.999 > 24 96 O 0.88603379028405 0.53657224630799 0.05427548215743 15.999 > 24 97 O 0.40725016541420 0.33147543194196 0.02372704226353 15.999 > 25 98 O 0.90725016541420 0.33147543194196 0.02372704226353 15.999 > 25 99 O 0.40725016541420 0.83147543194196 0.02372704226353 15.999 > 25 100 O 0.90725016541420 0.83147543194196 0.02372704226353 15.999 > 25 101 O 0.37958447935078 0.33038739075196 0.74901679025893 15.999 > 26 102 O 0.87958447935078 0.33038739075196 0.74901679025893 15.999 > 26 103 O 0.37958447935078 0.83038739075196 0.74901679025893 15.999 > 26 104 O 0.87958447935078 0.83038739075196 0.74901679025893 15.999 > 26 105 O 0.11680309905554 0.31966836832566 0.72472898170796 15.999 > 27 106 O 0.61680309905554 0.31966836832566 0.72472898170796 15.999 > 27 107 O 0.11680309905554 0.81966836832566 0.72472898170796 15.999 > 27 108 O 0.61680309905554 0.81966836832566 0.72472898170796 15.999 > 27 109 O 0.09274983458580 0.08147543194196 0.47627295773647 15.999 > 28 110 O 0.59274983458580 0.08147543194196 0.47627295773647 15.999 > 28 111 O 0.09274983458580 0.58147543194196 0.47627295773647 15.999 > 28 112 O 0.59274983458580 0.58147543194196 0.47627295773647 15.999 > 28 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.3106025 0.0000000 0.0239183 0.0000000 3.0779133 0.0000000 0.0239186 0.0000000 3.2323924 -------------------------- Born effective charges -------------------------- 1 Li 0.9988880 0.0001040 -0.0576453 0.0290276 1.1912857 -0.0433680 -0.0632422 0.0284004 1.0492003 2 Li 0.9988880 -0.0001040 -0.0576453 -0.0290276 1.1912857 0.0433680 -0.0632422 -0.0284004 1.0492003 3 Li 0.9988880 0.0001040 -0.0576453 0.0290276 1.1912857 -0.0433680 -0.0632422 0.0284004 1.0492003 4 Li 0.9988880 -0.0001040 -0.0576453 -0.0290276 1.1912857 0.0433680 -0.0632422 -0.0284004 1.0492003 5 Y 3.7807251 -0.1280526 0.0448674 -0.2101549 3.5268662 0.2489707 0.0656183 0.3810886 3.5470442 6 Y 3.7807251 -0.1280526 0.0448674 -0.2101549 3.5268662 0.2489707 0.0656183 0.3810886 3.5470442 7 Y 3.7807251 0.1280526 0.0448674 0.2101549 3.5268662 -0.2489707 0.0656183 -0.3810886 3.5470442 8 Y 3.7807251 0.1280526 0.0448674 0.2101549 3.5268662 -0.2489707 0.0656183 -0.3810886 3.5470442 9 Si 3.3300491 0.1802816 0.0885121 0.0987543 2.3665779 0.1134535 0.0465067 -0.1225595 3.1184032 10 Si 3.3300491 0.1802816 0.0885121 0.0987543 2.3665779 0.1134535 0.0465067 -0.1225595 3.1184032 11 Si 3.3300491 -0.1802816 0.0885121 -0.0987543 2.3665779 -0.1134535 0.0465067 0.1225595 3.1184032 12 Si 3.3300491 -0.1802816 0.0885121 -0.0987543 2.3665779 -0.1134535 0.0465067 0.1225595 3.1184032 13 O -2.5333909 -0.0709630 -0.4703745 -0.0643722 -1.7919391 0.5052492 -0.4751376 0.4578216 -1.7227229 14 O -2.5333909 0.0709630 -0.4703745 0.0643722 -1.7919391 -0.5052492 -0.4751376 -0.4578216 -1.7227229 15 O -1.3440614 -0.1916008 -0.1165725 -0.2249571 -1.8158350 0.0025085 -0.0912016 0.0431731 -2.1149873 16 O -2.3142711 -0.0542162 0.4586965 -0.1004508 -1.7367740 0.5143864 0.4770060 0.5080032 -1.8659214 17 O -2.5333909 -0.0709630 -0.4703745 -0.0643722 -1.7919391 0.5052492 -0.4751376 0.4578216 -1.7227229 18 O -1.9179389 -0.1531502 0.0525162 -0.1552252 -1.7401816 0.0031664 0.0404505 0.0338046 -2.0110162 19 O -2.3142711 0.0542162 0.4586965 0.1004508 -1.7367740 -0.5143864 0.4770060 -0.5080032 -1.8659214 20 O -1.9179389 -0.1531502 0.0525162 -0.1552252 -1.7401816 0.0031664 0.0404505 0.0338046 -2.0110162 21 O -1.9179389 0.1531502 0.0525162 0.1552252 -1.7401816 -0.0031664 0.0404505 -0.0338046 -2.0110162 22 O -1.3440614 0.1916008 -0.1165725 0.2249571 -1.8158350 -0.0025085 -0.0912016 -0.0431731 -2.1149873 23 O -2.3142711 -0.0542162 0.4586965 -0.1004508 -1.7367740 0.5143864 0.4770060 0.5080032 -1.8659214 24 O -1.9179389 0.1531502 0.0525162 0.1552252 -1.7401816 -0.0031664 0.0404505 -0.0338046 -2.0110162 25 O -1.3440614 0.1916008 -0.1165725 0.2249571 -1.8158350 -0.0025085 -0.0912016 -0.0431731 -2.1149873 26 O -2.3142711 0.0542162 0.4586965 0.1004508 -1.7367740 -0.5143864 0.4770060 -0.5080032 -1.8659214 27 O -2.5333909 0.0709630 -0.4703745 0.0643722 -1.7919391 -0.5052492 -0.4751376 -0.4578216 -1.7227229 28 O -1.3440614 -0.1916008 -0.1165725 -0.2249571 -1.8158350 0.0025085 -0.0912016 0.0431731 -2.1149873 ---------------------------------------------------------------------------- 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: 336/336 Permutation basis: 14448/14448 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3654 Number of blocks in projector: 3654 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: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 27 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 784 / 784 (1) 271 eigenvectors found. (1) Complementary block size: 27 (1) Compute compressed projector. (1) Use standard solver. (1) 13 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 27 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 784 / 784 (1) 271 eigenvectors found. (1) Complementary block size: 27 (1) Compute compressed projector. (1) Use standard solver. (1) 13 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 237 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 487 eigenvectors found. (1) Block: 784 / 784 (1) 275 eigenvectors found. (1) Complementary block size: 22 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 434 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 434 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 434 Use standard eigh solver. Tree of FC basis block matrices: - (3654, 3592), data: False |-- (434, 427), data: True |-- (434, 427), data: True |-- (434, 427), data: True |-- (784, 771), data: False |-- (784, 9), data: (784, 22) @ (22, 9) |-- (284, 275), data: True |-- (500, 487), data: False |-- (500, 11), data: (500, 24) @ (24, 11) |-- (250, 239), data: True |-- (250, 237), data: True |-- (784, 770), data: False |-- (784, 13), data: (784, 27) @ (27, 13) |-- (284, 271), data: True |-- (500, 486), data: False |-- (500, 13), data: (500, 27) @ (27, 13) |-- (250, 237), data: True |-- (250, 236), data: True |-- (784, 770), data: False |-- (784, 13), data: (784, 27) @ (27, 13) |-- (284, 271), data: True |-- (500, 486), data: False |-- (500, 13), data: (500, 27) @ (27, 13) |-- (250, 237), data: True |-- (250, 236), data: True ----- Solver_atoms: 1 -- 112 / 112 Time (Solver_compr_matrix_reshape): 0.003 Solver_block: 100 / 880 - Time: 2.560 Solver_block: 200 / 880 - Time: 3.066 Solver_block: 300 / 880 - Time: 1.787 Solver_block: 400 / 880 - Time: 1.038 Solver_block: 500 / 880 - Time: 1.048 Solver_block: 600 / 880 - Time: 2.164 Solver_block: 700 / 880 - Time: 2.388 Solver_block: 800 / 880 - Time: 1.078 Solver_block: 880 / 880 - Time: 0.887 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 16.557 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (yy) -0.00000000 (yy) Permutation basis: 336/336 Permutation basis: 14448/14448 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3654 Number of blocks in projector: 3654 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: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 27 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 784 / 784 (1) 271 eigenvectors found. (1) Complementary block size: 27 (1) Compute compressed projector. (1) Use standard solver. (1) 13 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 27 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 784 / 784 (1) 271 eigenvectors found. (1) Complementary block size: 27 (1) Compute compressed projector. (1) Use standard solver. (1) 13 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 237 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 487 eigenvectors found. (1) Block: 784 / 784 (1) 275 eigenvectors found. (1) Complementary block size: 22 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 434 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 434 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 434 Use standard eigh solver. Tree of FC basis block matrices: - (3654, 3592), data: False |-- (434, 427), data: True |-- (434, 427), data: True |-- (434, 427), data: True |-- (784, 771), data: False |-- (784, 9), data: (784, 22) @ (22, 9) |-- (284, 275), data: True |-- (500, 487), data: False |-- (500, 11), data: (500, 24) @ (24, 11) |-- (250, 239), data: True |-- (250, 237), data: True |-- (784, 770), data: False |-- (784, 13), data: (784, 27) @ (27, 13) |-- (284, 271), data: True |-- (500, 486), data: False |-- (500, 13), data: (500, 27) @ (27, 13) |-- (250, 237), data: True |-- (250, 236), data: True |-- (784, 770), data: False |-- (784, 13), data: (784, 27) @ (27, 13) |-- (284, 271), data: True |-- (500, 486), data: False |-- (500, 13), data: (500, 27) @ (27, 13) |-- (250, 237), data: True |-- (250, 236), data: True Max drift after symmetrization by symfc projector: -0.00000000 (yy) -0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 14:33:32]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 14:33:33]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 2 1] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.392238050282745 0.000000000000000 0.000000000000000 b 0.000000000000000 6.163597620000002 0.000000000000000 c -4.317918974199862 0.000000000000000 9.893519258797626 Atomic positions (fractional): 1 Li 0.08100164894105 0.86609823002144 0.43095387895144 6.941 2 Li 0.91899835105895 0.36609823002144 0.06904612104856 6.941 3 Li 0.91899835105895 0.13390176997856 0.56904612104856 6.941 4 Li 0.08100164894105 0.63390176997856 0.93095387895144 6.941 5 Y 0.55330550683912 0.88238955900116 0.84771151599436 88.906 6 Y 0.44669449316088 0.11761044099884 0.15228848400564 88.906 7 Y 0.44669449316088 0.38238955900116 0.65228848400564 88.906 8 Y 0.55330550683912 0.61761044099884 0.34771151599436 88.906 9 Si 0.09483041647742 0.34925783385222 0.35882894081006 28.085 10 Si 0.90516958352258 0.65074216614778 0.64117105918994 28.085 11 Si 0.90516958352258 0.84925783385222 0.14117105918994 28.085 12 Si 0.09483041647742 0.15074216614777 0.85882894081006 28.085 13 O 0.76639380188892 0.13933673665132 0.77527101829204 15.999 14 O 0.76639380188892 0.36066326334868 0.27527101829204 15.999 15 O 0.81450033082841 0.83704913611608 0.52372704226353 15.999 16 O 0.24083104129844 0.16077478150393 0.75098320974107 15.999 17 O 0.23360619811108 0.86066326334868 0.22472898170796 15.999 18 O 0.77206758056811 0.42685550738401 0.55427548215743 15.999 19 O 0.24083104129844 0.33922521849607 0.25098320974107 15.999 20 O 0.22793241943189 0.57314449261599 0.44572451784257 15.999 21 O 0.22793241943189 0.92685550738401 0.94572451784257 15.999 22 O 0.18549966917159 0.33704913611608 0.97627295773647 15.999 23 O 0.75916895870156 0.83922521849607 0.24901679025893 15.999 24 O 0.77206758056811 0.07314449261599 0.05427548215743 15.999 25 O 0.81450033082841 0.66295086388392 0.02372704226353 15.999 26 O 0.75916895870156 0.66077478150393 0.74901679025893 15.999 27 O 0.23360619811108 0.63933673665132 0.72472898170796 15.999 28 O 0.18549966917159 0.16295086388392 0.47627295773647 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.784476100565490 0.000000000000000 0.000000000000000 b 0.000000000000000 12.327195240000004 0.000000000000000 c -4.317918974199862 0.000000000000000 9.893519258797626 Atomic positions (fractional): 1 Li 0.04050082447053 0.43304911501072 0.43095387895144 6.941 > 1 2 Li 0.54050082447053 0.43304911501072 0.43095387895144 6.941 > 1 3 Li 0.04050082447053 0.93304911501072 0.43095387895144 6.941 > 1 4 Li 0.54050082447053 0.93304911501072 0.43095387895144 6.941 > 1 5 Li 0.45949917552947 0.18304911501072 0.06904612104856 6.941 > 5 6 Li 0.95949917552947 0.18304911501072 0.06904612104856 6.941 > 5 7 Li 0.45949917552947 0.68304911501072 0.06904612104856 6.941 > 5 8 Li 0.95949917552947 0.68304911501072 0.06904612104856 6.941 > 5 9 Li 0.45949917552947 0.06695088498928 0.56904612104856 6.941 > 9 10 Li 0.95949917552947 0.06695088498928 0.56904612104856 6.941 > 9 11 Li 0.45949917552947 0.56695088498928 0.56904612104856 6.941 > 9 12 Li 0.95949917552947 0.56695088498928 0.56904612104856 6.941 > 9 13 Li 0.04050082447053 0.31695088498928 0.93095387895144 6.941 > 13 14 Li 0.54050082447053 0.31695088498928 0.93095387895144 6.941 > 13 15 Li 0.04050082447053 0.81695088498928 0.93095387895144 6.941 > 13 16 Li 0.54050082447053 0.81695088498928 0.93095387895144 6.941 > 13 17 Y 0.27665275341956 0.44119477950058 0.84771151599436 88.906 > 17 18 Y 0.77665275341956 0.44119477950058 0.84771151599436 88.906 > 17 19 Y 0.27665275341956 0.94119477950058 0.84771151599436 88.906 > 17 20 Y 0.77665275341956 0.94119477950058 0.84771151599436 88.906 > 17 21 Y 0.22334724658044 0.05880522049942 0.15228848400564 88.906 > 21 22 Y 0.72334724658044 0.05880522049942 0.15228848400564 88.906 > 21 23 Y 0.22334724658044 0.55880522049942 0.15228848400564 88.906 > 21 24 Y 0.72334724658044 0.55880522049942 0.15228848400564 88.906 > 21 25 Y 0.22334724658044 0.19119477950058 0.65228848400564 88.906 > 25 26 Y 0.72334724658044 0.19119477950058 0.65228848400564 88.906 > 25 27 Y 0.22334724658044 0.69119477950058 0.65228848400564 88.906 > 25 28 Y 0.72334724658044 0.69119477950058 0.65228848400564 88.906 > 25 29 Y 0.27665275341956 0.30880522049942 0.34771151599436 88.906 > 29 30 Y 0.77665275341956 0.30880522049942 0.34771151599436 88.906 > 29 31 Y 0.27665275341956 0.80880522049942 0.34771151599436 88.906 > 29 32 Y 0.77665275341956 0.80880522049942 0.34771151599436 88.906 > 29 33 Si 0.04741520823871 0.17462891692611 0.35882894081006 28.085 > 33 34 Si 0.54741520823871 0.17462891692611 0.35882894081006 28.085 > 33 35 Si 0.04741520823871 0.67462891692611 0.35882894081006 28.085 > 33 36 Si 0.54741520823871 0.67462891692611 0.35882894081006 28.085 > 33 37 Si 0.45258479176129 0.32537108307389 0.64117105918994 28.085 > 37 38 Si 0.95258479176129 0.32537108307389 0.64117105918994 28.085 > 37 39 Si 0.45258479176129 0.82537108307389 0.64117105918994 28.085 > 37 40 Si 0.95258479176129 0.82537108307389 0.64117105918994 28.085 > 37 41 Si 0.45258479176129 0.42462891692611 0.14117105918994 28.085 > 41 42 Si 0.95258479176129 0.42462891692611 0.14117105918994 28.085 > 41 43 Si 0.45258479176129 0.92462891692611 0.14117105918994 28.085 > 41 44 Si 0.95258479176129 0.92462891692611 0.14117105918994 28.085 > 41 45 Si 0.04741520823871 0.07537108307389 0.85882894081006 28.085 > 45 46 Si 0.54741520823871 0.07537108307389 0.85882894081006 28.085 > 45 47 Si 0.04741520823871 0.57537108307389 0.85882894081006 28.085 > 45 48 Si 0.54741520823871 0.57537108307389 0.85882894081006 28.085 > 45 49 O 0.38319690094446 0.06966836832566 0.77527101829204 15.999 > 49 50 O 0.88319690094446 0.06966836832566 0.77527101829204 15.999 > 49 51 O 0.38319690094446 0.56966836832566 0.77527101829204 15.999 > 49 52 O 0.88319690094446 0.56966836832566 0.77527101829204 15.999 > 49 53 O 0.38319690094446 0.18033163167434 0.27527101829204 15.999 > 53 54 O 0.88319690094446 0.18033163167434 0.27527101829204 15.999 > 53 55 O 0.38319690094446 0.68033163167434 0.27527101829204 15.999 > 53 56 O 0.88319690094446 0.68033163167434 0.27527101829204 15.999 > 53 57 O 0.40725016541420 0.41852456805804 0.52372704226353 15.999 > 57 58 O 0.90725016541420 0.41852456805804 0.52372704226353 15.999 > 57 59 O 0.40725016541420 0.91852456805804 0.52372704226353 15.999 > 57 60 O 0.90725016541420 0.91852456805804 0.52372704226353 15.999 > 57 61 O 0.12041552064922 0.08038739075196 0.75098320974107 15.999 > 61 62 O 0.62041552064922 0.08038739075196 0.75098320974107 15.999 > 61 63 O 0.12041552064922 0.58038739075196 0.75098320974107 15.999 > 61 64 O 0.62041552064922 0.58038739075196 0.75098320974107 15.999 > 61 65 O 0.11680309905554 0.43033163167434 0.22472898170796 15.999 > 65 66 O 0.61680309905554 0.43033163167434 0.22472898170796 15.999 > 65 67 O 0.11680309905554 0.93033163167434 0.22472898170796 15.999 > 65 68 O 0.61680309905554 0.93033163167434 0.22472898170796 15.999 > 65 69 O 0.38603379028405 0.21342775369201 0.55427548215743 15.999 > 69 70 O 0.88603379028405 0.21342775369201 0.55427548215743 15.999 > 69 71 O 0.38603379028405 0.71342775369201 0.55427548215743 15.999 > 69 72 O 0.88603379028405 0.71342775369201 0.55427548215743 15.999 > 69 73 O 0.12041552064922 0.16961260924804 0.25098320974107 15.999 > 73 74 O 0.62041552064922 0.16961260924804 0.25098320974107 15.999 > 73 75 O 0.12041552064922 0.66961260924804 0.25098320974107 15.999 > 73 76 O 0.62041552064922 0.66961260924804 0.25098320974107 15.999 > 73 77 O 0.11396620971595 0.28657224630799 0.44572451784257 15.999 > 77 78 O 0.61396620971595 0.28657224630799 0.44572451784257 15.999 > 77 79 O 0.11396620971595 0.78657224630799 0.44572451784257 15.999 > 77 80 O 0.61396620971595 0.78657224630799 0.44572451784257 15.999 > 77 81 O 0.11396620971595 0.46342775369201 0.94572451784257 15.999 > 81 82 O 0.61396620971595 0.46342775369201 0.94572451784257 15.999 > 81 83 O 0.11396620971595 0.96342775369201 0.94572451784257 15.999 > 81 84 O 0.61396620971595 0.96342775369201 0.94572451784257 15.999 > 81 85 O 0.09274983458580 0.16852456805804 0.97627295773647 15.999 > 85 86 O 0.59274983458580 0.16852456805804 0.97627295773647 15.999 > 85 87 O 0.09274983458580 0.66852456805804 0.97627295773647 15.999 > 85 88 O 0.59274983458580 0.66852456805804 0.97627295773647 15.999 > 85 89 O 0.37958447935078 0.41961260924804 0.24901679025893 15.999 > 89 90 O 0.87958447935078 0.41961260924804 0.24901679025893 15.999 > 89 91 O 0.37958447935078 0.91961260924804 0.24901679025893 15.999 > 89 92 O 0.87958447935078 0.91961260924804 0.24901679025893 15.999 > 89 93 O 0.38603379028405 0.03657224630799 0.05427548215743 15.999 > 93 94 O 0.88603379028405 0.03657224630799 0.05427548215743 15.999 > 93 95 O 0.38603379028405 0.53657224630799 0.05427548215743 15.999 > 93 96 O 0.88603379028405 0.53657224630799 0.05427548215743 15.999 > 93 97 O 0.40725016541420 0.33147543194196 0.02372704226353 15.999 > 97 98 O 0.90725016541420 0.33147543194196 0.02372704226353 15.999 > 97 99 O 0.40725016541420 0.83147543194196 0.02372704226353 15.999 > 97 100 O 0.90725016541420 0.83147543194196 0.02372704226353 15.999 > 97 101 O 0.37958447935078 0.33038739075196 0.74901679025893 15.999 > 101 102 O 0.87958447935078 0.33038739075196 0.74901679025893 15.999 > 101 103 O 0.37958447935078 0.83038739075196 0.74901679025893 15.999 > 101 104 O 0.87958447935078 0.83038739075196 0.74901679025893 15.999 > 101 105 O 0.11680309905554 0.31966836832566 0.72472898170796 15.999 > 105 106 O 0.61680309905554 0.31966836832566 0.72472898170796 15.999 > 105 107 O 0.11680309905554 0.81966836832566 0.72472898170796 15.999 > 105 108 O 0.61680309905554 0.81966836832566 0.72472898170796 15.999 > 105 109 O 0.09274983458580 0.08147543194196 0.47627295773647 15.999 > 109 110 O 0.59274983458580 0.08147543194196 0.47627295773647 15.999 > 109 111 O 0.09274983458580 0.58147543194196 0.47627295773647 15.999 > 109 112 O 0.59274983458580 0.58147543194196 0.47627295773647 15.999 > 109 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.3106025 0.0000000 0.0239183 0.0000000 3.0779133 0.0000000 0.0239186 0.0000000 3.2323924 -------------------------- Born effective charges -------------------------- 1 Li 0.9988880 0.0001040 -0.0576453 0.0290276 1.1912857 -0.0433680 -0.0632422 0.0284004 1.0492003 2 Li 0.9988880 -0.0001040 -0.0576453 -0.0290276 1.1912857 0.0433680 -0.0632422 -0.0284004 1.0492003 3 Li 0.9988880 0.0001040 -0.0576453 0.0290276 1.1912857 -0.0433680 -0.0632422 0.0284004 1.0492003 4 Li 0.9988880 -0.0001040 -0.0576453 -0.0290276 1.1912857 0.0433680 -0.0632422 -0.0284004 1.0492003 5 Y 3.7807251 -0.1280526 0.0448674 -0.2101549 3.5268662 0.2489707 0.0656183 0.3810886 3.5470442 6 Y 3.7807251 -0.1280526 0.0448674 -0.2101549 3.5268662 0.2489707 0.0656183 0.3810886 3.5470442 7 Y 3.7807251 0.1280526 0.0448674 0.2101549 3.5268662 -0.2489707 0.0656183 -0.3810886 3.5470442 8 Y 3.7807251 0.1280526 0.0448674 0.2101549 3.5268662 -0.2489707 0.0656183 -0.3810886 3.5470442 9 Si 3.3300491 0.1802816 0.0885121 0.0987543 2.3665779 0.1134535 0.0465067 -0.1225595 3.1184032 10 Si 3.3300491 0.1802816 0.0885121 0.0987543 2.3665779 0.1134535 0.0465067 -0.1225595 3.1184032 11 Si 3.3300491 -0.1802816 0.0885121 -0.0987543 2.3665779 -0.1134535 0.0465067 0.1225595 3.1184032 12 Si 3.3300491 -0.1802816 0.0885121 -0.0987543 2.3665779 -0.1134535 0.0465067 0.1225595 3.1184032 13 O -2.5333909 -0.0709630 -0.4703745 -0.0643722 -1.7919391 0.5052492 -0.4751376 0.4578216 -1.7227229 14 O -2.5333909 0.0709630 -0.4703745 0.0643722 -1.7919391 -0.5052492 -0.4751376 -0.4578216 -1.7227229 15 O -1.3440614 -0.1916008 -0.1165725 -0.2249571 -1.8158350 0.0025085 -0.0912016 0.0431731 -2.1149873 16 O -2.3142711 -0.0542162 0.4586965 -0.1004508 -1.7367740 0.5143864 0.4770060 0.5080032 -1.8659214 17 O -2.5333909 -0.0709630 -0.4703745 -0.0643722 -1.7919391 0.5052492 -0.4751376 0.4578216 -1.7227229 18 O -1.9179389 -0.1531502 0.0525162 -0.1552252 -1.7401816 0.0031664 0.0404505 0.0338046 -2.0110162 19 O -2.3142711 0.0542162 0.4586965 0.1004508 -1.7367740 -0.5143864 0.4770060 -0.5080032 -1.8659214 20 O -1.9179389 -0.1531502 0.0525162 -0.1552252 -1.7401816 0.0031664 0.0404505 0.0338046 -2.0110162 21 O -1.9179389 0.1531502 0.0525162 0.1552252 -1.7401816 -0.0031664 0.0404505 -0.0338046 -2.0110162 22 O -1.3440614 0.1916008 -0.1165725 0.2249571 -1.8158350 -0.0025085 -0.0912016 -0.0431731 -2.1149873 23 O -2.3142711 -0.0542162 0.4586965 -0.1004508 -1.7367740 0.5143864 0.4770060 0.5080032 -1.8659214 24 O -1.9179389 0.1531502 0.0525162 0.1552252 -1.7401816 -0.0031664 0.0404505 -0.0338046 -2.0110162 25 O -1.3440614 0.1916008 -0.1165725 0.2249571 -1.8158350 -0.0025085 -0.0912016 -0.0431731 -2.1149873 26 O -2.3142711 0.0542162 0.4586965 0.1004508 -1.7367740 -0.5143864 0.4770060 -0.5080032 -1.8659214 27 O -2.5333909 0.0709630 -0.4703745 0.0643722 -1.7919391 -0.5052492 -0.4751376 -0.4578216 -1.7227229 28 O -1.3440614 -0.1916008 -0.1165725 -0.2249571 -1.8158350 0.0025085 -0.0912016 0.0431731 -2.1149873 ---------------------------------------------------------------------------- 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] [-0.0040 0.0000 0.0092] [ 0.0040 0.0000 -0.0092] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0040 0.0000 0.0092] [ 0.0040 0.0000 -0.0092] 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] [-0.0040 0.0000 0.0092] [ 0.0040 0.0000 -0.0092] 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] [-0.0040 0.0000 0.0092] [ 0.0040 0.0000 -0.0092] Computing fc3[ 57, 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] [-0.0040 0.0000 0.0092] [ 0.0040 0.0000 -0.0092] Computing fc3[ 61, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0040 0.0000 0.0092] [ 0.0040 0.0000 -0.0092] 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] [-0.0040 0.0000 0.0092] [ 0.0040 0.0000 -0.0092] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000001 (zzz) 0.00000001 (zzz) 0.00000001 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000001 (yx) -0.00000001 (yx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 14:34:09]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 14:34:09]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 2 1] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.392238050282745 0.000000000000000 0.000000000000000 b 0.000000000000000 6.163597620000002 0.000000000000000 c -4.317918974199862 0.000000000000000 9.893519258797626 Atomic positions (fractional): 1 Li 0.08100164894105 0.86609823002144 0.43095387895144 6.941 2 Li 0.91899835105895 0.36609823002144 0.06904612104856 6.941 3 Li 0.91899835105895 0.13390176997856 0.56904612104856 6.941 4 Li 0.08100164894105 0.63390176997856 0.93095387895144 6.941 5 Y 0.55330550683912 0.88238955900116 0.84771151599436 88.906 6 Y 0.44669449316088 0.11761044099884 0.15228848400564 88.906 7 Y 0.44669449316088 0.38238955900116 0.65228848400564 88.906 8 Y 0.55330550683912 0.61761044099884 0.34771151599436 88.906 9 Si 0.09483041647742 0.34925783385222 0.35882894081006 28.085 10 Si 0.90516958352258 0.65074216614778 0.64117105918994 28.085 11 Si 0.90516958352258 0.84925783385222 0.14117105918994 28.085 12 Si 0.09483041647742 0.15074216614777 0.85882894081006 28.085 13 O 0.76639380188892 0.13933673665132 0.77527101829204 15.999 14 O 0.76639380188892 0.36066326334868 0.27527101829204 15.999 15 O 0.81450033082841 0.83704913611608 0.52372704226353 15.999 16 O 0.24083104129844 0.16077478150393 0.75098320974107 15.999 17 O 0.23360619811108 0.86066326334868 0.22472898170796 15.999 18 O 0.77206758056811 0.42685550738401 0.55427548215743 15.999 19 O 0.24083104129844 0.33922521849607 0.25098320974107 15.999 20 O 0.22793241943189 0.57314449261599 0.44572451784257 15.999 21 O 0.22793241943189 0.92685550738401 0.94572451784257 15.999 22 O 0.18549966917159 0.33704913611608 0.97627295773647 15.999 23 O 0.75916895870156 0.83922521849607 0.24901679025893 15.999 24 O 0.77206758056811 0.07314449261599 0.05427548215743 15.999 25 O 0.81450033082841 0.66295086388392 0.02372704226353 15.999 26 O 0.75916895870156 0.66077478150393 0.74901679025893 15.999 27 O 0.23360619811108 0.63933673665132 0.72472898170796 15.999 28 O 0.18549966917159 0.16295086388392 0.47627295773647 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.784476100565490 0.000000000000000 0.000000000000000 b 0.000000000000000 12.327195240000004 0.000000000000000 c -4.317918974199862 0.000000000000000 9.893519258797626 Atomic positions (fractional): 1 Li 0.04050082447053 0.43304911501072 0.43095387895144 6.941 > 1 2 Li 0.54050082447053 0.43304911501072 0.43095387895144 6.941 > 1 3 Li 0.04050082447053 0.93304911501072 0.43095387895144 6.941 > 1 4 Li 0.54050082447053 0.93304911501072 0.43095387895144 6.941 > 1 5 Li 0.45949917552947 0.18304911501072 0.06904612104856 6.941 > 5 6 Li 0.95949917552947 0.18304911501072 0.06904612104856 6.941 > 5 7 Li 0.45949917552947 0.68304911501072 0.06904612104856 6.941 > 5 8 Li 0.95949917552947 0.68304911501072 0.06904612104856 6.941 > 5 9 Li 0.45949917552947 0.06695088498928 0.56904612104856 6.941 > 9 10 Li 0.95949917552947 0.06695088498928 0.56904612104856 6.941 > 9 11 Li 0.45949917552947 0.56695088498928 0.56904612104856 6.941 > 9 12 Li 0.95949917552947 0.56695088498928 0.56904612104856 6.941 > 9 13 Li 0.04050082447053 0.31695088498928 0.93095387895144 6.941 > 13 14 Li 0.54050082447053 0.31695088498928 0.93095387895144 6.941 > 13 15 Li 0.04050082447053 0.81695088498928 0.93095387895144 6.941 > 13 16 Li 0.54050082447053 0.81695088498928 0.93095387895144 6.941 > 13 17 Y 0.27665275341956 0.44119477950058 0.84771151599436 88.906 > 17 18 Y 0.77665275341956 0.44119477950058 0.84771151599436 88.906 > 17 19 Y 0.27665275341956 0.94119477950058 0.84771151599436 88.906 > 17 20 Y 0.77665275341956 0.94119477950058 0.84771151599436 88.906 > 17 21 Y 0.22334724658044 0.05880522049942 0.15228848400564 88.906 > 21 22 Y 0.72334724658044 0.05880522049942 0.15228848400564 88.906 > 21 23 Y 0.22334724658044 0.55880522049942 0.15228848400564 88.906 > 21 24 Y 0.72334724658044 0.55880522049942 0.15228848400564 88.906 > 21 25 Y 0.22334724658044 0.19119477950058 0.65228848400564 88.906 > 25 26 Y 0.72334724658044 0.19119477950058 0.65228848400564 88.906 > 25 27 Y 0.22334724658044 0.69119477950058 0.65228848400564 88.906 > 25 28 Y 0.72334724658044 0.69119477950058 0.65228848400564 88.906 > 25 29 Y 0.27665275341956 0.30880522049942 0.34771151599436 88.906 > 29 30 Y 0.77665275341956 0.30880522049942 0.34771151599436 88.906 > 29 31 Y 0.27665275341956 0.80880522049942 0.34771151599436 88.906 > 29 32 Y 0.77665275341956 0.80880522049942 0.34771151599436 88.906 > 29 33 Si 0.04741520823871 0.17462891692611 0.35882894081006 28.085 > 33 34 Si 0.54741520823871 0.17462891692611 0.35882894081006 28.085 > 33 35 Si 0.04741520823871 0.67462891692611 0.35882894081006 28.085 > 33 36 Si 0.54741520823871 0.67462891692611 0.35882894081006 28.085 > 33 37 Si 0.45258479176129 0.32537108307389 0.64117105918994 28.085 > 37 38 Si 0.95258479176129 0.32537108307389 0.64117105918994 28.085 > 37 39 Si 0.45258479176129 0.82537108307389 0.64117105918994 28.085 > 37 40 Si 0.95258479176129 0.82537108307389 0.64117105918994 28.085 > 37 41 Si 0.45258479176129 0.42462891692611 0.14117105918994 28.085 > 41 42 Si 0.95258479176129 0.42462891692611 0.14117105918994 28.085 > 41 43 Si 0.45258479176129 0.92462891692611 0.14117105918994 28.085 > 41 44 Si 0.95258479176129 0.92462891692611 0.14117105918994 28.085 > 41 45 Si 0.04741520823871 0.07537108307389 0.85882894081006 28.085 > 45 46 Si 0.54741520823871 0.07537108307389 0.85882894081006 28.085 > 45 47 Si 0.04741520823871 0.57537108307389 0.85882894081006 28.085 > 45 48 Si 0.54741520823871 0.57537108307389 0.85882894081006 28.085 > 45 49 O 0.38319690094446 0.06966836832566 0.77527101829204 15.999 > 49 50 O 0.88319690094446 0.06966836832566 0.77527101829204 15.999 > 49 51 O 0.38319690094446 0.56966836832566 0.77527101829204 15.999 > 49 52 O 0.88319690094446 0.56966836832566 0.77527101829204 15.999 > 49 53 O 0.38319690094446 0.18033163167434 0.27527101829204 15.999 > 53 54 O 0.88319690094446 0.18033163167434 0.27527101829204 15.999 > 53 55 O 0.38319690094446 0.68033163167434 0.27527101829204 15.999 > 53 56 O 0.88319690094446 0.68033163167434 0.27527101829204 15.999 > 53 57 O 0.40725016541420 0.41852456805804 0.52372704226353 15.999 > 57 58 O 0.90725016541420 0.41852456805804 0.52372704226353 15.999 > 57 59 O 0.40725016541420 0.91852456805804 0.52372704226353 15.999 > 57 60 O 0.90725016541420 0.91852456805804 0.52372704226353 15.999 > 57 61 O 0.12041552064922 0.08038739075196 0.75098320974107 15.999 > 61 62 O 0.62041552064922 0.08038739075196 0.75098320974107 15.999 > 61 63 O 0.12041552064922 0.58038739075196 0.75098320974107 15.999 > 61 64 O 0.62041552064922 0.58038739075196 0.75098320974107 15.999 > 61 65 O 0.11680309905554 0.43033163167434 0.22472898170796 15.999 > 65 66 O 0.61680309905554 0.43033163167434 0.22472898170796 15.999 > 65 67 O 0.11680309905554 0.93033163167434 0.22472898170796 15.999 > 65 68 O 0.61680309905554 0.93033163167434 0.22472898170796 15.999 > 65 69 O 0.38603379028405 0.21342775369201 0.55427548215743 15.999 > 69 70 O 0.88603379028405 0.21342775369201 0.55427548215743 15.999 > 69 71 O 0.38603379028405 0.71342775369201 0.55427548215743 15.999 > 69 72 O 0.88603379028405 0.71342775369201 0.55427548215743 15.999 > 69 73 O 0.12041552064922 0.16961260924804 0.25098320974107 15.999 > 73 74 O 0.62041552064922 0.16961260924804 0.25098320974107 15.999 > 73 75 O 0.12041552064922 0.66961260924804 0.25098320974107 15.999 > 73 76 O 0.62041552064922 0.66961260924804 0.25098320974107 15.999 > 73 77 O 0.11396620971595 0.28657224630799 0.44572451784257 15.999 > 77 78 O 0.61396620971595 0.28657224630799 0.44572451784257 15.999 > 77 79 O 0.11396620971595 0.78657224630799 0.44572451784257 15.999 > 77 80 O 0.61396620971595 0.78657224630799 0.44572451784257 15.999 > 77 81 O 0.11396620971595 0.46342775369201 0.94572451784257 15.999 > 81 82 O 0.61396620971595 0.46342775369201 0.94572451784257 15.999 > 81 83 O 0.11396620971595 0.96342775369201 0.94572451784257 15.999 > 81 84 O 0.61396620971595 0.96342775369201 0.94572451784257 15.999 > 81 85 O 0.09274983458580 0.16852456805804 0.97627295773647 15.999 > 85 86 O 0.59274983458580 0.16852456805804 0.97627295773647 15.999 > 85 87 O 0.09274983458580 0.66852456805804 0.97627295773647 15.999 > 85 88 O 0.59274983458580 0.66852456805804 0.97627295773647 15.999 > 85 89 O 0.37958447935078 0.41961260924804 0.24901679025893 15.999 > 89 90 O 0.87958447935078 0.41961260924804 0.24901679025893 15.999 > 89 91 O 0.37958447935078 0.91961260924804 0.24901679025893 15.999 > 89 92 O 0.87958447935078 0.91961260924804 0.24901679025893 15.999 > 89 93 O 0.38603379028405 0.03657224630799 0.05427548215743 15.999 > 93 94 O 0.88603379028405 0.03657224630799 0.05427548215743 15.999 > 93 95 O 0.38603379028405 0.53657224630799 0.05427548215743 15.999 > 93 96 O 0.88603379028405 0.53657224630799 0.05427548215743 15.999 > 93 97 O 0.40725016541420 0.33147543194196 0.02372704226353 15.999 > 97 98 O 0.90725016541420 0.33147543194196 0.02372704226353 15.999 > 97 99 O 0.40725016541420 0.83147543194196 0.02372704226353 15.999 > 97 100 O 0.90725016541420 0.83147543194196 0.02372704226353 15.999 > 97 101 O 0.37958447935078 0.33038739075196 0.74901679025893 15.999 > 101 102 O 0.87958447935078 0.33038739075196 0.74901679025893 15.999 > 101 103 O 0.37958447935078 0.83038739075196 0.74901679025893 15.999 > 101 104 O 0.87958447935078 0.83038739075196 0.74901679025893 15.999 > 101 105 O 0.11680309905554 0.31966836832566 0.72472898170796 15.999 > 105 106 O 0.61680309905554 0.31966836832566 0.72472898170796 15.999 > 105 107 O 0.11680309905554 0.81966836832566 0.72472898170796 15.999 > 105 108 O 0.61680309905554 0.81966836832566 0.72472898170796 15.999 > 105 109 O 0.09274983458580 0.08147543194196 0.47627295773647 15.999 > 109 110 O 0.59274983458580 0.08147543194196 0.47627295773647 15.999 > 109 111 O 0.09274983458580 0.58147543194196 0.47627295773647 15.999 > 109 112 O 0.59274983458580 0.58147543194196 0.47627295773647 15.999 > 109 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.3106025 0.0000000 0.0239183 0.0000000 3.0779133 0.0000000 0.0239186 0.0000000 3.2323924 -------------------------- Born effective charges -------------------------- 1 Li 0.9988880 0.0001040 -0.0576453 0.0290276 1.1912857 -0.0433680 -0.0632422 0.0284004 1.0492003 2 Li 0.9988880 -0.0001040 -0.0576453 -0.0290276 1.1912857 0.0433680 -0.0632422 -0.0284004 1.0492003 3 Li 0.9988880 0.0001040 -0.0576453 0.0290276 1.1912857 -0.0433680 -0.0632422 0.0284004 1.0492003 4 Li 0.9988880 -0.0001040 -0.0576453 -0.0290276 1.1912857 0.0433680 -0.0632422 -0.0284004 1.0492003 5 Y 3.7807251 -0.1280526 0.0448674 -0.2101549 3.5268662 0.2489707 0.0656183 0.3810886 3.5470442 6 Y 3.7807251 -0.1280526 0.0448674 -0.2101549 3.5268662 0.2489707 0.0656183 0.3810886 3.5470442 7 Y 3.7807251 0.1280526 0.0448674 0.2101549 3.5268662 -0.2489707 0.0656183 -0.3810886 3.5470442 8 Y 3.7807251 0.1280526 0.0448674 0.2101549 3.5268662 -0.2489707 0.0656183 -0.3810886 3.5470442 9 Si 3.3300491 0.1802816 0.0885121 0.0987543 2.3665779 0.1134535 0.0465067 -0.1225595 3.1184032 10 Si 3.3300491 0.1802816 0.0885121 0.0987543 2.3665779 0.1134535 0.0465067 -0.1225595 3.1184032 11 Si 3.3300491 -0.1802816 0.0885121 -0.0987543 2.3665779 -0.1134535 0.0465067 0.1225595 3.1184032 12 Si 3.3300491 -0.1802816 0.0885121 -0.0987543 2.3665779 -0.1134535 0.0465067 0.1225595 3.1184032 13 O -2.5333909 -0.0709630 -0.4703745 -0.0643722 -1.7919391 0.5052492 -0.4751376 0.4578216 -1.7227229 14 O -2.5333909 0.0709630 -0.4703745 0.0643722 -1.7919391 -0.5052492 -0.4751376 -0.4578216 -1.7227229 15 O -1.3440614 -0.1916008 -0.1165725 -0.2249571 -1.8158350 0.0025085 -0.0912016 0.0431731 -2.1149873 16 O -2.3142711 -0.0542162 0.4586965 -0.1004508 -1.7367740 0.5143864 0.4770060 0.5080032 -1.8659214 17 O -2.5333909 -0.0709630 -0.4703745 -0.0643722 -1.7919391 0.5052492 -0.4751376 0.4578216 -1.7227229 18 O -1.9179389 -0.1531502 0.0525162 -0.1552252 -1.7401816 0.0031664 0.0404505 0.0338046 -2.0110162 19 O -2.3142711 0.0542162 0.4586965 0.1004508 -1.7367740 -0.5143864 0.4770060 -0.5080032 -1.8659214 20 O -1.9179389 -0.1531502 0.0525162 -0.1552252 -1.7401816 0.0031664 0.0404505 0.0338046 -2.0110162 21 O -1.9179389 0.1531502 0.0525162 0.1552252 -1.7401816 -0.0031664 0.0404505 -0.0338046 -2.0110162 22 O -1.3440614 0.1916008 -0.1165725 0.2249571 -1.8158350 -0.0025085 -0.0912016 -0.0431731 -2.1149873 23 O -2.3142711 -0.0542162 0.4586965 -0.1004508 -1.7367740 0.5143864 0.4770060 0.5080032 -1.8659214 24 O -1.9179389 0.1531502 0.0525162 0.1552252 -1.7401816 -0.0031664 0.0404505 -0.0338046 -2.0110162 25 O -1.3440614 0.1916008 -0.1165725 0.2249571 -1.8158350 -0.0025085 -0.0912016 -0.0431731 -2.1149873 26 O -2.3142711 0.0542162 0.4586965 0.1004508 -1.7367740 -0.5143864 0.4770060 -0.5080032 -1.8659214 27 O -2.5333909 0.0709630 -0.4703745 0.0643722 -1.7919391 -0.5052492 -0.4751376 -0.4578216 -1.7227229 28 O -1.3440614 -0.1916008 -0.1165725 -0.2249571 -1.8158350 0.0025085 -0.0912016 0.0431731 -2.1149873 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000001 (zzz) 0.00000001 (zzz) 0.00000001 (zzz) Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 10 8 5 ] 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: 0.60, Number of G-points: 303, Lambda: 0.11 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/130) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.463 ( 0.000 0.000 0.000) 0.000 2.717 ( 0.000 0.000 0.000) 0.000 4.066 ( 0.000 0.000 0.000) 0.000 4.234 ( 0.000 0.000 0.000) 0.000 4.238 ( 0.000 0.000 0.000) 0.000 4.739 ( 0.000 0.000 0.000) 0.000 5.047 ( 0.000 0.000 0.000) 0.000 5.067 ( 0.000 0.000 0.000) 0.000 5.327 ( 0.000 0.000 0.000) 0.000 5.425 ( 0.000 0.000 0.000) 0.000 5.496 ( 0.000 0.000 0.000) 0.000 5.925 ( 0.000 0.000 0.000) 0.000 6.243 ( 0.000 0.000 0.000) 0.000 6.585 ( 0.000 0.000 0.000) 0.000 6.768 ( 0.000 0.000 0.000) 0.000 6.769 ( 0.000 0.000 0.000) 0.000 6.865 ( 0.000 0.000 0.000) 0.000 7.063 ( 0.000 0.000 0.000) 0.000 7.085 ( 0.000 0.000 0.000) 0.000 7.512 ( 0.000 0.000 0.000) 0.000 7.691 ( 0.000 0.000 0.000) 0.000 7.926 ( 0.000 0.000 0.000) 0.000 7.945 ( 0.000 0.000 0.000) 0.000 8.073 ( 0.000 0.000 0.000) 0.000 8.084 ( 0.000 0.000 0.000) 0.000 8.344 ( 0.000 0.000 0.000) 0.000 8.413 ( 0.000 0.000 0.000) 0.000 8.617 ( 0.000 0.000 0.000) 0.000 8.635 ( 0.000 0.000 0.000) 0.000 8.805 ( 0.000 0.000 0.000) 0.000 9.328 ( 0.000 0.000 0.000) 0.000 9.476 ( 0.000 0.000 0.000) 0.000 9.737 ( 0.000 0.000 0.000) 0.000 9.827 ( 0.000 0.000 0.000) 0.000 9.906 ( 0.000 0.000 0.000) 0.000 10.126 ( 0.000 0.000 0.000) 0.000 10.491 ( 0.000 0.000 0.000) 0.000 10.520 ( 0.000 0.000 0.000) 0.000 10.824 ( 0.000 0.000 0.000) 0.000 10.869 ( 0.000 0.000 0.000) 0.000 11.132 ( 0.000 0.000 0.000) 0.000 11.268 ( 0.000 0.000 0.000) 0.000 11.372 ( 0.000 0.000 0.000) 0.000 12.071 ( 0.000 0.000 0.000) 0.000 12.219 ( 0.000 0.000 0.000) 0.000 12.812 ( 0.000 0.000 0.000) 0.000 13.384 ( 0.000 0.000 0.000) 0.000 13.679 ( 0.000 0.000 0.000) 0.000 13.806 ( 0.000 0.000 0.000) 0.000 13.898 ( 0.000 0.000 0.000) 0.000 14.399 ( 0.000 0.000 0.000) 0.000 14.413 ( 0.000 0.000 0.000) 0.000 14.489 ( 0.000 0.000 0.000) 0.000 14.916 ( 0.000 0.000 0.000) 0.000 15.075 ( 0.000 0.000 0.000) 0.000 15.393 ( 0.000 0.000 0.000) 0.000 15.698 ( 0.000 0.000 0.000) 0.000 15.761 ( 0.000 0.000 0.000) 0.000 15.956 ( 0.000 0.000 0.000) 0.000 16.260 ( 0.000 0.000 0.000) 0.000 16.384 ( 0.000 0.000 0.000) 0.000 17.161 ( 0.000 0.000 0.000) 0.000 17.567 ( 0.000 0.000 0.000) 0.000 17.651 ( 0.000 0.000 0.000) 0.000 18.018 ( 0.000 0.000 0.000) 0.000 24.357 ( 0.000 0.000 0.000) 0.000 24.468 ( 0.000 0.000 0.000) 0.000 24.804 ( 0.000 0.000 0.000) 0.000 24.820 ( 0.000 0.000 0.000) 0.000 25.019 ( 0.000 0.000 0.000) 0.000 25.615 ( 0.000 0.000 0.000) 0.000 25.652 ( 0.000 0.000 0.000) 0.000 25.874 ( 0.000 0.000 0.000) 0.000 26.508 ( 0.000 0.000 0.000) 0.000 26.655 ( 0.000 0.000 0.000) 0.000 26.678 ( 0.000 0.000 0.000) 0.000 26.889 ( 0.000 0.000 0.000) 0.000 27.619 ( 0.000 0.000 0.000) 0.000 28.017 ( 0.000 0.000 0.000) 0.000 29.259 ( 0.000 0.000 0.000) 0.000 29.490 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/130) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.763 ( 36.835 0.000 8.941) 37.905 0.820 ( 29.552 0.000 32.022) 43.574 1.548 ( 70.214 0.000 24.751) 74.449 2.501 ( 5.749 0.000 -3.795) 6.889 3.003 ( 31.202 0.000 -11.672) 33.314 4.016 ( -3.243 0.000 -0.401) 3.268 4.158 ( -3.359 0.000 -1.473) 3.668 4.379 ( 7.055 0.000 6.927) 9.888 4.726 ( 0.317 0.000 -3.659) 3.673 4.922 ( -4.411 0.000 -15.598) 16.210 5.070 ( -4.418 0.000 9.947) 10.884 5.240 ( -7.472 0.000 -4.686) 8.820 5.539 ( 5.117 0.000 9.106) 10.445 5.551 ( 6.879 0.000 -3.966) 7.940 5.897 ( -3.365 0.000 -4.857) 5.909 6.311 ( 5.922 0.000 0.752) 5.969 6.464 ( -13.263 0.000 1.438) 13.341 6.671 ( -6.895 0.000 7.264) 10.015 6.757 ( -6.061 0.000 3.922) 7.219 6.810 ( -5.480 0.000 2.711) 6.114 7.116 ( 6.133 0.000 -7.852) 9.964 7.147 ( 9.507 0.000 -8.876) 13.006 7.562 ( 1.054 0.000 2.882) 3.069 7.728 ( 5.198 0.000 -2.945) 5.974 7.942 ( -0.279 0.000 -1.034) 1.071 7.983 ( 4.956 0.000 -1.360) 5.139 8.067 ( 1.296 0.000 -3.044) 3.309 8.327 ( -0.955 0.000 1.420) 1.712 8.469 ( -6.418 0.000 -6.905) 9.427 8.492 ( 1.465 0.000 11.459) 11.553 8.617 ( 3.598 0.000 -6.476) 7.408 8.739 ( 13.450 0.000 -19.318) 23.539 9.322 ( -2.196 0.000 1.342) 2.574 9.416 ( 6.125 0.000 -19.603) 20.537 9.499 ( 2.759 0.000 2.247) 3.558 9.848 ( 1.274 0.000 -0.718) 1.462 10.021 ( 8.694 0.000 1.060) 8.758 10.091 ( -3.453 0.000 -1.615) 3.812 10.313 ( 0.449 0.000 0.938) 1.040 10.518 ( 1.397 0.000 -0.632) 1.533 10.808 ( -1.981 0.000 0.919) 2.184 10.899 ( 1.700 0.000 2.151) 2.742 11.125 ( 7.057 0.000 -3.361) 7.816 11.188 ( -10.652 0.000 1.242) 10.724 11.333 ( 0.192 0.000 -2.647) 2.654 11.985 ( -10.078 0.000 -5.523) 11.492 12.173 ( 8.869 0.000 2.452) 9.202 12.271 ( 4.680 0.000 0.458) 4.703 12.818 ( -0.494 0.000 2.622) 2.669 13.255 ( -8.580 0.000 -9.243) 12.612 13.703 ( -0.198 0.000 4.460) 4.464 13.864 ( -2.179 0.000 -2.890) 3.619 13.877 ( 3.534 0.000 5.075) 6.185 14.356 ( -5.596 0.000 1.203) 5.723 14.426 ( 0.487 0.000 -2.662) 2.706 14.518 ( 2.444 0.000 3.918) 4.618 14.909 ( 1.656 0.000 -10.015) 10.151 15.066 ( -0.789 0.000 -1.046) 1.310 15.536 ( 10.608 0.000 4.571) 11.551 15.704 ( -0.051 0.000 0.952) 0.953 15.772 ( 2.064 0.000 -1.901) 2.806 16.305 ( 4.435 0.000 0.847) 4.516 16.380 ( -0.640 0.000 0.848) 1.062 16.836 ( -24.596 0.000 56.414) 61.543 17.109 ( -1.351 0.000 -7.990) 8.103 17.596 ( -4.869 0.000 -2.503) 5.475 17.601 ( -0.043 0.000 6.586) 6.586 17.971 ( -4.645 0.000 -0.657) 4.691 24.344 ( -0.782 0.000 -0.524) 0.942 24.478 ( 1.257 0.000 -0.858) 1.521 24.797 ( -2.116 0.000 -0.364) 2.147 24.840 ( 1.182 0.000 1.081) 1.602 24.999 ( -1.431 0.000 -0.850) 1.664 25.573 ( -6.102 0.000 3.527) 7.048 25.674 ( 3.815 0.000 -8.838) 9.626 25.893 ( 0.284 0.000 2.167) 2.186 26.575 ( 7.694 0.000 -2.268) 8.021 26.729 ( 4.797 0.000 1.857) 5.144 26.962 ( 8.385 0.000 -1.289) 8.484 27.245 ( 14.729 0.000 -33.150) 36.275 28.005 ( -3.202 0.000 4.401) 5.442 29.171 ( -3.016 0.000 -15.116) 15.414 29.456 ( -7.350 0.000 10.417) 12.749 30.338 ( -5.116 0.000 11.918) 12.970 ======================= Grid point 2 (3/130) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.498 ( 34.478 0.000 8.005) 35.395 1.600 ( 27.456 0.000 28.997) 39.933 2.605 ( 10.755 0.000 -6.214) 12.422 2.965 ( 58.715 0.000 24.539) 63.636 3.337 ( 13.439 0.000 -26.753) 29.938 4.062 ( -7.617 0.000 2.118) 7.906 4.150 ( 17.674 0.000 6.722) 18.910 4.562 ( 7.805 0.000 -6.341) 10.057 4.733 ( 2.675 0.000 7.029) 7.521 4.743 ( 1.770 0.000 -13.690) 13.804 5.012 ( -11.681 0.000 -8.956) 14.719 5.091 ( -3.366 0.000 13.974) 14.374 5.558 ( -11.033 0.000 -6.953) 13.041 5.648 ( 5.389 0.000 -2.143) 5.800 5.802 ( 1.425 0.000 3.732) 3.995 6.179 ( -17.989 0.000 3.831) 18.392 6.337 ( -7.213 0.000 0.547) 7.233 6.665 ( -3.317 0.000 10.041) 10.575 6.719 ( -3.317 0.000 -4.719) 5.768 6.743 ( 4.966 0.000 4.847) 6.940 7.150 ( 4.457 0.000 -7.374) 8.616 7.253 ( 10.655 0.000 -12.635) 16.528 7.663 ( 4.485 0.000 9.061) 10.110 7.829 ( 7.002 0.000 -1.319) 7.125 7.882 ( -5.568 0.000 -2.173) 5.977 7.993 ( -0.668 0.000 -0.642) 0.926 8.177 ( 8.726 0.000 2.186) 8.996 8.306 ( -2.566 0.000 -7.750) 8.164 8.365 ( 5.560 0.000 -0.879) 5.629 8.607 ( -1.640 0.000 15.712) 15.798 8.640 ( 3.834 0.000 -5.289) 6.533 8.849 ( 10.889 0.000 -9.276) 14.305 9.260 ( -1.871 0.000 -5.413) 5.727 9.404 ( 3.516 0.000 -8.534) 9.230 9.625 ( 6.029 0.000 6.106) 8.581 9.850 ( -0.042 0.000 -3.988) 3.989 9.984 ( -5.632 0.000 -1.022) 5.724 10.149 ( 5.949 0.000 -3.292) 6.799 10.319 ( -0.190 0.000 -0.588) 0.618 10.589 ( 5.503 0.000 1.287) 5.652 10.784 ( -1.518 0.000 2.179) 2.656 10.928 ( -6.840 0.000 2.842) 7.407 10.980 ( -6.474 0.000 5.013) 8.188 11.250 ( 6.668 0.000 -0.279) 6.674 11.339 ( 3.376 0.000 -6.207) 7.065 11.702 ( -12.723 0.000 -7.656) 14.849 12.395 ( 11.119 0.000 3.442) 11.640 12.397 ( 8.288 0.000 0.698) 8.317 12.836 ( -0.655 0.000 4.508) 4.555 12.970 ( -11.564 0.000 -10.954) 15.928 13.714 ( -3.569 0.000 5.188) 6.297 13.783 ( -3.148 0.000 -4.063) 5.140 13.948 ( 0.149 0.000 2.957) 2.961 14.208 ( -10.776 0.000 0.721) 10.800 14.409 ( -1.549 0.000 0.966) 1.826 14.679 ( 8.182 0.000 11.452) 14.075 14.908 ( 4.521 0.000 -4.788) 6.585 15.016 ( -2.963 0.000 -2.936) 4.171 15.693 ( -1.078 0.000 -1.515) 1.859 15.788 ( 11.774 0.000 4.031) 12.445 15.810 ( 3.058 0.000 -0.694) 3.136 16.379 ( -0.491 0.000 2.049) 2.107 16.430 ( 7.921 0.000 0.459) 7.934 16.837 ( -11.304 0.000 26.183) 28.519 17.011 ( -1.206 0.000 -9.395) 9.472 17.432 ( -9.216 0.000 -5.521) 10.743 17.646 ( -1.830 0.000 7.875) 8.085 17.846 ( -7.599 0.000 -1.439) 7.734 24.333 ( 0.268 0.000 -0.312) 0.411 24.492 ( 1.347 0.000 -2.333) 2.694 24.748 ( -3.683 0.000 2.497) 4.450 24.854 ( -1.337 0.000 0.769) 1.543 24.977 ( 0.891 0.000 -1.025) 1.358 25.495 ( -4.688 0.000 2.664) 5.392 25.652 ( -0.356 0.000 -4.095) 4.110 25.879 ( -4.693 0.000 2.772) 5.451 26.728 ( 11.011 0.000 -4.446) 11.875 26.885 ( 9.321 0.000 3.445) 9.938 27.164 ( 13.227 0.000 -0.168) 13.228 27.252 ( 7.276 0.000 -15.638) 17.248 27.971 ( -5.572 0.000 7.478) 9.325 28.911 ( -10.198 0.000 -17.189) 19.986 29.420 ( -4.363 0.000 9.031) 10.030 30.340 ( -1.305 0.000 3.084) 3.349 ======================= Grid point 3 (4/130) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.145 ( 28.471 0.000 5.572) 29.011 2.285 ( 22.526 0.000 24.035) 32.941 2.769 ( 12.282 0.000 -5.955) 13.650 3.247 ( 5.691 0.000 -23.888) 24.556 3.878 ( -6.828 0.000 3.781) 7.805 4.131 ( 38.654 0.000 18.812) 42.989 4.293 ( -3.750 0.000 -3.278) 4.980 4.541 ( 0.659 0.000 -8.791) 8.816 4.569 ( -23.475 0.000 -12.606) 26.646 4.911 ( 5.213 0.000 5.865) 7.847 5.103 ( 26.181 0.000 1.627) 26.232 5.165 ( -0.579 0.000 11.416) 11.431 5.215 ( -7.816 0.000 -10.078) 12.754 5.695 ( -0.980 0.000 2.070) 2.290 5.897 ( 3.691 0.000 0.423) 3.715 5.933 ( -10.104 0.000 6.711) 12.130 6.131 ( -12.396 0.000 2.843) 12.718 6.651 ( 1.500 0.000 -6.186) 6.366 6.698 ( -2.164 0.000 7.441) 7.749 6.910 ( 8.004 0.000 1.921) 8.231 7.177 ( 3.366 0.000 -2.609) 4.259 7.333 ( 7.866 0.000 -10.118) 12.816 7.696 ( -8.457 0.000 0.766) 8.492 7.862 ( 4.650 0.000 6.674) 8.134 7.920 ( 1.096 0.000 2.152) 2.415 8.011 ( 4.297 0.000 -1.106) 4.437 8.263 ( 4.715 0.000 -8.940) 10.107 8.375 ( 4.029 0.000 14.185) 14.746 8.516 ( 13.347 0.000 -7.744) 15.430 8.668 ( 3.627 0.000 -5.201) 6.341 8.675 ( -2.756 0.000 12.548) 12.847 8.982 ( 9.100 0.000 -6.054) 10.930 9.192 ( 0.796 0.000 -8.312) 8.350 9.352 ( -4.356 0.000 -4.826) 6.501 9.733 ( -6.224 0.000 -9.920) 11.711 9.757 ( 5.017 0.000 -2.291) 5.515 9.931 ( -1.792 0.000 8.286) 8.477 10.233 ( 5.986 0.000 -1.242) 6.113 10.317 ( 1.645 0.000 -2.090) 2.660 10.640 ( -8.933 0.000 6.501) 11.049 10.784 ( -0.075 0.000 1.482) 1.484 10.814 ( 2.122 0.000 2.584) 3.344 11.009 ( 1.479 0.000 1.792) 2.323 11.285 ( -2.906 0.000 -6.567) 7.181 11.339 ( 2.110 0.000 -6.963) 7.275 11.496 ( -3.113 0.000 0.714) 3.194 12.524 ( -2.348 0.000 -3.383) 4.118 12.572 ( 8.681 0.000 1.371) 8.788 12.791 ( 3.478 0.000 -1.000) 3.619 12.873 ( 0.501 0.000 5.822) 5.844 13.636 ( -7.938 0.000 2.444) 8.306 13.694 ( -2.834 0.000 -3.594) 4.577 13.965 ( 0.619 0.000 1.368) 1.501 13.993 ( -11.460 0.000 -1.201) 11.522 14.387 ( -1.811 0.000 1.287) 2.222 14.909 ( -1.407 0.000 -7.038) 7.178 14.974 ( 4.518 0.000 -1.150) 4.662 14.975 ( 6.480 0.000 19.592) 20.636 15.641 ( -2.815 0.000 -1.863) 3.375 15.870 ( 3.749 0.000 0.201) 3.754 16.003 ( 8.201 0.000 1.310) 8.304 16.411 ( 1.901 0.000 3.789) 4.239 16.566 ( 6.939 0.000 -5.020) 8.565 16.840 ( -6.929 0.000 16.194) 17.614 16.922 ( -0.076 0.000 -9.318) 9.318 17.189 ( -10.420 0.000 -6.008) 12.028 17.655 ( -3.223 0.000 6.064) 6.868 17.684 ( -7.964 0.000 -1.860) 8.178 24.355 ( 2.047 0.000 0.437) 2.093 24.482 ( 0.007 0.000 -3.036) 3.036 24.714 ( -2.551 0.000 3.476) 4.312 24.799 ( -4.035 0.000 -0.722) 4.099 25.027 ( 4.732 0.000 -0.254) 4.739 25.450 ( -1.636 0.000 0.971) 1.903 25.601 ( -2.843 0.000 -0.728) 2.935 25.760 ( -9.744 0.000 1.791) 9.907 26.890 ( 10.202 0.000 -5.220) 11.460 27.100 ( 9.604 0.000 3.904) 10.368 27.261 ( 4.482 0.000 -9.057) 10.106 27.417 ( 12.394 0.000 2.457) 12.635 27.923 ( -6.259 0.000 8.123) 10.255 28.552 ( -13.605 0.000 -14.684) 20.018 29.452 ( 1.355 0.000 5.509) 5.673 30.339 ( -0.130 0.000 0.112) 0.172 ======================= Grid point 4 (5/130) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.618 ( 19.121 0.000 2.611) 19.299 2.754 ( 10.359 0.000 9.381) 13.976 2.994 ( 14.420 0.000 4.978) 15.255 3.266 ( 12.683 0.000 -14.486) 19.253 3.689 ( -9.675 0.000 -4.975) 10.879 3.937 ( -27.401 0.000 -12.367) 30.062 4.262 ( 0.156 0.000 4.119) 4.122 4.519 ( 4.082 0.000 -4.436) 6.028 4.778 ( 5.258 0.000 10.680) 11.904 4.808 ( -17.895 0.000 -7.260) 19.311 4.984 ( 7.107 0.000 2.566) 7.556 5.219 ( -0.640 0.000 4.828) 4.870 5.699 ( -0.590 0.000 10.670) 10.687 5.723 ( 22.247 0.000 4.888) 22.778 5.847 ( -6.772 0.000 -0.214) 6.775 5.933 ( 2.455 0.000 1.818) 3.054 6.073 ( 4.753 0.000 -2.819) 5.526 6.659 ( 2.964 0.000 -4.071) 5.035 6.694 ( -2.210 0.000 2.857) 3.612 7.045 ( 5.044 0.000 0.748) 5.099 7.226 ( 1.879 0.000 0.161) 1.886 7.379 ( 3.704 0.000 -4.942) 6.176 7.569 ( -5.811 0.000 0.834) 5.870 7.923 ( -1.692 0.000 2.092) 2.690 7.994 ( 6.015 0.000 6.749) 9.040 8.121 ( 8.344 0.000 -1.634) 8.502 8.321 ( 6.284 0.000 -4.911) 7.975 8.434 ( -9.478 0.000 11.066) 14.571 8.685 ( 3.024 0.000 -5.832) 6.569 8.689 ( 10.510 0.000 -5.642) 11.928 8.781 ( 5.192 0.000 5.976) 7.917 8.935 ( -8.645 0.000 -15.990) 18.177 9.157 ( 0.511 0.000 -3.255) 3.295 9.271 ( -0.467 0.000 8.736) 8.749 9.541 ( -5.054 0.000 -8.844) 10.186 9.789 ( 1.294 0.000 -2.084) 2.453 10.022 ( 3.288 0.000 7.050) 7.779 10.321 ( 2.399 0.000 0.460) 2.443 10.356 ( 4.816 0.000 -3.046) 5.698 10.464 ( -11.374 0.000 3.103) 11.790 10.824 ( 3.802 0.000 0.999) 3.931 10.934 ( 5.197 0.000 1.872) 5.524 11.047 ( 1.678 0.000 1.171) 2.046 11.117 ( -7.764 0.000 -4.472) 8.960 11.301 ( -0.547 0.000 -5.599) 5.626 11.511 ( 0.908 0.000 1.331) 1.611 12.413 ( -2.386 0.000 -3.482) 4.221 12.700 ( 3.880 0.000 0.370) 3.898 12.937 ( 6.204 0.000 3.794) 7.272 12.959 ( 3.356 0.000 5.645) 6.567 13.490 ( -7.247 0.000 -0.838) 7.295 13.629 ( -1.522 0.000 -1.992) 2.507 13.787 ( -8.460 0.000 -2.275) 8.760 13.994 ( 1.045 0.000 1.160) 1.561 14.366 ( -1.169 0.000 0.785) 1.408 14.804 ( -2.989 0.000 -4.340) 5.270 15.039 ( 2.599 0.000 0.151) 2.604 15.262 ( 7.224 0.000 14.406) 16.116 15.569 ( -3.986 0.000 -0.026) 3.986 15.962 ( 4.780 0.000 3.643) 6.010 16.101 ( 2.486 0.000 -0.433) 2.523 16.512 ( 4.711 0.000 3.827) 6.070 16.524 ( -2.715 0.000 -16.094) 16.322 16.830 ( -6.044 0.000 9.094) 10.919 16.866 ( 1.912 0.000 -7.086) 7.339 17.040 ( -2.257 0.000 1.188) 2.550 17.537 ( -5.813 0.000 -1.660) 6.045 17.634 ( -2.736 0.000 3.252) 4.250 24.411 ( 2.980 0.000 1.039) 3.156 24.454 ( -0.603 0.000 -1.787) 1.886 24.704 ( -1.056 0.000 2.043) 2.300 24.711 ( -4.081 0.000 -1.318) 4.288 25.141 ( 7.380 0.000 0.031) 7.380 25.449 ( 1.220 0.000 -0.530) 1.331 25.541 ( -3.714 0.000 1.128) 3.881 25.570 ( -11.088 0.000 0.684) 11.109 27.009 ( 6.158 0.000 -3.597) 7.131 27.270 ( 2.437 0.000 -4.585) 5.193 27.272 ( 5.558 0.000 2.570) 6.124 27.657 ( 10.428 0.000 5.084) 11.602 27.877 ( -4.401 0.000 5.535) 7.071 28.198 ( -12.665 0.000 -11.490) 17.100 29.535 ( 2.981 0.000 2.940) 4.187 30.337 ( 0.114 0.000 -0.519) 0.531 ======================= Grid point 5 (6/130) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 65 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.856 ( 0.000 0.000 0.000) 0.000 2.865 ( 0.000 0.000 0.000) 0.000 3.247 ( 0.000 0.000 -0.000) 0.000 3.430 ( 0.000 0.000 0.000) 0.000 3.469 ( -0.000 0.000 0.000) 0.000 3.509 ( 0.000 0.000 0.000) 0.000 4.426 ( -0.000 0.000 -0.000) 0.000 4.461 ( 0.000 0.000 0.000) 0.000 4.602 ( 0.000 0.000 0.000) 0.000 4.700 ( 0.000 0.000 -0.000) 0.000 5.129 ( 0.000 0.000 -0.000) 0.000 5.231 ( 0.000 0.000 0.000) 0.000 5.774 ( 0.000 0.000 0.000) 0.000 5.787 ( -0.000 0.000 -0.000) 0.000 5.943 ( 0.000 0.000 0.000) 0.000 5.963 ( 0.000 0.000 0.000) 0.000 6.132 ( 0.000 0.000 0.000) 0.000 6.674 ( 0.000 0.000 0.000) 0.000 6.683 ( 0.000 0.000 0.000) 0.000 7.097 ( 0.000 0.000 0.000) 0.000 7.239 ( 0.000 0.000 0.000) 0.000 7.393 ( 0.000 0.000 0.000) 0.000 7.501 ( 0.000 0.000 0.000) 0.000 7.912 ( 0.000 0.000 0.000) 0.000 8.163 ( 0.000 0.000 0.000) 0.000 8.270 ( 0.000 0.000 -0.000) 0.000 8.302 ( 0.000 0.000 0.000) 0.000 8.362 ( 0.000 0.000 -0.000) 0.000 8.670 ( 0.000 0.000 0.000) 0.000 8.701 ( 0.000 0.000 -0.000) 0.000 8.775 ( -0.000 0.000 0.000) 0.000 8.860 ( 0.000 0.000 -0.000) 0.000 9.153 ( 0.000 0.000 0.000) 0.000 9.379 ( 0.000 0.000 0.000) 0.000 9.403 ( -0.000 0.000 -0.000) 0.000 9.788 ( 0.000 0.000 0.000) 0.000 10.107 ( 0.000 0.000 0.000) 0.000 10.343 ( 0.000 0.000 0.000) 0.000 10.343 ( 0.000 0.000 0.000) 0.000 10.394 ( 0.000 0.000 0.000) 0.000 10.919 ( 0.000 0.000 0.000) 0.000 10.972 ( -0.000 0.000 -0.000) 0.000 10.987 ( 0.000 0.000 0.000) 0.000 11.085 ( 0.000 0.000 0.000) 0.000 11.259 ( 0.000 0.000 0.000) 0.000 11.525 ( 0.000 0.000 0.000) 0.000 12.385 ( 0.000 0.000 0.000) 0.000 12.734 ( 0.000 0.000 0.000) 0.000 13.018 ( 0.000 0.000 0.000) 0.000 13.029 ( 0.000 0.000 0.000) 0.000 13.408 ( 0.000 0.000 0.000) 0.000 13.608 ( 0.000 0.000 0.000) 0.000 13.686 ( 0.000 0.000 0.000) 0.000 14.010 ( 0.000 0.000 0.000) 0.000 14.358 ( 0.000 0.000 0.000) 0.000 14.755 ( 0.000 0.000 0.000) 0.000 15.065 ( 0.000 0.000 0.000) 0.000 15.417 ( 0.000 0.000 0.000) 0.000 15.510 ( 0.000 0.000 -0.000) 0.000 16.065 ( 0.000 0.000 0.000) 0.000 16.118 ( 0.000 0.000 0.000) 0.000 16.363 ( -0.000 0.000 -0.000) 0.000 16.588 ( 0.000 0.000 -0.000) 0.000 16.795 ( 0.000 0.000 0.000) 0.000 16.861 ( 0.000 0.000 0.000) 0.000 17.046 ( 0.000 0.000 0.000) 0.000 17.469 ( 0.000 0.000 0.000) 0.000 17.620 ( 0.000 0.000 0.000) 0.000 24.440 ( 0.000 0.000 0.000) 0.000 24.454 ( 0.000 0.000 0.000) 0.000 24.657 ( 0.000 0.000 0.000) 0.000 24.703 ( 0.000 0.000 0.000) 0.000 25.252 ( 0.000 0.000 0.000) 0.000 25.425 ( 0.000 0.000 0.000) 0.000 25.475 ( 0.000 0.000 -0.000) 0.000 25.494 ( -0.000 0.000 0.000) 0.000 27.052 ( 0.000 0.000 0.000) 0.000 27.275 ( 0.000 0.000 -0.000) 0.000 27.335 ( 0.000 0.000 0.000) 0.000 27.857 ( 0.000 0.000 0.000) 0.000 27.897 ( 0.000 0.000 0.000) 0.000 27.908 ( -0.000 0.000 -0.000) 0.000 29.580 ( 0.000 0.000 0.000) 0.000 30.336 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 11 (7/130) ======================= q-point: ( 0.00 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.677 ( 0.000 33.144 0.000) 33.144 0.851 ( 0.000 41.404 0.000) 41.404 1.388 ( 0.000 66.092 0.000) 66.092 2.580 ( 0.000 11.037 0.000) 11.037 2.782 ( 0.000 6.356 0.000) 6.356 3.967 ( 0.000 -11.023 0.000) 11.023 4.117 ( 0.000 -9.549 0.000) 9.549 4.267 ( 0.000 2.805 0.000) 2.805 4.632 ( 0.000 -9.816 0.000) 9.816 5.061 ( 0.000 -0.225 0.000) 0.225 5.140 ( 0.000 5.695 0.000) 5.695 5.271 ( 0.000 -5.800 0.000) 5.800 5.490 ( 0.000 6.843 0.000) 6.843 5.533 ( 0.000 3.021 0.000) 3.021 5.957 ( 0.000 -3.088 0.000) 3.088 6.396 ( 0.000 10.758 0.000) 10.758 6.610 ( 0.000 -9.360 0.000) 9.360 6.686 ( 0.000 8.258 0.000) 8.258 6.926 ( 0.000 2.827 0.000) 2.827 7.087 ( 0.000 3.893 0.000) 3.893 7.233 ( 0.000 11.312 0.000) 11.312 7.356 ( 0.000 7.819 0.000) 7.819 7.531 ( 0.000 2.124 0.000) 2.124 7.680 ( 0.000 -0.903 0.000) 0.903 7.878 ( 0.000 -1.584 0.000) 1.584 7.989 ( 0.000 2.052 0.000) 2.052 8.058 ( 0.000 -0.653 0.000) 0.653 8.165 ( 0.000 6.443 0.000) 6.443 8.355 ( 0.000 -4.500 0.000) 4.500 8.371 ( 0.000 1.650 0.000) 1.650 8.603 ( 0.000 -1.197 0.000) 1.197 8.668 ( 0.000 2.759 0.000) 2.759 8.801 ( 0.000 -0.470 0.000) 0.470 9.292 ( 0.000 -7.222 0.000) 7.222 9.656 ( 0.000 -7.145 0.000) 7.145 9.703 ( 0.000 -6.680 0.000) 6.680 9.887 ( 0.000 -1.379 0.000) 1.379 9.938 ( 0.000 7.163 0.000) 7.163 10.104 ( 0.000 -2.229 0.000) 2.229 10.422 ( 0.000 -1.913 0.000) 1.913 10.659 ( 0.000 8.687 0.000) 8.687 10.782 ( 0.000 2.333 0.000) 2.333 11.058 ( 0.000 -4.820 0.000) 4.820 11.080 ( 0.000 11.877 0.000) 11.877 11.312 ( 0.000 4.050 0.000) 4.050 11.496 ( 0.000 9.411 0.000) 9.411 12.011 ( 0.000 -5.845 0.000) 5.845 12.178 ( 0.000 -3.997 0.000) 3.997 12.838 ( 0.000 2.102 0.000) 2.102 13.418 ( 0.000 2.286 0.000) 2.286 13.726 ( 0.000 -7.918 0.000) 7.918 13.960 ( 0.000 3.835 0.000) 3.835 14.306 ( 0.000 -10.594 0.000) 10.594 14.322 ( 0.000 1.745 0.000) 1.745 14.327 ( 0.000 -8.208 0.000) 8.208 14.645 ( 0.000 -18.255 0.000) 18.255 15.000 ( 0.000 -7.536 0.000) 7.536 15.353 ( 0.000 -8.620 0.000) 8.620 15.459 ( 0.000 -9.696 0.000) 9.696 15.733 ( 0.000 -2.234 0.000) 2.234 16.125 ( 0.000 13.145 0.000) 13.145 16.164 ( 0.000 -12.641 0.000) 12.641 16.436 ( 0.000 14.145 0.000) 14.145 16.612 ( 0.000 -3.483 0.000) 3.483 17.302 ( 0.000 11.662 0.000) 11.662 17.372 ( 0.000 -11.404 0.000) 11.404 17.855 ( 0.000 12.305 0.000) 12.305 18.627 ( 0.000 3.843 0.000) 3.843 24.377 ( 0.000 1.954 0.000) 1.954 24.482 ( 0.000 1.272 0.000) 1.272 24.818 ( 0.000 1.410 0.000) 1.410 24.997 ( 0.000 0.551 0.000) 0.551 25.629 ( 0.000 1.260 0.000) 1.260 25.664 ( 0.000 1.104 0.000) 1.104 25.908 ( 0.000 3.098 0.000) 3.098 26.113 ( 0.000 0.263 0.000) 0.263 26.520 ( 0.000 1.137 0.000) 1.137 26.650 ( 0.000 -0.428 0.000) 0.428 26.905 ( 0.000 1.603 0.000) 1.603 27.541 ( 0.000 -2.935 0.000) 2.935 27.622 ( 0.000 0.263 0.000) 0.263 27.983 ( 0.000 -3.176 0.000) 3.176 29.394 ( 0.000 -1.770 0.000) 1.770 29.466 ( 0.000 -2.124 0.000) 2.124 ======================= Grid point 12 (8/130) ======================= q-point: ( 0.10 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.075 ( 24.989 21.537 17.643) 37.411 1.166 ( 19.462 30.451 15.533) 39.336 2.028 ( 52.059 41.434 15.490) 68.314 2.621 ( 5.896 11.276 -3.011) 13.076 3.060 ( 29.870 5.588 -10.816) 32.255 3.940 ( -0.969 -7.958 -0.078) 8.017 4.094 ( -3.286 -7.900 1.655) 8.715 4.349 ( 6.963 0.319 1.703) 7.175 4.633 ( 1.007 -8.815 -1.317) 8.969 4.979 ( -4.500 3.581 -13.404) 14.585 5.071 ( -2.066 -0.533 5.184) 5.606 5.187 ( -7.030 -2.097 -3.325) 8.054 5.533 ( 3.915 2.127 -1.599) 4.734 5.683 ( 6.998 7.185 7.439) 12.487 5.928 ( -2.533 -0.533 -4.042) 4.800 6.373 ( -7.385 1.289 -1.053) 7.570 6.501 ( -3.770 4.650 0.950) 6.061 6.647 ( -5.538 0.374 6.514) 8.558 6.774 ( -8.386 9.597 0.195) 12.746 7.062 ( -9.569 14.845 5.580) 18.523 7.149 ( 8.596 6.274 -8.667) 13.724 7.289 ( 6.029 9.660 -7.228) 13.487 7.582 ( 1.117 1.954 1.407) 2.654 7.719 ( 4.371 -1.067 -2.257) 5.033 7.836 ( -3.061 -5.103 3.025) 6.676 8.017 ( 4.620 -0.174 -5.585) 7.250 8.130 ( 0.112 5.643 -3.866) 6.841 8.328 ( -0.957 -1.797 -0.381) 2.072 8.425 ( 1.165 -4.991 9.513) 10.806 8.464 ( 1.724 0.734 -3.271) 3.770 8.647 ( 6.531 1.646 -9.654) 11.771 8.737 ( 12.051 0.063 -14.624) 18.950 9.021 ( 13.211 -18.741 1.722) 22.994 9.375 ( 5.171 -6.453 3.575) 9.009 9.518 ( -1.958 -0.210 -10.113) 10.303 9.865 ( -3.581 -6.105 -1.744) 7.289 9.932 ( 4.510 -7.919 6.362) 11.114 9.969 ( 2.539 -4.376 6.061) 7.895 10.210 ( 5.025 -3.255 5.281) 7.984 10.638 ( 0.710 6.689 -2.029) 7.026 10.742 ( 20.126 -23.479 9.701) 32.410 10.806 ( 1.066 2.358 0.587) 2.653 11.087 ( 0.786 7.327 5.474) 9.180 11.099 ( -3.167 -4.513 6.484) 8.511 11.285 ( -0.798 5.689 -1.733) 6.000 11.498 ( 3.038 7.481 0.393) 8.084 12.120 ( 9.682 -5.433 2.237) 11.325 12.226 ( 5.482 -3.603 -0.612) 6.588 12.839 ( -1.585 1.812 3.924) 4.603 13.285 ( -8.549 1.664 -9.177) 12.652 13.762 ( -0.271 -5.711 3.343) 6.623 13.920 ( -2.632 4.663 -2.497) 5.908 14.216 ( -6.991 -11.548 6.168) 14.842 14.274 ( -4.440 -7.410 -2.414) 8.969 14.429 ( 6.954 -0.104 -2.285) 7.320 14.618 ( -9.097 -2.766 3.321) 10.072 14.868 ( -4.767 -1.657 -9.803) 11.026 15.323 ( -6.036 10.787 -17.099) 21.099 15.447 ( 1.921 0.864 1.377) 2.516 15.566 ( -5.114 -4.531 -2.831) 7.396 15.732 ( 0.228 -3.353 -1.516) 3.687 16.293 ( -1.287 -8.587 5.313) 10.179 16.475 ( 5.072 13.117 -1.141) 14.110 16.760 ( -7.486 -5.259 30.556) 31.896 17.155 ( -5.858 3.669 -7.973) 10.552 17.425 ( -0.390 -3.506 3.387) 4.890 17.835 ( -2.914 12.263 1.874) 12.743 18.256 ( -19.150 16.512 -0.533) 25.291 24.372 ( -0.625 2.232 -0.031) 2.318 24.477 ( 0.518 0.948 -0.610) 1.240 24.807 ( -2.013 1.308 0.921) 2.571 24.970 ( -2.405 1.336 -0.755) 2.853 25.285 ( -20.458 22.671 -2.008) 30.603 25.589 ( -6.256 1.453 4.072) 7.605 25.727 ( 2.709 5.841 -10.835) 12.603 25.923 ( 0.075 2.767 1.687) 3.242 26.593 ( 8.313 1.685 -2.221) 8.768 26.740 ( 5.521 0.834 1.863) 5.886 26.977 ( 8.224 1.473 -1.332) 8.461 27.265 ( 12.599 1.897 -31.744) 34.206 27.969 ( -2.837 -3.427 4.379) 6.243 28.981 ( 18.963 -26.238 4.243) 32.650 29.393 ( -4.484 -7.475 8.960) 12.500 29.595 ( 15.942 -26.926 17.301) 35.755 ======================= Grid point 13 (9/130) ======================= q-point: ( 0.20 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.685 ( 28.264 16.306 6.902) 33.352 1.753 ( 23.718 14.534 27.352) 39.011 2.744 ( 10.488 12.629 -4.643) 17.060 3.186 ( 50.492 19.769 19.191) 57.521 3.378 ( 13.502 4.037 -23.865) 27.715 4.005 ( -3.963 -5.708 1.514) 7.112 4.129 ( 16.631 -2.198 6.684) 18.058 4.483 ( 9.152 -3.837 -8.552) 13.100 4.679 ( 3.743 -6.083 4.699) 8.550 4.830 ( 0.381 4.921 -11.611) 12.617 5.015 ( -8.318 0.750 -4.758) 9.612 5.097 ( -1.452 1.779 11.545) 11.771 5.513 ( -4.906 -2.408 -4.302) 6.955 5.724 ( -7.099 1.820 -6.242) 9.627 5.886 ( 3.152 8.189 5.567) 10.392 6.125 ( -13.847 -2.940 2.502) 14.375 6.497 ( -11.148 12.335 1.873) 16.732 6.581 ( -0.640 -1.682 2.237) 2.871 6.719 ( 0.575 3.727 5.745) 6.872 6.969 ( -2.055 13.625 1.590) 13.870 7.248 ( 4.989 9.396 -7.134) 12.809 7.329 ( 9.481 6.672 -12.930) 17.366 7.673 ( 3.911 1.123 8.824) 9.717 7.756 ( -0.948 -7.298 0.075) 7.359 7.849 ( 3.465 -0.841 2.736) 4.495 8.003 ( -0.156 -0.863 -5.302) 5.374 8.184 ( 9.488 0.202 -5.965) 11.209 8.289 ( -1.993 -0.050 0.867) 2.174 8.435 ( 1.254 5.822 -1.058) 6.048 8.559 ( 1.715 -3.410 10.397) 11.075 8.682 ( 3.941 2.741 -5.029) 6.952 8.851 ( 9.952 0.264 -6.694) 11.997 9.149 ( 4.150 -10.245 -5.165) 12.201 9.377 ( -2.515 -3.518 -11.109) 11.921 9.525 ( 5.905 -7.978 2.549) 10.248 9.800 ( -1.312 -3.500 1.647) 4.084 9.980 ( -0.363 -1.212 1.199) 1.743 10.071 ( 2.501 -6.714 3.399) 7.930 10.311 ( 3.564 -1.414 -0.361) 3.851 10.689 ( 6.230 6.280 -1.389) 8.954 10.743 ( -4.866 3.002 -0.928) 5.792 10.932 ( -9.591 0.393 3.548) 10.234 11.046 ( 0.786 -20.342 1.744) 20.431 11.147 ( 1.573 6.267 2.180) 6.819 11.341 ( 5.814 6.305 1.290) 8.673 11.589 ( 4.146 3.168 -2.065) 5.612 12.332 ( 10.243 -4.622 -0.387) 11.245 12.392 ( 11.075 -2.548 3.881) 12.009 12.842 ( -2.398 0.638 5.701) 6.218 13.009 ( -10.903 3.024 -10.281) 15.288 13.724 ( -5.098 -1.862 1.428) 5.612 13.838 ( -4.348 4.598 -2.029) 6.645 14.091 ( -9.137 -12.156 -0.679) 15.222 14.206 ( -1.710 -11.629 1.286) 11.824 14.333 ( -11.430 22.995 -0.969) 25.697 14.584 ( 3.614 -10.346 6.221) 12.602 14.876 ( 6.951 -2.332 -2.057) 7.614 15.171 ( -0.161 11.040 -7.054) 13.102 15.529 ( 2.543 -14.077 3.732) 14.783 15.598 ( 3.286 -9.978 1.109) 10.564 15.739 ( 2.387 -7.742 -0.856) 8.147 16.303 ( -1.450 -8.618 4.764) 9.954 16.583 ( 6.259 10.004 -0.732) 11.824 16.816 ( -7.192 -1.743 19.783) 21.122 17.004 ( -3.324 -0.442 -8.139) 8.802 17.383 ( -4.699 0.862 -2.300) 5.302 17.790 ( -4.036 10.616 3.782) 11.971 17.995 ( -10.797 11.323 -0.417) 15.652 24.364 ( 0.167 2.711 0.011) 2.716 24.493 ( 1.580 0.693 -1.295) 2.157 24.755 ( -3.992 0.927 1.335) 4.310 24.905 ( -3.565 1.892 -1.195) 4.209 25.115 ( -1.897 13.115 -0.088) 13.252 25.515 ( -4.762 1.830 3.472) 6.170 25.686 ( -0.756 3.448 -4.935) 6.067 25.902 ( -4.803 2.071 2.433) 5.769 26.760 ( 11.822 3.101 -4.645) 13.075 26.907 ( 9.981 1.988 3.495) 10.761 27.171 ( 12.473 0.674 -0.570) 12.505 27.265 ( 7.679 1.526 -15.339) 17.222 27.946 ( -4.655 -2.398 7.280) 8.968 28.887 ( -8.561 -2.569 -16.288) 18.579 29.370 ( -4.576 -4.796 8.840) 11.049 29.975 ( 8.829 -30.036 8.554) 32.455 ======================= Grid point 14 (10/130) ======================= q-point: ( 0.30 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.243 ( 25.644 9.433 5.527) 27.877 2.388 ( 21.627 9.529 22.825) 32.856 2.919 ( 11.865 13.896 -4.597) 18.842 3.286 ( 5.046 3.575 -22.340) 23.180 3.834 ( -4.273 -4.181 2.998) 6.687 4.144 ( 12.920 1.015 4.624) 13.760 4.373 ( 14.008 4.913 3.233) 15.193 4.548 ( -10.608 0.901 -8.509) 13.629 4.587 ( 0.667 2.021 -6.462) 6.803 4.895 ( 2.065 -1.057 4.749) 5.285 5.023 ( 7.655 -3.130 3.762) 9.086 5.255 ( -7.000 3.548 -7.416) 10.797 5.273 ( 12.832 5.465 8.374) 16.268 5.676 ( 3.535 -3.629 0.756) 5.122 5.833 ( -8.120 1.961 2.266) 8.655 6.080 ( 2.365 7.518 5.520) 9.622 6.224 ( -16.747 9.343 2.742) 19.372 6.577 ( 0.034 -2.431 -2.863) 3.757 6.764 ( -1.174 3.523 4.765) 6.040 7.036 ( 5.554 10.995 1.861) 12.458 7.231 ( 1.353 4.325 -4.686) 6.519 7.418 ( 6.907 8.068 -8.778) 13.779 7.682 ( -3.130 -1.171 1.697) 3.748 7.853 ( 4.501 -0.826 4.541) 6.447 7.941 ( 2.486 1.413 2.738) 3.959 8.012 ( 4.970 0.397 -0.254) 4.993 8.257 ( 2.358 -0.383 -4.880) 5.433 8.352 ( 5.413 -2.823 4.307) 7.472 8.505 ( 7.249 0.182 -2.556) 7.689 8.655 ( 2.593 -0.021 4.982) 5.617 8.711 ( 2.284 2.346 -2.473) 4.103 8.989 ( 8.460 0.520 -4.541) 9.616 9.130 ( 0.296 -5.658 -6.357) 8.515 9.240 ( -3.686 -9.996 -7.160) 12.836 9.623 ( 3.480 -4.471 -0.711) 5.710 9.808 ( -1.306 0.049 -4.674) 4.853 9.956 ( -2.373 0.318 7.342) 7.722 10.159 ( 6.031 -5.990 0.727) 8.531 10.336 ( 0.841 0.629 -2.512) 2.722 10.623 ( -7.899 -2.393 1.745) 8.436 10.750 ( -5.228 3.202 1.480) 6.307 10.851 ( 6.311 3.249 1.589) 7.273 11.038 ( -2.554 -8.737 -1.033) 9.161 11.170 ( 0.773 0.961 -1.166) 1.697 11.449 ( 4.329 10.745 -1.769) 11.719 11.618 ( 2.102 9.389 -0.927) 9.666 12.505 ( 4.245 -4.832 -1.311) 6.564 12.532 ( 1.930 -0.694 -1.472) 2.525 12.822 ( 2.935 2.652 -0.966) 4.072 12.890 ( 0.876 0.981 6.991) 7.114 13.604 ( -8.889 -3.626 0.333) 9.605 13.751 ( -2.621 5.535 -1.749) 6.369 13.918 ( -8.975 -6.978 -0.930) 11.407 14.144 ( -3.516 -1.075 -2.369) 4.374 14.222 ( -2.694 2.359 2.713) 4.493 14.674 ( 0.473 -16.122 5.319) 16.984 14.999 ( 6.143 2.506 -3.310) 7.414 15.163 ( 1.731 6.504 3.836) 7.747 15.559 ( -0.620 -8.627 -1.673) 8.809 15.688 ( 5.780 -9.565 3.586) 11.737 15.813 ( 4.255 -15.671 1.001) 16.269 16.329 ( 0.087 -9.551 5.264) 10.906 16.638 ( -0.036 -0.380 -2.243) 2.275 16.816 ( -6.221 0.440 4.197) 7.517 16.926 ( 1.372 1.320 -1.137) 2.218 17.246 ( -4.794 7.908 -5.301) 10.659 17.740 ( -5.020 7.741 2.612) 9.589 17.821 ( -7.527 10.092 0.709) 12.610 24.385 ( 1.824 2.730 0.464) 3.316 24.498 ( 0.391 1.628 -2.352) 2.888 24.708 ( -2.395 0.000 2.637) 3.562 24.822 ( -4.096 1.625 -1.440) 4.636 25.131 ( 2.900 9.167 0.211) 9.617 25.473 ( -1.886 2.060 1.290) 3.076 25.622 ( -3.352 2.084 -1.115) 4.101 25.783 ( -9.362 2.029 1.750) 9.737 26.930 ( 10.441 3.892 -5.477) 12.416 27.134 ( 10.118 2.958 3.542) 11.121 27.272 ( 4.638 1.097 -8.033) 9.341 27.422 ( 12.120 0.771 1.457) 12.231 27.919 ( -4.785 -0.383 7.947) 9.284 28.551 ( -13.114 -0.018 -13.846) 19.071 29.387 ( 0.496 -6.100 4.935) 7.862 30.119 ( 3.527 -20.179 2.218) 20.605 ======================= Grid point 15 (11/130) ======================= q-point: ( 0.40 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.687 ( 18.190 6.952 2.065) 19.582 2.886 ( 13.724 10.261 15.459) 23.079 3.091 ( 9.943 10.704 -1.670) 14.705 3.298 ( 11.682 3.128 -12.888) 17.673 3.700 ( -7.734 0.919 -4.805) 9.151 3.966 ( -25.631 1.794 -10.185) 27.639 4.206 ( 3.303 -4.029 0.853) 5.279 4.531 ( 0.601 0.916 -4.229) 4.369 4.815 ( -12.573 -0.845 -3.830) 13.171 4.856 ( -3.923 5.674 7.022) 9.843 5.054 ( 10.924 3.983 4.499) 12.468 5.164 ( 0.974 -0.086 5.242) 5.332 5.622 ( -1.342 -6.668 3.820) 7.801 5.795 ( 14.764 5.849 3.991) 16.375 5.926 ( 9.818 2.013 2.107) 10.241 5.993 ( -5.756 11.317 4.176) 13.365 6.149 ( 1.595 6.416 -1.351) 6.748 6.560 ( 0.210 -4.923 -1.923) 5.290 6.762 ( -1.088 3.044 1.609) 3.611 7.145 ( 4.510 9.101 0.512) 10.170 7.241 ( 0.647 -1.409 0.250) 1.570 7.403 ( -1.026 6.438 -5.665) 8.637 7.692 ( 1.519 8.423 0.616) 8.581 7.957 ( 2.040 3.133 0.123) 3.741 7.983 ( 4.646 -1.328 5.659) 7.441 8.128 ( 5.247 1.182 1.455) 5.572 8.295 ( 3.021 -3.092 0.853) 4.406 8.386 ( -4.738 -3.595 2.351) 6.395 8.628 ( 8.119 -3.074 -4.673) 9.859 8.699 ( 3.263 -0.532 -12.266) 12.704 8.770 ( 1.903 -0.835 6.437) 6.764 8.951 ( -6.458 0.475 -10.102) 12.000 9.088 ( 0.861 -5.207 -1.743) 5.558 9.246 ( 3.543 -1.907 8.812) 9.687 9.564 ( -5.670 1.819 -7.650) 9.694 9.763 ( 2.239 -3.208 -1.951) 4.371 10.029 ( 1.980 0.748 6.865) 7.184 10.287 ( 6.254 -4.763 0.304) 7.867 10.321 ( -0.194 -0.739 -2.224) 2.352 10.485 ( -8.565 -0.639 2.399) 8.918 10.709 ( 1.405 -2.823 -0.972) 3.300 10.943 ( -5.118 -4.663 -1.114) 7.013 11.003 ( 5.965 1.833 1.857) 6.511 11.165 ( -0.143 1.059 -1.767) 2.065 11.464 ( 0.780 15.674 -3.659) 16.114 11.668 ( 1.980 12.572 1.458) 12.810 12.382 ( -4.156 -2.774 -3.586) 6.150 12.658 ( 5.115 -3.054 -0.091) 5.958 12.889 ( 1.891 -0.399 3.735) 4.206 13.056 ( 7.468 3.462 6.249) 10.335 13.433 ( -7.731 -5.512 -1.487) 9.611 13.707 ( -1.009 7.512 -1.361) 7.701 13.744 ( -7.865 -4.399 -1.819) 9.193 14.110 ( 0.610 2.536 -0.284) 2.624 14.192 ( -2.223 -6.198 0.711) 6.623 14.693 ( -0.981 -14.830 1.554) 14.943 15.027 ( 1.420 4.407 -3.250) 5.657 15.280 ( 3.806 -5.699 6.842) 9.684 15.509 ( -2.305 -3.676 -2.561) 5.039 15.875 ( 3.038 -13.963 5.317) 15.246 15.881 ( 7.665 -8.484 4.802) 12.402 16.378 ( 0.180 -11.242 0.929) 11.282 16.540 ( -3.799 -2.684 -10.098) 11.118 16.679 ( -8.221 -10.248 2.999) 13.476 16.973 ( 2.949 9.964 -3.033) 10.825 17.190 ( 0.932 11.375 0.571) 11.427 17.632 ( -5.829 7.495 -0.721) 9.522 17.746 ( -3.033 9.143 2.348) 9.915 24.428 ( 1.777 1.813 0.135) 2.543 24.485 ( 0.458 2.825 -0.686) 2.943 24.700 ( -0.942 -0.096 1.130) 1.475 24.738 ( -3.390 2.224 -0.732) 4.120 25.215 ( 5.859 6.551 -0.199) 8.791 25.465 ( 0.775 1.543 -1.032) 2.012 25.548 ( -4.932 1.281 1.666) 5.361 25.611 ( -9.214 3.114 0.865) 9.764 27.047 ( 6.000 3.807 -3.733) 8.027 27.274 ( 3.303 0.740 -3.454) 4.836 27.323 ( 4.841 4.157 1.622) 6.584 27.649 ( 9.842 -0.240 4.221) 10.712 27.900 ( -2.889 1.915 4.959) 6.050 28.213 ( -12.214 1.698 -10.047) 15.906 29.452 ( 2.394 -7.967 2.485) 8.682 30.172 ( 1.446 -15.676 0.264) 15.744 ======================= Grid point 16 (12/130) ======================= q-point: (-0.50 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.898 ( -0.000 6.132 -0.000) 6.132 3.065 ( -0.000 16.600 -0.000) 16.600 3.264 ( 0.000 1.747 0.000) 1.747 3.437 ( 0.000 1.303 -0.000) 1.303 3.504 ( -0.000 3.146 0.000) 3.146 3.594 ( 0.000 7.428 0.000) 7.428 4.326 ( -0.000 -9.809 -0.000) 9.809 4.447 ( 0.000 1.347 0.000) 1.347 4.715 ( 0.000 9.122 -0.000) 9.122 4.743 ( -0.000 3.718 0.000) 3.718 5.101 ( 0.000 -10.448 0.000) 10.448 5.294 ( -0.000 13.471 0.000) 13.471 5.625 ( 0.000 -11.690 -0.000) 11.690 5.868 ( 0.000 6.426 -0.000) 6.426 6.048 ( -0.000 10.322 -0.000) 10.322 6.059 ( 0.000 6.303 0.000) 6.303 6.159 ( 0.000 2.210 0.000) 2.210 6.554 ( 0.000 -6.112 -0.000) 6.112 6.761 ( -0.000 3.458 0.000) 3.458 7.192 ( 0.000 9.227 -0.000) 9.227 7.239 ( -0.000 -7.773 -0.000) 7.773 7.363 ( 0.000 9.796 0.000) 9.796 7.701 ( 0.000 11.186 0.000) 11.186 7.955 ( 0.000 4.623 0.000) 4.623 8.157 ( -0.000 -1.765 0.000) 1.765 8.214 ( 0.000 -7.484 -0.000) 7.484 8.276 ( 0.000 1.324 -0.000) 1.324 8.353 ( 0.000 -1.017 0.000) 1.017 8.589 ( 0.000 -4.643 0.000) 4.643 8.709 ( -0.000 0.416 0.000) 0.416 8.812 ( -0.000 -4.518 0.000) 4.518 8.832 ( 0.000 3.007 -0.000) 3.007 9.106 ( 0.000 -3.010 0.000) 3.010 9.395 ( 0.000 -0.728 0.000) 0.728 9.402 ( -0.000 1.678 -0.000) 1.678 9.780 ( 0.000 -1.130 0.000) 1.130 10.095 ( 0.000 -0.771 0.000) 0.771 10.297 ( 0.000 -1.387 0.000) 1.387 10.360 ( 0.000 -3.362 0.000) 3.362 10.395 ( -0.000 0.507 0.000) 0.507 10.746 ( 0.000 -6.383 -0.000) 6.383 10.860 ( -0.000 -3.857 0.000) 3.857 11.089 ( 0.000 -1.165 0.000) 1.165 11.141 ( 0.000 4.569 0.000) 4.569 11.453 ( 0.000 17.505 0.000) 17.505 11.693 ( 0.000 13.876 0.000) 13.876 12.334 ( 0.000 -4.421 0.000) 4.421 12.703 ( 0.000 -2.319 0.000) 2.319 12.932 ( 0.000 -1.533 0.000) 1.533 13.168 ( 0.000 4.933 0.000) 4.933 13.344 ( 0.000 -6.010 0.000) 6.010 13.647 ( 0.000 -4.100 -0.000) 4.100 13.692 ( 0.000 8.256 0.000) 8.256 14.129 ( 0.000 10.240 0.000) 10.240 14.163 ( 0.000 -15.314 0.000) 15.314 14.686 ( 0.000 -12.765 0.000) 12.765 15.027 ( 0.000 2.776 0.000) 2.776 15.359 ( -0.000 -14.478 -0.000) 14.478 15.461 ( 0.000 1.825 0.000) 1.825 15.894 ( 0.000 -18.473 0.000) 18.473 16.104 ( 0.000 3.477 0.000) 3.477 16.246 ( -0.000 -9.410 -0.000) 9.410 16.508 ( 0.000 -8.074 -0.000) 8.074 16.602 ( 0.000 -14.121 0.000) 14.121 16.984 ( 0.000 11.401 0.000) 11.401 17.219 ( 0.000 11.685 0.000) 11.685 17.565 ( 0.000 7.469 0.000) 7.469 17.727 ( -0.000 8.883 -0.000) 8.883 24.438 ( 0.000 1.021 0.000) 1.021 24.503 ( -0.000 3.569 0.000) 3.569 24.675 ( 0.000 1.052 0.000) 1.052 24.716 ( 0.000 1.712 0.000) 1.712 25.303 ( 0.000 4.489 0.000) 4.489 25.448 ( 0.000 2.116 0.000) 2.116 25.496 ( 0.000 1.990 -0.000) 1.990 25.524 ( -0.000 2.783 0.000) 2.783 27.088 ( 0.000 3.564 0.000) 3.564 27.286 ( 0.000 1.058 -0.000) 1.058 27.380 ( 0.000 3.866 0.000) 3.866 27.816 ( 0.000 -0.411 0.000) 0.411 27.892 ( -0.000 -1.618 -0.000) 1.618 27.998 ( -0.000 6.903 -0.000) 6.903 29.488 ( 0.000 -8.725 -0.000) 8.725 30.185 ( 0.000 -14.386 0.000) 14.386 ======================= Grid point 22 (13/130) ======================= q-point: ( 0.00 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.338 ( 0.000 31.902 0.000) 31.902 1.668 ( 0.000 38.794 0.000) 38.794 2.622 ( 0.000 52.662 0.000) 52.662 2.882 ( 0.000 18.466 0.000) 18.466 2.972 ( 0.000 12.217 0.000) 12.217 3.644 ( 0.000 -18.236 0.000) 18.236 3.909 ( 0.000 -11.022 0.000) 11.022 4.321 ( 0.000 1.370 0.000) 1.370 4.374 ( 0.000 -14.926 0.000) 14.926 4.948 ( 0.000 -10.318 0.000) 10.318 5.170 ( 0.000 -4.188 0.000) 4.188 5.267 ( 0.000 4.823 0.000) 4.823 5.584 ( 0.000 1.781 0.000) 1.781 5.628 ( 0.000 4.641 0.000) 4.641 5.893 ( 0.000 -2.188 0.000) 2.188 6.463 ( 0.000 -5.134 0.000) 5.134 6.604 ( 0.000 8.107 0.000) 8.107 6.898 ( 0.000 13.247 0.000) 13.247 6.958 ( 0.000 0.454 0.000) 0.454 7.214 ( 0.000 6.289 0.000) 6.289 7.441 ( 0.000 5.331 0.000) 5.331 7.546 ( 0.000 10.516 0.000) 10.516 7.599 ( 0.000 5.461 0.000) 5.461 7.665 ( 0.000 -0.433 0.000) 0.433 7.926 ( 0.000 6.611 0.000) 6.611 8.038 ( 0.000 3.501 0.000) 3.501 8.054 ( 0.000 1.187 0.000) 1.187 8.223 ( 0.000 -2.529 0.000) 2.529 8.367 ( 0.000 7.190 0.000) 7.190 8.383 ( 0.000 -1.126 0.000) 1.126 8.591 ( 0.000 0.891 0.000) 0.891 8.738 ( 0.000 4.185 0.000) 4.185 8.788 ( 0.000 -0.326 0.000) 0.326 9.173 ( 0.000 -3.823 0.000) 3.823 9.496 ( 0.000 -7.505 0.000) 7.505 9.546 ( 0.000 -7.961 0.000) 7.961 9.862 ( 0.000 -0.870 0.000) 0.870 10.038 ( 0.000 -4.102 0.000) 4.102 10.074 ( 0.000 6.180 0.000) 6.180 10.413 ( 0.000 0.271 0.000) 0.271 10.848 ( 0.000 8.680 0.000) 8.680 10.916 ( 0.000 9.277 0.000) 9.277 10.996 ( 0.000 0.518 0.000) 0.518 11.304 ( 0.000 9.391 0.000) 9.391 11.422 ( 0.000 6.728 0.000) 6.728 11.685 ( 0.000 8.279 0.000) 8.279 11.867 ( 0.000 -7.668 0.000) 7.668 12.070 ( 0.000 -6.126 0.000) 6.126 12.867 ( 0.000 -0.044 0.000) 0.044 13.467 ( 0.000 -18.383 0.000) 18.383 13.487 ( 0.000 4.333 0.000) 4.333 13.939 ( 0.000 -6.912 0.000) 6.912 13.971 ( 0.000 -17.545 0.000) 17.545 14.107 ( 0.000 -12.233 0.000) 12.233 14.356 ( 0.000 -0.582 0.000) 0.582 14.373 ( 0.000 -9.842 0.000) 9.842 14.833 ( 0.000 -7.797 0.000) 7.797 14.972 ( 0.000 -19.545 0.000) 19.545 15.481 ( 0.000 8.238 0.000) 8.238 15.679 ( 0.000 -2.870 0.000) 2.870 15.916 ( 0.000 -12.031 0.000) 12.031 16.380 ( 0.000 10.241 0.000) 10.241 16.551 ( 0.000 -0.561 0.000) 0.561 16.706 ( 0.000 9.283 0.000) 9.283 17.159 ( 0.000 -7.342 0.000) 7.342 17.510 ( 0.000 6.989 0.000) 6.989 18.116 ( 0.000 13.093 0.000) 13.093 18.692 ( 0.000 1.794 0.000) 1.794 24.430 ( 0.000 3.047 0.000) 3.047 24.513 ( 0.000 1.539 0.000) 1.539 24.860 ( 0.000 2.658 0.000) 2.658 25.008 ( 0.000 0.412 0.000) 0.412 25.662 ( 0.000 1.887 0.000) 1.887 25.691 ( 0.000 1.419 0.000) 1.419 25.985 ( 0.000 4.133 0.000) 4.133 26.120 ( 0.000 0.294 0.000) 0.294 26.550 ( 0.000 1.753 0.000) 1.753 26.640 ( 0.000 -0.564 0.000) 0.564 26.956 ( 0.000 3.405 0.000) 3.405 27.454 ( 0.000 -5.550 0.000) 5.550 27.631 ( 0.000 0.732 0.000) 0.732 27.896 ( 0.000 -5.106 0.000) 5.106 29.354 ( 0.000 -1.903 0.000) 1.903 29.413 ( 0.000 -2.877 0.000) 2.877 ======================= Grid point 23 (14/130) ======================= q-point: ( 0.10 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.570 ( 17.057 26.129 11.200) 33.152 1.838 ( 10.916 34.183 10.083) 37.273 2.880 ( 15.087 22.851 -1.937) 27.451 2.985 ( 20.424 37.174 7.645) 43.098 3.222 ( 24.669 9.484 -8.729) 27.833 3.685 ( 5.064 -14.282 2.320) 15.330 3.911 ( -0.797 -8.929 3.307) 9.555 4.383 ( 6.138 -1.948 -5.886) 8.724 4.392 ( 2.610 -11.070 3.698) 11.960 4.930 ( -0.606 -6.731 -2.088) 7.074 5.096 ( -3.420 2.288 1.415) 4.351 5.237 ( -3.543 5.374 -9.936) 11.839 5.515 ( 1.979 -6.060 -4.335) 7.709 5.756 ( 1.161 -2.015 2.490) 3.407 5.918 ( 3.108 2.767 4.323) 6.001 6.290 ( -14.117 -5.308 -2.085) 15.226 6.646 ( 0.052 7.143 7.495) 10.354 6.830 ( -1.655 14.719 -1.088) 14.852 6.969 ( -3.822 7.215 -0.593) 8.186 7.311 ( 10.887 8.213 -2.620) 13.887 7.362 ( -10.166 12.584 5.924) 17.228 7.478 ( 4.610 7.557 -10.801) 13.965 7.646 ( 1.723 4.044 -3.826) 5.828 7.692 ( 1.077 0.095 0.644) 1.258 7.805 ( -8.382 2.192 2.518) 9.023 7.990 ( -0.670 -1.790 -5.983) 6.281 8.205 ( 5.959 -2.322 -2.600) 6.904 8.299 ( 5.148 3.179 0.003) 6.050 8.338 ( -5.188 -0.853 10.927) 12.126 8.508 ( 13.722 0.816 -6.698) 15.291 8.648 ( 9.673 0.474 -9.871) 13.828 8.762 ( 2.551 -0.009 1.623) 3.023 8.795 ( 1.891 -0.707 0.564) 2.097 9.250 ( 6.323 -5.016 0.652) 8.098 9.456 ( -2.657 -4.934 -6.707) 8.740 9.600 ( 1.235 -11.059 7.693) 13.528 9.886 ( -1.215 -3.018 7.118) 7.827 9.948 ( -3.507 0.425 3.061) 4.674 10.177 ( 4.980 0.125 1.990) 5.364 10.494 ( 5.439 -4.638 4.295) 8.339 10.817 ( 0.805 10.334 -1.903) 10.539 10.918 ( -0.883 4.210 -0.005) 4.301 11.077 ( 1.617 5.289 5.344) 7.691 11.289 ( -1.250 7.942 1.005) 8.102 11.424 ( 1.780 7.972 -1.293) 8.270 11.678 ( 1.566 8.335 -1.686) 8.646 11.989 ( 11.042 -6.693 1.242) 12.971 12.131 ( 6.651 -5.255 -0.404) 8.487 12.860 ( -2.024 -0.544 2.827) 3.519 13.301 ( -7.453 -3.037 -8.819) 11.939 13.583 ( 1.299 -10.414 5.669) 11.928 13.880 ( -7.872 -14.845 0.990) 16.832 13.931 ( -0.565 -6.291 -3.029) 7.005 14.072 ( -3.645 -11.622 -0.109) 12.181 14.327 ( 1.459 -8.258 -3.079) 8.933 14.499 ( 5.828 -7.029 6.438) 11.172 14.801 ( -1.126 -4.133 -3.713) 5.669 15.022 ( 3.574 -18.060 2.887) 18.636 15.496 ( -0.431 6.747 3.636) 7.677 15.661 ( -1.221 -3.099 -1.218) 3.546 15.768 ( -11.546 1.052 -10.701) 15.778 16.199 ( -7.876 3.853 -1.566) 8.907 16.608 ( 0.826 -0.913 2.151) 2.478 16.779 ( 1.336 3.788 8.377) 9.290 17.094 ( -4.966 -2.624 -1.780) 5.892 17.517 ( 0.282 6.690 0.412) 6.709 18.088 ( -3.316 12.425 0.837) 12.888 18.490 ( -16.211 6.914 -1.242) 17.667 24.428 ( -0.213 3.187 0.215) 3.202 24.508 ( 0.134 1.723 -0.373) 1.768 24.846 ( -2.135 2.512 0.650) 3.360 24.987 ( -1.990 0.470 -0.672) 2.152 25.555 ( -12.496 6.195 0.675) 13.964 25.625 ( -6.305 1.868 4.161) 7.782 25.901 ( -4.804 8.924 -8.683) 13.346 25.993 ( -0.442 3.729 0.135) 3.758 26.638 ( 9.830 2.574 -1.993) 10.355 26.753 ( 7.997 0.247 1.266) 8.100 27.024 ( 7.926 3.285 -1.655) 8.738 27.313 ( 9.584 2.431 -27.180) 28.923 27.871 ( -1.721 -5.920 5.238) 8.090 28.355 ( 30.808 -25.734 24.937) 47.257 29.278 ( -5.262 -2.737 -2.882) 6.595 29.399 ( -3.876 -4.608 5.517) 8.167 ======================= Grid point 24 (15/130) ======================= q-point: ( 0.20 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.045 ( 22.953 18.637 8.788) 30.845 2.176 ( 13.639 25.315 18.233) 34.049 3.062 ( 11.955 16.939 -3.325) 20.998 3.426 ( 7.733 1.067 -16.034) 17.833 3.595 ( 17.929 7.717 7.985) 21.089 3.954 ( 20.286 9.685 2.845) 22.659 4.066 ( 17.428 -3.049 6.123) 18.722 4.417 ( 6.268 -6.201 -5.781) 10.544 4.531 ( 8.056 -5.049 -1.197) 9.582 4.890 ( -1.921 2.035 -2.895) 4.026 5.059 ( 0.698 3.944 -5.327) 6.665 5.163 ( -1.223 2.842 7.661) 8.262 5.424 ( -5.657 -6.891 -5.513) 10.482 5.676 ( -7.311 -5.755 -4.345) 10.269 6.051 ( -5.076 2.452 1.929) 5.958 6.079 ( 2.213 2.767 7.673) 8.452 6.652 ( -8.529 8.677 2.973) 12.525 6.793 ( -4.294 13.420 -1.569) 14.177 6.847 ( -4.860 8.900 4.598) 11.134 7.257 ( -2.325 13.543 0.796) 13.764 7.423 ( -0.979 5.433 -10.511) 11.873 7.544 ( 14.530 13.788 -8.107) 21.609 7.610 ( -3.321 -5.362 2.274) 6.704 7.717 ( 1.520 3.071 8.161) 8.851 7.818 ( 4.777 -2.551 1.793) 5.704 7.945 ( 3.255 -3.349 -6.529) 8.028 8.226 ( 4.616 1.537 -6.531) 8.144 8.281 ( -3.808 1.828 4.447) 6.134 8.490 ( 4.927 -2.490 3.066) 6.315 8.595 ( 3.804 8.138 -1.366) 9.087 8.718 ( 5.955 0.475 -9.176) 10.949 8.875 ( 7.218 2.643 -1.199) 7.780 8.900 ( 8.090 -12.368 -1.443) 14.849 9.238 ( -6.597 -7.447 -12.319) 15.835 9.414 ( 5.097 -3.630 2.686) 6.810 9.704 ( 4.475 -6.288 5.933) 9.735 9.912 ( -3.532 -4.840 8.554) 10.443 9.971 ( 1.100 -1.898 4.464) 4.974 10.268 ( 3.939 -1.775 -1.094) 4.456 10.611 ( 2.120 -12.063 3.790) 12.821 10.870 ( 2.085 6.696 -0.611) 7.040 10.882 ( -0.148 7.325 0.668) 7.357 11.021 ( -7.006 8.525 -1.108) 11.091 11.291 ( -0.307 5.345 -1.124) 5.470 11.524 ( 7.649 10.392 4.121) 13.546 11.739 ( 5.803 8.806 -1.874) 10.711 12.217 ( 12.001 -6.132 -1.840) 13.601 12.319 ( 11.779 -4.093 3.725) 13.015 12.837 ( -3.493 -1.767 4.397) 5.887 13.073 ( -8.797 2.053 -7.731) 11.890 13.626 ( -0.461 -9.789 3.383) 10.368 13.707 ( -10.185 -15.585 0.061) 18.618 13.901 ( -1.319 -2.930 -1.437) 3.520 13.984 ( -4.404 -11.223 -1.386) 12.135 14.340 ( 0.092 -12.155 1.481) 12.245 14.611 ( -2.321 -3.189 3.633) 5.362 14.758 ( 3.126 -2.866 -4.467) 6.159 15.151 ( 8.175 -15.464 1.625) 17.567 15.431 ( -8.990 7.511 -4.214) 12.450 15.551 ( -0.328 6.205 0.369) 6.225 15.628 ( -1.503 -2.664 0.253) 3.070 16.115 ( -4.152 -6.554 4.458) 8.948 16.590 ( -4.276 -5.701 0.910) 7.184 16.841 ( -1.349 -8.389 3.472) 9.178 17.012 ( -1.207 11.392 0.937) 11.494 17.511 ( -0.428 7.933 -2.158) 8.232 18.012 ( -5.718 10.534 1.430) 12.071 18.204 ( -12.806 8.295 -0.429) 15.264 24.432 ( 0.516 3.730 0.394) 3.786 24.522 ( 1.608 1.848 -0.447) 2.490 24.787 ( -4.302 2.157 0.355) 4.825 24.926 ( -3.458 0.444 -1.372) 3.747 25.376 ( -5.551 10.508 0.300) 11.888 25.558 ( -4.740 2.071 4.666) 6.966 25.791 ( -2.790 6.495 -5.891) 9.202 25.952 ( -5.157 2.494 1.324) 5.879 26.845 ( 14.050 4.789 -5.005) 15.665 26.952 ( 11.811 2.040 2.735) 12.294 27.193 ( 10.193 1.642 -2.148) 10.546 27.324 ( 9.450 4.280 -13.629) 17.128 27.879 ( -2.423 -3.771 7.385) 8.639 28.765 ( 2.501 -11.806 -9.039) 15.077 29.223 ( -2.904 -9.720 10.187) 14.377 29.418 ( 4.237 -18.280 6.362) 19.814 ======================= Grid point 25 (16/130) ======================= q-point: ( 0.30 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.499 ( 20.969 14.807 3.907) 25.965 2.642 ( 17.534 15.014 20.254) 30.710 3.270 ( 12.596 17.638 -3.453) 21.948 3.376 ( 4.700 5.668 -17.031) 18.555 3.723 ( 0.141 -5.882 2.760) 6.499 4.144 ( -2.088 -1.530 -4.015) 4.777 4.372 ( -3.647 -4.564 -8.980) 10.713 4.568 ( 14.309 -5.863 -1.595) 15.546 4.624 ( 4.307 6.169 0.066) 7.524 4.911 ( 2.580 1.523 6.107) 6.802 5.043 ( -0.892 5.607 5.819) 8.130 5.297 ( -2.261 -0.147 3.169) 3.895 5.335 ( 9.349 1.139 -1.348) 9.514 5.622 ( 10.192 -0.569 2.544) 10.520 5.939 ( -6.044 6.761 2.037) 9.295 6.226 ( 3.183 7.114 6.286) 10.012 6.433 ( -12.774 9.139 1.914) 15.823 6.629 ( -6.785 7.593 -5.831) 11.734 6.849 ( -3.794 5.305 6.526) 9.227 7.249 ( 0.418 4.705 -6.093) 7.710 7.361 ( 2.002 11.732 -0.636) 11.918 7.557 ( -0.245 1.700 -2.270) 2.847 7.724 ( 6.481 8.298 0.252) 10.532 7.799 ( 2.608 -5.348 -1.005) 6.035 7.959 ( 9.433 0.667 3.639) 10.132 8.050 ( 6.726 3.203 1.869) 7.681 8.208 ( -6.024 -5.507 5.984) 10.121 8.324 ( 9.821 2.338 -12.234) 15.862 8.522 ( 2.130 0.750 -0.839) 2.409 8.693 ( 5.339 2.533 -5.826) 8.298 8.755 ( 2.199 2.687 2.005) 4.010 8.953 ( 1.581 -6.571 -8.180) 10.611 9.026 ( 3.741 -5.561 0.837) 6.754 9.050 ( 1.514 -1.445 -3.664) 4.219 9.544 ( 6.279 -4.172 2.490) 7.939 9.759 ( -5.085 -4.504 -1.158) 6.891 9.943 ( 2.529 -0.435 8.431) 8.813 10.046 ( 4.359 -4.259 2.160) 6.466 10.302 ( 1.481 -2.445 -2.387) 3.725 10.578 ( -6.997 -6.669 -0.029) 9.666 10.822 ( -3.617 4.687 1.268) 6.055 10.928 ( -1.739 5.049 0.346) 5.351 10.967 ( 5.599 6.252 -2.366) 8.720 11.254 ( -1.465 4.600 -2.077) 5.256 11.701 ( 7.323 12.485 1.450) 14.547 11.841 ( 5.938 12.034 0.167) 13.420 12.401 ( 7.976 -4.841 -2.084) 9.560 12.491 ( 1.993 -3.078 0.246) 3.675 12.861 ( 5.411 -1.136 4.907) 7.393 12.911 ( -4.354 2.114 0.119) 4.841 13.488 ( -10.781 -7.915 -1.360) 13.443 13.662 ( -0.597 -14.168 2.486) 14.397 13.827 ( -5.434 -4.986 1.026) 7.446 13.924 ( 0.049 -6.384 -4.090) 7.582 14.345 ( -1.287 -15.263 2.453) 15.512 14.490 ( -7.929 7.786 0.025) 11.113 14.851 ( 6.877 -12.324 -1.944) 14.246 15.275 ( -2.636 -2.578 -1.559) 4.004 15.322 ( 6.625 -5.248 -3.927) 9.319 15.585 ( -0.065 -5.401 1.238) 5.542 15.644 ( 3.081 5.223 7.945) 9.995 16.092 ( -2.888 -11.284 5.869) 13.043 16.486 ( -5.951 -10.581 -1.460) 12.228 16.747 ( -9.314 -8.315 0.450) 12.493 17.085 ( 5.892 12.277 1.064) 13.659 17.471 ( -0.401 11.259 -4.388) 12.090 17.903 ( -7.154 7.441 0.938) 10.365 18.016 ( -7.542 8.201 0.872) 11.176 24.457 ( 1.780 4.218 0.477) 4.604 24.544 ( 1.088 2.623 -1.278) 3.114 24.722 ( -2.693 1.357 1.447) 3.344 24.847 ( -3.613 0.551 -1.460) 3.936 25.336 ( 0.150 9.619 0.297) 9.625 25.522 ( -2.253 2.483 2.273) 4.050 25.687 ( -4.721 4.165 -2.187) 6.665 25.828 ( -8.837 1.994 1.363) 9.161 27.040 ( 11.437 6.616 -6.088) 14.548 27.191 ( 10.299 2.100 0.737) 10.536 27.303 ( 5.492 1.590 -3.048) 6.480 27.473 ( 11.995 4.748 -2.405) 13.123 27.910 ( -0.952 -0.042 8.032) 8.088 28.553 ( -10.818 0.047 -11.130) 15.521 29.226 ( -1.968 -9.174 3.879) 10.153 29.613 ( 7.580 -27.280 5.330) 28.811 ======================= Grid point 26 (17/130) ======================= q-point: ( 0.40 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.883 ( 16.586 11.665 1.930) 20.369 3.081 ( 13.554 9.043 14.920) 22.093 3.377 ( 9.438 6.678 -11.757) 16.490 3.457 ( 7.865 21.278 -1.563) 22.739 3.712 ( -2.338 -0.203 -4.525) 5.097 3.964 ( -15.011 -2.315 -3.845) 15.667 4.148 ( -1.539 -1.699 -4.711) 5.239 4.541 ( -11.206 -2.516 0.135) 11.486 4.692 ( 6.785 -6.419 -8.237) 12.453 4.934 ( -6.176 -0.001 6.680) 9.098 5.118 ( -7.755 4.925 1.111) 9.253 5.265 ( 7.295 0.575 12.303) 14.315 5.531 ( 3.454 3.200 -0.328) 4.720 5.938 ( 6.780 8.338 1.900) 10.913 5.977 ( 15.263 1.435 4.046) 15.855 6.219 ( -5.358 10.012 3.633) 11.922 6.332 ( -0.930 10.006 0.278) 10.053 6.504 ( -2.695 -0.202 -3.566) 4.474 6.824 ( -2.071 3.520 3.666) 5.488 7.180 ( -2.584 -1.875 -4.527) 5.539 7.418 ( 2.295 14.571 0.768) 14.770 7.541 ( 1.762 4.645 -4.486) 6.694 7.791 ( 0.356 -1.934 3.545) 4.054 7.929 ( 11.841 1.039 -3.480) 12.386 8.078 ( -4.166 2.620 7.502) 8.972 8.128 ( -0.193 -0.784 3.913) 3.995 8.230 ( 5.668 -0.032 2.839) 6.340 8.339 ( 2.833 -1.149 -9.439) 9.922 8.600 ( 5.433 0.628 -4.601) 7.147 8.685 ( 3.041 0.257 -9.905) 10.365 8.758 ( -3.498 -0.112 -0.890) 3.612 8.904 ( -2.391 -4.764 -0.397) 5.345 9.032 ( 3.213 0.606 0.954) 3.406 9.225 ( 7.048 0.226 7.190) 10.070 9.586 ( -7.373 -0.893 -6.577) 9.921 9.673 ( 4.918 -3.856 2.118) 6.598 10.050 ( 1.859 1.306 5.242) 5.714 10.170 ( 6.755 -5.925 1.021) 9.043 10.290 ( -0.524 -2.386 -2.472) 3.475 10.440 ( -6.802 -3.129 0.188) 7.490 10.764 ( -1.490 6.180 -1.557) 6.545 10.887 ( -4.034 1.311 1.157) 4.396 11.051 ( 4.721 3.396 -2.223) 6.226 11.230 ( 0.102 4.156 -0.215) 4.163 11.796 ( 3.501 15.608 -1.826) 16.100 11.956 ( 4.736 14.967 2.073) 15.834 12.340 ( -5.932 -0.112 -2.996) 6.647 12.595 ( 6.377 -3.538 -0.397) 7.303 12.890 ( -0.201 -0.386 3.694) 3.720 13.071 ( 9.114 -2.223 5.473) 10.861 13.290 ( -8.339 -7.430 -2.006) 11.348 13.597 ( -6.210 -10.161 -1.010) 11.951 13.804 ( 1.104 -7.412 2.390) 7.866 13.893 ( -0.264 -2.960 -3.504) 4.594 14.336 ( -1.207 -17.444 1.468) 17.547 14.377 ( -4.027 7.438 -0.121) 8.459 14.948 ( 4.519 -14.687 -0.694) 15.382 15.191 ( -3.585 4.663 -1.591) 6.093 15.413 ( 6.281 -8.467 -5.197) 11.754 15.561 ( -3.434 -7.979 2.772) 9.118 15.854 ( 9.211 1.219 10.298) 13.870 16.105 ( -0.581 -13.933 4.755) 14.734 16.366 ( -4.737 -12.759 -2.868) 13.909 16.536 ( -11.276 -4.963 -3.190) 12.726 17.186 ( 4.069 10.345 -1.176) 11.179 17.456 ( 2.020 13.480 -1.813) 13.750 17.771 ( -6.640 5.460 -0.171) 8.599 17.930 ( -3.307 7.774 1.475) 8.576 24.487 ( 0.780 3.935 -0.678) 4.068 24.555 ( 1.464 3.776 0.481) 4.078 24.707 ( -0.816 0.728 0.463) 1.188 24.780 ( -2.324 1.464 -0.261) 2.759 25.367 ( 3.134 7.542 -0.987) 8.226 25.507 ( 0.142 2.368 -1.418) 2.764 25.592 ( -4.992 2.829 1.875) 6.036 25.673 ( -8.207 2.651 1.490) 8.752 27.160 ( 5.891 7.117 -4.160) 10.132 27.296 ( 3.616 1.365 -3.143) 4.982 27.401 ( 3.954 2.286 2.178) 5.060 27.678 ( 10.329 3.000 0.876) 10.791 27.953 ( -1.004 4.280 3.814) 5.820 28.279 ( -9.671 5.014 -5.684) 12.288 29.234 ( 0.371 -12.769 1.338) 12.844 29.745 ( 3.683 -25.062 1.837) 25.398 ======================= Grid point 27 (18/130) ======================= q-point: (-0.50 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.071 ( -0.000 10.193 -0.000) 10.193 3.318 ( 0.000 3.406 -0.000) 3.406 3.478 ( 0.000 12.314 0.000) 12.314 3.511 ( 0.000 16.539 -0.000) 16.539 3.581 ( -0.000 4.112 0.000) 4.112 3.772 ( -0.000 8.741 0.000) 8.741 4.152 ( -0.000 -5.970 -0.000) 5.970 4.400 ( 0.000 -8.445 -0.000) 8.445 4.755 ( 0.000 -7.083 -0.000) 7.083 4.851 ( -0.000 7.047 0.000) 7.047 5.048 ( 0.000 7.209 0.000) 7.209 5.350 ( 0.000 -14.528 0.000) 14.528 5.591 ( -0.000 14.503 -0.000) 14.503 6.012 ( 0.000 7.727 -0.000) 7.727 6.142 ( -0.000 0.603 0.000) 0.603 6.229 ( 0.000 5.068 0.000) 5.068 6.298 ( 0.000 11.934 0.000) 11.934 6.465 ( 0.000 -1.952 -0.000) 1.952 6.831 ( -0.000 3.437 0.000) 3.437 7.121 ( 0.000 -3.795 -0.000) 3.795 7.443 ( 0.000 14.166 -0.000) 14.166 7.544 ( 0.000 6.496 -0.000) 6.496 7.812 ( -0.000 -2.610 0.000) 2.610 8.039 ( -0.000 -3.712 0.000) 3.712 8.069 ( 0.000 -5.440 -0.000) 5.440 8.131 ( 0.000 6.996 -0.000) 6.996 8.331 ( -0.000 2.994 -0.000) 2.994 8.335 ( 0.000 -0.098 0.000) 0.098 8.552 ( -0.000 1.681 -0.000) 1.681 8.695 ( 0.000 -3.925 0.000) 3.925 8.728 ( -0.000 0.105 0.000) 0.105 8.866 ( 0.000 0.254 -0.000) 0.254 9.083 ( 0.000 1.196 0.000) 1.196 9.375 ( 0.000 -1.295 0.000) 1.295 9.438 ( -0.000 2.130 -0.000) 2.130 9.732 ( 0.000 -3.397 0.000) 3.397 10.094 ( 0.000 0.804 0.000) 0.804 10.263 ( 0.000 -5.618 0.000) 5.618 10.265 ( 0.000 -2.296 -0.000) 2.296 10.353 ( 0.000 -3.210 0.000) 3.210 10.751 ( 0.000 5.167 -0.000) 5.167 10.839 ( -0.000 2.806 0.000) 2.806 11.087 ( 0.000 1.955 0.000) 1.955 11.236 ( 0.000 3.857 0.000) 3.857 11.819 ( 0.000 17.199 0.000) 17.199 12.016 ( 0.000 17.032 -0.000) 17.032 12.261 ( 0.000 -1.154 0.000) 1.154 12.655 ( 0.000 -2.719 0.000) 2.719 12.920 ( 0.000 -0.483 0.000) 0.483 13.180 ( 0.000 -9.570 -0.000) 9.570 13.210 ( -0.000 -0.396 0.000) 0.396 13.510 ( 0.000 -9.605 -0.000) 9.605 13.847 ( -0.000 -14.156 -0.000) 14.156 13.860 ( 0.000 4.587 0.000) 4.587 14.330 ( 0.000 -18.540 -0.000) 18.540 14.338 ( -0.000 7.203 0.000) 7.203 14.994 ( 0.000 -17.124 0.000) 17.124 15.143 ( -0.000 6.768 0.000) 6.768 15.462 ( 0.000 -1.401 -0.000) 1.401 15.527 ( -0.000 -14.270 0.000) 14.270 16.058 ( 0.000 -8.305 0.000) 8.305 16.105 ( -0.000 -7.310 -0.000) 7.310 16.294 ( 0.000 -11.419 -0.000) 11.419 16.371 ( 0.000 -5.567 0.000) 5.567 17.215 ( 0.000 10.473 -0.000) 10.473 17.486 ( 0.000 14.376 0.000) 14.376 17.694 ( 0.000 4.091 0.000) 4.091 17.906 ( -0.000 7.455 -0.000) 7.455 24.486 ( 0.000 3.584 0.000) 3.584 24.586 ( -0.000 4.475 0.000) 4.475 24.688 ( 0.000 0.440 0.000) 0.440 24.763 ( 0.000 2.136 0.000) 2.136 25.408 ( -0.000 5.313 0.000) 5.313 25.499 ( 0.000 2.557 0.000) 2.557 25.549 ( 0.000 3.006 -0.000) 3.006 25.591 ( 0.000 3.270 0.000) 3.270 27.196 ( 0.000 6.981 0.000) 6.981 27.316 ( 0.000 1.774 -0.000) 1.774 27.447 ( 0.000 1.692 0.000) 1.692 27.838 ( 0.000 -3.800 0.000) 3.800 27.900 ( -0.000 9.688 -0.000) 9.688 28.164 ( 0.000 9.543 0.000) 9.543 29.246 ( -0.000 -14.505 -0.000) 14.505 29.786 ( 0.000 -23.972 0.000) 23.972 ======================= Grid point 33 (19/130) ======================= q-point: ( 0.00 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.964 ( 0.000 29.589 0.000) 29.589 2.409 ( 0.000 33.936 0.000) 33.936 2.974 ( 0.000 -12.864 0.000) 12.864 3.265 ( 0.000 16.358 0.000) 16.358 3.406 ( 0.000 -5.974 0.000) 5.974 3.465 ( 0.000 18.016 0.000) 18.016 3.813 ( 0.000 8.953 0.000) 8.953 4.098 ( 0.000 -3.832 0.000) 3.832 4.234 ( 0.000 -12.103 0.000) 12.103 4.781 ( 0.000 -4.619 0.000) 4.619 5.036 ( 0.000 -8.432 0.000) 8.432 5.231 ( 0.000 -8.398 0.000) 8.398 5.636 ( 0.000 2.626 0.000) 2.626 5.665 ( 0.000 -0.022 0.000) 0.022 5.924 ( 0.000 6.594 0.000) 6.594 6.345 ( 0.000 -7.973 0.000) 7.973 6.753 ( 0.000 7.423 0.000) 7.423 6.957 ( 0.000 -0.843 0.000) 0.843 7.169 ( 0.000 11.376 0.000) 11.376 7.303 ( 0.000 3.663 0.000) 3.663 7.414 ( 0.000 -4.851 0.000) 4.851 7.569 ( 0.000 -6.365 0.000) 6.365 7.750 ( 0.000 8.276 0.000) 8.276 7.780 ( 0.000 6.591 0.000) 6.591 8.046 ( 0.000 3.958 0.000) 3.958 8.133 ( 0.000 5.185 0.000) 5.185 8.177 ( 0.000 -1.830 0.000) 1.830 8.187 ( 0.000 9.488 0.000) 9.488 8.335 ( 0.000 -1.989 0.000) 1.989 8.474 ( 0.000 1.494 0.000) 1.494 8.662 ( 0.000 5.792 0.000) 5.792 8.777 ( 0.000 0.868 0.000) 0.868 8.889 ( 0.000 9.278 0.000) 9.278 9.128 ( 0.000 -1.338 0.000) 1.338 9.372 ( 0.000 -4.732 0.000) 4.732 9.402 ( 0.000 -6.045 0.000) 6.045 9.857 ( 0.000 0.418 0.000) 0.418 9.949 ( 0.000 -4.208 0.000) 4.208 10.198 ( 0.000 6.178 0.000) 6.178 10.399 ( 0.000 -2.219 0.000) 2.219 10.953 ( 0.000 4.399 0.000) 4.399 11.076 ( 0.000 4.435 0.000) 4.435 11.144 ( 0.000 10.688 0.000) 10.688 11.421 ( 0.000 0.864 0.000) 0.864 11.588 ( 0.000 9.828 0.000) 9.828 11.748 ( 0.000 -2.164 0.000) 2.164 11.803 ( 0.000 2.813 0.000) 2.813 11.951 ( 0.000 -5.527 0.000) 5.527 12.806 ( 0.000 -5.751 0.000) 5.751 13.034 ( 0.000 -20.853 0.000) 20.853 13.568 ( 0.000 2.495 0.000) 2.495 13.712 ( 0.000 -8.569 0.000) 8.569 13.763 ( 0.000 -6.050 0.000) 6.050 13.880 ( 0.000 -9.122 0.000) 9.122 14.200 ( 0.000 -6.834 0.000) 6.834 14.256 ( 0.000 -7.988 0.000) 7.988 14.693 ( 0.000 -7.478 0.000) 7.478 14.703 ( 0.000 -4.954 0.000) 4.954 15.627 ( 0.000 -1.924 0.000) 1.924 15.691 ( 0.000 -3.137 0.000) 3.137 15.790 ( 0.000 14.628 0.000) 14.628 16.465 ( 0.000 -4.986 0.000) 4.986 16.584 ( 0.000 2.904 0.000) 2.904 16.695 ( 0.000 -5.417 0.000) 5.417 17.215 ( 0.000 10.555 0.000) 10.555 17.558 ( 0.000 -2.215 0.000) 2.215 18.370 ( 0.000 11.584 0.000) 11.584 18.682 ( 0.000 -2.977 0.000) 2.977 24.491 ( 0.000 2.671 0.000) 2.671 24.536 ( 0.000 0.560 0.000) 0.560 24.921 ( 0.000 3.097 0.000) 3.097 25.007 ( 0.000 -0.698 0.000) 0.698 25.698 ( 0.000 1.522 0.000) 1.522 25.715 ( 0.000 0.774 0.000) 0.774 26.061 ( 0.000 3.109 0.000) 3.109 26.122 ( 0.000 -0.193 0.000) 0.193 26.585 ( 0.000 1.597 0.000) 1.597 26.628 ( 0.000 -0.624 0.000) 0.624 27.045 ( 0.000 5.437 0.000) 5.437 27.322 ( 0.000 -7.217 0.000) 7.217 27.655 ( 0.000 1.749 0.000) 1.749 27.791 ( 0.000 -4.908 0.000) 4.908 29.326 ( 0.000 -0.692 0.000) 0.692 29.360 ( 0.000 -2.218 0.000) 2.218 ======================= Grid point 34 (20/130) ======================= q-point: ( 0.10 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.106 ( 11.476 26.223 6.305) 29.311 2.511 ( 6.704 31.441 5.858) 32.677 3.035 ( 6.980 -12.356 -1.693) 14.292 3.337 ( 6.987 6.337 -3.461) 10.047 3.514 ( 5.503 0.803 3.230) 6.431 3.628 ( 19.682 10.706 0.523) 22.411 3.919 ( 9.004 8.551 5.623) 13.631 4.143 ( 5.631 0.030 0.715) 5.676 4.313 ( 9.340 -8.159 -3.624) 12.920 4.855 ( 5.368 -0.673 5.258) 7.544 5.049 ( 1.165 -7.056 0.904) 7.208 5.262 ( 1.668 -8.552 0.147) 8.715 5.428 ( -7.160 5.506 -16.021) 18.392 5.679 ( -3.279 -4.690 -5.440) 7.896 5.988 ( 3.452 3.410 7.648) 9.058 6.192 ( -11.198 -4.973 -0.387) 12.259 6.809 ( 1.143 8.318 7.962) 11.571 6.991 ( 2.494 0.724 -3.221) 4.137 7.151 ( -2.381 10.374 0.725) 10.669 7.384 ( 5.744 0.102 5.055) 7.652 7.494 ( 5.952 -0.033 2.081) 6.306 7.576 ( 0.654 -3.350 -9.716) 10.299 7.675 ( -1.522 8.669 -3.733) 9.560 7.811 ( 1.762 4.523 -0.912) 4.939 7.894 ( -11.479 4.985 -2.785) 12.821 7.965 ( -5.999 -0.409 -4.906) 7.761 8.192 ( 5.001 2.130 0.766) 5.490 8.290 ( 0.271 -1.401 4.670) 4.883 8.459 ( -0.708 7.263 0.989) 7.364 8.492 ( 11.793 0.449 -0.981) 11.842 8.696 ( 4.092 0.983 -5.342) 6.801 8.751 ( -0.667 2.012 -1.302) 2.487 8.922 ( 3.057 9.743 -0.447) 10.221 9.180 ( 4.561 -2.078 -1.662) 5.280 9.354 ( -2.255 -4.695 -2.773) 5.901 9.419 ( 1.316 -7.377 6.447) 9.885 9.852 ( -2.658 -0.344 5.454) 6.077 9.919 ( -2.431 -2.633 2.534) 4.389 10.227 ( 1.494 4.414 1.828) 5.005 10.423 ( 0.506 -3.577 2.793) 4.567 10.973 ( 0.475 5.517 2.871) 6.237 11.055 ( 0.308 8.008 -1.138) 8.095 11.221 ( 3.698 6.792 2.126) 8.020 11.385 ( -2.364 1.308 -2.153) 3.455 11.606 ( 3.215 9.843 0.180) 10.357 11.800 ( 2.719 3.216 -1.256) 4.394 11.883 ( 11.435 -2.690 -0.324) 11.752 12.032 ( 8.069 -4.534 -0.191) 9.257 12.792 ( -2.118 -5.796 1.349) 6.316 13.016 ( -1.027 -19.290 -1.896) 19.410 13.521 ( -4.742 1.791 -0.003) 5.068 13.677 ( -3.490 -6.168 -0.390) 7.098 13.748 ( -0.584 -7.657 -0.747) 7.715 13.852 ( -3.294 -9.026 0.545) 9.624 14.166 ( -0.571 -6.302 -3.338) 7.154 14.296 ( 2.123 -11.780 0.735) 11.993 14.719 ( 3.567 -3.231 0.350) 4.826 14.775 ( 4.238 -6.693 4.035) 8.890 15.600 ( -2.586 -1.507 -0.254) 3.004 15.666 ( -3.632 -5.516 0.016) 6.604 15.777 ( -2.386 17.663 3.974) 18.262 16.343 ( -9.658 5.209 -4.411) 11.826 16.567 ( -0.477 -4.845 -0.605) 4.906 16.644 ( -5.919 -9.816 -0.002) 11.462 17.240 ( 1.530 11.979 1.721) 12.198 17.574 ( 1.361 -1.548 0.100) 2.064 18.323 ( -4.876 10.275 -0.128) 11.374 18.555 ( -11.328 -0.209 -1.327) 11.408 24.491 ( 0.088 2.772 0.287) 2.788 24.535 ( 0.240 0.748 -0.018) 0.785 24.904 ( -2.219 2.932 0.195) 3.682 24.986 ( -2.066 -0.676 -0.556) 2.244 25.633 ( -6.971 2.363 1.360) 7.485 25.656 ( -5.918 1.045 3.118) 6.770 26.032 ( -3.679 4.081 -3.558) 6.546 26.059 ( -1.237 2.384 -2.067) 3.390 26.689 ( 11.114 2.276 -1.418) 11.433 26.748 ( 10.387 -0.662 0.239) 10.411 27.114 ( 8.404 5.622 -3.542) 10.714 27.333 ( 10.344 -1.467 -19.617) 22.225 27.765 ( 0.037 -3.061 8.371) 8.913 27.974 ( 15.101 -13.011 17.386) 26.450 29.251 ( -6.134 -0.137 -2.610) 6.667 29.320 ( -5.363 -3.274 2.295) 6.690 ======================= Grid point 35 (21/130) ======================= q-point: ( 0.20 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.438 ( 17.456 19.795 6.129) 27.095 2.709 ( 7.447 26.163 11.052) 29.362 3.177 ( 10.101 -12.295 -4.234) 16.465 3.444 ( 7.738 1.980 -4.014) 8.939 3.623 ( 3.434 4.545 5.036) 7.604 4.030 ( 17.141 2.690 -2.004) 17.466 4.159 ( 11.561 -8.507 3.030) 14.670 4.325 ( 8.647 1.546 -3.559) 9.478 4.519 ( 16.670 8.439 -0.221) 18.686 5.009 ( 3.238 10.411 3.116) 11.339 5.092 ( -0.051 -8.879 2.578) 9.245 5.164 ( -2.433 3.469 -5.095) 6.627 5.305 ( 2.686 -2.951 -3.994) 5.646 5.514 ( -5.285 -9.499 -4.747) 11.862 6.062 ( -2.205 2.013 3.554) 4.642 6.155 ( 5.591 0.814 7.590) 9.462 6.839 ( -7.093 8.457 3.118) 11.470 6.959 ( -3.027 4.031 0.011) 5.041 7.068 ( -7.702 10.286 0.923) 12.883 7.386 ( -4.806 -1.472 -7.364) 8.916 7.514 ( -0.704 0.705 -4.812) 4.914 7.610 ( 4.741 6.098 0.975) 7.786 7.652 ( -1.201 -1.747 2.690) 3.425 7.783 ( 3.368 2.291 1.860) 4.478 7.857 ( 1.612 5.328 -1.682) 5.815 7.909 ( 8.833 0.224 -5.031) 10.168 8.231 ( -2.746 1.505 1.574) 3.505 8.396 ( 6.346 -1.489 2.302) 6.913 8.425 ( 3.828 4.438 -13.699) 14.900 8.664 ( 2.949 -2.164 -1.687) 4.028 8.725 ( 5.734 -1.905 0.540) 6.066 8.779 ( 4.183 3.681 0.372) 5.584 8.978 ( 3.751 7.107 -1.531) 8.181 9.146 ( -3.906 -1.696 -8.626) 9.620 9.351 ( 3.586 -1.978 2.985) 5.067 9.552 ( 5.410 -8.281 7.216) 12.244 9.863 ( -1.536 -0.139 7.757) 7.909 9.935 ( 0.590 -2.092 4.890) 5.351 10.265 ( 1.716 1.711 -0.262) 2.437 10.436 ( -1.510 -6.027 2.355) 6.644 10.997 ( -1.095 7.260 3.260) 8.034 11.071 ( 1.797 8.319 -1.022) 8.572 11.206 ( -4.034 8.041 -3.923) 9.814 11.346 ( -0.418 -0.209 -2.187) 2.237 11.737 ( 9.039 10.217 2.725) 13.911 11.894 ( 8.038 5.575 0.387) 9.790 12.108 ( 12.899 -3.618 -3.142) 13.760 12.239 ( 12.167 -3.823 3.268) 13.165 12.752 ( -3.432 -5.976 2.480) 7.324 12.966 ( -2.100 -13.913 -3.183) 14.427 13.420 ( -5.738 -0.950 0.683) 5.856 13.583 ( -6.077 -2.620 0.291) 6.624 13.746 ( 1.204 -9.611 -1.332) 9.778 13.771 ( -5.494 -8.388 0.372) 10.034 14.132 ( -1.569 -7.457 -0.839) 7.666 14.326 ( 1.021 -16.428 -1.311) 16.512 14.790 ( 2.674 1.665 1.389) 3.442 14.920 ( 8.637 -7.015 1.325) 11.205 15.527 ( -6.457 0.335 1.131) 6.564 15.562 ( -4.019 -1.480 -2.455) 4.937 15.787 ( -1.850 15.028 8.263) 17.250 16.128 ( -8.805 6.304 -3.615) 11.416 16.461 ( -8.492 -7.313 -3.973) 11.890 16.578 ( -3.365 -14.738 4.534) 15.783 17.286 ( 2.324 13.111 0.781) 13.338 17.599 ( 1.608 -0.125 -1.274) 2.055 18.201 ( -7.851 7.755 -0.098) 11.036 18.317 ( -11.832 2.687 -0.896) 12.166 24.505 ( 1.133 3.205 0.562) 3.446 24.554 ( 1.696 0.936 0.146) 1.942 24.838 ( -4.415 2.725 -0.399) 5.204 24.922 ( -3.761 -0.899 -1.282) 4.074 25.526 ( -4.675 4.778 1.723) 6.903 25.589 ( -4.448 0.869 4.568) 6.435 25.918 ( -5.009 5.201 -4.723) 8.629 25.991 ( -5.554 1.118 -0.501) 5.688 26.933 ( 16.097 3.428 -4.242) 16.996 26.980 ( 13.875 0.648 0.356) 13.895 27.251 ( 8.436 4.353 -4.758) 10.618 27.406 ( 11.681 1.876 -12.033) 16.875 27.840 ( 1.262 2.038 9.595) 9.890 28.395 ( 15.023 -21.067 6.446) 26.666 29.097 ( -8.349 -1.550 1.749) 8.670 29.212 ( -7.082 -6.144 1.105) 9.441 ======================= Grid point 36 (22/130) ======================= q-point: ( 0.30 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.805 ( 18.045 14.768 1.786) 23.387 2.983 ( 10.463 17.870 14.306) 25.168 3.322 ( 10.905 -6.813 -7.514) 14.893 3.568 ( 8.847 -2.805 -3.113) 9.789 3.752 ( 5.494 15.990 6.338) 18.056 4.098 ( -1.920 -1.288 -7.071) 7.439 4.246 ( -8.899 -7.024 -9.636) 14.879 4.403 ( 11.704 -9.402 -2.840) 15.279 4.743 ( 3.256 5.130 -2.436) 6.546 4.912 ( -11.762 -1.689 6.432) 13.512 5.120 ( 6.363 1.823 1.564) 6.801 5.295 ( -4.120 -4.823 -1.920) 6.627 5.387 ( 15.206 8.761 7.207) 18.971 5.612 ( 15.398 -1.283 6.556) 16.785 6.094 ( 1.354 8.218 3.167) 8.910 6.314 ( 4.227 0.379 6.579) 7.829 6.616 ( -12.551 9.300 -1.752) 15.719 6.776 ( -12.223 4.427 -5.186) 13.996 6.988 ( -5.442 8.208 4.746) 10.933 7.260 ( -2.150 -2.134 -8.821) 9.327 7.485 ( 3.356 -0.353 -3.497) 4.859 7.626 ( -2.184 -6.608 0.912) 7.019 7.711 ( 4.098 9.860 2.203) 10.903 7.897 ( 4.401 5.369 -0.712) 6.979 7.951 ( 8.197 -1.251 4.991) 9.678 8.104 ( 10.885 0.129 -0.808) 10.916 8.144 ( -6.144 1.885 1.879) 6.696 8.354 ( 1.755 -2.997 -15.140) 15.533 8.537 ( 8.412 2.933 -1.295) 9.002 8.707 ( 3.217 -3.638 -2.871) 5.642 8.779 ( 2.237 2.410 0.011) 3.289 8.887 ( 0.382 0.656 -1.953) 2.095 8.998 ( 3.629 3.401 -5.129) 7.145 9.089 ( 4.286 2.361 1.978) 5.278 9.468 ( 4.787 -1.771 4.046) 6.514 9.649 ( -1.334 -6.229 4.461) 7.777 9.942 ( 4.723 0.492 5.144) 7.001 10.002 ( 2.049 -0.733 4.687) 5.167 10.277 ( 0.763 0.019 -2.679) 2.785 10.411 ( -2.366 -7.328 0.061) 7.700 10.977 ( -2.597 9.265 0.914) 9.665 11.066 ( -3.557 7.539 -0.463) 8.349 11.121 ( 1.628 6.737 -5.002) 8.547 11.304 ( -1.772 -0.658 -1.973) 2.732 11.931 ( 9.325 10.022 0.679) 13.706 12.083 ( 9.327 10.730 3.491) 14.640 12.307 ( 11.417 -4.094 -3.266) 12.561 12.438 ( 3.733 -1.479 2.516) 4.738 12.758 ( 2.837 -7.600 4.763) 9.408 12.901 ( -1.601 -7.024 -2.247) 7.546 13.314 ( -6.966 -3.595 0.690) 7.869 13.481 ( -5.456 -4.132 0.966) 6.912 13.671 ( -4.690 -6.478 0.328) 8.004 13.766 ( 2.326 -10.118 -2.339) 10.642 14.090 ( -2.657 -8.962 0.414) 9.357 14.303 ( -2.016 -17.923 -1.591) 18.106 14.849 ( 3.004 6.897 1.030) 7.593 15.089 ( 9.436 -6.429 -1.877) 11.571 15.411 ( -5.078 3.807 -0.621) 6.377 15.506 ( -1.771 -2.683 0.176) 3.219 15.842 ( -0.235 10.825 9.846) 14.635 15.965 ( -6.880 1.376 -0.714) 7.053 16.268 ( -7.809 -10.286 -4.695) 13.742 16.522 ( -7.081 -13.272 4.852) 15.806 17.341 ( 3.588 12.118 -0.675) 12.656 17.614 ( 2.018 1.744 -2.730) 3.816 18.039 ( -9.125 6.086 -0.140) 10.969 18.133 ( -7.592 3.004 0.270) 8.169 24.543 ( 2.327 3.828 0.559) 4.514 24.591 ( 1.938 1.603 -0.332) 2.537 24.759 ( -3.396 2.092 0.386) 4.008 24.840 ( -3.557 -1.173 -1.222) 3.939 25.490 ( -0.912 5.385 1.068) 5.565 25.561 ( -2.103 1.093 2.786) 3.658 25.776 ( -6.618 4.159 -2.519) 8.212 25.854 ( -8.493 0.417 0.245) 8.507 27.169 ( 12.952 4.894 -5.618) 14.943 27.217 ( 10.394 0.652 -1.448) 10.514 27.346 ( 5.444 3.780 -1.767) 6.859 27.552 ( 10.915 0.087 -6.002) 12.457 27.981 ( 5.580 9.245 9.121) 14.136 28.521 ( -1.525 -5.278 -4.842) 7.323 29.037 ( -3.793 -9.212 4.799) 11.058 29.125 ( -0.436 -17.161 2.490) 17.346 ======================= Grid point 37 (23/130) ======================= q-point: ( 0.40 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.127 ( 14.523 11.467 0.590) 18.513 3.261 ( 8.204 7.996 8.279) 14.135 3.492 ( 12.604 4.840 -4.849) 14.345 3.685 ( 5.011 -1.828 -3.116) 6.177 3.875 ( -3.509 2.355 -1.790) 4.589 3.952 ( -0.667 15.349 0.546) 15.373 4.062 ( -0.281 -6.525 -2.761) 7.091 4.439 ( -8.915 -2.118 -7.237) 11.677 4.665 ( -2.477 -0.731 -3.816) 4.607 4.832 ( -0.614 -9.962 6.821) 12.090 5.166 ( -8.849 -0.448 2.092) 9.104 5.229 ( 0.742 0.421 3.479) 3.582 5.705 ( 10.953 9.323 6.107) 15.626 5.956 ( 12.382 -3.089 5.409) 13.861 6.138 ( 1.580 10.579 2.357) 10.953 6.375 ( -2.832 3.196 2.979) 5.206 6.470 ( -1.412 5.004 -0.740) 5.252 6.551 ( -6.069 3.232 -4.783) 8.376 6.920 ( -3.869 6.133 2.917) 7.816 7.146 ( -3.515 -2.161 -6.230) 7.473 7.549 ( 7.195 -1.622 -7.223) 10.323 7.605 ( 0.055 -4.086 -0.257) 4.095 7.762 ( -3.147 7.180 5.230) 9.424 7.972 ( -3.591 -5.211 4.237) 7.616 8.009 ( 4.207 4.824 -0.657) 6.434 8.191 ( 3.594 0.612 -2.676) 4.523 8.243 ( 7.792 0.539 2.736) 8.276 8.323 ( 4.540 -0.746 -3.417) 5.731 8.635 ( 2.263 1.997 -2.982) 4.243 8.722 ( 1.724 -0.146 -9.042) 9.206 8.774 ( -1.543 3.109 -3.586) 4.991 8.835 ( 0.802 -0.137 2.193) 2.340 9.094 ( 4.234 4.729 2.652) 6.879 9.233 ( 6.758 -0.543 4.032) 7.888 9.537 ( -0.747 -0.976 -0.550) 1.347 9.639 ( 0.059 -1.502 2.852) 3.224 10.077 ( 2.496 -0.339 3.143) 4.028 10.082 ( 5.294 -0.680 3.610) 6.444 10.252 ( -0.688 -1.100 -3.279) 3.527 10.343 ( -3.880 -5.743 -2.006) 7.215 10.932 ( -1.774 10.052 -1.089) 10.265 10.994 ( -3.059 7.901 0.115) 8.474 11.136 ( 2.422 3.586 -2.828) 5.169 11.267 ( -1.080 -1.715 -0.504) 2.089 12.075 ( 5.713 11.994 -0.424) 13.292 12.247 ( 5.693 12.857 1.595) 14.152 12.405 ( -1.700 5.777 -0.850) 6.082 12.502 ( 6.258 -5.115 0.428) 8.094 12.842 ( 1.348 -4.922 2.842) 5.841 12.952 ( 5.991 -9.168 1.976) 11.128 13.185 ( -6.170 -2.262 0.573) 6.596 13.367 ( -6.974 -10.216 -0.785) 12.394 13.632 ( -0.263 -5.265 0.479) 5.294 13.787 ( 1.690 -9.623 -1.959) 9.965 14.048 ( -2.048 -9.581 0.422) 9.807 14.250 ( -1.945 -16.432 -0.835) 16.568 14.912 ( 2.456 10.095 1.090) 10.447 15.236 ( 7.584 -2.027 -2.056) 8.115 15.335 ( -0.909 2.540 -3.012) 4.043 15.475 ( -3.529 -3.204 2.272) 5.281 15.871 ( -3.182 -6.731 2.089) 7.732 15.920 ( 0.012 2.900 5.802) 6.487 16.123 ( -2.849 -8.399 -3.068) 9.385 16.399 ( -8.602 -8.979 2.118) 12.614 17.398 ( 2.937 10.403 -1.355) 10.895 17.645 ( 3.846 2.842 -1.927) 5.155 17.876 ( -8.041 6.329 -0.009) 10.233 18.032 ( -3.910 1.870 0.730) 4.395 24.576 ( 0.619 4.361 -1.074) 4.534 24.625 ( 2.325 2.642 0.962) 3.648 24.724 ( -1.436 0.960 0.122) 1.732 24.786 ( -1.402 -0.886 0.332) 1.691 25.494 ( 1.268 4.682 -1.533) 5.087 25.548 ( -0.039 1.385 -1.326) 1.918 25.653 ( -5.629 2.885 1.604) 6.526 25.708 ( -7.382 0.658 1.854) 7.640 27.308 ( 5.916 4.993 -3.213) 8.382 27.331 ( 4.655 2.748 -2.932) 6.150 27.425 ( 2.846 2.128 0.994) 3.690 27.684 ( 6.772 -3.687 -3.411) 8.432 28.152 ( 4.888 15.644 4.530) 17.005 28.412 ( -4.109 7.548 -0.911) 8.643 28.966 ( -3.638 -12.720 -0.339) 13.235 29.211 ( 3.547 -26.092 2.879) 26.489 ======================= Grid point 38 (24/130) ======================= q-point: (-0.50 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.281 ( 0.000 9.591 0.000) 9.591 3.392 ( 0.000 3.326 0.000) 3.326 3.605 ( 0.000 7.173 -0.000) 7.173 3.660 ( -0.000 3.561 0.000) 3.561 3.839 ( -0.000 -2.775 0.000) 2.775 4.022 ( 0.000 25.878 -0.000) 25.878 4.122 ( -0.000 -16.241 0.000) 16.241 4.175 ( 0.000 8.717 0.000) 8.717 4.602 ( 0.000 -8.502 0.000) 8.502 4.953 ( -0.000 -18.078 0.000) 18.078 5.021 ( 0.000 9.144 -0.000) 9.144 5.232 ( 0.000 1.777 0.000) 1.777 5.843 ( -0.000 9.799 -0.000) 9.799 6.099 ( -0.000 -4.107 0.000) 4.107 6.182 ( 0.000 8.787 0.000) 8.787 6.326 ( 0.000 3.539 0.000) 3.539 6.473 ( 0.000 5.017 0.000) 5.017 6.477 ( -0.000 2.219 -0.000) 2.219 6.905 ( -0.000 4.140 -0.000) 4.140 7.071 ( 0.000 -2.051 0.000) 2.051 7.581 ( 0.000 -2.215 -0.000) 2.215 7.654 ( -0.000 -9.170 0.000) 9.170 7.698 ( 0.000 9.258 -0.000) 9.258 7.959 ( -0.000 -4.858 0.000) 4.858 8.042 ( -0.000 4.232 -0.000) 4.232 8.217 ( 0.000 -0.037 -0.000) 0.037 8.370 ( -0.001 2.439 -0.002) 2.439 8.370 ( 0.001 1.178 0.003) 1.178 8.621 ( -0.000 2.975 -0.000) 2.975 8.635 ( 0.000 -1.108 0.000) 1.108 8.784 ( -0.000 4.121 0.000) 4.121 8.857 ( 0.000 -0.481 -0.000) 0.481 9.150 ( 0.000 4.861 -0.000) 4.861 9.333 ( -0.000 -3.084 0.000) 3.084 9.501 ( -0.000 4.157 -0.000) 4.157 9.665 ( 0.000 -2.915 0.000) 2.915 10.119 ( 0.000 1.309 0.000) 1.309 10.174 ( 0.000 -1.969 0.000) 1.969 10.215 ( 0.000 -2.166 0.000) 2.166 10.275 ( 0.000 -4.857 -0.000) 4.857 10.908 ( 0.000 9.860 -0.000) 9.860 10.966 ( -0.000 8.654 0.000) 8.654 11.149 ( 0.000 2.614 0.000) 2.614 11.255 ( 0.000 -2.756 0.000) 2.756 12.127 ( 0.000 13.179 0.000) 13.179 12.328 ( -0.000 7.380 0.000) 7.380 12.350 ( 0.000 14.903 -0.000) 14.903 12.573 ( 0.000 -5.514 0.000) 5.514 12.896 ( 0.000 -2.174 -0.000) 2.174 12.989 ( 0.000 -8.542 0.000) 8.542 13.161 ( 0.000 -4.024 0.000) 4.024 13.264 ( -0.000 -13.193 -0.000) 13.193 13.637 ( 0.000 -5.905 -0.000) 5.905 13.795 ( 0.000 -9.230 0.000) 9.230 14.029 ( 0.000 -9.531 -0.000) 9.531 14.228 ( 0.000 -15.578 -0.000) 15.578 14.942 ( 0.000 11.463 0.000) 11.463 15.275 ( 0.000 5.890 0.000) 5.890 15.380 ( 0.000 -1.643 -0.000) 1.643 15.408 ( -0.000 -4.564 0.000) 4.564 15.876 ( 0.000 -10.949 0.000) 10.949 15.902 ( -0.000 -7.768 -0.000) 7.768 16.127 ( -0.000 -2.994 -0.000) 2.994 16.297 ( 0.000 -4.759 0.000) 4.759 17.420 ( 0.000 9.934 0.000) 9.934 17.711 ( 0.000 -2.417 0.000) 2.417 17.764 ( -0.000 12.035 0.000) 12.035 17.998 ( -0.000 1.225 -0.000) 1.225 24.572 ( 0.000 4.470 0.000) 4.470 24.676 ( 0.000 4.190 0.000) 4.190 24.688 ( -0.000 -0.729 -0.000) 0.729 24.783 ( 0.000 -0.376 0.000) 0.376 25.501 ( 0.000 3.608 0.000) 3.608 25.541 ( 0.000 1.398 0.000) 1.398 25.608 ( -0.000 2.519 0.000) 2.519 25.640 ( 0.000 1.350 0.000) 1.350 27.354 ( -0.000 7.251 -0.000) 7.251 27.354 ( 0.000 1.964 0.000) 1.964 27.457 ( 0.000 0.770 0.000) 0.770 27.734 ( 0.000 -6.582 0.000) 6.582 28.200 ( 0.000 18.793 -0.000) 18.793 28.390 ( 0.000 13.086 0.000) 13.086 28.927 ( 0.000 -16.392 0.000) 16.392 29.258 ( 0.000 -27.008 0.000) 27.008 ======================= Grid point 44 (25/130) ======================= q-point: ( 0.00 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 78 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.531 ( 0.000 -26.111 0.000) 26.111 2.531 ( 0.000 26.111 0.000) 26.111 3.024 ( 0.000 -26.155 0.000) 26.155 3.024 ( 0.000 26.155 0.000) 26.155 3.614 ( 0.000 -17.241 0.000) 17.241 3.614 ( 0.000 17.241 0.000) 17.241 3.874 ( 0.000 -20.889 0.000) 20.889 3.874 ( 0.000 20.889 0.000) 20.889 4.520 ( 0.000 -23.880 0.000) 23.880 4.520 ( 0.000 23.880 0.000) 23.880 5.030 ( 0.000 -8.459 0.000) 8.459 5.030 ( 0.000 8.459 0.000) 8.459 5.659 ( 0.000 -0.297 0.000) 0.297 5.659 ( 0.000 0.297 0.000) 0.297 6.134 ( 0.000 -11.961 0.000) 11.961 6.134 ( 0.000 11.961 0.000) 11.961 6.894 ( 0.000 -5.614 0.000) 5.614 6.894 ( 0.000 5.614 0.000) 5.614 7.313 ( 0.000 -4.605 0.000) 4.605 7.313 ( 0.000 4.605 0.000) 4.605 7.425 ( 0.000 -7.527 0.000) 7.527 7.425 ( 0.000 7.527 0.000) 7.527 7.842 ( 0.000 -0.579 0.000) 0.579 7.842 ( 0.000 0.579 0.000) 0.579 8.118 ( 0.000 -3.288 0.000) 3.288 8.118 ( 0.000 3.288 0.000) 3.288 8.226 ( 0.000 -3.063 0.000) 3.063 8.226 ( 0.000 3.063 0.000) 3.063 8.418 ( 0.000 -6.290 0.000) 6.290 8.418 ( 0.000 6.290 0.000) 6.290 8.769 ( 0.000 -3.005 0.000) 3.005 8.769 ( 0.000 3.005 0.000) 3.005 9.070 ( 0.000 -6.165 0.000) 6.165 9.070 ( 0.000 6.165 0.000) 6.165 9.320 ( 0.000 -0.785 0.000) 0.785 9.320 ( 0.000 0.785 0.000) 0.785 9.882 ( 0.000 -2.244 0.000) 2.244 9.882 ( 0.000 2.244 0.000) 2.244 10.319 ( 0.000 -5.378 0.000) 5.378 10.319 ( 0.000 5.378 0.000) 5.378 11.061 ( 0.000 -4.875 0.000) 4.875 11.061 ( 0.000 4.875 0.000) 4.875 11.336 ( 0.000 -7.664 0.000) 7.664 11.336 ( 0.000 7.664 0.000) 7.664 11.782 ( 0.000 -0.153 0.000) 0.153 11.782 ( 0.000 0.153 0.000) 0.153 11.811 ( 0.000 -6.528 0.000) 6.528 11.811 ( 0.000 6.528 0.000) 6.528 12.753 ( 0.000 -4.665 0.000) 4.665 12.753 ( 0.000 4.665 0.000) 4.665 13.599 ( 0.000 -2.734 0.000) 2.734 13.599 ( 0.000 2.734 0.000) 2.734 13.757 ( 0.000 -3.304 0.000) 3.304 13.757 ( 0.000 3.304 0.000) 3.304 14.136 ( 0.000 -1.586 0.000) 1.586 14.136 ( 0.000 1.586 0.000) 1.586 14.639 ( 0.000 -0.973 0.000) 0.973 14.639 ( 0.000 0.973 0.000) 0.973 15.618 ( 0.000 -1.448 0.000) 1.448 15.618 ( 0.000 1.448 0.000) 1.448 16.179 ( 0.000 -19.188 0.000) 19.188 16.179 ( 0.000 19.188 0.000) 19.188 16.639 ( 0.000 -2.156 0.000) 2.156 16.639 ( 0.000 2.156 0.000) 2.156 17.434 ( 0.000 -9.403 0.000) 9.403 17.434 ( 0.000 9.403 0.000) 9.403 18.571 ( 0.000 -7.870 0.000) 7.870 18.571 ( 0.000 7.870 0.000) 7.870 24.531 ( 0.000 -1.150 0.000) 1.150 24.531 ( 0.000 1.150 0.000) 1.150 24.977 ( 0.000 -2.245 0.000) 2.245 24.977 ( 0.000 2.245 0.000) 2.245 25.719 ( 0.000 -0.423 0.000) 0.423 25.719 ( 0.000 0.423 0.000) 0.423 26.107 ( 0.000 -1.415 0.000) 1.415 26.107 ( 0.000 1.415 0.000) 1.415 26.612 ( 0.000 -1.009 0.000) 1.009 26.612 ( 0.000 1.009 0.000) 1.009 27.174 ( 0.000 -7.075 0.000) 7.075 27.174 ( 0.000 7.075 0.000) 7.075 27.706 ( 0.000 -3.358 0.000) 3.358 27.706 ( 0.000 3.358 0.000) 3.358 29.328 ( 0.000 -0.860 0.000) 0.860 29.328 ( 0.000 0.860 0.000) 0.860 ======================= Grid point 46 (26/130) ======================= q-point: ( 0.10 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.618 ( 7.616 -23.886 3.016) 25.252 2.618 ( 7.616 23.886 3.016) 25.252 3.089 ( 4.851 -24.167 1.661) 24.705 3.089 ( 4.851 24.167 1.661) 24.705 3.700 ( 6.930 -15.413 2.267) 17.050 3.700 ( 6.930 15.413 2.267) 17.050 3.979 ( 12.952 -17.798 -4.002) 22.373 3.979 ( 12.952 17.798 -4.002) 22.373 4.611 ( 6.676 -22.373 6.600) 24.263 4.611 ( 6.676 22.373 6.600) 24.263 5.077 ( 4.758 -8.614 0.264) 9.844 5.077 ( 4.758 8.614 0.264) 9.844 5.566 ( -6.023 -6.469 -11.654) 14.626 5.566 ( -6.023 6.469 -11.654) 14.626 6.078 ( -3.809 -5.650 3.881) 7.842 6.078 ( -3.809 5.650 3.881) 7.842 6.950 ( 2.624 -4.773 2.605) 6.037 6.950 ( 2.624 4.773 2.605) 6.037 7.310 ( -1.551 -6.104 4.025) 7.474 7.310 ( -1.551 6.104 4.025) 7.474 7.511 ( 7.869 -2.269 -3.944) 9.090 7.511 ( 7.869 2.269 -3.944) 9.090 7.812 ( -0.943 -3.692 -3.051) 4.882 7.812 ( -0.943 3.692 -3.051) 4.882 7.956 ( -9.300 -1.176 -4.675) 10.475 7.956 ( -9.300 1.176 -4.675) 10.475 8.248 ( 1.789 -2.558 1.515) 3.470 8.248 ( 1.789 2.558 1.515) 3.470 8.528 ( 5.840 -1.250 2.552) 6.495 8.528 ( 5.840 1.250 2.552) 6.495 8.743 ( -0.018 -3.463 -4.307) 5.527 8.743 ( -0.018 3.463 -4.307) 5.527 9.116 ( 3.520 -6.871 -1.391) 7.845 9.116 ( 3.520 6.871 -1.391) 7.845 9.307 ( -0.737 -2.206 2.472) 3.395 9.307 ( -0.737 2.206 2.472) 3.395 9.869 ( -2.187 -1.859 3.556) 4.570 9.869 ( -2.187 1.859 3.556) 4.570 10.332 ( -0.214 -5.313 2.337) 5.808 10.332 ( -0.214 5.313 2.337) 5.808 11.088 ( 1.420 -4.314 2.536) 5.202 11.088 ( 1.420 4.314 2.536) 5.202 11.345 ( 0.881 -4.907 -1.925) 5.344 11.345 ( 0.881 4.907 -1.925) 5.344 11.781 ( 2.634 -5.490 0.540) 6.113 11.781 ( 2.634 5.490 0.540) 6.113 11.923 ( 10.031 -5.857 -1.445) 11.706 11.923 ( 10.031 5.857 -1.445) 11.706 12.744 ( -0.992 -4.917 -0.058) 5.016 12.744 ( -0.992 4.917 -0.058) 5.016 13.571 ( -2.605 -3.758 -0.516) 4.602 13.571 ( -2.605 3.758 -0.516) 4.602 13.726 ( -3.172 -3.452 0.334) 4.700 13.726 ( -3.172 3.452 0.334) 4.700 14.123 ( -0.341 -3.258 -2.104) 3.893 14.123 ( -0.341 3.258 -2.104) 3.893 14.699 ( 4.651 -1.351 2.695) 5.542 14.699 ( 4.651 1.351 2.695) 5.542 15.593 ( -2.711 -1.379 0.329) 3.059 15.593 ( -2.711 1.379 0.329) 3.059 16.169 ( -3.027 -18.726 4.216) 19.432 16.169 ( -3.027 18.726 4.216) 19.432 16.544 ( -6.924 -3.765 -4.936) 9.300 16.544 ( -6.924 3.765 -4.936) 9.300 17.462 ( 2.094 -8.941 0.915) 9.229 17.462 ( 2.094 8.941 0.915) 9.229 18.490 ( -7.560 -5.958 -0.918) 9.669 18.490 ( -7.560 5.958 -0.918) 9.669 24.532 ( 0.266 -1.118 0.232) 1.172 24.532 ( 0.266 1.118 0.232) 1.172 24.957 ( -2.193 -2.150 -0.265) 3.083 24.957 ( -2.193 2.150 -0.265) 3.083 25.662 ( -5.823 -0.526 2.207) 6.249 25.662 ( -5.823 0.526 2.207) 6.249 26.078 ( -1.939 -0.587 -2.432) 3.165 26.078 ( -1.939 0.587 -2.432) 3.165 26.727 ( 11.335 -1.458 -0.626) 11.445 26.727 ( 11.335 1.458 -0.626) 11.445 27.243 ( 10.218 -6.462 -9.160) 15.168 27.243 ( 10.218 6.462 -9.160) 15.168 27.790 ( 4.495 -5.438 10.424) 12.587 27.790 ( 4.494 5.438 10.424) 12.587 29.268 ( -5.944 -1.747 -0.409) 6.209 29.268 ( -5.944 1.747 -0.409) 6.209 ======================= Grid point 48 (27/130) ======================= q-point: ( 0.20 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.835 ( 12.712 -18.981 1.801) 22.916 2.835 ( 12.712 18.981 1.801) 22.916 3.196 ( 4.479 -20.596 4.352) 21.522 3.196 ( 4.479 20.596 4.352) 21.522 3.881 ( 9.871 -14.523 2.991) 17.813 3.881 ( 9.871 14.523 2.991) 17.813 4.195 ( 10.251 -9.309 -5.833) 15.026 4.195 ( 10.251 9.309 -5.833) 15.026 4.815 ( 7.348 -15.513 3.460) 17.510 4.815 ( 7.348 15.513 3.460) 17.510 5.217 ( 8.510 -3.683 3.668) 9.972 5.217 ( 8.510 3.683 3.668) 9.972 5.310 ( -6.531 -8.692 -9.662) 14.545 5.310 ( -6.531 8.692 -9.662) 14.545 6.121 ( 3.296 -3.200 5.799) 7.398 6.121 ( 3.296 3.200 5.800) 7.398 6.963 ( -4.454 -3.375 1.026) 5.682 6.963 ( -4.454 3.375 1.026) 5.682 7.263 ( -5.987 -9.063 0.232) 10.865 7.263 ( -5.987 9.063 0.232) 10.865 7.550 ( -0.523 -2.942 -5.521) 6.277 7.550 ( -0.523 2.942 -5.521) 6.277 7.778 ( 0.522 -3.709 3.568) 5.173 7.778 ( 0.522 3.709 3.568) 5.173 7.903 ( 6.888 -2.256 -4.343) 8.450 7.903 ( 6.888 2.256 -4.343) 8.450 8.293 ( 2.271 -4.215 -3.236) 5.779 8.293 ( 2.271 4.215 -3.236) 5.779 8.581 ( 0.979 -5.829 -3.513) 6.876 8.581 ( 0.979 5.829 -3.513) 6.876 8.768 ( 4.647 -3.894 1.838) 6.335 8.768 ( 4.647 3.894 1.838) 6.335 9.110 ( -0.325 -4.261 -5.452) 6.927 9.110 ( -0.325 4.261 -5.452) 6.927 9.390 ( 4.828 -6.473 5.839) 9.966 9.390 ( 4.828 6.473 5.839) 9.966 9.888 ( 0.427 -2.206 5.958) 6.367 9.888 ( 0.427 2.206 5.958) 6.367 10.332 ( -1.226 -4.477 0.986) 4.745 10.332 ( -1.226 4.477 0.986) 4.745 11.132 ( 0.646 -3.681 2.366) 4.423 11.132 ( 0.646 3.681 2.366) 4.423 11.309 ( -2.080 -2.516 -4.184) 5.307 11.309 ( -2.080 2.516 -4.184) 5.307 11.901 ( 9.250 -4.934 0.809) 10.514 11.901 ( 9.250 4.934 0.809) 10.514 12.140 ( 12.996 -5.838 0.586) 14.259 12.140 ( 12.996 5.838 0.586) 14.259 12.717 ( -1.601 -5.943 -0.080) 6.156 12.717 ( -1.601 5.943 -0.080) 6.156 13.502 ( -4.456 -6.086 -0.308) 7.549 13.502 ( -4.456 6.086 -0.308) 7.549 13.662 ( -3.682 -1.983 0.723) 4.244 13.662 ( -3.682 1.983 0.723) 4.244 14.090 ( -1.369 -4.773 -2.279) 5.464 14.090 ( -1.369 4.773 -2.279) 5.464 14.829 ( 6.895 -2.738 1.891) 7.656 14.829 ( 6.895 2.738 1.891) 7.656 15.530 ( -4.215 -0.953 0.762) 4.388 15.530 ( -4.215 0.953 0.762) 4.388 16.125 ( -6.375 -14.456 5.374) 16.688 16.125 ( -6.375 14.456 5.374) 16.688 16.360 ( -7.250 -5.308 -4.364) 9.989 16.360 ( -7.250 5.308 -4.364) 9.989 17.509 ( 2.367 -8.257 -0.157) 8.591 17.509 ( 2.367 8.257 -0.157) 8.591 18.313 ( -9.858 -3.029 -0.885) 10.350 18.313 ( -9.858 3.029 -0.885) 10.350 24.552 ( 1.597 -1.242 0.513) 2.087 24.552 ( 1.597 1.242 0.513) 2.087 24.890 ( -4.207 -2.225 -0.993) 4.862 24.890 ( -4.207 2.225 -0.993) 4.862 25.586 ( -4.230 -1.372 3.362) 5.575 25.586 ( -4.230 1.372 3.362) 5.575 25.987 ( -5.648 -1.679 -2.641) 6.457 25.987 ( -5.648 1.679 -2.641) 6.457 26.977 ( 15.588 -1.028 -2.102) 15.762 26.977 ( 15.588 1.028 -2.102) 15.762 27.359 ( 9.594 -5.315 -8.563) 13.915 27.359 ( 9.594 5.315 -8.563) 13.915 28.018 ( 9.843 -14.841 9.953) 20.401 28.018 ( 9.843 14.841 9.953) 20.401 29.119 ( -9.261 -3.099 -0.096) 9.766 29.119 ( -9.261 3.099 -0.096) 9.766 ======================= Grid point 50 (28/130) ======================= q-point: ( 0.30 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.085 ( 13.586 -12.161 -1.481) 18.294 3.085 ( 13.586 12.161 -1.481) 18.294 3.362 ( 8.737 -15.004 7.305) 18.837 3.362 ( 8.737 15.004 7.305) 18.837 4.051 ( 0.281 -9.877 0.216) 9.883 4.051 ( 0.281 9.877 0.216) 9.883 4.204 ( 4.793 -8.190 -8.752) 12.909 4.204 ( 4.793 8.190 -8.752) 12.909 4.841 ( -6.174 -4.659 0.671) 7.763 4.841 ( -6.174 4.659 0.671) 7.763 5.187 ( 0.913 -4.834 -1.310) 5.091 5.187 ( 0.913 4.834 -1.310) 5.091 5.545 ( 15.575 -5.700 8.344) 18.566 5.545 ( 15.575 5.700 8.344) 18.566 6.248 ( 4.385 -6.184 4.973) 9.067 6.248 ( 4.385 6.184 4.973) 9.067 6.771 ( -12.871 -4.752 -2.835) 14.010 6.771 ( -12.871 4.752 -2.835) 14.010 7.160 ( -4.148 -7.709 -2.548) 9.118 7.160 ( -4.148 7.709 -2.548) 9.118 7.502 ( 1.227 -3.267 -3.216) 4.745 7.502 ( 1.227 3.267 -3.216) 4.745 7.868 ( 1.953 -4.364 5.467) 7.262 7.868 ( 1.953 4.364 5.467) 7.262 8.038 ( 9.098 -5.978 -1.786) 11.032 8.038 ( 9.098 5.978 -1.786) 11.032 8.240 ( -1.462 -6.148 -6.622) 9.154 8.240 ( -1.462 6.148 -6.622) 9.154 8.619 ( 5.324 -4.160 -1.818) 6.997 8.619 ( 5.324 4.160 -1.818) 6.997 8.860 ( 2.280 -3.584 -1.147) 4.400 8.860 ( 2.280 3.584 -1.147) 4.400 9.085 ( 3.131 -3.208 -2.139) 4.966 9.085 ( 3.131 3.208 -2.139) 4.966 9.517 ( 2.847 -5.918 5.657) 8.668 9.517 ( 2.847 5.918 5.657) 8.668 9.973 ( 3.475 -2.136 5.053) 6.494 9.973 ( 3.475 2.136 5.053) 6.494 10.307 ( -1.222 -3.108 -1.699) 3.747 10.307 ( -1.222 3.108 -1.699) 3.747 11.142 ( -0.408 -3.945 -0.290) 3.977 11.142 ( -0.408 3.945 -0.290) 3.977 11.223 ( -3.184 -5.744 -3.259) 7.331 11.223 ( -3.184 5.744 -3.259) 7.331 12.106 ( 10.907 -6.978 1.238) 13.007 12.106 ( 10.907 6.978 1.238) 13.007 12.374 ( 10.108 -7.448 1.344) 12.627 12.374 ( 10.108 7.448 1.344) 12.627 12.700 ( 0.255 -6.026 0.849) 6.091 12.700 ( 0.255 6.026 0.849) 6.091 13.389 ( -8.006 -6.543 0.317) 10.345 13.389 ( -8.006 6.543 0.317) 10.345 13.620 ( -0.992 -2.165 0.105) 2.384 13.620 ( -0.992 2.165 0.105) 2.384 14.038 ( -2.051 -5.392 -1.850) 6.058 14.038 ( -2.051 5.392 -1.850) 6.058 14.978 ( 8.044 -5.530 0.583) 9.779 14.978 ( 8.044 5.530 0.583) 9.779 15.461 ( -3.871 -1.978 1.146) 4.496 15.461 ( -3.871 1.978 1.146) 4.496 16.007 ( -7.886 -7.129 -0.858) 10.665 16.007 ( -7.886 7.129 -0.858) 10.665 16.240 ( -5.390 -12.624 3.146) 14.083 16.240 ( -5.390 12.624 3.146) 14.083 17.548 ( 2.620 -7.486 -1.432) 8.059 17.548 ( 2.620 7.486 -1.432) 8.059 18.134 ( -8.472 -2.717 -0.332) 8.903 18.134 ( -8.472 2.717 -0.332) 8.903 24.597 ( 2.617 -1.200 0.427) 2.910 24.597 ( 2.617 1.200 0.427) 2.910 24.804 ( -3.817 -2.228 -0.690) 4.474 24.804 ( -3.817 2.228 -0.690) 4.474 25.558 ( -1.523 -1.555 2.181) 3.081 25.558 ( -1.523 1.555 2.181) 3.081 25.840 ( -7.915 -1.922 -1.380) 8.261 25.840 ( -7.915 1.922 -1.380) 8.261 27.218 ( 11.419 -0.702 -2.772) 11.771 27.218 ( 11.419 0.702 -2.772) 11.771 27.466 ( 8.006 -6.783 -4.945) 11.600 27.466 ( 8.006 6.783 -4.945) 11.600 28.271 ( 10.020 -16.847 5.661) 20.403 28.271 ( 10.020 16.847 5.661) 20.403 28.950 ( -8.642 -2.568 0.619) 9.037 28.950 ( -8.642 2.568 0.619) 9.037 ======================= Grid point 52 (29/130) ======================= q-point: ( 0.40 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.307 ( 10.545 -4.894 -0.710) 11.647 3.307 ( 10.545 4.894 -0.710) 11.647 3.609 ( 11.333 -6.899 4.138) 13.898 3.609 ( 11.333 6.899 4.138) 13.898 3.881 ( -8.033 -4.708 -4.146) 10.192 3.881 ( -8.033 4.708 -4.146) 10.192 4.355 ( 9.730 -12.933 -2.909) 16.444 4.355 ( 9.730 12.933 -2.909) 16.444 4.646 ( -12.951 -2.641 0.223) 13.219 4.646 ( -12.951 2.641 0.223) 13.219 5.203 ( -1.410 -2.843 2.350) 3.948 5.203 ( -1.410 2.843 2.350) 3.948 5.861 ( 10.494 -6.140 6.606) 13.837 5.861 ( 10.494 6.140 6.606) 13.837 6.325 ( 0.092 -6.810 3.255) 7.549 6.325 ( 0.092 6.810 3.255) 7.549 6.562 ( -5.270 -2.574 -3.265) 6.713 6.562 ( -5.270 2.574 -3.265) 6.713 7.059 ( -4.013 -6.530 -2.557) 8.080 7.059 ( -4.013 6.530 -2.557) 8.080 7.525 ( 3.204 -1.033 -3.688) 4.994 7.525 ( 3.204 1.033 -3.688) 4.994 7.882 ( -4.169 -4.164 3.421) 6.814 7.882 ( -4.169 4.164 3.421) 6.814 8.129 ( 3.546 -5.500 -2.111) 6.876 8.129 ( 3.546 5.500 -2.111) 6.876 8.285 ( 7.552 -2.807 1.015) 8.120 8.285 ( 7.552 2.807 1.015) 8.120 8.675 ( 1.135 -2.325 -3.669) 4.490 8.675 ( 1.135 2.325 -3.669) 4.490 8.842 ( 0.288 -1.330 -2.671) 2.998 8.842 ( 0.288 1.330 -2.671) 2.998 9.186 ( 5.282 -3.756 2.280) 6.871 9.186 ( 5.282 3.756 2.280) 6.871 9.580 ( 0.523 -3.836 2.902) 4.839 9.580 ( 0.523 3.836 2.902) 4.839 10.080 ( 3.733 -1.230 4.003) 5.610 10.080 ( 3.733 1.230 4.003) 5.610 10.255 ( -2.056 -2.016 -3.690) 4.680 10.255 ( -2.056 2.016 -3.690) 4.680 11.127 ( 0.172 -5.879 -1.963) 6.201 11.127 ( 0.172 5.879 -1.963) 6.201 11.154 ( -2.545 -8.021 -0.520) 8.431 11.154 ( -2.545 8.021 -0.520) 8.431 12.289 ( 6.999 -8.760 0.732) 11.237 12.289 ( 6.999 8.760 0.732) 11.237 12.502 ( 3.643 -4.197 -0.298) 5.565 12.502 ( 3.643 4.197 -0.298) 5.565 12.769 ( 4.893 -3.461 2.978) 6.692 12.769 ( 4.893 3.461 2.978) 6.692 13.221 ( -9.249 -5.077 -0.296) 10.555 13.221 ( -9.249 5.077 -0.296) 10.555 13.619 ( 0.587 -4.480 -0.397) 4.536 13.619 ( 0.587 4.480 -0.397) 4.536 13.996 ( -1.117 -5.450 -0.892) 5.635 13.996 ( -1.117 5.450 -0.892) 5.635 15.131 ( 7.779 -8.875 0.239) 11.804 15.131 ( 7.779 8.875 0.239) 11.804 15.404 ( -3.551 -3.682 1.188) 5.251 15.404 ( -3.551 3.682 1.188) 5.251 15.854 ( -5.830 -4.958 -3.156) 8.279 15.854 ( -5.830 4.958 -3.156) 8.279 16.190 ( -3.586 -10.405 4.357) 11.836 16.190 ( -3.586 10.405 4.357) 11.836 17.584 ( 2.460 -7.189 -1.416) 7.729 17.584 ( 2.460 7.189 -1.416) 7.729 18.003 ( -5.373 -4.542 0.095) 7.036 18.003 ( -5.373 4.542 0.095) 7.036 24.641 ( 1.646 -1.438 -0.390) 2.220 24.641 ( 1.646 1.438 -0.390) 2.220 24.753 ( -1.404 -1.938 0.632) 2.475 24.753 ( -1.404 1.938 0.632) 2.475 25.553 ( 0.363 -1.158 -1.459) 1.898 25.553 ( 0.363 1.158 -1.459) 1.898 25.699 ( -6.585 -1.465 1.698) 6.956 25.699 ( -6.585 1.465 1.698) 6.956 27.349 ( 4.881 -1.068 -1.094) 5.115 27.349 ( 4.881 1.068 -1.094) 5.115 27.554 ( 4.535 -8.085 -3.766) 10.006 27.554 ( 4.535 8.085 -3.766) 10.006 28.475 ( 7.778 -8.923 3.829) 12.441 28.475 ( 7.778 8.923 3.829) 12.441 28.817 ( -6.075 -5.320 -0.080) 8.075 28.817 ( -6.075 5.320 -0.080) 8.075 ======================= Grid point 54 (30/130) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 65 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.413 ( 0.000 -2.435 0.000) 2.435 3.413 ( 0.000 2.435 0.000) 2.435 3.728 ( 0.000 -2.064 0.000) 2.064 3.728 ( 0.000 2.064 0.000) 2.064 3.825 ( 0.000 -10.477 0.000) 10.477 3.825 ( 0.000 10.477 0.000) 10.477 4.396 ( 0.000 -11.392 0.000) 11.392 4.396 ( 0.000 11.392 -0.000) 11.392 4.527 ( 0.000 -23.293 0.000) 23.293 4.527 ( 0.000 23.293 0.000) 23.293 5.187 ( 0.000 -6.169 0.000) 6.169 5.187 ( 0.000 6.169 0.000) 6.169 5.996 ( 0.000 -5.951 0.000) 5.951 5.996 ( 0.000 5.951 0.000) 5.951 6.327 ( 0.000 -4.112 0.000) 4.112 6.327 ( 0.000 4.112 0.000) 4.112 6.513 ( 0.000 -0.562 0.000) 0.562 6.513 ( 0.000 0.562 0.000) 0.562 7.002 ( 0.000 -4.872 0.000) 4.872 7.002 ( 0.000 4.872 0.000) 4.872 7.542 ( 0.000 -0.870 -0.000) 0.870 7.542 ( 0.000 0.870 -0.000) 0.870 7.843 ( 0.000 -6.143 0.000) 6.143 7.843 ( 0.000 6.143 0.000) 6.143 8.162 ( 0.000 -5.168 0.000) 5.168 8.162 ( 0.000 5.168 -0.000) 5.168 8.388 ( 0.000 -0.409 0.000) 0.409 8.388 ( 0.000 0.409 0.000) 0.409 8.637 ( 0.000 -0.574 -0.000) 0.574 8.637 ( 0.000 0.574 0.000) 0.574 8.846 ( 0.000 -1.419 0.000) 1.419 8.846 ( 0.000 1.419 0.000) 1.419 9.253 ( 0.000 -4.727 0.000) 4.727 9.253 ( 0.000 4.727 0.000) 4.727 9.595 ( 0.000 -4.433 0.000) 4.433 9.595 ( 0.000 4.433 -0.000) 4.433 10.166 ( 0.000 -3.769 0.000) 3.769 10.166 ( 0.000 3.769 0.000) 3.769 10.184 ( 0.000 -2.089 0.000) 2.089 10.184 ( 0.000 2.089 0.000) 2.089 11.118 ( 0.000 -6.056 0.000) 6.056 11.118 ( 0.000 6.056 0.000) 6.056 11.129 ( 0.000 -1.695 0.000) 1.695 11.129 ( 0.000 1.695 0.000) 1.695 12.356 ( 0.000 -8.725 0.000) 8.725 12.356 ( 0.000 8.725 0.000) 8.725 12.535 ( 0.000 -0.063 0.000) 0.063 12.535 ( 0.000 0.063 0.000) 0.063 12.854 ( 0.000 -1.799 0.000) 1.799 12.854 ( -0.000 1.799 0.000) 1.799 13.106 ( 0.000 -0.776 0.000) 0.776 13.106 ( 0.000 0.776 0.000) 0.776 13.624 ( 0.000 -4.918 0.000) 4.918 13.624 ( 0.000 4.918 -0.000) 4.918 13.983 ( 0.000 -5.466 0.000) 5.466 13.983 ( 0.000 5.466 0.000) 5.466 15.228 ( 0.000 -13.303 0.000) 13.303 15.228 ( -0.000 13.303 0.000) 13.303 15.360 ( 0.000 -2.024 -0.000) 2.024 15.360 ( 0.000 2.024 0.000) 2.024 15.779 ( 0.000 -2.181 0.000) 2.181 15.779 ( 0.000 2.181 0.000) 2.181 16.174 ( 0.000 -5.966 0.000) 5.966 16.174 ( 0.000 5.966 0.000) 5.966 17.605 ( 0.000 -7.725 0.000) 7.725 17.605 ( 0.000 7.725 0.000) 7.725 17.950 ( 0.000 -5.960 0.000) 5.960 17.950 ( 0.000 5.960 0.000) 5.960 24.651 ( 0.000 -3.008 0.000) 3.008 24.651 ( 0.000 3.008 0.000) 3.008 24.749 ( 0.000 -2.800 0.000) 2.800 24.749 ( -0.000 2.800 0.000) 2.800 25.548 ( 0.000 -0.897 0.000) 0.897 25.548 ( 0.000 0.897 0.000) 0.897 25.644 ( 0.000 -0.907 0.000) 0.907 25.644 ( -0.000 0.907 0.000) 0.907 27.391 ( 0.000 -1.407 0.000) 1.407 27.391 ( 0.000 1.407 0.000) 1.407 27.576 ( 0.000 -8.533 0.000) 8.533 27.576 ( 0.000 8.533 0.000) 8.533 28.589 ( 0.000 -17.529 0.000) 17.529 28.589 ( 0.000 17.529 0.000) 17.529 28.738 ( 0.000 -22.581 0.000) 22.581 28.738 ( 0.000 22.581 0.000) 22.581 ======================= Grid point 99 (31/130) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.690 ( -3.882 0.000 33.222) 33.448 0.751 ( 14.186 0.000 36.251) 38.927 1.424 ( 3.096 0.000 66.891) 66.962 2.347 ( 0.604 0.000 -10.447) 10.465 2.557 ( -4.535 0.000 -15.257) 15.917 4.073 ( -3.481 0.000 -0.658) 3.543 4.255 ( -5.498 0.000 2.341) 5.975 4.464 ( -1.444 0.000 11.863) 11.951 4.711 ( -1.309 0.000 -26.653) 26.685 4.727 ( 1.219 0.000 3.940) 4.124 5.259 ( 1.812 0.000 15.005) 15.114 5.279 ( -5.092 0.000 -7.898) 9.397 5.483 ( 8.658 0.000 1.239) 8.746 5.547 ( -8.718 0.000 6.283) 10.746 5.844 ( -0.944 0.000 -8.691) 8.743 6.271 ( 0.484 0.000 3.220) 3.256 6.585 ( -3.157 0.000 -0.115) 3.159 6.643 ( 11.832 0.000 -11.582) 16.557 6.835 ( 1.843 0.000 5.026) 5.354 6.943 ( 10.103 0.000 -6.814) 12.186 6.995 ( -4.361 0.000 -6.094) 7.494 7.108 ( -8.024 0.000 -0.734) 8.058 7.591 ( -1.595 0.000 3.545) 3.887 7.677 ( -3.148 0.000 -0.720) 3.229 7.899 ( -1.765 0.000 -6.015) 6.269 7.901 ( 3.365 0.000 -4.435) 5.567 7.985 ( 0.682 0.000 -3.047) 3.123 8.067 ( -14.861 0.000 -3.505) 15.268 8.406 ( -0.170 0.000 4.557) 4.560 8.554 ( 6.455 0.000 11.838) 13.483 8.643 ( -1.352 0.000 0.189) 1.365 8.680 ( -6.992 0.000 5.258) 8.749 9.323 ( -0.643 0.000 -5.601) 5.637 9.351 ( -11.215 0.000 -5.625) 12.547 9.508 ( 2.938 0.000 7.361) 7.926 9.813 ( -0.434 0.000 -1.281) 1.353 9.947 ( 3.822 0.000 4.328) 5.774 10.186 ( -3.621 0.000 5.179) 6.319 10.443 ( -9.949 0.000 -0.485) 9.961 10.471 ( 0.353 0.000 -5.303) 5.315 10.809 ( 3.774 0.000 -0.814) 3.860 10.843 ( 3.575 0.000 -1.991) 4.092 10.995 ( 0.523 0.000 3.950) 3.984 11.252 ( -2.813 0.000 -1.493) 3.185 11.358 ( 2.225 0.000 -0.276) 2.242 11.916 ( 0.862 0.000 -11.344) 11.377 12.098 ( 1.450 0.000 2.282) 2.704 12.212 ( 0.140 0.000 -0.726) 0.739 12.910 ( 5.021 0.000 8.375) 9.765 13.367 ( -10.088 0.000 -2.402) 10.370 13.714 ( 4.453 0.000 3.288) 5.535 13.875 ( 3.165 0.000 6.820) 7.519 13.887 ( -2.744 0.000 -1.069) 2.945 14.367 ( 1.252 0.000 -3.751) 3.954 14.499 ( 2.968 0.000 1.171) 3.190 14.686 ( -20.156 0.000 -2.474) 20.307 14.899 ( -8.616 0.000 -2.581) 8.994 15.005 ( 2.382 0.000 -5.402) 5.904 15.452 ( 3.835 0.000 5.044) 6.337 15.739 ( -2.426 0.000 -2.185) 3.265 15.813 ( -2.646 0.000 9.690) 10.045 16.309 ( -0.863 0.000 4.982) 5.056 16.333 ( 4.490 0.000 -4.707) 6.505 17.017 ( -2.648 0.000 -11.962) 12.251 17.311 ( 25.967 0.000 4.197) 26.304 17.613 ( -1.044 0.000 -3.507) 3.659 17.891 ( 5.344 0.000 4.634) 7.074 18.026 ( -0.987 0.000 0.450) 1.084 24.359 ( -0.713 0.000 0.270) 0.762 24.446 ( 0.067 0.000 -1.912) 1.913 24.847 ( -2.110 0.000 1.824) 2.789 24.854 ( 0.025 0.000 2.869) 2.869 25.030 ( -1.585 0.000 1.437) 2.139 25.500 ( 3.463 0.000 -10.718) 11.264 25.884 ( 2.258 0.000 0.991) 2.466 25.892 ( -20.911 0.000 3.701) 21.236 26.525 ( -2.917 0.000 1.693) 3.373 26.662 ( 2.629 0.000 -1.495) 3.024 26.691 ( -7.905 0.000 2.526) 8.298 26.874 ( -1.104 0.000 -1.541) 1.896 28.108 ( 1.131 0.000 8.766) 8.839 29.030 ( -1.508 0.000 -16.098) 16.169 29.655 ( -1.169 0.000 10.007) 10.075 30.005 ( 28.734 0.000 -1.889) 28.796 ======================= Grid point 100 (32/130) ======================= q-point: ( 0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.146 ( 21.483 0.000 24.913) 32.897 1.549 ( 29.355 0.000 31.992) 43.419 2.327 ( 13.743 0.000 -9.616) 16.773 2.380 ( 35.241 0.000 49.770) 60.983 2.610 ( 22.810 0.000 -25.793) 34.432 3.986 ( 2.180 0.000 -6.903) 7.240 4.210 ( -1.585 0.000 3.209) 3.579 4.504 ( -4.483 0.000 8.089) 9.248 4.534 ( 1.202 0.000 -18.896) 18.934 4.827 ( 1.718 0.000 13.334) 13.444 5.052 ( -8.559 0.000 -12.366) 15.039 5.402 ( -5.703 0.000 20.198) 20.988 5.510 ( 5.331 0.000 -0.309) 5.340 5.545 ( -0.850 0.000 -12.029) 12.060 5.794 ( 2.019 0.000 -2.974) 3.594 6.363 ( 4.595 0.000 3.246) 5.626 6.467 ( -9.222 0.000 -0.799) 9.257 6.710 ( 2.493 0.000 -7.434) 7.841 6.855 ( -0.373 0.000 5.091) 5.104 6.861 ( -14.012 0.000 -0.126) 14.013 6.928 ( 1.841 0.000 -5.899) 6.180 6.984 ( 4.174 0.000 -4.941) 6.468 7.677 ( 5.115 0.000 -1.652) 5.375 7.689 ( 5.145 0.000 8.237) 9.712 7.891 ( 4.684 0.000 -7.539) 8.875 7.899 ( -0.390 0.000 -2.265) 2.298 7.992 ( 3.895 0.000 -1.084) 4.043 8.217 ( 20.183 0.000 -13.607) 24.341 8.426 ( -16.190 0.000 -1.457) 16.255 8.433 ( -1.251 0.000 6.948) 7.060 8.685 ( 2.730 0.000 1.292) 3.020 8.793 ( 4.728 0.000 16.465) 17.130 9.224 ( -2.991 0.000 -8.864) 9.355 9.267 ( 2.999 0.000 -3.073) 4.294 9.628 ( 2.499 0.000 7.576) 7.977 9.803 ( 0.201 0.000 -3.598) 3.604 10.070 ( 3.307 0.000 3.463) 4.789 10.130 ( -6.349 0.000 4.144) 7.582 10.339 ( -2.173 0.000 0.626) 2.261 10.472 ( 5.281 0.000 -3.237) 6.195 10.831 ( -0.621 0.000 0.474) 0.781 10.915 ( 4.579 0.000 -0.488) 4.605 11.113 ( 7.083 0.000 2.165) 7.406 11.176 ( -2.655 0.000 -3.448) 4.352 11.312 ( -7.348 0.000 3.050) 7.956 11.727 ( -7.475 0.000 -15.372) 17.093 12.229 ( 9.491 0.000 2.491) 9.813 12.262 ( 5.841 0.000 -0.920) 5.913 13.004 ( -3.044 0.000 12.332) 12.702 13.105 ( -13.614 0.000 -6.164) 14.944 13.791 ( -4.141 0.000 -3.862) 5.663 13.813 ( 1.402 0.000 5.867) 6.032 13.982 ( 1.043 0.000 5.348) 5.449 14.338 ( -2.581 0.000 -5.103) 5.718 14.458 ( -4.868 0.000 1.944) 5.242 14.625 ( 8.302 0.000 6.449) 10.512 14.814 ( -0.691 0.000 -1.731) 1.864 14.996 ( 0.665 0.000 -4.251) 4.303 15.638 ( 9.718 0.000 5.198) 11.021 15.687 ( -0.340 0.000 -3.755) 3.771 15.839 ( -2.488 0.000 7.990) 8.369 16.358 ( 2.436 0.000 -3.525) 4.284 16.373 ( 2.415 0.000 6.163) 6.620 16.860 ( -2.297 0.000 -12.677) 12.883 17.396 ( -9.567 0.000 7.766) 12.322 17.503 ( -6.560 0.000 -6.654) 9.345 17.831 ( -7.651 0.000 10.910) 13.325 17.959 ( -5.846 0.000 -0.944) 5.922 24.342 ( -1.009 0.000 0.451) 1.105 24.440 ( 0.983 0.000 -2.210) 2.419 24.830 ( -2.062 0.000 2.533) 3.266 24.883 ( -0.002 0.000 2.317) 2.317 24.997 ( -2.537 0.000 1.294) 2.848 25.458 ( 1.938 0.000 -8.792) 9.003 25.726 ( -5.509 0.000 5.392) 7.709 25.949 ( 1.457 0.000 3.331) 3.636 26.551 ( 4.417 0.000 -0.015) 4.417 26.752 ( 7.534 0.000 0.273) 7.539 26.890 ( 14.273 0.000 -5.169) 15.180 26.932 ( 9.335 0.000 -1.186) 9.410 28.177 ( -2.973 0.000 12.097) 12.457 28.832 ( -5.122 0.000 -17.521) 18.254 29.640 ( -7.031 0.000 6.935) 9.876 30.239 ( 7.214 0.000 -10.839) 13.020 ======================= Grid point 101 (33/130) ======================= q-point: ( 0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.763 ( 25.048 0.000 16.680) 30.093 2.265 ( 23.824 0.000 19.553) 30.821 2.463 ( 10.457 0.000 5.279) 11.714 2.739 ( 14.260 0.000 -31.171) 34.278 3.578 ( 47.148 0.000 33.929) 58.087 4.165 ( -9.520 0.000 6.099) 11.306 4.234 ( 25.454 0.000 -1.532) 25.501 4.403 ( 2.620 0.000 -17.125) 17.325 4.456 ( -2.304 0.000 0.162) 2.310 4.776 ( -10.425 0.000 -12.990) 16.656 4.975 ( 1.231 0.000 13.466) 13.522 5.313 ( -8.329 0.000 -16.051) 18.084 5.417 ( -6.371 0.000 16.175) 17.384 5.668 ( 6.550 0.000 4.763) 8.098 5.812 ( 1.050 0.000 -3.018) 3.195 6.244 ( -14.258 0.000 2.528) 14.480 6.363 ( -8.284 0.000 0.357) 8.292 6.649 ( -7.041 0.000 -2.609) 7.508 6.690 ( 4.696 0.000 -11.296) 12.234 6.873 ( -1.775 0.000 9.378) 9.545 7.039 ( 12.635 0.000 -5.368) 13.728 7.054 ( 6.464 0.000 -2.321) 6.868 7.824 ( -3.903 0.000 -1.147) 4.068 7.827 ( 9.301 0.000 0.790) 9.334 7.891 ( 4.237 0.000 10.433) 11.261 7.920 ( 4.424 0.000 -3.247) 5.487 8.108 ( 9.705 0.000 -5.988) 11.404 8.149 ( -5.735 0.000 -7.922) 9.781 8.422 ( 11.369 0.000 -10.111) 15.215 8.516 ( 3.602 0.000 11.364) 11.921 8.778 ( 6.609 0.000 -0.832) 6.661 8.929 ( -4.550 0.000 12.110) 12.937 9.111 ( -0.862 0.000 -4.676) 4.755 9.321 ( 3.573 0.000 -1.496) 3.873 9.698 ( 1.207 0.000 2.092) 2.415 9.716 ( -4.512 0.000 -9.145) 10.197 10.079 ( -2.767 0.000 6.449) 7.018 10.134 ( 2.744 0.000 1.919) 3.349 10.317 ( -1.683 0.000 0.259) 1.702 10.616 ( 9.527 0.000 2.273) 9.794 10.817 ( -1.439 0.000 0.871) 1.682 10.978 ( 0.773 0.000 1.356) 1.560 11.082 ( -8.175 0.000 3.511) 8.897 11.205 ( -2.089 0.000 -3.500) 4.076 11.217 ( 2.317 0.000 -3.038) 3.821 11.486 ( -3.497 0.000 -10.879) 11.427 12.409 ( 9.730 0.000 0.245) 9.733 12.438 ( 9.589 0.000 0.155) 9.591 12.813 ( -10.285 0.000 -4.815) 11.356 13.037 ( -4.040 0.000 13.363) 13.961 13.693 ( -2.737 0.000 -4.385) 5.169 13.849 ( -4.875 0.000 8.117) 9.469 13.973 ( -2.205 0.000 -0.007) 2.205 14.162 ( -10.116 0.000 -5.827) 11.675 14.427 ( -1.431 0.000 0.351) 1.473 14.810 ( 2.935 0.000 -2.872) 4.107 14.856 ( 5.436 0.000 -0.772) 5.490 15.042 ( 7.185 0.000 9.508) 11.917 15.673 ( 0.942 0.000 -0.569) 1.101 15.849 ( -1.370 0.000 3.896) 4.130 15.852 ( 9.312 0.000 2.480) 9.637 16.377 ( 2.671 0.000 -3.222) 4.185 16.459 ( 1.673 0.000 2.059) 2.653 16.751 ( 0.876 0.000 -10.511) 10.547 17.267 ( -11.845 0.000 12.028) 16.882 17.278 ( -9.321 0.000 -9.206) 13.101 17.800 ( -4.711 0.000 6.629) 8.133 17.809 ( -8.196 0.000 -2.481) 8.563 24.341 ( 0.399 0.000 1.184) 1.249 24.439 ( 0.785 0.000 -2.481) 2.602 24.804 ( -2.814 0.000 2.560) 3.804 24.858 ( -3.270 0.000 -0.929) 3.400 24.992 ( 0.495 0.000 2.918) 2.960 25.418 ( 0.987 0.000 -7.411) 7.476 25.685 ( -3.732 0.000 4.125) 5.563 25.938 ( -5.842 0.000 2.690) 6.432 26.669 ( 8.351 0.000 -1.228) 8.441 26.939 ( 11.149 0.000 1.529) 11.253 27.060 ( 8.528 0.000 -3.600) 9.256 27.190 ( 15.798 0.000 3.955) 16.286 28.188 ( -7.048 0.000 13.517) 15.244 28.562 ( -8.669 0.000 -16.912) 19.004 29.557 ( -5.269 0.000 4.358) 6.838 30.237 ( 3.492 0.000 -10.671) 11.228 ======================= Grid point 102 (34/130) ======================= q-point: ( 0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.291 ( 20.779 0.000 6.851) 21.880 2.618 ( 16.338 0.000 -8.449) 18.394 2.783 ( 16.785 0.000 -19.136) 25.454 2.914 ( 12.874 0.000 34.620) 36.937 3.947 ( -17.341 0.000 5.022) 18.054 4.161 ( -14.153 0.000 -11.688) 18.355 4.390 ( -8.854 0.000 -1.820) 9.039 4.401 ( 6.125 0.000 0.554) 6.150 4.616 ( 28.219 0.000 20.560) 34.915 4.944 ( 16.647 0.000 -17.742) 24.328 5.033 ( -4.886 0.000 5.531) 7.380 5.098 ( 15.209 0.000 -2.189) 15.366 5.417 ( -6.756 0.000 12.900) 14.562 5.787 ( 2.425 0.000 -10.023) 10.312 5.804 ( 3.048 0.000 8.400) 8.936 6.026 ( -10.579 0.000 1.973) 10.762 6.137 ( -12.595 0.000 -2.497) 12.840 6.586 ( 1.700 0.000 -0.237) 1.717 6.647 ( 1.984 0.000 -14.758) 14.891 6.970 ( 3.725 0.000 6.573) 7.555 7.168 ( 5.596 0.000 0.368) 5.608 7.218 ( 9.062 0.000 -2.464) 9.391 7.681 ( -7.256 0.000 -1.087) 7.337 7.920 ( 2.170 0.000 -2.375) 3.217 7.997 ( 0.611 0.000 1.171) 1.321 8.026 ( 3.979 0.000 4.145) 5.746 8.155 ( 7.332 0.000 2.574) 7.771 8.260 ( 15.201 0.000 -11.494) 19.057 8.501 ( 5.432 0.000 -8.819) 10.357 8.718 ( 1.636 0.000 13.249) 13.350 8.844 ( -4.419 0.000 1.311) 4.609 8.865 ( 3.140 0.000 -4.066) 5.137 9.145 ( 2.098 0.000 6.980) 7.288 9.369 ( 1.317 0.000 4.151) 4.355 9.525 ( -5.533 0.000 -10.515) 11.882 9.755 ( 2.969 0.000 3.785) 4.811 10.105 ( -0.894 0.000 6.416) 6.478 10.216 ( 4.656 0.000 -0.044) 4.656 10.286 ( -0.459 0.000 -0.665) 0.808 10.800 ( -0.020 0.000 0.146) 0.147 10.809 ( -0.681 0.000 9.533) 9.557 10.843 ( -9.017 0.000 0.623) 9.039 11.041 ( 0.520 0.000 1.635) 1.716 11.148 ( -2.593 0.000 -6.788) 7.267 11.181 ( 3.595 0.000 -8.040) 8.807 11.453 ( 2.904 0.000 -3.591) 4.618 12.457 ( -3.831 0.000 -1.425) 4.087 12.591 ( 8.603 0.000 0.289) 8.607 12.798 ( 8.109 0.000 -0.484) 8.123 13.077 ( -3.078 0.000 12.573) 12.944 13.623 ( -1.395 0.000 -2.987) 3.297 13.730 ( -12.438 0.000 6.604) 14.083 13.912 ( -10.334 0.000 -6.796) 12.369 13.976 ( 1.518 0.000 -0.017) 1.519 14.397 ( -1.734 0.000 -0.325) 1.765 14.745 ( -1.300 0.000 -8.605) 8.703 14.960 ( 5.344 0.000 -0.221) 5.349 15.289 ( 6.553 0.000 9.568) 11.597 15.683 ( -4.074 0.000 4.269) 5.901 15.907 ( 6.719 0.000 4.502) 8.088 16.003 ( 5.981 0.000 -0.859) 6.043 16.405 ( -4.102 0.000 -10.517) 11.289 16.408 ( 4.201 0.000 -5.354) 6.806 16.726 ( 3.492 0.000 -5.546) 6.554 17.095 ( -3.595 0.000 -2.223) 4.227 17.153 ( -10.602 0.000 10.889) 15.198 17.634 ( -7.757 0.000 -3.270) 8.418 17.747 ( -5.228 0.000 2.982) 6.019 24.379 ( 2.190 0.000 1.956) 2.936 24.429 ( 0.354 0.000 -2.153) 2.182 24.770 ( -4.403 0.000 -2.192) 4.918 24.770 ( -2.801 0.000 2.099) 3.500 25.052 ( 3.399 0.000 2.671) 4.323 25.387 ( 1.610 0.000 -5.635) 5.861 25.641 ( -4.247 0.000 2.906) 5.146 25.791 ( -10.786 0.000 0.967) 10.829 26.827 ( 9.335 0.000 -0.830) 9.372 27.155 ( 9.929 0.000 1.306) 10.014 27.166 ( 5.006 0.000 -0.520) 5.033 27.515 ( 12.868 0.000 7.682) 14.987 28.136 ( -9.866 0.000 12.592) 15.997 28.256 ( -10.194 0.000 -13.982) 17.304 29.545 ( 0.335 0.000 3.579) 3.594 30.219 ( 4.267 0.000 -11.026) 11.823 ======================= Grid point 103 (35/130) ======================= q-point: ( 0.40 0.00 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.693 ( 19.223 0.000 4.423) 19.725 2.825 ( 9.452 0.000 -0.782) 9.484 3.045 ( 19.613 0.000 -6.728) 20.735 3.347 ( 4.951 0.000 23.314) 23.834 3.657 ( -15.071 0.000 4.952) 15.863 3.730 ( -17.357 0.000 -7.281) 18.822 4.390 ( 3.945 0.000 8.149) 9.054 4.471 ( 5.687 0.000 -0.782) 5.741 4.665 ( -16.394 0.000 -7.242) 17.922 4.876 ( -12.126 0.000 -0.940) 12.163 5.122 ( 8.301 0.000 12.078) 14.656 5.377 ( -7.148 0.000 9.561) 11.938 5.717 ( 32.122 0.000 -5.078) 32.521 5.745 ( 3.147 0.000 -12.556) 12.944 5.837 ( -8.294 0.000 -4.279) 9.333 5.915 ( -5.654 0.000 -8.322) 10.061 5.965 ( 4.084 0.000 6.944) 8.056 6.545 ( 1.696 0.000 -17.401) 17.483 6.673 ( 3.985 0.000 5.392) 6.705 7.073 ( 2.155 0.000 3.784) 4.355 7.229 ( 1.446 0.000 -0.725) 1.617 7.338 ( 6.110 0.000 -1.540) 6.301 7.544 ( -6.214 0.000 -1.943) 6.511 7.898 ( -0.886 0.000 -4.559) 4.644 8.106 ( 7.766 0.000 0.608) 7.790 8.127 ( 4.802 0.000 1.172) 4.943 8.285 ( 5.611 0.000 -0.016) 5.611 8.441 ( 12.197 0.000 -9.913) 15.718 8.491 ( 2.262 0.000 -4.881) 5.380 8.600 ( -13.226 0.000 3.915) 13.793 8.864 ( -0.594 0.000 5.294) 5.327 8.953 ( 4.891 0.000 6.666) 8.268 9.265 ( 0.316 0.000 11.490) 11.494 9.370 ( -3.961 0.000 -7.266) 8.275 9.458 ( 2.040 0.000 8.698) 8.934 9.832 ( -0.187 0.000 5.892) 5.895 10.143 ( -0.126 0.000 4.603) 4.605 10.257 ( 3.094 0.000 -4.705) 5.631 10.338 ( 4.509 0.000 -0.030) 4.509 10.507 ( -17.483 0.000 0.320) 17.486 10.849 ( 4.910 0.000 1.108) 5.033 10.952 ( 3.387 0.000 0.802) 3.481 11.045 ( -4.528 0.000 -2.517) 5.180 11.079 ( 1.415 0.000 1.280) 1.908 11.197 ( 4.143 0.000 -3.750) 5.588 11.470 ( 2.042 0.000 -4.202) 4.672 12.428 ( -0.910 0.000 4.895) 4.979 12.710 ( 3.901 0.000 0.168) 3.904 12.919 ( 5.395 0.000 -4.781) 7.209 13.107 ( -3.541 0.000 7.298) 8.112 13.567 ( -9.752 0.000 7.211) 12.129 13.597 ( 0.357 0.000 -0.871) 0.942 13.709 ( -5.251 0.000 -4.772) 7.095 13.996 ( 0.749 0.000 -1.090) 1.322 14.364 ( -1.203 0.000 -0.899) 1.502 14.679 ( 1.813 0.000 -7.325) 7.546 15.033 ( 2.703 0.000 -0.567) 2.762 15.420 ( 2.235 0.000 3.935) 4.526 15.548 ( -7.794 0.000 -7.490) 10.810 16.067 ( 2.998 0.000 -2.618) 3.981 16.094 ( -0.481 0.000 4.249) 4.276 16.297 ( 7.243 0.000 1.058) 7.320 16.426 ( 4.205 0.000 -10.681) 11.479 16.782 ( 3.927 0.000 0.558) 3.967 17.047 ( -9.120 0.000 8.608) 12.541 17.076 ( -0.956 0.000 2.647) 2.814 17.489 ( -4.254 0.000 -3.217) 5.334 17.663 ( -4.695 0.000 -0.279) 4.703 24.424 ( 0.715 0.000 -1.168) 1.370 24.442 ( 2.207 0.000 2.015) 2.988 24.676 ( -3.140 0.000 -2.105) 3.780 24.735 ( -2.400 0.000 0.967) 2.587 25.160 ( 6.041 0.000 1.845) 6.316 25.391 ( 3.103 0.000 -4.261) 5.271 25.574 ( -4.559 0.000 1.261) 4.730 25.583 ( -11.433 0.000 0.507) 11.444 26.988 ( 7.387 0.000 1.407) 7.520 27.245 ( 3.087 0.000 2.011) 3.685 27.299 ( 4.417 0.000 0.237) 4.423 27.787 ( 10.560 0.000 6.425) 12.361 27.981 ( -8.639 0.000 -8.897) 12.401 28.034 ( -10.577 0.000 9.702) 14.353 29.592 ( 0.634 0.000 3.016) 3.082 30.219 ( 5.111 0.000 -10.678) 11.838 ======================= Grid point 104 (36/130) ======================= q-point: (-0.50 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.875 ( -7.292 0.000 1.742) 7.497 2.924 ( -2.540 0.000 5.241) 5.824 3.216 ( -17.705 0.000 -1.034) 17.735 3.471 ( 30.609 0.000 2.440) 30.707 3.556 ( -1.975 0.000 8.826) 9.044 3.707 ( 0.871 0.000 15.183) 15.208 4.332 ( -12.196 0.000 -3.160) 12.598 4.609 ( 8.480 0.000 -5.320) 10.011 4.625 ( 12.261 0.000 10.121) 15.899 4.673 ( -6.535 0.000 4.400) 7.878 5.166 ( -10.032 0.000 3.611) 10.662 5.298 ( -7.788 0.000 4.024) 8.766 5.612 ( -5.734 0.000 -9.898) 11.439 5.707 ( 3.759 0.000 -12.398) 12.955 5.761 ( -2.420 0.000 -9.780) 10.075 6.004 ( -4.811 0.000 0.319) 4.821 6.091 ( 9.017 0.000 -4.142) 9.922 6.468 ( 7.551 0.000 -19.418) 20.834 6.780 ( 0.004 0.000 10.405) 10.405 7.094 ( -2.215 0.000 1.155) 2.498 7.250 ( 0.934 0.000 0.697) 1.166 7.434 ( 4.338 0.000 1.488) 4.587 7.466 ( 0.378 0.000 -2.456) 2.485 7.838 ( 0.231 0.000 -7.679) 7.683 8.043 ( -6.191 0.000 -6.038) 8.648 8.202 ( 3.918 0.000 -5.259) 6.558 8.374 ( -13.155 0.000 4.624) 13.944 8.434 ( 1.969 0.000 4.264) 4.696 8.532 ( 5.809 0.000 -10.071) 11.626 8.614 ( 11.037 0.000 -1.670) 11.163 9.011 ( 7.220 0.000 19.651) 20.935 9.067 ( -2.190 0.000 8.818) 9.086 9.246 ( -4.780 0.000 -2.777) 5.528 9.276 ( -6.552 0.000 10.721) 12.564 9.565 ( 2.724 0.000 7.242) 7.738 9.849 ( -1.333 0.000 4.347) 4.546 10.082 ( -8.628 0.000 -2.528) 8.991 10.283 ( 3.487 0.000 -5.325) 6.365 10.338 ( 0.609 0.000 -0.238) 0.654 10.392 ( 1.395 0.000 -0.628) 1.530 10.935 ( -6.367 0.000 1.607) 6.567 10.970 ( -1.298 0.000 -1.380) 1.895 10.991 ( 8.473 0.000 1.073) 8.540 11.068 ( -1.595 0.000 -1.078) 1.925 11.292 ( 5.193 0.000 2.513) 5.769 11.462 ( 1.143 0.000 -4.861) 4.994 12.469 ( -0.584 0.000 7.701) 7.723 12.745 ( -0.303 0.000 0.531) 0.611 12.914 ( 0.036 0.000 -6.615) 6.615 13.032 ( -6.928 0.000 -0.367) 6.938 13.512 ( -2.719 0.000 7.153) 7.653 13.616 ( 1.415 0.000 1.009) 1.738 13.679 ( 3.939 0.000 -0.299) 3.950 13.983 ( -0.303 0.000 -2.869) 2.885 14.342 ( -0.127 0.000 -1.242) 1.248 14.696 ( 5.638 0.000 -6.937) 8.939 15.052 ( 0.146 0.000 -1.025) 1.036 15.254 ( -9.604 0.000 -13.102) 16.245 15.538 ( 3.374 0.000 5.052) 6.075 16.016 ( -4.353 0.000 -0.554) 4.388 16.085 ( 1.584 0.000 -3.573) 3.909 16.388 ( 2.667 0.000 -13.811) 14.066 16.604 ( 11.524 0.000 15.814) 19.568 16.809 ( -4.166 0.000 1.328) 4.372 16.998 ( -1.832 0.000 8.086) 8.291 17.037 ( -4.461 0.000 -0.489) 4.487 17.459 ( 3.095 0.000 -0.871) 3.215 17.581 ( -2.125 0.000 -3.706) 4.272 24.443 ( 1.795 0.000 0.244) 1.811 24.454 ( -2.146 0.000 0.024) 2.147 24.658 ( 2.399 0.000 0.159) 2.404 24.696 ( -1.899 0.000 -0.634) 2.002 25.259 ( -0.493 0.000 0.745) 0.893 25.422 ( 2.676 0.000 -3.624) 4.505 25.437 ( -0.890 0.000 1.176) 1.474 25.509 ( -1.798 0.000 0.150) 1.805 27.106 ( 2.018 0.000 4.708) 5.122 27.314 ( -2.031 0.000 -1.821) 2.728 27.320 ( 2.497 0.000 4.227) 4.909 27.751 ( -7.030 0.000 -7.278) 10.119 27.915 ( -8.523 0.000 5.610) 10.204 28.077 ( 12.487 0.000 8.122) 14.896 29.588 ( -3.462 0.000 1.643) 3.832 30.230 ( 5.008 0.000 -10.047) 11.226 ======================= Grid point 105 (37/130) ======================= q-point: (-0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.600 ( -21.667 0.000 1.027) 21.692 2.640 ( -28.936 0.000 0.955) 28.952 3.006 ( -7.226 0.000 1.908) 7.474 3.573 ( -4.275 0.000 13.793) 14.440 3.776 ( 0.944 0.000 1.765) 2.001 4.147 ( 28.506 0.000 4.904) 28.925 4.270 ( 8.048 0.000 7.150) 10.765 4.504 ( -15.673 0.000 -10.445) 18.835 4.707 ( -6.688 0.000 9.280) 11.439 4.920 ( -2.338 0.000 -2.343) 3.310 4.963 ( 15.003 0.000 7.717) 16.872 5.211 ( -7.880 0.000 4.050) 8.860 5.512 ( -10.284 0.000 -14.450) 17.735 5.558 ( 4.855 0.000 -2.552) 5.485 5.813 ( 10.394 0.000 -3.174) 10.867 5.842 ( -6.761 0.000 -5.463) 8.692 6.017 ( -8.150 0.000 -7.034) 10.765 6.494 ( 7.888 0.000 -14.848) 16.813 6.826 ( -4.855 0.000 11.542) 12.522 7.014 ( -6.315 0.000 -1.029) 6.398 7.258 ( -1.279 0.000 3.814) 4.023 7.508 ( 0.468 0.000 4.151) 4.178 7.514 ( 7.077 0.000 -3.940) 8.100 7.790 ( 3.233 0.000 -11.653) 12.093 7.917 ( -4.995 0.000 -0.269) 5.002 8.107 ( -6.556 0.000 -6.172) 9.004 8.282 ( -0.917 0.000 0.917) 1.297 8.443 ( -3.647 0.000 4.914) 6.119 8.501 ( -0.559 0.000 -8.843) 8.861 8.717 ( 1.942 0.000 -0.572) 2.024 8.924 ( -16.149 0.000 7.349) 17.743 9.118 ( -3.299 0.000 -3.941) 5.139 9.317 ( -0.706 0.000 8.877) 8.905 9.387 ( 6.042 0.000 21.509) 22.341 9.719 ( 8.628 0.000 9.386) 12.749 9.857 ( -2.374 0.000 -5.797) 6.264 9.908 ( -5.099 0.000 5.182) 7.270 10.271 ( -0.479 0.000 -4.390) 4.416 10.396 ( -0.614 0.000 0.293) 0.680 10.401 ( 6.420 0.000 -2.792) 7.001 10.825 ( -6.042 0.000 1.525) 6.231 10.881 ( -5.529 0.000 -2.640) 6.127 11.027 ( -2.443 0.000 -1.072) 2.668 11.190 ( 11.853 0.000 0.727) 11.876 11.391 ( 2.875 0.000 2.596) 3.873 11.426 ( -1.112 0.000 -4.985) 5.108 12.540 ( 1.367 0.000 7.394) 7.519 12.696 ( -5.517 0.000 -0.406) 5.532 12.852 ( -1.980 0.000 -1.078) 2.254 12.904 ( -4.905 0.000 -0.424) 4.924 13.553 ( 1.738 0.000 3.571) 3.971 13.671 ( 2.926 0.000 2.315) 3.731 13.805 ( 8.903 0.000 0.093) 8.904 13.946 ( -0.506 0.000 -3.940) 3.972 14.340 ( 1.045 0.000 -1.163) 1.563 14.722 ( 4.490 0.000 -15.221) 15.869 15.026 ( -5.716 0.000 -2.530) 6.251 15.033 ( -1.288 0.000 0.079) 1.290 15.650 ( 2.834 0.000 7.447) 7.968 15.945 ( -3.832 0.000 1.229) 4.024 16.050 ( -1.515 0.000 -7.335) 7.489 16.323 ( 2.052 0.000 -10.811) 11.004 16.680 ( -7.014 0.000 -4.310) 8.232 16.797 ( -7.894 0.000 8.714) 11.758 17.041 ( 10.649 0.000 2.257) 10.885 17.070 ( 0.147 0.000 10.192) 10.194 17.529 ( 1.209 0.000 -7.123) 7.225 17.562 ( 7.085 0.000 1.082) 7.167 24.398 ( -2.882 0.000 -0.292) 2.897 24.495 ( 2.605 0.000 2.129) 3.364 24.654 ( -1.079 0.000 -2.829) 3.028 24.731 ( 4.141 0.000 0.736) 4.206 25.158 ( -7.384 0.000 1.755) 7.590 25.395 ( -0.522 0.000 -4.576) 4.606 25.553 ( 4.459 0.000 1.369) 4.665 25.562 ( 9.495 0.000 0.042) 9.495 27.123 ( -5.458 0.000 6.964) 8.848 27.205 ( -6.954 0.000 -3.765) 7.908 27.407 ( 1.433 0.000 7.652) 7.785 27.568 ( -7.881 0.000 -4.450) 9.050 27.830 ( -3.158 0.000 1.511) 3.501 28.408 ( 16.118 0.000 7.569) 17.806 29.498 ( -6.648 0.000 0.845) 6.701 30.232 ( 3.890 0.000 -10.569) 11.262 ======================= Grid point 106 (38/130) ======================= q-point: (-0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.017 ( -35.906 0.000 -2.641) 36.002 2.103 ( -32.258 0.000 1.788) 32.308 2.851 ( -10.900 0.000 1.486) 11.001 3.672 ( 1.725 0.000 16.737) 16.825 3.674 ( -28.670 0.000 -10.594) 30.565 3.988 ( -8.760 0.000 1.709) 8.925 4.337 ( -1.458 0.000 -0.278) 1.484 4.717 ( 0.325 0.000 0.582) 0.667 4.755 ( 20.127 0.000 3.436) 20.418 4.878 ( -15.573 0.000 5.534) 16.527 5.013 ( -5.060 0.000 1.376) 5.244 5.033 ( -13.380 0.000 -3.913) 13.940 5.405 ( 10.933 0.000 8.814) 14.044 5.713 ( 5.449 0.000 3.074) 6.256 5.778 ( -6.163 0.000 -9.560) 11.374 5.814 ( 11.279 0.000 -2.760) 11.612 6.073 ( 17.353 0.000 -1.984) 17.466 6.483 ( 3.119 0.000 -12.819) 13.193 6.809 ( -4.335 0.000 8.355) 9.412 6.843 ( -10.178 0.000 -3.527) 10.772 7.292 ( -0.815 0.000 7.351) 7.396 7.489 ( -3.949 0.000 -1.338) 4.169 7.604 ( 3.462 0.000 -5.150) 6.205 7.792 ( 5.962 0.000 -8.029) 10.000 7.847 ( -1.467 0.000 3.239) 3.556 7.966 ( -4.167 0.000 -3.703) 5.574 8.276 ( -2.493 0.000 4.996) 5.584 8.394 ( -1.459 0.000 -10.488) 10.589 8.407 ( -3.265 0.000 3.700) 4.934 8.685 ( -14.856 0.000 5.702) 15.913 8.713 ( -1.890 0.000 0.907) 2.096 9.036 ( -3.607 0.000 -0.220) 3.614 9.319 ( -3.533 0.000 1.885) 4.005 9.543 ( 0.411 0.000 8.821) 8.831 9.665 ( -7.498 0.000 -7.595) 10.672 9.935 ( -0.527 0.000 9.153) 9.168 9.991 ( 2.674 0.000 10.477) 10.813 10.280 ( 4.821 0.000 4.525) 6.611 10.355 ( -5.288 0.000 2.101) 5.690 10.525 ( 9.211 0.000 -5.463) 10.709 10.753 ( -1.869 0.000 -0.693) 1.994 10.769 ( -2.715 0.000 -1.208) 2.971 10.953 ( -3.227 0.000 -3.562) 4.806 11.333 ( -4.337 0.000 -5.116) 6.707 11.435 ( -0.275 0.000 2.013) 2.032 11.441 ( 15.572 0.000 -2.229) 15.731 12.531 ( -6.723 0.000 -1.113) 6.814 12.553 ( -8.619 0.000 -0.022) 8.619 12.852 ( -1.853 0.000 1.377) 2.308 12.941 ( 7.603 0.000 12.906) 14.979 13.610 ( 2.662 0.000 -0.904) 2.811 13.754 ( 3.679 0.000 2.506) 4.452 13.904 ( -0.113 0.000 -5.109) 5.110 13.996 ( 11.293 0.000 0.572) 11.308 14.362 ( 1.964 0.000 -0.370) 1.998 14.606 ( -1.324 0.000 -14.742) 14.802 15.004 ( 0.770 0.000 2.069) 2.207 15.025 ( -1.123 0.000 4.885) 5.013 15.745 ( 0.245 0.000 7.968) 7.971 15.890 ( -3.513 0.000 2.109) 4.097 15.896 ( -6.549 0.000 -10.837) 12.662 16.306 ( 2.739 0.000 -5.114) 5.801 16.495 ( -5.335 0.000 -13.645) 14.651 16.630 ( -11.525 0.000 1.944) 11.687 17.149 ( -0.810 0.000 10.438) 10.469 17.297 ( 11.253 0.000 3.959) 11.929 17.507 ( 3.117 0.000 -8.127) 8.704 17.719 ( 8.126 0.000 1.819) 8.327 24.357 ( -1.553 0.000 0.480) 1.625 24.544 ( -1.094 0.000 2.374) 2.614 24.638 ( 3.839 0.000 -3.287) 5.054 24.806 ( 3.305 0.000 0.178) 3.310 25.059 ( -5.067 0.000 2.851) 5.813 25.364 ( 1.954 0.000 -5.978) 6.289 25.664 ( 4.861 0.000 4.084) 6.349 25.728 ( 8.262 0.000 -1.230) 8.353 27.013 ( -9.508 0.000 -4.494) 10.516 27.019 ( -11.403 0.000 6.704) 13.228 27.376 ( -10.032 0.000 -2.411) 10.317 27.494 ( -0.350 0.000 11.725) 11.730 27.833 ( 2.633 0.000 0.124) 2.636 28.784 ( 18.394 0.000 5.060) 19.077 29.382 ( -6.348 0.000 1.785) 6.595 30.190 ( 1.910 0.000 -14.235) 14.363 ======================= Grid point 107 (39/130) ======================= q-point: (-0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.323 ( -36.931 0.000 2.731) 37.032 1.478 ( -37.323 0.000 6.177) 37.830 2.648 ( -11.721 0.000 -3.376) 12.197 2.699 ( -60.461 0.000 2.247) 60.503 3.769 ( -26.085 0.000 12.420) 28.891 3.980 ( -6.676 0.000 -7.382) 9.953 4.093 ( 7.575 0.000 4.605) 8.865 4.544 ( -15.213 0.000 -0.012) 15.213 4.717 ( 2.678 0.000 -6.679) 7.196 4.948 ( 5.672 0.000 5.738) 8.068 5.056 ( -2.575 0.000 15.517) 15.729 5.080 ( 10.138 0.000 -3.747) 10.808 5.485 ( -2.452 0.000 -10.693) 10.970 5.751 ( -4.420 0.000 7.574) 8.770 5.818 ( 10.232 0.000 4.202) 11.061 6.124 ( 19.143 0.000 -0.359) 19.146 6.352 ( 7.447 0.000 -0.460) 7.461 6.456 ( 8.137 0.000 -8.683) 11.900 6.606 ( -7.698 0.000 -7.640) 10.846 6.816 ( -1.411 0.000 4.135) 4.369 7.279 ( -4.502 0.000 1.106) 4.636 7.356 ( -7.076 0.000 -5.357) 8.876 7.578 ( -1.768 0.000 3.041) 3.518 7.846 ( -0.193 0.000 -0.538) 0.572 7.892 ( 2.296 0.000 -4.637) 5.175 7.915 ( 3.033 0.000 0.838) 3.146 8.228 ( -7.706 0.000 4.767) 9.061 8.345 ( 3.110 0.000 -5.722) 6.512 8.416 ( 3.117 0.000 1.395) 3.415 8.477 ( -11.170 0.000 5.491) 12.447 8.682 ( -2.389 0.000 2.204) 3.251 8.964 ( -4.623 0.000 -0.690) 4.674 9.263 ( -0.216 0.000 -2.736) 2.745 9.514 ( -3.165 0.000 -4.562) 5.552 9.613 ( 1.813 0.000 4.558) 4.905 9.886 ( -4.398 0.000 -0.188) 4.402 10.125 ( 1.653 0.000 10.330) 10.461 10.226 ( -9.358 0.000 -0.365) 9.365 10.427 ( -0.993 0.000 15.045) 15.077 10.543 ( -1.692 0.000 -3.774) 4.136 10.759 ( 2.746 0.000 0.497) 2.791 10.862 ( 2.960 0.000 -5.707) 6.429 10.890 ( 10.108 0.000 -0.942) 10.152 11.204 ( -4.221 0.000 -5.028) 6.565 11.416 ( -2.910 0.000 1.125) 3.120 11.702 ( 15.387 0.000 -7.033) 16.919 12.343 ( -11.060 0.000 -0.867) 11.094 12.400 ( -8.138 0.000 1.164) 8.221 12.833 ( -1.006 0.000 -0.937) 1.375 13.241 ( 9.977 0.000 14.730) 17.791 13.632 ( 1.681 0.000 -2.983) 3.424 13.838 ( 3.097 0.000 2.096) 3.740 13.851 ( -0.833 0.000 -6.078) 6.134 14.229 ( 11.387 0.000 2.891) 11.748 14.422 ( 4.509 0.000 4.376) 6.284 14.493 ( -1.188 0.000 -6.190) 6.303 15.025 ( 1.099 0.000 -2.447) 2.682 15.110 ( 2.320 0.000 17.701) 17.853 15.663 ( -9.020 0.000 -9.138) 12.840 15.781 ( -2.890 0.000 7.673) 8.199 15.850 ( -3.013 0.000 2.532) 3.936 16.233 ( -7.082 0.000 -25.015) 25.999 16.329 ( 2.637 0.000 -2.032) 3.329 16.445 ( -9.340 0.000 1.885) 9.529 17.192 ( -1.442 0.000 3.908) 4.166 17.496 ( 7.956 0.000 0.940) 8.011 17.525 ( 3.704 0.000 -1.871) 4.149 17.877 ( 6.971 0.000 1.740) 7.185 24.348 ( -0.177 0.000 0.967) 0.983 24.505 ( -2.093 0.000 -1.383) 2.508 24.727 ( 5.434 0.000 0.738) 5.484 24.847 ( 0.814 0.000 0.171) 0.832 25.019 ( -1.882 0.000 3.181) 3.696 25.375 ( 5.132 0.000 -7.320) 8.939 25.792 ( 3.777 0.000 7.668) 8.547 25.832 ( 4.113 0.000 -1.900) 4.530 26.810 ( -7.825 0.000 -3.837) 8.715 26.830 ( -13.344 0.000 5.007) 14.253 27.162 ( -11.166 0.000 -0.864) 11.200 27.593 ( 0.395 0.000 12.602) 12.609 27.914 ( 4.541 0.000 2.358) 5.117 29.120 ( 15.461 0.000 -8.005) 17.411 29.329 ( -2.499 0.000 11.635) 11.901 30.044 ( -2.427 0.000 -23.512) 23.637 ======================= Grid point 108 (40/130) ======================= q-point: (-0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.803 ( -27.894 0.000 22.972) 36.136 0.883 ( -34.677 0.000 18.416) 39.264 1.567 ( -63.407 0.000 29.484) 69.927 2.467 ( -5.596 0.000 -6.933) 8.910 3.046 ( -35.428 0.000 -7.001) 36.113 4.066 ( 2.584 0.000 4.272) 4.993 4.247 ( 2.860 0.000 5.068) 5.819 4.395 ( -3.478 0.000 9.648) 10.256 4.722 ( 2.440 0.000 -5.597) 6.105 4.958 ( -2.293 0.000 -18.110) 18.254 5.139 ( -1.817 0.000 15.659) 15.764 5.234 ( 10.693 0.000 -0.751) 10.719 5.406 ( 0.220 0.000 -2.604) 2.613 5.677 ( -10.046 0.000 8.196) 12.965 5.922 ( -0.285 0.000 -3.183) 3.196 6.317 ( -6.712 0.000 1.105) 6.803 6.471 ( 15.787 0.000 3.147) 16.098 6.501 ( 11.168 0.000 -10.671) 15.447 6.691 ( 10.813 0.000 -1.029) 10.862 6.791 ( -0.321 0.000 -1.395) 1.432 7.165 ( -7.602 0.000 -6.391) 9.931 7.216 ( -3.433 0.000 0.287) 3.445 7.581 ( -1.299 0.000 3.764) 3.982 7.765 ( -5.687 0.000 0.642) 5.723 7.921 ( -0.115 0.000 -3.299) 3.301 7.956 ( 5.385 0.000 -5.070) 7.396 8.065 ( -11.178 0.000 0.759) 11.204 8.357 ( 3.115 0.000 -2.431) 3.952 8.429 ( -1.677 0.000 9.041) 9.195 8.510 ( 3.401 0.000 -6.973) 7.758 8.678 ( -0.680 0.000 5.418) 5.460 8.790 ( -11.673 0.000 -10.803) 15.905 9.302 ( 3.616 0.000 1.706) 3.999 9.458 ( 0.190 0.000 -2.910) 2.916 9.630 ( -1.913 0.000 -9.704) 9.890 9.833 ( -0.109 0.000 -1.861) 1.864 10.019 ( -10.985 0.000 -1.997) 11.165 10.193 ( -1.989 0.000 7.021) 7.298 10.497 ( 0.047 0.000 -2.958) 2.959 10.521 ( -0.162 0.000 12.809) 12.810 10.803 ( 0.344 0.000 -2.171) 2.199 10.826 ( 1.166 0.000 -4.406) 4.557 11.092 ( -5.135 0.000 -7.119) 8.777 11.161 ( 13.799 0.000 -0.443) 13.806 11.357 ( -3.071 0.000 -0.819) 3.179 11.865 ( 8.595 0.000 -5.995) 10.479 12.153 ( -8.091 0.000 0.741) 8.125 12.276 ( -5.634 0.000 0.017) 5.634 12.797 ( 0.396 0.000 -1.845) 1.887 13.456 ( 0.442 0.000 8.141) 8.153 13.643 ( 2.070 0.000 -1.330) 2.460 13.802 ( 0.429 0.000 -0.557) 0.704 13.893 ( 1.185 0.000 1.358) 1.802 14.356 ( 3.341 0.000 -2.836) 4.383 14.463 ( 1.125 0.000 -1.596) 1.953 14.689 ( 12.585 0.000 7.975) 14.899 15.012 ( 1.526 0.000 -5.509) 5.717 15.395 ( -5.644 0.000 -7.842) 9.661 15.498 ( -4.101 0.000 6.300) 7.518 15.786 ( -3.000 0.000 7.244) 7.841 15.807 ( -3.611 0.000 2.316) 4.289 15.955 ( 17.188 0.000 18.947) 25.581 16.331 ( -5.097 0.000 3.270) 6.055 16.392 ( 5.700 0.000 8.314) 10.080 17.148 ( -2.480 0.000 -5.420) 5.961 17.605 ( 3.926 0.000 -1.394) 4.166 17.632 ( 5.750 0.000 8.211) 10.024 17.991 ( 3.738 0.000 1.180) 3.920 24.358 ( 0.238 0.000 0.740) 0.777 24.464 ( -0.721 0.000 -1.813) 1.952 24.824 ( 3.509 0.000 1.367) 3.766 24.847 ( -1.000 0.000 1.532) 1.830 25.028 ( -0.204 0.000 2.340) 2.349 25.438 ( 8.505 0.000 -8.444) 11.985 25.860 ( 1.019 0.000 -1.146) 1.534 25.931 ( 3.264 0.000 10.774) 11.258 26.634 ( -10.482 0.000 3.292) 10.987 26.682 ( -2.895 0.000 -2.736) 3.983 26.972 ( -8.073 0.000 -0.520) 8.090 27.577 ( -15.025 0.000 -20.006) 25.020 28.015 ( 2.825 0.000 4.086) 4.967 29.148 ( 2.289 0.000 -14.715) 14.892 29.514 ( 5.474 0.000 13.665) 14.720 29.708 ( -8.849 0.000 -15.883) 18.182 ======================= Grid point 109 (41/130) ======================= q-point: ( 0.00 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.032 ( 2.457 24.110 25.874) 35.452 1.136 ( 10.529 30.679 23.330) 39.954 1.908 ( -1.200 41.793 42.093) 59.329 2.477 ( 1.315 12.312 -8.913) 15.256 2.640 ( -4.397 8.260 -12.679) 15.758 3.988 ( -3.269 -9.189 0.903) 9.795 4.152 ( 0.676 -8.576 4.071) 9.517 4.360 ( -3.649 -5.294 1.493) 6.601 4.599 ( 1.980 -6.282 1.020) 6.665 4.902 ( -6.529 8.107 -11.016) 15.156 5.209 ( -3.269 -5.195 -4.504) 7.613 5.331 ( -1.746 4.522 14.777) 15.552 5.437 ( -0.511 -0.917 -0.073) 1.052 5.659 ( 2.550 7.555 4.269) 9.044 5.862 ( -0.091 -0.389 -8.696) 8.705 6.387 ( 0.879 8.285 1.014) 8.393 6.617 ( -2.449 -2.183 -1.270) 3.518 6.733 ( 3.838 1.121 4.770) 6.225 6.749 ( 11.667 8.534 -20.651) 25.207 6.914 ( -2.191 3.070 -0.330) 3.786 7.100 ( -3.504 4.413 -3.631) 6.703 7.287 ( 4.251 12.726 -7.815) 15.527 7.610 ( -1.548 0.175 0.728) 1.719 7.711 ( -4.685 4.234 3.287) 7.119 7.879 ( 1.814 -0.283 -0.169) 1.844 7.924 ( -3.486 0.617 -6.940) 7.791 8.014 ( -0.106 -0.318 -5.493) 5.503 8.061 ( -5.302 3.767 -4.551) 7.938 8.373 ( 1.233 -3.059 4.847) 5.863 8.536 ( 1.382 -0.806 8.962) 9.103 8.652 ( -4.190 -0.806 4.655) 6.315 8.701 ( -0.521 2.974 3.949) 4.971 9.107 ( -11.828 -12.182 5.729) 17.920 9.370 ( 3.145 -7.282 7.107) 10.650 9.417 ( -1.332 -2.915 -10.881) 11.343 9.871 ( 1.049 0.651 -3.183) 3.414 9.954 ( 2.812 0.412 4.778) 5.560 10.012 ( -3.181 -13.757 6.683) 15.622 10.322 ( -6.267 -4.304 3.779) 8.490 10.565 ( 9.220 -10.394 10.476) 17.401 10.661 ( -0.013 -1.103 5.468) 5.578 10.785 ( 1.677 2.270 1.010) 2.998 11.088 ( 1.745 9.176 1.086) 9.404 11.184 ( 3.054 -13.260 9.691) 16.705 11.311 ( -1.459 4.298 0.949) 4.638 11.467 ( 1.525 7.925 -2.207) 8.367 12.035 ( 1.304 -5.896 2.089) 6.390 12.167 ( -0.715 -3.924 -1.140) 4.149 12.897 ( 2.719 1.389 6.023) 6.753 13.379 ( -9.211 0.001 -4.140) 10.098 13.805 ( 1.947 -6.102 6.838) 9.369 13.957 ( -3.282 3.826 -0.069) 5.041 14.122 ( 9.577 4.826 -10.170) 14.779 14.283 ( 1.281 -7.901 -2.955) 8.533 14.434 ( -4.347 -7.201 4.537) 9.557 14.613 ( 6.609 -14.590 -1.497) 16.087 14.879 ( -4.312 -6.726 -8.286) 11.510 15.239 ( -10.844 15.911 -20.378) 28.036 15.447 ( 1.815 1.441 4.557) 5.112 15.671 ( -3.291 -7.107 7.139) 10.598 15.768 ( -5.497 3.344 -4.174) 7.670 16.262 ( 3.586 -5.851 -6.562) 9.495 16.468 ( 0.095 8.820 6.752) 11.108 17.002 ( 5.927 -10.557 11.954) 17.014 17.174 ( 3.675 5.265 -6.411) 9.074 17.431 ( 1.944 -7.917 1.395) 8.271 17.923 ( -0.286 10.059 6.367) 11.909 18.422 ( 2.561 14.527 -12.070) 19.060 24.383 ( -0.214 2.019 0.455) 2.081 24.462 ( -0.028 1.492 -1.630) 2.210 24.825 ( 0.798 1.112 0.739) 1.556 24.983 ( -0.268 1.043 -1.593) 1.923 25.346 ( 6.239 20.979 -15.422) 26.775 25.534 ( 2.730 3.305 -10.312) 11.168 25.898 ( -2.830 2.304 0.561) 3.692 25.952 ( -14.659 4.365 -0.268) 15.297 26.538 ( -2.810 1.160 1.719) 3.492 26.672 ( 3.327 -0.211 1.340) 3.593 26.768 ( -9.423 7.542 -7.405) 14.160 26.894 ( -2.034 2.186 -2.212) 3.716 28.074 ( 0.803 -3.231 8.826) 9.433 28.803 ( 7.047 -24.196 7.308) 26.240 29.467 ( 9.638 -19.290 17.200) 27.583 29.617 ( 1.096 -6.184 7.960) 10.140 ======================= Grid point 110 (42/130) ======================= q-point: ( 0.10 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.410 ( 16.324 21.057 19.877) 33.241 1.740 ( 23.754 17.265 28.970) 41.250 2.449 ( 14.446 11.324 -9.456) 20.648 2.642 ( 29.940 19.723 14.556) 38.695 2.727 ( 22.230 15.794 1.903) 27.336 3.938 ( 2.788 -5.083 -3.677) 6.865 4.185 ( -1.466 -3.777 4.657) 6.173 4.326 ( -0.015 -7.436 -2.733) 7.922 4.621 ( 0.510 -3.198 -5.175) 6.105 4.774 ( -3.016 0.505 2.717) 4.091 5.079 ( -4.334 1.040 -4.088) 6.047 5.340 ( -5.982 -4.126 10.913) 13.111 5.502 ( 1.252 1.975 3.356) 4.091 5.685 ( 1.403 5.868 -9.555) 11.301 5.864 ( 3.956 6.455 -0.375) 7.580 6.379 ( -8.431 -1.694 1.324) 8.701 6.516 ( -0.986 5.796 0.044) 5.879 6.747 ( -4.429 -1.308 0.532) 4.649 6.772 ( 2.138 7.633 -4.172) 8.958 6.900 ( 7.013 3.606 -5.624) 9.686 7.041 ( -1.518 9.141 -6.735) 11.455 7.185 ( -3.368 12.361 -2.740) 13.102 7.676 ( 5.285 0.082 -0.970) 5.374 7.710 ( 1.951 0.855 8.482) 8.745 7.874 ( 1.060 -1.449 -4.590) 4.929 7.883 ( 2.083 -0.939 -3.071) 3.828 8.010 ( 1.370 2.608 -4.524) 5.398 8.217 ( 18.990 -0.123 -10.875) 21.883 8.405 ( -4.414 -0.637 3.435) 5.629 8.480 ( -8.200 3.584 1.533) 9.079 8.675 ( 4.016 -1.590 5.254) 6.802 8.783 ( 1.828 -0.206 11.294) 11.443 9.065 ( 1.848 -10.742 0.772) 10.927 9.296 ( -2.160 -1.586 -11.162) 11.480 9.504 ( 3.115 -8.763 7.459) 11.922 9.819 ( -1.524 -2.895 -3.696) 4.936 9.993 ( -0.370 -4.410 1.569) 4.695 10.104 ( 3.592 -0.201 5.887) 6.899 10.292 ( -1.054 -2.965 2.905) 4.283 10.581 ( 2.168 7.212 -3.919) 8.489 10.809 ( -1.216 3.234 1.408) 3.731 10.888 ( 8.333 -15.206 3.519) 17.693 11.115 ( 0.685 4.721 -1.215) 4.923 11.240 ( -7.484 -9.285 3.249) 12.360 11.270 ( 1.851 9.006 1.187) 9.270 11.499 ( 2.768 1.003 -1.228) 3.189 12.156 ( 8.239 -6.182 0.729) 10.326 12.225 ( 8.392 -3.548 0.431) 9.121 12.988 ( -0.862 -0.184 10.413) 10.451 13.127 ( -12.170 1.722 -6.615) 13.958 13.823 ( -4.515 -0.764 0.155) 4.582 13.904 ( -2.071 0.743 3.393) 4.044 14.141 ( -1.285 0.529 -7.893) 8.014 14.266 ( -2.344 -11.990 -1.436) 12.302 14.443 ( 2.285 -2.405 3.432) 4.773 14.630 ( -10.479 8.481 -2.120) 13.647 14.730 ( 5.997 -7.828 -1.437) 9.965 15.043 ( 3.160 8.129 -8.377) 12.092 15.550 ( 2.574 -3.842 5.546) 7.221 15.659 ( -4.048 -6.824 2.842) 8.428 15.709 ( 0.336 -6.862 3.833) 7.867 16.283 ( 3.886 -5.927 -5.608) 9.038 16.535 ( 1.050 9.791 6.734) 11.930 16.938 ( -3.169 3.504 -8.107) 9.384 17.194 ( -6.788 -10.420 8.572) 15.104 17.421 ( -2.488 -2.695 -3.523) 5.086 17.935 ( -4.204 9.197 7.087) 12.348 18.203 ( -12.284 14.130 -4.259) 19.201 24.375 ( -0.804 2.660 0.434) 2.813 24.455 ( 0.738 1.498 -1.498) 2.244 24.822 ( -1.850 0.573 0.999) 2.179 24.942 ( -2.267 1.586 -2.063) 3.451 25.194 ( -6.371 17.530 -2.692) 18.845 25.497 ( 2.200 3.800 -7.918) 9.054 25.746 ( -5.577 1.993 5.319) 7.961 25.971 ( 1.205 1.918 2.893) 3.675 26.569 ( 4.919 1.685 -0.045) 5.200 26.776 ( 6.983 1.785 1.638) 7.391 26.888 ( 14.196 0.676 -6.945) 15.818 26.951 ( 9.269 1.581 -1.459) 9.515 28.139 ( -2.913 -3.618 11.733) 12.619 28.783 ( -2.081 -5.410 -15.144) 16.216 29.574 ( -6.168 -6.342 5.698) 10.523 29.851 ( 11.214 -28.646 4.650) 31.112 ======================= Grid point 111 (43/130) ======================= q-point: ( 0.20 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.905 ( 21.145 13.094 13.714) 28.401 2.376 ( 20.959 10.065 23.009) 32.711 2.617 ( 12.398 13.621 -0.357) 18.422 2.820 ( 12.725 7.590 -28.706) 32.304 3.695 ( 39.579 10.169 27.182) 49.079 4.102 ( -2.240 -5.559 5.782) 8.328 4.231 ( 20.186 0.052 -2.543) 20.345 4.291 ( -0.351 -4.495 -3.617) 5.781 4.567 ( -0.034 2.277 -8.099) 8.413 4.737 ( -0.303 -0.489 -5.097) 5.129 5.005 ( -4.369 1.522 5.611) 7.272 5.326 ( -2.039 2.426 -1.638) 3.568 5.467 ( -7.425 2.226 8.393) 11.425 5.648 ( 0.400 -2.138 1.217) 2.493 5.908 ( -0.301 8.932 -2.166) 9.196 6.185 ( -8.730 -3.000 1.863) 9.417 6.498 ( -7.876 10.787 -2.350) 13.562 6.590 ( -6.903 -2.635 -0.180) 7.391 6.788 ( 1.869 7.097 -6.576) 9.854 6.951 ( 2.778 7.156 0.338) 7.684 7.114 ( 13.729 7.501 -4.796) 16.363 7.162 ( 1.610 9.106 -1.141) 9.318 7.728 ( -1.092 -5.782 -1.436) 6.057 7.851 ( 3.019 -1.825 1.286) 3.755 7.897 ( 5.199 0.548 1.927) 5.571 7.926 ( 6.340 1.470 3.886) 7.579 8.043 ( 5.538 -2.680 -5.676) 8.371 8.257 ( -3.710 7.182 -3.349) 8.750 8.413 ( 11.540 -0.705 -10.257) 15.456 8.526 ( 3.663 1.135 8.090) 8.953 8.788 ( 5.548 -0.273 -0.523) 5.579 8.883 ( -2.371 -3.397 11.884) 12.585 9.077 ( -1.006 -2.998 -4.064) 5.149 9.199 ( 0.960 -11.119 -3.294) 11.636 9.577 ( 1.578 -5.526 1.947) 6.067 9.782 ( -1.065 1.219 -4.511) 4.792 10.023 ( 2.395 -3.581 2.839) 5.160 10.161 ( -1.248 0.394 4.568) 4.752 10.304 ( 0.171 -3.107 0.333) 3.130 10.648 ( 5.913 4.573 -2.145) 7.777 10.759 ( -3.624 -0.401 2.481) 4.410 10.988 ( 1.984 -7.696 -0.597) 7.970 11.057 ( -11.373 -8.182 2.502) 14.232 11.118 ( 1.673 4.217 -4.346) 6.283 11.347 ( 3.364 11.243 -1.065) 11.784 11.528 ( 3.767 6.979 -3.139) 8.530 12.324 ( 10.232 -6.003 -0.406) 11.870 12.441 ( 10.623 -1.964 0.248) 10.806 12.843 ( -9.638 2.693 -4.424) 10.941 13.051 ( -3.306 1.010 12.337) 12.812 13.730 ( -3.918 1.659 -1.717) 4.588 13.862 ( -7.459 -0.528 4.895) 8.938 14.012 ( -4.806 -4.469 -4.912) 8.197 14.189 ( -4.287 -10.153 -3.101) 11.449 14.331 ( -8.219 11.416 -0.695) 14.084 14.655 ( 3.404 -14.679 1.164) 15.113 14.824 ( 7.350 -2.253 -4.620) 8.969 15.144 ( 7.220 5.846 4.991) 10.545 15.612 ( -0.148 -5.614 0.625) 5.651 15.634 ( 1.012 -9.736 5.469) 11.213 15.774 ( 2.126 -11.081 4.239) 12.053 16.315 ( 4.128 -5.576 -4.789) 8.430 16.574 ( -1.436 5.715 0.395) 5.905 16.865 ( 1.189 8.455 -3.896) 9.385 17.081 ( -10.608 -10.130 3.210) 15.015 17.303 ( -5.482 2.342 -2.845) 6.605 17.889 ( -6.268 7.558 4.971) 11.006 17.975 ( -9.489 11.461 -1.782) 14.985 24.373 ( 0.266 2.849 0.933) 3.010 24.458 ( 0.914 1.877 -1.881) 2.810 24.785 ( -2.870 -0.645 1.552) 3.326 24.874 ( -3.373 1.208 -1.578) 3.915 25.129 ( -1.303 11.199 1.474) 11.371 25.456 ( 0.215 3.637 -6.801) 7.715 25.706 ( -3.681 2.049 4.133) 5.902 25.955 ( -5.704 1.488 2.522) 6.412 26.697 ( 8.993 2.709 -1.413) 9.498 26.971 ( 11.218 2.668 2.516) 11.802 27.066 ( 9.493 0.917 -4.456) 10.526 27.191 ( 15.088 0.146 3.540) 15.498 28.154 ( -6.042 -3.254 12.389) 14.163 28.561 ( -7.556 -0.258 -15.494) 17.240 29.488 ( -5.225 -6.329 2.804) 8.673 29.999 ( 6.329 -21.055 -4.914) 22.528 ======================= Grid point 112 (44/130) ======================= q-point: ( 0.30 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.373 ( 19.844 8.332 6.286) 22.421 2.764 ( 16.039 11.679 -12.643) 23.526 2.863 ( 16.314 8.029 -14.301) 23.133 2.984 ( 10.943 6.851 31.889) 34.404 3.920 ( -14.994 -2.299 6.553) 16.524 4.162 ( -5.236 -1.316 -6.191) 8.215 4.225 ( -6.886 -6.599 -5.359) 10.940 4.461 ( 3.315 0.842 -2.382) 4.168 4.759 ( 21.766 7.221 15.120) 27.468 4.975 ( 9.548 1.523 -2.647) 10.025 5.044 ( 17.298 0.658 -1.645) 17.388 5.121 ( -10.064 7.673 -0.808) 12.681 5.487 ( -1.188 3.463 12.046) 12.590 5.739 ( 5.188 -5.286 4.633) 8.736 5.806 ( -4.296 4.205 -4.962) 7.795 6.108 ( -2.690 6.812 -2.030) 7.600 6.234 ( -13.368 8.631 -1.856) 16.020 6.518 ( -0.366 -3.596 -3.660) 5.144 6.748 ( 1.071 7.027 -8.562) 11.128 7.057 ( 5.182 6.617 3.621) 9.151 7.202 ( 3.095 4.411 0.310) 5.398 7.313 ( 8.176 8.572 -2.143) 12.039 7.655 ( -1.864 -2.324 -3.014) 4.238 7.874 ( 2.415 -3.542 -2.615) 5.021 8.015 ( 0.438 2.508 5.221) 5.808 8.099 ( 4.254 4.182 -0.960) 6.042 8.123 ( 9.164 -2.173 2.975) 9.876 8.278 ( 9.970 2.308 -6.687) 12.225 8.490 ( 5.348 -1.058 -9.032) 10.550 8.659 ( -2.475 -5.505 11.088) 12.625 8.796 ( -0.866 -2.493 -2.387) 3.558 8.924 ( 1.158 3.060 -1.309) 3.524 9.073 ( 3.228 -5.920 6.457) 9.336 9.274 ( 4.685 -7.317 5.580) 10.326 9.578 ( -3.886 4.373 -6.281) 8.583 9.719 ( 1.516 -3.762 1.111) 4.205 10.108 ( 1.797 -1.108 4.609) 5.070 10.184 ( 2.142 -3.298 1.899) 4.367 10.286 ( -1.128 -0.619 -1.518) 1.990 10.646 ( -2.270 -6.570 0.880) 7.006 10.798 ( -9.775 -1.177 2.868) 10.255 10.875 ( 3.231 0.918 -0.208) 3.365 11.004 ( -0.198 -6.016 -1.796) 6.281 11.117 ( 1.630 2.967 -3.100) 4.590 11.369 ( 2.890 14.285 -4.997) 15.408 11.601 ( 4.692 12.020 -0.931) 12.937 12.456 ( -5.182 -1.342 -1.516) 5.564 12.513 ( 9.517 -4.715 -0.650) 10.640 12.838 ( 7.798 2.772 0.300) 8.282 13.095 ( -2.212 0.937 12.202) 12.436 13.619 ( -8.312 -4.560 -0.191) 9.482 13.744 ( -5.555 3.865 1.362) 6.903 13.868 ( -8.304 -3.169 -3.010) 9.384 14.099 ( -1.154 -0.425 -1.804) 2.184 14.233 ( -2.824 -1.938 -1.526) 3.750 14.653 ( -0.180 -14.094 -5.668) 15.192 14.928 ( 5.910 0.987 -1.959) 6.304 15.304 ( 4.261 -1.621 5.640) 7.252 15.576 ( -4.538 -9.548 3.237) 11.056 15.803 ( 7.849 -4.953 6.747) 11.475 15.843 ( 4.729 -14.105 3.119) 15.200 16.356 ( 4.313 -5.802 -4.857) 8.710 16.452 ( -7.268 2.430 -11.299) 13.653 16.847 ( -4.463 0.959 -5.115) 6.855 16.934 ( -2.179 -0.980 4.467) 5.066 17.233 ( -1.938 5.965 3.028) 6.965 17.757 ( -8.597 8.444 -0.679) 12.070 17.846 ( -5.356 8.579 1.209) 10.185 24.400 ( 1.543 2.126 0.899) 2.776 24.460 ( 0.920 2.806 -1.059) 3.137 24.744 ( -2.573 -0.941 -0.089) 2.741 24.799 ( -3.646 1.635 0.073) 3.996 25.147 ( 1.887 8.064 1.319) 8.386 25.412 ( 0.750 2.449 -5.401) 5.977 25.662 ( -4.405 1.995 3.106) 5.747 25.815 ( -10.184 2.111 1.118) 10.461 26.864 ( 9.664 3.528 -0.925) 10.329 27.166 ( 6.001 0.645 0.593) 6.065 27.208 ( 9.457 4.441 0.434) 10.457 27.503 ( 12.552 -1.061 7.097) 14.459 28.111 ( -8.228 -2.092 8.409) 11.949 28.289 ( -9.618 2.865 -9.456) 13.789 29.458 ( -0.019 -8.086 1.962) 8.321 30.048 ( 5.463 -15.987 -8.567) 18.943 ======================= Grid point 113 (45/130) ======================= q-point: ( 0.40 0.12 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.764 ( 18.001 7.128 5.182) 20.043 2.963 ( 13.154 11.263 -4.798) 17.969 3.108 ( 16.117 6.922 -5.075) 18.260 3.372 ( 3.443 2.224 20.715) 21.117 3.667 ( -13.316 1.206 3.387) 13.792 3.803 ( -16.154 6.402 -2.912) 17.618 4.260 ( 4.720 -8.760 3.527) 10.558 4.496 ( 1.894 2.024 1.187) 3.015 4.728 ( -13.315 -0.245 -5.129) 14.271 4.912 ( -7.910 5.841 -0.289) 9.837 5.199 ( -0.456 -2.583 8.771) 9.155 5.323 ( 3.338 7.676 9.481) 12.647 5.671 ( -2.221 -9.596 -0.996) 9.900 5.769 ( 6.621 2.876 -7.140) 10.153 5.855 ( 16.817 6.168 -7.627) 19.468 6.005 ( -2.201 10.563 -7.485) 13.132 6.105 ( -1.381 8.061 3.143) 8.761 6.475 ( 1.151 -4.114 -10.772) 11.588 6.738 ( 2.250 4.252 0.248) 4.817 7.164 ( 2.693 7.303 3.286) 8.449 7.263 ( 3.156 -0.421 0.097) 3.185 7.352 ( -1.395 6.701 0.199) 6.848 7.634 ( 2.193 6.477 -5.684) 8.893 7.901 ( 2.051 -0.166 -5.317) 5.702 8.064 ( 3.423 -1.617 1.483) 4.066 8.196 ( 4.904 5.457 1.821) 7.560 8.280 ( 6.544 -0.816 0.095) 6.595 8.407 ( 5.947 -2.423 -3.432) 7.282 8.503 ( 5.064 -0.105 -6.058) 7.897 8.551 ( -10.357 -3.441 3.928) 11.599 8.839 ( 1.940 -5.138 3.891) 6.731 8.923 ( 1.168 0.222 3.398) 3.600 9.226 ( 0.536 -2.772 11.542) 11.883 9.389 ( -1.894 -1.246 -3.064) 3.812 9.446 ( 0.647 1.184 5.221) 5.393 9.802 ( 1.655 -2.929 5.103) 6.112 10.137 ( -1.703 -1.174 3.208) 3.817 10.247 ( 1.814 -1.325 -3.665) 4.299 10.290 ( 4.962 -4.237 -0.895) 6.586 10.491 ( -12.974 -2.713 -2.120) 13.423 10.699 ( 2.437 -5.061 0.282) 5.624 10.929 ( -2.894 -2.570 -0.700) 3.934 11.022 ( 4.827 -2.033 -0.034) 5.238 11.134 ( 1.378 4.204 -0.343) 4.438 11.398 ( 3.841 16.789 -2.807) 17.450 11.654 ( 1.988 14.594 -2.005) 14.864 12.388 ( -2.496 -3.514 4.131) 5.971 12.650 ( 5.421 -3.875 -0.770) 6.708 12.939 ( 2.025 1.622 -1.021) 2.788 13.156 ( -0.458 2.701 4.915) 5.627 13.466 ( -7.434 -7.690 3.175) 11.157 13.657 ( -3.476 -1.026 -3.968) 5.374 13.734 ( -3.717 6.395 2.601) 7.841 14.098 ( 1.253 3.343 -1.248) 3.781 14.178 ( -1.615 -8.418 -1.636) 8.727 14.597 ( 1.165 -12.749 -8.956) 15.624 15.001 ( 2.878 1.869 0.434) 3.459 15.403 ( 2.347 -6.073 4.269) 7.785 15.497 ( -5.373 -4.985 0.538) 7.349 15.854 ( 1.104 -15.791 -0.974) 15.859 16.118 ( 6.837 -0.936 8.344) 10.828 16.180 ( -3.550 -5.209 -12.791) 14.260 16.388 ( 4.377 -5.142 -7.346) 9.978 16.715 ( -6.995 -14.154 1.276) 15.840 16.987 ( 2.441 10.424 4.360) 11.560 17.259 ( 0.230 8.995 4.567) 10.091 17.607 ( -5.830 8.599 -1.802) 10.545 17.759 ( -4.124 8.113 -0.988) 9.155 24.425 ( 0.949 1.155 -0.298) 1.524 24.491 ( 1.783 3.668 1.155) 4.239 24.683 ( -2.153 0.496 -2.069) 3.026 24.750 ( -2.552 1.626 1.196) 3.254 25.219 ( 4.869 5.222 0.741) 7.178 25.405 ( 2.593 1.468 -3.847) 4.866 25.592 ( -5.399 1.862 1.657) 5.946 25.624 ( -9.916 3.421 0.326) 10.494 27.027 ( 7.338 3.819 1.581) 8.422 27.256 ( 3.281 1.050 2.098) 4.033 27.349 ( 4.225 4.508 0.397) 6.191 27.764 ( 9.835 -1.690 6.279) 11.790 27.963 ( -8.125 -0.837 -3.946) 9.071 28.100 ( -8.962 5.343 4.548) 11.382 29.492 ( 0.885 -9.514 1.824) 9.727 30.073 ( 5.238 -13.844 -9.541) 17.610 ======================= Grid point 114 (46/130) ======================= q-point: (-0.50 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.941 ( -6.704 6.754 3.323) 10.080 3.084 ( -4.886 13.788 3.344) 15.005 3.251 ( -13.448 3.728 -1.148) 14.002 3.493 ( 28.889 2.166 3.156) 29.142 3.570 ( -3.729 1.598 7.330) 8.377 3.763 ( 0.544 5.099 13.277) 14.233 4.298 ( -6.762 -4.219 -1.237) 8.065 4.506 ( 4.620 -5.691 0.983) 7.395 4.676 ( 8.349 2.897 0.961) 8.890 4.786 ( -4.050 10.137 4.650) 11.866 5.175 ( -4.574 -8.511 5.960) 11.352 5.304 ( -13.405 8.075 -1.786) 15.751 5.559 ( -1.612 -5.124 -3.254) 6.280 5.735 ( 4.575 5.132 -11.118) 13.072 5.866 ( -2.838 8.491 -12.612) 15.467 6.081 ( -5.785 6.214 -1.790) 8.677 6.133 ( 7.656 4.231 -2.428) 9.078 6.425 ( 6.372 -2.870 -15.322) 16.841 6.799 ( -0.601 1.392 7.846) 7.991 7.199 ( -1.789 9.545 2.277) 9.974 7.283 ( -2.430 -3.317 3.235) 5.232 7.385 ( 5.849 7.241 0.571) 9.326 7.644 ( 3.266 9.471 -5.058) 11.222 7.858 ( 0.810 1.533 -9.016) 9.181 8.064 ( -4.438 2.166 -3.988) 6.348 8.165 ( -0.852 -2.634 -4.239) 5.063 8.343 ( -9.682 -2.636 4.812) 11.129 8.442 ( 0.727 0.817 4.528) 4.658 8.544 ( 7.378 1.614 -5.033) 9.076 8.617 ( 9.839 -0.101 -3.752) 10.531 8.947 ( 3.740 -6.236 14.658) 16.363 9.031 ( 1.892 -3.169 10.387) 11.024 9.189 ( -7.214 -3.500 3.624) 8.799 9.292 ( -6.983 0.369 3.489) 7.815 9.566 ( 3.661 0.009 6.592) 7.540 9.840 ( -1.246 -1.522 4.952) 5.329 10.046 ( -7.083 -2.694 -4.938) 9.045 10.256 ( 3.395 -2.056 -4.786) 6.218 10.353 ( -1.022 -1.320 -1.019) 1.956 10.358 ( 3.207 -2.050 -1.830) 4.223 10.756 ( 0.566 -6.378 0.958) 6.475 10.877 ( 0.192 -4.321 0.610) 4.368 11.066 ( -1.033 1.782 -0.634) 2.155 11.156 ( 1.089 3.359 0.454) 3.560 11.468 ( 4.019 16.464 1.397) 17.005 11.645 ( -0.270 14.659 -3.938) 15.181 12.414 ( -0.046 -4.739 7.304) 8.707 12.700 ( 0.506 -2.894 -0.508) 2.982 12.915 ( -2.275 0.332 -1.288) 2.636 13.094 ( -5.924 3.587 -4.905) 8.487 13.427 ( -0.772 -6.975 5.350) 8.825 13.639 ( 3.675 -3.533 -0.603) 5.133 13.726 ( -0.557 8.332 3.304) 8.981 14.099 ( 0.769 9.903 -3.025) 10.383 14.156 ( 0.071 -14.414 -0.274) 14.417 14.556 ( 3.119 -14.511 -11.520) 18.789 15.054 ( 1.868 4.998 2.669) 5.966 15.345 ( -7.511 -1.584 -2.546) 8.087 15.511 ( 3.026 -1.929 4.780) 5.978 15.841 ( -1.665 -13.944 -4.373) 14.708 15.932 ( -4.466 -9.132 -6.479) 12.055 16.323 ( 2.860 -9.149 -8.243) 12.642 16.484 ( 8.080 -7.558 5.661) 12.428 16.620 ( -2.108 -14.323 1.427) 14.547 17.075 ( 0.380 11.314 7.800) 13.747 17.262 ( -3.774 11.860 3.582) 12.951 17.553 ( 2.221 7.336 -1.114) 7.745 17.686 ( -1.241 8.729 -3.992) 9.679 24.444 ( 0.823 1.201 0.634) 1.588 24.498 ( -1.304 3.251 -0.511) 3.540 24.677 ( 2.359 1.242 0.251) 2.677 24.711 ( -1.804 1.753 -0.443) 2.554 25.304 ( 0.759 4.074 0.313) 4.156 25.441 ( 3.259 1.760 -2.418) 4.423 25.471 ( -2.806 3.037 0.240) 4.142 25.534 ( -1.511 2.297 0.068) 2.750 27.145 ( 1.946 3.908 5.040) 6.668 27.331 ( 2.038 1.036 4.192) 4.775 27.364 ( -1.722 4.397 -1.432) 4.935 27.749 ( -7.128 0.573 -5.541) 9.047 27.941 ( -6.011 1.729 4.813) 7.892 28.090 ( 10.220 1.747 6.559) 12.268 29.490 ( -2.661 -9.286 1.041) 9.715 30.084 ( 4.105 -13.949 -9.602) 17.425 ======================= Grid point 115 (47/130) ======================= q-point: (-0.40 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.653 ( -24.507 5.621 -0.811) 25.157 2.740 ( -25.503 8.667 1.559) 26.981 3.136 ( -6.565 12.276 1.192) 13.972 3.585 ( -3.607 1.292 13.091) 13.641 3.782 ( -0.389 0.455 1.782) 1.880 4.110 ( 20.436 -3.092 3.571) 20.974 4.284 ( 11.108 1.711 7.609) 13.573 4.554 ( -2.502 0.193 -6.425) 6.898 4.790 ( -7.959 8.159 4.972) 12.435 4.898 ( 8.040 -0.274 3.577) 8.804 4.954 ( -8.091 0.256 -0.523) 8.112 5.175 ( 1.047 -3.739 5.002) 6.332 5.593 ( -0.316 0.776 0.608) 1.035 5.617 ( -4.707 8.829 -11.597) 15.316 5.806 ( -5.382 -0.228 -7.782) 9.465 5.908 ( 5.043 8.548 -4.106) 10.741 6.088 ( -5.803 6.686 -6.578) 11.029 6.463 ( 8.150 -1.689 -12.352) 14.894 6.819 ( -4.745 -0.452 9.634) 10.748 7.121 ( -6.453 9.654 -0.948) 11.651 7.302 ( 0.512 2.759 6.242) 6.844 7.496 ( 3.671 3.143 -0.129) 4.834 7.640 ( -0.095 6.819 -3.305) 7.579 7.819 ( 4.244 2.248 -11.245) 12.228 7.939 ( -5.553 2.615 0.012) 6.138 8.086 ( -3.839 -1.513 -3.891) 5.672 8.249 ( -3.747 -2.148 2.563) 5.022 8.474 ( -0.161 2.373 2.893) 3.745 8.530 ( -2.647 3.372 -5.774) 7.191 8.689 ( -0.355 -2.453 -1.076) 2.702 8.930 ( -11.937 -0.093 6.842) 13.759 9.090 ( -2.387 -2.616 -4.609) 5.813 9.242 ( -1.327 -5.887 9.335) 11.116 9.320 ( 5.276 -6.743 22.421) 24.000 9.674 ( 2.219 -2.983 3.483) 5.095 9.871 ( -1.669 -4.823 5.286) 7.348 9.875 ( -2.432 1.439 -6.333) 6.935 10.246 ( -2.408 -3.701 -3.872) 5.873 10.345 ( 1.238 -1.919 -0.282) 2.302 10.418 ( 6.453 -0.472 -3.402) 7.310 10.728 ( -2.006 -2.206 0.787) 3.084 10.947 ( 4.153 -6.577 -1.546) 7.931 10.987 ( -5.535 4.810 1.305) 7.448 11.170 ( 0.363 2.001 -1.529) 2.544 11.521 ( -2.125 11.826 -0.057) 12.015 11.610 ( 1.891 13.716 -1.879) 13.973 12.505 ( 2.865 -3.316 7.116) 8.357 12.657 ( -4.978 -2.653 -0.086) 5.641 12.877 ( -1.564 1.131 3.023) 3.587 12.916 ( -6.864 1.383 -5.928) 9.174 13.501 ( 4.156 -5.168 3.877) 7.682 13.732 ( 4.511 0.861 0.006) 4.592 13.765 ( 3.753 0.473 1.601) 4.107 14.101 ( 2.462 12.470 -2.845) 13.026 14.159 ( 0.484 -14.067 -0.649) 14.091 14.518 ( 3.475 -14.685 -13.178) 20.034 15.116 ( 0.314 8.359 4.581) 9.537 15.181 ( -5.754 4.973 -2.812) 8.108 15.608 ( 1.518 -4.244 7.220) 8.511 15.728 ( -4.330 -13.865 -4.184) 15.116 15.867 ( -2.211 -16.234 -1.670) 16.469 16.256 ( -0.335 -10.268 -9.475) 13.976 16.505 ( -0.282 -7.652 -5.692) 9.540 16.790 ( 10.005 -11.450 6.053) 16.365 17.026 ( -10.070 11.377 2.709) 15.433 17.281 ( 1.157 11.680 8.022) 14.216 17.623 ( 4.008 7.502 -3.040) 9.033 17.679 ( 5.646 9.458 -2.562) 11.309 24.423 ( -2.601 2.432 -0.218) 3.567 24.512 ( 2.167 1.768 1.758) 3.303 24.660 ( -1.382 0.743 -2.372) 2.844 24.758 ( 4.289 2.098 0.885) 4.856 25.226 ( -6.180 6.153 0.999) 8.778 25.414 ( -0.515 1.760 -4.534) 4.891 25.563 ( 6.138 1.644 1.888) 6.629 25.598 ( 7.766 2.660 -0.187) 8.211 27.162 ( -5.404 3.967 6.319) 9.213 27.259 ( -7.259 4.813 -2.085) 8.956 27.413 ( 1.142 0.696 7.296) 7.417 27.572 ( -7.772 0.823 -4.081) 8.817 27.850 ( -4.015 1.866 0.830) 4.505 28.406 ( 16.011 -0.096 7.337) 17.613 29.415 ( -5.562 -7.932 0.391) 9.696 30.059 ( 1.507 -16.341 -10.492) 19.478 ======================= Grid point 116 (48/130) ======================= q-point: (-0.30 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.092 ( -32.377 8.461 -2.959) 33.595 2.220 ( -30.811 10.036 0.300) 32.405 2.971 ( -10.865 11.299 0.095) 15.675 3.658 ( -3.298 1.163 10.113) 10.700 3.751 ( -7.881 1.497 -0.978) 8.081 4.079 ( -18.911 10.203 1.809) 21.564 4.312 ( -4.586 -2.194 -3.799) 6.346 4.688 ( -0.712 -3.950 -0.801) 4.093 4.736 ( 12.158 -0.800 5.279) 13.278 4.899 ( -12.169 1.505 6.166) 13.725 4.965 ( 0.450 -0.539 -0.914) 1.153 5.165 ( -14.251 8.154 0.775) 16.437 5.411 ( 9.658 -0.291 8.638) 12.961 5.707 ( 2.607 -4.077 2.112) 5.281 5.781 ( 9.543 5.516 -0.535) 11.035 5.909 ( -1.915 7.517 -9.427) 12.208 6.139 ( 17.755 5.963 -5.221) 19.444 6.491 ( 4.331 2.392 -10.532) 11.636 6.792 ( -6.168 0.858 6.991) 9.362 6.976 ( -5.716 10.090 -3.063) 11.995 7.378 ( 0.028 7.334 8.102) 10.929 7.494 ( 1.049 -0.942 -7.683) 7.811 7.602 ( -1.515 1.744 -2.407) 3.336 7.772 ( -4.467 -0.161 -3.401) 5.616 7.908 ( 0.791 4.637 1.033) 4.817 8.003 ( -0.765 1.395 -1.889) 2.470 8.233 ( 0.303 -4.209 0.266) 4.228 8.397 ( -7.544 4.004 0.794) 8.577 8.476 ( -0.694 3.806 -1.641) 4.202 8.604 ( -8.307 -3.405 2.385) 9.289 8.795 ( -6.257 3.945 2.574) 7.832 8.997 ( -3.401 -3.556 -2.138) 5.365 9.282 ( -1.646 -3.588 5.643) 6.887 9.502 ( -0.879 -3.788 9.694) 10.445 9.643 ( -7.078 -4.810 -0.602) 8.578 9.783 ( 0.602 -7.110 5.139) 8.794 9.971 ( 1.138 -5.841 3.049) 6.687 10.145 ( -5.022 -10.497 0.003) 11.636 10.359 ( -0.280 -0.314 -0.557) 0.698 10.582 ( 13.099 2.528 -2.196) 13.520 10.730 ( 2.631 0.687 -0.880) 2.858 10.852 ( -7.785 7.739 2.404) 11.238 11.013 ( 1.914 -8.708 -3.665) 9.640 11.140 ( -0.997 -1.090 -4.173) 4.427 11.413 ( -5.288 7.879 -4.094) 10.334 11.651 ( 0.319 9.933 1.241) 10.016 12.513 ( -6.445 -2.191 -2.386) 7.213 12.527 ( -8.965 -2.534 1.352) 9.414 12.801 ( -2.044 -2.141 -1.369) 3.261 12.980 ( 7.218 2.562 12.304) 14.493 13.619 ( 5.560 -2.067 1.127) 6.038 13.800 ( 2.989 5.098 3.366) 6.801 13.884 ( 8.533 -8.931 -4.687) 13.211 14.140 ( 3.835 4.295 -4.475) 7.293 14.187 ( 3.975 -1.595 1.710) 4.612 14.480 ( 2.948 -10.425 -10.067) 14.789 15.018 ( -6.638 2.789 -0.264) 7.205 15.222 ( 2.624 11.490 6.829) 13.622 15.596 ( -5.485 -16.606 -0.824) 17.508 15.686 ( -2.353 -6.324 5.322) 8.594 15.800 ( -2.825 -13.421 0.335) 13.719 16.195 ( 1.244 -11.801 -7.253) 13.907 16.447 ( 2.001 0.144 -13.243) 13.394 16.826 ( -11.571 12.417 0.127) 16.973 17.001 ( 7.506 -10.994 6.160) 14.668 17.353 ( 0.621 7.127 2.912) 7.724 17.671 ( 5.190 11.252 -2.845) 12.714 17.822 ( 8.889 8.404 0.623) 12.249 24.383 ( -1.541 2.455 0.226) 2.907 24.544 ( -1.787 0.508 1.776) 2.570 24.652 ( 4.008 1.391 -2.506) 4.928 24.844 ( 4.124 2.362 0.618) 4.793 25.143 ( -3.498 7.794 1.578) 8.687 25.383 ( 1.894 1.759 -5.858) 6.403 25.693 ( 5.298 2.783 4.351) 7.399 25.753 ( 8.237 2.265 -1.129) 8.617 27.041 ( -9.694 3.207 -1.382) 10.304 27.076 ( -12.521 4.955 4.098) 14.076 27.380 ( -9.815 0.487 -1.624) 9.960 27.500 ( -0.194 0.763 10.348) 10.378 27.831 ( 1.481 -0.239 0.273) 1.525 28.779 ( 17.975 -0.522 5.528) 18.813 29.312 ( -5.540 -6.710 0.607) 8.722 29.950 ( -3.467 -21.694 -13.790) 25.939 ======================= Grid point 117 (49/130) ======================= q-point: (-0.20 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.463 ( -32.412 14.382 0.676) 35.466 1.654 ( -30.944 15.680 4.033) 34.924 2.763 ( -9.661 10.642 -3.132) 14.710 2.992 ( -52.698 25.719 2.361) 58.687 3.763 ( -19.636 -1.349 11.324) 22.708 3.961 ( -10.074 -1.833 -8.399) 13.243 4.051 ( 0.203 -3.945 5.447) 6.729 4.540 ( -13.885 0.518 0.950) 13.927 4.596 ( -0.409 -8.692 -6.324) 10.756 5.015 ( 9.399 -2.260 1.652) 9.807 5.080 ( 7.511 6.333 5.893) 11.457 5.125 ( -4.264 4.714 13.246) 14.692 5.551 ( -1.189 5.312 -5.107) 7.464 5.739 ( -2.148 1.350 -0.110) 2.539 5.878 ( 8.448 0.254 6.106) 10.427 6.112 ( 16.512 0.629 0.753) 16.541 6.398 ( 12.300 -1.960 -7.908) 14.754 6.478 ( 5.497 9.615 -6.349) 12.766 6.648 ( -8.550 6.717 -2.230) 11.099 6.951 ( 2.315 10.217 0.220) 10.479 7.350 ( -6.624 6.194 -1.846) 9.254 7.408 ( -3.860 5.088 -6.683) 9.244 7.589 ( 1.181 0.159 1.391) 1.831 7.725 ( 1.516 -5.794 2.512) 6.494 7.872 ( -5.441 1.521 2.733) 6.276 8.033 ( 3.628 3.961 -4.294) 6.877 8.239 ( -1.076 -5.879 1.002) 6.060 8.295 ( -4.879 1.911 3.020) 6.048 8.425 ( -2.939 0.480 -2.674) 4.002 8.503 ( -3.356 3.812 4.614) 6.862 8.725 ( -3.304 3.328 1.588) 4.952 8.919 ( -4.080 -4.294 -2.359) 6.376 9.275 ( -1.903 0.408 2.141) 2.893 9.456 ( -3.858 -4.072 -1.730) 5.870 9.594 ( 0.743 -2.744 1.934) 3.439 9.871 ( -0.038 -3.312 6.190) 7.020 9.957 ( -1.368 -9.796 -0.653) 9.912 10.073 ( -6.407 -22.404 10.860) 25.709 10.308 ( -5.415 -0.706 -0.283) 5.468 10.731 ( -2.965 3.306 2.999) 5.358 10.778 ( 1.900 9.074 1.984) 9.481 10.836 ( 9.465 -5.813 -8.183) 13.797 10.942 ( -5.430 -14.870 -4.707) 16.516 11.067 ( -2.266 -2.650 -4.043) 5.338 11.305 ( -2.636 8.589 -2.177) 9.244 11.598 ( -6.028 5.703 -1.314) 8.402 12.304 ( -11.706 -3.673 -1.813) 12.402 12.374 ( -8.794 -2.567 1.806) 9.337 12.779 ( 0.719 -0.198 -1.464) 1.643 13.265 ( 9.565 1.017 13.589) 16.649 13.706 ( 3.142 -2.475 -0.789) 4.077 13.901 ( 3.866 5.958 4.010) 8.156 13.969 ( 7.470 -5.734 -10.249) 13.918 14.185 ( 4.202 -8.715 -1.834) 9.848 14.346 ( 11.342 2.715 -3.164) 12.084 14.485 ( 2.880 -0.977 0.387) 3.066 14.917 ( -3.493 -3.713 -0.243) 5.103 15.374 ( 6.068 10.965 10.483) 16.339 15.490 ( -3.070 -6.495 1.175) 7.279 15.641 ( -5.390 -12.928 7.312) 15.801 15.805 ( -0.628 -4.182 6.662) 7.891 16.164 ( 1.355 -10.526 -9.529) 14.263 16.349 ( 1.305 6.545 -18.426) 19.597 16.632 ( -9.117 13.753 1.635) 16.581 17.174 ( 5.097 -7.030 7.442) 11.436 17.346 ( 0.414 2.225 -5.830) 6.254 17.764 ( 4.874 12.384 1.150) 13.359 18.002 ( 10.176 9.965 0.434) 14.249 24.371 ( -0.217 2.156 0.609) 2.251 24.503 ( -2.123 0.405 -0.500) 2.218 24.732 ( 4.617 1.144 -0.626) 4.798 24.918 ( 3.560 2.790 0.081) 4.524 25.132 ( 1.222 11.137 1.750) 11.339 25.395 ( 5.089 1.907 -6.751) 8.667 25.822 ( 3.744 2.819 5.402) 7.151 25.867 ( 4.771 3.230 0.114) 5.762 26.831 ( -9.401 2.065 -3.384) 10.203 26.867 ( -13.468 3.481 4.704) 14.685 27.173 ( -10.959 1.175 -0.825) 11.053 27.594 ( 0.573 0.177 11.721) 11.736 27.896 ( 3.591 -1.829 2.934) 4.985 29.101 ( 11.803 -2.559 -11.627) 16.765 29.236 ( -3.742 -10.253 11.906) 16.151 29.676 ( -12.576 -27.231 -16.840) 34.399 ======================= Grid point 118 (50/130) ======================= q-point: (-0.10 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.012 ( -20.568 20.865 17.339) 34.044 1.180 ( -25.108 26.102 11.693) 38.058 2.100 ( -45.721 42.454 21.355) 65.945 2.582 ( -5.249 10.708 -6.731) 13.694 3.100 ( -33.845 5.279 -6.402) 34.847 3.989 ( 0.907 -8.670 4.579) 9.847 4.110 ( 0.922 -10.473 2.823) 10.886 4.403 ( -5.851 0.831 7.589) 9.619 4.580 ( 2.995 -8.946 -6.321) 11.356 5.089 ( -2.977 1.601 -6.238) 7.095 5.181 ( 3.846 -1.295 8.402) 9.330 5.245 ( 1.604 9.614 5.722) 11.302 5.454 ( 0.482 5.535 -4.055) 6.878 5.675 ( -7.954 -0.205 5.585) 9.721 5.952 ( -2.829 -0.599 -1.892) 3.456 6.364 ( 6.362 2.522 -3.756) 7.807 6.508 ( 10.445 -3.254 2.901) 11.318 6.573 ( 6.670 6.946 0.195) 9.632 6.645 ( 11.804 9.954 -12.247) 19.708 6.951 ( -0.823 10.295 -3.815) 11.010 7.228 ( -4.525 0.911 -1.995) 5.029 7.280 ( -3.139 10.654 -4.622) 12.030 7.616 ( 0.823 2.068 0.400) 2.261 7.775 ( -6.408 1.633 3.882) 7.668 7.817 ( 4.408 -4.492 0.775) 6.341 8.043 ( 3.282 5.303 -8.819) 10.801 8.095 ( -10.378 1.456 0.684) 10.502 8.322 ( 0.892 -2.999 0.179) 3.134 8.388 ( -0.836 -7.699 -2.102) 8.025 8.510 ( -2.220 3.005 3.608) 5.194 8.693 ( -2.743 1.647 3.087) 4.446 8.748 ( -9.696 -3.654 -8.239) 13.238 9.279 ( -2.251 -2.210 7.359) 8.007 9.357 ( -7.639 -9.251 -2.179) 12.193 9.569 ( -3.490 -6.609 -10.893) 13.210 9.860 ( 0.135 0.363 -3.206) 3.230 9.908 ( -2.390 -10.684 5.108) 12.081 10.104 ( -12.951 -21.766 12.468) 28.230 10.239 ( 1.637 -10.383 21.347) 23.794 10.545 ( -18.926 -19.355 -5.662) 27.656 10.695 ( -2.924 8.392 3.796) 9.664 10.785 ( -0.782 3.205 -3.199) 4.595 11.021 ( 6.764 -6.098 1.537) 9.236 11.060 ( 1.345 5.603 2.623) 6.331 11.300 ( 2.156 7.365 -0.174) 7.676 11.482 ( -2.922 9.797 -1.684) 10.361 12.099 ( -8.653 -4.928 0.548) 9.973 12.240 ( -6.267 -3.372 0.460) 7.132 12.812 ( 3.084 2.171 0.794) 3.854 13.471 ( 1.003 0.772 6.445) 6.569 13.726 ( 1.005 -6.886 1.239) 7.068 13.974 ( 0.449 4.847 2.869) 5.650 14.032 ( 8.992 2.533 -11.210) 14.592 14.252 ( 4.605 -7.869 -2.977) 9.591 14.446 ( 2.990 -3.783 -1.838) 5.160 14.551 ( 1.381 -12.825 -0.791) 12.923 14.917 ( 3.943 -6.727 -4.294) 8.901 15.374 ( -1.542 -6.738 -1.062) 6.994 15.546 ( -4.866 -6.825 1.764) 8.565 15.698 ( -0.381 -3.096 0.403) 3.146 15.994 ( -5.919 8.237 -19.940) 22.371 16.168 ( 28.500 12.368 30.416) 43.478 16.266 ( 2.116 -4.909 -5.815) 7.899 16.559 ( 0.737 17.074 8.256) 18.979 17.245 ( -0.990 10.201 -5.446) 11.606 17.348 ( 4.457 -12.885 1.472) 13.714 17.856 ( 2.860 11.793 3.568) 12.648 18.229 ( 16.013 15.329 -2.572) 22.316 24.378 ( 0.232 1.876 0.559) 1.971 24.474 ( -0.319 1.172 -1.039) 1.599 24.792 ( 2.281 0.886 -0.065) 2.448 24.972 ( 2.285 1.661 -0.645) 2.898 25.231 ( 9.965 17.039 -3.643) 20.073 25.465 ( 8.557 2.575 -7.343) 11.566 25.880 ( 1.261 2.206 -0.440) 2.578 25.982 ( 3.950 4.251 8.013) 9.894 26.646 ( -9.996 1.129 2.387) 10.339 26.701 ( -4.703 1.701 -1.607) 5.253 26.984 ( -8.093 1.249 -0.838) 8.232 27.573 ( -15.069 -0.477 -20.378) 25.349 27.987 ( 2.307 -2.696 4.352) 5.615 28.748 ( -28.783 -38.036 7.376) 48.266 29.351 ( -0.490 -7.549 -2.360) 7.925 29.490 ( 3.708 -4.684 9.506) 11.227 ======================= Grid point 119 (51/130) ======================= q-point: ( 0.00 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.550 ( 2.995 26.434 18.468) 32.385 1.812 ( 5.600 34.312 13.282) 37.217 2.708 ( -1.696 23.016 -5.383) 23.698 2.819 ( 1.744 18.592 -9.293) 20.858 2.973 ( -2.071 33.459 15.330) 36.862 3.723 ( -1.501 -14.496 7.016) 16.175 3.956 ( 1.817 -10.282 4.043) 11.196 4.250 ( 0.039 -7.844 -4.956) 9.279 4.460 ( -4.072 -6.747 6.271) 10.071 4.927 ( -0.387 -5.877 -1.126) 5.996 5.196 ( -5.977 5.823 -7.859) 11.463 5.333 ( -10.320 -3.444 10.050) 14.811 5.472 ( -0.131 -0.060 4.570) 4.573 5.752 ( -1.009 -1.535 -1.630) 2.456 5.871 ( 5.763 4.506 0.213) 7.319 6.454 ( -2.511 -1.467 -0.057) 2.908 6.576 ( 10.072 1.314 -6.147) 11.873 6.870 ( -2.176 5.424 -2.289) 6.276 6.945 ( 2.891 9.635 -0.867) 10.097 7.053 ( 0.999 12.562 -10.947) 16.692 7.213 ( 5.948 5.871 -9.413) 12.587 7.521 ( -1.228 6.692 -5.517) 8.760 7.606 ( 3.544 2.349 -0.774) 4.322 7.758 ( -11.205 -2.120 2.370) 11.648 7.922 ( -0.151 4.869 -0.048) 4.872 7.958 ( -1.590 6.161 -4.549) 7.822 8.042 ( 2.838 3.097 -1.584) 4.489 8.190 ( 1.480 6.940 -7.683) 10.458 8.311 ( 2.325 -2.037 6.928) 7.586 8.530 ( -2.716 0.283 4.862) 5.576 8.637 ( -0.843 -0.258 5.339) 5.411 8.773 ( -0.441 4.067 4.164) 5.838 8.927 ( -12.579 -5.182 6.138) 14.925 9.183 ( 1.114 -8.419 1.313) 8.594 9.369 ( 1.543 -2.459 -8.139) 8.642 9.631 ( 2.048 -13.313 3.010) 13.801 9.911 ( 3.275 -0.102 4.365) 5.458 10.062 ( 0.341 5.079 1.143) 5.217 10.205 ( -2.066 -6.529 11.590) 13.462 10.436 ( 5.136 -0.867 3.047) 6.034 10.818 ( -3.709 10.350 -3.827) 11.642 10.875 ( 3.633 4.390 -0.579) 5.727 11.084 ( 4.582 1.389 5.195) 7.065 11.253 ( 1.687 6.498 -3.686) 7.659 11.462 ( -2.442 9.223 3.082) 10.026 11.655 ( -1.243 8.794 -2.641) 9.266 11.896 ( 0.651 -7.049 2.674) 7.567 12.061 ( -0.745 -6.048 -0.983) 6.173 12.914 ( 1.533 -0.883 4.546) 4.878 13.336 ( -5.988 -7.642 -6.624) 11.753 13.643 ( 1.651 -7.318 8.120) 11.056 13.908 ( -0.287 -9.461 -1.636) 9.606 13.977 ( -0.367 -13.634 -1.769) 13.753 14.076 ( 1.512 -11.722 -2.756) 12.136 14.217 ( -0.292 -7.262 -3.982) 8.287 14.475 ( 2.579 -6.120 1.853) 6.895 14.760 ( 1.674 -3.566 -1.425) 4.189 15.081 ( -2.314 -16.641 4.541) 17.404 15.543 ( 1.407 8.163 4.997) 9.674 15.641 ( -1.046 -1.112 -1.733) 2.309 15.825 ( -3.715 -4.585 -6.469) 8.756 16.230 ( -3.143 8.342 -11.033) 14.184 16.585 ( 3.461 1.702 5.665) 6.853 16.898 ( 0.527 -3.381 9.062) 9.687 17.154 ( -1.583 -1.600 0.505) 2.306 17.475 ( 2.593 6.156 -3.205) 7.409 18.150 ( -0.305 11.608 3.595) 12.156 18.601 ( 0.986 4.498 -7.747) 9.012 24.435 ( 0.029 2.952 0.492) 2.993 24.499 ( 0.018 1.865 -1.129) 2.180 24.862 ( 0.786 2.424 0.149) 2.553 24.995 ( -0.013 0.295 -1.452) 1.482 25.576 ( 5.504 5.052 -5.336) 9.181 25.636 ( 4.191 5.264 -8.051) 10.493 25.966 ( 0.125 3.856 -1.635) 4.190 26.035 ( -10.425 3.193 -3.182) 11.358 26.569 ( -2.384 1.839 1.832) 3.525 26.663 ( 1.596 -0.506 1.979) 2.592 26.904 ( -1.825 4.762 -6.775) 8.479 26.980 ( -7.665 5.942 -10.807) 14.521 27.984 ( 0.004 -5.267 9.145) 10.553 28.306 ( 8.915 -20.222 23.726) 32.424 29.297 ( 0.734 -2.730 0.426) 2.859 29.493 ( 0.430 -6.237 3.452) 7.141 ======================= Grid point 120 (52/130) ======================= q-point: ( 0.10 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.856 ( 12.502 21.866 16.172) 29.932 2.182 ( 15.691 24.997 20.662) 36.028 2.733 ( 11.842 14.787 -12.516) 22.705 2.928 ( 18.704 14.026 -19.006) 30.130 3.325 ( 19.608 30.815 23.540) 43.453 3.787 ( 5.096 -7.999 5.587) 11.008 4.055 ( 2.413 -6.231 9.532) 11.640 4.233 ( 3.353 -4.717 -8.073) 9.933 4.451 ( -0.120 -9.181 3.288) 9.753 4.866 ( -4.393 6.088 -5.031) 9.037 5.066 ( -0.958 -1.400 -0.582) 1.794 5.279 ( -2.361 -2.515 6.363) 7.238 5.503 ( -5.023 -3.085 5.936) 8.366 5.688 ( 0.334 -5.218 -5.279) 7.430 6.025 ( 7.400 7.681 2.811) 11.030 6.291 ( -13.832 -4.252 1.712) 14.572 6.657 ( 4.335 5.626 -7.138) 10.070 6.849 ( 0.733 9.278 0.311) 9.312 6.964 ( -0.926 7.378 0.460) 7.450 7.057 ( 8.555 13.176 -12.291) 19.947 7.232 ( 3.500 9.015 -10.177) 14.039 7.422 ( -2.679 10.227 -3.318) 11.080 7.631 ( -2.253 -4.491 0.011) 5.025 7.727 ( 6.141 1.943 2.491) 6.906 7.867 ( -1.964 -0.262 0.306) 2.005 7.890 ( -3.124 2.147 0.615) 3.840 8.113 ( -2.539 7.665 -8.269) 11.558 8.201 ( 11.880 -1.455 -3.910) 12.592 8.418 ( 3.813 2.389 0.698) 4.553 8.560 ( -0.400 0.879 7.108) 7.174 8.647 ( -1.747 2.883 5.301) 6.282 8.794 ( 0.570 -0.161 2.588) 2.655 8.860 ( 0.928 -6.724 4.297) 8.034 9.180 ( -1.576 -7.917 -9.683) 12.607 9.378 ( 3.175 -3.572 3.007) 5.646 9.670 ( 3.182 -8.658 -0.497) 9.238 9.976 ( 0.292 0.304 2.330) 2.368 10.113 ( 0.785 0.947 5.873) 6.001 10.219 ( -2.256 -4.167 4.513) 6.544 10.588 ( 5.246 -9.658 4.370) 11.828 10.758 ( 1.318 10.842 -3.777) 11.556 10.929 ( 1.068 5.706 0.414) 5.820 11.135 ( -3.523 1.695 0.759) 3.982 11.236 ( 0.520 4.403 -4.635) 6.414 11.486 ( 2.686 10.518 5.252) 12.059 11.639 ( 2.407 8.626 -1.703) 9.116 12.010 ( 8.261 -7.534 0.597) 11.197 12.137 ( 9.630 -4.663 0.808) 10.730 12.967 ( -1.751 -2.948 7.219) 7.991 13.150 ( -7.692 -1.394 -6.072) 9.898 13.696 ( -1.430 -10.270 4.841) 11.444 13.869 ( -2.406 -8.667 -1.639) 9.143 13.884 ( -6.331 -13.873 -2.265) 15.416 14.043 ( -2.602 -10.043 -2.454) 10.661 14.270 ( 5.751 -9.183 -0.289) 10.839 14.534 ( 5.614 -11.484 -3.171) 13.170 14.793 ( -2.601 2.745 3.355) 5.055 15.075 ( 1.770 -10.983 -0.455) 11.134 15.545 ( -5.103 3.553 -3.182) 6.985 15.617 ( -4.933 6.979 5.233) 10.021 15.675 ( -2.085 2.001 0.859) 3.015 16.151 ( 1.118 -3.359 -5.480) 6.524 16.643 ( -1.886 -0.680 3.365) 3.917 16.899 ( -1.777 -6.850 0.846) 7.127 17.126 ( -4.278 4.153 5.094) 7.842 17.478 ( 0.461 5.542 -4.183) 6.959 18.139 ( -4.440 10.189 4.205) 11.883 18.418 ( -11.497 6.931 -5.434) 14.483 24.437 ( -0.233 3.254 0.601) 3.317 24.495 ( 0.638 2.163 -0.842) 2.407 24.850 ( -2.247 1.986 -0.070) 3.000 24.962 ( -2.065 0.575 -1.938) 2.890 25.493 ( -7.796 9.437 -5.304) 13.341 25.610 ( 0.995 6.623 -6.257) 9.165 25.814 ( -5.530 5.105 2.636) 7.975 26.015 ( 0.519 2.109 1.656) 2.731 26.615 ( 6.147 2.755 -0.060) 6.736 26.789 ( 8.261 -0.612 2.467) 8.643 26.949 ( 12.235 5.030 -8.479) 15.713 26.992 ( 8.511 2.411 -2.200) 9.116 28.043 ( -2.535 -5.339 10.944) 12.438 28.576 ( 7.556 -15.069 -3.105) 17.141 29.348 ( 1.095 -12.328 8.079) 14.780 29.470 ( -3.532 -8.612 1.123) 9.376 ======================= Grid point 121 (53/130) ======================= q-point: ( 0.20 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.230 ( 15.786 17.386 10.676) 25.796 2.642 ( 15.490 15.605 19.575) 29.439 2.907 ( 15.053 11.451 -10.694) 21.727 3.032 ( 9.656 13.524 -18.317) 24.732 3.820 ( 7.854 -0.985 14.082) 16.154 4.055 ( 12.557 0.094 3.253) 12.972 4.233 ( 10.053 0.048 5.202) 11.319 4.239 ( 7.898 -0.237 -9.870) 12.643 4.533 ( 6.428 -0.798 8.050) 10.333 4.805 ( 6.293 5.080 -5.409) 9.729 5.035 ( -2.443 2.696 1.403) 3.899 5.381 ( 6.242 0.451 4.002) 7.428 5.444 ( -7.711 -3.539 14.617) 16.901 5.600 ( -6.532 -2.618 -2.985) 7.644 6.073 ( -7.153 3.026 1.049) 7.838 6.187 ( 5.570 5.570 0.946) 7.934 6.587 ( -5.658 3.890 -6.026) 9.135 6.759 ( -10.645 12.479 -4.549) 17.022 6.954 ( -1.076 8.160 1.052) 8.297 7.086 ( 5.321 4.746 -9.450) 11.838 7.305 ( 10.477 9.363 -4.508) 14.757 7.400 ( 2.318 13.307 -3.004) 13.837 7.617 ( 0.730 -3.214 -0.446) 3.326 7.796 ( 1.038 -2.908 -3.269) 4.496 7.909 ( 2.220 1.099 7.540) 7.937 7.954 ( 6.623 -0.316 6.671) 9.406 8.030 ( 4.535 2.847 -8.576) 10.111 8.342 ( 2.979 -1.938 1.630) 3.910 8.453 ( 2.752 5.001 -5.126) 7.672 8.571 ( -0.143 4.391 0.322) 4.405 8.735 ( 3.815 -2.887 5.983) 7.660 8.833 ( 2.163 -2.369 -0.983) 3.355 8.947 ( 3.670 -10.314 0.076) 10.948 9.041 ( -2.287 -0.505 -2.870) 3.704 9.478 ( 4.303 -4.259 3.693) 7.092 9.763 ( 4.323 -3.503 -0.364) 5.577 9.976 ( -0.302 -0.313 0.564) 0.713 10.133 ( -4.699 -2.743 7.420) 9.202 10.216 ( 2.095 -3.668 -3.338) 5.383 10.644 ( -1.372 -12.328 -0.785) 12.428 10.799 ( 5.398 9.214 -3.987) 11.399 10.902 ( -3.205 4.901 -0.127) 5.857 11.037 ( -5.873 3.582 1.987) 7.161 11.216 ( 1.611 4.974 -4.413) 6.842 11.591 ( 4.704 11.413 0.303) 12.348 11.728 ( 6.732 11.343 1.548) 13.281 12.187 ( 11.043 -7.129 -0.858) 13.172 12.376 ( 11.867 -3.687 1.295) 12.494 12.895 ( -6.580 1.128 -1.600) 6.865 13.051 ( -3.512 -1.934 7.839) 8.805 13.676 ( -8.182 -5.597 -0.375) 9.921 13.708 ( -3.670 -17.477 1.047) 17.889 13.854 ( 0.601 -7.072 -2.208) 7.433 13.948 ( -5.496 -9.401 -2.120) 11.094 14.348 ( 1.476 -11.631 0.848) 11.755 14.603 ( -2.775 -6.697 -4.981) 8.795 14.709 ( 2.760 3.693 -0.763) 4.673 15.167 ( 6.043 -9.779 -0.120) 11.496 15.403 ( -7.731 -0.803 3.253) 8.426 15.577 ( 0.340 -2.005 0.421) 2.076 15.727 ( 0.036 8.540 8.930) 12.356 16.147 ( 1.528 -8.998 -2.836) 9.557 16.559 ( -6.424 -6.824 -1.961) 9.575 16.885 ( -3.820 -7.008 0.919) 8.034 17.086 ( -2.161 10.192 4.365) 11.296 17.429 ( -0.847 8.017 -5.159) 9.571 18.057 ( -7.366 8.216 2.700) 11.361 18.176 ( -10.088 7.739 -2.276) 12.916 24.443 ( 0.507 3.740 0.568) 3.817 24.507 ( 1.292 2.638 -0.921) 3.078 24.793 ( -3.396 1.309 0.469) 3.670 24.894 ( -3.324 0.584 -1.637) 3.751 25.365 ( -3.320 10.593 -1.101) 11.155 25.550 ( -1.908 4.928 -5.126) 7.363 25.767 ( -3.566 3.997 3.287) 6.284 25.986 ( -5.484 1.239 1.964) 5.956 26.772 ( 10.828 4.457 -1.835) 11.853 27.006 ( 11.381 0.173 2.533) 11.661 27.128 ( 11.455 5.162 -3.710) 13.100 27.202 ( 13.737 1.164 1.858) 13.911 28.071 ( -3.486 -4.233 10.202) 11.582 28.538 ( -2.909 -2.743 -11.749) 12.410 29.332 ( -5.531 -8.314 0.510) 9.999 29.519 ( 5.786 -22.912 2.325) 23.745 ======================= Grid point 122 (54/130) ======================= q-point: ( 0.30 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.606 ( 17.180 13.423 5.804) 22.561 2.988 ( 11.011 9.928 -12.030) 19.092 3.063 ( 18.811 9.564 -1.488) 21.155 3.202 ( 9.764 13.551 10.016) 19.475 3.885 ( -9.893 0.291 12.674) 16.081 4.080 ( -2.050 -4.969 -1.736) 5.649 4.155 ( -5.878 -2.419 -9.409) 11.355 4.459 ( 8.880 -3.193 -4.796) 10.586 4.735 ( -2.160 -2.912 6.234) 7.212 5.036 ( 10.062 1.783 3.158) 10.696 5.154 ( 11.412 9.105 -1.684) 14.696 5.358 ( -3.536 7.871 9.459) 12.804 5.423 ( -0.160 -4.159 9.021) 9.935 5.713 ( 11.896 2.147 4.621) 12.941 5.951 ( -5.921 8.524 -1.194) 10.447 6.264 ( 1.936 8.635 -2.789) 9.279 6.408 ( -8.240 5.228 -4.864) 10.904 6.515 ( -6.569 5.327 -5.378) 10.022 6.889 ( -3.167 6.436 -4.979) 8.732 7.139 ( 3.526 1.228 -0.484) 3.765 7.360 ( 0.957 6.979 -0.832) 7.094 7.518 ( 4.552 10.545 0.331) 11.491 7.622 ( 6.371 -0.637 -8.558) 10.688 7.803 ( 2.083 -0.485 0.271) 2.156 8.061 ( 10.465 -2.220 -0.371) 10.705 8.097 ( 4.517 4.006 2.405) 6.499 8.166 ( 7.145 1.588 5.111) 8.927 8.350 ( -3.188 1.806 5.736) 6.807 8.472 ( 4.712 0.184 -8.968) 10.132 8.550 ( -2.831 -2.022 2.617) 4.353 8.744 ( -1.342 -2.764 -7.468) 8.075 8.926 ( 2.323 -4.521 1.821) 5.399 8.977 ( 6.772 -1.564 5.594) 8.922 9.165 ( 7.829 -1.683 6.591) 10.371 9.605 ( 5.570 -4.205 3.550) 7.830 9.686 ( -8.117 2.992 -5.543) 10.275 10.049 ( 5.925 -3.563 2.124) 7.233 10.113 ( -1.776 -2.950 3.482) 4.897 10.225 ( 1.748 -4.225 -4.510) 6.422 10.542 ( -5.775 -7.645 -3.447) 10.182 10.806 ( -5.491 3.664 -2.838) 7.186 10.899 ( 7.377 4.634 -1.557) 8.850 10.980 ( -3.238 2.953 2.124) 4.870 11.218 ( 1.104 5.478 -1.185) 5.713 11.674 ( 5.620 14.658 -2.724) 15.933 11.870 ( 6.437 13.772 1.653) 15.292 12.371 ( 5.988 -5.140 -0.839) 7.935 12.475 ( 1.313 -0.539 -0.988) 1.729 12.890 ( 6.137 1.863 0.339) 6.423 13.074 ( -2.120 -4.289 11.260) 12.234 13.460 ( -10.885 -9.147 -1.910) 14.345 13.686 ( -3.687 -9.919 -0.968) 10.626 13.836 ( -2.577 -11.549 -0.761) 11.857 13.850 ( 0.009 -4.017 -1.157) 4.181 14.339 ( -1.678 -13.104 -1.834) 13.337 14.437 ( -5.545 6.551 -5.042) 9.954 14.858 ( 7.931 -6.773 2.025) 10.624 15.244 ( 3.951 -7.693 -3.074) 9.178 15.312 ( -5.764 -7.013 4.649) 10.199 15.613 ( 1.009 -6.707 1.109) 6.872 15.834 ( 4.227 6.851 9.559) 12.497 16.154 ( 0.940 -11.728 -1.240) 11.831 16.408 ( -6.673 -9.049 -4.632) 12.160 16.705 ( -11.981 -4.306 -4.796) 13.605 17.143 ( 2.855 10.858 4.309) 12.026 17.400 ( 1.589 9.566 -2.130) 9.928 17.913 ( -8.696 6.711 0.022) 10.984 18.022 ( -5.960 7.446 -0.379) 9.545 24.462 ( 1.091 3.761 -0.246) 3.924 24.529 ( 1.715 3.564 0.096) 3.956 24.743 ( -2.438 0.788 0.044) 2.563 24.827 ( -2.906 0.874 0.060) 3.035 25.326 ( -0.224 8.656 -1.028) 8.720 25.477 ( -1.108 3.550 -4.855) 6.116 25.717 ( -4.788 3.317 3.278) 6.683 25.860 ( -8.982 1.882 1.555) 9.308 26.965 ( 10.796 6.222 -1.113) 12.510 27.183 ( 6.536 1.050 0.717) 6.659 27.322 ( 9.082 5.743 1.908) 10.913 27.482 ( 12.643 -0.517 4.522) 13.437 28.071 ( -4.133 -1.030 5.268) 6.774 28.360 ( -6.711 3.906 -5.547) 9.543 29.251 ( -2.055 -11.416 -1.411) 11.685 29.629 ( 6.271 -23.576 -3.545) 24.652 ======================= Grid point 123 (55/130) ======================= q-point: ( 0.40 0.25 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.958 ( 15.807 11.004 5.272) 19.969 3.165 ( 15.542 8.519 -5.613) 18.592 3.347 ( 15.931 13.315 -10.002) 23.046 3.431 ( 0.541 3.584 13.451) 13.931 3.718 ( -10.898 4.824 4.230) 12.646 3.959 ( -10.830 7.896 6.822) 15.039 4.111 ( 2.519 -4.607 1.584) 5.484 4.548 ( -11.134 -13.559 -3.074) 17.812 4.560 ( 4.992 3.120 -1.049) 5.979 5.090 ( -6.219 4.825 6.405) 10.148 5.139 ( -6.289 2.955 1.679) 7.149 5.418 ( -3.995 -13.185 0.473) 13.785 5.609 ( 3.886 14.652 9.082) 17.671 5.895 ( 3.493 8.954 -6.060) 11.362 5.963 ( 13.495 3.732 -5.086) 14.897 6.225 ( -0.517 8.894 -6.200) 10.854 6.277 ( -1.592 9.352 -1.317) 9.577 6.425 ( -0.287 -0.719 -7.025) 7.067 6.819 ( -0.522 3.658 -1.437) 3.964 7.180 ( -0.770 -2.347 3.862) 4.585 7.391 ( 4.089 6.245 -2.480) 7.866 7.505 ( -0.894 7.231 0.711) 7.321 7.765 ( 10.263 4.191 -9.621) 14.679 7.845 ( 1.687 -0.702 0.706) 1.958 8.134 ( 0.016 5.598 1.813) 5.884 8.240 ( 4.330 -1.904 -1.328) 4.913 8.310 ( 2.942 3.928 7.098) 8.629 8.353 ( -0.557 -2.485 7.899) 8.300 8.477 ( 1.962 0.331 -7.371) 7.635 8.540 ( 3.156 1.818 -0.333) 3.657 8.712 ( 2.497 -4.989 -0.172) 5.582 8.936 ( -0.437 -0.584 1.469) 1.640 9.164 ( 1.448 -2.948 9.264) 9.829 9.338 ( 3.836 -2.301 1.447) 4.701 9.496 ( -4.443 2.738 0.990) 5.312 9.732 ( 3.187 -3.251 3.538) 5.765 10.097 ( -1.375 -1.850 -1.338) 2.665 10.181 ( 6.389 -4.426 0.447) 7.785 10.206 ( 1.135 -3.652 -5.706) 6.870 10.398 ( -5.845 -5.671 -4.254) 9.188 10.722 ( -0.404 5.751 -1.604) 5.984 10.917 ( -4.376 2.079 0.761) 4.904 11.020 ( 5.676 2.666 0.165) 6.273 11.237 ( 0.794 4.553 0.597) 4.661 11.755 ( 5.053 17.253 -2.008) 18.090 11.975 ( 3.532 16.003 -0.064) 16.388 12.333 ( -4.403 -0.519 2.550) 5.114 12.582 ( 6.424 -3.115 -0.698) 7.174 12.966 ( -0.130 0.503 0.469) 0.700 13.156 ( 1.687 -4.654 5.628) 7.496 13.285 ( -6.067 -7.966 -0.243) 10.016 13.552 ( -5.678 -8.333 -2.955) 10.508 13.836 ( -0.136 -11.100 -1.080) 11.154 13.855 ( 1.728 -2.733 1.599) 3.607 14.278 ( -0.565 -12.305 -5.800) 13.615 14.340 ( -2.142 5.419 -2.947) 6.530 14.998 ( 4.107 -7.126 4.844) 9.545 15.233 ( -5.120 -1.873 5.063) 7.440 15.321 ( 5.844 -11.672 -3.733) 13.576 15.612 ( -2.139 -6.351 2.290) 7.082 15.993 ( 4.942 -5.538 -0.085) 7.423 16.155 ( -1.766 -6.192 1.108) 6.533 16.250 ( -2.326 -8.568 -7.984) 11.940 16.453 ( -9.463 -6.285 -2.746) 11.687 17.232 ( 2.324 11.020 5.576) 12.567 17.451 ( 3.792 9.993 0.748) 10.714 17.760 ( -6.940 6.062 -0.828) 9.252 17.926 ( -3.583 7.109 -1.791) 8.160 24.475 ( 0.836 3.549 -0.389) 3.667 24.575 ( 1.996 4.333 1.299) 4.944 24.695 ( -1.672 0.738 -1.492) 2.359 24.788 ( -2.058 1.628 0.911) 2.778 25.340 ( 2.826 6.015 -1.289) 6.770 25.447 ( 1.710 2.361 -3.377) 4.461 25.643 ( -5.421 2.962 2.020) 6.499 25.699 ( -8.790 3.424 0.781) 9.465 27.140 ( 7.414 7.106 1.986) 10.460 27.287 ( 3.649 2.014 2.426) 4.822 27.446 ( 2.375 3.718 1.616) 4.698 27.740 ( 11.125 -0.737 5.629) 12.490 27.974 ( -6.526 3.375 -3.239) 8.030 28.236 ( -6.228 7.960 2.737) 10.471 29.234 ( 0.733 -15.116 -1.083) 15.173 29.692 ( 4.952 -22.693 -6.815) 24.206 ======================= Grid point 124 (56/130) ======================= q-point: (-0.50 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.118 ( -6.354 9.597 3.561) 12.048 3.298 ( -16.739 5.595 2.382) 17.810 3.473 ( 11.513 15.839 -2.328) 19.719 3.567 ( 19.672 6.639 2.400) 20.901 3.628 ( -5.337 4.632 4.877) 8.586 3.887 ( -5.567 6.166 8.663) 12.002 4.177 ( 1.385 -6.101 2.442) 6.716 4.383 ( 0.753 -6.794 -1.556) 7.010 4.722 ( 10.421 -0.139 1.820) 10.580 4.986 ( -9.966 3.314 8.936) 13.790 5.068 ( -2.234 5.094 2.168) 5.970 5.253 ( -7.108 -11.612 -8.393) 15.994 5.635 ( -5.849 10.841 3.814) 12.895 5.898 ( 3.659 9.612 -9.660) 14.110 6.004 ( -0.993 3.736 -11.644) 12.269 6.198 ( -2.640 5.989 -2.252) 6.922 6.283 ( 3.457 8.800 -1.644) 9.597 6.397 ( 5.383 0.668 -10.298) 11.639 6.824 ( -1.571 1.146 4.218) 4.645 7.209 ( 0.534 -2.291 6.512) 6.923 7.449 ( 0.844 11.859 0.718) 11.911 7.527 ( 3.842 3.619 -1.420) 5.466 7.792 ( 0.219 5.494 -3.205) 6.364 7.846 ( 1.165 -3.524 -8.703) 9.461 8.132 ( -3.677 1.119 1.427) 4.100 8.168 ( -4.704 6.760 -0.854) 8.280 8.317 ( -4.688 0.764 0.805) 4.818 8.455 ( 0.533 -0.533 8.051) 8.086 8.589 ( 10.784 2.073 2.414) 11.243 8.621 ( 6.030 2.081 -5.940) 8.716 8.802 ( 2.807 -6.046 7.929) 10.359 8.956 ( -1.081 -4.072 7.212) 8.353 9.130 ( -6.008 -1.867 2.107) 6.635 9.297 ( -6.297 0.209 1.201) 6.414 9.569 ( 3.454 0.530 5.581) 6.585 9.759 ( -3.323 -5.967 3.047) 7.479 10.020 ( -2.433 0.392 -6.958) 7.381 10.188 ( 2.056 -4.620 -6.423) 8.175 10.271 ( 1.881 -4.376 -0.587) 4.799 10.327 ( 2.344 -2.174 -1.893) 3.716 10.745 ( 2.296 4.451 0.134) 5.010 10.856 ( -1.838 2.689 0.243) 3.266 11.103 ( 1.910 2.898 2.015) 4.014 11.240 ( -0.765 3.937 0.119) 4.012 11.823 ( 2.562 17.060 0.500) 17.259 11.979 ( -1.672 17.287 -3.324) 17.683 12.332 ( 0.602 -1.867 6.650) 6.933 12.647 ( 0.855 -2.618 -0.643) 2.828 12.914 ( -3.545 -0.742 -0.097) 3.623 13.131 ( -5.932 -0.325 -6.422) 8.748 13.250 ( 1.301 -9.989 5.343) 11.402 13.516 ( 2.698 -8.593 -0.131) 9.007 13.807 ( -1.686 -8.597 -1.358) 8.865 13.907 ( 1.957 -4.507 1.721) 5.206 14.242 ( 1.960 -12.860 -6.557) 14.567 14.303 ( 1.202 6.868 -3.247) 7.691 15.076 ( -2.254 -13.927 7.264) 15.869 15.204 ( -0.923 4.028 5.032) 6.511 15.413 ( 6.609 -8.636 -3.097) 11.307 15.584 ( -3.778 -7.244 4.060) 9.123 15.877 ( -7.425 -0.012 -12.669) 14.685 16.077 ( -3.285 -13.235 -5.417) 14.673 16.301 ( 4.065 -10.305 0.984) 11.121 16.388 ( 5.015 -7.258 0.492) 8.836 17.305 ( -1.599 9.962 7.959) 12.851 17.509 ( 0.104 12.817 1.956) 12.965 17.682 ( 1.152 4.342 -1.048) 4.613 17.864 ( -0.231 7.544 -4.112) 8.595 24.495 ( 1.102 3.632 0.864) 3.892 24.576 ( -1.951 4.250 -0.993) 4.781 24.696 ( 1.610 0.718 0.742) 1.913 24.756 ( -1.001 1.991 -0.637) 2.317 25.401 ( 2.994 4.869 -0.454) 5.734 25.485 ( 3.540 2.269 -1.800) 4.574 25.545 ( -4.401 3.902 0.313) 5.890 25.592 ( -1.900 2.991 -0.149) 3.547 27.262 ( 1.991 7.359 5.724) 9.533 27.362 ( 1.234 2.042 4.522) 5.113 27.449 ( -2.138 2.793 0.183) 3.522 27.814 ( -7.256 5.582 -3.940) 9.966 27.958 ( 2.990 1.146 6.026) 6.824 28.175 ( 2.170 6.817 1.155) 7.246 29.234 ( -0.612 -15.272 -0.434) 15.290 29.697 ( 2.051 -23.190 -8.377) 24.742 ======================= Grid point 125 (57/130) ======================= q-point: (-0.40 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.823 ( -21.902 10.854 -2.717) 24.594 2.951 ( -23.009 11.365 1.457) 25.705 3.461 ( -6.995 18.037 -1.599) 19.411 3.627 ( -2.693 2.572 10.902) 11.520 3.778 ( -5.048 -1.341 0.696) 5.270 4.054 ( 16.815 -1.859 5.040) 17.652 4.275 ( 9.872 -5.008 6.436) 12.805 4.511 ( 10.604 -0.112 -4.143) 11.385 4.847 ( -12.387 -4.109 3.176) 13.432 4.929 ( 3.844 -1.489 9.299) 10.172 5.047 ( -6.568 7.713 -5.234) 11.403 5.112 ( 5.684 1.086 1.171) 5.904 5.581 ( -3.333 0.268 4.443) 5.561 5.816 ( -7.466 7.420 -9.768) 14.361 5.840 ( -5.685 4.643 -7.337) 10.379 6.121 ( 2.943 10.366 -5.335) 12.024 6.272 ( -1.567 10.333 -5.179) 11.664 6.480 ( 10.951 4.199 -7.979) 14.185 6.820 ( -3.021 0.825 7.074) 7.736 7.283 ( 0.646 2.045 2.366) 3.193 7.429 ( -2.085 13.132 4.552) 14.055 7.570 ( -0.478 1.755 -3.963) 4.360 7.699 ( -2.488 -2.473 -5.618) 6.624 7.862 ( 5.939 2.358 -6.777) 9.314 8.016 ( -5.986 3.866 1.681) 7.322 8.101 ( -5.749 3.748 1.245) 6.975 8.234 ( -5.071 1.242 1.732) 5.501 8.532 ( 0.802 2.050 5.862) 6.262 8.636 ( 0.670 6.671 -6.636) 9.433 8.654 ( -3.591 1.040 0.895) 3.845 8.878 ( -4.021 -5.369 5.240) 8.512 9.008 ( 2.567 -6.161 0.175) 6.676 9.138 ( -1.628 -5.563 15.693) 16.729 9.178 ( -5.117 -2.436 5.260) 7.732 9.615 ( -2.610 -3.120 -2.091) 4.574 9.720 ( -0.545 -8.198 4.447) 9.343 9.914 ( -3.446 2.243 -7.631) 8.668 10.126 ( -4.702 -6.778 -3.481) 8.953 10.295 ( 2.213 -2.790 -1.675) 3.935 10.407 ( 7.767 -1.696 -3.071) 8.522 10.770 ( 0.656 5.313 -0.548) 5.382 10.871 ( 2.822 1.889 -0.788) 3.487 11.104 ( -3.978 5.629 2.967) 7.504 11.238 ( 1.077 4.066 0.052) 4.207 11.806 ( -5.911 14.854 -1.763) 16.084 11.910 ( -1.541 15.073 -0.964) 15.182 12.435 ( 3.319 -2.762 5.683) 7.137 12.601 ( -5.366 -2.981 0.249) 6.144 12.878 ( -2.497 -1.485 -0.098) 2.906 12.945 ( -5.207 1.091 -2.922) 6.069 13.357 ( 5.873 -8.739 3.703) 11.161 13.587 ( 4.495 -10.453 -2.127) 11.576 13.764 ( -0.927 -8.623 -1.262) 8.764 13.949 ( 1.356 -5.070 1.029) 5.348 14.235 ( 2.642 -9.727 -6.106) 11.785 14.343 ( 5.909 6.558 -3.098) 9.355 15.031 ( -7.183 -14.366 6.437) 17.304 15.279 ( 2.562 4.273 6.414) 8.122 15.503 ( 1.301 -10.921 -2.768) 11.341 15.513 ( -3.621 -4.581 1.699) 6.082 15.657 ( -6.131 1.681 -5.521) 8.420 15.986 ( -0.336 -12.425 -6.294) 13.933 16.365 ( 4.716 -7.514 -2.294) 9.163 16.553 ( 10.175 -11.237 -1.112) 15.200 17.252 ( -8.757 10.383 4.473) 14.300 17.530 ( -0.516 11.812 4.896) 12.797 17.762 ( 6.573 5.443 -1.352) 8.641 17.872 ( 5.215 8.377 -3.727) 10.548 24.493 ( -2.313 4.292 -0.173) 4.878 24.563 ( 1.336 2.996 1.222) 3.501 24.683 ( -1.368 1.427 -1.588) 2.536 24.794 ( 3.764 1.043 0.850) 3.997 25.371 ( -3.820 7.100 -0.508) 8.078 25.459 ( -0.594 2.423 -4.377) 5.038 25.616 ( 6.580 3.231 2.589) 7.774 25.655 ( 7.572 2.647 -0.083) 8.022 27.281 ( -5.552 7.197 5.009) 10.378 27.357 ( -6.668 3.957 3.251) 8.408 27.433 ( -0.973 0.881 5.911) 6.055 27.644 ( -7.354 7.335 -3.751) 11.043 27.896 ( -6.304 2.495 -0.574) 6.804 28.410 ( 15.208 0.784 6.053) 16.387 29.198 ( -2.500 -12.735 -0.960) 13.014 29.621 ( -2.678 -25.352 -9.900) 27.348 ======================= Grid point 126 (58/130) ======================= q-point: (-0.30 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.362 ( -24.395 17.359 -4.951) 30.347 2.475 ( -25.971 14.698 0.083) 29.841 3.271 ( -10.794 16.895 -3.100) 20.287 3.657 ( -3.422 -5.660 8.923) 11.107 3.707 ( -2.830 -1.871 1.331) 3.644 4.218 ( 0.564 -2.228 0.473) 2.347 4.391 ( -21.927 11.797 -2.746) 25.050 4.561 ( 1.387 -7.828 1.547) 8.099 4.717 ( 1.135 0.176 3.307) 3.501 4.935 ( -9.044 1.748 6.731) 11.409 4.998 ( 3.052 3.325 -0.164) 4.516 5.282 ( -1.668 -0.616 2.996) 3.484 5.375 ( -3.167 1.670 5.521) 6.581 5.671 ( -0.611 -2.001 6.664) 6.985 5.890 ( 8.517 5.340 -2.126) 10.275 6.061 ( -5.088 7.343 -8.960) 12.653 6.326 ( 14.175 11.739 -8.241) 20.165 6.622 ( 9.603 10.073 -7.633) 15.873 6.846 ( -0.894 3.856 8.008) 8.933 7.212 ( -3.372 11.255 -6.381) 13.370 7.464 ( 0.606 0.344 -6.996) 7.031 7.527 ( 1.386 5.275 8.580) 10.167 7.640 ( -0.315 -0.561 -6.647) 6.678 7.815 ( -7.797 4.551 -2.009) 9.249 7.984 ( -5.705 -1.098 4.229) 7.186 8.033 ( 2.893 6.495 1.220) 7.214 8.152 ( -4.810 -2.828 0.255) 5.586 8.490 ( -11.325 3.643 3.180) 12.314 8.543 ( -2.216 3.175 1.337) 4.096 8.638 ( 0.601 6.877 -2.604) 7.378 8.829 ( -2.919 -2.073 0.690) 3.646 8.938 ( -4.757 0.173 -3.509) 5.914 9.204 ( -1.320 -3.414 11.186) 11.769 9.293 ( 0.823 -17.054 18.040) 24.839 9.512 ( -6.175 -5.340 0.448) 8.176 9.711 ( -4.593 -6.667 -6.702) 10.510 9.788 ( -1.104 -3.457 -4.822) 6.035 9.998 ( -5.237 -4.712 -2.526) 7.484 10.310 ( 0.290 -2.881 -1.060) 3.083 10.519 ( 5.780 -9.242 -6.331) 12.606 10.786 ( 2.781 5.428 -1.657) 6.320 10.910 ( 1.726 4.990 -1.029) 5.380 11.042 ( -4.352 9.472 4.150) 11.219 11.257 ( 0.954 5.822 -2.659) 6.471 11.636 ( -8.109 13.281 -2.814) 15.813 11.867 ( -4.605 10.677 1.615) 11.739 12.448 ( -5.852 -3.707 -0.081) 6.928 12.460 ( -10.323 -3.726 0.068) 10.975 12.771 ( -1.252 -1.992 -1.971) 3.070 13.035 ( 6.657 2.393 9.795) 12.083 13.522 ( 9.236 -9.560 1.621) 13.391 13.600 ( -0.344 -13.562 -3.519) 14.016 13.799 ( 5.650 -7.437 -1.382) 9.441 13.974 ( 0.894 -6.728 0.286) 6.794 14.240 ( 3.187 -6.945 -5.822) 9.606 14.456 ( 7.868 4.667 -2.913) 9.601 14.935 ( -7.926 -10.473 4.922) 14.026 15.319 ( -9.685 -10.690 -2.437) 14.629 15.386 ( 3.121 1.898 6.898) 7.806 15.550 ( -0.838 -0.751 -1.331) 1.743 15.607 ( 2.379 -5.064 3.434) 6.565 15.977 ( 3.613 -5.261 -3.707) 7.380 16.435 ( 5.891 -2.021 -5.871) 8.559 16.713 ( 8.145 -14.172 -2.526) 16.540 17.115 ( -8.141 12.886 3.753) 15.697 17.536 ( -1.499 8.826 0.915) 8.999 17.881 ( 7.174 8.923 -0.852) 11.481 17.996 ( 9.459 7.807 -0.838) 12.293 24.450 ( -1.743 3.910 -0.242) 4.288 24.568 ( -2.425 1.564 0.860) 3.011 24.694 ( 4.178 2.701 -1.153) 5.107 24.875 ( 3.842 0.617 1.121) 4.049 25.320 ( -0.384 8.175 -0.806) 8.223 25.427 ( 1.741 2.386 -5.444) 6.194 25.769 ( 6.355 4.337 4.356) 8.842 25.809 ( 8.412 2.988 -0.436) 8.938 27.132 ( -10.950 5.276 -1.978) 12.315 27.199 ( -14.364 6.306 6.206) 16.870 27.400 ( -8.660 1.676 2.939) 9.297 27.547 ( -1.229 4.968 4.283) 6.674 27.816 ( -1.621 -1.557 0.559) 2.316 28.762 ( 15.937 -1.547 7.448) 17.659 29.114 ( -5.543 -13.075 -5.550) 15.248 29.438 ( -7.001 -24.815 -10.143) 27.707 ======================= Grid point 127 (59/130) ======================= q-point: (-0.20 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.860 ( -23.938 22.797 -2.426) 33.145 2.072 ( -19.015 24.770 3.046) 31.375 3.041 ( -9.483 15.232 -5.404) 18.739 3.529 ( -23.473 17.178 2.704) 29.212 3.649 ( -9.920 -7.599 7.258) 14.451 3.909 ( -14.040 -1.376 -7.867) 16.152 4.042 ( -23.619 5.758 6.507) 25.167 4.405 ( -6.287 -8.982 -3.629) 11.549 4.583 ( -9.892 1.897 2.995) 10.508 4.911 ( 2.526 -4.934 -1.533) 5.751 5.210 ( 6.592 4.500 10.627) 13.291 5.237 ( -0.639 5.405 11.791) 12.986 5.577 ( 4.902 -4.980 8.409) 10.933 5.748 ( -0.863 -2.081 0.030) 2.253 5.900 ( -1.655 5.047 -5.795) 7.861 6.061 ( 11.461 -4.644 2.126) 12.548 6.473 ( 6.219 8.134 -11.147) 15.136 6.730 ( 11.198 13.831 -7.689) 19.386 6.879 ( -1.238 13.075 4.363) 13.839 7.166 ( 3.810 10.845 -6.177) 13.049 7.400 ( -3.598 -1.056 -10.595) 11.239 7.567 ( 4.859 3.711 -4.339) 7.497 7.624 ( -2.495 9.004 -1.783) 9.512 7.700 ( -1.021 1.402 7.918) 8.106 7.884 ( -9.221 -0.043 5.817) 10.903 8.105 ( 3.133 3.205 0.329) 4.494 8.109 ( 0.356 -5.143 1.258) 5.306 8.333 ( -6.747 2.662 1.538) 7.415 8.436 ( -8.796 1.633 -2.985) 9.432 8.648 ( -0.405 8.550 2.840) 9.018 8.773 ( -2.986 -2.469 -1.027) 4.009 8.829 ( -4.898 0.223 -2.954) 5.724 9.233 ( -8.883 -7.246 18.284) 21.581 9.385 ( -8.157 -3.203 0.075) 8.764 9.450 ( 2.076 -17.481 9.070) 19.804 9.531 ( -4.829 -10.674 -10.450) 15.698 9.770 ( 2.890 -4.121 -0.260) 5.040 9.914 ( -1.583 -0.761 -1.401) 2.246 10.260 ( -5.013 -3.260 -1.735) 6.226 10.495 ( -0.753 -10.361 -6.677) 12.349 10.841 ( 3.074 2.001 -1.310) 3.894 10.890 ( -1.631 8.712 -0.152) 8.865 11.041 ( -0.524 11.379 -0.123) 11.392 11.219 ( 0.508 7.542 -5.363) 9.269 11.515 ( -4.156 11.533 1.697) 12.376 11.769 ( -6.045 8.988 0.889) 10.868 12.216 ( -13.330 -4.468 -1.939) 14.192 12.302 ( -9.869 -4.138 2.566) 11.005 12.789 ( 2.812 -0.385 -0.546) 2.890 13.275 ( 8.683 -1.507 11.169) 14.227 13.551 ( -1.340 -14.220 -4.348) 14.930 13.709 ( 9.466 -9.939 0.628) 13.740 13.904 ( 5.588 -8.335 -1.031) 10.087 13.999 ( 2.215 -8.984 -0.510) 9.267 14.263 ( 3.963 -5.356 -4.449) 8.011 14.518 ( -0.125 -2.883 -4.269) 5.153 14.836 ( -4.304 -4.251 0.916) 6.119 15.150 ( -7.437 -16.092 1.742) 17.813 15.477 ( -0.207 0.255 3.673) 3.688 15.583 ( 5.031 0.057 0.798) 5.095 15.724 ( 6.727 -8.077 5.660) 11.938 16.067 ( 7.545 6.686 3.786) 10.769 16.468 ( 4.038 4.258 -10.270) 11.828 16.781 ( 0.606 -6.178 -1.483) 6.382 17.068 ( 0.169 5.573 4.893) 7.418 17.500 ( -0.986 8.012 -3.213) 8.688 18.004 ( 5.861 11.086 0.677) 12.558 18.198 ( 13.192 8.206 -0.872) 15.560 24.429 ( -0.489 3.347 0.091) 3.383 24.525 ( -1.818 1.430 -0.204) 2.322 24.774 ( 4.338 2.821 -0.731) 5.226 24.946 ( 3.016 0.463 0.360) 3.072 25.358 ( 5.354 9.100 -0.904) 10.597 25.445 ( 5.075 2.726 -5.354) 7.865 25.898 ( 4.123 4.307 1.708) 6.202 25.948 ( 5.843 4.256 2.600) 7.682 26.888 ( -11.882 3.292 -3.035) 12.698 26.955 ( -15.562 4.464 4.587) 16.827 27.220 ( -10.776 4.004 -0.073) 11.496 27.606 ( 0.741 1.220 8.581) 8.699 27.837 ( 1.079 -4.054 4.734) 6.326 28.740 ( -27.625 -29.324 -12.250) 42.108 29.103 ( 14.992 -1.582 1.663) 15.167 29.313 ( -0.227 -9.431 -2.211) 9.689 ======================= Grid point 128 (60/130) ======================= q-point: (-0.10 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.526 ( -13.094 27.543 9.085) 31.821 1.814 ( -12.303 33.911 6.774) 36.705 2.850 ( -5.552 14.952 -7.737) 17.727 3.010 ( -27.059 41.806 11.094) 51.020 3.252 ( -27.194 8.929 -4.652) 28.998 3.715 ( -4.119 -14.618 5.545) 16.168 3.921 ( -0.978 -8.625 3.396) 9.321 4.314 ( -2.652 -10.823 -3.898) 11.805 4.488 ( -4.787 -0.014 5.954) 7.640 4.930 ( 1.644 -10.583 -2.633) 11.029 5.247 ( -4.643 3.767 14.009) 15.231 5.429 ( -1.783 2.890 7.789) 8.497 5.582 ( -6.752 5.414 -10.111) 13.309 5.655 ( 1.764 -0.558 7.675) 7.895 5.883 ( -1.388 -4.002 -1.878) 4.634 6.353 ( 15.412 -4.464 1.779) 16.144 6.460 ( 3.683 4.151 -8.745) 10.357 6.839 ( 5.034 14.661 -2.225) 15.660 6.927 ( 3.629 12.369 -3.334) 13.315 7.147 ( 1.518 9.444 -11.661) 15.082 7.241 ( -3.400 0.658 -6.113) 7.026 7.554 ( -1.914 13.932 -1.973) 14.201 7.631 ( -0.214 0.001 -3.692) 3.698 7.778 ( 6.955 1.284 1.319) 7.195 7.853 ( -0.210 4.022 7.907) 8.874 8.089 ( -7.459 -4.236 -1.088) 8.647 8.124 ( 0.489 2.190 -5.876) 6.289 8.228 ( -5.611 -1.890 -1.300) 6.062 8.299 ( -1.986 2.328 1.797) 3.548 8.587 ( -8.620 0.986 2.799) 9.117 8.665 ( -4.069 -0.342 -2.734) 4.915 8.761 ( -1.181 4.270 1.577) 4.702 9.127 ( -17.103 -10.428 14.389) 24.663 9.227 ( -6.753 -3.794 2.423) 8.116 9.407 ( 1.725 -6.371 -10.410) 12.326 9.544 ( 2.082 -12.771 5.604) 14.101 9.834 ( 1.317 -1.699 2.594) 3.369 10.004 ( 7.254 1.890 6.471) 9.902 10.147 ( -4.108 -2.971 1.232) 5.218 10.422 ( -2.414 -1.982 -2.375) 3.924 10.836 ( 0.403 4.852 -0.336) 4.881 10.925 ( -1.155 7.407 -2.972) 8.064 10.974 ( 0.946 5.423 0.364) 5.517 11.234 ( 3.186 7.858 -3.506) 9.176 11.482 ( -2.271 9.981 2.967) 10.657 11.694 ( -2.167 9.606 -0.222) 9.850 11.979 ( -10.305 -6.241 0.564) 12.061 12.148 ( -7.716 -5.226 0.954) 9.368 12.847 ( 2.980 0.243 1.263) 3.245 13.467 ( -2.412 -17.197 -3.918) 17.802 13.505 ( 4.905 0.544 8.553) 9.875 13.862 ( 6.245 -10.983 -0.352) 12.639 13.964 ( 2.208 -9.565 -1.383) 9.913 14.047 ( 3.543 -11.352 -2.285) 12.109 14.295 ( 0.567 -7.763 -4.880) 9.187 14.428 ( -2.923 -2.579 1.592) 4.210 14.786 ( -0.361 -5.462 -4.967) 7.391 15.083 ( -3.697 -18.202 6.479) 19.671 15.493 ( 0.045 5.239 3.284) 6.184 15.648 ( 1.837 -2.803 -1.077) 3.520 15.855 ( 4.085 -12.907 -3.087) 13.885 16.356 ( 9.118 8.916 10.481) 16.507 16.404 ( 2.803 8.895 -11.979) 15.181 16.787 ( 0.335 2.895 6.830) 7.426 17.143 ( 2.501 -4.053 2.016) 5.171 17.465 ( 1.064 8.312 -4.327) 9.431 18.100 ( 3.183 11.970 1.952) 12.539 18.463 ( 15.846 7.479 -3.527) 17.874 24.429 ( 0.197 2.971 0.274) 2.990 24.505 ( -0.090 1.635 -0.642) 1.759 24.831 ( 2.500 2.701 -0.522) 3.717 24.988 ( 1.663 0.290 -0.732) 1.840 25.481 ( 8.559 7.259 -4.368) 12.042 25.537 ( 9.331 4.289 -4.727) 11.305 25.948 ( 1.811 4.203 -1.148) 4.718 26.069 ( 3.649 3.607 4.094) 6.564 26.676 ( -9.626 1.688 0.968) 9.821 26.738 ( -8.911 1.556 0.223) 9.049 27.029 ( -8.342 3.550 -1.425) 9.177 27.554 ( -16.292 -1.695 -21.648) 27.146 27.909 ( 1.223 -4.763 5.594) 7.448 28.113 ( -22.609 -22.413 22.330) 38.886 29.278 ( 4.411 -1.911 -4.975) 6.918 29.388 ( 5.828 -5.030 6.093) 9.818 ======================= Grid point 129 (61/130) ======================= q-point: ( 0.00 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.084 ( 1.802 25.746 11.081) 28.087 2.482 ( 3.030 30.660 6.738) 31.537 2.905 ( 0.852 -4.376 -6.983) 8.285 3.164 ( -0.584 15.933 -8.743) 18.184 3.498 ( 0.468 -10.123 7.466) 12.587 3.551 ( -2.566 13.721 8.425) 16.304 3.835 ( 5.252 -2.976 -0.422) 6.051 4.116 ( -1.591 2.465 0.203) 2.941 4.300 ( -3.907 -5.534 9.796) 11.910 4.831 ( 4.145 -2.901 5.214) 7.265 5.193 ( -6.100 -7.410 11.702) 15.135 5.333 ( -3.841 -3.685 9.538) 10.923 5.397 ( -10.350 1.996 -12.761) 16.552 5.659 ( -2.683 -5.952 -5.517) 8.548 6.007 ( 4.244 8.113 4.738) 10.310 6.380 ( -5.562 -6.620 3.599) 9.366 6.640 ( 13.331 5.292 -13.592) 19.760 6.880 ( 1.197 -2.467 -6.228) 6.805 7.181 ( 0.859 9.987 2.084) 10.239 7.275 ( 1.598 7.440 -5.775) 9.553 7.294 ( 8.758 2.079 -7.067) 11.444 7.538 ( -4.123 -1.767 -2.745) 5.259 7.675 ( -0.093 1.888 -1.495) 2.411 7.744 ( -2.501 1.631 -5.954) 6.661 8.026 ( -1.577 4.265 -3.483) 5.728 8.073 ( -8.123 2.585 -3.270) 9.130 8.169 ( -1.923 8.353 2.079) 8.820 8.299 ( 8.603 5.058 3.959) 10.736 8.304 ( 3.122 0.095 1.735) 3.573 8.543 ( 0.757 -0.947 3.379) 3.590 8.662 ( -5.060 4.203 -0.464) 6.594 8.854 ( -6.985 -0.243 5.442) 8.858 8.906 ( -2.243 6.277 2.561) 7.141 9.081 ( 1.544 -1.196 -4.076) 4.520 9.319 ( 0.589 -2.537 -4.415) 5.126 9.420 ( 3.594 -8.133 1.071) 8.956 9.922 ( 1.868 1.251 5.954) 6.364 10.056 ( -2.229 -5.116 9.071) 10.650 10.196 ( 2.871 5.380 -0.371) 6.110 10.407 ( 2.855 -3.047 0.549) 4.211 10.958 ( 3.395 5.118 0.200) 6.145 11.036 ( -1.428 9.285 -2.793) 9.801 11.172 ( 3.386 4.969 1.676) 6.242 11.350 ( 0.358 2.195 -5.225) 5.678 11.640 ( -1.901 7.980 3.715) 9.005 11.759 ( -1.986 0.369 0.400) 2.059 11.812 ( -0.221 0.766 1.613) 1.799 11.947 ( -0.943 -4.972 -0.546) 5.090 12.826 ( 0.702 -7.273 1.995) 7.575 13.010 ( -0.981 -19.087 -2.118) 19.229 13.606 ( -1.860 1.075 2.878) 3.591 13.715 ( -0.811 -6.646 0.429) 6.709 13.759 ( -0.380 -6.286 -0.591) 6.325 13.865 ( 1.348 -8.454 -1.386) 8.673 14.099 ( 0.141 -4.565 -4.688) 6.545 14.277 ( -0.278 -11.774 -1.910) 11.931 14.701 ( 1.402 -2.280 3.982) 4.798 14.806 ( -0.373 -9.290 5.625) 10.866 15.602 ( -0.033 -1.570 -1.995) 2.539 15.664 ( 2.058 -5.152 -2.633) 6.141 15.849 ( 1.639 17.243 5.963) 18.319 16.440 ( -6.408 7.772 -6.305) 11.884 16.543 ( 3.296 -6.189 1.819) 7.244 16.741 ( -2.902 -8.165 1.929) 8.877 17.261 ( 0.265 8.967 4.201) 9.905 17.529 ( 1.757 -1.204 -2.690) 3.431 18.375 ( -0.187 10.086 0.711) 10.112 18.629 ( 0.265 -1.556 -4.804) 5.057 24.493 ( 0.191 2.508 0.286) 2.532 24.529 ( 0.161 0.878 -0.567) 1.058 24.917 ( 0.565 2.769 -0.437) 2.859 24.993 ( 0.200 -0.634 -1.447) 1.592 25.657 ( 3.201 3.181 -2.600) 5.208 25.701 ( 3.297 1.413 -2.251) 4.234 26.037 ( 0.048 2.860 -2.304) 3.673 26.076 ( -5.370 0.977 -2.882) 6.172 26.607 ( -1.546 1.718 2.015) 3.066 26.652 ( 0.533 -0.632 2.146) 2.300 26.992 ( -1.141 4.230 -4.785) 6.488 27.072 ( -5.775 2.321 -12.027) 13.542 27.885 ( -0.165 -3.660 10.272) 10.906 28.001 ( 5.490 -10.352 17.349) 20.935 29.277 ( -0.087 0.372 -2.312) 2.343 29.379 ( 0.637 -4.697 -0.008) 4.740 ======================= Grid point 130 (62/130) ======================= q-point: ( 0.10 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.289 ( 9.303 20.683 10.818) 25.127 2.701 ( 10.284 24.787 11.681) 29.267 2.908 ( 7.597 -1.555 -10.822) 13.314 3.205 ( 9.764 11.419 -9.764) 17.918 3.646 ( 4.386 6.836 9.595) 12.571 3.679 ( 13.548 -6.041 4.829) 15.600 4.002 ( 10.698 -8.864 -1.473) 13.971 4.125 ( 6.211 -4.683 -4.573) 9.023 4.421 ( 3.150 14.891 19.483) 24.724 4.985 ( 3.831 4.529 4.449) 7.415 5.089 ( -6.876 3.669 -10.536) 13.105 5.203 ( 1.460 -5.024 3.505) 6.297 5.353 ( -5.795 -9.847 11.816) 16.437 5.545 ( -3.718 -7.918 -3.588) 9.454 6.128 ( 5.167 2.639 4.305) 7.225 6.231 ( -9.942 -2.489 3.260) 10.754 6.756 ( 10.289 4.605 -15.161) 18.893 6.930 ( 5.820 -0.482 -2.539) 6.368 7.163 ( -2.677 10.230 -0.168) 10.576 7.288 ( -0.230 7.824 -11.511) 13.920 7.373 ( 6.146 4.057 -6.739) 9.982 7.509 ( 3.921 -2.839 0.092) 4.842 7.636 ( 0.478 6.041 -2.280) 6.474 7.761 ( 4.524 0.638 -1.070) 4.692 7.875 ( -7.694 0.974 -0.048) 7.755 7.916 ( -5.813 -0.042 1.635) 6.039 8.199 ( 3.193 2.690 -0.665) 4.227 8.287 ( -3.489 6.604 -3.661) 8.318 8.486 ( -3.084 2.951 1.551) 4.541 8.540 ( 7.935 1.946 5.373) 9.779 8.685 ( 3.157 -3.758 2.025) 5.310 8.778 ( -3.772 2.362 2.578) 5.143 8.904 ( 0.302 6.689 -0.927) 6.760 9.073 ( 0.956 -1.366 -6.928) 7.125 9.323 ( 2.556 -1.868 0.520) 3.209 9.505 ( 5.629 -7.786 1.519) 9.728 9.980 ( -0.897 0.394 5.702) 5.785 10.073 ( -4.200 -4.225 10.793) 12.328 10.221 ( 0.974 4.339 -2.656) 5.180 10.449 ( 0.939 -5.677 -0.775) 5.806 11.000 ( 0.714 11.498 -3.092) 11.928 11.032 ( 2.492 5.732 1.222) 6.369 11.226 ( -0.579 4.287 -1.260) 4.506 11.295 ( -0.099 0.768 -5.112) 5.170 11.672 ( 2.756 7.961 4.485) 9.544 11.791 ( 3.855 5.683 0.982) 6.937 11.880 ( 7.768 -4.342 -0.130) 8.900 12.049 ( 10.624 -4.203 1.617) 11.539 12.841 ( -1.626 -8.750 3.321) 9.499 12.965 ( -1.513 -15.292 -2.847) 15.628 13.548 ( -5.825 -1.054 2.040) 6.261 13.685 ( -3.290 -6.323 1.252) 7.236 13.719 ( -1.941 -3.881 -2.222) 4.875 13.849 ( -2.157 -8.444 -1.024) 8.776 14.108 ( 2.529 -6.651 -0.811) 7.161 14.267 ( 1.855 -13.665 -3.317) 14.183 14.779 ( 1.873 -2.087 4.144) 5.003 14.852 ( 2.001 -7.689 2.939) 8.472 15.564 ( -1.681 -0.205 -2.814) 3.284 15.639 ( -3.064 -3.334 -1.802) 4.874 15.926 ( -0.328 18.237 10.158) 20.878 16.231 ( -8.289 8.834 -7.114) 14.048 16.571 ( -6.092 -5.301 -0.178) 8.077 16.670 ( -1.524 -14.515 3.372) 14.979 17.295 ( -0.279 9.816 3.339) 10.372 17.541 ( 1.706 -0.160 -3.217) 3.645 18.329 ( -5.382 8.118 1.079) 9.800 18.493 ( -9.164 0.762 -4.330) 10.164 24.499 ( 0.250 2.643 0.450) 2.692 24.531 ( 0.714 1.175 -0.324) 1.413 24.896 ( -2.373 2.412 -0.738) 3.463 24.963 ( -2.092 -0.519 -1.737) 2.768 25.621 ( -4.149 4.455 -1.932) 6.387 25.693 ( -2.213 1.403 -1.074) 2.832 25.938 ( -3.755 5.843 -2.514) 7.386 26.043 ( -0.440 0.416 -0.135) 0.621 26.674 ( 7.447 2.842 0.130) 7.972 26.765 ( 8.892 -1.610 1.347) 9.136 27.041 ( 9.152 3.096 -2.907) 10.090 27.056 ( 10.036 3.683 -7.616) 13.126 27.960 ( -0.829 -1.682 10.338) 10.506 28.249 ( 9.162 -15.044 7.147) 19.009 29.224 ( -4.268 -1.480 0.506) 4.545 29.330 ( -4.913 -5.612 -1.471) 7.602 ======================= Grid point 131 (63/130) ======================= q-point: ( 0.20 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.568 ( 12.607 15.416 7.082) 21.136 2.977 ( 11.390 12.158 1.965) 16.775 3.006 ( 9.391 2.697 -1.887) 9.951 3.304 ( 9.393 9.631 -8.368) 15.843 3.824 ( 4.520 4.007 13.576) 14.859 3.975 ( 10.165 -4.533 -2.093) 11.325 4.173 ( 8.054 -6.292 -6.288) 12.000 4.187 ( 4.668 -6.784 -4.947) 9.606 4.662 ( 5.726 11.523 12.873) 18.201 4.919 ( 5.830 5.130 -8.059) 11.192 5.142 ( 7.117 6.634 2.124) 9.958 5.285 ( -8.597 -5.557 13.577) 17.003 5.395 ( 6.513 -4.349 10.728) 13.282 5.512 ( 1.368 -4.936 3.849) 6.407 6.120 ( -2.372 3.753 1.599) 4.719 6.277 ( 6.097 0.461 3.011) 6.816 6.727 ( -2.635 8.631 -11.498) 14.617 6.936 ( -8.200 3.434 -5.467) 10.436 7.078 ( -1.338 3.984 -1.433) 4.440 7.143 ( -0.566 1.741 -11.880) 12.020 7.422 ( 1.700 2.765 -4.190) 5.300 7.525 ( 0.434 -0.312 -3.316) 3.359 7.713 ( 2.371 6.824 1.162) 7.317 7.782 ( 6.784 3.918 -1.065) 7.906 7.915 ( 8.862 -2.578 5.834) 10.919 7.934 ( -0.045 0.137 3.981) 3.983 8.162 ( 0.606 7.798 -6.633) 10.255 8.280 ( 2.006 -2.031 2.734) 3.953 8.463 ( -1.894 -0.828 2.899) 3.561 8.649 ( 0.202 -3.576 -2.038) 4.121 8.732 ( 2.594 3.713 1.440) 4.753 8.798 ( 3.437 0.579 -2.774) 4.454 8.888 ( 1.502 4.927 -2.896) 5.909 9.057 ( 2.406 0.740 0.464) 2.559 9.419 ( 5.518 -0.560 3.430) 6.522 9.650 ( 6.640 -7.151 2.362) 10.040 9.990 ( -2.075 1.052 4.026) 4.649 10.071 ( -3.394 -2.930 6.693) 8.056 10.199 ( 0.786 1.975 -5.901) 6.272 10.422 ( -1.382 -8.898 -3.787) 9.769 11.001 ( 2.555 9.635 -4.937) 11.124 11.032 ( -2.728 7.272 -0.654) 7.794 11.147 ( -4.212 5.624 -0.931) 7.088 11.287 ( 1.209 1.006 -2.389) 2.860 11.787 ( 6.692 7.933 1.348) 10.466 11.953 ( 9.678 9.496 4.747) 14.366 12.053 ( 11.462 -4.805 -2.041) 12.595 12.304 ( 12.794 -3.711 2.506) 13.555 12.818 ( -2.700 -8.243 2.716) 9.089 12.923 ( -1.525 -11.556 0.052) 11.656 13.450 ( -6.416 -2.912 1.858) 7.287 13.603 ( -5.687 -2.139 1.172) 6.187 13.679 ( -0.330 -6.325 -3.409) 7.193 13.779 ( -4.206 -7.718 -0.612) 8.811 14.138 ( -0.429 -9.393 1.670) 9.550 14.282 ( 1.592 -16.940 -2.606) 17.213 14.818 ( 1.638 2.668 0.675) 3.203 14.939 ( 5.162 -7.623 0.335) 9.213 15.493 ( -3.974 3.384 -3.112) 6.076 15.551 ( -4.103 -0.283 0.884) 4.207 15.996 ( -1.750 12.531 10.775) 16.619 16.058 ( -5.249 4.946 -3.619) 8.069 16.382 ( -9.982 -9.361 -3.123) 14.037 16.687 ( -3.416 -12.517 5.262) 14.001 17.311 ( 0.304 10.713 1.694) 10.851 17.537 ( 1.521 1.610 -4.464) 4.984 18.203 ( -8.584 5.932 0.474) 10.445 18.282 ( -9.493 2.705 -2.216) 10.117 24.515 ( 1.208 3.101 0.260) 3.338 24.552 ( 1.708 1.465 -0.294) 2.269 24.829 ( -3.799 2.074 -0.150) 4.331 24.894 ( -3.571 -0.645 -1.379) 3.882 25.533 ( -3.404 6.074 -1.155) 7.058 25.623 ( -3.520 1.720 -2.312) 4.549 25.864 ( -4.149 5.188 0.785) 6.690 25.994 ( -5.316 -0.651 1.013) 5.450 26.866 ( 13.147 4.473 -1.851) 14.010 26.990 ( 13.157 -1.547 0.807) 13.273 27.213 ( 9.419 2.809 1.325) 9.918 27.255 ( 14.062 3.090 -2.947) 14.696 28.029 ( 0.713 1.576 7.991) 8.176 28.409 ( 5.955 -10.456 -3.988) 12.677 29.159 ( -3.827 -8.136 3.363) 9.599 29.196 ( -6.732 -7.590 -2.733) 10.507 ======================= Grid point 132 (64/130) ======================= q-point: ( 0.30 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.868 ( 14.859 11.473 3.888) 19.171 3.113 ( 12.155 1.195 -9.590) 15.528 3.275 ( 12.595 11.585 7.283) 18.598 3.430 ( 9.447 7.881 -5.688) 13.554 3.948 ( -4.840 -1.360 -2.788) 5.749 4.018 ( -0.231 4.905 12.476) 13.408 4.065 ( -1.645 -6.303 -4.719) 8.043 4.342 ( 6.797 -5.735 -2.542) 9.249 4.757 ( -4.710 4.269 3.427) 7.222 5.102 ( 7.954 4.679 2.403) 9.535 5.155 ( -8.493 -12.764 8.759) 17.657 5.261 ( 0.921 0.336 -0.893) 1.326 5.614 ( 10.229 8.708 12.573) 18.399 5.751 ( 13.845 0.910 6.103) 15.158 6.134 ( 1.277 9.570 0.308) 9.660 6.387 ( 3.966 0.307 -0.600) 4.022 6.518 ( -8.403 8.691 -8.005) 14.499 6.648 ( -12.531 5.004 -6.967) 15.186 6.995 ( -3.899 3.716 -6.193) 8.207 7.124 ( 1.100 -2.550 -2.152) 3.513 7.385 ( 0.526 -0.922 -3.511) 3.668 7.523 ( 3.236 -6.876 -7.620) 10.762 7.767 ( 1.907 11.751 2.994) 12.276 7.921 ( 5.364 6.518 0.136) 8.442 8.020 ( 8.882 -0.949 0.191) 8.935 8.138 ( 7.861 -0.662 4.568) 9.116 8.198 ( 4.111 1.619 3.984) 5.949 8.294 ( -6.038 -4.491 9.937) 12.465 8.494 ( 5.140 2.776 -3.011) 6.572 8.613 ( 0.210 2.286 -4.977) 5.481 8.730 ( -1.511 2.283 -8.035) 8.488 8.806 ( 3.973 -3.905 1.306) 5.722 9.012 ( 7.922 4.071 2.941) 9.380 9.164 ( 5.694 -0.504 4.802) 7.466 9.550 ( 4.046 0.166 3.640) 5.445 9.701 ( -2.885 -2.313 0.225) 3.705 10.012 ( 3.423 0.285 2.076) 4.014 10.078 ( 0.578 -0.853 1.265) 1.631 10.165 ( 1.510 -1.021 -7.501) 7.719 10.350 ( -2.157 -9.363 -5.643) 11.142 10.948 ( -2.821 8.755 -3.131) 9.717 11.034 ( 3.828 6.753 -2.706) 8.221 11.075 ( -4.094 5.854 1.252) 7.252 11.283 ( -0.498 -0.078 -0.308) 0.591 11.936 ( 8.185 10.994 0.161) 13.707 12.149 ( 7.671 13.418 2.035) 15.589 12.262 ( 11.209 -5.880 -0.957) 12.694 12.474 ( 3.066 -0.033 0.864) 3.185 12.850 ( 5.074 -7.699 1.706) 9.377 12.911 ( -1.530 -9.932 4.541) 11.027 13.326 ( -7.932 -1.889 0.523) 8.170 13.504 ( -6.756 -5.124 0.344) 8.486 13.638 ( -1.147 -6.373 -2.009) 6.779 13.717 ( -0.420 -7.964 -2.367) 8.319 14.115 ( -3.070 -9.990 1.499) 10.558 14.269 ( -0.988 -16.622 -1.284) 16.700 14.887 ( 4.155 6.039 2.521) 7.752 15.040 ( 7.272 -5.528 -2.955) 9.600 15.385 ( -5.081 6.288 -0.952) 8.140 15.519 ( -0.769 -2.833 0.828) 3.050 15.939 ( -3.125 -5.254 -3.734) 7.162 16.049 ( -3.759 7.753 9.435) 12.777 16.186 ( -7.870 -7.897 -1.780) 11.290 16.594 ( -9.140 -8.411 1.081) 12.468 17.351 ( 2.397 9.735 2.207) 10.266 17.544 ( 3.297 3.144 -3.733) 5.890 18.032 ( -9.171 5.268 -0.387) 10.584 18.124 ( -6.464 2.383 -1.037) 6.967 24.542 ( 1.546 3.730 -0.749) 4.107 24.589 ( 2.394 1.954 0.242) 3.099 24.769 ( -2.870 1.592 0.305) 3.296 24.828 ( -2.612 -0.728 0.359) 2.735 25.472 ( -1.620 5.397 -2.531) 6.178 25.537 ( -2.444 1.889 -4.134) 5.161 25.790 ( -5.588 3.628 2.877) 7.257 25.880 ( -7.839 -0.133 1.982) 8.087 27.100 ( 12.569 6.430 -0.847) 14.144 27.204 ( 8.522 0.743 1.026) 8.615 27.389 ( 5.767 1.367 4.831) 7.646 27.488 ( 11.836 -0.346 0.158) 11.842 28.120 ( 3.465 7.088 3.225) 8.523 28.424 ( 0.651 1.176 -3.374) 3.632 29.032 ( -6.366 -9.279 -4.127) 11.985 29.169 ( 1.524 -19.477 0.606) 19.546 ======================= Grid point 133 (65/130) ======================= q-point: ( 0.40 0.38 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.165 ( 13.224 8.499 3.255) 16.053 3.306 ( 13.078 3.778 -2.588) 13.856 3.508 ( 2.974 4.878 -5.768) 8.118 3.554 ( 12.546 8.754 2.122) 15.445 3.806 ( -3.246 -0.933 -3.451) 4.829 4.058 ( 1.092 -3.130 5.451) 6.380 4.154 ( 0.342 10.499 14.117) 17.597 4.320 ( -9.399 -2.167 -4.210) 10.525 4.612 ( -4.324 0.966 -1.892) 4.817 4.995 ( -8.942 -12.844 7.202) 17.228 5.215 ( -6.114 -0.425 2.181) 6.506 5.270 ( 0.413 1.717 0.850) 1.960 5.845 ( 3.808 8.268 6.366) 11.108 5.995 ( 8.281 0.458 -1.740) 8.475 6.138 ( 0.799 12.705 -1.811) 12.858 6.356 ( -2.645 4.298 -4.477) 6.746 6.421 ( 2.457 2.143 -6.549) 7.316 6.447 ( -3.288 3.639 -4.233) 6.478 6.891 ( -1.994 3.768 -3.614) 5.589 7.119 ( -0.931 -4.413 2.204) 5.020 7.403 ( 4.952 -1.463 -4.638) 6.941 7.531 ( 3.812 -5.518 -5.380) 8.598 7.845 ( 2.189 7.593 2.441) 8.271 7.974 ( -1.406 6.787 0.990) 7.002 8.101 ( 0.593 -3.686 4.323) 5.712 8.269 ( -2.117 -2.065 7.477) 8.041 8.328 ( 5.417 1.906 5.353) 7.851 8.351 ( 5.289 1.093 4.986) 7.350 8.530 ( 3.040 2.559 -7.414) 8.412 8.589 ( 1.842 1.896 -0.860) 2.780 8.709 ( 3.845 4.701 -2.690) 6.642 8.878 ( 1.469 -4.193 1.845) 4.811 9.151 ( 3.180 2.188 1.801) 4.259 9.294 ( 3.557 -2.612 1.682) 4.722 9.559 ( -2.825 3.755 3.110) 5.635 9.685 ( 0.195 -1.642 1.744) 2.403 10.086 ( 0.749 0.711 -4.358) 4.479 10.116 ( 5.367 -1.584 0.894) 5.667 10.138 ( 2.211 -2.642 -7.356) 8.123 10.267 ( -1.506 -6.864 -4.164) 8.168 10.895 ( -0.479 10.585 -1.582) 10.714 11.011 ( -3.297 6.779 0.868) 7.589 11.102 ( 4.090 3.634 -0.056) 5.471 11.270 ( -0.797 -1.991 0.680) 2.250 12.069 ( 5.690 13.434 -0.193) 14.591 12.273 ( 4.629 12.848 1.126) 13.703 12.375 ( 0.666 2.292 -1.178) 2.662 12.524 ( 3.913 -1.601 0.877) 4.318 12.932 ( 0.592 -4.667 0.232) 4.710 12.965 ( 2.734 -10.101 4.397) 11.351 13.196 ( -5.230 -2.389 -0.563) 5.778 13.352 ( -7.784 -9.313 -0.422) 12.145 13.624 ( 0.205 -6.904 -0.527) 6.927 13.715 ( 2.891 -9.207 -4.528) 10.659 14.072 ( -2.477 -8.240 1.830) 8.797 14.241 ( -1.064 -14.069 -0.191) 14.111 14.975 ( 1.131 7.545 4.955) 9.098 15.172 ( 9.740 -2.559 -4.260) 10.935 15.302 ( -3.033 5.359 0.092) 6.159 15.513 ( -1.465 -4.361 1.379) 4.803 15.876 ( -0.282 -7.169 -4.869) 8.671 15.960 ( -7.525 -12.411 0.957) 14.546 16.130 ( -1.044 3.064 3.430) 4.716 16.402 ( -9.592 -3.557 -2.094) 10.443 17.424 ( 2.250 8.492 4.237) 9.753 17.606 ( 5.712 3.248 -1.925) 6.847 17.872 ( -7.641 5.901 -0.337) 9.660 18.017 ( -3.687 1.542 -2.009) 4.473 24.558 ( 1.045 4.245 -0.589) 4.411 24.645 ( 2.955 1.653 0.871) 3.496 24.718 ( -2.615 1.925 -0.632) 3.308 24.801 ( -1.432 -0.495 0.903) 1.764 25.444 ( 1.374 3.925 -2.745) 4.983 25.488 ( 0.973 1.405 -3.325) 3.739 25.703 ( -5.852 2.749 2.164) 6.818 25.748 ( -7.647 1.169 1.509) 7.882 27.297 ( 7.515 7.358 2.066) 10.718 27.334 ( 4.374 2.579 3.387) 6.104 27.479 ( 0.466 0.607 3.300) 3.387 27.689 ( 7.621 -4.986 4.393) 10.112 28.163 ( 1.410 14.865 -3.882) 15.428 28.422 ( -1.524 10.308 2.334) 10.678 28.913 ( -1.692 -15.662 -4.744) 16.452 29.202 ( 2.615 -24.307 -3.614) 24.713 ======================= Grid point 134 (66/130) ======================= q-point: (-0.50 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.295 ( -4.227 7.537 0.427) 8.652 3.405 ( -6.965 4.430 3.236) 8.866 3.631 ( 17.586 5.042 2.818) 18.510 3.697 ( -1.004 4.910 1.606) 5.263 3.804 ( 6.295 1.478 -7.227) 9.698 3.950 ( -16.453 -1.534 1.533) 16.595 4.163 ( -1.645 9.414 3.567) 10.201 4.325 ( 7.845 4.845 8.469) 12.519 4.627 ( 5.201 -8.137 2.776) 10.049 4.949 ( -4.118 -16.427 -1.499) 17.001 5.069 ( -5.773 6.567 4.897) 10.022 5.216 ( -3.982 3.367 -0.141) 5.217 5.834 ( -6.573 7.769 -0.838) 10.211 6.004 ( -1.935 -1.148 -7.397) 7.732 6.118 ( -1.491 9.755 -6.644) 11.897 6.311 ( -0.371 3.424 -1.943) 3.954 6.423 ( 4.542 4.694 -3.440) 7.383 6.452 ( 5.286 3.966 -3.775) 7.610 6.863 ( -0.258 3.592 0.097) 3.602 7.156 ( 2.462 -4.565 4.399) 6.801 7.480 ( 6.692 -3.113 -5.277) 9.073 7.582 ( 5.041 -3.210 -3.466) 6.909 7.813 ( -7.725 3.967 4.277) 9.680 7.931 ( -2.899 5.999 0.648) 6.695 8.140 ( -1.972 0.660 4.747) 5.183 8.298 ( -1.595 2.468 3.590) 4.640 8.338 ( -4.268 0.928 -0.026) 4.368 8.413 ( -0.222 -1.903 4.587) 4.971 8.619 ( 6.946 1.366 1.509) 7.238 8.696 ( 7.094 1.840 2.152) 7.638 8.771 ( 3.249 3.298 0.412) 4.648 8.877 ( -2.876 -2.821 1.580) 4.327 9.138 ( -2.855 2.869 -1.421) 4.290 9.291 ( -3.475 -1.360 -0.996) 3.862 9.590 ( 0.195 1.295 5.477) 5.632 9.655 ( -4.476 -3.202 0.099) 5.504 10.038 ( -0.361 0.858 -7.089) 7.150 10.097 ( -0.759 -3.586 -6.765) 7.694 10.208 ( 4.179 -1.542 -0.706) 4.510 10.269 ( 3.660 -3.451 -1.180) 5.166 10.903 ( 1.559 10.467 0.166) 10.584 10.976 ( -0.712 8.406 0.103) 8.436 11.169 ( 2.001 2.187 1.992) 3.571 11.266 ( -0.208 -2.345 0.705) 2.457 12.133 ( 0.664 13.327 0.670) 13.360 12.306 ( -2.422 13.246 -3.690) 13.962 12.370 ( 1.258 5.471 3.722) 6.735 12.582 ( 0.246 -3.732 0.629) 3.793 12.881 ( -3.873 -2.482 -0.665) 4.648 13.034 ( -3.440 -8.768 1.770) 9.584 13.097 ( 0.662 -3.707 -2.541) 4.543 13.297 ( 1.539 -12.129 0.984) 12.266 13.618 ( -0.257 -6.128 -1.246) 6.259 13.743 ( 3.701 -10.356 -4.455) 11.866 14.060 ( -0.969 -6.688 3.010) 7.398 14.232 ( 0.386 -12.774 -0.220) 12.782 14.991 ( -3.619 8.068 4.616) 9.975 15.266 ( 2.371 1.889 -1.671) 3.462 15.331 ( 6.652 0.234 -0.966) 6.726 15.468 ( -5.563 -6.828 2.425) 9.135 15.816 ( -0.125 -6.048 -4.288) 7.415 15.885 ( -2.275 -4.471 -2.736) 5.714 16.127 ( -0.597 -4.235 0.856) 4.362 16.285 ( 0.106 -4.775 -1.294) 4.948 17.482 ( -1.169 7.955 5.557) 9.774 17.707 ( 3.946 -0.971 -0.501) 4.095 17.762 ( -1.647 10.279 -0.003) 10.411 17.961 ( 0.418 1.668 -3.560) 3.954 24.580 ( 1.337 4.374 0.807) 4.645 24.659 ( -2.878 3.287 -1.228) 4.538 24.704 ( 2.184 0.208 1.070) 2.441 24.774 ( -1.267 -0.371 -0.773) 1.530 25.486 ( 4.060 3.260 -1.177) 5.338 25.522 ( 3.832 1.239 -1.694) 4.369 25.615 ( -3.982 2.741 0.639) 4.877 25.641 ( -3.169 1.582 -0.001) 3.542 27.385 ( 0.685 2.897 3.397) 4.517 27.440 ( 0.302 3.573 6.427) 7.360 27.485 ( -1.248 4.738 3.549) 6.050 27.813 ( -0.362 -5.308 6.282) 8.232 28.156 ( 1.195 17.118 -3.686) 17.551 28.358 ( -2.955 11.114 -3.097) 11.909 28.903 ( 2.525 -16.502 -1.720) 16.782 29.189 ( 0.009 -25.832 -6.488) 26.634 ======================= Grid point 135 (67/130) ======================= q-point: (-0.40 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.078 ( -14.052 13.839 -3.714) 20.069 3.183 ( -19.569 11.047 1.682) 22.534 3.603 ( -10.711 -4.115 4.479) 12.318 3.698 ( -7.417 -7.915 -2.923) 11.234 3.804 ( -1.962 11.425 -4.228) 12.339 4.059 ( 20.053 -0.333 7.696) 21.482 4.176 ( -1.147 3.446 6.186) 7.173 4.561 ( 10.142 2.820 2.756) 10.882 4.720 ( -9.547 -8.157 -0.377) 12.563 4.812 ( 5.605 -6.888 5.728) 10.567 5.159 ( 4.797 3.127 1.395) 5.894 5.178 ( -0.352 2.938 1.687) 3.406 5.643 ( -12.112 5.075 0.725) 13.152 5.817 ( -12.227 -2.367 -6.885) 14.230 6.046 ( 0.707 10.223 -5.753) 11.752 6.254 ( -0.044 2.025 -7.299) 7.575 6.471 ( 2.485 8.984 -1.924) 9.518 6.612 ( 12.352 6.015 -0.549) 13.749 6.870 ( 0.882 5.263 0.788) 5.395 7.260 ( 4.576 -5.012 1.971) 7.067 7.531 ( 2.774 -3.267 -4.906) 6.515 7.598 ( -2.377 -4.957 -4.383) 7.031 7.704 ( -3.771 10.690 2.262) 11.559 7.908 ( 0.284 0.643 -1.269) 1.451 8.089 ( -7.051 5.023 5.579) 10.299 8.203 ( -6.346 5.617 2.474) 8.829 8.272 ( -5.477 0.919 0.768) 5.606 8.503 ( 2.069 -5.355 9.128) 10.784 8.689 ( -0.747 -0.568 3.255) 3.387 8.775 ( -3.562 1.015 -2.009) 4.214 8.808 ( 0.986 3.141 -1.418) 3.584 8.867 ( 2.298 -2.674 3.795) 5.180 9.093 ( -2.042 1.564 2.065) 3.299 9.189 ( -5.709 0.758 1.179) 5.878 9.542 ( -6.695 -2.778 -0.480) 7.265 9.606 ( -1.401 -3.227 1.256) 3.735 9.957 ( -2.717 1.623 -7.290) 7.947 10.010 ( -3.473 -3.966 -4.130) 6.697 10.259 ( 2.504 -0.719 -2.025) 3.300 10.334 ( 4.022 -4.457 -2.871) 6.655 10.928 ( 0.993 10.051 -0.967) 10.147 11.002 ( 3.392 9.205 0.373) 9.817 11.197 ( -1.008 2.547 2.601) 3.778 11.285 ( 1.883 -0.764 0.799) 2.184 12.086 ( -6.802 12.124 0.504) 13.911 12.192 ( -5.934 11.608 -2.992) 13.376 12.421 ( 1.051 1.855 1.622) 2.679 12.531 ( -6.615 -3.583 2.338) 7.878 12.796 ( -5.541 -6.072 -3.235) 8.834 12.939 ( -2.060 -4.186 2.992) 5.543 13.181 ( 5.921 -5.451 -0.265) 8.052 13.376 ( 5.609 -8.805 -0.102) 10.440 13.603 ( 0.587 -4.853 -1.949) 5.262 13.769 ( 2.301 -11.040 -3.220) 11.728 14.078 ( 0.007 -6.369 3.244) 7.147 14.258 ( 2.840 -13.591 -0.561) 13.896 14.932 ( -5.364 5.968 2.859) 8.519 15.283 ( -4.844 -2.297 2.915) 6.103 15.367 ( -1.908 -5.222 -0.857) 5.625 15.428 ( 4.876 -2.110 -2.122) 5.721 15.771 ( -3.910 5.967 -7.433) 10.303 15.862 ( 5.734 1.473 1.716) 6.164 16.191 ( 5.400 -8.663 3.110) 10.672 16.339 ( 6.218 -10.034 -3.303) 12.258 17.452 ( -5.438 9.309 3.262) 11.264 17.682 ( -2.747 1.442 1.519) 3.454 17.871 ( 8.560 6.382 -0.537) 10.691 17.989 ( 5.712 2.848 -3.110) 7.100 24.584 ( -2.725 4.177 -0.624) 5.027 24.622 ( 0.004 2.449 0.988) 2.641 24.713 ( 0.021 1.468 -0.845) 1.694 24.793 ( 3.109 -1.172 0.832) 3.425 25.484 ( -2.321 3.732 -2.250) 4.937 25.504 ( -0.857 1.770 -4.096) 4.544 25.678 ( 7.286 2.595 2.647) 8.175 25.698 ( 7.565 1.519 0.983) 7.779 27.379 ( -4.868 1.932 2.293) 5.718 27.421 ( -5.184 0.043 5.156) 7.311 27.500 ( -4.805 8.832 8.594) 13.227 27.780 ( -5.971 0.811 4.545) 7.548 28.019 ( -9.800 13.334 -7.465) 18.154 28.443 ( 10.742 1.961 2.246) 11.148 28.933 ( 1.415 -12.444 -3.277) 12.946 29.097 ( -2.693 -24.264 -7.423) 25.516 ======================= Grid point 136 (68/130) ======================= q-point: (-0.30 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.746 ( -20.645 18.784 -5.777) 28.504 2.819 ( -14.699 19.759 1.004) 24.647 3.402 ( -12.010 -11.922 -0.755) 16.939 3.579 ( -4.533 -8.515 -0.168) 9.648 3.690 ( -6.712 13.047 -0.648) 14.686 4.166 ( -3.448 -3.042 -1.634) 4.880 4.403 ( 0.969 -6.280 4.271) 7.656 4.467 ( -7.408 -3.023 4.542) 9.200 4.819 ( 0.825 6.665 3.973) 7.804 4.940 ( 5.106 -1.460 7.607) 9.278 5.094 ( -7.883 6.570 -1.217) 10.334 5.250 ( 3.380 0.137 -0.550) 3.427 5.446 ( -11.057 2.603 7.338) 13.523 5.579 ( -5.674 -5.463 6.426) 10.166 6.022 ( -0.601 6.857 -3.576) 7.757 6.164 ( -4.582 1.955 -7.400) 8.921 6.568 ( 11.857 11.680 -6.461) 17.854 6.844 ( 12.727 7.306 -2.489) 14.885 6.910 ( 2.401 4.623 1.226) 5.352 7.302 ( 2.091 -3.233 -7.146) 8.117 7.506 ( 0.361 1.388 -2.389) 2.786 7.544 ( 2.087 -3.801 -4.978) 6.602 7.684 ( -2.060 8.089 4.168) 9.330 7.853 ( -4.598 -1.754 -3.195) 5.867 8.008 ( -6.011 4.186 7.087) 10.192 8.133 ( -8.100 0.724 0.459) 8.145 8.196 ( -1.033 8.908 5.864) 10.715 8.536 ( -6.086 0.217 -0.262) 6.095 8.641 ( -2.522 3.091 5.693) 6.952 8.706 ( -5.244 -0.529 -1.896) 5.601 8.812 ( 2.118 -0.170 0.712) 2.241 8.889 ( -3.967 -10.709 4.518) 12.282 9.040 ( -3.243 4.020 -0.486) 5.188 9.185 ( 0.598 0.028 7.367) 7.391 9.421 ( -6.248 -2.636 1.026) 6.858 9.554 ( -3.908 -6.525 -3.500) 8.372 9.820 ( -4.714 2.756 -5.894) 8.034 9.923 ( -2.513 -2.792 -2.853) 4.717 10.269 ( 0.348 -1.108 -2.715) 2.953 10.351 ( 1.924 -6.192 -5.444) 8.467 10.934 ( 1.286 9.069 -2.510) 9.497 11.066 ( 2.100 7.882 -0.913) 8.208 11.204 ( 0.805 5.654 2.508) 6.238 11.330 ( 1.804 0.811 -0.565) 2.057 11.910 ( -10.492 12.420 -0.387) 16.263 12.051 ( -8.224 6.678 0.326) 10.599 12.384 ( -9.145 -2.685 3.417) 10.125 12.387 ( -8.643 -2.431 -1.724) 9.143 12.694 ( -0.637 -4.728 -1.115) 4.900 12.980 ( 1.028 -11.679 4.813) 12.673 13.304 ( 7.144 -1.381 0.129) 7.278 13.478 ( 5.357 -3.163 0.454) 6.238 13.632 ( 4.796 -6.520 -2.835) 8.576 13.776 ( 0.709 -11.147 -1.412) 11.259 14.109 ( 1.046 -5.910 1.851) 6.281 14.314 ( 2.899 -15.088 -0.673) 15.378 14.854 ( -4.797 2.919 1.429) 5.794 15.113 ( -11.510 -8.811 -0.071) 14.495 15.417 ( 4.366 1.133 1.589) 4.782 15.493 ( 4.192 -3.438 -1.755) 5.698 15.675 ( 0.147 10.113 -6.198) 11.862 16.023 ( 8.073 5.712 5.064) 11.111 16.347 ( 8.182 -7.879 3.105) 11.776 16.434 ( 6.571 -10.897 -3.489) 13.195 17.365 ( -5.439 11.437 1.549) 12.759 17.638 ( -2.487 0.436 -0.685) 2.616 18.036 ( 9.448 6.446 -0.348) 11.443 18.114 ( 9.418 3.481 -1.304) 10.125 24.529 ( -2.219 3.583 -0.666) 4.267 24.593 ( -2.742 0.599 -0.100) 2.808 24.758 ( 4.238 3.416 0.261) 5.449 24.868 ( 3.733 -1.275 1.283) 4.148 25.444 ( 0.858 3.923 -2.638) 4.804 25.470 ( 1.535 1.659 -4.762) 5.271 25.849 ( 7.468 3.103 3.320) 8.742 25.864 ( 8.625 2.088 0.996) 8.930 27.228 ( -12.349 3.633 -0.343) 12.877 27.285 ( -13.846 1.536 4.263) 14.568 27.470 ( -6.230 5.745 9.302) 12.584 27.714 ( -6.867 4.213 8.639) 11.813 27.784 ( -5.842 5.654 -9.140) 12.232 28.588 ( -6.845 -20.219 0.820) 21.362 28.879 ( 6.818 -2.980 -8.067) 10.974 29.079 ( 4.597 -11.138 -1.904) 12.199 ======================= Grid point 137 (69/130) ======================= q-point: (-0.20 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.333 ( -18.196 23.188 -2.360) 29.570 2.615 ( -9.194 27.338 1.390) 28.876 3.173 ( -9.490 -10.824 -4.736) 15.154 3.501 ( -6.317 3.172 3.840) 8.044 3.584 ( -4.265 -6.695 -0.482) 7.953 4.013 ( -14.132 2.632 -3.216) 14.730 4.109 ( -16.576 -1.677 -1.296) 16.711 4.417 ( -18.790 7.721 6.793) 21.420 4.543 ( -12.870 -0.472 -0.422) 12.886 4.909 ( -7.787 2.373 -4.414) 9.260 5.205 ( 2.531 -3.760 12.789) 13.568 5.314 ( 0.929 1.120 9.370) 9.482 5.484 ( 3.658 0.109 11.297) 11.875 5.677 ( 4.413 -5.079 8.988) 11.227 5.969 ( -3.479 1.315 -6.567) 7.548 6.024 ( 2.455 0.262 -3.747) 4.488 6.664 ( 3.665 10.439 -10.521) 15.267 6.971 ( 6.148 7.206 -3.056) 9.953 7.022 ( 6.460 2.106 -1.797) 7.028 7.282 ( 3.338 -3.708 -11.888) 12.892 7.483 ( -0.946 10.957 -5.659) 12.368 7.599 ( 8.244 1.774 -3.950) 9.312 7.722 ( 1.863 0.998 7.300) 7.600 7.747 ( -4.381 0.513 0.558) 4.446 7.952 ( -7.383 5.921 2.671) 9.834 8.019 ( -2.601 -2.480 5.339) 6.436 8.213 ( -0.832 6.312 1.056) 6.453 8.368 ( -9.163 0.511 -0.460) 9.189 8.538 ( -7.787 6.348 -1.766) 10.200 8.670 ( -4.494 -3.044 -3.361) 6.384 8.782 ( -0.912 1.951 3.152) 3.818 8.882 ( -3.204 -5.749 5.857) 8.810 9.001 ( -3.212 1.842 5.362) 6.516 9.269 ( 2.614 -4.353 1.145) 5.205 9.325 ( -5.938 -2.185 2.280) 6.725 9.404 ( -6.035 -5.072 -5.044) 9.358 9.760 ( 1.888 2.062 -0.920) 2.943 9.887 ( 0.450 -2.321 0.585) 2.435 10.219 ( -1.850 0.005 -4.391) 4.765 10.353 ( 2.689 -5.165 -4.626) 7.437 10.933 ( 0.749 6.832 -2.549) 7.331 11.057 ( -0.461 6.154 -1.990) 6.484 11.247 ( -0.296 8.171 -0.314) 8.183 11.330 ( 1.507 3.117 -3.205) 4.718 11.746 ( -7.825 10.295 3.227) 13.328 11.906 ( -7.232 3.684 0.987) 8.176 12.148 ( -14.166 -1.553 -0.243) 14.253 12.224 ( -10.703 -3.339 2.762) 11.547 12.729 ( 3.148 -4.744 0.181) 5.696 13.023 ( 0.483 -19.112 1.876) 19.210 13.438 ( 6.188 2.957 2.489) 7.296 13.593 ( 5.965 -2.916 1.138) 6.736 13.707 ( 4.699 -8.251 -2.941) 9.940 13.789 ( 1.743 -10.214 0.079) 10.362 14.146 ( 1.912 -5.586 0.077) 5.904 14.328 ( -0.928 -13.226 -0.843) 13.285 14.780 ( -3.883 -1.056 0.008) 4.024 14.902 ( -10.117 -8.174 0.032) 13.006 15.522 ( 4.601 -1.120 0.988) 4.837 15.563 ( 5.105 -5.382 -2.027) 7.690 15.679 ( 3.900 14.465 -2.262) 15.152 16.230 ( 9.047 3.551 5.745) 11.290 16.514 ( 5.481 0.117 -0.319) 5.492 16.533 ( 7.345 -11.817 1.804) 14.030 17.286 ( -4.000 11.798 0.981) 12.496 17.583 ( -1.757 -0.392 -2.847) 3.368 18.201 ( 8.143 7.974 -0.097) 11.397 18.314 ( 12.866 2.973 -1.104) 13.251 24.496 ( -0.930 2.989 -0.286) 3.143 24.548 ( -1.621 0.564 -0.352) 1.752 24.839 ( 3.990 3.407 -0.249) 5.252 24.941 ( 3.132 -1.049 0.281) 3.315 25.483 ( 5.088 3.491 -1.997) 6.486 25.497 ( 5.303 2.138 -3.560) 6.736 25.981 ( 4.833 3.563 0.404) 6.018 26.018 ( 6.062 2.223 2.441) 6.902 26.955 ( -14.571 3.108 -1.676) 14.992 27.016 ( -16.803 1.117 2.660) 17.049 27.357 ( -12.110 9.502 3.416) 15.768 27.657 ( -0.851 4.250 0.826) 4.412 27.731 ( -2.484 -6.332 9.020) 11.297 28.191 ( -25.241 -23.319 -9.646) 35.692 29.087 ( 13.127 0.004 -0.505) 13.136 29.176 ( 6.364 -4.826 -1.070) 8.058 ======================= Grid point 138 (70/130) ======================= q-point: (-0.10 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.083 ( -9.049 26.758 4.887) 28.666 2.487 ( -6.389 31.007 3.349) 31.835 2.993 ( -4.961 -7.707 -5.731) 10.809 3.365 ( -10.945 8.189 -2.727) 13.939 3.503 ( -5.455 -11.923 4.270) 13.790 3.653 ( -15.718 18.594 3.849) 24.650 3.870 ( -8.622 -0.052 -1.161) 8.700 4.169 ( -7.881 8.752 4.017) 12.444 4.385 ( -8.671 -12.376 2.857) 15.379 4.788 ( -1.890 -3.692 -0.866) 4.237 5.221 ( -8.527 -6.753 15.927) 19.286 5.343 ( -5.343 -5.811 8.822) 11.838 5.652 ( -6.313 1.012 -7.626) 9.952 5.685 ( 2.362 1.114 6.596) 7.094 5.886 ( 3.822 6.031 -1.654) 7.329 6.251 ( 14.095 -6.358 3.910) 15.950 6.603 ( 1.607 9.152 -11.232) 14.578 6.977 ( -3.364 -3.669 -4.784) 6.904 7.106 ( 6.536 7.773 -4.069) 10.940 7.236 ( 3.516 -1.037 -9.053) 9.767 7.374 ( -5.096 10.712 -5.015) 12.879 7.647 ( -5.126 0.521 -0.963) 5.241 7.730 ( -0.200 2.139 -5.625) 6.021 7.787 ( 1.633 0.938 2.871) 3.433 7.967 ( 8.395 6.910 2.138) 11.082 8.036 ( 2.792 0.227 -0.498) 2.845 8.191 ( -2.777 3.768 2.670) 5.389 8.253 ( -2.962 2.415 2.529) 4.582 8.390 ( -7.576 4.532 -5.103) 10.197 8.519 ( -3.768 -3.232 0.736) 5.018 8.773 ( -5.228 6.648 1.462) 8.583 8.873 ( -0.681 5.041 3.067) 5.940 8.974 ( -6.095 -2.176 7.051) 9.571 9.160 ( -7.219 -2.691 -2.723) 8.171 9.321 ( 2.581 -3.590 -1.600) 4.701 9.356 ( 1.511 -6.395 -1.042) 6.653 9.832 ( 3.236 1.378 3.685) 5.094 9.971 ( 4.036 -4.284 6.911) 9.078 10.167 ( 0.572 4.245 -3.471) 5.513 10.367 ( 1.920 -3.901 -1.974) 4.775 10.925 ( 0.845 5.622 -1.739) 5.945 11.053 ( 1.441 4.447 -1.345) 4.865 11.173 ( -3.855 10.390 -1.453) 11.177 11.356 ( 2.888 3.475 -4.075) 6.085 11.664 ( -4.572 6.970 4.272) 9.367 11.821 ( -2.474 1.993 0.692) 3.252 11.897 ( -12.139 -0.022 0.862) 12.169 12.053 ( -9.113 -3.756 1.581) 9.982 12.786 ( 2.354 -5.757 0.755) 6.265 13.031 ( -0.141 -20.775 -0.444) 20.780 13.561 ( 3.684 2.877 3.496) 5.837 13.691 ( 3.122 -4.987 0.864) 5.947 13.747 ( 1.914 -8.485 -1.202) 8.780 13.835 ( 2.854 -8.726 -1.059) 9.242 14.154 ( -0.310 -5.683 -4.151) 7.045 14.293 ( -1.495 -10.063 0.737) 10.200 14.705 ( -2.949 -2.589 -1.293) 4.132 14.791 ( -3.820 -9.430 5.473) 11.553 15.589 ( 2.753 -2.190 -0.923) 3.637 15.628 ( 3.837 -4.271 -2.904) 6.435 15.763 ( 4.131 14.898 2.165) 15.611 16.417 ( 6.402 -5.492 3.028) 8.962 16.560 ( 0.836 5.427 -3.851) 6.706 16.685 ( 4.768 -5.767 5.225) 9.126 17.243 ( -1.673 9.846 2.312) 10.251 17.537 ( -0.122 -1.149 -3.409) 3.599 18.325 ( 4.898 9.856 0.187) 11.008 18.540 ( 11.508 0.316 -2.658) 11.815 24.488 ( 0.091 2.606 -0.003) 2.608 24.530 ( -0.075 0.651 -0.418) 0.777 24.893 ( 2.296 3.191 -0.651) 3.985 24.984 ( 1.788 -0.840 -0.920) 2.179 25.576 ( 6.625 3.135 -2.598) 7.776 25.608 ( 7.813 2.049 -2.103) 8.346 26.035 ( 1.739 3.986 -1.377) 4.562 26.114 ( 2.115 0.728 1.279) 2.577 26.710 ( -10.202 1.613 0.273) 10.332 26.753 ( -11.718 -0.081 0.738) 11.741 27.137 ( -10.413 7.036 -1.964) 12.719 27.478 ( -19.611 -6.534 -17.782) 27.267 27.796 ( -1.662 -5.804 18.200) 19.175 27.830 ( -2.901 -6.061 8.661) 10.962 29.253 ( 5.504 -0.588 -3.606) 6.606 29.302 ( 6.593 -3.299 1.790) 7.586 ======================= Grid point 139 (71/130) ======================= q-point: ( 0.00 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.571 ( 1.672 -21.257 3.324) 21.580 2.571 ( 1.672 21.257 3.324) 21.580 3.068 ( -0.358 -23.193 3.962) 23.532 3.068 ( -0.358 23.193 3.962) 23.532 3.568 ( 3.991 -16.244 -4.029) 17.206 3.568 ( 3.991 16.244 -4.029) 17.206 3.889 ( -4.948 -17.976 1.206) 18.683 3.889 ( -4.948 17.976 1.206) 18.683 4.630 ( 4.899 -19.802 10.067) 22.748 4.630 ( 4.899 19.802 10.067) 22.748 5.161 ( -6.888 -6.366 11.912) 15.161 5.161 ( -6.888 6.366 11.912) 15.161 5.530 ( -5.296 -6.753 -10.065) 13.227 5.530 ( -5.296 6.753 -10.065) 13.227 6.197 ( -1.679 -10.220 4.212) 11.181 6.197 ( -1.679 10.220 4.212) 11.181 6.777 ( 7.871 -7.016 -11.705) 15.754 6.777 ( 7.871 7.016 -11.705) 15.754 7.287 ( 6.625 -1.657 -2.031) 7.124 7.287 ( 6.625 1.657 -2.031) 7.124 7.437 ( -4.138 -7.409 0.906) 8.535 7.437 ( -4.138 7.409 0.906) 8.535 7.738 ( -0.473 -2.571 -6.982) 7.456 7.738 ( -0.473 2.571 -6.982) 7.456 8.085 ( -6.062 -1.502 -3.764) 7.292 8.085 ( -6.062 1.502 -3.764) 7.292 8.269 ( 0.540 -3.070 4.124) 5.169 8.269 ( 0.540 3.070 4.124) 5.169 8.451 ( 5.791 -7.385 2.688) 9.762 8.451 ( 5.791 7.385 2.688) 9.762 8.784 ( -7.013 -5.743 -0.486) 9.078 8.784 ( -7.013 5.743 -0.486) 9.078 9.058 ( 0.677 -4.677 0.194) 4.730 9.058 ( 0.677 4.677 0.194) 4.730 9.299 ( 2.115 -2.620 -1.960) 3.896 9.299 ( 2.115 2.620 -1.960) 3.896 9.967 ( -0.023 -3.311 7.552) 8.246 9.967 ( -0.023 3.311 7.552) 8.246 10.314 ( 2.896 -5.674 -0.853) 6.427 10.314 ( 2.896 5.674 -0.853) 6.427 11.074 ( 2.401 -4.645 1.247) 5.376 11.074 ( 2.401 4.645 1.247) 5.376 11.299 ( -0.394 -6.470 -3.376) 7.308 11.299 ( -0.394 6.470 -3.376) 7.308 11.781 ( 3.171 -4.889 0.605) 5.859 11.781 ( 3.171 4.889 0.605) 5.859 11.832 ( -5.326 -6.489 1.244) 8.486 11.832 ( -5.326 6.489 1.244) 8.486 12.752 ( -0.033 -3.919 0.001) 3.920 12.752 ( -0.033 3.919 0.001) 3.920 13.627 ( -1.733 -2.185 2.475) 3.728 13.627 ( -1.733 2.185 2.475) 3.728 13.750 ( 0.547 -3.189 -0.797) 3.332 13.750 ( 0.547 3.189 -0.797) 3.332 14.088 ( -0.274 -4.850 -3.872) 6.212 14.088 ( -0.274 4.850 -3.872) 6.212 14.695 ( 0.808 -2.230 4.630) 5.202 14.695 ( 0.808 2.230 4.630) 5.202 15.594 ( 1.097 -1.276 -1.997) 2.611 15.594 ( 1.097 1.276 -1.997) 2.611 16.230 ( 2.629 -18.321 4.916) 19.151 16.230 ( 2.629 18.321 4.916) 19.151 16.618 ( -5.125 -5.927 -2.513) 8.228 16.618 ( -5.125 5.927 -2.513) 8.228 17.437 ( 1.371 -7.356 0.327) 7.490 17.437 ( 1.371 7.356 0.327) 7.490 18.545 ( -0.044 -6.485 -2.168) 6.837 18.545 ( -0.044 6.485 -2.168) 6.837 24.529 ( 0.250 -0.907 -0.070) 0.944 24.529 ( 0.250 0.907 -0.070) 0.944 24.966 ( 0.354 -1.969 -1.068) 2.268 24.966 ( 0.354 1.969 -1.068) 2.268 25.702 ( 2.697 -1.183 -1.274) 3.209 25.702 ( 2.697 1.183 -1.274) 3.209 26.076 ( -1.983 -0.980 -2.516) 3.351 26.076 ( -1.983 0.980 -2.516) 3.351 26.635 ( -0.487 -1.092 2.146) 2.457 26.635 ( -0.487 1.092 2.146) 2.457 27.066 ( -2.970 -2.563 -7.535) 8.496 27.066 ( -2.970 2.563 -7.535) 8.496 27.870 ( 1.977 -2.702 12.191) 12.642 27.870 ( 1.977 2.702 12.191) 12.642 29.306 ( 0.310 -2.502 -1.912) 3.164 29.306 ( 0.310 2.502 -1.912) 3.164 ======================= Grid point 141 (72/130) ======================= q-point: ( 0.10 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.679 ( 6.835 -16.972 2.192) 18.428 2.679 ( 6.835 16.972 2.192) 18.428 3.154 ( 4.983 -17.031 3.871) 18.162 3.154 ( 4.983 17.031 3.871) 18.162 3.716 ( 12.686 -10.674 -1.425) 16.640 3.716 ( 12.686 10.674 -1.425) 16.640 3.913 ( 7.606 -11.951 -0.824) 14.190 3.913 ( 7.606 11.951 -0.824) 14.190 4.847 ( 4.117 -19.461 14.941) 24.878 4.847 ( 4.117 19.461 14.941) 24.878 5.131 ( -0.346 -4.346 -1.196) 4.520 5.131 ( -0.346 4.346 -1.196) 4.520 5.359 ( -5.714 -9.515 -0.777) 11.126 5.359 ( -5.714 9.515 -0.777) 11.126 6.174 ( -1.870 -2.650 3.831) 5.020 6.174 ( -1.870 2.650 3.831) 5.020 6.861 ( 9.456 -5.282 -11.138) 15.536 6.861 ( 9.456 5.282 -11.138) 15.536 7.329 ( -4.322 -4.700 -5.790) 8.620 7.329 ( -4.322 4.700 -5.790) 8.620 7.432 ( 5.798 -3.556 -0.038) 6.802 7.432 ( 5.798 3.556 -0.038) 6.802 7.736 ( 5.084 -3.393 -1.445) 6.281 7.736 ( 5.084 3.393 -1.445) 6.281 7.897 ( -8.561 -1.120 -1.541) 8.770 7.897 ( -8.561 1.120 -1.541) 8.770 8.289 ( -1.504 -4.290 2.145) 5.027 8.289 ( -1.504 4.290 2.145) 5.027 8.565 ( 0.059 -3.124 0.542) 3.171 8.565 ( 0.059 3.124 0.542) 3.171 8.709 ( 2.413 -6.732 0.384) 7.162 8.709 ( 2.413 6.732 0.384) 7.162 9.046 ( -0.546 -4.962 -3.876) 6.320 9.046 ( -0.546 4.962 -3.876) 6.320 9.356 ( 4.746 -5.963 1.854) 7.843 9.356 ( 4.746 5.963 1.854) 7.843 10.005 ( -2.524 -2.267 8.346) 9.010 10.005 ( -2.524 2.267 8.346) 9.010 10.331 ( 0.141 -5.935 -2.825) 6.575 10.331 ( 0.141 5.935 -2.825) 6.575 11.133 ( 1.712 -1.725 1.197) 2.709 11.133 ( 1.712 1.725 1.197) 2.709 11.269 ( 0.293 -2.374 -4.492) 5.089 11.269 ( 0.293 2.374 -4.492) 5.089 11.796 ( 2.323 -3.580 0.719) 4.328 11.796 ( 2.323 3.580 0.719) 4.328 11.933 ( 10.487 -7.201 2.261) 12.920 11.933 ( 10.487 7.201 2.261) 12.920 12.744 ( -0.916 -2.856 0.171) 3.004 12.744 ( -0.916 2.856 0.171) 3.004 13.588 ( -4.065 -3.523 2.051) 5.757 13.588 ( -4.065 3.523 2.051) 5.757 13.726 ( -2.267 -3.410 -0.464) 4.121 13.726 ( -2.267 3.410 -0.464) 4.121 14.065 ( 0.563 -4.184 -2.901) 5.122 14.065 ( 0.563 4.184 -2.901) 5.122 14.766 ( 2.961 -1.421 3.140) 4.544 14.766 ( 2.961 1.421 3.140) 4.544 15.578 ( -1.181 -1.927 -1.601) 2.770 15.578 ( -1.181 1.927 -1.601) 2.770 16.295 ( -2.574 -14.843 7.327) 16.752 16.295 ( -2.574 14.843 7.327) 16.752 16.448 ( -7.605 -4.575 -4.090) 9.772 16.448 ( -7.605 4.575 -4.090) 9.772 17.469 ( 1.582 -6.602 -0.264) 6.794 17.469 ( 1.582 6.602 -0.264) 6.794 18.456 ( -6.991 -4.237 -1.996) 8.415 18.456 ( -6.991 4.237 -1.996) 8.415 24.536 ( 0.608 -0.829 0.119) 1.034 24.536 ( 0.608 0.829 0.119) 1.034 24.940 ( -2.275 -1.755 -1.335) 3.169 24.940 ( -2.275 1.755 -1.335) 3.169 25.685 ( -3.090 -1.904 -0.239) 3.637 25.685 ( -3.090 1.904 -0.239) 3.637 26.024 ( -1.752 -2.499 -2.023) 3.661 26.024 ( -1.752 2.499 -2.023) 3.661 26.726 ( 8.408 -2.260 0.613) 8.728 26.726 ( 8.408 2.260 0.613) 8.728 27.086 ( 9.458 -0.850 -5.107) 10.782 27.086 ( 9.458 0.850 -5.107) 10.782 28.014 ( 3.855 -7.427 9.541) 12.691 28.014 ( 3.855 7.427 9.541) 12.691 29.243 ( -5.154 -2.850 -1.847) 6.172 29.243 ( -5.154 2.850 -1.847) 6.172 ======================= Grid point 143 (73/130) ======================= q-point: ( 0.20 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.844 ( 10.307 -11.414 -0.974) 15.410 2.844 ( 10.307 11.414 -0.974) 15.410 3.291 ( 6.833 -10.664 3.666) 13.186 3.291 ( 6.833 10.664 3.666) 13.186 3.955 ( 10.871 -4.574 1.094) 11.845 3.955 ( 10.871 4.574 1.094) 11.845 4.047 ( 5.285 -1.937 -4.055) 6.937 4.047 ( 5.285 1.937 -4.055) 6.937 4.896 ( 0.503 -8.968 0.380) 8.990 4.896 ( 0.503 8.968 0.380) 8.990 5.208 ( -1.119 -3.681 6.072) 7.189 5.208 ( -1.119 3.681 6.072) 7.189 5.405 ( 9.434 -6.022 10.687) 15.475 5.405 ( 9.434 6.022 10.687) 15.475 6.217 ( 3.436 -5.022 2.452) 6.560 6.217 ( 3.436 5.022 2.452) 6.560 6.888 ( -0.662 -6.385 -8.607) 10.737 6.888 ( -0.662 6.385 -8.607) 10.737 7.146 ( -4.887 -2.039 -9.485) 10.863 7.146 ( -4.887 2.039 -9.485) 10.863 7.478 ( -2.518 -3.054 -1.540) 4.247 7.478 ( -2.518 3.054 -1.540) 4.247 7.828 ( 4.588 -5.090 3.837) 7.853 7.828 ( 4.588 5.090 3.837) 7.853 7.886 ( 7.435 -3.150 -0.306) 8.080 7.886 ( 7.435 3.150 -0.306) 8.080 8.256 ( -2.903 -2.487 1.539) 4.121 8.256 ( -2.903 2.487 1.539) 4.121 8.535 ( 0.465 -6.475 -1.653) 6.699 8.535 ( 0.465 6.475 -1.653) 6.699 8.794 ( 2.909 -1.912 -0.739) 3.558 8.794 ( 2.909 1.912 -0.739) 3.558 9.016 ( 1.811 -5.272 -1.745) 5.841 9.016 ( 1.811 5.272 -1.745) 5.841 9.493 ( 6.601 -7.253 3.703) 10.483 9.493 ( 6.601 7.253 3.703) 10.483 10.020 ( -1.780 -2.027 5.853) 6.445 10.020 ( -1.780 2.027 5.853) 6.445 10.279 ( -1.306 -5.539 -6.217) 8.428 10.279 ( -1.306 5.539 -6.217) 8.428 11.127 ( -0.837 -1.086 -3.498) 3.757 11.127 ( -0.837 1.086 -3.498) 3.757 11.242 ( -1.009 -4.442 -0.745) 4.616 11.242 ( -1.009 4.442 -0.745) 4.616 11.921 ( 9.556 -5.515 0.905) 11.070 11.921 ( 9.556 5.515 0.905) 11.070 12.180 ( 12.719 -9.148 2.618) 15.884 12.180 ( 12.719 9.148 2.618) 15.884 12.727 ( -1.072 -3.076 1.027) 3.415 12.727 ( -1.072 3.076 1.027) 3.415 13.519 ( -5.109 -5.947 1.864) 8.058 13.519 ( -5.109 5.947 1.864) 8.058 13.665 ( -3.734 -3.093 -0.695) 4.898 13.665 ( -3.734 3.093 -0.695) 4.898 14.049 ( -0.669 -3.446 -1.227) 3.719 14.049 ( -0.669 3.446 -1.227) 3.719 14.854 ( 5.258 -1.977 0.357) 5.629 14.854 ( 5.258 1.977 0.357) 5.629 15.532 ( -2.606 -1.599 -0.593) 3.115 15.532 ( -2.606 1.599 -0.593) 3.115 16.155 ( -10.665 -8.202 -3.008) 13.786 16.155 ( -10.665 8.202 -3.008) 13.786 16.393 ( -3.200 -15.260 7.471) 17.289 16.393 ( -3.200 15.260 7.471) 17.289 17.488 ( 1.602 -6.129 -1.733) 6.568 17.488 ( 1.602 6.129 -1.733) 6.568 18.287 ( -9.051 -2.109 -1.296) 9.383 18.287 ( -9.051 2.109 -1.296) 9.383 24.558 ( 1.757 -0.966 0.029) 2.005 24.558 ( 1.757 0.966 0.029) 2.005 24.869 ( -3.874 -1.698 -0.810) 4.307 24.869 ( -3.874 1.698 -0.810) 4.307 25.617 ( -3.511 -2.239 -0.952) 4.272 25.617 ( -3.511 2.239 -0.952) 4.272 25.954 ( -4.966 -3.310 0.132) 5.969 25.954 ( -4.966 3.310 0.132) 5.969 26.943 ( 14.163 -3.063 -0.750) 14.510 26.943 ( 14.163 3.063 -0.750) 14.510 27.265 ( 10.732 -1.875 -0.728) 10.919 27.265 ( 10.732 1.875 -0.728) 10.919 28.166 ( 6.700 -11.190 3.903) 13.614 28.166 ( 6.700 11.190 3.903) 13.614 29.103 ( -8.051 -1.762 -1.308) 8.345 29.103 ( -8.051 1.762 -1.308) 8.345 ======================= Grid point 145 (74/130) ======================= q-point: ( 0.30 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.051 ( 13.502 -6.414 -2.092) 15.094 3.051 ( 13.502 6.414 -2.092) 15.094 3.475 ( 9.519 -5.339 3.055) 11.333 3.475 ( 9.519 5.339 3.055) 11.333 3.917 ( -4.269 -3.394 -8.914) 10.450 3.917 ( -4.269 3.394 -8.914) 10.450 4.214 ( 7.421 -8.281 6.893) 13.083 4.214 ( 7.421 8.281 6.893) 13.083 4.907 ( -7.585 -10.534 4.805) 13.841 4.907 ( -7.585 10.534 4.805) 13.841 5.205 ( 1.534 -4.769 2.650) 5.667 5.205 ( 1.534 4.769 2.650) 5.667 5.733 ( 13.296 -3.111 8.909) 16.304 5.733 ( 13.296 3.111 8.909) 16.304 6.311 ( 4.330 -6.963 0.363) 8.208 6.311 ( 4.330 6.963 0.363) 8.208 6.666 ( -11.974 -3.858 -7.327) 14.558 6.666 ( -11.974 3.858 -7.327) 14.558 7.057 ( -0.423 -3.236 -6.729) 7.479 7.057 ( -0.423 3.236 -6.729) 7.479 7.409 ( -0.094 -3.691 -3.720) 5.241 7.409 ( -0.094 3.691 -3.720) 5.241 7.931 ( 3.147 -4.221 0.770) 5.321 7.931 ( 3.147 4.221 0.770) 5.321 8.078 ( 9.813 -4.821 3.631) 11.521 8.078 ( 9.813 4.821 3.631) 11.521 8.227 ( -2.565 -1.866 6.468) 7.204 8.227 ( -2.565 1.866 6.468) 7.204 8.570 ( 3.855 -4.198 -3.004) 6.443 8.570 ( 3.855 4.198 -3.004) 6.443 8.784 ( 0.799 -1.630 -4.573) 4.920 8.784 ( 0.799 1.630 -4.573) 4.920 9.110 ( 5.911 -4.598 3.270) 8.172 9.110 ( 5.911 4.598 3.270) 8.172 9.614 ( 2.334 -5.075 3.463) 6.572 9.614 ( 2.334 5.075 3.463) 6.572 10.045 ( 1.974 -2.335 1.074) 3.241 10.045 ( 1.974 2.335 1.074) 3.241 10.203 ( -0.617 -4.751 -7.503) 8.902 10.203 ( -0.617 4.751 -7.503) 8.902 11.087 ( 0.233 -2.796 -3.190) 4.248 11.087 ( 0.233 2.796 -3.190) 4.248 11.207 ( -2.716 -6.487 0.610) 7.059 11.207 ( -2.716 6.487 0.610) 7.059 12.124 ( 10.754 -7.789 0.455) 13.286 12.124 ( 10.754 7.789 0.455) 13.286 12.396 ( 8.009 -9.653 0.586) 12.556 12.396 ( 8.009 9.653 0.586) 12.556 12.746 ( 2.101 -2.360 2.987) 4.348 12.746 ( 2.101 2.360 2.987) 4.348 13.408 ( -9.056 -6.777 1.490) 11.408 13.408 ( -9.056 6.777 1.490) 11.408 13.596 ( -1.510 -2.723 -2.344) 3.897 13.596 ( -1.510 2.723 -2.344) 3.897 14.025 ( -1.400 -3.993 0.757) 4.299 14.025 ( -1.400 3.993 0.757) 4.299 14.975 ( 7.999 -2.702 -0.777) 8.479 14.975 ( 7.999 2.702 -0.777) 8.479 15.479 ( -2.967 -2.366 0.372) 3.813 15.479 ( -2.967 2.366 0.372) 3.813 15.941 ( -8.759 -6.447 -3.962) 11.575 15.941 ( -8.759 6.447 -3.962) 11.575 16.365 ( -6.423 -13.382 6.774) 16.316 16.365 ( -6.423 13.382 6.774) 16.316 17.515 ( 2.916 -5.548 -1.434) 6.430 17.515 ( 2.916 5.548 -1.434) 6.430 18.118 ( -7.849 -2.680 -1.037) 8.359 18.118 ( -7.849 2.680 -1.037) 8.359 24.596 ( 2.340 -1.299 -0.472) 2.718 24.596 ( 2.340 1.299 -0.472) 2.718 24.802 ( -2.920 -1.634 0.596) 3.399 24.802 ( -2.920 1.634 0.596) 3.399 25.542 ( -2.433 -1.532 -3.330) 4.400 25.542 ( -2.433 1.532 -3.330) 4.400 25.853 ( -6.740 -2.392 2.320) 7.519 25.853 ( -6.740 2.392 2.320) 7.519 27.194 ( 11.910 -2.362 0.651) 12.160 27.194 ( 11.910 2.362 0.651) 12.160 27.436 ( 6.793 -3.553 1.972) 7.916 27.436 ( 6.793 3.553 1.972) 7.916 28.330 ( 9.409 -10.609 -0.188) 14.182 28.330 ( 9.409 10.609 -0.188) 14.182 28.939 ( -8.161 -2.441 -1.599) 8.668 28.939 ( -8.161 2.441 -1.599) 8.668 ======================= Grid point 147 (75/130) ======================= q-point: ( 0.40 -0.50 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.292 ( 12.280 -4.030 -0.606) 12.939 3.292 ( 12.280 4.030 -0.606) 12.939 3.636 ( 5.869 -5.285 -3.146) 8.501 3.636 ( 5.869 5.285 -3.146) 8.501 3.843 ( 0.931 -10.752 2.600) 11.101 3.843 ( 0.931 10.752 2.600) 11.101 4.359 ( 3.517 -2.430 2.619) 5.013 4.359 ( 3.517 2.430 2.619) 5.013 4.697 ( -14.162 -11.923 4.089) 18.959 4.697 ( -14.162 11.923 4.089) 18.959 5.257 ( -1.445 -2.703 2.680) 4.072 5.257 ( -1.445 2.703 2.680) 4.072 5.963 ( 5.205 -3.634 2.378) 6.779 5.963 ( 5.205 3.634 2.378) 6.779 6.344 ( -1.303 -6.060 -0.068) 6.199 6.344 ( -1.303 6.060 -0.068) 6.199 6.465 ( -1.203 -1.986 -7.502) 7.854 6.465 ( -1.203 1.986 -7.502) 7.854 6.996 ( -0.897 -6.638 -2.974) 7.329 6.996 ( -0.897 6.638 -2.974) 7.329 7.422 ( 4.122 -3.717 -3.662) 6.650 7.422 ( 4.122 3.717 -3.662) 6.650 7.965 ( -1.810 -4.604 3.240) 5.914 7.965 ( -1.810 4.604 3.240) 5.914 8.173 ( -0.042 -6.752 5.351) 8.616 8.173 ( -0.042 6.752 5.351) 8.616 8.356 ( 6.488 -0.783 5.335) 8.436 8.356 ( 6.488 0.783 5.335) 8.436 8.579 ( 1.781 -2.382 -3.893) 4.899 8.579 ( 1.781 2.382 -3.893) 4.899 8.806 ( 3.159 -3.570 -1.245) 4.927 8.806 ( 3.159 3.570 -1.245) 4.927 9.225 ( 3.321 -4.090 0.931) 5.350 9.225 ( 3.321 4.090 0.931) 5.350 9.638 ( -1.539 -3.398 2.775) 4.649 9.638 ( -1.539 3.398 2.775) 4.649 10.102 ( 3.754 -0.897 -5.896) 7.047 10.102 ( 3.754 0.897 -5.896) 7.047 10.146 ( 0.715 -4.310 -2.302) 4.938 10.146 ( 0.715 4.310 -2.302) 4.938 11.091 ( 1.710 -6.034 -0.981) 6.348 11.091 ( 1.710 6.034 -0.981) 6.348 11.161 ( -2.452 -7.400 0.951) 7.853 11.161 ( -2.452 7.400 0.951) 7.853 12.295 ( 6.788 -8.653 -0.203) 10.999 12.295 ( 6.788 8.653 -0.203) 10.999 12.487 ( 3.029 -6.908 -0.719) 7.577 12.487 ( 3.029 6.908 -0.719) 7.577 12.844 ( 4.347 -0.972 3.357) 5.578 12.844 ( 4.347 0.972 3.357) 5.578 13.217 ( -10.895 -4.498 -0.064) 11.787 13.217 ( -10.895 4.498 -0.064) 11.787 13.578 ( 1.481 -2.876 -2.884) 4.334 13.578 ( 1.481 2.876 -2.884) 4.334 14.015 ( -1.068 -4.668 2.355) 5.336 14.015 ( -1.068 4.668 2.355) 5.336 15.126 ( 8.242 -4.480 -0.751) 9.411 15.126 ( 8.242 4.480 -0.751) 9.411 15.419 ( -4.151 -5.576 0.100) 6.952 15.419 ( -4.151 5.576 0.100) 6.952 15.792 ( -3.658 -1.633 -2.306) 4.623 15.792 ( -3.658 1.633 -2.306) 4.623 16.272 ( -7.231 -8.334 2.810) 11.385 16.272 ( -7.231 8.334 2.810) 11.385 17.573 ( 3.440 -5.468 0.465) 6.477 17.573 ( 3.440 5.468 0.465) 6.477 17.987 ( -4.995 -4.275 -1.470) 6.737 17.987 ( -4.995 4.275 -1.470) 6.737 24.631 ( 1.750 -2.562 -0.475) 3.139 24.631 ( 1.750 2.562 -0.475) 3.139 24.770 ( -1.613 -2.463 0.794) 3.049 24.770 ( -1.613 2.463 0.794) 3.049 25.494 ( 0.795 -1.011 -3.297) 3.539 25.494 ( 0.795 1.011 -3.297) 3.539 25.746 ( -6.650 -1.257 2.002) 7.058 25.746 ( -6.650 1.257 2.002) 7.058 27.371 ( 5.063 -0.924 2.971) 5.943 27.371 ( 5.063 0.924 2.971) 5.943 27.556 ( 4.195 -7.047 3.922) 9.091 27.556 ( 4.195 7.047 3.922) 9.091 28.492 ( 8.001 -13.178 -2.403) 15.603 28.492 ( 8.001 13.178 -2.403) 15.603 28.782 ( -6.244 -13.115 -2.877) 14.808 28.782 ( -6.244 13.115 -2.877) 14.808 ======================= Grid point 149 (76/130) ======================= q-point: (-0.50 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.417 ( -0.400 -3.696 -0.188) 3.722 3.417 ( -0.400 3.696 -0.188) 3.722 3.728 ( 8.903 -4.750 0.024) 10.091 3.728 ( 8.903 4.750 0.024) 10.091 3.825 ( -9.977 -7.639 1.122) 12.616 3.825 ( -9.977 7.639 1.122) 12.616 4.425 ( 5.359 -11.551 2.103) 12.906 4.425 ( 5.359 11.551 2.103) 12.906 4.588 ( -2.865 -18.159 4.412) 18.906 4.588 ( -2.865 18.159 4.412) 18.906 5.196 ( -4.345 -4.712 1.699) 6.631 5.196 ( -4.345 4.712 1.699) 6.631 5.949 ( -5.065 -3.984 -3.954) 7.561 5.949 ( -5.065 3.984 -3.954) 7.561 6.286 ( -2.383 -5.614 -4.936) 7.846 6.286 ( -2.383 5.614 -4.936) 7.846 6.489 ( 5.975 -1.105 -0.694) 6.116 6.489 ( 5.975 1.105 -0.694) 6.116 6.999 ( 2.894 -9.208 -1.001) 9.704 6.999 ( 2.894 9.208 -1.001) 9.704 7.484 ( 4.720 -3.666 -2.680) 6.549 7.484 ( 4.720 3.666 -2.680) 6.549 7.923 ( -5.306 -5.089 4.303) 8.518 7.923 ( -5.306 5.089 4.303) 8.519 8.226 ( -0.122 -6.071 6.486) 8.885 8.226 ( -0.122 6.071 6.486) 8.885 8.386 ( -3.772 -1.889 -0.377) 4.235 8.386 ( -3.772 1.889 -0.377) 4.235 8.663 ( 5.392 -2.958 2.305) 6.568 8.663 ( 5.392 2.958 2.305) 6.568 8.844 ( 1.828 -2.036 -0.234) 2.746 8.844 ( 1.828 2.036 -0.234) 2.746 9.226 ( -2.020 -4.749 -2.465) 5.719 9.226 ( -2.020 4.749 -2.465) 5.719 9.618 ( -3.306 -1.465 2.520) 4.407 9.618 ( -3.306 1.465 2.520) 4.407 10.054 ( -0.471 -1.038 -7.654) 7.738 10.054 ( -0.471 1.038 -7.654) 7.738 10.209 ( 4.217 -1.748 -0.228) 4.571 10.209 ( 4.217 1.748 -0.228) 4.571 11.121 ( 1.349 -6.892 0.138) 7.024 11.121 ( 1.349 6.892 0.138) 7.024 11.146 ( 0.199 -5.268 1.541) 5.493 11.146 ( 0.199 5.268 1.541) 5.493 12.354 ( -0.450 -7.413 -0.225) 7.430 12.354 ( -0.450 7.413 -0.225) 7.430 12.518 ( 0.961 -5.053 -1.474) 5.351 12.518 ( 0.961 5.053 -1.474) 5.351 12.878 ( -5.757 -5.143 2.549) 8.130 12.878 ( -5.757 5.143 2.549) 8.130 13.101 ( 2.227 -5.350 -0.947) 5.872 13.101 ( 2.227 5.350 -0.947) 5.872 13.590 ( 1.789 -3.511 -2.549) 4.693 13.590 ( 1.789 3.511 -2.549) 4.693 14.021 ( -0.698 -4.581 2.944) 5.490 14.021 ( -0.698 4.581 2.944) 5.490 15.226 ( 0.084 -11.223 -0.147) 11.224 15.226 ( 0.084 11.223 -0.147) 11.224 15.339 ( -0.884 -3.200 -1.715) 3.736 15.339 ( -0.884 3.200 -1.715) 3.736 15.787 ( 3.355 -3.440 0.603) 4.843 15.787 ( 3.355 3.440 0.603) 4.843 16.168 ( -4.123 -5.924 -0.462) 7.233 16.168 ( -4.123 5.924 -0.462) 7.233 17.628 ( 0.607 -6.053 2.156) 6.454 17.628 ( 0.607 6.053 2.156) 6.454 17.925 ( 0.635 -5.131 -2.245) 5.637 17.925 ( 0.635 5.131 -2.245) 5.637 24.656 ( 0.809 -2.705 0.448) 2.859 24.656 ( 0.809 2.705 0.448) 2.859 24.743 ( -1.203 -2.543 -0.534) 2.863 24.743 ( -1.203 2.543 -0.534) 2.863 25.528 ( 4.137 -0.858 -1.612) 4.522 25.528 ( 4.137 0.858 -1.612) 4.522 25.650 ( -3.670 -0.664 0.469) 3.759 25.650 ( -3.670 0.664 0.469) 3.759 27.429 ( -0.952 -1.733 3.428) 3.957 27.429 ( -0.952 1.733 3.428) 3.957 27.662 ( 1.252 -9.038 7.771) 11.985 27.662 ( 1.252 9.038 7.771) 11.985 28.510 ( -2.778 -11.790 -7.173) 14.078 28.510 ( -2.778 11.790 -7.173) 14.078 28.721 ( 2.505 -14.799 -1.731) 15.109 28.721 ( 2.505 14.799 -1.731) 15.109 ======================= Grid point 151 (77/130) ======================= q-point: (-0.40 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.321 ( -7.980 -4.257 0.622) 9.066 3.321 ( -7.980 4.257 0.622) 9.066 3.515 ( -17.362 -2.940 -4.245) 18.113 3.515 ( -17.362 2.940 -4.245) 18.113 3.969 ( 10.243 -6.168 3.963) 12.597 3.969 ( 10.243 6.168 3.963) 12.597 4.431 ( -8.051 -14.529 3.389) 16.952 4.431 ( -8.051 14.529 3.389) 16.952 4.689 ( 10.145 -4.808 3.096) 11.646 4.689 ( 10.145 4.808 3.096) 11.646 5.199 ( 1.592 -0.796 3.116) 3.588 5.199 ( 1.592 0.796 3.116) 3.588 5.745 ( -12.859 -4.521 -3.537) 14.082 5.745 ( -12.859 4.521 -3.537) 14.082 6.213 ( -0.028 -5.600 -6.507) 8.585 6.213 ( -0.028 5.600 -6.507) 8.585 6.619 ( 7.083 -4.757 1.506) 8.664 6.619 ( 7.083 4.757 1.506) 8.664 7.065 ( 5.145 -12.161 -2.482) 13.435 7.065 ( 5.145 12.161 -2.482) 13.435 7.521 ( 0.871 -2.308 -2.508) 3.518 7.521 ( 0.871 2.308 -2.508) 3.518 7.858 ( -3.675 -4.982 1.098) 6.288 7.858 ( -3.675 4.982 1.098) 6.288 8.222 ( -6.135 -5.554 2.934) 8.780 8.222 ( -6.135 5.554 2.934) 8.780 8.343 ( -1.324 -8.091 8.334) 11.691 8.343 ( -1.324 8.091 8.334) 11.691 8.702 ( -1.839 -2.747 -0.695) 3.378 8.702 ( -1.839 2.747 -0.695) 3.378 8.882 ( 0.885 -0.895 -0.154) 1.268 8.882 ( 0.885 0.895 -0.154) 1.268 9.159 ( -2.358 -3.518 -0.244) 4.242 9.159 ( -2.358 3.518 -0.244) 4.242 9.548 ( -5.557 -2.584 0.871) 6.189 9.548 ( -5.557 2.584 0.871) 6.189 9.972 ( -2.373 -0.404 -6.103) 6.560 9.972 ( -2.373 0.404 -6.103) 6.560 10.266 ( 2.621 -1.711 -2.202) 3.827 10.266 ( 2.621 1.711 -2.202) 3.827 11.127 ( 0.073 -5.388 -0.952) 5.472 11.127 ( 0.073 5.388 -0.952) 5.472 11.201 ( 3.276 -4.541 2.512) 6.137 11.201 ( 3.276 4.541 2.512) 6.137 12.271 ( -7.735 -4.932 -0.790) 9.208 12.271 ( -7.735 4.932 -0.790) 9.208 12.488 ( -3.295 -2.731 -1.256) 4.460 12.488 ( -3.295 2.731 -1.256) 4.460 12.760 ( -6.245 -6.985 2.104) 9.603 12.760 ( -6.245 6.985 2.104) 9.603 13.225 ( 9.138 -6.539 -0.007) 11.237 13.225 ( 9.138 6.539 -0.007) 11.237 13.596 ( 0.948 -4.525 -2.061) 5.061 13.596 ( 0.948 4.525 -2.061) 5.061 14.040 ( 0.440 -4.519 2.668) 5.267 14.040 ( 0.440 4.519 2.668) 5.267 15.118 ( -7.858 -10.288 -0.911) 12.978 15.118 ( -7.858 10.288 -0.911) 12.978 15.383 ( 3.689 -2.750 -0.606) 4.641 15.383 ( 3.689 2.750 -0.606) 4.641 15.876 ( 5.252 -4.807 -1.770) 7.336 15.876 ( 5.252 4.807 -1.770) 7.336 16.151 ( 2.804 -6.947 1.466) 7.633 16.151 ( 2.804 6.947 1.466) 7.633 17.617 ( -2.938 -6.512 1.530) 7.306 17.617 ( -2.938 6.512 1.530) 7.306 17.982 ( 6.759 -3.428 -1.696) 7.766 17.982 ( 6.759 3.428 -1.696) 7.766 24.641 ( -2.526 -1.000 -0.416) 2.749 24.641 ( -2.526 1.000 -0.416) 2.749 24.752 ( 2.539 -2.433 0.593) 3.566 24.752 ( 2.539 2.433 0.593) 3.566 25.522 ( -1.423 -0.226 -3.525) 3.808 25.522 ( -1.423 0.226 -3.525) 3.808 25.710 ( 7.591 -0.460 2.104) 7.891 25.710 ( 7.591 0.460 2.104) 7.891 27.406 ( -4.850 -1.056 3.881) 6.301 27.406 ( -4.850 1.056 3.881) 6.301 27.686 ( -6.066 -8.129 8.190) 13.036 27.686 ( -6.066 8.129 8.190) 13.036 28.356 ( -6.627 -14.738 -7.050) 17.630 28.356 ( -6.627 14.738 -7.050) 17.630 28.786 ( 6.186 -3.228 -2.750) 7.500 28.786 ( 6.186 3.228 -2.750) 7.500 ======================= Grid point 153 (78/130) ======================= q-point: (-0.30 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.100 ( -17.311 -16.427 -1.724) 23.927 3.100 ( -17.311 16.427 -1.724) 23.927 3.246 ( -5.849 -20.625 -1.251) 21.475 3.246 ( -5.849 20.625 -1.251) 21.475 3.999 ( -6.590 -13.386 -3.920) 15.426 3.999 ( -6.590 13.386 -3.920) 15.426 4.385 ( -3.128 -3.506 6.443) 7.974 4.385 ( -3.128 3.506 6.443) 7.974 4.901 ( 5.847 -2.286 6.000) 8.684 4.901 ( 5.847 2.286 6.000) 8.684 5.222 ( -0.855 -4.408 0.043) 4.490 5.222 ( -0.854 4.408 0.043) 4.490 5.492 ( -11.435 -3.007 6.186) 13.344 5.492 ( -11.435 3.007 6.186) 13.344 6.138 ( -4.096 -4.050 -5.242) 7.788 6.138 ( -4.096 4.050 -5.242) 7.788 6.781 ( 10.141 -8.398 -2.289) 13.365 6.781 ( 10.141 8.398 -2.289) 13.365 7.128 ( 4.493 -11.678 -5.505) 13.670 7.128 ( 4.493 11.678 -5.505) 13.670 7.513 ( 2.636 -0.414 -2.081) 3.384 7.513 ( 2.635 0.414 -2.081) 3.384 7.802 ( -3.477 -3.291 0.779) 4.851 7.802 ( -3.477 3.291 0.779) 4.851 8.106 ( -7.933 -4.033 3.455) 9.547 8.106 ( -7.933 4.033 3.455) 9.547 8.413 ( -1.943 -11.612 7.870) 14.162 8.413 ( -1.943 11.612 7.870) 14.162 8.644 ( -1.801 -1.498 0.781) 2.469 8.644 ( -1.801 1.498 0.781) 2.469 8.826 ( -4.239 -3.378 -3.583) 6.498 8.826 ( -4.239 3.378 -3.583) 6.498 9.156 ( 0.117 -4.243 2.443) 4.897 9.156 ( 0.117 4.243 2.443) 4.897 9.440 ( -6.330 -4.308 0.327) 7.664 9.440 ( -6.330 4.308 0.327) 7.664 9.872 ( -3.269 -2.530 -4.255) 5.932 9.872 ( -3.269 2.530 -4.255) 5.932 10.273 ( 1.343 -1.770 -4.311) 4.850 10.273 ( 1.343 1.770 -4.311) 4.850 11.110 ( -0.499 -5.615 -2.447) 6.145 11.110 ( -0.499 5.615 -2.447) 6.145 11.289 ( 3.800 -3.985 1.674) 5.755 11.289 ( 3.800 3.985 1.674) 5.755 12.086 ( -10.690 -4.084 -0.282) 11.447 12.086 ( -10.690 4.084 -0.282) 11.447 12.362 ( -9.704 -0.852 0.421) 9.751 12.362 ( -9.704 0.852 0.421) 9.751 12.712 ( -0.968 -9.309 1.752) 9.521 12.712 ( -0.968 9.309 1.752) 9.521 13.397 ( 8.235 -6.029 1.040) 10.259 13.397 ( 8.235 6.029 1.040) 10.259 13.601 ( 1.607 -4.334 -1.483) 4.854 13.601 ( 1.607 4.334 -1.483) 4.854 14.080 ( 1.748 -5.032 1.688) 5.588 14.080 ( 1.748 5.032 1.688) 5.588 14.957 ( -8.430 -6.548 -1.205) 10.742 14.957 ( -8.430 6.548 -1.205) 10.742 15.443 ( 3.434 -1.734 -0.443) 3.872 15.443 ( 3.434 1.734 -0.443) 3.872 15.947 ( 5.975 -13.946 -4.717) 15.889 15.947 ( 5.975 13.946 -4.717) 15.889 16.287 ( 7.445 -5.169 5.883) 10.805 16.287 ( 7.445 5.169 5.883) 10.805 17.561 ( -3.419 -7.374 -0.228) 8.131 17.561 ( -3.419 7.374 -0.228) 8.131 18.128 ( 9.670 -2.153 -0.888) 9.947 18.128 ( 9.670 2.153 -0.888) 9.947 24.584 ( -2.642 -1.628 -0.698) 3.181 24.584 ( -2.642 1.628 -0.698) 3.181 24.824 ( 3.998 -2.915 1.114) 5.072 24.824 ( 3.998 2.915 1.114) 5.072 25.485 ( 1.280 -0.392 -3.865) 4.090 25.485 ( 1.280 0.392 -3.865) 4.090 25.884 ( 8.295 -0.285 2.207) 8.588 25.884 ( 8.295 0.285 2.207) 8.588 27.279 ( -12.566 -1.552 2.390) 12.885 27.279 ( -12.566 1.552 2.390) 12.885 27.614 ( -6.761 -7.420 8.057) 12.871 27.614 ( -6.761 7.420 8.057) 12.871 28.131 ( -12.279 -21.613 -6.777) 25.765 28.131 ( -12.279 21.613 -6.777) 25.765 28.920 ( 10.236 -5.141 -1.921) 11.614 28.920 ( 10.236 5.141 -1.921) 11.614 ======================= Grid point 155 (79/130) ======================= q-point: (-0.20 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.780 ( -13.411 -19.886 -2.855) 24.155 2.780 ( -13.411 19.886 -2.855) 24.155 3.174 ( -4.138 -22.404 2.511) 22.921 3.174 ( -4.138 22.404 2.511) 22.921 3.812 ( -8.479 -14.114 -3.959) 16.934 3.812 ( -8.479 14.114 -3.959) 16.934 4.275 ( -12.198 -11.016 2.588) 16.638 4.275 ( -12.198 11.016 2.588) 16.638 4.785 ( -15.067 -12.930 -0.959) 19.878 4.785 ( -15.067 12.930 -0.959) 19.878 5.256 ( -4.493 -6.096 9.448) 12.108 5.256 ( -4.493 6.096 9.448) 12.108 5.560 ( 8.709 -5.721 12.287) 16.111 5.560 ( 8.709 5.721 12.287) 16.111 6.004 ( -3.110 -2.009 -5.608) 6.720 6.004 ( -3.110 2.009 -5.608) 6.720 6.880 ( 2.902 -9.874 -6.684) 12.272 6.880 ( 2.902 9.874 -6.684) 12.272 7.158 ( 5.388 -6.995 -7.991) 11.908 7.158 ( 5.388 6.995 -7.991) 11.908 7.620 ( 7.971 -1.806 -1.855) 8.381 7.620 ( 7.971 1.806 -1.855) 8.381 7.739 ( -3.742 -1.214 2.416) 4.617 7.739 ( -3.742 1.214 2.416) 4.617 8.006 ( -5.190 -0.281 3.817) 6.448 8.006 ( -5.190 0.281 3.817) 6.448 8.334 ( -7.151 -4.499 1.163) 8.528 8.334 ( -7.151 4.499 1.163) 8.528 8.622 ( -5.892 -4.189 -1.669) 7.420 8.622 ( -5.892 4.189 -1.669) 7.420 8.784 ( 3.297 -4.278 3.243) 6.300 8.784 ( 3.297 4.278 3.243) 6.300 9.168 ( -0.658 -7.548 -0.111) 7.578 9.168 ( -0.658 7.548 -0.111) 7.578 9.318 ( -6.689 -2.367 0.610) 7.121 9.318 ( -6.689 2.367 0.610) 7.121 9.822 ( 0.609 -3.595 0.019) 3.646 9.822 ( 0.609 3.595 0.019) 3.646 10.262 ( 1.806 -3.743 -4.899) 6.424 10.262 ( 1.806 3.743 -4.899) 6.424 11.073 ( -0.860 -4.864 -2.859) 5.707 11.073 ( -0.860 4.864 -2.859) 5.707 11.347 ( 1.635 -1.597 -0.649) 2.376 11.347 ( 1.635 1.597 -0.649) 2.376 11.900 ( -9.060 -4.366 0.728) 10.083 11.900 ( -9.060 4.366 0.728) 10.083 12.163 ( -12.153 -2.564 2.422) 12.655 12.163 ( -12.153 2.564 2.422) 12.655 12.726 ( 0.837 -7.583 0.732) 7.664 12.726 ( 0.837 7.583 0.732) 7.664 13.531 ( 4.593 -5.144 2.317) 7.275 13.531 ( 4.593 5.144 2.317) 7.275 13.644 ( 4.058 -3.335 -1.003) 5.348 13.644 ( 4.059 3.335 -1.003) 5.348 14.120 ( 1.389 -4.745 0.283) 4.952 14.120 ( 1.389 4.745 0.283) 4.952 14.795 ( -7.586 -2.744 -0.895) 8.116 14.795 ( -7.586 2.744 -0.895) 8.116 15.508 ( 4.164 -0.550 -1.103) 4.343 15.508 ( 4.164 0.550 -1.103) 4.343 16.033 ( 6.518 -17.906 -2.821) 19.263 16.033 ( 6.518 17.906 -2.821) 19.263 16.484 ( 7.506 -2.819 6.618) 10.396 16.484 ( 7.506 2.819 6.618) 10.396 17.493 ( -2.982 -7.940 -1.643) 8.640 17.493 ( -2.982 7.940 -1.643) 8.640 18.314 ( 10.669 -2.913 -0.751) 11.085 18.314 ( 10.669 2.913 -0.751) 11.085 24.541 ( -1.350 -1.320 -0.444) 1.940 24.541 ( -1.350 1.320 -0.444) 1.940 24.903 ( 3.547 -2.643 0.116) 4.425 24.903 ( 3.547 2.643 0.116) 4.425 25.518 ( 5.066 -0.268 -2.560) 5.683 25.518 ( 5.066 0.268 -2.560) 5.683 26.030 ( 5.544 -1.038 1.167) 5.759 26.030 ( 5.544 1.038 1.167) 5.759 27.006 ( -16.312 -1.743 0.421) 16.411 27.006 ( -16.312 1.743 0.421) 16.411 27.568 ( -8.374 -9.758 7.838) 15.060 27.568 ( -8.374 9.758 7.838) 15.060 27.820 ( -12.103 -12.745 -5.594) 18.445 27.820 ( -12.103 12.745 -5.594) 18.445 29.107 ( 10.352 -2.097 -1.089) 10.619 29.107 ( 10.352 2.097 -1.089) 10.619 ======================= Grid point 157 (80/130) ======================= q-point: (-0.10 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.589 ( -5.792 -22.186 0.563) 22.937 2.589 ( -5.792 22.186 0.563) 22.937 3.106 ( -5.480 -24.142 3.151) 24.956 3.106 ( -5.480 24.142 3.151) 24.956 3.636 ( -6.553 -14.914 -3.552) 16.673 3.636 ( -6.553 14.914 -3.552) 16.673 4.046 ( -12.707 -19.060 2.310) 23.024 4.046 ( -12.707 19.060 2.310) 23.024 4.573 ( -5.318 -19.049 1.941) 19.872 4.573 ( -5.318 19.049 1.941) 19.872 5.208 ( -9.174 -6.229 13.463) 17.442 5.208 ( -9.174 6.229 13.463) 17.442 5.671 ( -3.227 -1.257 -2.529) 4.288 5.671 ( -3.227 1.257 -2.529) 4.288 6.076 ( 9.998 -10.364 3.354) 14.786 6.076 ( 9.998 10.364 3.354) 14.786 6.811 ( -1.005 -10.617 -9.830) 14.503 6.811 ( -1.005 10.617 -9.830) 14.503 7.203 ( 6.022 -2.452 -6.311) 9.062 7.203 ( 6.022 2.452 -6.311) 9.062 7.557 ( -9.130 -7.367 1.345) 11.809 7.557 ( -9.130 7.367 1.345) 11.809 7.788 ( 2.333 -2.110 -4.519) 5.506 7.788 ( 2.333 2.110 -4.519) 5.506 8.043 ( 7.433 -0.940 1.683) 7.679 8.043 ( 7.433 0.940 1.683) 7.679 8.257 ( -2.887 -2.236 3.288) 4.914 8.257 ( -2.887 2.236 3.288) 4.914 8.468 ( -6.190 -3.189 -3.378) 7.739 8.468 ( -6.190 3.189 -3.378) 7.739 8.866 ( -1.481 -2.384 5.726) 6.377 8.866 ( -1.481 2.384 5.726) 6.377 9.086 ( -4.216 -6.095 -3.414) 8.160 9.086 ( -4.216 6.095 -3.414) 8.160 9.275 ( 1.165 -0.958 0.062) 1.510 9.275 ( 1.165 0.958 0.062) 1.510 9.885 ( 2.928 -3.688 4.658) 6.623 9.885 ( 2.928 3.688 4.658) 6.623 10.270 ( 2.746 -5.336 -2.915) 6.672 10.270 ( 2.746 5.336 -2.915) 6.672 11.048 ( 0.311 -4.733 -1.194) 4.891 11.048 ( 0.311 4.733 -1.194) 4.891 11.339 ( -0.972 -5.157 -2.106) 5.655 11.339 ( -0.972 5.157 -2.106) 5.655 11.781 ( -3.763 -5.071 0.509) 6.335 11.781 ( -3.763 5.071 0.509) 6.335 11.971 ( -10.426 -5.106 2.544) 11.885 11.971 ( -10.426 5.106 2.544) 11.885 12.745 ( 0.702 -5.493 0.154) 5.540 12.745 ( 0.702 5.493 0.154) 5.540 13.607 ( 1.469 -3.235 2.790) 4.517 13.607 ( 1.469 3.235 2.790) 4.517 13.715 ( 3.696 -3.496 -0.831) 5.155 13.715 ( 3.696 3.496 -0.831) 5.155 14.124 ( -0.262 -4.052 -2.164) 4.602 14.124 ( -0.262 4.052 -2.164) 4.602 14.689 ( -3.656 -1.492 2.024) 4.437 14.689 ( -3.656 1.492 2.024) 4.437 15.568 ( 3.283 -0.697 -1.759) 3.789 15.568 ( 3.283 0.697 -1.759) 3.789 16.134 ( 5.093 -18.560 0.758) 19.261 16.134 ( 5.093 18.560 0.758) 19.261 16.634 ( 3.070 -2.135 3.273) 4.969 16.634 ( 3.070 2.135 3.273) 4.969 17.437 ( -1.242 -8.068 -1.303) 8.266 17.437 ( -1.242 8.068 -1.303) 8.266 18.485 ( 7.706 -5.546 -1.388) 9.595 18.485 ( 7.706 5.546 -1.388) 9.595 24.527 ( -0.023 -1.082 -0.231) 1.107 24.527 ( -0.023 1.082 -0.231) 1.107 24.951 ( 2.032 -2.339 -0.826) 3.206 24.951 ( 2.032 2.339 -0.826) 3.206 25.618 ( 6.699 -0.923 -1.587) 6.947 25.618 ( 6.699 0.923 -1.587) 6.947 26.099 ( 1.452 -2.087 -0.474) 2.586 26.099 ( 1.452 2.087 -0.474) 2.586 26.739 ( -11.421 -1.172 0.380) 11.487 26.739 ( -11.421 1.172 0.380) 11.487 27.306 ( -15.336 -9.217 -5.622) 18.755 27.306 ( -15.336 9.217 -5.622) 18.755 27.758 ( -0.086 -1.429 9.481) 9.589 27.758 ( -0.086 1.429 9.481) 9.589 29.257 ( 6.318 -1.104 -1.388) 6.562 29.257 ( 6.318 1.104 -1.388) 6.562 ======================= Grid point 189 (81/130) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.316 ( -2.516 0.000 27.357) 27.472 1.424 ( 8.518 0.000 26.774) 28.097 1.953 ( 8.065 0.000 -14.456) 16.554 2.141 ( -9.999 0.000 -24.145) 26.133 2.788 ( 1.738 0.000 56.521) 56.548 3.783 ( -6.939 0.000 -36.835) 37.483 4.275 ( -5.125 0.000 -0.280) 5.133 4.296 ( 4.993 0.000 -5.915) 7.741 4.757 ( 1.111 0.000 15.975) 16.014 4.961 ( 3.437 0.000 17.696) 18.027 5.058 ( -6.452 0.000 -13.288) 14.772 5.340 ( 3.652 0.000 -15.987) 16.399 5.486 ( -3.465 0.000 7.535) 8.294 5.637 ( 4.305 0.000 -8.768) 9.768 5.826 ( -10.717 0.000 19.914) 22.614 6.221 ( 7.403 0.000 -15.446) 17.128 6.474 ( 7.072 0.000 2.455) 7.486 6.561 ( -5.857 0.000 -3.105) 6.629 6.844 ( 8.042 0.000 -1.696) 8.219 6.883 ( -4.684 0.000 -4.303) 6.361 6.954 ( 6.359 0.000 5.551) 8.441 7.055 ( -8.326 0.000 -4.056) 9.261 7.663 ( 3.442 0.000 3.384) 4.827 7.689 ( -6.286 0.000 2.478) 6.757 7.749 ( -1.120 0.000 -5.849) 5.956 7.784 ( 6.184 0.000 -6.160) 8.728 7.983 ( -0.443 0.000 0.879) 0.985 8.010 ( -5.186 0.000 -1.949) 5.540 8.515 ( 1.328 0.000 5.769) 5.920 8.613 ( -1.088 0.000 -3.364) 3.536 8.789 ( 12.254 0.000 8.803) 15.088 8.804 ( -11.314 0.000 5.686) 12.663 9.174 ( -2.795 0.000 -5.761) 6.403 9.206 ( -2.809 0.000 -7.341) 7.860 9.679 ( 2.718 0.000 7.226) 7.721 9.776 ( -0.799 0.000 -2.761) 2.875 10.084 ( 3.260 0.000 9.034) 9.604 10.273 ( -5.857 0.000 -4.058) 7.125 10.333 ( 4.539 0.000 -0.775) 4.605 10.407 ( -6.291 0.000 -3.224) 7.069 10.803 ( 1.307 0.000 0.153) 1.316 10.812 ( 3.062 0.000 -0.856) 3.179 11.089 ( 2.457 0.000 5.105) 5.665 11.190 ( -4.282 0.000 -4.558) 6.254 11.429 ( 3.544 0.000 7.899) 8.657 11.654 ( -2.694 0.000 -13.244) 13.515 12.148 ( 1.396 0.000 2.403) 2.779 12.189 ( -0.526 0.000 -1.591) 1.676 13.099 ( 7.986 0.000 9.474) 12.391 13.270 ( -10.553 0.000 -7.027) 12.678 13.790 ( 6.576 0.000 3.719) 7.555 13.853 ( -5.337 0.000 -2.368) 5.839 14.059 ( 0.616 0.000 10.238) 10.257 14.249 ( 1.166 0.000 -7.929) 8.014 14.541 ( 6.795 0.000 3.039) 7.444 14.616 ( -11.567 0.000 -4.031) 12.249 14.868 ( -4.568 0.000 0.006) 4.568 14.906 ( 3.184 0.000 -3.716) 4.893 15.567 ( 4.827 0.000 5.799) 7.545 15.672 ( -4.111 0.000 -4.363) 5.995 16.024 ( -4.533 0.000 10.143) 11.109 16.205 ( 5.755 0.000 -7.728) 9.635 16.470 ( -0.531 0.000 11.036) 11.049 16.738 ( -1.016 0.000 -14.531) 14.566 17.411 ( 9.277 0.000 5.491) 10.780 17.522 ( -3.452 0.000 -5.248) 6.281 17.979 ( 2.603 0.000 3.450) 4.321 18.023 ( -1.736 0.000 -0.985) 1.996 24.372 ( -0.894 0.000 1.111) 1.426 24.404 ( 0.538 0.000 -2.005) 2.076 24.885 ( -0.784 0.000 1.604) 1.785 24.898 ( 0.700 0.000 0.713) 0.999 25.105 ( -3.835 0.000 6.522) 7.566 25.281 ( 4.705 0.000 -10.323) 11.345 25.910 ( 5.315 0.000 1.324) 5.478 25.927 ( -10.305 0.000 0.026) 10.305 26.570 ( -4.432 0.000 2.534) 5.105 26.621 ( 4.203 0.000 -2.405) 4.842 26.757 ( -1.394 0.000 3.696) 3.951 26.827 ( -0.803 0.000 -3.017) 3.122 28.353 ( 1.684 0.000 14.916) 15.011 28.685 ( -1.775 0.000 -17.354) 17.445 29.830 ( -4.676 0.000 7.138) 8.534 29.944 ( 11.366 0.000 -4.214) 12.122 ======================= Grid point 190 (82/130) ======================= q-point: ( 0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.665 ( 14.240 0.000 24.645) 28.463 1.796 ( 19.525 0.000 -14.877) 24.547 2.014 ( 16.891 0.000 -31.694) 35.914 2.328 ( 29.987 0.000 20.200) 36.156 3.445 ( 20.081 0.000 49.950) 53.836 3.506 ( 14.963 0.000 -39.214) 41.972 4.227 ( -0.216 0.000 -0.459) 0.507 4.362 ( 2.900 0.000 0.153) 2.904 4.786 ( -9.386 0.000 -12.875) 15.933 4.791 ( -12.914 0.000 17.599) 21.829 5.134 ( 0.942 0.000 14.679) 14.709 5.159 ( -3.359 0.000 -22.508) 22.757 5.553 ( 4.804 0.000 5.481) 7.289 5.721 ( 6.785 0.000 -5.863) 8.967 5.827 ( -7.428 0.000 20.869) 22.152 6.249 ( 9.073 0.000 -16.709) 19.014 6.439 ( -5.373 0.000 -2.203) 5.807 6.608 ( -1.712 0.000 2.250) 2.827 6.770 ( 4.179 0.000 -7.166) 8.296 6.809 ( -12.906 0.000 -4.029) 13.521 6.928 ( 4.126 0.000 -0.017) 4.126 7.035 ( -2.457 0.000 7.338) 7.739 7.687 ( 5.062 0.000 3.292) 6.038 7.755 ( 5.162 0.000 -5.039) 7.214 7.787 ( 5.119 0.000 0.105) 5.120 7.916 ( 8.738 0.000 2.683) 9.141 8.002 ( 4.700 0.000 -5.521) 7.251 8.041 ( 2.881 0.000 5.874) 6.542 8.420 ( -14.097 0.000 -0.980) 14.131 8.570 ( 1.435 0.000 6.043) 6.211 8.697 ( 0.537 0.000 -0.883) 1.033 8.989 ( 0.752 0.000 -6.299) 6.344 9.158 ( 3.148 0.000 11.731) 12.146 9.219 ( 4.634 0.000 -0.845) 4.711 9.696 ( -4.290 0.000 -7.310) 8.476 9.736 ( -0.732 0.000 3.404) 3.482 10.140 ( -2.029 0.000 -4.791) 5.203 10.179 ( -0.581 0.000 7.596) 7.619 10.347 ( -0.172 0.000 0.224) 0.282 10.482 ( 8.692 0.000 5.586) 10.332 10.817 ( 1.223 0.000 -1.745) 2.131 10.871 ( 5.263 0.000 -4.113) 6.680 11.089 ( -2.784 0.000 -3.649) 4.590 11.187 ( 1.675 0.000 4.435) 4.740 11.430 ( -7.350 0.000 -12.891) 14.839 11.468 ( -7.172 0.000 11.229) 13.324 12.236 ( 7.067 0.000 -1.788) 7.290 12.260 ( 8.247 0.000 0.614) 8.270 12.982 ( -13.392 0.000 -6.334) 14.815 13.255 ( -0.220 0.000 11.892) 11.894 13.712 ( -5.341 0.000 -3.795) 6.552 13.901 ( 2.782 0.000 2.234) 3.568 14.112 ( -3.898 0.000 7.571) 8.516 14.179 ( -2.063 0.000 -10.381) 10.584 14.463 ( -3.564 0.000 -0.808) 3.655 14.737 ( 5.961 0.000 2.961) 6.656 14.819 ( -1.052 0.000 2.125) 2.371 14.967 ( 7.918 0.000 3.203) 8.541 15.601 ( 1.310 0.000 -4.377) 4.569 15.733 ( 7.672 0.000 3.999) 8.651 16.000 ( -5.856 0.000 7.121) 9.220 16.230 ( 4.438 0.000 -9.048) 10.078 16.554 ( -2.137 0.000 11.120) 11.324 16.617 ( 0.277 0.000 -10.839) 10.843 17.328 ( -9.861 0.000 -10.754) 14.591 17.488 ( -2.729 0.000 3.419) 4.374 17.918 ( -7.183 0.000 -3.443) 7.966 17.971 ( -4.727 0.000 3.715) 6.012 24.366 ( -0.777 0.000 1.915) 2.066 24.401 ( 0.598 0.000 -1.619) 1.726 24.871 ( -1.774 0.000 1.308) 2.204 24.892 ( -1.687 0.000 -1.187) 2.063 25.084 ( -3.815 0.000 7.016) 7.986 25.271 ( 3.130 0.000 -9.133) 9.655 25.807 ( -4.585 0.000 2.581) 5.261 26.019 ( 1.606 0.000 3.129) 3.517 26.573 ( 2.371 0.000 1.997) 3.100 26.739 ( 9.864 0.000 -1.504) 9.978 26.884 ( 8.625 0.000 2.425) 8.959 26.940 ( 15.053 0.000 2.828) 15.316 28.471 ( -2.998 0.000 16.383) 16.655 28.482 ( -5.009 0.000 -16.632) 17.370 29.728 ( -8.945 0.000 1.679) 9.101 30.016 ( 4.194 0.000 -11.120) 11.885 ======================= Grid point 191 (83/130) ======================= q-point: ( 0.20 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.010 ( 13.315 0.000 -11.157) 17.371 2.060 ( 24.575 0.000 -17.150) 29.968 2.233 ( 22.864 0.000 0.200) 22.865 3.060 ( 22.165 0.000 30.648) 37.823 3.768 ( 39.770 0.000 -33.866) 52.236 4.184 ( 4.432 0.000 3.829) 5.857 4.284 ( 21.758 0.000 26.097) 33.977 4.357 ( -3.315 0.000 0.810) 3.413 4.535 ( -7.489 0.000 -8.505) 11.332 4.627 ( -14.982 0.000 14.497) 20.848 4.956 ( 1.729 0.000 -17.485) 17.570 5.217 ( -3.514 0.000 9.102) 9.756 5.668 ( -1.240 0.000 9.849) 9.927 5.717 ( -2.034 0.000 -6.578) 6.885 5.887 ( -1.526 0.000 14.988) 15.065 6.245 ( 2.832 0.000 -15.342) 15.602 6.293 ( -12.029 0.000 2.777) 12.345 6.402 ( -9.147 0.000 -11.434) 14.642 6.592 ( -4.318 0.000 -3.171) 5.357 6.959 ( 13.073 0.000 -4.131) 13.710 7.042 ( 7.070 0.000 1.436) 7.215 7.051 ( -0.194 0.000 8.010) 8.013 7.796 ( -0.584 0.000 -1.268) 1.396 7.796 ( 1.252 0.000 -1.717) 2.125 7.918 ( 12.920 0.000 -0.523) 12.930 7.958 ( -1.220 0.000 -7.603) 7.700 8.105 ( -2.548 0.000 8.135) 8.524 8.129 ( 6.463 0.000 9.566) 11.545 8.323 ( 4.042 0.000 -1.665) 4.372 8.723 ( 8.024 0.000 8.397) 11.614 8.737 ( 5.111 0.000 -3.559) 6.228 8.895 ( -2.271 0.000 -6.346) 6.740 9.281 ( -1.713 0.000 12.650) 12.765 9.315 ( 5.472 0.000 0.647) 5.510 9.505 ( -6.774 0.000 -10.520) 12.512 9.767 ( 2.153 0.000 4.884) 5.338 10.138 ( 2.458 0.000 0.052) 2.459 10.232 ( -0.326 0.000 7.552) 7.559 10.326 ( -2.764 0.000 0.324) 2.783 10.703 ( 8.500 0.000 5.516) 10.133 10.822 ( -0.511 0.000 -0.200) 0.549 10.937 ( 6.912 0.000 -7.828) 10.443 11.040 ( -0.756 0.000 0.703) 1.032 11.080 ( -5.246 0.000 -10.136) 11.414 11.342 ( -16.485 0.000 10.472) 19.530 11.366 ( 3.229 0.000 -0.584) 3.281 12.399 ( 10.846 0.000 -1.331) 10.927 12.412 ( 6.947 0.000 -1.579) 7.124 12.753 ( -5.065 0.000 -1.648) 5.326 13.309 ( -4.044 0.000 12.176) 12.830 13.620 ( -2.045 0.000 -2.367) 3.128 13.941 ( 0.774 0.000 -1.354) 1.559 13.983 ( -8.420 0.000 -11.287) 14.082 14.041 ( -9.473 0.000 8.548) 12.759 14.421 ( -1.486 0.000 -0.628) 1.613 14.700 ( -4.185 0.000 -6.050) 7.357 14.873 ( 4.127 0.000 2.417) 4.783 15.247 ( 9.924 0.000 8.807) 13.268 15.694 ( 9.378 0.000 2.434) 9.689 15.887 ( 6.309 0.000 0.903) 6.373 15.912 ( -6.628 0.000 1.078) 6.715 16.229 ( 4.233 0.000 -10.723) 11.528 16.468 ( -11.424 0.000 -3.244) 11.876 16.592 ( 4.231 0.000 -5.478) 6.922 17.109 ( -2.708 0.000 -5.082) 5.758 17.418 ( -7.470 0.000 4.473) 8.707 17.734 ( -8.182 0.000 -5.099) 9.641 17.893 ( -6.317 0.000 2.439) 6.771 24.383 ( 0.618 0.000 2.872) 2.937 24.397 ( 0.464 0.000 -1.647) 1.711 24.819 ( -4.108 0.000 -2.560) 4.841 24.842 ( -2.448 0.000 1.159) 2.708 25.087 ( -1.492 0.000 6.026) 6.208 25.257 ( 2.989 0.000 -7.988) 8.529 25.756 ( -3.991 0.000 2.713) 4.825 25.969 ( -7.365 0.000 -0.119) 7.366 26.677 ( 6.952 0.000 1.899) 7.206 26.944 ( 12.541 0.000 -0.791) 12.566 27.062 ( 7.933 0.000 2.531) 8.327 27.357 ( 18.063 0.000 12.484) 21.957 28.242 ( -7.046 0.000 -14.295) 15.938 28.497 ( -8.708 0.000 16.500) 18.657 29.604 ( -3.547 0.000 0.929) 3.667 29.971 ( 3.455 0.000 -14.902) 15.297 ======================= Grid point 192 (84/130) ======================= q-point: ( 0.30 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.251 ( 25.150 0.000 -9.737) 26.969 2.416 ( 24.926 0.000 -10.845) 27.183 2.665 ( 18.787 0.000 6.295) 19.814 3.581 ( 6.987 0.000 28.251) 29.103 3.893 ( -7.986 0.000 -13.511) 15.694 4.064 ( -12.343 0.000 4.967) 13.305 4.447 ( 0.476 0.000 5.699) 5.719 4.474 ( -6.125 0.000 8.331) 10.341 4.498 ( 22.193 0.000 -23.635) 32.421 4.961 ( 12.814 0.000 8.324) 15.281 5.030 ( 19.968 0.000 -4.390) 20.445 5.167 ( -1.695 0.000 11.282) 11.408 5.571 ( -4.693 0.000 -10.292) 11.311 5.651 ( -8.143 0.000 8.134) 11.510 5.999 ( 1.233 0.000 9.292) 9.374 6.028 ( -15.652 0.000 0.137) 15.652 6.040 ( -12.398 0.000 -6.914) 14.195 6.221 ( 3.775 0.000 -24.322) 24.613 6.642 ( 7.034 0.000 5.616) 9.001 7.084 ( 5.830 0.000 -0.473) 5.849 7.163 ( 3.889 0.000 0.084) 3.889 7.180 ( 5.056 0.000 2.511) 5.645 7.679 ( -7.535 0.000 1.508) 7.685 7.830 ( 1.206 0.000 -6.534) 6.645 7.946 ( 4.796 0.000 -3.146) 5.736 8.026 ( 4.438 0.000 -5.759) 7.271 8.224 ( 6.912 0.000 8.467) 10.930 8.236 ( 0.878 0.000 0.276) 0.920 8.424 ( 4.911 0.000 1.971) 5.292 8.795 ( -4.599 0.000 -2.815) 5.392 8.829 ( 7.117 0.000 -0.262) 7.122 8.919 ( 5.035 0.000 6.015) 7.844 9.324 ( -1.001 0.000 -7.524) 7.591 9.378 ( 1.835 0.000 12.883) 13.013 9.467 ( 5.902 0.000 4.494) 7.419 9.887 ( 4.111 0.000 7.414) 8.477 10.188 ( 0.938 0.000 3.055) 3.196 10.230 ( -3.949 0.000 0.498) 3.980 10.305 ( 0.012 0.000 3.041) 3.041 10.785 ( -5.129 0.000 -4.698) 6.956 10.797 ( 0.143 0.000 -0.298) 0.330 10.991 ( 3.895 0.000 -9.418) 10.191 11.001 ( 3.010 0.000 -7.479) 8.062 11.070 ( -13.085 0.000 11.916) 17.698 11.091 ( 2.902 0.000 3.406) 4.475 11.407 ( 1.007 0.000 -0.294) 1.049 12.494 ( 2.281 0.000 4.787) 5.302 12.579 ( 9.006 0.000 -1.518) 9.133 12.768 ( 4.692 0.000 -1.494) 4.924 13.294 ( -6.402 0.000 6.100) 8.842 13.589 ( -0.439 0.000 -0.147) 0.463 13.751 ( -6.596 0.000 -6.925) 9.563 13.851 ( -9.842 0.000 3.205) 10.351 13.980 ( -2.172 0.000 1.339) 2.551 14.385 ( -1.905 0.000 -0.326) 1.933 14.574 ( -1.936 0.000 -8.272) 8.496 14.971 ( 3.890 0.000 1.301) 4.102 15.423 ( 4.356 0.000 6.252) 7.620 15.593 ( -11.715 0.000 -14.627) 18.740 15.973 ( 3.599 0.000 -2.075) 4.154 16.092 ( 15.743 0.000 11.172) 19.304 16.215 ( 3.956 0.000 -11.936) 12.575 16.234 ( -7.246 0.000 -3.696) 8.134 16.677 ( 7.219 0.000 -0.875) 7.272 17.119 ( 1.457 0.000 4.509) 4.738 17.298 ( -9.018 0.000 4.071) 9.894 17.545 ( -7.272 0.000 -5.558) 9.153 17.777 ( -7.219 0.000 0.070) 7.219 24.394 ( 0.672 0.000 -1.379) 1.534 24.435 ( 1.995 0.000 3.545) 4.067 24.713 ( -4.391 0.000 -3.239) 5.457 24.799 ( -3.006 0.000 0.839) 3.121 25.129 ( 1.383 0.000 4.801) 4.996 25.260 ( 3.804 0.000 -6.449) 7.487 25.687 ( -5.455 0.000 1.575) 5.678 25.789 ( -10.476 0.000 -1.277) 10.553 26.850 ( 9.244 0.000 2.740) 9.642 27.161 ( 10.519 0.000 -0.512) 10.531 27.213 ( 5.382 0.000 4.272) 6.872 27.686 ( 8.433 0.000 6.391) 10.581 28.011 ( -6.548 0.000 -9.141) 11.244 28.416 ( -13.360 0.000 14.588) 19.782 29.626 ( 1.662 0.000 5.959) 6.186 29.931 ( 6.338 0.000 -16.597) 17.766 ======================= Grid point 193 (85/130) ======================= q-point: ( 0.40 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.762 ( 18.088 0.000 -4.924) 18.746 2.776 ( 30.764 0.000 2.629) 30.876 2.983 ( 12.302 0.000 -0.103) 12.302 3.642 ( -16.245 0.000 8.352) 18.267 3.660 ( -5.466 0.000 0.345) 5.476 3.997 ( -6.109 0.000 20.429) 21.323 4.459 ( -0.179 0.000 -1.207) 1.220 4.491 ( -4.141 0.000 -7.218) 8.322 4.586 ( 6.649 0.000 8.138) 10.509 4.864 ( -8.757 0.000 2.377) 9.074 5.392 ( 5.341 0.000 -17.063) 17.879 5.397 ( -0.716 0.000 13.343) 13.362 5.512 ( -11.454 0.000 -1.253) 11.523 5.568 ( 26.515 0.000 -9.505) 28.167 5.710 ( -12.707 0.000 -0.150) 12.708 5.784 ( -5.941 0.000 -6.786) 9.019 6.087 ( -1.305 0.000 4.376) 4.566 6.097 ( 3.723 0.000 -23.192) 23.489 6.868 ( 7.607 0.000 12.635) 14.748 7.182 ( -0.113 0.000 5.634) 5.635 7.192 ( 1.430 0.000 -1.110) 1.810 7.258 ( 7.623 0.000 -5.977) 9.687 7.556 ( -7.492 0.000 3.037) 8.084 7.738 ( -2.064 0.000 -10.911) 11.105 8.023 ( 2.708 0.000 -4.116) 4.927 8.078 ( 4.544 0.000 -5.575) 7.192 8.286 ( 8.659 0.000 -0.282) 8.663 8.387 ( 4.821 0.000 3.427) 5.915 8.511 ( 2.915 0.000 1.535) 3.295 8.650 ( -10.101 0.000 1.847) 10.269 9.016 ( 10.322 0.000 5.406) 11.652 9.061 ( 6.449 0.000 3.363) 7.274 9.299 ( 0.498 0.000 2.580) 2.628 9.505 ( 0.078 0.000 10.639) 10.639 9.603 ( 2.949 0.000 5.395) 6.149 9.979 ( -2.928 0.000 7.627) 8.170 10.164 ( -0.488 0.000 -4.558) 4.584 10.191 ( -3.839 0.000 -1.029) 3.974 10.341 ( 2.114 0.000 0.420) 2.155 10.447 ( -15.366 0.000 -5.764) 16.412 10.856 ( 5.826 0.000 -0.473) 5.845 10.984 ( 1.299 0.000 0.284) 1.330 11.010 ( 0.869 0.000 -0.976) 1.307 11.037 ( 0.062 0.000 -2.590) 2.591 11.231 ( 4.859 0.000 6.372) 8.013 11.401 ( -0.383 0.000 -1.625) 1.669 12.584 ( 0.668 0.000 9.048) 9.073 12.695 ( 4.944 0.000 -1.713) 5.233 12.823 ( 2.853 0.000 -2.927) 4.087 13.154 ( -8.291 0.000 -4.609) 9.486 13.600 ( 1.609 0.000 0.463) 1.674 13.669 ( -1.447 0.000 3.391) 3.687 13.706 ( -8.667 0.000 5.263) 10.140 13.938 ( -0.745 0.000 -4.945) 5.001 14.352 ( -1.581 0.000 0.626) 1.701 14.509 ( 2.189 0.000 -9.299) 9.553 15.025 ( 1.539 0.000 -0.121) 1.544 15.265 ( -8.770 0.000 -14.151) 16.649 15.555 ( 3.664 0.000 8.902) 9.627 15.995 ( 1.700 0.000 -4.853) 5.143 16.116 ( -5.125 0.000 1.991) 5.499 16.179 ( 2.960 0.000 -12.058) 12.416 16.487 ( 16.159 0.000 9.598) 18.794 16.819 ( 6.356 0.000 2.277) 6.751 17.156 ( -8.426 0.000 2.012) 8.663 17.167 ( -3.374 0.000 6.673) 7.477 17.403 ( -1.428 0.000 -5.207) 5.399 17.634 ( -7.028 0.000 -2.224) 7.372 24.406 ( 1.630 0.000 -0.638) 1.751 24.491 ( -0.109 0.000 2.639) 2.641 24.630 ( -0.828 0.000 -2.280) 2.426 24.745 ( -3.258 0.000 0.131) 3.260 25.214 ( 3.913 0.000 3.500) 5.250 25.297 ( 4.968 0.000 -4.691) 6.833 25.583 ( -5.923 0.000 -0.280) 5.930 25.587 ( -10.008 0.000 -0.191) 10.010 27.046 ( 8.538 0.000 3.798) 9.345 27.292 ( 3.540 0.000 -0.896) 3.652 27.333 ( 3.221 0.000 5.983) 6.795 27.729 ( -2.189 0.000 -9.204) 9.461 27.965 ( 6.031 0.000 2.495) 6.527 28.252 ( -14.981 0.000 11.168) 18.685 29.698 ( -1.509 0.000 8.719) 8.849 29.938 ( 8.332 0.000 -16.034) 18.070 ======================= Grid point 194 (86/130) ======================= q-point: (-0.50 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.923 ( -9.701 0.000 2.937) 10.135 2.977 ( 7.378 0.000 -1.357) 7.502 3.297 ( -27.607 0.000 9.049) 29.052 3.459 ( 29.170 0.000 -4.676) 29.542 3.791 ( 13.801 0.000 12.256) 18.457 3.923 ( -12.631 0.000 2.259) 12.831 4.329 ( -7.273 0.000 3.127) 7.916 4.451 ( 4.641 0.000 -8.206) 9.427 4.836 ( 10.649 0.000 9.854) 14.509 4.860 ( 0.047 0.000 11.332) 11.332 5.138 ( -19.313 0.000 -6.248) 20.299 5.317 ( 4.228 0.000 -19.642) 20.092 5.387 ( -4.814 0.000 9.555) 10.699 5.606 ( 2.689 0.000 -9.629) 9.997 5.645 ( -5.593 0.000 11.897) 13.147 5.976 ( 1.726 0.000 -12.063) 12.186 5.980 ( -11.193 0.000 -1.069) 11.244 6.035 ( 19.794 0.000 -14.299) 24.418 7.068 ( -0.469 0.000 16.214) 16.221 7.147 ( -6.315 0.000 3.415) 7.179 7.238 ( 4.563 0.000 -1.763) 4.892 7.381 ( 9.046 0.000 -8.181) 12.196 7.461 ( -4.084 0.000 2.996) 5.065 7.611 ( -0.224 0.000 -12.220) 12.222 8.000 ( -2.198 0.000 1.470) 2.645 8.077 ( 0.329 0.000 -5.696) 5.706 8.428 ( -5.500 0.000 1.096) 5.608 8.463 ( 5.975 0.000 -1.305) 6.116 8.498 ( -5.274 0.000 4.453) 6.903 8.578 ( 6.461 0.000 -2.658) 6.986 9.152 ( -1.285 0.000 1.245) 1.789 9.167 ( 0.294 0.000 1.170) 1.207 9.510 ( 14.448 0.000 18.496) 23.470 9.514 ( -9.090 0.000 10.562) 13.935 9.653 ( 0.240 0.000 1.388) 1.408 9.841 ( -7.155 0.000 -8.369) 11.010 10.049 ( -5.087 0.000 1.728) 5.373 10.149 ( 3.534 0.000 -7.054) 7.890 10.344 ( 0.106 0.000 0.929) 0.935 10.370 ( 1.094 0.000 -1.373) 1.756 10.952 ( -4.862 0.000 0.061) 4.862 10.966 ( 2.765 0.000 0.000) 2.765 11.001 ( 0.465 0.000 1.283) 1.365 11.042 ( 1.499 0.000 -1.774) 2.322 11.341 ( 3.211 0.000 2.220) 3.904 11.385 ( 0.417 0.000 -2.498) 2.533 12.647 ( -1.443 0.000 7.829) 7.961 12.735 ( 0.704 0.000 -1.810) 1.943 12.852 ( 1.944 0.000 1.956) 2.758 12.969 ( -5.692 0.000 -6.297) 8.488 13.626 ( -4.052 0.000 3.587) 5.411 13.656 ( 3.781 0.000 0.774) 3.859 13.711 ( 1.362 0.000 6.055) 6.206 13.879 ( 0.011 0.000 -7.735) 7.735 14.341 ( -0.831 0.000 2.256) 2.404 14.478 ( 2.993 0.000 -11.414) 11.800 15.038 ( 0.485 0.000 0.097) 0.495 15.074 ( -3.874 0.000 -4.213) 5.723 15.703 ( 3.375 0.000 10.833) 11.347 15.941 ( -0.875 0.000 -11.056) 11.091 16.051 ( -4.456 0.000 3.453) 5.637 16.155 ( 3.588 0.000 -7.678) 8.475 16.834 ( 14.386 0.000 4.715) 15.139 16.842 ( -8.431 0.000 1.612) 8.583 17.063 ( -10.328 0.000 3.868) 11.028 17.107 ( 4.011 0.000 1.757) 4.379 17.445 ( 6.318 0.000 0.000) 6.318 17.489 ( -5.493 0.000 -4.393) 7.034 24.449 ( 3.166 0.000 0.298) 3.180 24.453 ( -3.410 0.000 -0.139) 3.413 24.665 ( 3.773 0.000 0.567) 3.815 24.680 ( -3.430 0.000 -0.863) 3.536 25.287 ( -1.403 0.000 2.189) 2.601 25.347 ( 2.231 0.000 -3.550) 4.193 25.467 ( -0.581 0.000 1.643) 1.743 25.498 ( -0.560 0.000 -1.198) 1.322 27.205 ( 4.311 0.000 4.313) 6.099 27.271 ( -3.976 0.000 -2.447) 4.668 27.437 ( 2.560 0.000 7.139) 7.584 27.596 ( -3.646 0.000 -8.097) 8.880 28.063 ( -13.049 0.000 7.915) 15.262 28.166 ( 13.584 0.000 -0.619) 13.598 29.696 ( -6.689 0.000 9.899) 11.947 29.964 ( 7.509 0.000 -14.949) 16.729 ======================= Grid point 195 (87/130) ======================= q-point: (-0.40 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.659 ( -21.819 0.000 4.528) 22.284 2.740 ( -36.821 0.000 5.839) 37.281 3.012 ( -4.691 0.000 -1.499) 4.924 3.728 ( -3.181 0.000 -5.109) 6.019 3.734 ( 7.513 0.000 0.904) 7.567 4.201 ( 14.122 0.000 0.114) 14.122 4.382 ( -12.163 0.000 0.461) 12.172 4.412 ( 14.219 0.000 3.979) 14.766 4.742 ( -9.132 0.000 -5.608) 10.716 5.009 ( 2.744 0.000 -7.731) 8.204 5.084 ( 4.661 0.000 14.966) 15.675 5.335 ( 9.473 0.000 3.912) 10.248 5.366 ( -16.747 0.000 10.125) 19.570 5.598 ( -1.459 0.000 7.818) 7.953 5.694 ( 12.155 0.000 -10.472) 16.044 5.809 ( -2.750 0.000 4.098) 4.935 5.834 ( -3.731 0.000 -8.912) 9.661 6.214 ( 8.801 0.000 -10.220) 13.487 7.011 ( -9.964 0.000 -0.427) 9.973 7.068 ( -9.778 0.000 10.983) 14.705 7.306 ( 4.116 0.000 -3.141) 5.177 7.355 ( 1.158 0.000 -16.573) 16.613 7.514 ( 4.031 0.000 8.056) 9.009 7.625 ( 7.110 0.000 -3.270) 7.826 7.969 ( -4.320 0.000 4.604) 6.313 8.010 ( -3.701 0.000 -2.454) 4.441 8.290 ( -5.696 0.000 -1.174) 5.816 8.465 ( -1.966 0.000 -2.534) 3.207 8.473 ( -3.340 0.000 4.015) 5.222 8.689 ( 5.666 0.000 -1.903) 5.978 9.026 ( -14.544 0.000 2.717) 14.796 9.086 ( -4.674 0.000 -0.051) 4.675 9.402 ( -5.469 0.000 -2.101) 5.859 9.624 ( -2.352 0.000 0.720) 2.460 9.706 ( -3.805 0.000 -6.322) 7.379 10.003 ( 15.946 0.000 16.665) 23.065 10.055 ( 1.754 0.000 6.703) 6.929 10.140 ( 2.695 0.000 -8.078) 8.516 10.358 ( 1.959 0.000 -1.440) 2.431 10.384 ( 2.624 0.000 -0.306) 2.642 10.848 ( -5.496 0.000 -0.355) 5.508 10.892 ( -7.965 0.000 4.973) 9.390 11.007 ( -4.219 0.000 -0.634) 4.266 11.112 ( 9.199 0.000 -6.109) 11.042 11.354 ( -1.289 0.000 -4.186) 4.380 11.402 ( 2.993 0.000 -0.816) 3.102 12.644 ( -4.271 0.000 3.259) 5.372 12.685 ( -4.665 0.000 -0.883) 4.748 12.862 ( -1.383 0.000 -4.832) 5.026 12.969 ( 5.713 0.000 10.693) 12.123 13.599 ( -1.149 0.000 0.809) 1.405 13.741 ( 3.400 0.000 3.043) 4.563 13.817 ( 0.552 0.000 -8.537) 8.555 13.822 ( 6.930 0.000 3.327) 7.687 14.359 ( 0.054 0.000 4.040) 4.041 14.437 ( 2.054 0.000 -9.206) 9.433 15.024 ( -0.950 0.000 0.207) 0.973 15.073 ( 1.969 0.000 4.815) 5.203 15.799 ( -2.771 0.000 -14.399) 14.664 15.840 ( 1.762 0.000 10.181) 10.333 16.004 ( -4.269 0.000 4.905) 6.503 16.182 ( 4.202 0.000 -4.364) 6.058 16.612 ( -13.881 0.000 -3.564) 14.331 16.856 ( -10.171 0.000 -0.845) 10.206 17.130 ( 10.918 0.000 4.294) 11.732 17.248 ( 5.813 0.000 6.133) 8.450 17.363 ( -2.645 0.000 -7.654) 8.098 17.590 ( 8.020 0.000 1.807) 8.221 24.398 ( -2.346 0.000 0.198) 2.354 24.526 ( 4.655 0.000 0.148) 4.658 24.606 ( -3.429 0.000 -0.931) 3.553 24.742 ( 3.811 0.000 0.379) 3.830 25.212 ( -6.448 0.000 3.533) 7.352 25.298 ( -1.892 0.000 -4.686) 5.054 25.571 ( 7.592 0.000 0.704) 7.625 25.576 ( 7.292 0.000 0.862) 7.343 27.127 ( -8.242 0.000 -3.957) 9.142 27.247 ( -4.143 0.000 4.269) 5.949 27.461 ( -4.910 0.000 -6.149) 7.869 27.553 ( 3.549 0.000 7.531) 8.325 27.925 ( -7.116 0.000 5.724) 9.132 28.435 ( 17.321 0.000 -5.154) 18.072 29.631 ( -9.231 0.000 12.369) 15.434 29.953 ( 3.932 0.000 -15.202) 15.703 ======================= Grid point 196 (88/130) ======================= q-point: (-0.30 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.082 ( -36.735 0.000 6.441) 37.295 2.212 ( -30.706 0.000 8.476) 31.854 2.809 ( -12.712 0.000 -5.551) 13.871 3.649 ( -17.602 0.000 8.199) 19.417 3.878 ( 6.327 0.000 1.564) 6.517 4.115 ( -12.254 0.000 11.967) 17.128 4.211 ( -9.475 0.000 -11.183) 14.657 4.600 ( -1.444 0.000 -8.294) 8.419 4.685 ( 15.482 0.000 -9.219) 18.019 4.938 ( -24.248 0.000 3.812) 24.546 4.998 ( 2.047 0.000 0.248) 2.062 5.314 ( 3.101 0.000 17.438) 17.712 5.438 ( -8.313 0.000 -10.492) 13.386 5.671 ( 9.413 0.000 2.978) 9.872 5.814 ( 9.065 0.000 10.891) 14.170 5.889 ( 5.780 0.000 7.979) 9.852 6.047 ( 19.946 0.000 -1.421) 19.996 6.219 ( 2.589 0.000 -12.326) 12.595 6.767 ( -12.955 0.000 -5.005) 13.888 6.968 ( -7.863 0.000 7.427) 10.816 7.265 ( 0.993 0.000 -11.709) 11.751 7.306 ( -0.996 0.000 -6.044) 6.125 7.658 ( 2.092 0.000 9.260) 9.494 7.731 ( 6.140 0.000 -2.376) 6.583 7.918 ( -3.980 0.000 -0.784) 4.056 7.927 ( -2.781 0.000 4.257) 5.085 8.232 ( 0.708 0.000 -2.086) 2.203 8.385 ( -2.470 0.000 -5.550) 6.075 8.432 ( -5.066 0.000 3.949) 6.423 8.743 ( 0.306 0.000 2.113) 2.135 8.784 ( -13.391 0.000 4.367) 14.085 9.004 ( -3.124 0.000 -2.754) 4.165 9.281 ( -4.135 0.000 -2.798) 4.992 9.552 ( -7.112 0.000 -4.214) 8.266 9.579 ( -0.452 0.000 -5.202) 5.221 9.994 ( -6.912 0.000 -2.531) 7.360 10.181 ( 4.863 0.000 6.306) 7.964 10.268 ( 0.552 0.000 -4.449) 4.483 10.406 ( 5.505 0.000 -6.128) 8.237 10.590 ( 10.512 0.000 15.911) 19.070 10.779 ( -0.794 0.000 1.668) 1.848 10.797 ( -6.484 0.000 5.960) 8.807 10.905 ( -5.963 0.000 0.426) 5.978 11.178 ( 0.829 0.000 -7.125) 7.173 11.329 ( 9.366 0.000 -10.074) 13.755 11.429 ( 0.710 0.000 -1.659) 1.804 12.539 ( -8.914 0.000 1.823) 9.098 12.565 ( -7.566 0.000 -0.163) 7.568 12.805 ( -0.877 0.000 -5.343) 5.415 13.219 ( 9.987 0.000 12.045) 15.647 13.591 ( 0.326 0.000 -0.578) 0.664 13.767 ( 1.065 0.000 -6.967) 7.048 13.827 ( 2.597 0.000 4.120) 4.871 14.017 ( 11.760 0.000 -0.286) 11.763 14.416 ( 2.277 0.000 6.320) 6.718 14.416 ( 1.683 0.000 -4.475) 4.781 15.004 ( -1.348 0.000 -1.480) 2.002 15.226 ( 6.482 0.000 15.837) 17.112 15.623 ( -3.743 0.000 -12.939) 13.470 15.912 ( -1.227 0.000 5.094) 5.239 15.980 ( -4.130 0.000 9.390) 10.258 16.236 ( 4.553 0.000 -2.263) 5.084 16.288 ( -15.607 0.000 -8.545) 17.793 16.659 ( -10.559 0.000 1.089) 10.615 17.243 ( -3.688 0.000 -4.818) 6.068 17.337 ( 9.458 0.000 0.042) 9.458 17.426 ( 7.502 0.000 4.195) 8.595 17.757 ( 8.126 0.000 1.736) 8.309 24.371 ( -1.033 0.000 0.919) 1.383 24.515 ( -2.234 0.000 -4.057) 4.632 24.646 ( 4.940 0.000 3.106) 5.835 24.808 ( 3.061 0.000 -0.081) 3.062 25.140 ( -4.892 0.000 5.123) 7.083 25.240 ( 0.517 0.000 -5.981) 6.003 25.709 ( 6.778 0.000 -0.830) 6.829 25.741 ( 8.260 0.000 3.300) 8.894 26.923 ( -9.429 0.000 -4.215) 10.328 27.126 ( -11.467 0.000 3.394) 11.959 27.306 ( -7.256 0.000 -4.393) 8.482 27.669 ( 1.701 0.000 6.123) 6.355 27.906 ( 0.829 0.000 4.185) 4.266 28.694 ( 16.779 0.000 -11.538) 20.363 29.587 ( -6.975 0.000 16.023) 17.475 29.849 ( -1.600 0.000 -16.192) 16.271 ======================= Grid point 197 (89/130) ======================= q-point: (-0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.576 ( -27.222 0.000 19.367) 33.408 1.714 ( -31.959 0.000 15.788) 35.646 2.487 ( -14.269 0.000 -12.361) 18.878 3.066 ( -52.145 0.000 31.208) 60.770 3.581 ( -30.856 0.000 -20.651) 37.128 4.094 ( 1.634 0.000 8.278) 8.438 4.232 ( 7.892 0.000 8.842) 11.851 4.557 ( 4.007 0.000 -6.686) 7.795 4.662 ( -11.244 0.000 10.702) 15.523 4.818 ( -8.962 0.000 -21.121) 22.944 4.910 ( 13.330 0.000 -10.333) 16.866 5.331 ( 4.026 0.000 -4.071) 5.725 5.464 ( -3.513 0.000 19.634) 19.946 5.837 ( 4.395 0.000 -4.274) 6.131 5.931 ( -3.282 0.000 11.148) 11.621 6.166 ( 5.848 0.000 -12.460) 13.764 6.205 ( 16.669 0.000 8.268) 18.607 6.384 ( 14.205 0.000 -5.694) 15.304 6.526 ( -6.558 0.000 2.203) 6.918 6.884 ( -7.476 0.000 3.082) 8.087 7.152 ( -3.827 0.000 -9.874) 10.590 7.198 ( -2.249 0.000 -6.476) 6.855 7.710 ( -2.904 0.000 6.524) 7.142 7.814 ( 3.756 0.000 -1.874) 4.198 7.863 ( -1.670 0.000 1.279) 2.104 7.915 ( -3.095 0.000 -0.512) 3.137 8.263 ( 3.130 0.000 -1.131) 3.329 8.297 ( -11.260 0.000 -0.839) 11.292 8.324 ( 3.460 0.000 -9.952) 10.536 8.629 ( -7.835 0.000 7.373) 10.759 8.758 ( -0.961 0.000 4.754) 4.851 8.883 ( -7.702 0.000 -5.527) 9.480 9.273 ( 2.358 0.000 4.384) 4.977 9.423 ( -2.090 0.000 -3.375) 3.969 9.520 ( 0.928 0.000 -10.428) 10.469 9.855 ( -4.966 0.000 -2.886) 5.743 10.160 ( -6.768 0.000 -3.309) 7.534 10.294 ( 1.353 0.000 4.691) 4.882 10.412 ( 2.334 0.000 -8.941) 9.240 10.738 ( -6.268 0.000 11.835) 13.392 10.780 ( -0.118 0.000 -0.604) 0.616 10.812 ( -3.786 0.000 0.563) 3.828 10.910 ( 11.499 0.000 4.423) 12.320 11.094 ( -2.472 0.000 -4.281) 4.943 11.397 ( -2.471 0.000 -2.240) 3.335 11.531 ( 17.460 0.000 -8.437) 19.392 12.361 ( -11.279 0.000 2.046) 11.463 12.410 ( -8.358 0.000 -0.732) 8.390 12.755 ( 0.534 0.000 -2.886) 2.935 13.451 ( 6.511 0.000 1.284) 6.637 13.608 ( 1.207 0.000 0.025) 1.207 13.780 ( 3.788 0.000 3.902) 5.439 13.895 ( 1.346 0.000 2.951) 3.244 14.193 ( 8.763 0.000 -5.662) 10.433 14.423 ( 1.356 0.000 -1.300) 1.878 14.573 ( 8.236 0.000 7.149) 10.906 14.946 ( -1.827 0.000 -4.393) 4.757 15.409 ( -5.156 0.000 -6.427) 8.240 15.614 ( 8.334 0.000 15.524) 17.620 15.885 ( -3.954 0.000 1.195) 4.131 15.934 ( -8.990 0.000 -6.185) 10.912 15.992 ( -4.275 0.000 11.747) 12.501 16.343 ( 8.128 0.000 4.802) 9.441 16.503 ( -7.915 0.000 3.667) 8.723 17.134 ( -3.279 0.000 -5.759) 6.627 17.481 ( 6.941 0.000 -2.030) 7.231 17.606 ( 7.104 0.000 7.044) 10.004 17.907 ( 6.615 0.000 0.767) 6.659 24.369 ( -0.248 0.000 1.177) 1.203 24.450 ( -1.262 0.000 -3.487) 3.709 24.765 ( 4.982 0.000 2.563) 5.602 24.852 ( 1.741 0.000 0.055) 1.742 25.112 ( -3.182 0.000 6.033) 6.820 25.224 ( 3.661 0.000 -7.338) 8.200 25.798 ( 3.896 0.000 -1.670) 4.239 25.922 ( 7.258 0.000 4.594) 8.590 26.735 ( -6.954 0.000 -3.496) 7.783 26.910 ( -13.607 0.000 2.733) 13.879 27.123 ( -9.096 0.000 -2.868) 9.538 27.623 ( -9.048 0.000 -9.495) 13.116 28.013 ( 4.884 0.000 7.521) 8.968 28.835 ( 10.239 0.000 -16.405) 19.338 29.650 ( -0.835 0.000 16.592) 16.613 29.670 ( -3.580 0.000 -9.083) 9.763 ======================= Grid point 198 (90/130) ======================= q-point: (-0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.349 ( -23.168 0.000 24.915) 34.022 1.357 ( -21.248 0.000 30.965) 37.555 2.091 ( -12.911 0.000 -11.019) 16.974 2.591 ( -26.585 0.000 43.585) 51.053 2.767 ( -34.789 0.000 -19.331) 39.799 4.130 ( -4.521 0.000 -2.110) 4.989 4.362 ( -2.039 0.000 3.738) 4.258 4.394 ( -5.508 0.000 -31.768) 32.242 4.598 ( 3.489 0.000 4.526) 5.715 4.738 ( 4.720 0.000 15.952) 16.636 5.111 ( 13.451 0.000 -12.175) 18.143 5.341 ( 0.953 0.000 -5.515) 5.597 5.504 ( -7.460 0.000 16.391) 18.009 5.752 ( -3.490 0.000 -12.240) 12.728 5.897 ( -10.764 0.000 14.589) 18.130 6.214 ( 8.955 0.000 -16.994) 19.209 6.373 ( -0.588 0.000 3.805) 3.850 6.575 ( 14.682 0.000 6.534) 16.070 6.726 ( 12.897 0.000 3.656) 13.405 6.730 ( -6.344 0.000 -3.756) 7.372 7.003 ( -3.976 0.000 -7.153) 8.184 7.160 ( 0.531 0.000 -4.857) 4.886 7.663 ( -5.759 0.000 3.919) 6.966 7.778 ( -4.452 0.000 0.627) 4.496 7.811 ( -2.006 0.000 -6.962) 7.245 7.872 ( -3.457 0.000 -0.394) 3.479 8.056 ( -8.373 0.000 -3.162) 8.950 8.234 ( -7.173 0.000 -13.539) 15.322 8.370 ( 7.982 0.000 2.935) 8.505 8.612 ( -0.509 0.000 7.626) 7.643 8.665 ( -5.007 0.000 -3.617) 6.177 8.822 ( 0.050 0.000 8.039) 8.039 9.267 ( -2.194 0.000 -4.914) 5.382 9.413 ( -5.031 0.000 -11.424) 12.483 9.520 ( 6.572 0.000 8.788) 10.973 9.790 ( 0.428 0.000 -2.295) 2.334 10.029 ( -5.297 0.000 3.875) 6.563 10.300 ( -1.448 0.000 1.475) 2.067 10.382 ( 0.265 0.000 -7.015) 7.020 10.609 ( -10.414 0.000 -4.122) 11.200 10.771 ( -0.129 0.000 3.710) 3.713 10.781 ( 0.001 0.000 0.688) 0.688 11.047 ( -0.630 0.000 0.725) 0.960 11.204 ( 13.833 0.000 4.535) 14.558 11.309 ( -4.510 0.000 -2.691) 5.251 11.709 ( 8.012 0.000 -10.989) 13.600 12.191 ( -7.812 0.000 2.455) 8.189 12.265 ( -6.288 0.000 -0.318) 6.296 12.852 ( 9.019 0.000 5.916) 10.787 13.457 ( -2.761 0.000 -7.051) 7.572 13.650 ( 4.360 0.000 1.965) 4.783 13.914 ( -0.930 0.000 0.450) 1.033 13.940 ( 3.156 0.000 12.075) 12.481 14.261 ( 4.192 0.000 -6.398) 7.650 14.450 ( 2.512 0.000 0.149) 2.516 14.747 ( 4.046 0.000 0.770) 4.119 14.895 ( 1.216 0.000 -5.186) 5.327 15.121 ( -17.417 0.000 -10.971) 20.585 15.525 ( -6.163 0.000 2.683) 6.722 15.792 ( -5.527 0.000 -1.705) 5.784 16.011 ( -3.974 0.000 11.818) 12.469 16.116 ( 10.924 0.000 -3.776) 11.558 16.435 ( -3.924 0.000 7.070) 8.086 16.728 ( 19.747 0.000 1.279) 19.788 17.090 ( 5.224 0.000 8.203) 9.725 17.555 ( 2.947 0.000 -3.143) 4.308 17.809 ( 8.354 0.000 7.519) 11.239 18.006 ( 3.570 0.000 -0.126) 3.572 24.375 ( -0.287 0.000 0.984) 1.025 24.415 ( 0.149 0.000 -2.734) 2.738 24.857 ( 2.571 0.000 1.915) 3.206 24.877 ( 0.754 0.000 0.802) 1.101 25.111 ( -2.562 0.000 6.189) 6.698 25.253 ( 6.328 0.000 -9.242) 11.201 25.840 ( 2.605 0.000 -1.050) 2.809 26.047 ( 1.378 0.000 1.291) 1.888 26.624 ( -1.996 0.000 -2.868) 3.494 26.696 ( -10.997 0.000 2.652) 11.312 26.940 ( -7.688 0.000 -2.508) 8.087 27.105 ( -29.168 0.000 -15.664) 33.108 28.183 ( 4.284 0.000 12.262) 12.989 28.817 ( 3.075 0.000 -17.310) 17.581 29.706 ( 10.102 0.000 3.611) 10.727 29.781 ( 0.734 0.000 12.371) 12.393 ======================= Grid point 199 (91/130) ======================= q-point: ( 0.00 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.570 ( -1.843 20.204 25.336) 32.457 1.651 ( 9.647 20.464 24.761) 33.540 2.097 ( 4.538 13.405 -17.006) 22.125 2.223 ( -7.781 8.850 -21.971) 24.932 3.003 ( 1.550 19.517 46.534) 50.485 3.804 ( -6.013 1.656 -26.919) 27.632 4.211 ( 1.179 -6.732 0.835) 6.885 4.236 ( -0.240 -5.095 -4.353) 6.706 4.752 ( -2.070 -2.138 11.663) 12.036 4.896 ( -2.438 -2.206 4.653) 5.698 5.081 ( 0.959 -0.025 -1.429) 1.721 5.335 ( -0.060 -0.505 -14.637) 14.645 5.552 ( -1.543 6.181 5.411) 8.358 5.675 ( 2.802 3.109 -7.038) 8.188 5.868 ( -8.622 3.377 19.822) 21.878 6.306 ( 10.331 4.572 -21.421) 24.218 6.462 ( 4.322 1.305 4.948) 6.698 6.568 ( -4.557 1.647 -4.628) 6.701 6.868 ( 4.228 4.610 7.371) 9.668 6.931 ( 1.456 2.231 1.463) 3.039 7.031 ( -9.003 2.199 -2.531) 9.607 7.098 ( 4.448 9.098 -9.274) 13.732 7.640 ( 0.868 -0.936 3.097) 3.349 7.745 ( -0.844 0.403 -7.332) 7.391 7.787 ( -2.486 7.351 3.101) 8.356 7.845 ( 3.647 5.341 -2.805) 7.050 7.963 ( 0.253 -2.121 -0.471) 2.188 7.985 ( -4.175 -0.718 -2.667) 5.006 8.496 ( 0.267 -1.805 6.311) 6.569 8.595 ( 0.404 -1.852 -2.621) 3.235 8.799 ( 1.870 0.534 8.129) 8.358 8.820 ( -1.783 1.933 5.495) 6.092 9.099 ( -6.007 -6.548 -2.283) 9.175 9.178 ( -0.023 -3.382 -10.187) 10.734 9.577 ( 1.840 -8.810 10.724) 14.000 9.767 ( -0.503 -3.686 -7.346) 8.235 10.038 ( 0.655 -3.057 3.328) 4.566 10.083 ( -0.862 -9.165 -0.187) 9.208 10.370 ( -0.212 3.595 4.769) 5.976 10.502 ( -1.245 5.042 -6.896) 8.633 10.818 ( 0.258 -0.113 2.748) 2.763 10.828 ( 2.430 -1.786 2.235) 3.753 11.143 ( 2.230 2.620 4.598) 5.743 11.236 ( -2.366 -2.386 -3.070) 4.552 11.377 ( -1.575 -2.029 3.340) 4.214 11.434 ( 3.060 -1.011 -1.703) 3.645 12.084 ( 0.964 -5.392 2.502) 6.022 12.132 ( -0.581 -4.339 -2.197) 4.897 13.065 ( 6.394 -0.890 9.657) 11.616 13.252 ( -9.244 -1.481 -8.175) 12.428 13.907 ( -2.126 -1.246 1.837) 3.073 13.944 ( 3.298 3.467 -2.515) 5.405 14.058 ( 1.017 0.244 5.909) 6.001 14.193 ( 1.502 -5.659 -5.857) 8.282 14.525 ( -2.917 -9.503 4.594) 10.951 14.602 ( 5.528 -8.647 -1.559) 10.381 14.772 ( 0.003 -1.079 0.367) 1.140 14.914 ( -7.451 11.871 -11.836) 18.345 15.566 ( 3.635 0.195 6.181) 7.173 15.681 ( -3.896 0.757 -4.978) 6.367 15.881 ( -4.200 -10.223 11.270) 15.785 16.095 ( 4.982 -8.499 -9.628) 13.775 16.639 ( 0.380 10.099 10.346) 14.463 16.877 ( -2.727 8.783 -12.521) 15.536 17.275 ( 6.051 -7.438 7.553) 12.206 17.396 ( -0.851 -6.788 -4.285) 8.072 18.075 ( -0.078 9.056 7.798) 11.951 18.230 ( 0.889 12.241 -7.847) 14.567 24.397 ( -0.476 2.196 1.039) 2.476 24.426 ( 0.346 2.007 -1.777) 2.703 24.861 ( 0.207 -0.065 2.978) 2.986 24.930 ( -0.221 0.847 -3.360) 3.473 25.245 ( -1.364 11.897 2.034) 12.146 25.349 ( 3.434 6.060 -7.605) 10.313 25.926 ( 2.591 1.532 1.570) 3.395 25.951 ( -7.471 2.082 -0.690) 7.786 26.584 ( -4.345 1.325 2.714) 5.291 26.642 ( 4.825 1.841 -2.973) 5.959 26.766 ( -2.427 1.076 3.462) 4.362 26.839 ( -0.739 1.157 -3.346) 3.616 28.316 ( 1.116 -3.558 14.433) 14.907 28.624 ( -0.513 -6.252 -14.918) 16.183 29.711 ( 2.072 -14.138 5.377) 15.267 29.734 ( 2.731 -12.789 2.772) 13.368 ======================= Grid point 200 (92/130) ======================= q-point: ( 0.10 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.818 ( 9.300 15.358 13.486) 22.455 2.023 ( 15.778 16.945 -5.812) 23.871 2.141 ( 17.683 12.614 -29.257) 36.439 2.409 ( 29.790 8.046 18.084) 35.766 3.537 ( 14.774 8.991 19.315) 25.926 3.610 ( 15.328 8.977 -9.557) 20.171 4.190 ( 0.410 -4.089 -1.259) 4.298 4.306 ( 4.209 -5.481 -0.276) 6.916 4.723 ( -9.330 -2.435 7.082) 11.964 4.786 ( -8.486 -1.918 3.692) 9.451 5.116 ( -4.317 -1.224 -6.113) 7.583 5.231 ( 3.590 4.579 -1.011) 5.906 5.575 ( 1.830 1.919 1.547) 3.069 5.749 ( 3.686 2.419 3.662) 5.731 5.902 ( -3.187 6.053 12.066) 13.871 6.335 ( 10.162 7.652 -19.922) 23.637 6.382 ( -9.977 -3.357 -1.212) 10.596 6.602 ( 3.323 -3.817 0.188) 5.065 6.800 ( -9.030 9.731 -1.829) 13.400 6.905 ( -0.626 5.345 -5.809) 7.919 6.959 ( 0.590 3.287 5.412) 6.359 7.147 ( 2.499 9.059 0.941) 9.445 7.698 ( 5.505 1.096 1.995) 5.957 7.715 ( 1.761 -3.338 -3.904) 5.430 7.830 ( 1.377 3.128 -1.257) 3.642 7.917 ( 4.071 0.003 7.133) 8.213 7.995 ( 5.190 1.619 -2.008) 5.795 8.048 ( 8.110 0.241 -1.619) 8.273 8.462 ( -10.079 3.032 0.616) 10.543 8.553 ( 0.549 -0.759 4.607) 4.702 8.700 ( -0.094 0.130 -1.127) 1.138 8.982 ( 1.485 -1.059 -3.369) 3.831 9.086 ( 1.564 -5.481 7.739) 9.611 9.154 ( 1.978 -7.492 1.167) 7.835 9.613 ( -3.173 -5.645 -0.556) 6.499 9.732 ( 1.657 -3.141 -1.237) 3.761 10.021 ( -0.116 -5.045 1.045) 5.153 10.164 ( 4.662 -4.930 0.751) 6.826 10.348 ( -3.426 1.346 0.878) 3.785 10.524 ( 5.477 4.723 0.791) 7.276 10.833 ( 0.872 2.864 0.282) 3.008 10.909 ( 4.236 -4.593 -1.822) 6.508 11.054 ( -6.442 -0.959 -3.746) 7.513 11.280 ( -3.648 -11.297 1.170) 11.929 11.318 ( -0.754 10.651 2.490) 10.964 11.440 ( 0.830 4.473 -3.318) 5.631 12.154 ( 6.394 -5.988 -0.666) 8.785 12.230 ( 10.216 -3.203 -0.019) 10.706 12.991 ( -11.447 0.914 -6.430) 13.161 13.231 ( 1.480 -1.431 11.885) 12.062 13.796 ( -6.239 3.575 -0.899) 7.247 13.987 ( 0.753 -0.485 -2.320) 2.487 14.042 ( -4.807 -5.603 2.372) 7.754 14.198 ( 0.003 -4.831 -4.187) 6.393 14.476 ( -8.320 3.458 -1.986) 9.227 14.613 ( 3.934 -4.652 0.964) 6.168 14.697 ( -1.517 -12.197 -1.270) 12.357 15.029 ( 12.155 6.835 6.764) 15.499 15.577 ( -0.964 -0.658 -3.466) 3.657 15.688 ( 2.494 -2.551 4.557) 5.788 15.888 ( -4.027 -11.167 9.268) 15.060 16.112 ( 5.784 -6.988 -10.377) 13.783 16.676 ( -4.695 5.858 1.775) 7.714 16.802 ( 2.028 13.430 0.136) 13.583 17.228 ( -8.842 -7.195 -7.299) 13.536 17.359 ( -1.826 -5.262 0.745) 5.620 18.072 ( -5.784 8.871 5.667) 12.011 18.097 ( -7.376 10.952 -5.933) 14.476 24.392 ( -0.720 2.322 1.138) 2.684 24.425 ( 0.687 2.190 -1.115) 2.552 24.851 ( -2.777 -0.670 0.389) 2.883 24.903 ( -1.001 0.708 -0.362) 1.278 25.205 ( -3.862 9.958 2.922) 11.073 25.342 ( 1.974 6.396 -6.808) 9.547 25.828 ( -4.522 1.940 2.653) 5.591 26.034 ( 1.505 1.271 3.011) 3.598 26.589 ( 2.697 1.594 1.919) 3.674 26.769 ( 10.680 2.846 -2.165) 11.263 26.868 ( 8.850 -1.104 3.030) 9.419 26.960 ( 13.831 1.611 2.871) 14.218 28.392 ( -4.824 -5.869 4.876) 9.027 28.488 ( -1.657 -1.368 -5.682) 6.075 29.617 ( -7.381 -9.494 -1.533) 12.123 29.833 ( 3.945 -15.893 -4.947) 17.106 ======================= Grid point 201 (93/130) ======================= q-point: ( 0.20 0.12 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.075 ( 16.298 9.163 -8.596) 20.579 2.219 ( 19.345 12.962 -21.441) 31.654 2.390 ( 19.365 12.381 1.965) 23.068 3.111 ( 21.360 4.806 27.901) 35.465 3.832 ( 32.788 6.245 -25.594) 42.061 4.133 ( 8.172 -4.607 5.385) 10.816 4.200 ( 5.113 -4.722 7.551) 10.269 4.326 ( -0.353 -3.835 -1.603) 4.172 4.650 ( -5.909 3.497 2.868) 7.441 4.709 ( 1.761 11.950 18.098) 21.759 4.975 ( 1.327 1.043 -11.487) 11.610 5.273 ( -4.230 5.552 4.210) 8.151 5.634 ( 0.984 -0.744 4.371) 4.542 5.822 ( -0.101 -1.492 6.586) 6.754 5.895 ( -7.047 9.248 6.803) 13.471 6.165 ( -7.209 -5.289 -5.418) 10.455 6.343 ( -0.422 6.323 -11.563) 13.185 6.486 ( -8.895 0.836 -9.370) 12.947 6.639 ( -2.144 8.507 -1.927) 8.982 7.024 ( 3.448 3.148 1.682) 4.962 7.042 ( 13.802 5.517 -1.016) 14.899 7.193 ( 0.827 10.360 3.883) 11.095 7.690 ( -2.480 -6.833 -2.486) 7.682 7.808 ( 0.772 -1.016 -0.588) 1.405 7.864 ( 8.183 -1.457 -2.291) 8.621 8.067 ( 5.815 4.756 2.559) 7.936 8.126 ( 7.300 0.276 7.806) 10.691 8.134 ( -0.038 3.432 -0.014) 3.432 8.352 ( -0.319 2.945 0.691) 3.042 8.680 ( 5.519 -2.275 2.608) 6.514 8.739 ( 5.672 -1.930 0.396) 6.004 8.908 ( -1.670 0.731 -6.057) 6.326 9.171 ( -2.013 -8.658 10.150) 13.492 9.226 ( 5.043 -7.799 4.313) 10.240 9.554 ( -1.854 4.063 -5.815) 7.332 9.733 ( 0.033 -3.446 3.137) 4.660 10.066 ( 3.499 -4.899 -0.379) 6.032 10.220 ( -0.721 -2.425 3.767) 4.538 10.324 ( -0.291 -3.134 0.474) 3.183 10.648 ( 4.586 -0.686 2.722) 5.377 10.825 ( -4.169 -1.519 3.025) 5.370 10.910 ( 3.171 -7.170 -5.854) 9.785 11.003 ( 4.345 4.749 -6.466) 9.124 11.121 ( -11.733 -9.371 1.812) 15.124 11.293 ( -1.579 10.689 -3.966) 11.510 11.503 ( 5.538 11.584 0.903) 12.872 12.313 ( 10.436 -5.804 -0.533) 11.953 12.420 ( 8.370 -1.120 -1.348) 8.551 12.784 ( -4.693 2.874 -1.948) 5.838 13.311 ( -2.985 -0.156 11.977) 12.345 13.697 ( -4.198 2.924 -0.385) 5.131 13.874 ( -6.793 -5.480 -6.334) 10.784 14.012 ( -5.551 -3.318 5.950) 8.788 14.105 ( -3.375 0.181 -4.789) 5.862 14.287 ( -6.858 -0.918 -2.775) 7.455 14.634 ( -3.770 -11.380 -3.677) 12.539 14.773 ( 8.946 -3.993 1.781) 9.958 15.270 ( 5.817 -0.158 5.671) 8.125 15.634 ( 6.243 -4.663 1.395) 7.916 15.745 ( 1.989 -3.292 5.947) 7.083 15.884 ( -2.710 -12.086 5.480) 13.544 16.143 ( 6.268 -3.382 -10.204) 12.444 16.523 ( -11.065 1.515 -8.310) 13.920 16.798 ( -0.859 17.019 -5.441) 17.888 17.049 ( -3.132 -6.771 1.213) 7.558 17.305 ( -3.559 -2.655 0.660) 4.488 17.905 ( -8.611 10.569 -3.728) 14.134 17.980 ( -7.114 7.486 2.489) 10.623 24.395 ( 0.220 1.612 0.509) 1.704 24.435 ( 0.995 2.961 0.310) 3.139 24.786 ( -3.286 -1.003 -1.849) 3.902 24.872 ( -2.924 1.175 1.663) 3.563 25.175 ( -1.860 7.613 3.162) 8.451 25.314 ( 1.281 5.167 -6.707) 8.563 25.779 ( -3.928 2.156 2.785) 5.275 25.987 ( -7.026 1.605 0.212) 7.210 26.703 ( 7.593 2.427 1.789) 8.170 26.984 ( 13.176 3.751 -1.130) 13.746 27.062 ( 8.318 0.115 3.060) 8.864 27.350 ( 17.291 -0.633 12.121) 21.126 28.220 ( -6.379 -2.254 -12.141) 13.899 28.478 ( -6.594 -1.790 13.544) 15.170 29.488 ( -3.049 -10.034 -2.324) 10.742 29.826 ( 3.463 -13.335 -11.345) 17.847 ======================= Grid point 202 (94/130) ======================= q-point: ( 0.30 0.12 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.344 ( 24.252 8.798 -9.452) 27.476 2.511 ( 24.161 9.378 -11.050) 28.175 2.765 ( 16.868 8.381 4.655) 19.402 3.589 ( 5.984 0.444 24.975) 25.686 3.908 ( -8.453 1.089 -10.159) 13.261 4.054 ( -5.202 -1.079 0.411) 5.328 4.341 ( -5.336 -3.572 12.855) 14.370 4.430 ( 8.453 -1.387 -2.596) 8.950 4.721 ( 13.550 13.160 -11.723) 22.231 4.933 ( 5.544 -3.228 2.126) 6.759 5.047 ( 7.225 -0.635 -2.028) 7.531 5.297 ( 9.270 13.828 14.717) 22.220 5.619 ( -2.900 4.777 -5.519) 7.854 5.762 ( -10.496 7.957 8.346) 15.593 5.827 ( -6.525 -9.405 0.226) 11.449 6.008 ( -5.177 1.522 -8.350) 9.942 6.177 ( -5.901 4.896 -4.571) 8.927 6.268 ( -1.803 3.905 -15.062) 15.664 6.703 ( 5.474 6.127 5.440) 9.854 7.115 ( 6.555 2.438 -1.508) 7.154 7.203 ( 1.857 4.975 -0.497) 5.334 7.290 ( 7.328 9.089 2.211) 11.883 7.613 ( -3.952 -5.441 -0.124) 6.726 7.813 ( 0.528 -0.251 -2.974) 3.031 7.993 ( 8.668 -0.606 -4.242) 9.669 8.071 ( -0.439 7.965 -3.372) 8.660 8.202 ( 3.260 -0.296 2.554) 4.152 8.298 ( 4.898 3.595 5.865) 8.445 8.421 ( 4.168 -0.068 2.663) 4.946 8.720 ( -0.441 -4.787 -3.071) 5.705 8.834 ( 0.654 -5.708 5.305) 7.820 8.886 ( 3.923 1.121 -0.976) 4.195 9.291 ( 4.306 -2.888 8.024) 9.553 9.370 ( 4.794 -4.486 4.322) 7.861 9.464 ( 0.066 3.839 -0.087) 3.840 9.826 ( 3.632 -5.767 7.328) 10.008 10.114 ( 3.204 -4.081 -3.686) 6.364 10.231 ( -0.388 -3.953 3.905) 5.570 10.295 ( -4.055 -1.480 1.230) 4.488 10.675 ( -1.331 -8.128 1.614) 8.393 10.763 ( -13.341 -7.121 -8.316) 17.259 10.881 ( 1.859 -6.469 2.437) 7.159 10.982 ( 1.685 1.445 -0.101) 2.222 11.062 ( 4.540 5.071 -3.397) 7.607 11.283 ( 3.379 15.172 -1.861) 15.655 11.598 ( 3.182 13.879 0.920) 14.268 12.480 ( 0.117 -3.122 3.196) 4.470 12.499 ( 8.943 -3.757 -0.232) 9.703 12.812 ( 6.258 3.063 -2.391) 7.366 13.310 ( -5.808 0.973 6.110) 8.486 13.611 ( -5.561 -5.298 1.155) 7.767 13.690 ( -6.193 -0.694 -5.417) 8.257 13.899 ( -7.849 1.986 4.391) 9.210 14.067 ( -0.182 4.235 -1.747) 4.585 14.184 ( -2.456 -9.888 -2.070) 10.397 14.514 ( -3.853 -9.899 -7.132) 12.794 14.931 ( 6.103 -0.021 1.919) 6.398 15.377 ( 3.718 -5.390 3.118) 7.252 15.610 ( -5.839 -2.712 -1.886) 6.709 15.879 ( -1.493 -13.543 3.072) 13.967 15.990 ( 12.412 -6.926 6.316) 15.554 16.127 ( -3.069 4.259 -14.172) 15.113 16.227 ( -1.704 -4.791 -9.618) 10.879 16.794 ( 1.593 3.211 0.003) 3.584 17.038 ( -2.899 -2.629 5.432) 6.695 17.283 ( 0.993 4.403 1.580) 4.782 17.723 ( -8.333 10.690 -2.487) 13.780 17.857 ( -7.096 6.883 -0.216) 9.888 24.403 ( 0.753 1.349 -0.553) 1.641 24.475 ( 2.071 3.280 2.406) 4.565 24.703 ( -3.410 -0.236 -2.913) 4.491 24.825 ( -3.457 1.800 1.560) 4.199 25.188 ( 0.703 5.230 2.937) 6.039 25.297 ( 2.619 3.403 -5.592) 7.051 25.711 ( -5.480 2.238 1.648) 6.145 25.818 ( -10.059 2.577 -1.025) 10.435 26.887 ( 9.759 3.545 2.827) 10.761 27.208 ( 10.453 3.723 -0.041) 11.096 27.222 ( 6.084 1.758 3.977) 7.478 27.669 ( 8.200 -1.625 6.510) 10.595 28.010 ( -6.101 -0.064 -8.644) 10.580 28.425 ( -11.523 0.857 13.863) 18.047 29.492 ( 2.464 -12.321 2.735) 12.859 29.806 ( 6.064 -11.800 -14.486) 19.643 ======================= Grid point 203 (95/130) ======================= q-point: ( 0.40 0.12 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.846 ( 29.055 6.830 0.009) 29.847 2.866 ( 21.932 9.063 -4.441) 24.143 3.046 ( 10.002 5.934 0.839) 11.660 3.651 ( -13.001 0.887 7.696) 15.134 3.694 ( -7.343 2.802 2.137) 8.145 4.025 ( -5.208 2.559 14.999) 16.083 4.309 ( -1.285 -5.778 1.142) 6.028 4.602 ( -2.229 1.792 2.422) 3.748 4.607 ( -2.489 -0.275 0.312) 2.524 4.911 ( -1.708 6.956 1.371) 7.293 5.313 ( 4.696 -6.005 0.996) 7.688 5.486 ( 0.103 7.149 -6.502) 9.664 5.540 ( -12.247 0.259 -6.328) 13.788 5.595 ( 1.295 2.300 2.302) 3.503 5.763 ( 4.050 5.205 -1.066) 6.681 5.837 ( 1.206 8.393 -7.939) 11.616 6.089 ( 4.639 -0.291 -20.400) 20.923 6.170 ( -3.752 6.389 0.658) 7.438 6.892 ( 5.773 1.879 12.821) 14.186 7.234 ( 3.190 4.844 -0.194) 5.803 7.240 ( 7.499 2.412 -1.397) 8.001 7.363 ( -1.044 11.130 1.007) 11.224 7.549 ( -2.669 -1.064 0.085) 2.875 7.756 ( -1.832 1.874 -8.609) 8.999 8.035 ( 2.414 1.426 -2.864) 4.008 8.114 ( 1.981 4.404 -6.162) 7.829 8.301 ( 10.206 0.470 0.659) 10.238 8.417 ( 3.552 2.867 3.602) 5.815 8.502 ( 2.457 -0.607 1.545) 2.965 8.614 ( -8.956 -2.704 2.276) 9.628 8.950 ( 6.752 -7.247 4.524) 10.889 9.026 ( 8.565 -1.614 4.983) 10.040 9.298 ( -2.053 -1.236 1.020) 2.604 9.497 ( 0.224 -0.809 10.845) 10.877 9.578 ( 4.024 -1.340 5.483) 6.932 9.929 ( 0.351 -4.448 6.403) 7.804 10.114 ( -1.287 -4.790 -5.440) 7.362 10.172 ( -8.070 -4.142 -5.029) 10.372 10.283 ( 3.283 -4.349 0.774) 5.504 10.409 ( -9.841 -3.862 -4.618) 11.537 10.721 ( 3.057 -5.485 1.477) 6.450 10.900 ( -1.622 -4.291 -1.329) 4.776 11.037 ( 3.331 0.777 1.651) 3.799 11.129 ( 3.556 5.962 -1.405) 7.083 11.373 ( 5.956 14.877 1.401) 16.087 11.623 ( -0.634 15.896 -0.730) 15.926 12.524 ( -0.287 -5.277 8.042) 9.623 12.632 ( 5.413 -3.290 -0.790) 6.384 12.879 ( 3.061 3.019 -3.457) 5.517 13.176 ( -8.041 1.375 -5.267) 9.710 13.544 ( -4.408 -7.844 5.858) 10.737 13.597 ( -0.738 -2.298 -1.689) 2.946 13.832 ( -4.187 7.262 5.983) 10.299 14.033 ( 0.005 7.266 -5.644) 9.200 14.161 ( 0.077 -12.893 0.606) 12.907 14.393 ( -1.551 -11.530 -9.694) 15.143 15.036 ( 3.695 4.328 2.838) 6.359 15.414 ( -4.739 4.387 -6.693) 9.300 15.514 ( 1.874 -3.626 4.898) 6.377 15.880 ( -2.304 -15.597 3.533) 16.157 15.906 ( -3.559 -7.107 -8.886) 11.922 16.135 ( 3.391 -6.594 -10.493) 12.848 16.353 ( 11.909 -8.078 4.991) 15.231 16.763 ( -7.215 -14.009 3.008) 16.042 17.092 ( 5.550 10.724 4.306) 12.820 17.347 ( 1.752 7.883 4.628) 9.307 17.558 ( -6.418 10.513 -3.162) 12.717 17.717 ( -6.528 7.111 -2.649) 10.010 24.421 ( 1.587 1.620 -0.123) 2.271 24.524 ( -0.337 3.059 1.912) 3.623 24.637 ( 0.135 0.763 -2.197) 2.330 24.768 ( -3.645 1.926 0.515) 4.155 25.250 ( 3.479 3.242 2.349) 5.304 25.327 ( 4.564 2.691 -3.605) 6.408 25.606 ( -6.153 2.190 -0.127) 6.532 25.622 ( -9.630 3.228 -0.515) 10.170 27.091 ( 8.718 4.327 4.087) 10.556 27.341 ( 2.881 2.489 3.678) 5.294 27.349 ( 3.893 3.698 1.687) 5.628 27.733 ( -0.968 0.645 -8.616) 8.694 27.953 ( 5.136 -1.135 2.713) 5.919 28.277 ( -14.220 2.432 9.960) 17.530 29.567 ( 0.030 -12.422 6.914) 14.216 29.816 ( 7.560 -11.567 -14.776) 20.231 ======================= Grid point 204 (96/130) ======================= q-point: (-0.50 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.014 ( -10.435 8.323 4.096) 13.962 3.099 ( 8.947 11.025 -3.459) 14.613 3.332 ( -26.862 3.425 9.327) 28.641 3.489 ( 28.012 2.866 -4.274) 28.481 3.785 ( 11.574 -0.368 11.831) 16.555 3.933 ( -11.965 0.792 0.156) 11.993 4.310 ( -3.517 -2.338 2.651) 4.986 4.406 ( 2.964 -4.251 -6.685) 8.458 4.847 ( 8.529 2.272 10.588) 13.785 4.932 ( -0.760 6.435 7.402) 9.837 5.173 ( -15.365 1.366 -4.960) 16.204 5.270 ( -3.124 -5.257 -1.329) 6.258 5.481 ( 2.193 8.271 -5.554) 10.201 5.592 ( 1.087 0.347 -6.560) 6.658 5.692 ( -2.966 5.687 6.218) 8.933 5.993 ( 1.729 3.369 -16.684) 17.108 6.044 ( -4.717 5.151 -0.904) 7.043 6.096 ( 10.608 4.736 -7.073) 13.601 7.061 ( -2.007 -0.828 16.021) 16.167 7.258 ( -5.846 8.458 1.680) 10.418 7.345 ( 3.798 4.498 0.226) 5.891 7.358 ( 5.986 4.729 -3.386) 8.347 7.527 ( 1.849 5.063 -3.121) 6.228 7.638 ( -0.762 2.377 -10.704) 10.991 8.028 ( -2.242 3.259 0.560) 3.996 8.077 ( -0.292 0.894 -3.838) 3.952 8.444 ( -6.959 -3.066 4.645) 8.911 8.466 ( -1.819 3.156 0.947) 3.764 8.519 ( 4.374 3.767 -0.617) 5.805 8.554 ( 6.461 -2.240 -3.320) 7.602 9.095 ( 3.136 -5.375 2.874) 6.855 9.126 ( -3.137 -3.937 0.119) 5.035 9.443 ( 11.514 -6.313 16.062) 20.746 9.483 ( -10.391 -2.891 10.333) 14.937 9.643 ( -0.052 -0.671 1.875) 1.992 9.836 ( -5.028 -0.650 -10.920) 12.039 9.986 ( -3.469 -5.563 4.130) 7.748 10.115 ( 3.792 -3.260 -7.784) 9.252 10.332 ( 1.554 -1.767 -0.232) 2.364 10.340 ( -0.275 -2.727 -0.835) 2.865 10.789 ( -0.265 -5.929 2.429) 6.412 10.849 ( 1.092 -5.285 -2.994) 6.171 11.093 ( -0.840 4.003 2.774) 4.942 11.144 ( 0.159 3.948 -1.697) 4.300 11.506 ( 5.968 14.909 2.442) 16.244 11.566 ( -3.306 14.810 -3.468) 15.565 12.587 ( -0.409 -4.946 8.192) 9.578 12.682 ( 1.024 -3.248 -1.587) 3.757 12.902 ( 1.867 2.551 0.810) 3.264 12.981 ( -6.923 0.998 -6.136) 9.305 13.533 ( -1.662 -6.422 5.173) 8.412 13.614 ( 3.592 -4.592 -2.373) 6.294 13.829 ( -2.094 7.840 6.988) 10.709 13.993 ( 1.773 8.027 -7.707) 11.268 14.178 ( -0.255 -11.416 3.006) 11.808 14.308 ( 1.563 -12.739 -10.475) 16.567 15.130 ( 3.376 8.740 4.799) 10.527 15.245 ( -5.772 9.935 -6.234) 13.072 15.635 ( 4.135 -7.854 6.941) 11.268 15.766 ( -4.168 -15.058 -5.172) 16.458 15.900 ( -1.768 -11.054 4.933) 12.233 16.087 ( 2.485 -6.676 -12.020) 13.972 16.587 ( 0.705 -14.150 3.558) 14.607 16.632 ( 1.470 -14.879 -0.785) 14.972 17.251 ( -0.143 12.866 8.059) 15.182 17.324 ( -2.225 12.207 1.206) 12.467 17.531 ( 4.887 6.965 -0.402) 8.517 17.582 ( -3.748 7.853 -5.314) 10.196 24.462 ( 1.494 1.727 1.019) 2.501 24.483 ( -1.794 2.501 -0.957) 3.224 24.686 ( 3.518 1.600 0.591) 3.909 24.699 ( -3.168 1.779 -0.704) 3.701 25.324 ( 0.130 3.292 1.753) 3.733 25.376 ( 1.233 2.609 -3.222) 4.325 25.495 ( -1.070 2.594 1.509) 3.186 25.523 ( -0.475 2.334 -1.103) 2.625 27.253 ( 3.721 4.582 4.713) 7.554 27.325 ( -3.101 4.973 -2.547) 6.390 27.449 ( 2.148 1.328 7.366) 7.787 27.610 ( -3.727 1.649 -7.905) 8.894 28.073 ( -11.674 0.893 7.205) 13.748 28.166 ( 12.352 0.163 -0.528) 12.365 29.582 ( -5.325 -10.902 8.916) 15.057 29.831 ( 6.097 -12.702 -14.131) 19.954 ======================= Grid point 205 (97/130) ======================= q-point: (-0.40 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.722 ( -25.310 5.815 6.572) 26.788 2.815 ( -33.458 6.972 4.016) 34.412 3.114 ( -4.782 9.701 -3.322) 11.314 3.718 ( 1.225 0.688 -1.528) 2.076 3.775 ( 2.790 1.865 -0.890) 3.472 4.166 ( 12.135 -2.683 0.338) 12.433 4.336 ( 4.532 0.134 -2.122) 5.006 4.497 ( 7.859 -0.038 3.171) 8.475 4.766 ( -10.989 3.744 -4.938) 12.616 4.965 ( -1.150 0.494 -0.247) 1.275 5.177 ( 1.329 3.709 14.125) 14.665 5.327 ( 6.751 -4.894 9.962) 12.991 5.405 ( -4.297 7.731 -4.431) 9.893 5.648 ( -4.551 4.537 4.735) 7.982 5.732 ( 11.633 0.050 0.815) 11.662 5.842 ( -4.763 7.328 -0.557) 8.757 5.889 ( -2.904 6.154 -11.653) 13.495 6.238 ( 8.004 2.650 -6.966) 10.937 7.057 ( -8.632 -1.008 10.973) 13.997 7.099 ( -10.392 7.676 -1.832) 13.049 7.342 ( -0.305 1.279 -12.205) 12.276 7.428 ( 3.202 8.389 0.348) 8.986 7.563 ( 2.190 3.353 0.757) 4.076 7.651 ( 7.903 2.665 -3.389) 9.002 7.980 ( -4.085 1.713 3.140) 5.429 8.039 ( -2.447 3.462 0.074) 4.240 8.301 ( -7.343 0.069 0.731) 7.380 8.457 ( -1.820 1.578 1.517) 2.847 8.516 ( -1.312 2.641 -1.811) 3.461 8.658 ( 4.091 -2.455 -1.999) 5.173 8.997 ( -8.901 -3.927 -0.087) 9.729 9.056 ( -7.948 -1.857 0.555) 8.181 9.355 ( -3.542 -4.327 -0.062) 5.592 9.611 ( -3.289 -1.079 0.695) 3.531 9.705 ( -3.829 0.026 -6.932) 7.919 9.862 ( 10.468 -10.707 16.712) 22.439 9.990 ( 0.826 -7.918 3.836) 8.837 10.138 ( 4.167 -2.332 -5.186) 7.049 10.318 ( 0.282 -2.774 -1.950) 3.402 10.369 ( 4.433 -1.655 -0.893) 4.816 10.737 ( -3.146 -3.109 -0.014) 4.423 10.908 ( 4.175 -7.531 -1.847) 8.807 11.034 ( -5.950 5.624 2.719) 8.627 11.121 ( -2.369 5.253 -2.241) 6.183 11.447 ( -4.846 11.109 -4.854) 13.056 11.617 ( 3.659 14.572 0.416) 15.030 12.602 ( -3.804 -3.130 1.795) 5.243 12.649 ( -2.891 -3.914 -1.814) 5.194 12.846 ( -4.095 -0.082 -1.034) 4.225 13.004 ( 5.432 2.131 9.070) 10.785 13.563 ( 1.745 -4.013 2.182) 4.890 13.674 ( 5.850 -6.270 -5.396) 10.131 13.857 ( -0.959 4.763 6.595) 8.192 13.989 ( 4.477 9.149 -6.057) 11.851 14.183 ( -0.840 -11.108 0.860) 11.173 14.304 ( 4.675 -10.060 -4.320) 11.905 15.104 ( -5.131 7.073 -3.498) 9.412 15.248 ( 3.948 11.412 7.440) 14.184 15.643 ( -4.139 -13.886 -6.026) 15.693 15.763 ( 3.464 -9.064 6.412) 11.631 15.884 ( -4.494 -9.650 5.602) 12.029 16.062 ( 3.402 -9.682 -7.536) 12.732 16.427 ( -8.975 -9.991 -2.780) 13.715 16.817 ( 9.348 -14.507 -1.822) 17.354 17.103 ( -10.465 11.674 3.118) 15.984 17.424 ( -3.524 8.216 2.958) 9.416 17.512 ( 7.752 11.917 -3.879) 14.737 17.675 ( 8.059 7.075 1.187) 10.790 24.420 ( -2.328 2.228 -0.072) 3.223 24.544 ( 4.503 1.783 0.737) 4.899 24.618 ( -3.902 1.222 -1.064) 4.225 24.770 ( 4.274 2.180 0.285) 4.806 25.259 ( -5.594 4.270 2.227) 7.381 25.323 ( -2.044 2.287 -4.016) 5.054 25.594 ( 7.782 2.287 1.010) 8.174 25.606 ( 7.220 2.669 0.892) 7.749 27.171 ( -8.464 4.304 -3.453) 10.103 27.309 ( -4.067 6.051 3.777) 8.211 27.469 ( -4.986 0.940 -5.813) 7.716 27.558 ( 2.568 0.526 7.516) 7.960 27.927 ( -7.138 0.181 4.800) 8.603 28.440 ( 17.313 0.501 -4.411) 17.873 29.531 ( -8.259 -9.665 11.217) 16.954 29.793 ( 1.535 -15.029 -13.943) 20.558 ======================= Grid point 206 (98/130) ======================= q-point: (-0.30 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.169 ( -34.988 8.394 7.422) 36.738 2.296 ( -29.041 8.235 7.934) 31.211 2.906 ( -11.870 8.991 -6.350) 16.188 3.712 ( -7.499 4.101 5.415) 10.118 3.875 ( 5.006 -0.672 2.595) 5.679 4.111 ( -15.297 -2.612 -8.055) 17.485 4.247 ( -8.973 6.742 7.637) 13.575 4.620 ( -6.609 1.535 -7.488) 10.105 4.698 ( 10.541 0.289 -6.429) 12.350 4.932 ( -13.774 0.546 0.374) 13.790 4.991 ( -0.353 -0.533 2.773) 2.846 5.417 ( 0.417 8.299 16.047) 18.071 5.543 ( -5.392 8.286 -3.506) 10.489 5.714 ( 4.077 1.574 2.644) 5.108 5.767 ( 10.985 -4.559 6.603) 13.603 5.901 ( 7.151 7.820 3.479) 11.153 6.034 ( 16.684 -2.906 -2.633) 17.138 6.288 ( 4.108 6.683 -7.756) 11.032 6.849 ( -12.072 7.760 -5.716) 15.447 6.993 ( -5.357 2.025 7.382) 9.343 7.267 ( 1.800 1.276 -8.801) 9.074 7.401 ( -3.860 7.424 -6.293) 10.470 7.611 ( 1.155 -2.666 2.644) 3.929 7.762 ( 3.442 1.864 1.156) 4.081 7.937 ( -3.434 2.157 1.485) 4.319 7.992 ( -2.254 5.311 2.109) 6.143 8.221 ( -0.631 -1.352 -0.308) 1.524 8.421 ( -2.125 4.004 -3.435) 5.687 8.458 ( -4.536 2.308 0.245) 5.095 8.658 ( -4.042 -4.932 3.147) 7.111 8.842 ( -7.082 2.277 2.253) 7.773 8.935 ( -2.865 -5.417 -3.788) 7.204 9.308 ( -1.492 0.920 -0.734) 1.900 9.517 ( -7.632 -1.633 -4.180) 8.854 9.561 ( -1.991 -1.971 -6.502) 7.080 9.957 ( -3.813 -5.997 -4.494) 8.408 10.009 ( -1.815 -8.201 7.344) 11.158 10.234 ( 2.510 -15.063 6.339) 16.534 10.336 ( 1.952 0.124 -1.657) 2.564 10.561 ( 12.693 -5.550 4.184) 14.471 10.714 ( 1.833 -1.205 -0.768) 2.324 10.935 ( -0.310 -6.509 -1.295) 6.644 10.950 ( -6.480 5.892 4.703) 9.941 11.030 ( -2.303 2.243 -5.151) 6.072 11.325 ( -3.859 10.250 -4.341) 11.782 11.636 ( -1.072 11.907 -2.264) 12.168 12.484 ( -8.716 -4.029 -0.046) 9.602 12.550 ( -6.469 -2.360 -0.736) 6.925 12.782 ( -2.826 -0.097 -0.311) 2.844 13.238 ( 9.553 0.884 11.145) 14.705 13.630 ( 4.061 -0.931 0.362) 4.181 13.727 ( 5.795 -4.759 -8.389) 11.252 13.906 ( 1.771 3.768 4.697) 6.277 14.064 ( 6.221 2.791 -2.693) 7.331 14.186 ( 2.408 -10.736 -1.657) 11.127 14.399 ( 6.089 -5.311 2.707) 8.521 14.985 ( -5.385 1.472 -2.813) 6.251 15.392 ( 2.983 5.022 6.694) 8.884 15.539 ( -0.994 -4.356 -1.081) 4.597 15.846 ( -4.116 -11.300 6.992) 13.911 15.874 ( 2.203 -5.095 8.617) 10.250 16.063 ( 0.498 -12.835 -4.739) 13.691 16.234 ( -6.387 -0.613 -7.535) 9.897 16.811 ( -7.275 6.878 -1.126) 10.075 17.094 ( 6.593 -8.739 1.404) 11.037 17.330 ( -3.890 7.332 -3.513) 9.013 17.669 ( 7.561 12.361 2.226) 14.660 17.841 ( 8.618 7.026 1.098) 11.174 24.391 ( -1.079 1.948 0.554) 2.295 24.534 ( -2.825 1.643 -2.756) 4.274 24.647 ( 4.599 0.737 2.145) 5.128 24.846 ( 3.909 2.580 -0.424) 4.702 25.199 ( -3.408 5.337 3.878) 7.426 25.269 ( 0.557 2.735 -4.985) 5.714 25.733 ( 6.652 2.290 -0.770) 7.078 25.774 ( 8.446 2.994 3.181) 9.509 26.961 ( -10.080 3.674 -4.215) 11.527 27.178 ( -12.275 4.914 3.259) 13.618 27.315 ( -7.184 1.028 -4.377) 8.475 27.660 ( 1.365 -0.807 5.749) 5.963 27.906 ( 0.691 -0.128 4.146) 4.205 28.696 ( 15.811 0.273 -11.355) 19.468 29.486 ( -6.821 -10.489 13.535) 18.432 29.654 ( -4.716 -16.822 -11.770) 21.066 ======================= Grid point 207 (99/130) ======================= q-point: (-0.20 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.695 ( -25.830 11.334 18.783) 33.888 1.853 ( -27.635 13.687 15.015) 34.300 2.610 ( -11.788 10.496 -11.497) 19.527 3.282 ( -45.378 19.501 23.645) 54.759 3.600 ( -27.026 1.337 -18.641) 32.858 4.036 ( 2.483 -6.021 8.187) 10.461 4.189 ( -4.039 -3.721 6.915) 8.831 4.431 ( -0.394 -6.593 -8.257) 10.574 4.649 ( -7.900 0.389 7.457) 10.870 4.903 ( 7.158 0.884 -8.391) 11.065 5.070 ( 3.220 13.061 -10.607) 17.131 5.371 ( 0.818 5.265 -6.131) 8.123 5.517 ( -4.557 4.662 17.545) 18.717 5.823 ( -1.643 -1.990 4.294) 5.010 5.997 ( 5.274 0.568 3.923) 6.597 6.076 ( 10.302 1.817 -4.478) 11.379 6.310 ( 13.128 -6.482 -2.743) 14.896 6.337 ( 9.044 8.477 -0.807) 12.422 6.625 ( -6.872 10.269 -0.136) 12.357 6.972 ( -3.049 6.630 1.994) 7.565 7.166 ( -4.183 1.552 -9.744) 10.716 7.291 ( -1.322 9.021 -5.257) 10.524 7.640 ( -0.236 -5.619 2.331) 6.087 7.789 ( -0.259 -1.902 1.941) 2.730 7.897 ( 0.118 3.844 -3.746) 5.368 7.964 ( -5.092 3.242 3.981) 7.231 8.262 ( -0.308 -0.814 -3.926) 4.021 8.314 ( -2.483 -1.416 -6.270) 6.891 8.331 ( -4.793 3.569 0.274) 5.982 8.613 ( -3.663 -0.068 5.014) 6.210 8.787 ( -2.390 1.619 4.407) 5.268 8.837 ( -6.480 -4.090 -4.294) 8.784 9.295 ( 0.374 0.637 -0.358) 0.821 9.354 ( -3.720 -5.466 -7.017) 9.641 9.501 ( 0.751 -1.026 -4.921) 5.083 9.839 ( -3.219 -3.361 -5.321) 7.069 10.002 ( -3.068 -8.571 4.147) 10.004 10.307 ( -1.749 -6.126 2.134) 6.719 10.324 ( 0.728 -5.962 -1.589) 6.213 10.733 ( -0.878 -12.107 -1.908) 12.287 10.750 ( 1.382 -2.604 3.285) 4.414 10.861 ( -6.706 7.271 5.704) 11.417 10.898 ( 0.759 -1.834 -0.905) 2.181 11.072 ( 7.094 -12.356 5.222) 15.174 11.259 ( 0.117 12.037 -1.700) 12.157 11.548 ( -5.324 9.575 -2.985) 11.356 12.301 ( -10.768 -4.817 0.787) 11.823 12.404 ( -9.198 -1.341 0.676) 9.319 12.761 ( 1.946 1.725 0.016) 2.600 13.456 ( 5.782 0.298 1.058) 5.886 13.710 ( 3.788 -6.830 2.422) 8.177 13.780 ( 6.569 5.855 -4.825) 10.036 13.999 ( 3.058 5.919 5.179) 8.438 14.123 ( 3.880 -7.651 -4.168) 9.537 14.270 ( 7.590 -8.450 -1.855) 11.509 14.550 ( 5.255 -4.495 4.092) 8.035 14.854 ( -4.739 -4.766 -4.765) 8.239 15.367 ( -2.193 -5.103 -4.220) 6.975 15.624 ( -0.983 -2.596 3.590) 4.538 15.849 ( -3.450 -11.226 9.991) 15.419 15.915 ( -5.928 0.439 -10.969) 12.476 16.035 ( 5.427 8.142 4.314) 10.693 16.225 ( 9.868 -5.685 12.453) 16.876 16.688 ( -5.240 14.020 3.983) 15.488 17.178 ( 0.734 -1.750 -8.789) 8.992 17.286 ( 3.177 -3.333 2.805) 5.392 17.820 ( 6.136 11.721 4.007) 13.824 18.007 ( 8.930 8.198 -0.277) 12.126 24.386 ( -0.218 1.647 0.807) 1.847 24.472 ( -1.521 1.892 -2.328) 3.363 24.743 ( 3.830 -0.184 1.730) 4.206 24.907 ( 3.278 2.438 -1.259) 4.275 25.192 ( -0.966 7.570 4.094) 8.661 25.269 ( 3.905 4.069 -5.181) 7.658 25.821 ( 3.833 2.221 -1.592) 4.707 25.951 ( 7.179 2.670 3.827) 8.562 26.758 ( -7.794 2.262 -3.426) 8.809 26.947 ( -14.334 3.394 2.726) 14.981 27.132 ( -9.122 0.982 -3.128) 9.693 27.613 ( -8.783 -0.975 -9.680) 13.107 28.002 ( 4.012 -1.181 7.587) 8.663 28.785 ( 5.256 -5.697 -15.840) 17.635 29.438 ( -4.918 -17.774 1.753) 18.525 29.574 ( -0.422 -7.811 11.291) 13.736 ======================= Grid point 208 (100/130) ======================= q-point: (-0.10 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.514 ( -15.012 14.636 26.733) 33.974 1.561 ( -19.111 19.440 24.545) 36.683 2.289 ( -9.429 15.487 -15.863) 24.091 2.731 ( -31.385 11.926 9.884) 34.999 2.924 ( -27.597 16.965 10.708) 34.118 4.064 ( -5.130 -7.254 -2.101) 9.130 4.174 ( 0.167 -9.907 0.489) 9.920 4.353 ( -3.089 -5.211 -9.237) 11.046 4.676 ( 0.211 0.187 10.884) 10.888 4.846 ( 0.927 9.879 -5.374) 11.284 5.101 ( 7.139 -0.166 -11.855) 13.840 5.386 ( 2.627 4.125 -5.883) 7.650 5.543 ( -5.730 3.759 13.418) 15.067 5.751 ( -3.648 0.275 -4.224) 5.588 5.951 ( -12.547 3.385 10.854) 16.932 6.238 ( 12.533 -2.424 -12.104) 17.592 6.387 ( 4.283 5.273 -5.263) 8.594 6.595 ( 6.845 -2.341 2.537) 7.666 6.666 ( 7.794 8.226 7.680) 13.689 6.878 ( -2.031 6.271 -2.568) 7.074 7.099 ( 3.108 5.124 -7.784) 9.824 7.207 ( -4.974 7.878 -3.704) 10.027 7.628 ( -2.291 -2.924 2.112) 4.273 7.802 ( -0.446 0.042 -2.007) 2.057 7.851 ( -1.262 4.716 -5.011) 6.996 7.882 ( -5.073 2.334 3.061) 6.369 8.052 ( -8.625 0.195 -5.079) 10.011 8.178 ( -6.707 -4.479 -10.281) 13.067 8.411 ( 2.780 2.272 4.707) 5.920 8.610 ( -2.100 -0.342 2.269) 3.110 8.661 ( -0.709 0.153 -0.364) 0.811 8.820 ( -1.053 -0.402 8.112) 8.190 9.241 ( -1.764 -3.792 -7.678) 8.743 9.300 ( -1.017 -8.646 -7.020) 11.183 9.489 ( -2.116 -2.868 5.913) 6.904 9.790 ( 1.799 -1.516 -3.634) 4.329 9.989 ( -1.130 -1.639 3.752) 4.247 10.191 ( -8.214 -14.312 0.453) 16.508 10.346 ( 1.620 1.925 -2.673) 3.671 10.607 ( -4.937 -2.275 -4.051) 6.780 10.772 ( -2.237 -4.648 6.957) 8.661 10.821 ( -3.082 3.010 5.790) 7.216 11.010 ( 8.285 0.709 0.037) 8.315 11.249 ( 3.540 -21.184 6.991) 22.587 11.309 ( 4.251 8.729 2.375) 9.995 11.430 ( -3.466 10.680 -2.642) 11.535 12.129 ( -7.637 -5.208 1.774) 9.413 12.235 ( -8.080 -2.725 -0.682) 8.554 12.870 ( 7.104 1.901 4.899) 8.836 13.439 ( -3.255 -1.843 -7.737) 8.593 13.816 ( 6.362 0.173 -0.599) 6.393 13.885 ( 4.490 1.831 3.201) 5.810 14.044 ( -2.164 2.066 3.869) 4.890 14.185 ( 4.685 -6.064 -3.232) 8.317 14.425 ( 9.396 -2.508 1.113) 9.788 14.578 ( -4.052 -11.270 2.510) 12.236 14.786 ( 2.028 -9.556 -7.234) 12.155 15.238 ( -9.259 6.092 -12.101) 16.410 15.507 ( -4.385 0.575 1.998) 4.853 15.786 ( -2.452 1.598 -5.195) 5.963 15.865 ( -4.290 -10.095 11.514) 15.902 16.080 ( 4.339 -5.669 -8.011) 10.730 16.558 ( 1.931 4.366 8.498) 9.747 16.870 ( 19.446 12.877 10.968) 25.773 17.071 ( -3.018 0.528 -3.949) 4.998 17.383 ( 3.881 -8.743 -0.116) 9.567 17.965 ( 4.677 10.346 6.595) 13.130 18.166 ( 9.368 11.488 -3.663) 15.269 24.392 ( 0.082 1.681 0.791) 1.860 24.440 ( -0.193 2.113 -1.992) 2.911 24.815 ( 2.266 -0.353 2.183) 3.166 24.941 ( 1.784 1.444 -2.338) 3.277 25.221 ( 0.973 10.089 2.428) 10.423 25.319 ( 5.661 5.823 -6.076) 10.142 25.863 ( 2.538 2.101 -1.110) 3.477 26.067 ( 1.206 1.682 0.579) 2.149 26.636 ( -2.583 1.118 -2.343) 3.662 26.721 ( -11.424 2.232 2.467) 11.898 26.941 ( -8.365 0.266 -3.315) 9.002 27.118 ( -26.421 1.240 -14.987) 30.401 28.158 ( 3.725 -2.471 12.181) 12.975 28.720 ( 1.363 -9.985 -11.735) 15.468 29.499 ( 5.895 -14.735 10.229) 18.881 29.687 ( 1.460 -8.499 8.968) 12.441 ======================= Grid point 209 (101/130) ======================= q-point: ( 0.00 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.985 ( -0.309 19.682 22.795) 30.118 2.147 ( 7.820 25.974 18.461) 32.812 2.423 ( 1.920 16.697 -19.234) 25.542 2.522 ( -5.557 19.955 -17.666) 27.225 3.472 ( 1.888 23.198 26.172) 35.024 3.815 ( -4.070 -1.874 -2.834) 5.302 4.022 ( 3.760 -11.385 1.539) 12.088 4.096 ( -0.984 -7.772 -8.924) 11.875 4.664 ( -3.070 -4.463 14.550) 15.525 4.926 ( -7.003 3.912 -6.793) 10.511 5.052 ( 3.420 -1.742 4.406) 5.843 5.312 ( -3.671 -2.103 -12.639) 13.328 5.682 ( -6.060 3.854 3.637) 8.050 5.769 ( 1.145 6.694 4.099) 7.932 5.887 ( -1.505 -2.546 11.238) 11.621 6.270 ( 13.579 -4.408 -18.425) 23.309 6.529 ( -2.731 1.701 5.310) 6.208 6.721 ( -0.472 8.597 -13.015) 15.605 6.929 ( 2.029 5.057 5.657) 7.854 7.060 ( 1.031 5.546 -6.415) 8.542 7.092 ( 1.339 8.695 8.524) 12.250 7.317 ( -1.025 9.189 -12.432) 15.494 7.633 ( 3.214 0.681 3.676) 4.930 7.732 ( -4.950 -2.476 -5.001) 7.460 7.907 ( -1.927 3.973 1.949) 4.827 7.943 ( -1.374 1.400 0.002) 1.962 8.016 ( 3.572 9.596 -0.323) 10.244 8.066 ( -0.378 10.663 -4.809) 11.703 8.450 ( -0.850 -2.372 6.273) 6.760 8.547 ( 1.621 -2.383 -2.734) 3.973 8.793 ( -0.008 -2.137 9.477) 9.715 8.881 ( 1.182 3.984 4.317) 5.992 8.965 ( -8.110 -4.632 -0.858) 9.379 9.060 ( 0.435 -7.473 -10.479) 12.878 9.401 ( 0.104 -6.912 8.706) 11.116 9.580 ( 0.329 -11.278 -7.210) 13.390 10.002 ( 0.236 1.168 4.025) 4.198 10.062 ( 2.773 2.989 -1.668) 4.405 10.413 ( -5.358 -2.483 8.093) 10.019 10.512 ( 6.195 -5.431 0.382) 8.247 10.775 ( -3.304 6.176 1.965) 7.274 10.850 ( 3.525 1.900 -2.890) 4.939 11.158 ( 2.605 0.666 2.013) 3.359 11.191 ( 0.391 3.356 -2.081) 3.968 11.530 ( -0.930 10.725 3.437) 11.301 11.595 ( -0.746 10.177 -3.033) 10.646 11.962 ( 0.341 -6.105 3.495) 7.043 12.026 ( -0.630 -5.826 -2.548) 6.390 13.040 ( 4.002 -3.247 7.467) 9.073 13.195 ( -5.887 -5.905 -7.431) 11.169 13.769 ( 0.203 -9.938 4.202) 10.791 13.854 ( 0.055 -10.169 -4.622) 11.170 13.946 ( -0.137 -10.093 1.867) 10.265 14.010 ( 1.845 -10.661 -3.538) 11.384 14.256 ( -2.137 -9.862 6.206) 11.846 14.404 ( 1.087 -9.980 -7.142) 12.320 14.855 ( 5.285 2.203 9.118) 10.767 15.045 ( -4.300 -4.675 -7.651) 9.944 15.602 ( 0.009 1.582 3.316) 3.674 15.689 ( -0.298 -2.323 -3.645) 4.332 15.772 ( -3.276 3.515 8.811) 10.036 15.998 ( 1.528 4.930 -11.776) 12.857 16.737 ( 2.163 -0.933 8.637) 8.952 16.904 ( -3.106 -5.902 -6.605) 9.386 17.250 ( -0.449 4.212 7.452) 8.572 17.386 ( 2.493 4.333 -5.607) 7.512 18.262 ( -0.446 8.709 7.209) 11.315 18.427 ( 0.820 6.931 -8.781) 11.217 24.450 ( -0.027 2.862 1.028) 3.041 24.475 ( 0.111 2.489 -1.249) 2.787 24.879 ( 0.167 1.513 2.022) 2.531 24.942 ( 0.285 0.506 -3.570) 3.617 25.488 ( 2.957 10.110 -2.808) 10.902 25.494 ( 0.375 7.799 -3.441) 8.533 25.965 ( 0.675 2.188 1.243) 2.606 25.997 ( -4.929 2.153 -1.613) 5.616 26.620 ( -3.679 2.037 3.009) 5.171 26.678 ( 4.593 1.248 -1.838) 5.102 26.812 ( -2.814 3.518 0.689) 4.557 26.874 ( -1.169 2.231 -4.027) 4.750 28.216 ( -0.081 -5.993 12.665) 14.011 28.435 ( 1.948 -11.678 -6.547) 13.529 29.410 ( 2.728 -10.931 7.667) 13.628 29.512 ( -1.138 -10.200 -1.925) 10.442 ======================= Grid point 210 (102/130) ======================= q-point: ( 0.10 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.191 ( 4.890 18.537 12.354) 22.806 2.369 ( 11.132 16.527 -13.454) 24.043 2.470 ( 14.430 18.198 -17.231) 28.919 2.668 ( 25.013 17.237 13.405) 33.203 3.759 ( 8.679 10.316 -2.593) 13.729 3.800 ( 10.292 7.385 9.954) 16.111 4.057 ( 3.202 -8.120 -4.518) 9.829 4.147 ( 6.915 -9.605 -1.761) 11.965 4.715 ( -4.063 -0.287 4.501) 6.070 4.779 ( -4.389 4.526 14.704) 15.998 5.082 ( -4.217 -1.966 -6.343) 7.866 5.289 ( 8.056 0.898 4.158) 9.110 5.608 ( -3.073 1.166 1.482) 3.606 5.805 ( -6.718 0.916 13.909) 15.474 5.998 ( 9.279 3.201 -4.419) 10.764 6.318 ( -8.068 -4.310 -2.990) 9.624 6.391 ( 5.474 0.243 -13.994) 15.029 6.723 ( 2.243 13.165 -2.502) 13.587 6.984 ( -1.293 3.779 -6.646) 7.754 7.028 ( -3.296 3.867 2.993) 5.897 7.070 ( 2.903 13.286 -1.441) 13.676 7.352 ( 6.535 10.123 0.560) 12.062 7.628 ( -2.126 -3.711 -2.600) 5.005 7.737 ( 3.064 1.760 3.226) 4.785 7.914 ( -2.823 6.111 -0.671) 6.765 7.969 ( 1.227 3.487 4.127) 5.540 7.975 ( 2.622 -1.660 1.111) 3.297 8.137 ( 7.931 7.406 -3.571) 11.423 8.471 ( 1.872 -1.018 3.526) 4.119 8.588 ( 1.087 1.971 -3.013) 3.761 8.723 ( -6.979 3.663 1.188) 7.970 8.890 ( -0.183 -8.580 1.562) 8.723 8.968 ( -1.929 -6.618 6.202) 9.272 9.013 ( 2.070 -2.068 -1.025) 3.101 9.479 ( 1.291 -7.414 3.963) 8.506 9.615 ( 8.151 -6.643 -2.877) 10.902 9.999 ( -1.662 2.136 0.439) 2.742 10.094 ( 3.115 -0.756 -4.372) 5.421 10.354 ( -7.388 -2.792 4.500) 9.090 10.589 ( 4.381 -6.222 -4.991) 9.100 10.733 ( -1.601 2.275 1.906) 3.372 10.915 ( 2.859 4.043 -1.910) 5.307 11.118 ( -2.319 4.130 -2.659) 5.431 11.162 ( -3.105 1.465 -1.720) 3.840 11.551 ( 0.490 11.086 0.492) 11.108 11.633 ( 5.450 11.396 1.442) 12.714 12.017 ( 5.850 -7.261 0.095) 9.325 12.151 ( 11.896 -4.089 0.496) 12.589 13.001 ( -7.893 -1.178 -4.956) 9.394 13.174 ( 1.881 -5.916 8.740) 10.720 13.750 ( -3.477 -6.943 0.154) 7.766 13.806 ( -3.665 -14.952 -2.576) 15.609 13.883 ( -4.460 -9.462 1.798) 10.613 13.988 ( -2.022 -9.614 -2.525) 10.144 14.342 ( 3.112 -10.137 5.938) 12.153 14.434 ( 7.549 -10.991 -5.586) 14.456 14.792 ( -9.666 6.815 -5.319) 12.968 15.077 ( 6.057 -5.505 3.648) 8.961 15.584 ( -4.787 -6.197 4.814) 9.192 15.599 ( -3.925 2.128 -2.437) 5.086 15.846 ( 0.315 11.211 10.834) 15.594 15.982 ( 5.527 -4.144 -9.670) 11.884 16.691 ( -8.100 -4.296 -1.305) 9.261 16.909 ( 2.825 -4.062 2.771) 5.671 17.220 ( -6.390 7.017 2.119) 9.724 17.368 ( 0.571 4.400 -4.998) 6.683 18.246 ( -7.228 7.840 5.624) 12.056 18.292 ( -6.827 7.606 -6.210) 11.960 24.449 ( -0.483 2.985 0.216) 3.032 24.478 ( 0.901 2.736 -0.435) 2.913 24.858 ( -3.077 1.204 0.276) 3.315 24.918 ( -0.933 0.660 -1.102) 1.587 25.417 ( -3.957 9.795 -1.469) 10.666 25.498 ( 0.002 8.085 -4.095) 9.062 25.880 ( -4.129 3.038 2.684) 5.787 26.059 ( 1.155 0.897 2.564) 2.952 26.633 ( 3.550 2.581 1.574) 4.663 26.813 ( 11.460 -0.439 -2.051) 11.650 26.883 ( 8.740 4.244 2.673) 10.077 26.998 ( 12.668 2.123 3.079) 13.208 28.249 ( -4.473 -7.623 4.584) 9.956 28.415 ( 2.420 -5.913 -6.306) 8.977 29.413 ( -5.291 -9.274 -4.553) 11.607 29.490 ( 0.680 -15.323 2.417) 15.527 ======================= Grid point 211 (103/130) ======================= q-point: ( 0.20 0.25 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.346 ( 13.263 15.704 -10.312) 22.996 2.558 ( 16.893 18.594 -16.760) 30.199 2.632 ( 13.721 11.440 1.832) 17.958 3.234 ( 16.917 6.530 21.022) 27.762 3.969 ( 14.836 3.721 -10.943) 18.807 4.050 ( 0.730 -4.448 -6.997) 8.323 4.128 ( 15.315 1.077 8.428) 17.514 4.210 ( 1.878 -6.961 1.498) 7.364 4.709 ( 5.936 1.903 -2.826) 6.844 4.911 ( -0.225 1.319 14.939) 14.998 5.030 ( 1.999 10.192 2.340) 10.647 5.429 ( 1.863 8.615 1.913) 9.019 5.623 ( 4.080 -1.296 5.881) 7.274 5.741 ( -10.472 -3.680 10.388) 15.203 6.087 ( -1.087 -2.731 -5.718) 6.429 6.140 ( -2.295 10.710 1.614) 11.072 6.363 ( 0.951 -0.888 -15.968) 16.021 6.624 ( -9.887 10.887 -6.579) 16.111 6.847 ( -1.368 9.304 -1.989) 9.612 7.089 ( 2.180 1.844 1.917) 3.439 7.207 ( 13.327 10.166 -4.394) 17.328 7.416 ( -3.273 8.125 3.670) 9.498 7.601 ( 0.924 1.944 -1.504) 2.626 7.764 ( 0.124 -2.471 -0.395) 2.506 7.868 ( 3.782 1.550 -1.153) 4.246 8.104 ( 4.659 -0.761 7.858) 9.167 8.137 ( 7.605 1.969 9.574) 12.385 8.243 ( 7.566 5.101 -7.516) 11.822 8.462 ( -5.016 7.451 -0.169) 8.984 8.634 ( 4.316 -3.724 5.818) 8.145 8.665 ( -0.274 -2.584 -4.269) 4.998 8.870 ( 1.248 -4.571 -4.139) 6.291 8.994 ( 0.696 -7.510 10.202) 12.687 9.122 ( 5.297 -1.237 6.781) 8.693 9.556 ( 4.312 -5.299 3.005) 7.464 9.688 ( 0.251 0.118 -6.035) 6.041 9.999 ( 1.533 -0.918 1.814) 2.546 10.119 ( 3.807 -5.471 -4.081) 7.815 10.225 ( -6.787 -5.720 -0.813) 8.913 10.560 ( -2.280 -12.392 -6.946) 14.388 10.775 ( 4.413 4.704 1.254) 6.571 10.871 ( -4.573 3.207 -2.289) 6.036 11.076 ( -4.006 3.604 2.044) 5.763 11.132 ( 4.514 7.033 -3.964) 9.250 11.568 ( 2.319 14.029 -1.470) 14.295 11.765 ( 6.716 12.967 1.316) 14.662 12.183 ( 10.812 -6.774 0.314) 12.762 12.379 ( 10.310 -2.457 -0.565) 10.614 12.848 ( -3.698 2.306 -2.450) 4.999 13.259 ( -1.237 -7.255 10.551) 12.864 13.607 ( -8.991 -9.079 -5.107) 13.760 13.731 ( -3.326 -9.941 0.727) 10.508 13.850 ( -1.534 -11.858 1.468) 12.046 13.906 ( -4.373 -8.261 -1.528) 9.471 14.384 ( -2.338 -10.508 0.568) 10.780 14.450 ( -3.395 0.709 -7.178) 7.972 14.717 ( 7.194 1.503 1.918) 7.596 15.172 ( 2.220 -10.519 0.573) 10.766 15.506 ( -6.712 -7.666 5.499) 11.578 15.580 ( 1.653 -4.126 0.213) 4.450 15.908 ( 0.344 7.007 2.543) 7.462 16.038 ( 4.750 -2.347 -0.920) 5.377 16.511 ( -8.906 -4.100 -4.635) 10.844 16.855 ( -9.496 -6.899 -3.996) 12.399 17.161 ( 0.477 13.823 2.756) 14.103 17.350 ( 0.903 4.609 -1.342) 4.885 18.086 ( -9.613 7.457 -1.438) 12.251 18.143 ( -7.669 7.335 0.660) 10.632 24.445 ( 0.274 3.086 -0.447) 3.130 24.500 ( 1.571 3.071 0.407) 3.473 24.792 ( -3.398 1.366 -1.068) 3.815 24.887 ( -2.416 0.379 1.547) 2.894 25.347 ( -2.832 8.388 -0.367) 8.861 25.439 ( -1.724 6.334 -4.962) 8.229 25.837 ( -3.754 3.482 2.957) 5.913 26.020 ( -6.198 1.278 1.004) 6.407 26.771 ( 9.508 4.127 1.522) 10.477 27.041 ( 12.154 -0.122 0.164) 12.156 27.112 ( 12.195 6.302 2.418) 13.938 27.335 ( 15.002 -0.678 10.945) 18.583 28.151 ( -4.076 -4.237 -6.942) 9.097 28.425 ( -0.774 -3.634 4.881) 6.134 29.268 ( -4.582 -10.204 -6.088) 12.736 29.497 ( 1.342 -17.082 -4.095) 17.617 ======================= Grid point 212 (104/130) ======================= q-point: ( 0.30 0.25 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.578 ( 21.739 13.370 -9.062) 27.083 2.776 ( 20.686 15.742 -13.245) 29.175 2.942 ( 14.147 8.082 5.914) 17.333 3.584 ( 4.683 -0.947 16.296) 16.981 3.899 ( -6.897 -3.065 -5.994) 9.638 4.048 ( 1.409 1.355 -2.607) 3.259 4.331 ( -2.022 1.966 20.634) 20.825 4.397 ( 7.942 -3.164 -1.245) 8.639 4.848 ( -17.670 -3.311 2.818) 18.197 4.968 ( 22.401 8.438 -7.883) 25.202 5.061 ( 8.524 4.811 -3.731) 10.475 5.568 ( -11.451 -9.894 2.961) 15.420 5.632 ( 8.979 14.534 12.778) 21.334 5.758 ( 4.500 4.463 -1.266) 6.463 5.929 ( -9.847 7.307 0.514) 12.273 6.137 ( 1.426 8.778 -11.369) 14.434 6.200 ( -3.841 1.118 -12.818) 13.427 6.409 ( -6.275 8.488 -2.504) 10.849 6.845 ( -0.621 6.329 4.383) 7.723 7.147 ( 4.421 -0.190 -1.518) 4.678 7.352 ( 1.853 7.849 -2.387) 8.410 7.433 ( 8.210 -1.818 -2.452) 8.759 7.575 ( -1.464 8.411 2.014) 8.772 7.814 ( 2.042 1.707 0.666) 2.744 8.018 ( 12.349 1.918 -0.789) 12.522 8.179 ( -1.074 2.494 2.363) 3.600 8.272 ( 3.237 6.589 -7.356) 10.393 8.356 ( 5.475 1.677 8.693) 10.409 8.451 ( 1.322 4.182 5.272) 6.858 8.620 ( 0.133 -4.277 -3.862) 5.764 8.690 ( -2.701 -7.274 7.468) 10.769 8.893 ( 3.775 -0.817 -1.630) 4.192 9.192 ( 6.854 -7.173 10.142) 14.188 9.292 ( 6.749 -1.792 7.011) 9.895 9.566 ( -3.975 4.851 -4.588) 7.770 9.683 ( 5.681 -6.782 3.265) 9.431 10.043 ( 3.604 -2.736 -4.963) 6.716 10.111 ( -2.854 -7.595 -4.357) 9.209 10.175 ( 1.354 -7.599 1.904) 7.950 10.433 ( -4.758 -10.852 -6.698) 13.611 10.754 ( -4.682 4.601 -1.201) 6.673 10.879 ( 4.742 4.314 -0.400) 6.424 11.037 ( -2.361 3.709 3.667) 5.725 11.194 ( 3.962 6.589 -1.419) 7.819 11.624 ( 5.167 17.307 -1.748) 18.146 11.891 ( 5.762 14.215 0.351) 15.342 12.372 ( 7.054 -5.144 0.931) 8.779 12.478 ( 2.397 -0.293 1.223) 2.707 12.859 ( 5.618 0.923 -3.306) 6.583 13.301 ( -3.572 -5.004 9.708) 11.491 13.396 ( -8.284 -10.550 -4.087) 14.022 13.624 ( -6.659 -7.414 -3.770) 10.655 13.838 ( -1.214 -8.893 -1.436) 9.090 13.852 ( -0.294 -12.391 2.704) 12.686 14.265 ( -4.232 -0.292 -5.395) 6.863 14.368 ( -4.097 0.164 -0.318) 4.112 14.919 ( 9.847 -1.702 3.739) 10.670 15.206 ( 2.356 -11.783 -0.397) 12.023 15.430 ( -6.634 -9.137 6.041) 12.806 15.624 ( 2.135 -7.923 0.067) 8.206 15.905 ( 1.309 -5.373 -7.882) 9.629 16.124 ( 2.823 1.280 4.194) 5.215 16.273 ( -9.318 3.090 -10.036) 14.039 16.627 ( -10.684 -10.084 -0.742) 14.710 17.230 ( 4.054 13.003 2.388) 13.828 17.394 ( 3.208 5.219 2.300) 6.543 17.904 ( -8.923 7.230 -0.885) 11.518 18.006 ( -6.968 6.682 -0.998) 9.706 24.452 ( 0.905 3.270 -0.455) 3.424 24.547 ( 2.711 3.312 1.343) 4.486 24.718 ( -3.215 1.719 -1.888) 4.106 24.854 ( -2.856 0.826 1.971) 3.567 25.310 ( -0.665 6.062 -0.181) 6.102 25.381 ( 0.102 4.338 -4.104) 5.973 25.771 ( -5.632 3.487 1.857) 6.880 25.876 ( -9.055 2.723 -0.213) 9.458 26.989 ( 11.336 6.336 3.044) 13.339 27.236 ( 7.243 1.131 3.713) 8.217 27.347 ( 10.510 7.714 1.193) 13.092 27.627 ( 8.133 -2.326 6.839) 10.878 28.010 ( -4.206 0.271 -7.608) 8.697 28.448 ( -5.537 1.216 11.264) 12.610 29.186 ( 1.121 -16.243 -4.183) 16.811 29.492 ( 4.075 -17.879 -9.118) 20.479 ======================= Grid point 213 (105/130) ======================= q-point: ( 0.40 0.25 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.022 ( 28.854 9.923 -0.196) 30.513 3.083 ( 22.077 10.703 -10.705) 26.768 3.200 ( 6.853 8.345 5.731) 12.225 3.665 ( -7.860 0.511 8.706) 11.740 3.754 ( -5.216 2.330 1.233) 5.844 4.079 ( 0.461 2.753 2.686) 3.874 4.294 ( -10.030 4.989 10.075) 15.066 4.467 ( -13.092 -10.811 -3.802) 17.399 4.631 ( 6.481 0.121 8.439) 10.642 5.118 ( 1.758 10.447 -0.634) 10.612 5.230 ( -1.882 -2.249 4.013) 4.970 5.334 ( -8.663 -11.550 -7.317) 16.186 5.705 ( -1.948 10.759 -9.178) 14.275 5.829 ( -1.621 14.663 10.056) 17.854 5.840 ( 0.947 3.484 -6.392) 7.341 6.062 ( 4.696 9.816 -10.480) 15.107 6.110 ( 6.530 3.328 -13.735) 15.568 6.308 ( -5.273 7.120 -0.088) 8.861 6.923 ( 1.908 0.773 11.108) 11.297 7.217 ( 4.578 -2.703 -2.771) 5.995 7.391 ( 2.325 4.935 2.311) 5.924 7.498 ( 2.837 -1.879 -1.540) 3.735 7.640 ( 4.053 13.417 -0.602) 14.029 7.813 ( -0.732 4.867 -3.925) 6.295 8.133 ( 1.376 7.814 -2.588) 8.345 8.218 ( -1.286 2.582 -2.377) 3.737 8.297 ( 10.096 2.021 -2.006) 10.490 8.454 ( -0.253 -1.044 4.122) 4.260 8.524 ( 2.088 3.977 4.669) 6.479 8.589 ( -2.903 1.039 3.199) 4.443 8.783 ( 6.488 -7.875 6.080) 11.877 8.985 ( 5.201 -2.413 2.978) 6.461 9.227 ( -3.671 -5.364 -0.694) 6.537 9.456 ( -0.049 -4.280 10.303) 11.157 9.583 ( 3.082 1.818 5.061) 6.197 9.798 ( 3.996 -7.982 0.970) 8.979 9.972 ( -3.800 -5.571 -11.003) 12.905 10.058 ( 1.118 -5.513 -6.667) 8.723 10.211 ( 1.666 -3.216 2.616) 4.468 10.312 ( -2.605 -5.091 -3.038) 6.476 10.720 ( 0.801 4.861 1.225) 5.076 10.890 ( -1.907 2.988 -2.345) 4.251 11.082 ( 2.843 3.496 4.635) 6.465 11.240 ( 1.307 4.600 -0.520) 4.810 11.727 ( 6.598 18.299 -0.364) 19.455 11.957 ( 1.119 16.274 -1.553) 16.386 12.436 ( -0.678 -2.481 6.887) 7.352 12.573 ( 5.377 -2.744 -0.413) 6.051 12.908 ( 2.419 -0.492 -4.478) 5.113 13.183 ( -7.540 -1.088 -5.969) 9.678 13.343 ( -2.527 -11.522 7.685) 14.078 13.498 ( -2.672 -7.180 -2.336) 8.009 13.825 ( 0.607 -9.085 -0.985) 9.159 13.870 ( 0.424 -13.553 0.207) 13.561 14.180 ( -1.468 1.764 -2.363) 3.294 14.282 ( -3.509 3.063 -2.197) 5.150 15.116 ( 7.178 0.852 5.597) 9.142 15.270 ( 4.631 -13.819 -0.007) 14.574 15.354 ( -6.580 -8.499 5.427) 12.041 15.653 ( 0.131 -7.153 0.862) 7.206 15.807 ( -1.955 -4.379 -13.106) 13.956 16.049 ( -4.211 -0.811 -9.811) 10.707 16.232 ( 4.116 -3.147 3.834) 6.445 16.457 ( -8.403 -13.134 2.134) 15.738 17.353 ( 6.572 12.370 3.543) 14.449 17.487 ( 3.393 5.622 4.218) 7.804 17.741 ( -7.559 7.317 -1.144) 10.582 17.869 ( -5.792 6.764 -3.325) 9.506 24.474 ( 1.646 3.540 0.309) 3.916 24.603 ( -0.106 4.358 1.235) 4.530 24.657 ( 0.492 1.053 -1.919) 2.244 24.806 ( -3.535 1.408 0.592) 3.851 25.330 ( 2.787 4.234 0.581) 5.103 25.389 ( 3.427 3.054 -2.018) 5.014 25.664 ( -6.420 3.231 0.118) 7.188 25.699 ( -9.030 3.834 -0.751) 9.839 27.215 ( 9.087 7.533 4.538) 12.645 27.380 ( 4.351 2.578 6.164) 7.973 27.469 ( 1.205 5.658 0.879) 5.852 27.779 ( 5.232 4.973 -6.911) 9.993 27.921 ( 1.883 -1.876 2.324) 3.531 28.352 ( -12.426 5.023 6.983) 15.113 29.231 ( 2.998 -19.670 2.238) 20.023 29.497 ( 5.034 -18.997 -11.315) 22.677 ======================= Grid point 214 (106/130) ======================= q-point: (-0.50 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.208 ( -12.694 9.016 5.783) 16.609 3.337 ( 7.083 9.005 -5.316) 12.630 3.454 ( -13.973 9.803 6.326) 18.203 3.570 ( 22.167 4.918 -3.033) 22.907 3.787 ( 7.914 0.715 9.681) 12.525 3.944 ( -12.793 -0.008 -3.966) 13.393 4.245 ( 0.711 -2.744 4.118) 4.999 4.331 ( 1.407 -1.250 -3.777) 4.220 4.873 ( 9.830 -2.320 9.998) 14.212 5.043 ( -8.321 -2.188 -7.297) 11.282 5.159 ( -2.514 2.528 4.784) 5.966 5.173 ( -6.472 -1.588 6.164) 9.078 5.644 ( 1.811 8.016 -4.632) 9.434 5.720 ( -2.669 9.767 -10.330) 14.465 5.840 ( -4.469 8.079 5.255) 10.624 6.087 ( 8.209 5.302 -16.515) 19.190 6.178 ( -2.769 7.876 0.779) 8.384 6.227 ( 3.676 8.067 -3.447) 9.511 7.028 ( -3.284 -2.584 13.681) 14.305 7.263 ( 3.708 -3.947 -5.553) 7.757 7.466 ( 3.094 1.444 2.379) 4.162 7.519 ( -0.963 6.299 -0.107) 6.373 7.677 ( 1.686 8.943 -3.029) 9.592 7.730 ( -2.022 9.584 -5.061) 11.025 8.139 ( -4.593 6.148 -0.259) 7.679 8.149 ( 1.317 6.777 -0.657) 6.935 8.372 ( -4.554 -2.742 4.714) 7.105 8.487 ( 5.101 -2.402 -5.976) 8.215 8.573 ( -1.857 5.735 3.372) 6.907 8.621 ( 5.392 5.742 -0.567) 7.897 8.958 ( 5.690 -7.452 5.366) 10.802 9.018 ( -4.911 -6.407 -0.976) 8.131 9.276 ( 6.621 -8.851 11.851) 16.206 9.394 ( -10.675 -6.104 2.968) 12.650 9.638 ( -1.847 0.401 3.607) 4.072 9.795 ( 0.427 -3.756 -7.851) 8.714 9.889 ( -3.279 -2.110 2.931) 4.878 10.029 ( 4.362 -4.740 -8.329) 10.529 10.261 ( 0.778 -3.940 0.149) 4.019 10.285 ( 1.443 -2.889 -2.005) 3.802 10.769 ( 1.634 3.836 2.266) 4.746 10.826 ( -1.243 3.039 -2.779) 4.302 11.168 ( 1.687 3.665 3.740) 5.502 11.227 ( -1.162 3.874 -1.744) 4.405 11.845 ( 4.217 17.013 1.900) 17.630 11.903 ( -3.721 17.214 -3.668) 17.989 12.498 ( 0.142 -3.040 8.545) 9.070 12.621 ( 0.970 -2.677 -2.900) 4.064 12.921 ( 1.655 -0.702 1.097) 2.106 12.991 ( -6.823 -0.554 -6.076) 9.153 13.371 ( -0.651 -9.454 6.177) 11.312 13.478 ( 2.484 -8.742 -3.821) 9.859 13.812 ( -3.064 -10.803 2.113) 11.427 13.884 ( 3.288 -12.119 -3.901) 13.149 14.169 ( 0.448 1.593 0.506) 1.731 14.225 ( 0.884 6.081 -3.931) 7.294 15.244 ( -5.154 -10.871 7.391) 14.120 15.302 ( 3.535 4.375 3.117) 6.430 15.371 ( 5.213 -13.097 1.425) 14.169 15.557 ( -4.987 -2.188 -11.403) 12.637 15.750 ( -1.548 -2.971 5.875) 6.763 15.920 ( -1.497 -8.488 -9.126) 12.553 16.333 ( -0.606 -10.430 2.047) 10.646 16.374 ( 4.073 -9.611 -1.664) 10.570 17.480 ( -5.537 8.596 7.589) 12.733 17.546 ( 5.276 9.953 0.787) 11.293 17.667 ( 1.011 5.720 0.563) 5.836 17.751 ( -1.028 7.725 -6.422) 10.099 24.519 ( 1.983 3.747 1.435) 4.475 24.550 ( -2.429 3.934 -1.504) 4.862 24.716 ( 2.086 1.209 1.122) 2.659 24.739 ( -1.795 1.648 -1.061) 2.658 25.402 ( 2.357 3.973 0.862) 4.699 25.437 ( 0.457 3.018 -2.381) 3.871 25.562 ( -1.894 3.674 1.065) 4.269 25.582 ( -0.763 3.170 -0.794) 3.356 27.375 ( 2.552 6.414 4.588) 8.289 27.439 ( -1.473 4.948 -1.610) 5.408 27.503 ( 1.558 4.718 8.934) 10.223 27.686 ( -4.282 6.677 -8.286) 11.471 28.094 ( -3.951 1.004 6.526) 7.695 28.184 ( 5.011 2.093 -1.592) 5.659 29.281 ( -1.937 -17.822 6.281) 18.995 29.480 ( 2.788 -20.974 -11.893) 24.272 ======================= Grid point 215 (107/130) ======================= q-point: (-0.40 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.876 ( -25.694 9.077 7.572) 28.283 2.998 ( -28.714 10.519 2.024) 30.647 3.367 ( -5.169 13.582 -7.694) 16.444 3.744 ( 0.892 0.871 -1.054) 1.633 3.777 ( -0.731 -2.265 1.352) 2.738 4.128 ( 9.295 0.476 -0.082) 9.308 4.373 ( 11.719 -7.233 3.561) 14.225 4.409 ( 11.285 4.326 -3.705) 12.641 4.805 ( -9.937 -2.440 -5.233) 11.493 5.080 ( -4.756 9.070 3.566) 10.844 5.155 ( 8.464 -10.574 8.659) 16.076 5.228 ( -2.190 2.241 8.389) 8.955 5.616 ( -3.897 10.312 -3.222) 11.485 5.719 ( 6.324 0.760 4.420) 7.753 5.774 ( -3.869 7.489 5.570) 10.103 6.038 ( -2.644 8.745 -2.370) 9.438 6.089 ( -0.277 12.577 -11.471) 17.025 6.340 ( 9.434 7.984 -3.744) 12.913 7.025 ( -5.650 -2.349 9.793) 11.548 7.214 ( -3.646 1.150 -9.239) 9.999 7.421 ( -4.241 5.973 -3.690) 8.202 7.556 ( 1.853 -2.251 -3.797) 4.787 7.622 ( -1.786 8.610 4.344) 9.807 7.758 ( 3.765 7.315 -2.452) 8.585 8.067 ( -3.966 6.535 3.226) 8.297 8.155 ( -1.846 7.333 2.959) 8.119 8.276 ( -7.658 -1.468 1.807) 8.004 8.520 ( 3.428 -0.988 -3.624) 5.086 8.570 ( -0.169 7.179 -0.455) 7.196 8.657 ( -0.987 3.550 -2.500) 4.453 8.879 ( -6.096 -6.778 -2.854) 9.552 9.011 ( -4.422 -2.743 0.394) 5.218 9.250 ( -1.536 -5.694 -0.526) 5.921 9.548 ( 6.306 -18.469 16.838) 25.776 9.589 ( -5.008 -0.779 2.253) 5.547 9.718 ( -3.675 -0.327 -7.114) 8.014 9.831 ( -4.532 -4.792 3.132) 7.301 10.040 ( -0.440 -6.042 -4.040) 7.281 10.261 ( 1.495 -2.887 -1.229) 3.475 10.319 ( 4.826 -3.308 -4.395) 7.318 10.751 ( -1.189 4.457 -1.385) 4.816 10.860 ( 3.104 3.295 0.231) 4.533 11.146 ( -3.384 5.089 -0.201) 6.115 11.227 ( 0.144 4.677 -0.256) 4.686 11.749 ( -7.603 16.964 -2.501) 18.758 11.923 ( 0.520 14.828 1.488) 14.912 12.535 ( -3.095 -3.501 3.053) 5.582 12.570 ( -2.544 -2.863 -4.127) 5.630 12.837 ( -5.500 -1.706 0.953) 5.837 13.037 ( 5.692 1.101 7.352) 9.363 13.422 ( 3.031 -10.873 2.200) 11.500 13.509 ( 4.006 -8.530 -5.034) 10.684 13.772 ( -2.145 -11.596 2.346) 12.024 13.914 ( 2.763 -10.991 -3.422) 11.839 14.170 ( 0.248 3.019 -0.578) 3.084 14.279 ( 6.688 4.730 -2.245) 8.494 15.141 ( -8.496 -8.283 3.032) 12.247 15.368 ( -4.999 -3.466 -7.807) 9.897 15.429 ( 5.292 -1.317 0.016) 5.453 15.493 ( 3.972 -10.219 7.977) 13.558 15.714 ( -6.425 -7.499 3.080) 10.344 15.904 ( 3.517 -2.556 1.181) 4.505 16.303 ( 0.478 -2.899 -3.351) 4.457 16.510 ( 9.421 -14.557 -2.719) 17.552 17.338 ( -10.193 10.257 3.443) 14.865 17.592 ( -4.611 7.348 -1.829) 8.865 17.719 ( 9.098 8.219 -0.659) 12.278 17.826 ( 8.078 7.088 0.068) 10.747 24.484 ( -2.398 3.880 -0.586) 4.599 24.597 ( 3.584 3.190 1.800) 5.124 24.651 ( -3.674 1.829 -1.372) 4.327 24.808 ( 4.297 1.171 0.399) 4.471 25.357 ( -3.667 4.646 -0.951) 5.995 25.381 ( -2.427 3.209 -2.291) 4.630 25.654 ( 7.874 3.301 0.984) 8.594 25.673 ( 7.490 3.577 1.663) 8.466 27.288 ( -8.603 6.596 -2.176) 11.057 27.457 ( -4.871 5.459 1.921) 7.564 27.524 ( -1.655 5.517 -5.470) 7.944 27.589 ( -2.928 4.789 8.670) 10.329 27.929 ( -7.629 -0.152 2.318) 7.975 28.459 ( 17.273 1.497 -2.167) 17.472 29.253 ( -6.796 -17.528 6.020) 19.740 29.401 ( -1.690 -21.629 -8.942) 23.465 ======================= Grid point 216 (108/130) ======================= q-point: (-0.30 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.405 ( -29.724 14.233 7.140) 33.721 2.539 ( -23.060 15.372 7.386) 28.681 3.135 ( -10.700 12.135 -9.737) 18.883 3.717 ( -2.515 -4.337 1.538) 5.244 3.819 ( 0.661 -5.003 4.380) 6.682 4.093 ( -5.811 1.458 -8.220) 10.171 4.392 ( -13.219 3.299 0.073) 13.625 4.653 ( 3.997 -4.543 -3.597) 7.039 4.698 ( -4.340 8.061 4.267) 10.101 4.983 ( 0.498 3.835 -2.275) 4.487 5.000 ( -13.051 2.330 1.554) 13.348 5.463 ( 11.709 -8.282 10.884) 18.005 5.611 ( -2.594 5.558 14.945) 16.155 5.809 ( 0.078 6.374 6.159) 8.864 5.866 ( -7.287 10.552 -7.382) 14.797 5.930 ( 8.580 -4.057 4.562) 10.530 6.153 ( 12.802 13.075 -6.621) 19.460 6.465 ( 7.498 10.708 -6.637) 14.660 7.025 ( 1.543 3.497 -6.614) 7.639 7.033 ( -7.986 4.785 4.311) 10.260 7.330 ( -2.230 5.452 -3.227) 6.717 7.498 ( -1.986 -1.830 -5.753) 6.355 7.628 ( -0.986 6.846 -1.997) 7.199 7.798 ( 0.520 2.190 2.192) 3.141 8.013 ( -5.833 5.007 0.153) 7.689 8.125 ( -4.517 6.981 5.738) 10.103 8.186 ( -1.009 -0.956 2.017) 2.450 8.510 ( -5.385 1.498 -1.125) 5.701 8.515 ( -7.089 3.632 -4.256) 9.031 8.604 ( 3.291 2.135 -1.402) 4.166 8.800 ( -0.227 -5.267 -3.267) 6.201 8.888 ( -5.920 0.877 -1.235) 6.111 9.274 ( 2.055 -4.002 -0.626) 4.542 9.508 ( -5.369 -3.896 -8.479) 10.766 9.527 ( -7.368 0.871 -1.827) 7.641 9.683 ( -3.876 -19.366 6.245) 20.714 9.842 ( 0.218 -9.516 15.293) 18.014 9.969 ( -3.921 -4.317 1.169) 5.948 10.277 ( 0.178 -4.852 -3.655) 6.077 10.374 ( 4.488 -8.401 -3.959) 10.314 10.758 ( 3.433 4.665 -1.089) 5.893 10.887 ( -0.430 4.903 -1.057) 5.034 11.099 ( -0.982 6.342 -0.067) 6.418 11.182 ( -3.670 7.674 -2.258) 8.801 11.609 ( -5.553 16.294 -0.195) 17.215 11.888 ( -5.008 12.114 0.566) 13.120 12.402 ( -9.425 -3.716 -1.960) 10.318 12.494 ( -5.396 -2.575 0.452) 5.996 12.785 ( -2.427 -0.864 2.958) 3.923 13.241 ( 8.477 -1.038 9.299) 12.626 13.486 ( 2.344 -15.752 -6.263) 17.113 13.569 ( 6.887 -5.085 1.457) 8.684 13.798 ( 3.087 -11.602 1.567) 12.107 13.927 ( 2.023 -10.624 -4.113) 11.570 14.189 ( 1.832 2.894 1.144) 3.611 14.396 ( 6.861 1.214 -2.539) 7.416 14.979 ( -9.725 -4.004 -1.095) 10.574 15.236 ( -3.614 -10.886 -3.469) 11.984 15.517 ( 4.534 -4.434 -1.584) 6.537 15.624 ( -5.124 -7.748 6.207) 11.172 15.650 ( 4.363 -11.566 7.220) 14.315 16.030 ( 5.946 7.425 9.071) 13.144 16.288 ( 2.256 4.722 -7.866) 9.448 16.657 ( 8.481 -14.512 -2.659) 17.017 17.202 ( -6.926 11.223 3.926) 13.760 17.489 ( -3.110 7.099 -5.060) 9.256 17.882 ( 8.197 8.704 0.921) 11.991 17.990 ( 9.163 6.793 0.333) 11.411 24.447 ( -1.321 3.433 0.024) 3.679 24.570 ( -3.447 1.654 -0.710) 3.889 24.688 ( 4.438 3.170 0.741) 5.504 24.883 ( 3.661 0.863 -0.531) 3.798 25.321 ( 0.040 5.661 0.867) 5.727 25.339 ( 0.414 3.862 -2.471) 4.603 25.795 ( 6.694 3.550 -0.668) 7.606 25.847 ( 8.569 3.716 2.654) 9.710 27.065 ( -11.925 6.275 -3.961) 14.046 27.283 ( -12.668 3.238 0.535) 13.086 27.387 ( -9.117 8.009 -2.683) 12.428 27.640 ( 0.548 -0.964 4.725) 4.854 27.898 ( 0.011 -0.719 4.378) 4.437 28.703 ( 11.048 -0.006 -11.833) 16.189 29.114 ( -9.215 -23.838 3.332) 25.774 29.333 ( -1.874 -13.717 2.992) 14.163 ======================= Grid point 217 (109/130) ======================= q-point: (-0.20 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.008 ( -21.199 18.463 15.216) 31.966 2.238 ( -18.495 22.981 12.964) 32.221 2.853 ( -9.403 12.087 -12.351) 19.674 3.589 ( -14.581 -3.596 -10.800) 18.498 3.722 ( -28.007 19.710 9.060) 35.425 3.871 ( -1.265 -8.813 8.258) 12.143 4.149 ( -16.999 -0.405 2.701) 17.217 4.330 ( -9.342 -1.699 -4.433) 10.479 4.668 ( -4.669 -1.030 3.943) 6.198 4.873 ( -1.702 -1.394 0.686) 2.305 5.265 ( 17.498 6.421 -5.211) 19.354 5.547 ( -10.179 8.849 -2.882) 13.792 5.640 ( -3.918 7.523 8.699) 12.150 5.738 ( 1.265 -6.446 4.095) 7.741 5.912 ( 1.827 -3.699 5.181) 6.623 6.132 ( 7.094 -7.240 3.731) 10.801 6.282 ( 6.769 10.156 -6.478) 13.818 6.568 ( 10.736 13.322 -4.632) 17.725 6.908 ( -1.258 14.879 -3.788) 15.405 7.078 ( 0.123 2.172 0.348) 2.203 7.218 ( -5.526 4.572 -5.827) 9.241 7.493 ( 6.401 3.405 -3.371) 7.996 7.586 ( -2.434 7.106 -0.762) 7.549 7.756 ( -4.139 -0.799 -0.169) 4.219 7.930 ( 0.092 -0.372 -3.661) 3.681 8.083 ( -5.507 6.731 5.819) 10.464 8.237 ( 1.019 -2.522 -0.543) 2.774 8.300 ( -10.065 2.558 -4.806) 11.443 8.389 ( -5.048 2.032 1.899) 5.764 8.653 ( 2.296 2.557 -1.715) 3.841 8.741 ( -5.756 -3.789 -2.816) 7.444 8.807 ( -2.457 1.012 1.319) 2.967 9.222 ( -5.084 -8.340 -12.322) 15.724 9.272 ( -3.093 -2.023 -7.379) 8.253 9.501 ( -3.452 -0.104 6.334) 7.214 9.632 ( -2.403 -13.719 1.698) 14.031 9.946 ( -1.579 -1.059 5.892) 6.191 10.012 ( 1.429 -13.015 15.558) 20.334 10.187 ( -2.196 -6.625 -4.425) 8.264 10.431 ( 1.531 -7.948 2.442) 8.454 10.818 ( -0.523 1.328 -1.766) 2.271 10.857 ( 3.342 6.495 -1.727) 7.506 11.059 ( -6.148 9.844 2.731) 11.923 11.132 ( 2.897 6.320 -3.514) 7.790 11.543 ( -2.211 14.793 1.088) 14.997 11.777 ( -6.220 11.199 -0.024) 12.810 12.192 ( -11.478 -5.394 -0.541) 12.693 12.356 ( -10.634 -3.030 1.986) 11.235 12.803 ( 2.635 1.096 1.691) 3.317 13.439 ( -0.561 -11.236 -6.974) 13.236 13.479 ( 8.558 -7.350 8.100) 13.887 13.730 ( 7.784 -6.776 0.989) 10.367 13.875 ( 3.412 -13.435 -1.164) 13.911 13.937 ( 3.610 -8.861 -4.399) 10.531 14.266 ( 3.328 -0.107 5.284) 6.246 14.455 ( 1.266 -4.079 -2.269) 4.836 14.787 ( -7.356 -1.933 -4.272) 8.724 15.177 ( -1.774 -13.383 0.415) 13.506 15.552 ( -0.807 -1.465 1.036) 1.967 15.615 ( 2.717 -8.997 -0.403) 9.407 15.768 ( 1.244 -10.344 5.598) 11.827 16.221 ( 2.128 11.345 -9.823) 15.157 16.315 ( 10.071 7.233 12.217) 17.407 16.784 ( 6.393 -7.626 1.862) 10.124 17.158 ( -1.442 7.692 3.080) 8.410 17.403 ( -1.239 7.165 -5.367) 9.037 18.036 ( 6.798 9.482 2.348) 11.901 18.174 ( 11.284 7.273 -1.504) 13.509 24.434 ( -0.360 2.963 0.440) 3.017 24.514 ( -1.842 2.037 -0.773) 2.853 24.770 ( 3.737 2.511 0.551) 4.536 24.931 ( 2.633 0.320 -1.887) 3.255 25.357 ( 2.902 6.656 -0.414) 7.273 25.373 ( 4.413 6.188 0.058) 7.600 25.883 ( 3.797 3.733 -1.674) 5.582 26.012 ( 6.703 2.777 2.035) 7.535 26.822 ( -10.184 3.862 -3.199) 11.351 27.022 ( -15.662 2.855 1.919) 16.035 27.182 ( -10.168 4.820 -3.360) 11.744 27.586 ( -8.261 -1.624 -10.203) 13.228 27.964 ( 1.703 -2.514 7.770) 8.342 28.558 ( -10.884 -16.388 -5.672) 20.475 29.145 ( 5.602 -8.553 3.968) 10.967 29.380 ( 2.340 -10.354 6.567) 12.482 ======================= Grid point 218 (110/130) ======================= q-point: (-0.10 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.881 ( -9.544 20.287 22.853) 32.014 2.065 ( -12.275 28.001 16.829) 34.899 2.599 ( -5.333 14.297 -15.824) 21.983 2.995 ( -27.739 13.178 -14.189) 33.829 3.413 ( -17.684 26.393 20.346) 37.726 3.875 ( -4.613 -8.955 7.433) 12.519 3.993 ( -2.624 -9.290 2.869) 10.070 4.216 ( -3.343 -7.290 -6.353) 10.231 4.635 ( -2.989 -4.827 6.270) 8.459 4.891 ( 2.475 -2.610 3.110) 4.755 5.231 ( -7.538 10.422 -15.897) 20.449 5.456 ( -0.513 1.332 -7.286) 7.424 5.650 ( 1.305 6.900 5.247) 8.766 5.768 ( -2.151 0.763 7.398) 7.742 5.915 ( -9.317 -8.019 10.699) 16.296 6.187 ( 6.971 -1.007 -10.345) 12.515 6.423 ( 9.618 1.383 -2.448) 10.021 6.768 ( 10.862 12.786 -1.283) 16.825 6.882 ( -0.831 8.774 -4.835) 10.053 6.996 ( -3.317 8.572 2.680) 9.574 7.136 ( -1.130 1.511 -5.040) 5.382 7.467 ( -4.698 12.656 -7.264) 15.330 7.574 ( 1.456 -1.148 0.573) 1.941 7.817 ( 6.836 0.508 1.881) 7.108 7.887 ( -0.692 3.463 -6.532) 7.425 7.991 ( -7.666 0.147 2.555) 8.081 8.088 ( -7.609 3.734 -4.437) 9.567 8.133 ( -3.428 5.196 -5.186) 8.102 8.424 ( -2.075 -0.974 7.772) 8.103 8.580 ( -3.748 -2.251 -2.309) 4.945 8.698 ( 2.440 2.401 3.552) 4.933 8.814 ( 0.879 1.369 3.463) 3.826 9.089 ( -2.099 -7.164 -4.774) 8.862 9.170 ( -1.134 -6.222 -11.500) 13.124 9.423 ( -8.810 -3.187 6.791) 11.572 9.630 ( -0.811 -13.122 -0.160) 13.148 9.965 ( -2.809 -3.116 7.399) 8.505 10.026 ( 1.553 3.111 -1.536) 3.801 10.331 ( 8.936 -7.701 8.405) 14.485 10.444 ( -4.079 -4.604 6.756) 9.137 10.781 ( 1.084 3.679 -3.490) 5.186 10.886 ( -3.023 4.732 0.193) 5.618 11.044 ( 3.704 4.672 4.184) 7.284 11.169 ( 3.141 4.774 -2.244) 6.140 11.531 ( -0.953 11.922 1.901) 12.111 11.672 ( -4.407 11.337 -1.808) 12.297 12.004 ( -7.744 -6.689 1.367) 10.324 12.158 ( -10.339 -4.418 -0.052) 11.243 12.903 ( 5.156 0.080 4.088) 6.580 13.344 ( -3.398 -10.407 -7.314) 13.166 13.674 ( 5.402 -7.923 6.307) 11.477 13.851 ( 5.938 -7.778 -3.747) 10.478 13.895 ( 1.137 -11.843 -0.495) 11.908 13.986 ( 3.660 -10.160 -2.756) 11.145 14.306 ( -5.311 -10.382 4.919) 12.656 14.454 ( 0.150 -5.397 -1.465) 5.595 14.704 ( 2.835 2.557 -0.180) 3.822 15.148 ( -2.326 -12.651 -0.984) 12.901 15.557 ( 1.000 4.223 1.654) 4.645 15.669 ( 2.591 -7.889 -0.070) 8.304 15.792 ( -1.767 -4.793 2.715) 5.785 16.111 ( -1.485 13.095 -13.448) 18.829 16.586 ( 6.963 -0.936 8.160) 10.768 16.938 ( 4.168 -7.382 4.182) 9.453 17.170 ( 1.268 8.764 2.456) 9.190 17.374 ( 2.107 5.464 -3.827) 6.996 18.170 ( 4.363 9.528 4.945) 11.587 18.367 ( 11.139 7.517 -5.589) 14.554 24.439 ( 0.279 2.757 0.695) 2.857 24.488 ( -0.505 2.309 -0.946) 2.546 24.836 ( 2.646 2.017 1.122) 3.511 24.952 ( 1.571 0.103 -2.725) 3.147 25.422 ( 4.663 8.150 -1.530) 9.513 25.464 ( 4.932 7.785 -1.275) 9.304 25.920 ( 2.271 3.412 -1.572) 4.390 26.100 ( 0.647 1.188 -0.779) 1.561 26.666 ( -4.051 1.777 -1.409) 4.643 26.767 ( -12.522 1.541 2.081) 12.787 26.967 ( -9.131 2.867 -4.428) 10.545 27.150 ( -20.926 1.671 -13.354) 24.880 28.086 ( 2.513 -4.396 11.623) 12.678 28.439 ( -2.099 -15.652 3.044) 16.083 29.280 ( 4.720 -6.294 5.819) 9.785 29.485 ( 3.329 -10.156 2.906) 11.075 ======================= Grid point 219 (111/130) ======================= q-point: ( 0.00 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.360 ( -0.022 16.929 14.789) 22.479 2.601 ( 4.577 13.612 -2.920) 14.655 2.764 ( -0.167 19.211 0.962) 19.236 2.951 ( -1.349 20.556 -11.536) 23.610 3.654 ( -2.603 -14.059 7.144) 15.983 3.763 ( 0.896 -9.143 3.921) 9.988 3.787 ( 3.649 2.054 3.901) 5.723 4.011 ( -2.383 -1.371 -9.566) 9.954 4.665 ( 4.809 6.940 21.756) 23.337 4.992 ( 3.551 -0.378 8.286) 9.023 5.069 ( -8.791 5.140 -13.899) 17.230 5.250 ( -7.040 -3.579 -9.930) 12.688 5.675 ( -8.061 -4.154 11.501) 14.646 5.710 ( -8.591 -8.605 20.985) 24.253 5.989 ( 8.918 9.558 -7.127) 14.889 6.221 ( 11.304 -0.103 -22.745) 25.399 6.509 ( -6.214 -2.523 7.476) 10.043 6.707 ( 5.480 -6.835 -10.985) 14.050 7.123 ( 2.529 8.985 -1.454) 9.446 7.186 ( 5.564 5.647 -4.329) 9.033 7.301 ( -1.920 10.290 5.647) 11.894 7.442 ( -2.065 4.042 -7.119) 8.443 7.655 ( 1.169 0.387 -0.160) 1.242 7.672 ( -2.449 -2.608 -0.841) 3.676 7.973 ( 2.524 2.814 -0.692) 3.843 8.003 ( -7.134 2.965 -3.233) 8.375 8.225 ( 0.559 9.342 3.458) 9.977 8.288 ( 0.112 7.778 -2.015) 8.036 8.428 ( 5.181 1.446 6.005) 8.061 8.535 ( -2.299 2.194 -4.007) 5.114 8.705 ( 1.024 -4.842 5.854) 7.666 8.856 ( -4.213 -7.581 -7.136) 11.231 8.980 ( -2.424 6.089 4.587) 7.999 9.029 ( -0.245 5.139 -0.616) 5.182 9.296 ( -1.482 -4.213 2.634) 5.185 9.383 ( 3.667 -8.204 -4.338) 9.978 10.052 ( 0.474 3.366 6.006) 6.901 10.146 ( 2.187 4.776 -2.969) 6.034 10.275 ( -2.000 -7.472 9.089) 11.934 10.397 ( 2.580 -6.350 -2.531) 7.306 10.958 ( 4.599 8.581 0.215) 9.738 10.983 ( -2.862 10.844 -2.217) 11.432 11.203 ( 2.516 1.525 1.672) 3.384 11.255 ( -0.875 1.831 -3.715) 4.233 11.710 ( -0.187 6.254 2.923) 6.906 11.751 ( -1.743 4.480 -1.111) 4.934 11.868 ( -0.140 -2.381 3.223) 4.009 11.923 ( -0.701 -3.789 -1.961) 4.323 12.884 ( 1.384 -10.931 3.520) 11.567 12.955 ( -1.579 -15.281 -3.266) 15.705 13.651 ( -1.961 -0.470 1.708) 2.643 13.697 ( 0.940 -2.452 -2.629) 3.716 13.772 ( -1.786 -6.531 2.414) 7.188 13.824 ( 2.014 -7.322 -2.507) 7.997 14.086 ( -0.152 -7.549 3.320) 8.248 14.189 ( -0.084 -11.151 -5.734) 12.539 14.811 ( 1.894 -3.759 5.484) 6.913 14.873 ( -1.248 -8.045 0.135) 8.142 15.575 ( -1.670 -2.008 -0.097) 2.614 15.604 ( 2.624 -4.067 -2.708) 5.546 16.021 ( 3.794 17.035 10.544) 20.390 16.248 ( -5.595 14.731 -11.214) 19.341 16.634 ( 4.718 -9.213 5.590) 11.764 16.731 ( -5.443 -9.606 -3.119) 11.473 17.362 ( -0.896 5.461 5.211) 7.601 17.458 ( 2.225 1.654 -4.207) 5.038 18.415 ( -0.253 6.117 3.510) 7.057 18.514 ( 0.301 1.748 -5.885) 6.147 24.503 ( 0.153 2.146 0.710) 2.265 24.517 ( 0.088 1.524 -0.585) 1.635 24.913 ( 0.149 1.666 0.612) 1.781 24.949 ( 0.398 0.040 -2.549) 2.580 25.623 ( 1.316 5.000 -0.396) 5.185 25.645 ( 2.044 4.699 -2.430) 5.672 26.006 ( -0.371 1.717 -0.050) 1.758 26.029 ( -2.763 0.869 -1.917) 3.473 26.659 ( -2.063 1.683 2.830) 3.885 26.691 ( 2.188 0.107 0.610) 2.274 26.892 ( -1.267 3.768 -2.538) 4.716 26.922 ( -1.974 2.174 -4.414) 5.302 28.101 ( -0.524 -4.391 9.667) 10.630 28.203 ( 2.292 -9.799 1.476) 10.171 29.277 ( 0.401 -2.966 2.450) 3.868 29.345 ( 0.073 -6.045 -3.209) 6.844 ======================= Grid point 220 (112/130) ======================= q-point: ( 0.10 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.515 ( 5.081 12.976 10.406) 17.392 2.625 ( 7.652 8.520 -15.743) 19.467 2.891 ( 8.691 21.256 -1.224) 22.997 3.034 ( 14.074 16.814 1.873) 22.007 3.755 ( 9.004 -9.552 3.873) 13.686 3.841 ( 6.273 -8.408 -0.114) 10.490 3.930 ( 7.337 -1.081 -4.240) 8.543 4.026 ( 8.594 -1.125 1.910) 8.875 4.742 ( -5.148 4.682 -10.680) 12.747 4.932 ( -4.367 4.857 11.937) 13.607 5.072 ( 4.868 4.022 4.561) 7.790 5.282 ( 10.517 -1.211 8.932) 13.851 5.619 ( -7.184 -0.578 9.284) 11.753 5.717 ( -8.334 -7.207 17.977) 21.085 6.070 ( 7.352 2.941 -10.827) 13.413 6.202 ( 2.021 -5.742 -13.141) 14.483 6.469 ( 3.668 6.736 -3.238) 8.325 6.824 ( 10.020 -5.373 -5.245) 12.521 7.065 ( -4.012 6.473 -4.091) 8.645 7.113 ( -6.893 3.541 -8.354) 11.395 7.349 ( 3.512 11.570 3.707) 12.647 7.528 ( 10.042 5.387 0.483) 11.406 7.591 ( -2.854 1.610 -0.179) 3.282 7.772 ( 4.158 0.975 2.010) 4.720 7.881 ( -2.200 -2.732 0.470) 3.539 8.009 ( -2.620 -1.909 5.214) 6.139 8.143 ( -3.585 12.192 -1.987) 12.863 8.287 ( 0.276 6.931 1.883) 7.187 8.479 ( 1.830 1.059 -1.675) 2.698 8.589 ( 3.114 -1.209 -3.272) 4.676 8.716 ( 0.570 -3.689 0.345) 3.749 8.817 ( -2.449 -0.741 5.069) 5.678 8.945 ( -5.941 4.495 3.564) 8.258 8.997 ( 2.522 1.318 -0.140) 2.849 9.348 ( 4.690 -4.332 1.185) 6.494 9.491 ( 9.687 -5.891 -2.370) 11.583 10.067 ( -2.133 3.866 2.630) 5.139 10.122 ( -0.518 3.213 -6.491) 7.261 10.252 ( -6.545 -5.793 4.505) 9.833 10.383 ( -0.518 -9.669 -5.039) 10.916 10.926 ( -0.382 11.317 -2.967) 11.706 11.038 ( 1.946 7.346 -0.741) 7.635 11.191 ( -1.641 2.392 -1.926) 3.482 11.234 ( 0.234 3.225 -0.314) 3.249 11.728 ( 1.844 5.610 1.152) 6.016 11.837 ( 7.707 8.130 1.923) 11.366 11.882 ( 4.643 -5.046 0.765) 6.900 12.079 ( 12.645 -3.200 0.934) 13.077 12.877 ( -2.948 -10.269 -1.920) 10.855 12.944 ( 1.003 -14.704 2.634) 14.972 13.595 ( -5.645 -1.880 2.729) 6.545 13.668 ( -2.153 -0.569 -2.008) 2.999 13.723 ( -4.143 -5.798 2.011) 7.404 13.816 ( -1.293 -7.378 -1.959) 7.743 14.145 ( 2.025 -9.499 2.502) 10.030 14.190 ( 4.086 -12.281 -2.391) 13.162 14.816 ( -1.946 -1.708 -1.845) 3.179 14.893 ( 2.029 -8.359 1.526) 8.736 15.527 ( -3.066 -0.489 -0.207) 3.111 15.605 ( -0.840 -2.673 -1.463) 3.161 16.052 ( -5.448 10.659 -9.389) 15.214 16.167 ( 1.204 17.477 12.314) 21.413 16.540 ( -9.630 -9.665 -2.565) 13.883 16.761 ( 1.739 -9.929 4.167) 10.908 17.363 ( -2.237 6.043 3.238) 7.211 17.451 ( 1.263 2.471 -5.292) 5.975 18.375 ( -7.156 4.646 3.194) 9.110 18.403 ( -6.635 3.347 -3.786) 8.340 24.505 ( -0.009 2.329 -0.157) 2.334 24.524 ( 0.906 1.564 -0.245) 1.824 24.889 ( -2.696 1.638 0.021) 3.155 24.926 ( -1.390 0.037 -1.042) 1.738 25.578 ( -3.552 5.947 -1.896) 7.182 25.629 ( -1.664 4.116 -3.491) 5.648 25.948 ( -2.828 3.674 2.117) 5.097 26.060 ( 0.424 -0.936 1.870) 2.134 26.688 ( 4.826 2.729 0.982) 5.631 26.784 ( 8.681 -1.901 -0.014) 8.886 26.988 ( 11.370 4.938 0.872) 12.427 27.040 ( 11.923 1.756 2.898) 12.396 28.120 ( -2.391 -4.014 2.830) 5.462 28.259 ( 4.506 -8.597 -3.864) 10.448 29.267 ( -4.161 -5.389 -0.221) 6.812 29.268 ( -4.319 -6.013 -0.857) 7.453 ======================= Grid point 221 (113/130) ======================= q-point: ( 0.20 0.38 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.645 ( 10.709 12.223 -10.222) 19.198 2.765 ( 12.432 5.244 1.762) 13.608 3.007 ( 9.634 20.528 -8.599) 24.252 3.342 ( 10.378 3.567 10.338) 15.077 3.900 ( 1.562 -8.123 -8.684) 11.993 3.964 ( 6.065 -7.137 -4.457) 10.373 4.067 ( 13.517 0.352 4.031) 14.110 4.242 ( 6.846 2.032 9.912) 12.217 4.733 ( 13.091 2.654 -6.961) 15.063 4.896 ( 1.132 -0.934 3.228) 3.546 5.272 ( -2.554 10.681 10.397) 15.123 5.552 ( 0.739 -1.921 5.417) 5.795 5.569 ( 1.958 1.361 12.375) 12.602 5.690 ( -2.667 -2.150 10.417) 10.966 6.064 ( 3.376 1.261 -8.404) 9.144 6.204 ( 7.619 -2.380 -12.539) 14.864 6.492 ( 0.153 11.098 -6.044) 12.638 6.803 ( -10.647 5.116 -5.159) 12.889 6.956 ( 0.249 0.898 -4.018) 4.124 7.037 ( 2.197 -4.815 -1.171) 5.421 7.398 ( -1.674 6.969 0.947) 7.229 7.511 ( -5.488 2.999 -0.072) 6.254 7.734 ( 10.498 5.092 1.665) 11.786 7.792 ( 0.558 7.166 1.275) 7.300 7.890 ( 0.832 -0.718 -2.822) 3.028 8.045 ( 8.088 -3.847 5.472) 10.496 8.240 ( 5.670 7.369 9.466) 13.269 8.328 ( 2.452 3.548 0.393) 4.331 8.516 ( 1.042 -2.298 0.092) 2.525 8.543 ( 0.817 -3.259 -4.424) 5.555 8.723 ( -4.941 4.322 0.180) 6.567 8.785 ( -1.630 -3.246 2.294) 4.296 8.931 ( 3.847 3.494 4.567) 6.919 9.120 ( 6.094 -0.853 5.030) 7.947 9.466 ( 7.004 -1.396 0.531) 7.161 9.643 ( 7.193 -4.815 -3.549) 9.355 10.032 ( -2.054 3.133 -1.182) 3.929 10.053 ( -0.803 -0.804 -5.311) 5.431 10.117 ( -5.899 -4.042 -4.629) 8.519 10.319 ( -2.136 -10.204 -3.934) 11.143 10.921 ( 1.448 8.266 -2.375) 8.721 10.999 ( -2.351 7.154 -1.323) 7.646 11.164 ( -2.935 4.496 2.220) 5.810 11.255 ( 2.515 3.946 -0.938) 4.773 11.807 ( 5.774 8.736 0.766) 10.499 11.990 ( 9.062 5.535 -1.922) 10.792 12.068 ( 11.041 -0.635 3.491) 11.597 12.328 ( 12.213 -3.019 -0.283) 12.584 12.812 ( -1.331 -6.040 -2.305) 6.601 12.982 ( 0.236 -16.753 3.808) 17.182 13.485 ( -7.905 -0.684 1.234) 8.030 13.598 ( -4.345 -0.879 -0.152) 4.435 13.671 ( -2.860 -6.004 1.433) 6.803 13.749 ( -3.996 -7.249 -1.823) 8.476 14.167 ( -0.342 -10.975 -0.334) 10.986 14.255 ( 1.624 -13.785 1.299) 13.941 14.804 ( 3.797 2.958 -1.752) 5.122 14.937 ( 2.584 -8.720 -0.348) 9.101 15.464 ( -3.775 1.349 0.371) 4.026 15.562 ( -2.600 -0.498 0.189) 2.654 15.900 ( -2.888 2.441 -9.367) 10.101 16.251 ( -3.287 12.580 11.290) 17.220 16.343 ( -9.390 -9.213 -0.833) 13.181 16.737 ( -6.130 -6.547 -1.400) 9.077 17.365 ( 0.343 6.690 3.407) 7.516 17.439 ( 2.245 3.210 -4.152) 5.708 18.211 ( -10.036 4.799 -0.323) 11.129 18.252 ( -8.350 3.252 0.189) 8.963 24.509 ( 0.879 2.882 -0.778) 3.112 24.547 ( 1.885 1.395 -0.152) 2.350 24.830 ( -3.375 2.090 -0.100) 3.971 24.887 ( -2.535 -0.450 1.199) 2.840 25.491 ( -3.688 5.458 -2.524) 7.054 25.541 ( -3.710 3.248 -4.277) 6.527 25.915 ( -3.768 3.984 2.938) 6.221 26.027 ( -5.246 -0.741 1.830) 5.605 26.862 ( 12.253 4.701 1.360) 13.194 27.015 ( 13.664 -2.185 1.529) 13.922 27.248 ( 13.358 5.820 2.733) 14.825 27.327 ( 12.156 -0.132 8.789) 15.001 28.086 ( 0.085 -0.741 -4.433) 4.495 28.316 ( 5.644 -7.354 -3.399) 9.874 29.110 ( -8.060 -4.916 -4.537) 10.474 29.205 ( -4.223 -10.538 0.653) 11.372 ======================= Grid point 222 (114/130) ======================= q-point: ( 0.30 0.38 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.840 ( 18.721 11.358 -7.443) 23.128 3.031 ( 14.632 4.102 -0.601) 15.208 3.145 ( 11.671 15.718 -4.794) 20.155 3.571 ( 6.329 -0.171 8.917) 10.936 3.797 ( -1.831 -5.491 -8.100) 9.955 4.031 ( 3.491 -6.331 1.539) 7.392 4.323 ( 6.123 -0.711 1.744) 6.406 4.380 ( 0.495 1.198 14.774) 14.831 4.854 ( -14.186 4.307 5.039) 15.658 5.061 ( 17.860 2.162 -2.240) 18.129 5.203 ( 3.841 5.321 -4.978) 8.237 5.349 ( -17.759 -9.080 4.470) 20.440 5.829 ( 8.965 2.901 2.915) 9.864 5.843 ( 6.099 4.144 6.746) 9.994 6.085 ( 5.004 7.903 -5.797) 11.005 6.207 ( 5.068 1.599 -16.866) 17.683 6.361 ( -8.741 10.203 -3.658) 13.924 6.571 ( -10.408 6.057 1.263) 12.108 6.921 ( -2.748 1.144 1.748) 3.452 7.079 ( 3.468 -6.065 -2.660) 7.476 7.365 ( -0.415 -0.881 0.808) 1.266 7.437 ( -1.070 -0.216 -0.599) 1.245 7.797 ( 2.112 9.677 -0.379) 9.912 7.908 ( 6.855 4.836 -0.840) 8.431 8.045 ( 10.504 2.424 3.047) 11.203 8.216 ( 5.505 -0.346 1.043) 5.613 8.366 ( 2.451 2.865 1.004) 3.901 8.399 ( 1.927 2.614 6.829) 7.562 8.529 ( 1.939 2.202 2.139) 3.632 8.560 ( -1.427 -4.461 5.698) 7.376 8.628 ( -2.090 4.093 -0.977) 4.699 8.839 ( 4.309 -5.607 2.137) 7.387 9.077 ( 6.256 -0.214 2.965) 6.927 9.262 ( 4.276 -2.478 4.415) 6.627 9.601 ( 5.391 0.489 1.011) 5.507 9.650 ( 0.281 1.607 -5.026) 5.284 9.970 ( 0.790 -4.180 -10.424) 11.258 10.002 ( 0.780 -3.193 -7.148) 7.868 10.080 ( 2.089 -0.812 3.052) 3.787 10.249 ( -2.167 -7.570 -2.592) 8.290 10.897 ( -1.361 8.690 -1.353) 8.900 11.011 ( 2.623 7.044 0.194) 7.519 11.121 ( -3.388 4.356 3.468) 6.518 11.282 ( 0.575 1.236 0.205) 1.379 11.938 ( 7.499 12.626 -0.093) 14.686 12.142 ( 8.834 8.436 -2.450) 12.458 12.285 ( 8.719 -1.691 2.939) 9.355 12.476 ( 4.047 -0.806 -0.662) 4.179 12.817 ( 4.308 -4.834 -3.994) 7.608 13.022 ( 0.760 -16.090 4.223) 16.652 13.335 ( -8.765 1.150 0.265) 8.844 13.485 ( -7.364 -3.357 -0.908) 8.144 13.635 ( -1.548 -7.473 -1.486) 7.775 13.671 ( -2.557 -7.728 0.505) 8.156 14.140 ( -2.052 -8.890 0.879) 9.166 14.260 ( -1.400 -11.969 0.455) 12.059 14.932 ( 9.440 1.816 0.147) 9.614 14.997 ( 3.875 -5.194 0.710) 6.519 15.391 ( -4.874 2.958 1.514) 5.898 15.530 ( -0.816 -2.136 0.279) 2.303 15.786 ( -0.782 -2.967 -10.170) 10.622 16.143 ( -9.807 -12.949 0.852) 16.266 16.264 ( -5.346 9.817 6.907) 13.140 16.542 ( -10.118 -1.592 -5.693) 11.718 17.433 ( 3.518 6.474 3.604) 8.203 17.481 ( 4.311 3.246 -0.607) 5.430 18.027 ( -9.398 5.030 -0.107) 10.660 18.100 ( -7.480 2.406 -0.975) 7.918 24.525 ( 1.478 3.549 -0.659) 3.901 24.593 ( 3.044 0.962 0.024) 3.193 24.767 ( -3.257 2.877 -0.189) 4.350 24.855 ( -2.404 -0.772 1.790) 3.096 25.415 ( -1.770 4.037 -2.339) 4.990 25.452 ( -1.779 2.297 -3.487) 4.539 25.843 ( -6.123 3.414 1.985) 7.286 25.913 ( -7.962 0.626 0.863) 8.033 27.129 ( 13.478 6.952 3.215) 15.502 27.257 ( 9.610 0.639 3.550) 10.265 27.479 ( 6.657 4.118 4.225) 8.896 27.583 ( 9.137 -2.056 7.363) 11.913 28.058 ( 1.959 5.926 -8.033) 10.172 28.441 ( 6.869 -3.733 4.034) 8.798 28.909 ( -7.832 -8.617 -7.009) 13.591 29.138 ( -1.661 -15.638 -3.157) 16.039 ======================= Grid point 223 (115/130) ======================= q-point: ( 0.40 0.38 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.204 ( 22.720 6.516 -3.402) 23.880 3.276 ( 15.951 8.155 -4.118) 18.382 3.337 ( 6.817 5.121 3.142) 9.087 3.685 ( -0.059 -1.863 2.817) 3.377 3.769 ( 1.897 3.305 1.322) 4.034 4.156 ( 6.419 -1.687 4.755) 8.165 4.257 ( -11.368 -1.534 -1.740) 11.602 4.480 ( -13.696 10.120 11.632) 20.623 4.587 ( 1.040 -3.563 1.166) 3.890 5.040 ( -12.315 -13.511 -3.087) 18.540 5.260 ( -1.003 2.629 2.426) 3.716 5.284 ( 2.711 3.713 0.372) 4.613 5.871 ( -1.689 5.278 -4.722) 7.280 5.909 ( 2.036 2.904 -6.446) 7.357 6.133 ( -2.770 12.831 -3.286) 13.532 6.181 ( 1.717 5.656 -8.604) 10.439 6.223 ( 7.808 4.991 -4.611) 10.351 6.451 ( -6.012 5.507 3.477) 8.863 6.916 ( -0.646 -0.892 6.135) 6.233 7.115 ( 2.454 -7.224 -2.891) 8.159 7.397 ( 1.537 -0.897 3.187) 3.650 7.466 ( 3.945 -2.385 -0.723) 4.666 7.868 ( 3.761 8.213 0.103) 9.034 7.962 ( 1.083 6.869 -3.190) 7.651 8.197 ( 2.206 0.203 4.357) 4.888 8.281 ( 3.903 3.180 -3.920) 6.381 8.392 ( -0.823 4.129 -1.132) 4.359 8.444 ( 0.579 1.329 2.733) 3.094 8.576 ( 0.082 -0.557 10.557) 10.572 8.639 ( 2.700 1.849 4.311) 5.412 8.696 ( 7.289 1.671 2.586) 7.913 8.913 ( 0.921 -5.997 1.631) 6.283 9.136 ( 0.324 -0.726 -2.152) 2.295 9.328 ( 0.012 -6.444 0.663) 6.478 9.638 ( 1.340 3.205 3.892) 5.217 9.709 ( 2.924 -0.948 -0.301) 3.089 9.916 ( 2.427 -1.161 -9.916) 10.274 9.961 ( 1.390 -3.754 -7.967) 8.916 10.154 ( 2.279 -2.004 2.854) 4.166 10.214 ( 0.203 -4.375 -1.242) 4.553 10.886 ( 0.726 10.582 0.532) 10.621 11.008 ( -2.462 8.115 -0.688) 8.508 11.148 ( 2.442 1.858 3.878) 4.945 11.283 ( -0.671 -1.084 0.404) 1.338 12.069 ( 6.232 14.432 0.217) 15.722 12.248 ( 4.033 10.980 -3.389) 12.179 12.417 ( 2.086 -0.131 4.932) 5.356 12.524 ( 3.432 -1.906 -1.070) 4.069 12.862 ( 3.772 -2.805 -4.631) 6.599 13.086 ( 2.466 -12.413 3.808) 13.216 13.154 ( -9.652 -1.265 -2.310) 10.005 13.345 ( -6.417 -6.852 -0.371) 9.394 13.615 ( 1.788 -8.815 -2.765) 9.410 13.647 ( -1.428 -7.804 0.900) 7.985 14.124 ( -1.306 -6.322 2.932) 7.090 14.228 ( -1.355 -9.379 -1.136) 9.545 15.077 ( 6.242 -2.352 -1.837) 6.919 15.116 ( 4.760 1.838 5.649) 7.612 15.318 ( -2.974 1.519 1.073) 3.508 15.526 ( -0.469 -5.312 -0.597) 5.366 15.717 ( 1.977 -2.705 -8.080) 8.748 15.975 ( -8.434 -9.002 -0.603) 12.350 16.203 ( -5.143 1.863 3.511) 6.500 16.330 ( -6.946 -1.007 -4.217) 8.188 17.542 ( 4.603 5.761 4.047) 8.412 17.575 ( 5.023 3.056 1.142) 5.990 17.867 ( -7.485 5.449 -0.105) 9.259 17.963 ( -5.572 2.179 -2.834) 6.620 24.554 ( 1.961 4.036 0.251) 4.494 24.656 ( 3.439 -0.205 0.113) 3.447 24.704 ( -3.173 4.127 -0.616) 5.242 24.815 ( -3.004 -0.629 0.309) 3.084 25.406 ( 2.304 3.014 -0.558) 3.834 25.438 ( 2.425 1.499 -1.339) 3.150 25.727 ( -6.912 2.769 0.236) 7.450 25.759 ( -8.340 1.752 -0.414) 8.532 27.363 ( 7.127 5.808 3.461) 9.824 27.447 ( 7.342 2.985 6.121) 10.014 27.548 ( -0.696 3.925 4.075) 5.701 27.824 ( 9.223 -4.481 7.093) 12.469 28.019 ( 2.226 14.689 -9.440) 17.602 28.490 ( -9.302 8.883 3.330) 13.287 28.808 ( 4.829 -21.314 -3.917) 22.203 29.090 ( 0.268 -19.967 -6.383) 20.964 ======================= Grid point 224 (116/130) ======================= q-point: (-0.50 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.333 ( -10.580 3.707 3.979) 11.896 3.433 ( 6.270 0.737 -3.620) 7.277 3.655 ( -0.296 8.007 0.880) 8.061 3.689 ( 11.704 6.488 0.075) 13.382 3.805 ( 6.454 0.444 5.223) 8.315 3.920 ( -16.033 -2.605 -4.614) 16.886 4.281 ( -0.546 7.408 6.963) 10.181 4.391 ( 3.460 7.171 -2.377) 8.309 4.732 ( 6.886 -9.990 6.717) 13.869 4.864 ( -5.612 -11.852 -6.118) 14.470 5.206 ( -3.548 3.524 7.126) 8.705 5.256 ( -3.226 3.098 2.263) 5.012 5.795 ( -2.799 5.931 -2.053) 6.872 5.854 ( -1.186 3.112 -7.189) 7.924 6.033 ( -6.946 10.035 2.206) 12.402 6.184 ( 4.647 3.112 -10.127) 11.568 6.358 ( 6.037 9.336 -0.187) 11.119 6.392 ( 1.267 7.513 -2.721) 8.091 6.961 ( -2.478 -3.307 8.506) 9.457 7.136 ( 4.724 -8.584 -6.726) 11.885 7.458 ( 1.646 -0.478 2.759) 3.249 7.523 ( 2.475 -2.818 -2.860) 4.717 7.871 ( -4.607 7.784 3.084) 9.556 7.934 ( -0.960 7.376 -1.929) 7.684 8.233 ( -2.230 3.298 3.387) 5.227 8.289 ( 0.568 4.636 -2.101) 5.122 8.359 ( -4.051 1.922 4.372) 6.262 8.480 ( 3.797 1.732 -4.029) 5.800 8.675 ( 2.159 1.176 4.711) 5.314 8.721 ( 3.736 3.253 0.873) 5.030 8.831 ( 2.453 -2.946 3.653) 5.295 8.885 ( -2.416 -5.410 -1.206) 6.047 9.153 ( 1.076 -2.223 4.268) 4.931 9.262 ( -4.070 -5.775 -4.040) 8.139 9.663 ( -3.934 1.896 4.836) 6.516 9.730 ( -1.856 -2.038 3.541) 4.487 9.878 ( -0.196 0.141 -5.954) 5.959 9.941 ( 3.379 -3.612 -7.722) 9.170 10.200 ( 1.210 -1.830 0.326) 2.218 10.228 ( 2.404 -2.554 -2.276) 4.181 10.922 ( 1.168 10.463 1.614) 10.651 10.958 ( -0.614 9.296 -1.659) 9.463 11.222 ( 1.817 0.614 2.829) 3.418 11.265 ( -0.608 -1.162 -1.120) 1.724 12.160 ( 1.763 13.378 2.169) 13.667 12.223 ( -2.629 13.042 -3.959) 13.881 12.471 ( -0.832 -0.020 5.708) 5.769 12.567 ( 1.813 -3.169 -2.926) 4.679 12.891 ( -1.956 -0.960 2.256) 3.136 12.968 ( -2.547 -0.270 -4.708) 5.360 13.163 ( -0.921 -10.650 5.424) 11.987 13.266 ( 2.036 -11.682 -3.983) 12.509 13.612 ( -2.232 -7.015 0.938) 7.422 13.656 ( 3.881 -8.829 -3.421) 10.233 14.135 ( -0.771 -5.482 3.930) 6.789 14.204 ( 0.683 -7.884 -2.570) 8.320 15.107 ( -6.649 1.753 5.964) 9.103 15.206 ( 7.447 -0.797 -3.832) 8.413 15.361 ( 3.876 -1.228 3.556) 5.401 15.454 ( -5.408 -8.371 -4.099) 10.776 15.762 ( 5.884 1.468 0.182) 6.067 15.811 ( -6.988 -0.986 -3.766) 8.000 16.173 ( -0.099 -4.788 3.276) 5.802 16.241 ( 0.160 -4.557 -3.029) 5.474 17.607 ( -4.467 4.593 5.709) 8.581 17.684 ( 6.716 2.398 -2.081) 7.429 17.781 ( -1.713 6.146 2.436) 6.829 17.866 ( 0.348 3.230 -5.297) 6.213 24.602 ( 2.401 4.092 1.321) 4.925 24.631 ( -2.961 3.678 -1.451) 4.940 24.728 ( 2.169 -0.064 1.283) 2.521 24.754 ( -1.999 -0.284 -1.207) 2.352 25.470 ( 2.561 2.468 -0.093) 3.558 25.486 ( 1.202 1.629 -1.561) 2.557 25.628 ( -1.793 2.556 0.611) 3.181 25.638 ( -1.504 2.070 -0.302) 2.577 27.463 ( 0.850 2.563 3.515) 4.433 27.499 ( -1.550 1.119 0.358) 1.945 27.662 ( 2.588 9.886 11.133) 15.112 27.853 ( -3.751 6.149 -5.436) 9.024 28.143 ( 4.917 6.372 4.657) 9.298 28.267 ( -4.776 6.125 -5.826) 9.709 28.903 ( 2.730 -18.159 2.838) 18.581 29.026 ( -0.918 -22.394 -8.414) 23.940 ======================= Grid point 225 (117/130) ======================= q-point: (-0.40 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.083 ( -18.137 11.237 4.328) 21.770 3.225 ( -22.908 11.472 1.839) 25.686 3.521 ( -5.220 -3.160 -11.125) 12.688 3.667 ( -5.621 -8.326 2.261) 10.297 3.799 ( -3.037 8.613 0.438) 9.143 4.194 ( 16.332 -6.886 4.312) 18.241 4.239 ( -2.216 8.111 -0.585) 8.428 4.549 ( 12.114 7.143 -1.856) 14.185 4.690 ( -4.948 -7.720 -3.366) 9.767 4.933 ( 10.136 -10.593 5.994) 15.840 5.237 ( -2.913 5.371 4.036) 7.323 5.277 ( -1.662 2.152 4.206) 5.009 5.737 ( -6.904 2.824 7.139) 10.325 5.762 ( -4.304 2.249 4.255) 6.456 5.972 ( -0.025 10.236 0.858) 10.272 6.147 ( -1.280 1.997 -2.017) 3.114 6.348 ( 1.820 12.586 -9.281) 15.743 6.541 ( 12.011 9.511 -4.690) 16.022 6.959 ( -2.549 -3.450 5.258) 6.786 7.158 ( 3.117 -6.365 -9.304) 11.696 7.469 ( -1.359 -1.057 -1.641) 2.379 7.494 ( -1.159 -1.633 -4.755) 5.159 7.816 ( -4.579 8.078 6.639) 11.415 7.896 ( -2.571 5.038 0.536) 5.681 8.181 ( -4.821 3.879 4.211) 7.485 8.262 ( -4.453 0.452 -1.388) 4.686 8.321 ( -3.541 8.516 6.504) 11.285 8.514 ( 3.798 1.334 -4.505) 6.042 8.726 ( 2.702 3.185 -2.952) 5.114 8.733 ( -2.164 -0.530 -4.075) 4.644 8.758 ( -5.853 0.507 -1.886) 6.171 8.925 ( 1.828 -7.945 1.165) 8.236 9.121 ( -4.044 -3.548 0.068) 5.380 9.265 ( 1.544 -6.934 5.644) 9.073 9.594 ( -7.305 1.387 5.989) 9.547 9.683 ( -6.456 -2.286 4.862) 8.399 9.819 ( -1.904 1.780 -4.294) 5.023 9.927 ( -0.317 -4.592 -3.287) 5.657 10.212 ( 1.027 -1.783 -1.903) 2.803 10.244 ( 2.012 -3.523 -4.918) 6.375 10.905 ( -0.883 10.107 -1.169) 10.213 11.003 ( 3.539 9.453 -0.147) 10.095 11.214 ( -1.405 0.702 -1.567) 2.218 11.287 ( 1.923 0.366 -0.197) 1.967 12.081 ( -7.950 14.390 -0.888) 16.463 12.183 ( -3.575 9.719 2.193) 10.586 12.471 ( -3.244 -2.264 2.608) 4.738 12.528 ( -2.880 -2.132 -3.403) 4.942 12.776 ( -6.822 -2.866 2.666) 7.865 13.041 ( 1.739 -3.845 5.513) 6.943 13.166 ( 4.388 -8.491 -1.260) 9.641 13.357 ( 7.376 -6.815 -1.477) 10.150 13.578 ( -1.195 -5.865 0.111) 5.987 13.698 ( 3.297 -9.438 -3.308) 10.530 14.143 ( -1.083 -5.479 2.101) 5.967 14.227 ( 3.654 -9.314 -1.792) 10.164 15.006 ( -7.641 0.095 3.813) 8.540 15.271 ( -5.909 -7.044 -7.056) 11.590 15.335 ( 4.695 -0.813 -0.181) 4.768 15.448 ( 1.402 -2.386 5.229) 5.916 15.661 ( -4.775 3.763 -2.617) 6.619 15.927 ( 8.663 0.466 3.695) 9.429 16.252 ( 5.472 -5.911 3.118) 8.638 16.273 ( 5.591 -4.189 -3.161) 7.668 17.513 ( -7.375 7.180 2.671) 10.634 17.676 ( -3.471 0.563 -3.256) 4.793 17.864 ( 8.042 6.153 0.142) 10.127 17.937 ( 7.842 3.293 -1.036) 8.568 24.566 ( -2.663 3.882 -0.864) 4.786 24.646 ( -1.449 0.781 1.033) 1.944 24.700 ( 1.290 3.373 -0.276) 3.622 24.811 ( 3.813 -0.950 0.708) 3.993 25.428 ( -2.373 2.401 -2.634) 4.282 25.440 ( -2.548 2.116 -1.576) 3.668 25.717 ( 7.861 2.613 1.153) 8.364 25.734 ( 7.883 2.122 1.901) 8.382 27.403 ( -6.752 4.225 -0.180) 7.967 27.498 ( -4.385 -0.389 1.283) 4.585 27.638 ( -5.095 7.513 -0.349) 9.084 27.839 ( -0.292 13.433 5.179) 14.400 27.918 ( -13.922 1.805 -2.491) 14.258 28.499 ( 16.069 1.353 2.464) 16.313 28.833 ( -9.332 -20.987 -5.820) 23.694 29.004 ( 2.498 -16.772 0.422) 16.962 ======================= Grid point 226 (118/130) ======================= q-point: (-0.30 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.719 ( -22.683 16.109 3.107) 27.995 2.896 ( -14.920 18.957 6.440) 24.969 3.270 ( -10.574 -3.023 -9.663) 14.640 3.643 ( -1.871 -11.523 5.387) 12.857 3.685 ( -7.561 4.974 -1.066) 9.113 4.092 ( -5.529 -4.177 -4.153) 8.079 4.384 ( -6.069 -0.300 -3.640) 7.083 4.544 ( -0.526 -5.559 -0.612) 5.617 4.893 ( 6.354 8.024 1.974) 10.423 5.045 ( -6.620 0.921 0.904) 6.745 5.100 ( -10.233 7.293 3.112) 12.945 5.310 ( 14.739 -5.144 5.766) 16.642 5.701 ( -6.766 2.983 15.744) 17.394 5.805 ( -0.573 -3.772 12.037) 12.627 5.978 ( -2.170 5.817 1.065) 6.299 6.037 ( -8.997 4.781 -4.545) 11.156 6.410 ( 11.356 12.546 -7.167) 18.377 6.698 ( 10.741 9.815 -9.073) 17.148 6.981 ( 1.489 -4.844 2.166) 5.511 7.096 ( 0.024 -1.116 -9.188) 9.256 7.421 ( 0.556 0.610 -4.388) 4.465 7.458 ( 1.100 1.031 -2.493) 2.913 7.778 ( -3.474 6.380 1.366) 7.392 7.860 ( -3.360 3.036 3.947) 6.008 8.107 ( -9.194 3.890 -1.635) 10.116 8.154 ( -3.716 -0.180 5.341) 6.509 8.302 ( -3.557 8.629 3.982) 10.147 8.518 ( -4.689 0.919 -1.002) 4.883 8.611 ( -3.403 4.562 -6.933) 8.970 8.639 ( -2.449 -0.952 -3.268) 4.194 8.745 ( 3.514 -0.367 -6.568) 7.458 8.901 ( -2.494 -4.366 -3.672) 6.227 9.099 ( -1.263 -7.951 1.725) 8.233 9.301 ( -1.679 -6.329 2.742) 7.099 9.510 ( -7.040 0.556 6.596) 9.663 9.576 ( -9.014 -1.002 4.703) 10.216 9.768 ( -1.323 1.102 3.650) 4.036 9.905 ( -0.571 -3.142 1.709) 3.622 10.185 ( -1.347 -3.132 -5.971) 6.876 10.247 ( 2.893 -4.772 -2.558) 6.139 10.895 ( 0.726 8.674 -1.084) 8.772 11.034 ( 0.064 7.477 -1.802) 7.691 11.198 ( 2.349 3.407 -3.076) 5.156 11.296 ( -0.432 2.883 -1.467) 3.263 11.926 ( -8.204 13.309 1.180) 15.679 12.082 ( -8.668 5.876 2.682) 10.810 12.346 ( -9.352 -1.040 -2.413) 9.714 12.447 ( -6.527 -2.461 2.177) 7.307 12.725 ( -1.749 -3.842 3.949) 5.781 13.051 ( -1.443 -17.293 1.347) 17.405 13.324 ( 9.177 2.456 1.361) 9.597 13.484 ( 7.223 -3.147 -0.155) 7.880 13.594 ( 2.994 -6.555 0.127) 7.208 13.726 ( 2.777 -9.135 -3.146) 10.053 14.141 ( -0.179 -6.103 0.934) 6.177 14.284 ( 3.253 -11.476 -1.747) 12.056 14.895 ( -7.092 -1.107 2.326) 7.545 15.066 ( -8.955 -6.979 -4.083) 12.065 15.437 ( 5.593 -1.300 -2.667) 6.331 15.510 ( 1.201 -4.114 4.452) 6.179 15.617 ( 0.832 7.710 2.510) 8.151 16.124 ( 9.108 -3.922 3.323) 10.459 16.371 ( 7.123 1.831 -3.527) 8.156 16.419 ( 8.702 -4.030 4.980) 10.805 17.404 ( -6.226 8.380 2.360) 10.703 17.578 ( -2.986 1.152 -5.155) 6.068 18.029 ( 9.514 5.754 -0.287) 11.122 18.094 ( 9.484 3.066 -0.438) 9.977 24.520 ( -1.852 3.404 -0.174) 3.879 24.591 ( -3.188 0.223 0.025) 3.196 24.764 ( 3.882 3.993 0.236) 5.574 24.880 ( 3.304 -1.126 -0.350) 3.508 25.402 ( 1.502 2.750 -1.348) 3.411 25.414 ( 1.045 2.676 -0.008) 2.873 25.866 ( 7.181 3.173 -0.326) 7.858 25.906 ( 8.330 1.759 1.561) 8.656 27.197 ( -13.845 6.148 -2.761) 15.398 27.314 ( -12.521 0.392 -1.250) 12.589 27.596 ( -7.462 8.568 -7.526) 13.628 27.641 ( -5.620 2.562 4.304) 7.528 27.890 ( -2.214 1.765 7.365) 7.891 28.532 ( -17.449 -21.136 -4.729) 27.813 28.809 ( 15.111 -0.172 1.470) 15.183 29.076 ( 4.268 -11.318 1.975) 12.256 ======================= Grid point 227 (119/130) ======================= q-point: (-0.20 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.400 ( -15.674 19.317 9.037) 26.467 2.721 ( -10.915 21.795 7.584) 25.528 3.017 ( -7.980 2.339 -8.563) 11.937 3.512 ( -9.020 -1.799 -5.314) 10.622 3.673 ( -2.492 -9.528 10.305) 14.255 3.957 ( -8.617 -2.391 -1.488) 9.066 4.094 ( -17.754 3.225 -0.566) 18.053 4.454 ( -11.367 2.946 -7.991) 14.204 4.581 ( -15.572 1.102 7.855) 17.475 4.885 ( -8.797 -0.392 1.715) 8.971 5.377 ( 15.138 5.430 2.193) 16.231 5.604 ( 6.216 -4.996 9.271) 12.229 5.669 ( -8.314 4.037 7.689) 12.022 5.794 ( -8.697 6.089 -5.015) 11.742 5.841 ( -6.449 -3.915 5.782) 9.505 6.007 ( 7.592 -4.658 1.662) 9.060 6.496 ( 2.218 10.823 -4.584) 11.961 6.822 ( 10.476 10.190 -7.341) 16.355 6.997 ( -1.582 -8.865 -4.482) 10.059 7.061 ( 3.326 0.178 -5.389) 6.335 7.419 ( 0.026 11.986 -1.195) 12.045 7.526 ( 7.995 3.306 -2.443) 8.990 7.736 ( -2.087 2.515 1.054) 3.435 7.810 ( -3.286 3.714 -0.545) 4.989 7.925 ( -4.763 2.469 -3.494) 6.402 8.098 ( -6.923 -3.591 0.917) 7.852 8.277 ( -1.812 5.564 3.979) 7.076 8.388 ( -7.234 3.271 2.119) 8.217 8.446 ( -5.419 4.786 -5.977) 9.381 8.597 ( -4.661 -4.659 -3.395) 7.413 8.776 ( 4.437 2.807 -3.223) 6.161 8.848 ( 1.597 0.394 -3.686) 4.036 9.034 ( -2.983 -4.278 -4.825) 7.105 9.234 ( -4.955 -2.951 -5.314) 7.842 9.422 ( -6.646 -3.596 4.706) 8.902 9.488 ( -8.150 -2.979 11.315) 14.259 9.853 ( 2.859 -0.983 9.848) 10.301 9.962 ( 4.525 -2.579 6.253) 8.138 10.110 ( -0.498 0.409 -5.149) 5.189 10.296 ( 3.372 -6.255 -0.815) 7.153 10.903 ( 0.177 6.730 -0.380) 6.743 11.008 ( 0.460 6.330 -2.119) 6.691 11.222 ( 0.279 5.628 -2.333) 6.098 11.258 ( -0.272 5.740 -2.263) 6.176 11.806 ( -5.960 9.581 1.507) 11.383 11.938 ( -8.337 3.047 2.471) 9.214 12.125 ( -11.916 0.775 -1.913) 12.093 12.293 ( -11.942 -3.187 3.006) 12.720 12.758 ( 1.929 -4.924 2.492) 5.846 13.032 ( -0.812 -19.875 -0.983) 19.916 13.487 ( 7.494 3.083 1.254) 8.200 13.620 ( 6.840 -3.343 -0.079) 7.613 13.661 ( 2.976 -6.128 0.153) 6.814 13.761 ( 3.573 -8.376 -2.381) 9.412 14.146 ( -0.603 -7.889 0.599) 7.935 14.301 ( 0.158 -11.683 -1.952) 11.846 14.777 ( -5.919 0.289 0.323) 5.934 14.922 ( -4.800 -9.397 1.261) 10.627 15.499 ( 4.119 -2.473 -2.732) 5.527 15.559 ( 1.998 -2.914 0.688) 3.600 15.720 ( 4.631 9.864 6.753) 12.820 16.310 ( 8.619 -9.282 2.002) 12.824 16.447 ( 4.479 9.199 -6.440) 12.090 16.637 ( 8.454 -3.112 7.007) 11.413 17.332 ( -3.811 7.726 3.504) 9.301 17.492 ( -1.264 1.131 -5.649) 5.898 18.200 ( 8.606 6.520 0.228) 10.799 18.281 ( 11.566 2.988 -1.896) 12.096 24.496 ( -0.820 2.809 0.329) 2.944 24.544 ( -1.815 0.708 0.054) 1.949 24.831 ( 3.392 3.260 -0.356) 4.718 24.925 ( 2.547 -0.950 -1.788) 3.253 25.456 ( 4.488 3.735 0.264) 5.844 25.480 ( 4.862 3.321 1.424) 6.057 25.964 ( 4.103 3.924 -1.772) 5.947 26.048 ( 5.807 0.526 0.161) 5.833 26.908 ( -13.395 4.411 -2.698) 14.358 27.038 ( -15.785 -1.015 -0.328) 15.821 27.329 ( -13.141 8.643 -4.442) 16.344 27.548 ( -8.609 -2.177 -10.876) 14.041 27.916 ( -1.257 -1.325 9.075) 9.257 28.211 ( -14.235 -15.884 7.952) 22.763 29.062 ( 11.078 -0.949 -0.361) 11.125 29.192 ( 6.418 -7.517 1.532) 10.003 ======================= Grid point 228 (120/130) ======================= q-point: (-0.10 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.294 ( -6.682 19.546 14.831) 25.429 2.606 ( -6.643 21.061 5.577) 22.777 2.842 ( -4.528 10.031 -6.320) 12.691 3.220 ( -14.692 8.497 -9.900) 19.648 3.681 ( -6.493 -12.789 10.742) 17.919 3.775 ( -8.596 6.621 6.867) 12.841 3.832 ( -8.665 -4.799 -2.039) 10.112 4.187 ( -8.778 4.861 -5.720) 11.550 4.499 ( -2.554 -3.541 10.347) 11.230 4.844 ( 1.283 -3.599 6.323) 7.387 5.413 ( -10.708 6.569 -13.833) 18.685 5.440 ( -8.004 -0.832 -1.132) 8.127 5.696 ( -7.253 -8.300 18.348) 21.404 5.747 ( -8.791 -5.463 9.931) 14.344 5.838 ( 12.589 10.806 -5.919) 17.615 6.177 ( 11.308 -1.479 -12.298) 16.772 6.483 ( 0.681 4.373 0.224) 4.431 6.847 ( -7.678 -8.413 -6.925) 13.330 6.984 ( 11.000 8.178 -2.389) 13.913 7.108 ( 4.843 1.205 -3.243) 5.952 7.359 ( -5.799 15.225 1.685) 16.379 7.582 ( -2.987 3.605 -4.193) 6.285 7.634 ( -1.534 1.939 -4.008) 4.709 7.805 ( -5.342 -3.842 -0.273) 6.586 7.919 ( 4.616 1.744 -4.047) 6.382 8.039 ( 7.583 4.178 0.990) 8.715 8.210 ( -8.212 8.250 -5.794) 13.002 8.286 ( -0.029 6.417 1.857) 6.680 8.396 ( -4.436 -0.850 6.622) 8.016 8.522 ( 1.627 -4.102 0.485) 4.440 8.750 ( -4.574 4.509 -2.539) 6.907 8.915 ( 5.298 4.997 -0.393) 7.293 8.989 ( 0.875 -1.740 -2.910) 3.502 9.063 ( -6.373 -2.972 -5.831) 9.135 9.347 ( -4.521 -4.805 1.227) 6.711 9.417 ( -6.267 -6.491 5.371) 10.500 9.965 ( 1.916 2.032 8.014) 8.487 10.108 ( 2.775 3.600 -1.474) 4.778 10.158 ( 6.320 -6.372 9.778) 13.272 10.351 ( 2.957 -5.949 -0.198) 6.646 10.902 ( 1.123 7.998 -0.420) 8.087 11.028 ( 0.836 6.614 -0.357) 6.676 11.167 ( -1.945 6.118 0.478) 6.438 11.269 ( 2.155 4.116 -3.545) 5.844 11.728 ( -3.642 5.667 1.442) 6.889 11.836 ( -4.064 2.438 0.952) 4.834 11.904 ( -9.304 0.468 -0.470) 9.328 12.080 ( -11.759 -3.033 0.780) 12.169 12.821 ( 2.444 -7.482 2.628) 8.298 13.003 ( -1.022 -18.626 -2.297) 18.794 13.617 ( 4.624 1.520 1.252) 5.025 13.687 ( 2.417 -3.966 -3.283) 5.688 13.730 ( 3.416 -5.332 1.746) 6.569 13.805 ( 2.323 -7.889 -1.596) 8.377 14.110 ( -3.355 -7.999 0.989) 8.731 14.259 ( -1.998 -12.065 -4.171) 12.921 14.738 ( 0.217 0.160 4.162) 4.171 14.886 ( -1.764 -10.419 2.790) 10.929 15.556 ( 4.104 -3.076 -2.498) 5.704 15.589 ( 0.745 -2.742 -0.159) 2.846 15.866 ( 4.679 13.716 7.838) 16.476 16.407 ( -1.176 13.082 -10.278) 16.678 16.480 ( 7.302 -9.793 2.987) 12.576 16.784 ( 1.597 -6.488 2.568) 7.158 17.326 ( -0.836 6.393 5.364) 8.387 17.452 ( 1.466 1.225 -4.377) 4.776 18.341 ( 5.439 7.091 1.692) 9.096 18.462 ( 9.433 1.881 -4.520) 10.628 24.494 ( 0.120 2.384 0.576) 2.455 24.524 ( -0.483 1.096 -0.160) 1.208 24.884 ( 2.391 2.471 -0.038) 3.439 24.949 ( 1.736 -0.508 -2.248) 2.886 25.552 ( 5.021 4.833 0.328) 6.977 25.588 ( 4.994 3.769 0.468) 6.274 25.995 ( 1.555 3.809 -2.333) 4.729 26.104 ( 0.205 -0.837 -1.869) 2.058 26.704 ( -6.131 1.950 -0.599) 6.462 26.771 ( -11.438 -0.876 0.870) 11.505 27.057 ( -11.213 5.348 -4.807) 13.321 27.175 ( -16.386 0.394 -10.800) 19.629 28.002 ( 1.276 -3.035 10.704) 11.199 28.155 ( -2.682 -11.378 10.072) 15.431 29.211 ( 5.403 -1.146 0.402) 5.538 29.311 ( 5.180 -6.515 -0.946) 8.377 ======================= Grid point 229 (121/130) ======================= q-point: ( 0.00 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.631 ( 0.988 -8.109 1.828) 8.371 2.631 ( 0.988 8.109 1.828) 8.371 3.155 ( -0.570 -12.082 3.442) 12.576 3.155 ( -0.570 12.082 3.442) 12.576 3.483 ( 2.522 -9.553 -3.254) 10.402 3.483 ( 2.522 9.553 -3.254) 10.402 3.910 ( -2.778 -7.300 0.624) 7.835 3.910 ( -2.778 7.300 0.624) 7.835 4.884 ( 9.945 -10.364 14.189) 20.190 4.884 ( 9.945 10.364 14.189) 20.190 5.179 ( -11.256 -4.050 -13.165) 17.788 5.179 ( -11.256 4.050 -13.165) 17.788 5.601 ( -7.677 -0.644 17.927) 19.512 5.601 ( -7.677 0.644 17.927) 19.512 6.165 ( 4.530 -6.910 -10.780) 13.582 6.165 ( 4.530 6.910 -10.780) 13.582 6.545 ( 3.180 -6.954 -5.410) 9.367 6.545 ( 3.180 6.954 -5.410) 9.367 7.229 ( 5.372 -1.564 -2.950) 6.324 7.229 ( 5.372 1.564 -2.950) 6.325 7.458 ( -4.473 -3.972 1.037) 6.071 7.458 ( -4.473 3.972 1.037) 6.071 7.647 ( 1.105 -0.724 -1.878) 2.296 7.647 ( 1.105 0.724 -1.878) 2.296 8.017 ( -2.980 -1.132 -2.076) 3.805 8.017 ( -2.980 1.132 -2.076) 3.805 8.335 ( -0.724 -1.646 1.693) 2.470 8.335 ( -0.724 1.646 1.693) 2.470 8.528 ( 5.934 -5.671 4.521) 9.371 8.528 ( 5.934 5.671 4.521) 9.371 8.710 ( -5.077 -6.213 -5.253) 9.590 8.710 ( -5.077 6.213 -5.253) 9.590 9.102 ( -2.852 -2.527 2.789) 4.722 9.102 ( -2.852 2.527 2.789) 4.722 9.251 ( 3.088 -2.974 -2.257) 4.846 9.251 ( 3.088 2.974 -2.257) 4.846 10.136 ( -0.247 -5.009 7.870) 9.333 10.136 ( -0.247 5.009 7.870) 9.333 10.268 ( 2.048 -5.955 -3.936) 7.426 10.268 ( 2.048 5.955 -3.936) 7.426 11.107 ( 2.347 -3.437 1.713) 4.501 11.107 ( 2.347 3.437 1.713) 4.501 11.223 ( -1.176 -3.895 -3.175) 5.161 11.223 ( -1.176 3.895 -3.175) 5.161 11.805 ( 2.511 -3.109 1.182) 4.167 11.805 ( 2.511 3.109 1.182) 4.167 11.846 ( -3.713 -3.696 0.130) 5.241 11.846 ( -3.713 3.696 0.130) 5.241 12.755 ( -0.078 -1.587 0.161) 1.597 12.755 ( -0.078 1.587 0.161) 1.597 13.682 ( -1.964 -2.404 2.572) 4.031 13.682 ( -1.964 2.404 2.572) 4.031 13.724 ( 1.167 -2.972 -1.689) 3.612 13.724 ( 1.167 2.972 -1.689) 3.612 14.018 ( 0.094 -3.185 -2.197) 3.871 14.018 ( 0.094 3.185 -2.197) 3.871 14.779 ( 0.320 -1.234 2.636) 2.928 14.779 ( 0.320 1.234 2.636) 2.928 15.557 ( 0.658 -0.572 -1.238) 1.515 15.557 ( 0.658 0.572 -1.238) 1.515 16.364 ( 5.038 -15.389 7.657) 17.912 16.364 ( 5.038 15.389 7.657) 17.912 16.525 ( -6.540 -11.083 -6.446) 14.393 16.525 ( -6.540 11.083 -6.446) 14.393 17.447 ( 0.864 -2.617 0.456) 2.794 17.447 ( 0.864 2.617 0.456) 2.794 18.504 ( -0.032 -2.565 -1.373) 2.910 18.504 ( -0.032 2.565 -1.373) 2.910 24.530 ( 0.159 -0.359 0.124) 0.412 24.530 ( 0.159 0.359 0.124) 0.412 24.940 ( 0.259 -0.918 -1.042) 1.413 24.940 ( 0.259 0.918 -1.042) 1.413 25.683 ( 1.519 -0.752 -0.462) 1.757 25.683 ( 1.519 0.752 -0.462) 1.757 26.031 ( -1.253 -0.619 -1.402) 1.980 26.031 ( -1.253 0.619 -1.402) 1.980 26.684 ( -0.009 -0.763 2.011) 2.151 26.684 ( -0.009 0.763 2.011) 2.151 26.941 ( -1.526 -0.708 -3.915) 4.261 26.941 ( -1.526 0.708 -3.915) 4.261 28.075 ( 0.734 -2.430 6.090) 6.598 28.075 ( 0.734 2.430 6.090) 6.598 29.267 ( 0.208 -1.736 -1.425) 2.255 29.267 ( 0.208 1.736 -1.425) 2.255 ======================= Grid point 231 (122/130) ======================= q-point: ( 0.10 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.687 ( 4.877 -3.067 -1.471) 5.946 2.687 ( 4.877 3.067 -1.471) 5.946 3.212 ( 4.235 -5.262 1.272) 6.873 3.212 ( 4.235 5.262 1.272) 6.873 3.637 ( 15.143 -4.220 -4.824) 16.444 3.637 ( 15.143 4.220 -4.824) 16.444 3.970 ( 6.066 -3.550 4.876) 8.554 3.970 ( 6.066 3.550 4.876) 8.554 4.881 ( -6.644 -6.801 -11.162) 14.663 4.881 ( -6.644 6.801 -11.162) 14.663 5.222 ( 11.539 -5.926 14.085) 19.148 5.222 ( 11.539 5.926 14.085) 19.148 5.613 ( -7.830 -2.312 18.245) 19.988 5.613 ( -7.830 2.312 18.245) 19.988 6.115 ( 2.840 -2.713 -12.034) 12.659 6.115 ( 2.840 2.713 -12.034) 12.659 6.646 ( 9.756 -9.945 -5.559) 15.000 6.646 ( 9.756 9.946 -5.559) 15.000 7.147 ( -6.352 -0.835 -7.747) 10.053 7.147 ( -6.352 0.835 -7.747) 10.053 7.505 ( 2.946 -4.467 5.186) 7.452 7.505 ( 2.946 4.467 5.186) 7.452 7.712 ( 7.054 -5.901 -2.531) 9.539 7.712 ( 7.054 5.901 -2.531) 9.539 7.920 ( -6.290 -5.047 3.948) 8.979 7.920 ( -6.290 5.047 3.948) 8.979 8.336 ( -1.452 -4.674 2.591) 5.538 8.336 ( -1.452 4.674 2.591) 5.538 8.516 ( -1.864 -4.313 -5.455) 7.200 8.516 ( -1.864 4.313 -5.455) 7.200 8.754 ( 4.641 -4.666 4.293) 7.858 8.754 ( 4.641 4.666 4.293) 7.858 9.015 ( -4.516 -2.707 0.912) 5.344 9.015 ( -4.516 2.707 0.912) 5.344 9.366 ( 8.620 -5.687 -1.082) 10.384 9.366 ( 8.620 5.687 -1.082) 10.384 10.148 ( -3.790 -4.346 4.515) 7.324 10.148 ( -3.790 4.346 4.515) 7.324 10.220 ( -1.745 -6.434 -7.174) 9.793 10.220 ( -1.745 6.434 -7.174) 9.793 11.103 ( -1.463 -4.199 -3.449) 5.628 11.103 ( -1.463 4.199 -3.449) 5.628 11.233 ( 1.981 -3.027 1.180) 3.805 11.233 ( 1.981 3.027 1.180) 3.805 11.805 ( 3.048 -3.085 0.041) 4.337 11.805 ( 3.048 3.085 0.041) 4.337 11.985 ( 10.980 -6.349 2.153) 12.865 11.985 ( 10.980 6.349 2.153) 12.865 12.750 ( -0.520 -1.340 0.303) 1.469 12.750 ( -0.520 1.340 0.303) 1.469 13.640 ( -4.549 -3.359 2.647) 6.244 13.640 ( -4.549 3.359 2.647) 6.244 13.707 ( -1.688 -3.406 -1.387) 4.046 13.707 ( -1.688 3.406 -1.387) 4.046 14.028 ( 1.569 -0.906 -0.336) 1.843 14.028 ( 1.569 0.906 -0.336) 1.843 14.800 ( 1.136 -1.181 -0.176) 1.648 14.800 ( 1.136 1.181 -0.176) 1.648 15.545 ( -0.761 -2.244 -1.232) 2.670 15.545 ( -0.761 2.244 -1.232) 2.670 16.303 ( -9.803 -12.127 -5.466) 16.524 16.303 ( -9.803 12.127 -5.466) 16.524 16.510 ( 1.514 -14.386 8.328) 16.691 16.510 ( 1.514 14.386 8.328) 16.691 17.451 ( 0.208 -2.375 -1.397) 2.764 17.451 ( 0.208 2.375 -1.397) 2.764 18.429 ( -6.765 -0.713 -0.288) 6.809 18.429 ( -6.765 0.713 -0.288) 6.809 24.535 ( 0.550 -0.516 -0.251) 0.795 24.535 ( 0.550 0.516 -0.251) 0.795 24.917 ( -2.049 -0.939 -0.495) 2.308 24.917 ( -2.049 0.939 -0.495) 2.308 25.655 ( -2.878 -1.454 -2.329) 3.977 25.655 ( -2.878 1.454 -2.329) 3.977 26.019 ( -0.930 -2.989 1.511) 3.476 26.019 ( -0.930 2.989 1.511) 3.476 26.740 ( 6.578 -2.358 0.449) 7.002 26.740 ( 6.578 2.358 0.449) 7.002 27.052 ( 11.889 -1.074 1.826) 12.076 27.052 ( 11.889 1.074 1.826) 12.076 28.118 ( 1.609 -4.028 -0.159) 4.340 28.118 ( 1.609 4.028 -0.159) 4.340 29.212 ( -4.977 -0.335 -0.696) 5.036 29.212 ( -4.977 0.335 -0.696) 5.036 ======================= Grid point 233 (123/130) ======================= q-point: ( 0.20 -0.50 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.799 ( 9.674 -2.641 -2.995) 10.465 2.799 ( 9.674 2.641 -2.995) 10.465 3.327 ( 7.523 -8.128 -0.345) 11.081 3.327 ( 7.523 8.128 -0.345) 11.081 3.809 ( 5.925 -2.453 -7.324) 9.735 3.809 ( 5.925 2.453 -7.324) 9.735 4.172 ( 8.952 -6.669 8.179) 13.839 4.172 ( 8.952 6.669 8.179) 13.838 4.838 ( 8.991 -5.311 -3.817) 11.118 4.838 ( 8.991 5.311 -3.817) 11.118 5.437 ( -7.708 -6.485 11.252) 15.102 5.437 ( -7.708 6.485 11.252) 15.102 5.639 ( 4.595 -3.254 11.566) 12.864 5.639 ( 4.595 3.254 11.566) 12.864 6.128 ( 9.004 -4.246 -12.581) 16.043 6.128 ( 9.004 4.246 -12.581) 16.043 6.719 ( -0.257 -10.568 -4.597) 11.527 6.719 ( -0.257 10.568 -4.597) 11.527 6.982 ( -3.519 -2.706 -4.273) 6.161 6.982 ( -3.519 2.706 -4.273) 6.161 7.502 ( -7.570 -3.341 3.011) 8.805 7.502 ( -7.570 3.341 3.011) 8.805 7.830 ( 7.384 -4.208 -2.987) 9.009 7.830 ( 7.384 4.208 -2.987) 9.009 7.943 ( 5.992 -6.631 5.277) 10.378 7.943 ( 5.992 6.631 5.277) 10.378 8.360 ( 0.263 -2.481 6.798) 7.241 8.360 ( 0.263 2.481 6.798) 7.241 8.489 ( 2.437 -1.572 -2.752) 3.998 8.489 ( 2.437 1.573 -2.752) 3.998 8.760 ( -4.263 -1.268 -0.516) 4.478 8.760 ( -4.263 1.268 -0.516) 4.478 9.052 ( 5.124 -5.687 3.827) 8.558 9.052 ( 5.124 5.687 3.827) 8.558 9.523 ( 8.727 -5.921 -1.272) 10.623 9.523 ( 8.727 5.921 -1.272) 10.623 10.051 ( -4.604 -1.210 -6.588) 8.127 10.051 ( -4.604 1.210 -6.588) 8.128 10.151 ( -1.607 -6.458 -1.404) 6.802 10.151 ( -1.607 6.458 -1.404) 6.802 11.053 ( -0.567 -3.054 -2.620) 4.063 11.053 ( -0.567 3.054 -2.620) 4.063 11.257 ( -0.939 -3.691 1.721) 4.180 11.257 ( -0.939 3.691 1.721) 4.180 11.932 ( 9.552 -4.477 0.021) 10.549 11.932 ( 9.552 4.477 0.021) 10.549 12.218 ( 11.727 -8.006 0.840) 14.224 12.218 ( 11.727 8.006 0.840) 14.224 12.748 ( 0.235 -3.599 0.626) 3.660 12.748 ( 0.235 3.599 0.626) 3.660 13.566 ( -5.603 -5.713 2.393) 8.353 13.566 ( -5.603 5.713 2.393) 8.353 13.635 ( -4.483 -3.449 -1.913) 5.971 13.635 ( -4.483 3.449 -1.913) 5.971 14.052 ( 0.187 -2.758 1.493) 3.142 14.052 ( 0.187 2.758 1.493) 3.142 14.841 ( 4.647 -2.037 -1.543) 5.303 14.841 ( 4.647 2.037 -1.543) 5.303 15.513 ( -1.577 -3.191 -1.079) 3.719 15.513 ( -1.577 3.191 -1.079) 3.719 16.076 ( -10.119 -12.373 -3.914) 16.456 16.076 ( -10.119 12.373 -3.914) 16.456 16.548 ( -4.190 -12.108 5.825) 14.075 16.548 ( -4.190 12.108 5.825) 14.075 17.453 ( 1.733 -1.970 -1.226) 2.896 17.453 ( 1.733 1.970 -1.226) 2.896 18.273 ( -9.359 -1.134 0.096) 9.428 18.273 ( -9.359 1.134 0.096) 9.428 24.551 ( 1.603 -1.061 -0.678) 2.038 24.551 ( 1.603 1.061 -0.678) 2.038 24.867 ( -3.017 -1.463 0.732) 3.432 24.867 ( -3.017 1.463 0.732) 3.432 25.561 ( -4.149 -1.326 -3.637) 5.675 25.561 ( -4.149 1.326 -3.637) 5.675 25.989 ( -4.357 -3.004 2.489) 5.848 25.989 ( -4.357 3.004 2.489) 5.848 26.952 ( 14.254 -3.943 1.515) 14.867 26.952 ( 14.254 3.943 1.515) 14.867 27.319 ( 11.693 -1.311 5.733) 13.088 27.319 ( 11.693 1.311 5.733) 13.088 28.154 ( 5.500 -7.029 -5.298) 10.379 28.154 ( 5.500 7.029 -5.298) 10.379 29.080 ( -8.424 -2.111 -0.600) 8.706 29.080 ( -8.424 2.111 -0.600) 8.706 ======================= Grid point 235 (124/130) ======================= q-point: ( 0.30 -0.50 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.011 ( 14.900 -5.176 -1.150) 15.815 3.011 ( 14.900 5.176 -1.150) 15.815 3.454 ( 7.326 -12.616 -5.229) 15.497 3.454 ( 7.326 12.616 -5.229) 15.497 3.832 ( 3.244 -9.468 1.152) 10.074 3.832 ( 3.244 9.468 1.152) 10.074 4.362 ( 3.868 -2.563 6.233) 7.770 4.362 ( 3.868 2.563 6.233) 7.770 4.995 ( -1.438 -7.845 3.028) 8.532 4.995 ( -1.438 7.845 3.028) 8.532 5.258 ( -6.074 -1.636 1.252) 6.414 5.258 ( -6.074 1.636 1.252) 6.414 5.866 ( 8.269 -0.732 3.146) 8.878 5.866 ( 8.269 0.732 3.146) 8.878 6.201 ( 8.625 -2.870 -11.556) 14.703 6.201 ( 8.625 2.870 -11.556) 14.703 6.557 ( -11.565 -7.651 -0.044) 13.867 6.557 ( -11.565 7.651 -0.044) 13.867 6.962 ( 1.058 -4.497 -1.113) 4.752 6.962 ( 1.058 4.497 -1.113) 4.752 7.395 ( -3.317 -2.811 1.644) 4.648 7.395 ( -3.317 2.811 1.644) 4.648 7.920 ( 4.870 -2.900 -1.574) 5.882 7.920 ( 4.870 2.900 -1.574) 5.882 8.149 ( 9.140 -5.829 2.672) 11.165 8.149 ( 9.140 5.829 2.672) 11.165 8.413 ( -0.746 -1.010 8.004) 8.102 8.413 ( -0.746 1.010 8.004) 8.102 8.533 ( 0.780 -2.312 2.165) 3.263 8.533 ( 0.780 2.312 2.165) 3.263 8.718 ( 2.779 -5.305 -1.977) 6.307 8.718 ( 2.779 5.305 -1.977) 6.307 9.172 ( 3.933 -6.198 2.160) 7.652 9.172 ( 3.933 6.198 2.160) 7.652 9.642 ( 4.747 -2.245 -1.294) 5.408 9.642 ( 4.747 2.245 -1.294) 5.408 9.943 ( 0.825 -1.501 -9.264) 9.422 9.943 ( 0.825 1.501 -9.264) 9.422 10.126 ( -0.445 -4.488 0.408) 4.529 10.126 ( -0.445 4.488 0.408) 4.529 11.049 ( 1.399 -4.340 -0.473) 4.585 11.049 ( 1.399 4.340 -0.473) 4.585 11.233 ( -2.980 -5.607 1.961) 6.645 11.233 ( -2.980 5.607 1.961) 6.645 12.121 ( 10.368 -5.875 -0.795) 11.944 12.121 ( 10.368 5.875 -0.795) 11.944 12.399 ( 6.987 -7.186 -0.269) 10.026 12.399 ( 6.987 7.186 -0.269) 10.026 12.784 ( 3.493 -4.752 0.216) 5.901 12.784 ( 3.493 4.752 0.216) 5.901 13.436 ( -10.527 -5.608 0.647) 11.945 13.436 ( -10.527 5.608 0.647) 11.945 13.553 ( -1.917 -1.176 -1.011) 2.466 13.553 ( -1.917 1.176 -1.011) 2.466 14.060 ( -0.729 -3.807 2.161) 4.438 14.060 ( -0.729 3.807 2.161) 4.438 14.954 ( 8.292 -1.249 -1.112) 8.459 14.954 ( 8.292 1.249 -1.112) 8.459 15.472 ( -1.986 -4.047 -0.972) 4.612 15.472 ( -1.986 4.047 -0.972) 4.612 15.878 ( -8.147 -11.114 -1.898) 13.910 15.878 ( -8.147 11.114 -1.898) 13.910 16.452 ( -8.462 -7.522 1.112) 11.376 16.452 ( -8.462 7.522 1.112) 11.376 17.506 ( 4.041 -1.118 0.811) 4.271 17.506 ( 4.041 1.118 0.811) 4.271 18.102 ( -8.644 -2.089 -0.364) 8.900 18.102 ( -8.644 2.089 -0.364) 8.900 24.583 ( 2.361 -1.882 -0.697) 3.099 24.583 ( 2.361 1.882 -0.697) 3.099 24.823 ( -2.691 -2.322 1.169) 3.742 24.823 ( -2.691 2.322 1.169) 3.742 25.466 ( -2.277 -0.927 -3.241) 4.068 25.466 ( -2.277 0.927 -3.241) 4.068 25.899 ( -6.971 -1.885 1.680) 7.414 25.899 ( -6.971 1.885 1.680) 7.414 27.239 ( 13.199 -3.108 3.221) 13.937 27.239 ( 13.199 3.108 3.221) 13.937 27.533 ( 5.742 -2.516 6.976) 9.379 27.533 ( 5.742 2.516 6.976) 9.379 28.259 ( 10.659 -12.135 -6.670) 17.475 28.259 ( 10.659 12.135 -6.670) 17.475 28.901 ( -9.521 -6.903 -1.572) 11.865 28.901 ( -9.521 6.903 -1.572) 11.865 ======================= Grid point 237 (125/130) ======================= q-point: ( 0.40 -0.50 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.295 ( 13.117 -2.992 1.034) 13.494 3.295 ( 13.117 2.992 1.034) 13.494 3.529 ( 8.129 -10.642 -5.243) 14.381 3.529 ( 8.129 10.642 -5.243) 14.381 3.953 ( 2.468 -11.525 5.730) 13.105 3.953 ( 2.468 11.525 5.730) 13.105 4.416 ( -0.469 -9.325 2.728) 9.727 4.416 ( -0.469 9.325 2.728) 9.727 4.761 ( -14.562 -13.634 0.953) 19.971 4.761 ( -14.562 13.634 0.953) 19.971 5.307 ( 0.508 -1.253 1.798) 2.249 5.307 ( 0.508 1.253 1.798) 2.249 5.932 ( 0.787 -0.907 -5.396) 5.528 5.932 ( 0.787 0.907 -5.396) 5.528 6.232 ( 3.293 -1.305 -10.611) 11.186 6.232 ( 3.293 1.305 -10.611) 11.186 6.425 ( -3.167 -8.906 5.971) 11.181 6.425 ( -3.167 8.906 5.971) 11.181 6.962 ( -0.279 -6.318 -0.121) 6.326 6.962 ( -0.279 6.319 -0.121) 6.326 7.412 ( 2.384 -2.208 1.961) 3.795 7.412 ( 2.384 2.208 1.961) 3.795 7.986 ( 2.542 -3.615 -1.239) 4.589 7.986 ( 2.542 3.615 -1.239) 4.589 8.260 ( 2.832 -4.327 0.754) 5.226 8.260 ( 2.832 4.327 0.754) 5.226 8.447 ( -2.197 -1.601 4.940) 5.639 8.447 ( -2.197 1.601 4.940) 5.639 8.608 ( 4.418 -4.111 5.285) 8.022 8.608 ( 4.418 4.111 5.285) 8.022 8.783 ( 3.782 -5.274 -0.560) 6.514 8.783 ( 3.782 5.274 -0.560) 6.514 9.209 ( 0.262 -5.674 -2.300) 6.127 9.209 ( 0.262 5.674 -2.300) 6.127 9.693 ( 0.963 -1.689 2.186) 2.925 9.693 ( 0.963 1.689 2.186) 2.925 9.912 ( 2.905 -1.018 -9.297) 9.793 9.912 ( 2.905 1.018 -9.297) 9.793 10.149 ( 1.886 -1.673 1.136) 2.765 10.149 ( 1.886 1.673 1.136) 2.765 11.087 ( 2.275 -6.779 0.458) 7.165 11.087 ( 2.274 6.779 0.458) 7.165 11.192 ( -2.771 -6.960 1.890) 7.726 11.192 ( -2.771 6.960 1.890) 7.726 12.281 ( 7.227 -6.308 -0.968) 9.642 12.281 ( 7.227 6.308 -0.968) 9.642 12.477 ( 2.167 -4.002 -0.407) 4.569 12.477 ( 2.167 4.002 -0.407) 4.569 12.875 ( 6.126 -5.700 -0.622) 8.390 12.875 ( 6.126 5.700 -0.622) 8.390 13.216 ( -12.447 -6.099 -0.062) 13.861 13.216 ( -12.447 6.099 -0.062) 13.861 13.539 ( 0.628 -1.525 -0.471) 1.715 13.539 ( 0.628 1.525 -0.471) 1.715 14.065 ( -0.527 -3.135 1.944) 3.726 14.065 ( -0.527 3.135 1.944) 3.726 15.108 ( 8.581 -2.960 -0.735) 9.107 15.108 ( 8.581 2.960 -0.735) 9.107 15.407 ( -4.688 -6.492 -1.140) 8.089 15.407 ( -4.688 6.492 -1.140) 8.089 15.774 ( -1.850 -8.095 0.588) 8.325 15.774 ( -1.850 8.095 0.588) 8.325 16.285 ( -8.414 -4.074 -1.568) 9.479 16.285 ( -8.414 4.074 -1.568) 9.479 17.602 ( 4.534 -0.661 2.041) 5.016 17.602 ( 4.534 0.661 2.041) 5.016 17.955 ( -6.237 -2.757 -1.267) 6.936 17.955 ( -6.237 2.757 -1.267) 6.936 24.625 ( 2.492 -2.677 -0.034) 3.657 24.625 ( 2.492 2.677 -0.034) 3.657 24.779 ( -2.738 -2.906 0.020) 3.993 24.779 ( -2.738 2.906 0.020) 3.993 25.445 ( 2.103 -0.780 -1.086) 2.492 25.445 ( 2.103 0.780 -1.086) 2.492 25.767 ( -7.609 -0.923 0.048) 7.664 25.767 ( -7.609 0.923 0.048) 7.664 27.443 ( 5.047 -2.507 3.243) 6.502 27.443 ( 5.047 2.507 3.243) 6.502 27.689 ( 5.673 -8.163 8.053) 12.794 27.689 ( 5.673 8.163 8.053) 12.794 28.383 ( 6.641 -20.019 -7.585) 22.415 28.383 ( 6.641 20.019 -7.585) 22.415 28.730 ( -6.174 -14.876 -1.636) 16.189 28.730 ( -6.174 14.876 -1.636) 16.189 ======================= Grid point 239 (126/130) ======================= q-point: (-0.50 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.396 ( -0.549 -2.997 -1.147) 3.255 3.396 ( -0.549 2.997 -1.147) 3.255 3.766 ( 13.413 -2.407 3.412) 14.048 3.766 ( 13.414 2.407 3.412) 14.048 3.834 ( -14.039 -5.259 -1.313) 15.049 3.834 ( -14.039 5.259 -1.313) 15.049 4.493 ( 4.182 -10.555 4.471) 12.202 4.493 ( 4.182 10.555 4.471) 12.202 4.613 ( -1.986 -11.108 -2.339) 11.524 4.613 ( -1.986 11.108 -2.339) 11.524 5.267 ( -3.193 -1.714 3.733) 5.203 5.267 ( -3.193 1.714 3.733) 5.203 5.869 ( -3.084 -1.424 -3.005) 4.535 5.869 ( -3.084 1.424 -3.005) 4.535 6.181 ( -2.396 -3.737 -3.399) 5.592 6.181 ( -2.396 3.738 -3.399) 5.592 6.482 ( 5.452 -0.971 -0.420) 5.554 6.482 ( 5.452 0.971 -0.420) 5.554 6.965 ( 1.476 -5.593 -1.424) 5.957 6.965 ( 1.476 5.593 -1.424) 5.957 7.470 ( 1.837 -1.779 0.464) 2.599 7.470 ( 1.837 1.779 0.464) 2.599 7.976 ( -3.086 -2.462 1.274) 4.149 7.976 ( -3.086 2.462 1.274) 4.149 8.296 ( -0.103 -2.443 -0.770) 2.563 8.296 ( -0.103 2.443 -0.770) 2.563 8.455 ( -0.911 -5.291 6.542) 8.464 8.455 ( -0.911 5.291 6.542) 8.464 8.685 ( 1.271 -3.902 -1.075) 4.243 8.685 ( 1.271 3.903 -1.075) 4.243 8.845 ( 2.295 -1.383 0.583) 2.743 8.845 ( 2.295 1.383 0.583) 2.743 9.173 ( -1.168 -3.177 -1.977) 3.920 9.173 ( -1.168 3.177 -1.977) 3.920 9.700 ( -3.916 -1.486 5.119) 6.615 9.700 ( -3.916 1.486 5.119) 6.615 9.890 ( 2.007 -1.344 -7.432) 7.814 9.890 ( 2.007 1.344 -7.432) 7.814 10.191 ( 2.032 -0.873 -0.928) 2.398 10.191 ( 2.032 0.873 -0.928) 2.398 11.124 ( 0.543 -1.887 0.111) 1.967 11.124 ( 0.543 1.887 0.111) 1.967 11.174 ( 0.475 -1.428 0.863) 1.735 11.174 ( 0.475 1.428 0.863) 1.735 12.349 ( -0.276 -3.033 -0.202) 3.052 12.349 ( -0.276 3.033 -0.202) 3.052 12.490 ( 0.287 -3.030 -0.919) 3.179 12.490 ( 0.287 3.030 -0.919) 3.179 12.953 ( -6.105 -7.044 4.452) 10.330 12.953 ( -6.105 7.044 4.452) 10.330 13.053 ( 4.232 -7.299 -3.663) 9.198 13.053 ( 4.232 7.299 -3.663) 9.198 13.551 ( 0.950 -1.190 -0.950) 1.794 13.551 ( 0.950 1.190 -0.950) 1.794 14.071 ( -0.332 -1.859 1.496) 2.409 14.071 ( -0.332 1.859 1.496) 2.409 15.223 ( 0.124 -4.617 -0.108) 4.620 15.223 ( 0.124 4.617 -0.108) 4.620 15.308 ( -0.554 -1.779 -0.958) 2.095 15.308 ( -0.554 1.779 -0.958) 2.095 15.796 ( 2.041 -2.004 0.165) 2.865 15.796 ( 2.041 2.004 0.165) 2.865 16.161 ( -2.553 -2.916 -0.192) 3.881 16.161 ( -2.553 2.916 -0.192) 3.881 17.677 ( 0.306 -2.265 2.014) 3.046 17.677 ( 0.306 2.265 2.014) 3.046 17.875 ( 0.445 -2.360 -2.068) 3.169 17.875 ( 0.445 2.360 -2.068) 3.169 24.665 ( 0.660 -1.313 0.338) 1.508 24.665 ( 0.660 1.313 0.338) 1.508 24.732 ( -0.903 -1.254 -0.376) 1.591 24.732 ( -0.903 1.255 -0.376) 1.591 25.499 ( 1.967 -0.374 -0.888) 2.190 25.499 ( 1.967 0.374 -0.888) 2.190 25.658 ( -1.676 -0.226 0.196) 1.702 25.658 ( -1.676 0.226 0.196) 1.702 27.498 ( -0.582 -0.957 2.393) 2.642 27.498 ( -0.582 0.957 2.393) 2.642 27.838 ( 1.237 -6.146 7.425) 9.718 27.838 ( 1.237 6.146 7.425) 9.718 28.345 ( -1.951 -5.755 -7.013) 9.279 28.345 ( -1.951 5.755 -7.013) 9.279 28.683 ( 1.310 -4.699 -1.418) 5.080 28.683 ( 1.310 4.699 -1.418) 5.080 ======================= Grid point 241 (127/130) ======================= q-point: (-0.40 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.320 ( -7.649 -11.035 -0.905) 13.457 3.320 ( -7.649 11.035 -0.905) 13.457 3.469 ( -17.430 -10.057 0.230) 20.124 3.469 ( -17.430 10.057 0.230) 20.124 4.014 ( 3.528 -10.224 -0.033) 10.816 4.014 ( 3.528 10.224 -0.033) 10.816 4.463 ( -2.518 -11.456 -0.965) 11.769 4.463 ( -2.518 11.456 -0.965) 11.769 4.736 ( 12.999 -8.734 2.222) 15.818 4.736 ( 12.999 8.734 2.222) 15.818 5.296 ( -1.066 -0.694 3.651) 3.866 5.296 ( -1.066 0.694 3.651) 3.866 5.775 ( -7.744 -0.794 7.064) 10.512 5.775 ( -7.744 0.794 7.064) 10.512 6.125 ( -1.131 -4.278 -0.760) 4.490 6.125 ( -1.131 4.278 -0.760) 4.490 6.574 ( 6.795 -7.631 -6.377) 12.045 6.574 ( 6.795 7.631 -6.377) 12.045 6.991 ( 3.085 -7.743 -3.141) 8.907 6.991 ( 3.085 7.743 -3.141) 8.907 7.467 ( -0.879 -1.059 -2.838) 3.154 7.467 ( -0.879 1.059 -2.838) 3.154 7.921 ( -4.882 -2.424 4.327) 6.959 7.921 ( -4.882 2.424 4.327) 6.959 8.246 ( -4.248 -2.354 0.757) 4.915 8.246 ( -4.248 2.354 0.757) 4.915 8.505 ( 0.821 -6.433 3.405) 7.325 8.505 ( 0.821 6.433 3.405) 7.325 8.664 ( -1.499 -1.887 -1.919) 3.081 8.664 ( -1.499 1.887 -1.919) 3.081 8.831 ( -2.477 -2.255 -4.207) 5.378 8.831 ( -2.477 2.255 -4.207) 5.378 9.165 ( 0.473 -4.514 1.194) 4.693 9.165 ( 0.473 4.514 1.194) 4.693 9.637 ( -7.547 -2.417 6.891) 10.502 9.637 ( -7.547 2.417 6.891) 10.502 9.860 ( -0.331 -2.281 -4.060) 4.669 9.860 ( -0.331 2.281 -4.060) 4.669 10.198 ( 0.740 -0.725 -3.596) 3.742 10.198 ( 0.740 0.725 -3.596) 3.742 11.104 ( -1.425 -6.454 -1.157) 6.709 11.104 ( -1.425 6.454 -1.157) 6.709 11.222 ( 3.584 -5.565 -0.567) 6.644 11.222 ( 3.584 5.565 -0.567) 6.644 12.266 ( -7.834 -2.733 0.350) 8.305 12.266 ( -7.834 2.733 0.350) 8.305 12.472 ( -2.304 -2.650 -0.160) 3.515 12.472 ( -2.304 2.650 -0.160) 3.515 12.826 ( -7.315 -9.215 3.600) 12.304 12.826 ( -7.315 9.215 3.600) 12.304 13.220 ( 11.326 -6.848 -0.414) 13.242 13.220 ( 11.326 6.848 -0.414) 13.242 13.555 ( 0.789 -3.603 -1.696) 4.060 13.555 ( 0.789 3.603 -1.696) 4.060 14.078 ( 0.242 -2.027 0.742) 2.172 14.078 ( 0.242 2.027 0.742) 2.172 15.103 ( -8.326 -7.739 -0.336) 11.373 15.103 ( -8.326 7.739 -0.336) 11.373 15.385 ( 4.247 -3.544 0.754) 5.583 15.385 ( 4.247 3.544 0.754) 5.583 15.814 ( 2.282 -9.383 -3.154) 10.158 15.814 ( 2.282 9.383 -3.154) 10.158 16.221 ( 6.334 -2.330 4.183) 7.940 16.221 ( 6.334 2.330 4.183) 7.940 17.632 ( -4.429 -4.360 -0.440) 6.230 17.632 ( -4.429 4.360 -0.440) 6.230 17.950 ( 7.568 -1.950 -0.948) 7.872 17.950 ( 7.568 1.950 -0.948) 7.872 24.630 ( -2.918 -2.153 -0.484) 3.658 24.630 ( -2.918 2.153 -0.484) 3.658 24.769 ( 3.251 -3.003 0.854) 4.507 24.769 ( 3.251 3.003 0.854) 4.507 25.457 ( -2.258 -0.396 -2.215) 3.188 25.457 ( -2.258 0.396 -2.215) 3.188 25.751 ( 7.946 -0.527 1.541) 8.111 25.751 ( 7.946 0.527 1.541) 8.111 27.467 ( -5.042 -2.346 1.240) 5.697 27.467 ( -5.042 2.346 1.240) 5.697 27.799 ( -7.199 -6.957 -0.001) 10.011 27.799 ( -7.199 6.957 -0.001) 10.011 28.267 ( -5.418 -21.050 0.911) 21.755 28.267 ( -5.418 21.050 0.911) 21.755 28.732 ( 6.280 -9.054 -1.843) 11.172 28.732 ( 6.280 9.054 -1.843) 11.172 ======================= Grid point 243 (128/130) ======================= q-point: (-0.30 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.029 ( -16.702 -13.095 -3.028) 21.438 3.029 ( -16.702 13.095 -3.028) 21.438 3.321 ( -5.858 -17.641 6.461) 19.679 3.321 ( -5.858 17.641 6.461) 19.679 3.907 ( -7.671 -12.305 -4.813) 15.278 3.907 ( -7.671 12.305 -4.813) 15.278 4.438 ( -3.172 -4.646 -0.933) 5.702 4.438 ( -3.172 4.646 -0.933) 5.702 5.007 ( 0.992 -3.918 2.431) 4.716 5.007 ( 0.992 3.918 2.431) 4.716 5.232 ( 4.058 -4.489 2.370) 6.499 5.232 ( 4.058 4.489 2.370) 6.499 5.745 ( -5.934 -2.053 14.752) 16.032 5.745 ( -5.934 2.053 14.752) 16.032 6.062 ( -6.805 -1.913 -1.082) 7.151 6.062 ( -6.805 1.913 -1.082) 7.151 6.665 ( 9.841 -11.457 -8.115) 17.145 6.665 ( 9.841 11.457 -8.115) 17.145 7.006 ( 1.573 -6.511 -4.839) 8.263 7.006 ( 1.573 6.511 -4.839) 8.263 7.449 ( 3.609 -1.914 -3.341) 5.278 7.449 ( 3.609 1.914 -3.341) 5.278 7.866 ( -4.722 -2.483 3.769) 6.532 7.866 ( -4.722 2.483 3.769) 6.532 8.158 ( -6.698 -0.893 1.514) 6.924 8.158 ( -6.698 0.893 1.514) 6.924 8.479 ( -5.615 -6.921 -0.863) 8.954 8.479 ( -5.615 6.921 -0.863) 8.954 8.660 ( 3.415 -6.914 -1.418) 7.840 8.660 ( 3.415 6.914 -1.418) 7.840 8.715 ( -4.158 -4.791 -5.571) 8.443 8.715 ( -4.158 4.791 -5.571) 8.443 9.182 ( -0.418 -7.199 0.904) 7.267 9.182 ( -0.418 7.199 0.904) 7.267 9.541 ( -9.222 -2.014 7.481) 12.044 9.541 ( -9.222 2.014 7.481) 12.044 9.830 ( -0.492 -3.993 0.914) 4.126 9.830 ( -0.492 3.993 0.914) 4.126 10.175 ( 0.875 -2.003 -4.271) 4.798 10.175 ( 0.875 2.003 -4.271) 4.798 11.064 ( -1.433 -5.693 -1.753) 6.126 11.064 ( -1.433 5.693 -1.753) 6.126 11.279 ( 3.420 -4.228 -2.114) 5.835 11.279 ( 3.420 4.228 -2.114) 5.835 12.098 ( -10.270 -3.794 1.180) 11.012 12.098 ( -10.270 3.794 1.180) 11.012 12.383 ( -7.900 -3.643 1.237) 8.787 12.383 ( -7.900 3.643 1.237) 8.787 12.757 ( -2.861 -9.137 2.302) 9.847 12.757 ( -2.861 9.137 2.302) 9.847 13.424 ( 9.616 -4.419 1.389) 10.673 13.424 ( 9.616 4.419 1.389) 10.673 13.567 ( 2.337 -4.664 -1.740) 5.499 13.567 ( 2.337 4.664 -1.740) 5.499 14.092 ( 1.052 -3.982 -0.620) 4.165 14.092 ( 1.052 3.982 -0.620) 4.165 14.942 ( -8.619 -4.854 -0.101) 9.892 14.942 ( -8.619 4.854 -0.101) 9.892 15.449 ( 2.268 -1.952 0.988) 3.151 15.449 ( 2.268 1.952 0.988) 3.151 15.876 ( 6.775 -15.394 -1.810) 16.916 15.876 ( 6.775 15.394 -1.810) 16.916 16.408 ( 8.639 -1.458 4.957) 10.066 16.408 ( 8.639 1.458 4.957) 10.066 17.538 ( -4.284 -4.626 -1.827) 6.565 17.538 ( -4.284 4.626 -1.827) 6.565 18.107 ( 9.813 -1.734 -0.844) 10.000 18.107 ( 9.813 1.734 -0.844) 10.000 24.575 ( -2.556 -1.854 -0.044) 3.158 24.575 ( -2.556 1.854 -0.044) 3.158 24.837 ( 3.415 -3.016 -0.039) 4.556 24.837 ( 3.415 3.016 -0.039) 4.556 25.436 ( 1.580 -0.456 -0.546) 1.733 25.436 ( 1.580 0.456 -0.546) 1.733 25.912 ( 7.828 -1.129 0.434) 7.921 25.912 ( 7.828 1.129 0.434) 7.921 27.292 ( -13.778 -2.850 -1.290) 14.129 27.292 ( -13.778 2.850 -1.290) 14.129 27.671 ( -4.338 -2.547 -4.266) 6.596 27.671 ( -4.338 2.547 -4.266) 6.596 28.106 ( -13.662 -18.362 5.791) 23.608 28.106 ( -13.662 18.362 5.791) 23.608 28.890 ( 10.863 -6.790 -0.631) 12.826 28.890 ( 10.863 6.790 -0.631) 12.826 ======================= Grid point 245 (129/130) ======================= q-point: (-0.20 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.754 ( -11.091 -14.201 0.694) 18.032 2.754 ( -11.091 14.201 0.694) 18.032 3.265 ( -6.006 -19.526 5.152) 21.069 3.265 ( -6.006 19.526 5.152) 21.069 3.749 ( -6.978 -11.884 -1.167) 13.830 3.749 ( -6.978 11.884 -1.167) 13.830 4.285 ( -11.037 -11.107 -2.406) 15.842 4.285 ( -11.037 11.107 -2.406) 15.842 4.781 ( -14.315 -9.498 1.289) 17.228 4.781 ( -14.315 9.498 1.289) 17.228 5.500 ( 5.875 -6.103 8.199) 11.789 5.500 ( 5.875 6.103 8.199) 11.789 5.751 ( -4.495 -4.475 5.546) 8.425 5.751 ( -4.495 4.475 5.546) 8.425 5.911 ( -2.167 -5.329 -0.780) 5.806 5.911 ( -2.167 5.329 -0.780) 5.806 6.735 ( 1.544 -12.635 -5.627) 13.918 6.735 ( 1.544 12.635 -5.627) 13.918 7.006 ( 4.528 -5.298 -5.660) 8.978 7.006 ( 4.528 5.298 -5.660) 8.978 7.563 ( 9.318 -1.773 -2.801) 9.890 7.563 ( 9.318 1.773 -2.801) 9.890 7.785 ( -6.828 -2.879 1.603) 7.581 7.785 ( -6.828 2.879 1.603) 7.581 8.024 ( -5.690 -4.372 -2.063) 7.466 8.024 ( -5.690 4.372 -2.063) 7.466 8.377 ( -4.389 -3.683 3.296) 6.610 8.377 ( -4.389 3.683 3.296) 6.610 8.537 ( -6.995 -2.317 -5.849) 9.408 8.537 ( -6.995 2.317 -5.849) 9.408 8.792 ( 8.705 -0.888 -2.366) 9.065 8.792 ( 8.705 0.888 -2.366) 9.065 9.130 ( -4.511 -7.282 -3.360) 9.202 9.130 ( -4.511 7.282 -3.360) 9.202 9.425 ( -9.372 -2.615 7.714) 12.417 9.425 ( -9.372 2.615 7.714) 12.417 9.887 ( 3.563 -3.477 6.278) 8.012 9.887 ( 3.563 3.477 6.278) 8.012 10.178 ( 2.661 -5.105 -2.824) 6.412 10.178 ( 2.661 5.105 -2.824) 6.412 11.034 ( -0.365 -4.179 -0.685) 4.250 11.034 ( -0.365 4.179 -0.685) 4.250 11.305 ( 1.369 -1.818 -2.765) 3.581 11.305 ( 1.369 1.818 -2.765) 3.581 11.921 ( -9.328 -3.053 1.003) 9.866 11.921 ( -9.328 3.053 1.003) 9.866 12.210 ( -11.520 -5.148 1.623) 12.722 12.210 ( -11.520 5.148 1.623) 12.722 12.744 ( -0.287 -6.715 0.841) 6.774 12.744 ( -0.287 6.715 0.841) 6.774 13.580 ( 5.470 -3.261 2.025) 6.683 13.580 ( 5.470 3.261 2.025) 6.683 13.620 ( 4.497 -3.430 -1.275) 5.797 13.620 ( 4.497 3.430 -1.275) 5.797 14.096 ( 0.285 -5.014 -2.296) 5.522 14.096 ( 0.285 5.014 -2.296) 5.522 14.804 ( -6.087 -2.960 1.601) 6.956 14.804 ( -6.087 2.960 1.601) 6.956 15.498 ( 2.518 -1.900 0.194) 3.161 15.498 ( 2.518 1.900 0.194) 3.161 16.019 ( 8.334 -16.573 1.318) 18.598 16.019 ( 8.334 16.573 1.318) 18.598 16.585 ( 6.279 -4.138 2.269) 7.855 16.585 ( 6.279 4.138 2.269) 7.855 17.456 ( -2.769 -4.268 -1.473) 5.297 17.456 ( -2.769 4.268 -1.473) 5.297 18.290 ( 10.380 -2.084 -1.333) 10.670 18.290 ( 10.380 2.084 -1.333) 10.670 24.539 ( -1.409 -1.275 0.307) 1.925 24.539 ( -1.409 1.275 0.307) 1.925 24.891 ( 2.907 -2.400 -1.187) 3.952 24.891 ( 2.907 2.400 -1.187) 3.952 25.504 ( 4.934 -0.776 1.340) 5.171 25.504 ( 4.934 0.776 1.340) 5.171 26.029 ( 4.845 -2.264 -1.194) 5.480 26.029 ( 4.845 2.264 -1.194) 5.480 26.991 ( -15.674 -3.465 -1.757) 16.148 26.991 ( -15.674 3.465 -1.757) 16.148 27.480 ( -11.788 -5.274 -9.510) 16.038 27.480 ( -11.788 5.274 -9.510) 16.038 27.965 ( -7.266 -7.364 12.266) 16.047 27.965 ( -7.266 7.364 12.266) 16.047 29.084 ( 9.927 -3.138 -0.915) 10.451 29.084 ( 9.927 3.138 -0.915) 10.451 ======================= Grid point 247 (130/130) ======================= q-point: (-0.10 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.634 ( -4.057 -12.330 3.174) 13.363 2.634 ( -4.057 12.330 3.174) 13.363 3.187 ( -5.471 -17.170 3.663) 18.389 3.187 ( -5.471 17.170 3.663) 18.389 3.586 ( -9.493 -9.607 -0.496) 13.515 3.586 ( -9.493 9.607 -0.496) 13.515 4.051 ( -10.581 -13.837 -2.202) 17.557 4.051 ( -10.581 13.837 -2.202) 17.557 4.675 ( 0.447 -12.828 8.039) 15.145 4.675 ( 0.447 12.828 8.039) 15.145 5.461 ( -9.288 -2.912 -4.808) 10.857 5.461 ( -9.288 2.912 -4.808) 10.857 5.635 ( -10.633 -4.182 13.739) 17.869 5.635 ( -10.633 4.182 13.739) 17.869 6.060 ( 13.958 -9.685 -8.031) 18.792 6.060 ( 13.958 9.685 -8.031) 18.792 6.636 ( -5.977 -10.385 -4.387) 12.760 6.636 ( -5.977 10.385 -4.387) 12.760 7.097 ( 8.387 -2.849 -2.668) 9.251 7.097 ( 8.387 2.849 -2.668) 9.251 7.582 ( -6.598 -6.283 -0.202) 9.113 7.582 ( -6.598 6.283 -0.202) 9.113 7.689 ( -2.184 -5.453 -3.001) 6.596 7.689 ( -2.184 5.453 -3.001) 6.596 8.010 ( 5.543 -4.956 -3.951) 8.420 8.010 ( 5.543 4.956 -3.951) 8.420 8.370 ( -4.152 -2.913 5.327) 7.355 8.370 ( -4.152 2.913 5.327) 7.355 8.403 ( 0.943 -7.193 -1.355) 7.380 8.403 ( 0.943 7.193 -1.355) 7.380 8.864 ( -2.397 -5.390 -5.273) 7.912 8.864 ( -2.397 5.390 -5.273) 7.912 9.044 ( 2.525 -0.720 -1.032) 2.821 9.044 ( 2.526 0.720 -1.032) 2.821 9.316 ( -7.309 -3.324 3.205) 8.645 9.316 ( -7.309 3.324 3.205) 8.645 10.030 ( 3.833 -4.408 8.991) 10.722 10.030 ( 3.833 4.408 8.991) 10.722 10.225 ( 4.138 -5.975 -1.985) 7.534 10.225 ( 4.138 5.975 -1.985) 7.534 11.049 ( 1.644 -4.750 1.441) 5.229 11.049 ( 1.644 4.750 1.441) 5.229 11.281 ( -1.328 -3.774 -3.096) 5.059 11.281 ( -1.328 3.774 -3.096) 5.059 11.796 ( -3.942 -3.294 0.797) 5.199 11.796 ( -3.942 3.294 0.797) 5.199 12.004 ( -10.939 -5.211 0.420) 12.124 12.004 ( -10.939 5.211 0.420) 12.124 12.750 ( 0.295 -4.063 0.262) 4.082 12.750 ( 0.295 4.063 0.262) 4.082 13.664 ( 1.870 -1.584 2.169) 3.273 13.664 ( 1.870 1.584 2.169) 3.273 13.690 ( 3.715 -3.247 -1.464) 5.147 13.690 ( 3.715 3.247 -1.464) 5.147 14.059 ( -1.494 -4.791 -3.179) 5.941 14.059 ( -1.494 4.791 -3.179) 5.941 14.757 ( -1.508 -2.815 3.638) 4.841 14.757 ( -1.508 2.815 3.638) 4.841 15.540 ( 2.036 -1.216 -0.746) 2.486 15.540 ( 2.036 1.216 -0.746) 2.486 16.192 ( 7.512 -16.347 4.672) 18.587 16.192 ( 7.512 16.347 4.672) 18.587 16.640 ( -0.470 -8.816 -3.323) 9.433 16.640 ( -0.470 8.816 -3.323) 9.433 17.427 ( 0.078 -3.365 0.558) 3.412 17.427 ( 0.078 3.365 0.558) 3.412 18.447 ( 7.216 -3.191 -1.814) 8.095 18.447 ( 7.216 3.191 -1.814) 8.095 24.527 ( -0.208 -0.804 0.331) 0.894 24.527 ( -0.208 0.804 0.331) 0.894 24.927 ( 2.022 -1.652 -1.270) 2.904 24.927 ( 2.022 1.652 -1.270) 2.904 25.614 ( 4.995 -1.045 1.226) 5.249 25.614 ( 4.995 1.045 1.226) 5.249 26.065 ( 0.576 -2.890 -2.469) 3.844 26.065 ( 0.576 2.890 -2.469) 3.844 26.743 ( -8.752 -1.742 0.059) 8.924 26.743 ( -8.752 1.742 0.059) 8.924 27.150 ( -13.702 -3.094 -7.280) 15.822 27.150 ( -13.702 3.094 -7.280) 15.822 28.000 ( -0.687 -3.588 10.784) 11.386 28.000 ( -0.687 3.588 10.784) 11.386 29.223 ( 5.776 -2.326 -1.564) 6.420 29.223 ( 5.776 2.326 -1.564) 6.420 =================== 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 3/33600 10.0 6424.222 6946.696 10442.695 0.000 1713.942 0.000 3/33600 20.0 2098.797 1993.341 1974.391 0.000 297.020 0.000 3/33600 30.0 780.597 733.587 630.756 0.000 39.767 0.000 3/33600 40.0 364.535 336.411 275.997 0.000 12.333 0.000 3/33600 50.0 200.405 181.727 147.370 0.000 6.151 0.000 3/33600 60.0 124.132 110.943 90.037 0.000 3.746 0.000 3/33600 70.0 84.159 74.290 60.634 0.000 2.521 0.000 3/33600 80.0 61.127 53.360 43.897 0.000 1.810 0.000 3/33600 90.0 46.806 40.440 33.565 0.000 1.365 0.000 3/33600 100.0 37.335 31.951 26.763 0.000 1.070 0.000 3/33600 110.0 30.752 26.089 22.046 0.000 0.867 0.000 3/33600 120.0 25.983 21.872 18.635 0.000 0.721 0.000 3/33600 130.0 22.410 18.735 16.082 0.000 0.613 0.000 3/33600 140.0 19.655 16.334 14.114 0.000 0.532 0.000 3/33600 150.0 17.480 14.452 12.560 0.000 0.468 0.000 3/33600 160.0 15.727 12.946 11.307 0.000 0.418 0.000 3/33600 170.0 14.289 11.719 10.279 0.000 0.377 0.000 3/33600 180.0 13.091 10.703 9.422 0.000 0.344 0.000 3/33600 190.0 12.079 9.851 8.698 0.000 0.316 0.000 3/33600 200.0 11.216 9.127 8.080 0.000 0.293 0.000 3/33600 210.0 10.470 8.505 7.546 0.000 0.273 0.000 3/33600 220.0 9.821 7.966 7.080 0.000 0.256 0.000 3/33600 230.0 9.250 7.494 6.671 0.000 0.241 0.000 3/33600 240.0 8.745 7.078 6.309 0.000 0.228 0.000 3/33600 250.0 8.295 6.708 5.986 0.000 0.216 0.000 3/33600 260.0 7.892 6.378 5.696 0.000 0.206 0.000 3/33600 270.0 7.528 6.081 5.435 0.000 0.197 0.000 3/33600 280.0 7.198 5.813 5.198 0.000 0.188 0.000 3/33600 290.0 6.898 5.569 4.982 0.000 0.181 0.000 3/33600 300.0 6.624 5.346 4.785 0.000 0.174 0.000 3/33600 310.0 6.372 5.142 4.604 0.000 0.167 0.000 3/33600 320.0 6.140 4.954 4.437 0.000 0.162 0.000 3/33600 330.0 5.925 4.780 4.282 0.000 0.156 0.000 3/33600 340.0 5.726 4.620 4.139 0.000 0.151 0.000 3/33600 350.0 5.540 4.470 4.005 0.000 0.147 0.000 3/33600 360.0 5.368 4.331 3.881 0.000 0.142 0.000 3/33600 370.0 5.206 4.201 3.764 0.000 0.138 0.000 3/33600 380.0 5.054 4.079 3.655 0.000 0.134 0.000 3/33600 390.0 4.912 3.964 3.552 0.000 0.131 0.000 3/33600 400.0 4.778 3.857 3.455 0.000 0.128 0.000 3/33600 410.0 4.651 3.755 3.364 0.000 0.124 0.000 3/33600 420.0 4.532 3.659 3.278 0.000 0.121 0.000 3/33600 430.0 4.419 3.568 3.196 0.000 0.119 0.000 3/33600 440.0 4.311 3.482 3.119 0.000 0.116 0.000 3/33600 450.0 4.209 3.400 3.045 0.000 0.113 0.000 3/33600 460.0 4.112 3.322 2.975 0.000 0.111 0.000 3/33600 470.0 4.020 3.248 2.908 0.000 0.108 0.000 3/33600 480.0 3.931 3.177 2.844 0.000 0.106 0.000 3/33600 490.0 3.847 3.109 2.784 0.000 0.104 0.000 3/33600 500.0 3.767 3.045 2.725 0.000 0.102 0.000 3/33600 510.0 3.690 2.983 2.670 0.000 0.100 0.000 3/33600 520.0 3.616 2.924 2.616 0.000 0.098 0.000 3/33600 530.0 3.545 2.867 2.565 0.000 0.096 0.000 3/33600 540.0 3.477 2.812 2.516 0.000 0.095 0.000 3/33600 550.0 3.412 2.760 2.469 0.000 0.093 0.000 3/33600 560.0 3.349 2.709 2.424 0.000 0.091 0.000 3/33600 570.0 3.289 2.661 2.380 0.000 0.090 0.000 3/33600 580.0 3.230 2.614 2.338 0.000 0.088 0.000 3/33600 590.0 3.174 2.569 2.297 0.000 0.087 0.000 3/33600 600.0 3.120 2.525 2.258 0.000 0.085 0.000 3/33600 610.0 3.068 2.483 2.220 0.000 0.084 0.000 3/33600 620.0 3.017 2.443 2.184 0.000 0.083 0.000 3/33600 630.0 2.968 2.403 2.148 0.000 0.081 0.000 3/33600 640.0 2.921 2.365 2.114 0.000 0.080 0.000 3/33600 650.0 2.875 2.329 2.081 0.000 0.079 0.000 3/33600 660.0 2.831 2.293 2.049 0.000 0.078 0.000 3/33600 670.0 2.788 2.258 2.018 0.000 0.077 0.000 3/33600 680.0 2.747 2.225 1.988 0.000 0.076 0.000 3/33600 690.0 2.706 2.192 1.959 0.000 0.075 0.000 3/33600 700.0 2.667 2.161 1.931 0.000 0.073 0.000 3/33600 710.0 2.629 2.130 1.903 0.000 0.072 0.000 3/33600 720.0 2.592 2.101 1.876 0.000 0.071 0.000 3/33600 730.0 2.556 2.072 1.850 0.000 0.071 0.000 3/33600 740.0 2.521 2.043 1.825 0.000 0.070 0.000 3/33600 750.0 2.487 2.016 1.801 0.000 0.069 0.000 3/33600 760.0 2.454 1.990 1.777 0.000 0.068 0.000 3/33600 770.0 2.422 1.964 1.753 0.000 0.067 0.000 3/33600 780.0 2.391 1.938 1.731 0.000 0.066 0.000 3/33600 790.0 2.361 1.914 1.709 0.000 0.065 0.000 3/33600 800.0 2.331 1.890 1.687 0.000 0.065 0.000 3/33600 810.0 2.302 1.867 1.666 0.000 0.064 0.000 3/33600 820.0 2.274 1.844 1.646 0.000 0.063 0.000 3/33600 830.0 2.246 1.822 1.626 0.000 0.062 0.000 3/33600 840.0 2.219 1.800 1.607 0.000 0.062 0.000 3/33600 850.0 2.193 1.779 1.588 0.000 0.061 0.000 3/33600 860.0 2.167 1.758 1.569 0.000 0.060 0.000 3/33600 870.0 2.142 1.738 1.551 0.000 0.059 0.000 3/33600 880.0 2.118 1.718 1.533 0.000 0.059 0.000 3/33600 890.0 2.094 1.699 1.516 0.000 0.058 0.000 3/33600 900.0 2.071 1.680 1.499 0.000 0.058 0.000 3/33600 910.0 2.048 1.662 1.483 0.000 0.057 0.000 3/33600 920.0 2.026 1.644 1.466 0.000 0.056 0.000 3/33600 930.0 2.004 1.626 1.451 0.000 0.056 0.000 3/33600 940.0 1.982 1.609 1.435 0.000 0.055 0.000 3/33600 950.0 1.962 1.592 1.420 0.000 0.055 0.000 3/33600 960.0 1.941 1.575 1.405 0.000 0.054 0.000 3/33600 970.0 1.921 1.559 1.391 0.000 0.053 0.000 3/33600 980.0 1.901 1.543 1.377 0.000 0.053 0.000 3/33600 990.0 1.882 1.528 1.363 0.000 0.052 0.000 3/33600 1000.0 1.863 1.512 1.349 0.000 0.052 0.000 3/33600 Thermal conductivity related properties were written into "kappa-m1085.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 14:43:24]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|