----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 21:23:48]------------------------- Compiled with OpenMP support (max 32 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.901622530001132 -4.556733970000000 0.000000000000000 b 4.901622530001132 4.556733970000000 0.000000000000000 c -1.892060010091136 0.000000000000000 5.063671494598264 Atomic positions (fractional): *1 Li 0.75835003932694 0.24164996067306 0.75000000000000 6.941 2 Li 0.24164996067306 0.75835003932694 0.25000000000000 6.941 *3 O 0.33352278834246 0.37621244953407 0.54261926078111 15.999 4 O 0.37621244953407 0.33352278834246 0.04261926078111 15.999 5 O 0.66647721165754 0.62378755046593 0.45738073921889 15.999 6 O 0.62378755046593 0.66647721165754 0.95738073921889 15.999 *7 O 0.96045049228901 0.79483776475532 0.33600133241548 15.999 *8 O 0.61743939923135 0.12954596258604 0.37223320520310 15.999 9 O 0.03954950771099 0.20516223524468 0.66399866758452 15.999 10 O 0.79483776475532 0.96045049228901 0.83600133241548 15.999 11 O 0.20516223524468 0.03954950771099 0.16399866758452 15.999 12 O 0.38256060076865 0.87045403741396 0.62776679479690 15.999 13 O 0.12954596258604 0.61743939923135 0.87223320520310 15.999 14 O 0.87045403741396 0.38256060076865 0.12776679479690 15.999 *15 Si 0.61233064049940 0.78222869968158 0.71984303610236 28.085 16 Si 0.38766935950060 0.21777130031842 0.28015696389764 28.085 17 Si 0.78222869968158 0.61233064049940 0.21984303610236 28.085 18 Si 0.21777130031842 0.38766935950060 0.78015696389764 28.085 *19 In 0.10805370628645 0.89194629371355 0.75000000000000 114.818 20 In 0.89194629371355 0.10805370628645 0.25000000000000 114.818 -------------------------------- unit cell --------------------------------- Lattice vectors: a 9.803245060002263 0.000000000000000 0.000000000000000 b 0.000000000000000 9.113467940000000 0.000000000000000 c -1.892060010091136 0.000000000000000 5.063671494598264 Atomic positions (fractional): *1 Li 0.00000000000000 0.24164996067306 0.75000000000000 6.941 > 1 2 Li 0.00000000000000 0.75835003932694 0.25000000000000 6.941 > 2 3 Li 0.50000000000000 0.74164996067306 0.75000000000000 6.941 > 1 4 Li 0.50000000000000 0.25835003932694 0.25000000000000 6.941 > 2 *5 O 0.85486761893826 0.52134483059581 0.54261926078111 15.999 > 3 6 O 0.85486761893826 0.47865516940419 0.04261926078111 15.999 > 4 7 O 0.14513238106174 0.47865516940419 0.45738073921889 15.999 > 5 8 O 0.14513238106174 0.52134483059581 0.95738073921889 15.999 > 6 *9 O 0.37764412852216 0.41719363623315 0.33600133241548 15.999 > 7 *10 O 0.87349268090870 0.25605328167734 0.37223320520310 15.999 > 8 11 O 0.62235587147784 0.58280636376684 0.66399866758452 15.999 > 9 12 O 0.37764412852216 0.58280636376684 0.83600133241548 15.999 > 10 13 O 0.62235587147784 0.41719363623315 0.16399866758452 15.999 > 11 14 O 0.12650731909130 0.74394671832266 0.62776679479690 15.999 > 12 15 O 0.87349268090870 0.74394671832266 0.87223320520310 15.999 > 13 16 O 0.12650731909130 0.25605328167734 0.12776679479690 15.999 > 14 17 O 0.35486761893826 0.02134483059581 0.54261926078111 15.999 > 3 18 O 0.35486761893826 0.97865516940419 0.04261926078111 15.999 > 4 19 O 0.64513238106174 0.97865516940419 0.45738073921889 15.999 > 5 20 O 0.64513238106174 0.02134483059581 0.95738073921889 15.999 > 6 21 O 0.87764412852216 0.91719363623316 0.33600133241548 15.999 > 7 22 O 0.37349268090869 0.75605328167734 0.37223320520310 15.999 > 8 23 O 0.12235587147784 0.08280636376684 0.66399866758452 15.999 > 9 24 O 0.87764412852216 0.08280636376684 0.83600133241548 15.999 > 10 25 O 0.12235587147784 0.91719363623316 0.16399866758452 15.999 > 11 26 O 0.62650731909130 0.24394671832266 0.62776679479690 15.999 > 12 27 O 0.37349268090869 0.24394671832266 0.87223320520310 15.999 > 13 28 O 0.62650731909130 0.75605328167734 0.12776679479690 15.999 > 14 *29 Si 0.19727967009049 0.58494902959109 0.71984303610236 28.085 > 15 30 Si 0.80272032990951 0.41505097040891 0.28015696389764 28.085 > 16 31 Si 0.19727967009049 0.41505097040891 0.21984303610236 28.085 > 17 32 Si 0.80272032990951 0.58494902959109 0.78015696389764 28.085 > 18 33 Si 0.69727967009049 0.08494902959109 0.71984303610236 28.085 > 15 34 Si 0.30272032990951 0.91505097040891 0.28015696389764 28.085 > 16 35 Si 0.69727967009049 0.91505097040891 0.21984303610236 28.085 > 17 36 Si 0.30272032990951 0.08494902959109 0.78015696389764 28.085 > 18 *37 In 0.00000000000000 0.89194629371355 0.75000000000000 114.818 > 19 38 In 0.00000000000000 0.10805370628645 0.25000000000000 114.818 > 20 39 In 0.50000000000000 0.39194629371355 0.75000000000000 114.818 > 19 40 In 0.50000000000000 0.60805370628645 0.25000000000000 114.818 > 20 -------------------------------- super cell -------------------------------- Lattice vectors: a 9.803245060002263 0.000000000000000 0.000000000000000 b 0.000000000000000 9.113467940000000 0.000000000000000 c -3.784120020182272 0.000000000000000 10.127342989196528 Atomic positions (fractional): *1 Li 0.00000000000000 0.24164996067306 0.37500000000000 6.941 > 1 2 Li 0.00000000000000 0.24164996067306 0.87500000000000 6.941 > 1 3 Li 0.00000000000000 0.75835003932694 0.12500000000000 6.941 > 2 4 Li 0.00000000000000 0.75835003932694 0.62500000000000 6.941 > 2 5 Li 0.50000000000000 0.74164996067306 0.37500000000000 6.941 > 1 6 Li 0.50000000000000 0.74164996067306 0.87500000000000 6.941 > 1 7 Li 0.50000000000000 0.25835003932694 0.12500000000000 6.941 > 2 8 Li 0.50000000000000 0.25835003932694 0.62500000000000 6.941 > 2 *9 O 0.85486761893826 0.52134483059581 0.27130963039056 15.999 > 3 10 O 0.85486761893826 0.52134483059581 0.77130963039056 15.999 > 3 11 O 0.85486761893826 0.47865516940419 0.02130963039056 15.999 > 4 12 O 0.85486761893826 0.47865516940419 0.52130963039056 15.999 > 4 13 O 0.14513238106174 0.47865516940419 0.22869036960944 15.999 > 5 14 O 0.14513238106174 0.47865516940419 0.72869036960944 15.999 > 5 15 O 0.14513238106174 0.52134483059581 0.47869036960944 15.999 > 6 16 O 0.14513238106174 0.52134483059581 0.97869036960944 15.999 > 6 *17 O 0.37764412852216 0.41719363623315 0.16800066620774 15.999 > 7 18 O 0.37764412852216 0.41719363623315 0.66800066620774 15.999 > 7 *19 O 0.87349268090870 0.25605328167734 0.18611660260155 15.999 > 8 20 O 0.87349268090870 0.25605328167734 0.68611660260155 15.999 > 8 21 O 0.62235587147784 0.58280636376684 0.33199933379226 15.999 > 9 22 O 0.62235587147784 0.58280636376684 0.83199933379226 15.999 > 9 23 O 0.37764412852216 0.58280636376684 0.41800066620774 15.999 > 10 24 O 0.37764412852216 0.58280636376684 0.91800066620774 15.999 > 10 25 O 0.62235587147784 0.41719363623315 0.08199933379226 15.999 > 11 26 O 0.62235587147784 0.41719363623315 0.58199933379226 15.999 > 11 27 O 0.12650731909130 0.74394671832266 0.31388339739845 15.999 > 12 28 O 0.12650731909130 0.74394671832266 0.81388339739845 15.999 > 12 29 O 0.87349268090870 0.74394671832266 0.43611660260155 15.999 > 13 30 O 0.87349268090870 0.74394671832266 0.93611660260155 15.999 > 13 31 O 0.12650731909130 0.25605328167734 0.06388339739845 15.999 > 14 32 O 0.12650731909130 0.25605328167734 0.56388339739845 15.999 > 14 33 O 0.35486761893826 0.02134483059581 0.27130963039056 15.999 > 3 34 O 0.35486761893826 0.02134483059581 0.77130963039056 15.999 > 3 35 O 0.35486761893826 0.97865516940419 0.02130963039056 15.999 > 4 36 O 0.35486761893826 0.97865516940419 0.52130963039056 15.999 > 4 37 O 0.64513238106174 0.97865516940419 0.22869036960944 15.999 > 5 38 O 0.64513238106174 0.97865516940419 0.72869036960944 15.999 > 5 39 O 0.64513238106174 0.02134483059581 0.47869036960944 15.999 > 6 40 O 0.64513238106174 0.02134483059581 0.97869036960944 15.999 > 6 41 O 0.87764412852216 0.91719363623316 0.16800066620774 15.999 > 7 42 O 0.87764412852216 0.91719363623316 0.66800066620774 15.999 > 7 43 O 0.37349268090869 0.75605328167734 0.18611660260155 15.999 > 8 44 O 0.37349268090869 0.75605328167734 0.68611660260155 15.999 > 8 45 O 0.12235587147784 0.08280636376684 0.33199933379226 15.999 > 9 46 O 0.12235587147784 0.08280636376684 0.83199933379226 15.999 > 9 47 O 0.87764412852216 0.08280636376684 0.41800066620774 15.999 > 10 48 O 0.87764412852216 0.08280636376684 0.91800066620774 15.999 > 10 49 O 0.12235587147784 0.91719363623316 0.08199933379226 15.999 > 11 50 O 0.12235587147784 0.91719363623316 0.58199933379226 15.999 > 11 51 O 0.62650731909130 0.24394671832266 0.31388339739845 15.999 > 12 52 O 0.62650731909130 0.24394671832266 0.81388339739845 15.999 > 12 53 O 0.37349268090869 0.24394671832266 0.43611660260155 15.999 > 13 54 O 0.37349268090869 0.24394671832266 0.93611660260155 15.999 > 13 55 O 0.62650731909130 0.75605328167734 0.06388339739845 15.999 > 14 56 O 0.62650731909130 0.75605328167734 0.56388339739845 15.999 > 14 *57 Si 0.19727967009049 0.58494902959109 0.35992151805118 28.085 > 15 58 Si 0.19727967009049 0.58494902959109 0.85992151805118 28.085 > 15 59 Si 0.80272032990951 0.41505097040891 0.14007848194882 28.085 > 16 60 Si 0.80272032990951 0.41505097040891 0.64007848194882 28.085 > 16 61 Si 0.19727967009049 0.41505097040891 0.10992151805118 28.085 > 17 62 Si 0.19727967009049 0.41505097040891 0.60992151805118 28.085 > 17 63 Si 0.80272032990951 0.58494902959109 0.39007848194882 28.085 > 18 64 Si 0.80272032990951 0.58494902959109 0.89007848194882 28.085 > 18 65 Si 0.69727967009049 0.08494902959109 0.35992151805118 28.085 > 15 66 Si 0.69727967009049 0.08494902959109 0.85992151805118 28.085 > 15 67 Si 0.30272032990951 0.91505097040891 0.14007848194882 28.085 > 16 68 Si 0.30272032990951 0.91505097040891 0.64007848194882 28.085 > 16 69 Si 0.69727967009049 0.91505097040891 0.10992151805118 28.085 > 17 70 Si 0.69727967009049 0.91505097040891 0.60992151805118 28.085 > 17 71 Si 0.30272032990951 0.08494902959109 0.39007848194882 28.085 > 18 72 Si 0.30272032990951 0.08494902959109 0.89007848194882 28.085 > 18 *73 In 0.00000000000000 0.89194629371355 0.37500000000000 114.818 > 19 74 In 0.00000000000000 0.89194629371355 0.87500000000000 114.818 > 19 75 In 0.00000000000000 0.10805370628645 0.12500000000000 114.818 > 20 76 In 0.00000000000000 0.10805370628645 0.62500000000000 114.818 > 20 77 In 0.50000000000000 0.39194629371355 0.37500000000000 114.818 > 19 78 In 0.50000000000000 0.39194629371355 0.87500000000000 114.818 > 19 79 In 0.50000000000000 0.60805370628645 0.12500000000000 114.818 > 20 80 In 0.50000000000000 0.60805370628645 0.62500000000000 114.818 > 20 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.0905883 0.0000000 -0.0341901 0.0000000 3.1015299 0.0000000 -0.0341901 0.0000000 3.1299513 -------------------------- Born effective charges -------------------------- 1 Li 1.0160678 0.0000000 0.0238203 0.0000000 1.0766505 -0.0000000 0.0282890 0.0000000 1.1929922 2 Li 1.0160678 0.0000000 0.0238203 0.0000000 1.0766505 -0.0000000 0.0282890 0.0000000 1.1929922 3 O -1.5213369 0.2658791 0.3479313 0.2335304 -1.6266680 -0.7313006 0.3143358 -0.7933242 -2.3163787 4 O -1.5213369 -0.2658791 0.3479313 -0.2335304 -1.6266680 0.7313006 0.3143358 0.7933242 -2.3163787 5 O -1.5213369 0.2658791 0.3479313 0.2335304 -1.6266680 -0.7313006 0.3143358 -0.7933242 -2.3163787 6 O -1.5213369 -0.2658791 0.3479313 -0.2335304 -1.6266680 0.7313006 0.3143358 0.7933242 -2.3163787 7 O -2.2264130 -0.2447073 -0.2945145 -0.1954454 -1.4975316 0.1039550 -0.2856526 0.1338942 -1.8846343 8 O -1.6658127 0.6882101 -0.0243346 0.5889934 -2.2559397 0.2266032 -0.0052474 0.1210454 -1.4237511 9 O -2.2264130 -0.2447073 -0.2945145 -0.1954454 -1.4975316 0.1039550 -0.2856526 0.1338942 -1.8846343 10 O -2.2264130 0.2447073 -0.2945145 0.1954454 -1.4975316 -0.1039550 -0.2856526 -0.1338942 -1.8846343 11 O -2.2264130 0.2447073 -0.2945145 0.1954454 -1.4975316 -0.1039550 -0.2856526 -0.1338942 -1.8846343 12 O -1.6658127 0.6882101 -0.0243346 0.5889934 -2.2559397 0.2266032 -0.0052474 0.1210454 -1.4237511 13 O -1.6658127 -0.6882101 -0.0243346 -0.5889934 -2.2559397 -0.2266032 -0.0052474 -0.1210454 -1.4237511 14 O -1.6658127 -0.6882101 -0.0243346 -0.5889934 -2.2559397 -0.2266032 -0.0052474 -0.1210454 -1.4237511 15 Si 3.2847017 -0.4694275 0.0102671 -0.1769860 3.1829072 -0.3662608 0.0151305 0.0200218 3.4421811 16 Si 3.2847017 -0.4694275 0.0102671 -0.1769860 3.1829072 -0.3662608 0.0151305 0.0200218 3.4421811 17 Si 3.2847017 0.4694275 0.0102671 0.1769860 3.1829072 0.3662608 0.0151305 -0.0200218 3.4421811 18 Si 3.2847017 0.4694275 0.0102671 0.1769860 3.1829072 0.3662608 0.0151305 -0.0200218 3.4421811 19 In 3.2416540 0.0000000 -0.1025189 0.0000000 3.3178139 -0.0000000 -0.1054214 0.0000000 3.1721738 20 In 3.2416540 0.0000000 -0.1025189 0.0000000 3.3178139 -0.0000000 -0.1054214 0.0000000 3.1721738 ---------------------------------------------------------------------------- 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: 240/240 Permutation basis: 8772/8772 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1894 Number of blocks in projector: 1894 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: 408 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 234 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 234 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 234 Use standard eigh solver. Tree of FC basis block matrices: - (1894, 1849), data: False |-- (234, 228), data: True |-- (234, 228), data: True |-- (234, 228), data: True |-- (392, 384), data: True |-- (392, 384), data: True |-- (408, 397), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 640 - Time: 0.380 Solver_block: 200 / 640 - Time: 0.325 Solver_block: 300 / 640 - Time: 0.319 Solver_block: 400 / 640 - Time: 0.320 Solver_block: 500 / 640 - Time: 0.319 Solver_block: 600 / 640 - Time: 0.319 Solver_block: 640 / 640 - Time: 0.147 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 2.168 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 240/240 Permutation basis: 8772/8772 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1894 Number of blocks in projector: 1894 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: 408 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 234 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 234 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 234 Use standard eigh solver. Tree of FC basis block matrices: - (1894, 1849), data: False |-- (234, 228), data: True |-- (234, 228), data: True |-- (234, 228), data: True |-- (392, 384), data: True |-- (392, 384), data: True |-- (408, 397), data: True Max drift after symmetrization by symfc projector: 0.00000000 (xx) 0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-07 21:24:12]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 21:24:12]------------------------- Compiled with OpenMP support (max 32 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.901622530001132 -4.556733970000000 0.000000000000000 b 4.901622530001132 4.556733970000000 0.000000000000000 c -1.892060010091136 0.000000000000000 5.063671494598264 Atomic positions (fractional): 1 Li 0.75835003932694 0.24164996067306 0.75000000000000 6.941 2 Li 0.24164996067306 0.75835003932694 0.25000000000000 6.941 3 O 0.33352278834246 0.37621244953407 0.54261926078111 15.999 4 O 0.37621244953407 0.33352278834246 0.04261926078111 15.999 5 O 0.66647721165754 0.62378755046593 0.45738073921889 15.999 6 O 0.62378755046593 0.66647721165754 0.95738073921889 15.999 7 O 0.96045049228901 0.79483776475532 0.33600133241548 15.999 8 O 0.61743939923135 0.12954596258604 0.37223320520310 15.999 9 O 0.03954950771099 0.20516223524468 0.66399866758452 15.999 10 O 0.79483776475532 0.96045049228901 0.83600133241548 15.999 11 O 0.20516223524468 0.03954950771099 0.16399866758452 15.999 12 O 0.38256060076865 0.87045403741396 0.62776679479690 15.999 13 O 0.12954596258604 0.61743939923135 0.87223320520310 15.999 14 O 0.87045403741396 0.38256060076865 0.12776679479690 15.999 15 Si 0.61233064049940 0.78222869968158 0.71984303610236 28.085 16 Si 0.38766935950060 0.21777130031842 0.28015696389764 28.085 17 Si 0.78222869968158 0.61233064049940 0.21984303610236 28.085 18 Si 0.21777130031842 0.38766935950060 0.78015696389764 28.085 19 In 0.10805370628645 0.89194629371355 0.75000000000000 114.818 20 In 0.89194629371355 0.10805370628645 0.25000000000000 114.818 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.803245060002263 0.000000000000000 0.000000000000000 b 0.000000000000000 9.113467940000000 0.000000000000000 c -3.784120020182272 0.000000000000000 10.127342989196528 Atomic positions (fractional): 1 Li 0.00000000000000 0.24164996067306 0.37500000000000 6.941 > 1 2 Li 0.00000000000000 0.24164996067306 0.87500000000000 6.941 > 1 3 Li 0.00000000000000 0.75835003932694 0.12500000000000 6.941 > 3 4 Li 0.00000000000000 0.75835003932694 0.62500000000000 6.941 > 3 5 Li 0.50000000000000 0.74164996067306 0.37500000000000 6.941 > 1 6 Li 0.50000000000000 0.74164996067306 0.87500000000000 6.941 > 1 7 Li 0.50000000000000 0.25835003932694 0.12500000000000 6.941 > 3 8 Li 0.50000000000000 0.25835003932694 0.62500000000000 6.941 > 3 9 O 0.85486761893826 0.52134483059581 0.27130963039056 15.999 > 9 10 O 0.85486761893826 0.52134483059581 0.77130963039056 15.999 > 9 11 O 0.85486761893826 0.47865516940419 0.02130963039056 15.999 > 11 12 O 0.85486761893826 0.47865516940419 0.52130963039056 15.999 > 11 13 O 0.14513238106174 0.47865516940419 0.22869036960944 15.999 > 13 14 O 0.14513238106174 0.47865516940419 0.72869036960944 15.999 > 13 15 O 0.14513238106174 0.52134483059581 0.47869036960944 15.999 > 15 16 O 0.14513238106174 0.52134483059581 0.97869036960944 15.999 > 15 17 O 0.37764412852216 0.41719363623315 0.16800066620774 15.999 > 17 18 O 0.37764412852216 0.41719363623315 0.66800066620774 15.999 > 17 19 O 0.87349268090870 0.25605328167734 0.18611660260155 15.999 > 19 20 O 0.87349268090870 0.25605328167734 0.68611660260155 15.999 > 19 21 O 0.62235587147784 0.58280636376684 0.33199933379226 15.999 > 21 22 O 0.62235587147784 0.58280636376684 0.83199933379226 15.999 > 21 23 O 0.37764412852216 0.58280636376684 0.41800066620774 15.999 > 23 24 O 0.37764412852216 0.58280636376684 0.91800066620774 15.999 > 23 25 O 0.62235587147784 0.41719363623315 0.08199933379226 15.999 > 25 26 O 0.62235587147784 0.41719363623315 0.58199933379226 15.999 > 25 27 O 0.12650731909130 0.74394671832266 0.31388339739845 15.999 > 27 28 O 0.12650731909130 0.74394671832266 0.81388339739845 15.999 > 27 29 O 0.87349268090870 0.74394671832266 0.43611660260155 15.999 > 29 30 O 0.87349268090870 0.74394671832266 0.93611660260155 15.999 > 29 31 O 0.12650731909130 0.25605328167734 0.06388339739845 15.999 > 31 32 O 0.12650731909130 0.25605328167734 0.56388339739845 15.999 > 31 33 O 0.35486761893826 0.02134483059581 0.27130963039056 15.999 > 9 34 O 0.35486761893826 0.02134483059581 0.77130963039056 15.999 > 9 35 O 0.35486761893826 0.97865516940419 0.02130963039056 15.999 > 11 36 O 0.35486761893826 0.97865516940419 0.52130963039056 15.999 > 11 37 O 0.64513238106174 0.97865516940419 0.22869036960944 15.999 > 13 38 O 0.64513238106174 0.97865516940419 0.72869036960944 15.999 > 13 39 O 0.64513238106174 0.02134483059581 0.47869036960944 15.999 > 15 40 O 0.64513238106174 0.02134483059581 0.97869036960944 15.999 > 15 41 O 0.87764412852216 0.91719363623316 0.16800066620774 15.999 > 17 42 O 0.87764412852216 0.91719363623316 0.66800066620774 15.999 > 17 43 O 0.37349268090869 0.75605328167734 0.18611660260155 15.999 > 19 44 O 0.37349268090869 0.75605328167734 0.68611660260155 15.999 > 19 45 O 0.12235587147784 0.08280636376684 0.33199933379226 15.999 > 21 46 O 0.12235587147784 0.08280636376684 0.83199933379226 15.999 > 21 47 O 0.87764412852216 0.08280636376684 0.41800066620774 15.999 > 23 48 O 0.87764412852216 0.08280636376684 0.91800066620774 15.999 > 23 49 O 0.12235587147784 0.91719363623316 0.08199933379226 15.999 > 25 50 O 0.12235587147784 0.91719363623316 0.58199933379226 15.999 > 25 51 O 0.62650731909130 0.24394671832266 0.31388339739845 15.999 > 27 52 O 0.62650731909130 0.24394671832266 0.81388339739845 15.999 > 27 53 O 0.37349268090869 0.24394671832266 0.43611660260155 15.999 > 29 54 O 0.37349268090869 0.24394671832266 0.93611660260155 15.999 > 29 55 O 0.62650731909130 0.75605328167734 0.06388339739845 15.999 > 31 56 O 0.62650731909130 0.75605328167734 0.56388339739845 15.999 > 31 57 Si 0.19727967009049 0.58494902959109 0.35992151805118 28.085 > 57 58 Si 0.19727967009049 0.58494902959109 0.85992151805118 28.085 > 57 59 Si 0.80272032990951 0.41505097040891 0.14007848194882 28.085 > 59 60 Si 0.80272032990951 0.41505097040891 0.64007848194882 28.085 > 59 61 Si 0.19727967009049 0.41505097040891 0.10992151805118 28.085 > 61 62 Si 0.19727967009049 0.41505097040891 0.60992151805118 28.085 > 61 63 Si 0.80272032990951 0.58494902959109 0.39007848194882 28.085 > 63 64 Si 0.80272032990951 0.58494902959109 0.89007848194882 28.085 > 63 65 Si 0.69727967009049 0.08494902959109 0.35992151805118 28.085 > 57 66 Si 0.69727967009049 0.08494902959109 0.85992151805118 28.085 > 57 67 Si 0.30272032990951 0.91505097040891 0.14007848194882 28.085 > 59 68 Si 0.30272032990951 0.91505097040891 0.64007848194882 28.085 > 59 69 Si 0.69727967009049 0.91505097040891 0.10992151805118 28.085 > 61 70 Si 0.69727967009049 0.91505097040891 0.60992151805118 28.085 > 61 71 Si 0.30272032990951 0.08494902959109 0.39007848194882 28.085 > 63 72 Si 0.30272032990951 0.08494902959109 0.89007848194882 28.085 > 63 73 In 0.00000000000000 0.89194629371355 0.37500000000000 114.818 > 73 74 In 0.00000000000000 0.89194629371355 0.87500000000000 114.818 > 73 75 In 0.00000000000000 0.10805370628645 0.12500000000000 114.818 > 75 76 In 0.00000000000000 0.10805370628645 0.62500000000000 114.818 > 75 77 In 0.50000000000000 0.39194629371355 0.37500000000000 114.818 > 73 78 In 0.50000000000000 0.39194629371355 0.87500000000000 114.818 > 73 79 In 0.50000000000000 0.60805370628645 0.12500000000000 114.818 > 75 80 In 0.50000000000000 0.60805370628645 0.62500000000000 114.818 > 75 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.0905883 0.0000000 -0.0341901 0.0000000 3.1015299 0.0000000 -0.0341901 0.0000000 3.1299513 -------------------------- Born effective charges -------------------------- 1 Li 1.0160678 0.0000000 0.0238203 0.0000000 1.0766505 -0.0000000 0.0282890 0.0000000 1.1929922 2 Li 1.0160678 0.0000000 0.0238203 0.0000000 1.0766505 -0.0000000 0.0282890 0.0000000 1.1929922 3 O -1.5213369 0.2658791 0.3479313 0.2335304 -1.6266680 -0.7313006 0.3143358 -0.7933242 -2.3163787 4 O -1.5213369 -0.2658791 0.3479313 -0.2335304 -1.6266680 0.7313006 0.3143358 0.7933242 -2.3163787 5 O -1.5213369 0.2658791 0.3479313 0.2335304 -1.6266680 -0.7313006 0.3143358 -0.7933242 -2.3163787 6 O -1.5213369 -0.2658791 0.3479313 -0.2335304 -1.6266680 0.7313006 0.3143358 0.7933242 -2.3163787 7 O -2.2264130 -0.2447073 -0.2945145 -0.1954454 -1.4975316 0.1039550 -0.2856526 0.1338942 -1.8846343 8 O -1.6658127 0.6882101 -0.0243346 0.5889934 -2.2559397 0.2266032 -0.0052474 0.1210454 -1.4237511 9 O -2.2264130 -0.2447073 -0.2945145 -0.1954454 -1.4975316 0.1039550 -0.2856526 0.1338942 -1.8846343 10 O -2.2264130 0.2447073 -0.2945145 0.1954454 -1.4975316 -0.1039550 -0.2856526 -0.1338942 -1.8846343 11 O -2.2264130 0.2447073 -0.2945145 0.1954454 -1.4975316 -0.1039550 -0.2856526 -0.1338942 -1.8846343 12 O -1.6658127 0.6882101 -0.0243346 0.5889934 -2.2559397 0.2266032 -0.0052474 0.1210454 -1.4237511 13 O -1.6658127 -0.6882101 -0.0243346 -0.5889934 -2.2559397 -0.2266032 -0.0052474 -0.1210454 -1.4237511 14 O -1.6658127 -0.6882101 -0.0243346 -0.5889934 -2.2559397 -0.2266032 -0.0052474 -0.1210454 -1.4237511 15 Si 3.2847017 -0.4694275 0.0102671 -0.1769860 3.1829072 -0.3662608 0.0151305 0.0200218 3.4421811 16 Si 3.2847017 -0.4694275 0.0102671 -0.1769860 3.1829072 -0.3662608 0.0151305 0.0200218 3.4421811 17 Si 3.2847017 0.4694275 0.0102671 0.1769860 3.1829072 0.3662608 0.0151305 -0.0200218 3.4421811 18 Si 3.2847017 0.4694275 0.0102671 0.1769860 3.1829072 0.3662608 0.0151305 -0.0200218 3.4421811 19 In 3.2416540 0.0000000 -0.1025189 0.0000000 3.3178139 -0.0000000 -0.1054214 0.0000000 3.1721738 20 In 3.2416540 0.0000000 -0.1025189 0.0000000 3.3178139 -0.0000000 -0.1054214 0.0000000 3.1721738 ---------------------------------------------------------------------------- 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] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Computing fc3[ 9, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] 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] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Computing fc3[ 19, 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] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] 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] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000008 (yyy) 0.00000008 (yyy) 0.00000008 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000005 (zx) 0.00000005 (zx) 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 2026-01-07 21:24:29]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 21:24:29]------------------------- Compiled with OpenMP support (max 32 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.901622530001132 -4.556733970000000 0.000000000000000 b 4.901622530001132 4.556733970000000 0.000000000000000 c -1.892060010091136 0.000000000000000 5.063671494598264 Atomic positions (fractional): 1 Li 0.75835003932694 0.24164996067306 0.75000000000000 6.941 2 Li 0.24164996067306 0.75835003932694 0.25000000000000 6.941 3 O 0.33352278834246 0.37621244953407 0.54261926078111 15.999 4 O 0.37621244953407 0.33352278834246 0.04261926078111 15.999 5 O 0.66647721165754 0.62378755046593 0.45738073921889 15.999 6 O 0.62378755046593 0.66647721165754 0.95738073921889 15.999 7 O 0.96045049228901 0.79483776475532 0.33600133241548 15.999 8 O 0.61743939923135 0.12954596258604 0.37223320520310 15.999 9 O 0.03954950771099 0.20516223524468 0.66399866758452 15.999 10 O 0.79483776475532 0.96045049228901 0.83600133241548 15.999 11 O 0.20516223524468 0.03954950771099 0.16399866758452 15.999 12 O 0.38256060076865 0.87045403741396 0.62776679479690 15.999 13 O 0.12954596258604 0.61743939923135 0.87223320520310 15.999 14 O 0.87045403741396 0.38256060076865 0.12776679479690 15.999 15 Si 0.61233064049940 0.78222869968158 0.71984303610236 28.085 16 Si 0.38766935950060 0.21777130031842 0.28015696389764 28.085 17 Si 0.78222869968158 0.61233064049940 0.21984303610236 28.085 18 Si 0.21777130031842 0.38766935950060 0.78015696389764 28.085 19 In 0.10805370628645 0.89194629371355 0.75000000000000 114.818 20 In 0.89194629371355 0.10805370628645 0.25000000000000 114.818 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.803245060002263 0.000000000000000 0.000000000000000 b 0.000000000000000 9.113467940000000 0.000000000000000 c -3.784120020182272 0.000000000000000 10.127342989196528 Atomic positions (fractional): 1 Li 0.00000000000000 0.24164996067306 0.37500000000000 6.941 > 1 2 Li 0.00000000000000 0.24164996067306 0.87500000000000 6.941 > 1 3 Li 0.00000000000000 0.75835003932694 0.12500000000000 6.941 > 3 4 Li 0.00000000000000 0.75835003932694 0.62500000000000 6.941 > 3 5 Li 0.50000000000000 0.74164996067306 0.37500000000000 6.941 > 1 6 Li 0.50000000000000 0.74164996067306 0.87500000000000 6.941 > 1 7 Li 0.50000000000000 0.25835003932694 0.12500000000000 6.941 > 3 8 Li 0.50000000000000 0.25835003932694 0.62500000000000 6.941 > 3 9 O 0.85486761893826 0.52134483059581 0.27130963039056 15.999 > 9 10 O 0.85486761893826 0.52134483059581 0.77130963039056 15.999 > 9 11 O 0.85486761893826 0.47865516940419 0.02130963039056 15.999 > 11 12 O 0.85486761893826 0.47865516940419 0.52130963039056 15.999 > 11 13 O 0.14513238106174 0.47865516940419 0.22869036960944 15.999 > 13 14 O 0.14513238106174 0.47865516940419 0.72869036960944 15.999 > 13 15 O 0.14513238106174 0.52134483059581 0.47869036960944 15.999 > 15 16 O 0.14513238106174 0.52134483059581 0.97869036960944 15.999 > 15 17 O 0.37764412852216 0.41719363623315 0.16800066620774 15.999 > 17 18 O 0.37764412852216 0.41719363623315 0.66800066620774 15.999 > 17 19 O 0.87349268090870 0.25605328167734 0.18611660260155 15.999 > 19 20 O 0.87349268090870 0.25605328167734 0.68611660260155 15.999 > 19 21 O 0.62235587147784 0.58280636376684 0.33199933379226 15.999 > 21 22 O 0.62235587147784 0.58280636376684 0.83199933379226 15.999 > 21 23 O 0.37764412852216 0.58280636376684 0.41800066620774 15.999 > 23 24 O 0.37764412852216 0.58280636376684 0.91800066620774 15.999 > 23 25 O 0.62235587147784 0.41719363623315 0.08199933379226 15.999 > 25 26 O 0.62235587147784 0.41719363623315 0.58199933379226 15.999 > 25 27 O 0.12650731909130 0.74394671832266 0.31388339739845 15.999 > 27 28 O 0.12650731909130 0.74394671832266 0.81388339739845 15.999 > 27 29 O 0.87349268090870 0.74394671832266 0.43611660260155 15.999 > 29 30 O 0.87349268090870 0.74394671832266 0.93611660260155 15.999 > 29 31 O 0.12650731909130 0.25605328167734 0.06388339739845 15.999 > 31 32 O 0.12650731909130 0.25605328167734 0.56388339739845 15.999 > 31 33 O 0.35486761893826 0.02134483059581 0.27130963039056 15.999 > 9 34 O 0.35486761893826 0.02134483059581 0.77130963039056 15.999 > 9 35 O 0.35486761893826 0.97865516940419 0.02130963039056 15.999 > 11 36 O 0.35486761893826 0.97865516940419 0.52130963039056 15.999 > 11 37 O 0.64513238106174 0.97865516940419 0.22869036960944 15.999 > 13 38 O 0.64513238106174 0.97865516940419 0.72869036960944 15.999 > 13 39 O 0.64513238106174 0.02134483059581 0.47869036960944 15.999 > 15 40 O 0.64513238106174 0.02134483059581 0.97869036960944 15.999 > 15 41 O 0.87764412852216 0.91719363623316 0.16800066620774 15.999 > 17 42 O 0.87764412852216 0.91719363623316 0.66800066620774 15.999 > 17 43 O 0.37349268090869 0.75605328167734 0.18611660260155 15.999 > 19 44 O 0.37349268090869 0.75605328167734 0.68611660260155 15.999 > 19 45 O 0.12235587147784 0.08280636376684 0.33199933379226 15.999 > 21 46 O 0.12235587147784 0.08280636376684 0.83199933379226 15.999 > 21 47 O 0.87764412852216 0.08280636376684 0.41800066620774 15.999 > 23 48 O 0.87764412852216 0.08280636376684 0.91800066620774 15.999 > 23 49 O 0.12235587147784 0.91719363623316 0.08199933379226 15.999 > 25 50 O 0.12235587147784 0.91719363623316 0.58199933379226 15.999 > 25 51 O 0.62650731909130 0.24394671832266 0.31388339739845 15.999 > 27 52 O 0.62650731909130 0.24394671832266 0.81388339739845 15.999 > 27 53 O 0.37349268090869 0.24394671832266 0.43611660260155 15.999 > 29 54 O 0.37349268090869 0.24394671832266 0.93611660260155 15.999 > 29 55 O 0.62650731909130 0.75605328167734 0.06388339739845 15.999 > 31 56 O 0.62650731909130 0.75605328167734 0.56388339739845 15.999 > 31 57 Si 0.19727967009049 0.58494902959109 0.35992151805118 28.085 > 57 58 Si 0.19727967009049 0.58494902959109 0.85992151805118 28.085 > 57 59 Si 0.80272032990951 0.41505097040891 0.14007848194882 28.085 > 59 60 Si 0.80272032990951 0.41505097040891 0.64007848194882 28.085 > 59 61 Si 0.19727967009049 0.41505097040891 0.10992151805118 28.085 > 61 62 Si 0.19727967009049 0.41505097040891 0.60992151805118 28.085 > 61 63 Si 0.80272032990951 0.58494902959109 0.39007848194882 28.085 > 63 64 Si 0.80272032990951 0.58494902959109 0.89007848194882 28.085 > 63 65 Si 0.69727967009049 0.08494902959109 0.35992151805118 28.085 > 57 66 Si 0.69727967009049 0.08494902959109 0.85992151805118 28.085 > 57 67 Si 0.30272032990951 0.91505097040891 0.14007848194882 28.085 > 59 68 Si 0.30272032990951 0.91505097040891 0.64007848194882 28.085 > 59 69 Si 0.69727967009049 0.91505097040891 0.10992151805118 28.085 > 61 70 Si 0.69727967009049 0.91505097040891 0.60992151805118 28.085 > 61 71 Si 0.30272032990951 0.08494902959109 0.39007848194882 28.085 > 63 72 Si 0.30272032990951 0.08494902959109 0.89007848194882 28.085 > 63 73 In 0.00000000000000 0.89194629371355 0.37500000000000 114.818 > 73 74 In 0.00000000000000 0.89194629371355 0.87500000000000 114.818 > 73 75 In 0.00000000000000 0.10805370628645 0.12500000000000 114.818 > 75 76 In 0.00000000000000 0.10805370628645 0.62500000000000 114.818 > 75 77 In 0.50000000000000 0.39194629371355 0.37500000000000 114.818 > 73 78 In 0.50000000000000 0.39194629371355 0.87500000000000 114.818 > 73 79 In 0.50000000000000 0.60805370628645 0.12500000000000 114.818 > 75 80 In 0.50000000000000 0.60805370628645 0.62500000000000 114.818 > 75 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.0905883 0.0000000 -0.0341901 0.0000000 3.1015299 0.0000000 -0.0341901 0.0000000 3.1299513 -------------------------- Born effective charges -------------------------- 1 Li 1.0160678 0.0000000 0.0238203 0.0000000 1.0766505 -0.0000000 0.0282890 0.0000000 1.1929922 2 Li 1.0160678 0.0000000 0.0238203 0.0000000 1.0766505 -0.0000000 0.0282890 0.0000000 1.1929922 3 O -1.5213369 0.2658791 0.3479313 0.2335304 -1.6266680 -0.7313006 0.3143358 -0.7933242 -2.3163787 4 O -1.5213369 -0.2658791 0.3479313 -0.2335304 -1.6266680 0.7313006 0.3143358 0.7933242 -2.3163787 5 O -1.5213369 0.2658791 0.3479313 0.2335304 -1.6266680 -0.7313006 0.3143358 -0.7933242 -2.3163787 6 O -1.5213369 -0.2658791 0.3479313 -0.2335304 -1.6266680 0.7313006 0.3143358 0.7933242 -2.3163787 7 O -2.2264130 -0.2447073 -0.2945145 -0.1954454 -1.4975316 0.1039550 -0.2856526 0.1338942 -1.8846343 8 O -1.6658127 0.6882101 -0.0243346 0.5889934 -2.2559397 0.2266032 -0.0052474 0.1210454 -1.4237511 9 O -2.2264130 -0.2447073 -0.2945145 -0.1954454 -1.4975316 0.1039550 -0.2856526 0.1338942 -1.8846343 10 O -2.2264130 0.2447073 -0.2945145 0.1954454 -1.4975316 -0.1039550 -0.2856526 -0.1338942 -1.8846343 11 O -2.2264130 0.2447073 -0.2945145 0.1954454 -1.4975316 -0.1039550 -0.2856526 -0.1338942 -1.8846343 12 O -1.6658127 0.6882101 -0.0243346 0.5889934 -2.2559397 0.2266032 -0.0052474 0.1210454 -1.4237511 13 O -1.6658127 -0.6882101 -0.0243346 -0.5889934 -2.2559397 -0.2266032 -0.0052474 -0.1210454 -1.4237511 14 O -1.6658127 -0.6882101 -0.0243346 -0.5889934 -2.2559397 -0.2266032 -0.0052474 -0.1210454 -1.4237511 15 Si 3.2847017 -0.4694275 0.0102671 -0.1769860 3.1829072 -0.3662608 0.0151305 0.0200218 3.4421811 16 Si 3.2847017 -0.4694275 0.0102671 -0.1769860 3.1829072 -0.3662608 0.0151305 0.0200218 3.4421811 17 Si 3.2847017 0.4694275 0.0102671 0.1769860 3.1829072 0.3662608 0.0151305 -0.0200218 3.4421811 18 Si 3.2847017 0.4694275 0.0102671 0.1769860 3.1829072 0.3662608 0.0151305 -0.0200218 3.4421811 19 In 3.2416540 0.0000000 -0.1025189 0.0000000 3.3178139 -0.0000000 -0.1054214 0.0000000 3.1721738 20 In 3.2416540 0.0000000 -0.1025189 0.0000000 3.3178139 -0.0000000 -0.1054214 0.0000000 3.1721738 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000008 (yyy) 0.00000008 (yyy) 0.00000008 (yyy) Max drift of fc2: 0.00000000 (xx) 0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 8 8 10 ] 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: 0.68, Number of G-points: 301, Lambda: 0.13 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/186) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 186 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 2.971 ( 0.000 0.000 0.000) 0.000 3.219 ( 0.000 0.000 0.000) 0.000 3.357 ( 0.000 0.000 0.000) 0.000 4.037 ( 0.000 0.000 0.000) 0.000 4.059 ( 0.000 0.000 0.000) 0.000 4.061 ( 0.000 0.000 0.000) 0.000 4.968 ( 0.000 0.000 0.000) 0.000 5.134 ( 0.000 0.000 0.000) 0.000 5.541 ( 0.000 0.000 0.000) 0.000 6.272 ( 0.000 0.000 0.000) 0.000 6.495 ( 0.000 0.000 0.000) 0.000 6.620 ( 0.000 0.000 0.000) 0.000 7.285 ( 0.000 0.000 0.000) 0.000 8.072 ( 0.000 0.000 0.000) 0.000 8.322 ( 0.000 0.000 0.000) 0.000 8.578 ( 0.000 0.000 0.000) 0.000 8.653 ( 0.000 0.000 0.000) 0.000 8.827 ( 0.000 0.000 0.000) 0.000 9.150 ( 0.000 0.000 0.000) 0.000 9.211 ( 0.000 0.000 0.000) 0.000 9.791 ( 0.000 0.000 0.000) 0.000 9.940 ( 0.000 0.000 0.000) 0.000 10.247 ( 0.000 0.000 0.000) 0.000 10.450 ( 0.000 0.000 0.000) 0.000 10.533 ( 0.000 0.000 0.000) 0.000 11.121 ( 0.000 0.000 0.000) 0.000 11.533 ( 0.000 0.000 0.000) 0.000 11.692 ( 0.000 0.000 0.000) 0.000 12.014 ( 0.000 0.000 0.000) 0.000 12.623 ( 0.000 0.000 0.000) 0.000 13.056 ( 0.000 0.000 0.000) 0.000 13.058 ( 0.000 0.000 0.000) 0.000 13.968 ( 0.000 0.000 0.000) 0.000 14.093 ( 0.000 0.000 0.000) 0.000 14.365 ( 0.000 0.000 0.000) 0.000 14.433 ( 0.000 0.000 0.000) 0.000 15.385 ( 0.000 0.000 0.000) 0.000 15.391 ( 0.000 0.000 0.000) 0.000 15.587 ( 0.000 0.000 0.000) 0.000 15.718 ( 0.000 0.000 0.000) 0.000 16.228 ( 0.000 0.000 0.000) 0.000 17.820 ( 0.000 0.000 0.000) 0.000 18.851 ( 0.000 0.000 0.000) 0.000 22.576 ( 0.000 0.000 0.000) 0.000 22.628 ( 0.000 0.000 0.000) 0.000 24.193 ( 0.000 0.000 0.000) 0.000 24.631 ( 0.000 0.000 0.000) 0.000 25.156 ( 0.000 0.000 0.000) 0.000 27.353 ( 0.000 0.000 0.000) 0.000 29.243 ( 0.000 0.000 0.000) 0.000 29.585 ( 0.000 0.000 0.000) 0.000 29.621 ( 0.000 0.000 0.000) 0.000 29.761 ( 0.000 0.000 0.000) 0.000 30.019 ( 0.000 0.000 0.000) 0.000 30.058 ( 0.000 0.000 0.000) 0.000 31.037 ( 0.000 0.000 0.000) 0.000 31.163 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/186) ======================= q-point: ( 0.12 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.549 ( 16.255 -18.449 18.923) 31.027 0.764 ( 21.660 -26.049 24.118) 41.586 1.302 ( 40.248 -45.667 23.293) 65.176 3.013 ( 1.529 -3.211 -0.010) 3.556 3.135 ( -5.743 -0.321 -11.754) 13.086 3.407 ( 3.463 0.746 3.768) 5.172 3.943 ( -10.339 -0.075 -5.022) 11.494 4.047 ( 3.435 2.868 -0.915) 4.567 4.445 ( -14.373 -26.449 0.258) 30.103 4.936 ( 2.924 7.297 -0.600) 7.884 5.165 ( -8.136 2.408 -9.135) 12.467 5.726 ( 11.415 1.327 12.220) 16.775 6.063 ( -6.134 14.137 -3.114) 15.722 6.536 ( 7.147 14.150 2.154) 15.998 6.695 ( 2.998 -13.689 0.148) 14.014 7.456 ( 3.077 -14.120 1.736) 14.556 8.079 ( -0.774 -0.066 3.068) 3.165 8.404 ( 5.826 5.312 -8.087) 11.294 8.497 ( -4.193 6.145 6.225) 9.700 8.803 ( -2.900 -3.038 -5.468) 6.895 8.884 ( -6.958 -13.256 -5.988) 16.124 9.153 ( -0.992 -1.362 -0.942) 1.930 9.646 ( 1.166 5.472 -16.070) 17.016 9.815 ( 21.010 20.066 7.502) 30.006 9.939 ( -0.520 -0.106 0.524) 0.746 10.404 ( 6.392 12.068 -4.549) 14.394 10.453 ( 5.735 12.051 -0.426) 13.353 10.484 ( 1.684 6.390 11.045) 12.871 11.259 ( -2.639 1.199 2.631) 3.915 11.511 ( 0.678 4.176 1.933) 4.651 11.900 ( -5.487 -12.319 -1.849) 13.612 12.115 ( 7.036 4.583 10.135) 13.162 12.950 ( -16.109 -5.730 -5.288) 17.897 13.115 ( 2.511 -5.014 1.160) 5.726 13.328 ( -5.508 -18.361 -33.532) 38.624 13.984 ( 0.999 -0.313 2.842) 3.029 14.106 ( -7.839 -0.935 18.907) 20.489 14.343 ( 0.807 2.956 -2.503) 3.957 14.710 ( -22.232 -23.841 -2.866) 32.724 15.334 ( -5.399 4.191 3.551) 7.702 15.363 ( -6.235 0.434 1.372) 6.399 15.625 ( -0.489 -2.813 2.449) 3.762 15.835 ( -7.489 -7.697 0.515) 10.751 16.244 ( 1.284 -0.813 0.330) 1.555 18.107 ( 17.792 17.285 -12.104) 27.602 18.876 ( 2.578 0.036 2.826) 3.825 22.537 ( -3.813 -0.724 -5.143) 6.444 22.670 ( 2.816 -0.070 2.899) 4.042 24.250 ( -5.844 -5.961 1.477) 8.478 24.673 ( 3.675 -2.264 0.185) 4.321 26.439 ( 85.055 89.551 41.979) 130.445 27.323 ( -8.819 -4.523 -2.274) 10.169 29.189 ( -3.962 3.586 -2.021) 5.713 29.522 ( -2.109 2.206 -7.873) 8.444 29.653 ( 1.001 0.229 4.042) 4.170 29.877 ( -2.591 -2.214 -11.318) 11.820 30.142 ( 0.217 -9.544 -3.218) 10.074 30.419 ( 18.244 19.286 17.272) 31.672 31.175 ( 1.445 -0.352 0.114) 1.492 33.007 ( -65.249 -62.789 -12.398) 91.398 ======================= Grid point 2 (3/186) ======================= q-point: ( 0.25 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.093 ( 15.430 -18.864 15.064) 28.650 1.476 ( 18.828 -22.708 22.933) 37.364 2.434 ( 30.678 -35.228 18.871) 50.381 2.999 ( -5.472 -0.930 -13.129) 14.254 3.044 ( -3.444 0.101 -1.258) 3.668 3.437 ( 2.289 0.822 2.647) 3.594 3.792 ( -8.641 0.867 -2.991) 9.185 4.092 ( 8.082 -0.455 -1.512) 8.235 4.634 ( -6.077 -14.510 4.911) 16.480 4.839 ( 4.934 9.261 -6.227) 12.202 5.064 ( -5.623 -6.237 -5.888) 10.256 5.791 ( 9.155 12.912 -0.463) 15.835 5.824 ( -12.941 0.490 1.894) 13.088 6.470 ( 11.007 13.880 5.264) 18.480 6.902 ( 3.257 -9.818 -3.925) 11.064 7.686 ( 2.769 -8.899 1.205) 9.397 8.055 ( -4.442 2.515 8.971) 10.321 8.286 ( 0.379 7.897 -9.336) 12.234 8.482 ( -3.131 -4.617 5.124) 7.575 8.789 ( 0.184 -1.901 -5.988) 6.286 8.933 ( -3.425 -6.259 -3.690) 8.033 9.145 ( -1.038 -1.209 -4.831) 5.087 9.526 ( -3.156 -1.443 -9.120) 9.758 9.841 ( 18.158 16.904 4.321) 25.182 9.932 ( -0.731 0.381 -0.251) 0.862 10.260 ( -5.971 1.514 -7.967) 10.071 10.360 ( 6.265 14.208 3.175) 15.849 10.464 ( -3.436 1.072 4.491) 5.755 11.192 ( -5.596 4.136 5.961) 9.162 11.467 ( 0.850 4.130 1.136) 4.367 12.002 ( -4.583 -11.271 1.711) 12.287 12.199 ( 6.901 3.670 9.164) 12.045 12.777 ( -12.420 -3.264 -13.782) 18.838 13.262 ( 3.239 -7.970 4.351) 9.641 13.349 ( 3.399 -3.332 -12.487) 13.363 14.021 ( 0.624 -0.344 4.579) 4.634 14.096 ( -6.362 -1.145 6.849) 9.418 14.293 ( 1.741 4.340 -1.818) 5.017 14.753 ( -7.016 -11.349 -2.345) 13.547 15.200 ( -8.832 3.148 2.193) 9.629 15.286 ( -5.502 0.066 -0.729) 5.550 15.651 ( -1.549 -1.461 1.897) 2.852 15.846 ( 0.330 -0.310 -0.026) 0.453 16.276 ( 1.385 -0.919 0.051) 1.663 18.023 ( 4.918 8.470 -7.476) 12.321 18.932 ( 3.283 -0.091 3.526) 4.818 22.477 ( -2.876 -0.432 -4.781) 5.597 22.714 ( 2.264 0.128 2.066) 3.067 24.269 ( -3.266 -3.397 3.665) 5.970 24.772 ( 4.883 -3.242 0.715) 5.904 26.526 ( 47.172 42.341 20.253) 66.544 27.228 ( -17.247 -8.325 -4.815) 19.747 29.038 ( -6.271 5.877 -2.837) 9.051 29.446 ( -2.029 0.700 -3.993) 4.533 29.681 ( -0.056 -0.255 5.163) 5.170 29.831 ( -0.439 0.031 -6.801) 6.815 30.258 ( -2.985 -11.939 -3.358) 12.756 30.467 ( 15.170 14.671 9.075) 22.972 31.210 ( 2.328 -1.018 0.158) 2.546 32.968 ( -28.557 -24.873 -4.741) 38.166 ======================= Grid point 3 (4/186) ======================= q-point: ( 0.38 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.572 ( 11.968 -15.147 9.458) 21.497 2.044 ( 12.742 -14.529 17.770) 26.253 2.840 ( -8.627 1.096 -5.928) 10.525 2.938 ( -3.737 3.135 -4.667) 6.751 3.126 ( 12.298 -11.622 0.107) 16.921 3.535 ( 3.801 -1.980 6.187) 7.527 3.706 ( -3.220 -5.039 4.357) 7.399 4.238 ( 8.204 -4.723 -0.737) 9.495 4.549 ( -1.413 12.310 -5.919) 13.732 4.908 ( 1.604 -8.932 -1.756) 9.243 5.128 ( -0.289 -9.463 -0.174) 9.469 5.673 ( -7.940 4.692 0.638) 9.245 5.743 ( 6.443 4.141 -0.934) 7.716 6.469 ( 6.224 5.972 2.598) 9.008 6.962 ( -1.456 0.339 -2.828) 3.199 7.697 ( -4.425 2.899 -1.358) 5.462 8.065 ( -0.823 -1.354 9.419) 9.551 8.166 ( 0.695 3.934 -6.425) 7.565 8.532 ( -2.811 -4.653 1.929) 5.768 8.803 ( 0.107 -1.994 -2.950) 3.563 8.938 ( -0.448 -1.111 -1.914) 2.258 9.130 ( -0.344 -1.954 -5.335) 5.691 9.559 ( -0.790 -9.933 -1.207) 10.037 9.844 ( 15.099 15.449 -1.432) 21.650 9.901 ( -1.492 0.590 -2.949) 3.357 10.180 ( -3.591 -2.419 -3.178) 5.371 10.254 ( 1.872 11.390 6.700) 13.346 10.408 ( -5.301 -0.464 -1.286) 5.475 11.078 ( -5.550 4.411 5.198) 8.790 11.440 ( 0.944 2.053 0.337) 2.285 12.095 ( -3.661 -7.855 3.050) 9.187 12.262 ( 5.860 4.217 5.422) 9.029 12.620 ( -7.758 -2.139 -11.068) 13.684 13.346 ( 0.552 -0.142 2.080) 2.156 13.481 ( 7.357 -8.470 -2.949) 11.600 13.994 ( -6.735 3.142 3.258) 8.115 14.071 ( 0.951 -0.158 -0.665) 1.171 14.273 ( 1.416 1.600 1.428) 2.570 14.821 ( 1.208 -5.941 -3.342) 6.922 15.056 ( -9.437 2.316 2.771) 10.104 15.223 ( -3.416 0.064 -0.376) 3.437 15.652 ( -0.935 -0.297 1.156) 1.516 15.850 ( 1.072 0.919 -0.351) 1.455 16.299 ( 0.713 -0.452 -0.190) 0.866 17.946 ( 1.186 4.083 -3.909) 5.775 18.984 ( 2.153 -0.137 2.267) 3.129 22.435 ( -1.548 -0.255 -2.897) 3.294 22.743 ( 1.231 0.140 1.098) 1.655 24.290 ( -1.611 -1.811 2.603) 3.556 24.871 ( 3.322 -2.352 0.723) 4.134 26.673 ( 36.007 25.379 13.322) 46.022 27.068 ( -24.488 -11.738 -7.478) 28.167 28.883 ( -4.160 4.203 -1.807) 6.183 29.409 ( -0.895 0.096 -1.828) 2.038 29.709 ( -0.173 -0.493 4.835) 4.863 29.796 ( -0.022 0.431 -5.181) 5.199 30.358 ( -6.301 -13.765 -3.979) 15.653 30.478 ( 12.580 14.965 6.303) 20.542 31.255 ( 1.887 -1.057 0.106) 2.165 32.925 ( -12.583 -9.770 -1.799) 16.032 ======================= Grid point 4 (5/186) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.806 ( 0.000 -0.000 0.000) 0.000 2.288 ( 0.000 -0.000 0.000) 0.000 2.725 ( 0.000 -0.000 0.000) 0.000 2.873 ( 0.000 -0.000 0.000) 0.000 3.262 ( 0.000 0.000 0.000) 0.000 3.522 ( 0.000 -0.000 0.000) 0.000 3.834 ( 0.000 -0.000 0.000) 0.000 4.342 ( -0.000 -0.000 0.000) 0.000 4.405 ( 0.000 -0.000 -0.000) 0.000 4.980 ( 0.000 -0.000 0.000) 0.000 5.224 ( 0.000 -0.000 0.000) 0.000 5.565 ( 0.000 0.000 0.000) 0.000 5.779 ( -0.000 -0.000 0.000) 0.000 6.474 ( 0.000 -0.000 0.000) 0.000 6.916 ( 0.000 -0.000 0.000) 0.000 7.625 ( 0.000 -0.000 0.000) 0.000 8.077 ( 0.000 -0.000 -0.000) 0.000 8.150 ( 0.000 -0.000 0.000) 0.000 8.550 ( 0.000 -0.000 0.000) 0.000 8.807 ( 0.000 -0.000 0.000) 0.000 8.942 ( -0.000 -0.000 0.000) 0.000 9.131 ( 0.000 -0.000 0.000) 0.000 9.680 ( 0.000 0.000 0.000) 0.000 9.787 ( -0.000 -0.000 0.000) 0.000 9.878 ( 0.000 -0.000 0.000) 0.000 10.170 ( 0.000 -0.000 -0.000) 0.000 10.200 ( -0.000 -0.000 -0.000) 0.000 10.364 ( 0.000 -0.000 0.000) 0.000 11.019 ( 0.000 -0.000 0.000) 0.000 11.434 ( 0.000 -0.000 0.000) 0.000 12.137 ( 0.000 -0.000 0.000) 0.000 12.283 ( 0.000 -0.000 0.000) 0.000 12.554 ( 0.000 -0.000 0.000) 0.000 13.355 ( 0.000 -0.000 0.000) 0.000 13.612 ( 0.000 -0.000 0.000) 0.000 13.901 ( 0.000 -0.000 0.000) 0.000 14.079 ( 0.000 -0.000 0.000) 0.000 14.278 ( 0.000 -0.000 0.000) 0.000 14.898 ( 0.000 -0.000 0.000) 0.000 14.948 ( 0.000 -0.000 0.000) 0.000 15.199 ( 0.000 -0.000 0.000) 0.000 15.651 ( 0.000 -0.000 0.000) 0.000 15.849 ( 0.000 -0.000 0.000) 0.000 16.306 ( 0.000 -0.000 0.000) 0.000 17.914 ( 0.000 -0.000 0.000) 0.000 19.005 ( 0.000 -0.000 0.000) 0.000 22.419 ( 0.000 -0.000 -0.000) 0.000 22.752 ( 0.000 -0.000 0.000) 0.000 24.298 ( 0.000 -0.000 0.000) 0.000 24.913 ( 0.000 -0.000 0.000) 0.000 26.853 ( 0.000 0.000 0.000) 0.000 26.881 ( -0.000 -0.000 -0.000) 0.000 28.820 ( 0.000 -0.000 0.000) 0.000 29.399 ( 0.000 -0.000 0.000) 0.000 29.727 ( 0.000 -0.000 -0.000) 0.000 29.777 ( 0.000 -0.000 0.000) 0.000 30.424 ( 0.000 -0.000 -0.000) 0.000 30.450 ( 0.000 0.000 0.000) 0.000 31.276 ( 0.000 -0.000 0.000) 0.000 32.906 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 10 (6/186) ======================= q-point: ( 0.12 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.059 ( 26.681 0.000 30.465) 40.497 1.114 ( 36.968 0.000 13.347) 39.304 1.652 ( 45.246 0.000 39.504) 60.064 2.983 ( -5.869 -0.000 -16.744) 17.743 3.041 ( 5.203 0.000 -0.330) 5.213 3.504 ( 4.889 0.000 2.552) 5.515 3.681 ( -14.670 -0.000 -1.771) 14.777 4.103 ( 3.971 0.000 -3.506) 5.297 4.279 ( 3.447 0.000 6.933) 7.743 4.966 ( -10.753 -0.000 -9.274) 14.200 5.035 ( 4.758 0.000 -0.958) 4.853 5.779 ( -16.546 -0.000 7.989) 18.374 6.166 ( 12.908 0.000 -13.376) 18.589 6.604 ( 6.022 0.000 2.297) 6.445 6.814 ( 5.423 0.000 9.486) 10.926 7.429 ( 10.551 0.000 -0.724) 10.576 8.091 ( -0.468 -0.000 7.748) 7.762 8.463 ( -7.509 -0.000 1.520) 7.661 8.502 ( -1.461 -0.000 -10.224) 10.327 8.645 ( 0.555 0.000 -2.023) 2.097 8.793 ( 1.426 0.000 -8.643) 8.760 9.122 ( -1.561 -0.000 -0.909) 1.806 9.531 ( -6.171 -0.000 -14.989) 16.210 9.924 ( -2.134 -0.000 1.296) 2.496 10.132 ( 5.691 0.000 7.100) 9.099 10.290 ( -8.989 -0.000 -7.385) 11.634 10.416 ( -2.620 -0.000 -2.982) 3.969 11.118 ( -0.250 -0.000 0.410) 0.480 11.274 ( 3.375 0.000 -1.680) 3.770 11.603 ( 3.522 0.000 3.333) 4.849 11.655 ( -4.034 -0.000 5.097) 6.501 12.326 ( 2.719 0.000 10.228) 10.583 12.477 ( -4.852 -0.000 -11.000) 12.023 13.149 ( 1.858 0.000 7.310) 7.542 13.156 ( 11.522 0.000 -15.984) 19.704 14.003 ( 1.065 0.000 3.220) 3.392 14.075 ( -11.200 -0.000 21.484) 24.228 14.360 ( 1.666 0.000 -5.062) 5.329 14.412 ( -1.252 -0.000 -0.115) 1.258 15.287 ( -5.584 -0.000 -0.383) 5.597 15.309 ( -10.183 -0.000 7.503) 12.649 15.642 ( 1.733 0.000 -1.097) 2.052 15.765 ( 3.106 0.000 -1.994) 3.691 16.244 ( 0.918 0.000 0.460) 1.026 18.268 ( 2.641 0.000 -15.552) 15.774 18.934 ( 2.935 0.000 4.952) 5.757 22.465 ( -2.710 -0.000 -5.420) 6.059 22.718 ( 2.530 0.000 2.603) 3.630 24.205 ( -0.742 -0.000 5.475) 5.525 24.724 ( 5.804 0.000 1.473) 5.988 27.105 ( -16.715 -0.000 -5.370) 17.557 27.863 ( -0.367 -0.000 15.578) 15.582 29.132 ( -6.852 -0.000 -3.117) 7.527 29.553 ( 0.231 0.000 -13.057) 13.059 29.688 ( 4.659 0.000 -9.690) 10.751 29.694 ( -3.671 -0.000 -3.685) 5.201 29.979 ( -4.876 -0.000 0.980) 4.974 30.991 ( -2.402 -0.000 2.457) 3.436 31.313 ( 8.775 0.000 0.661) 8.800 31.752 ( 6.115 0.000 22.799) 23.605 ======================= Grid point 11 (7/186) ======================= q-point: ( 0.25 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.495 ( 29.111 5.621 19.319) 35.387 1.619 ( 22.913 -8.445 21.571) 32.582 2.536 ( 29.315 -21.160 28.495) 46.034 2.857 ( -0.182 -1.633 -17.540) 17.617 3.085 ( 4.371 4.084 -0.588) 6.011 3.475 ( -4.406 0.600 2.061) 4.902 3.616 ( -4.655 -4.534 -2.864) 7.101 4.147 ( 4.645 -1.662 -3.774) 6.211 4.430 ( 1.176 -11.635 6.759) 13.508 4.875 ( -1.601 -2.041 -5.176) 5.790 5.033 ( 3.818 6.808 -3.176) 8.427 5.558 ( -20.657 -4.585 -0.556) 21.167 6.158 ( 12.890 15.528 -5.493) 20.915 6.771 ( 2.474 -1.510 -0.419) 2.928 6.835 ( 8.579 3.800 4.357) 10.346 7.634 ( 7.509 -7.336 -0.555) 10.513 8.112 ( -0.465 4.328 10.639) 11.495 8.345 ( -2.300 8.056 -8.755) 12.118 8.381 ( -7.419 -4.305 2.221) 8.860 8.735 ( 0.314 -9.226 -2.629) 9.599 8.793 ( 2.754 -1.675 -8.096) 8.715 9.096 ( -1.411 -0.096 -3.806) 4.060 9.399 ( -5.499 -1.771 -8.741) 10.477 9.892 ( -4.281 0.037 -0.446) 4.305 10.064 ( -8.767 -3.530 -10.049) 13.796 10.279 ( 10.817 10.147 9.789) 17.770 10.340 ( -7.462 0.054 -3.377) 8.191 10.893 ( 7.173 26.494 3.055) 27.617 11.237 ( -2.994 5.458 5.832) 8.530 11.564 ( 1.001 6.299 2.682) 6.919 11.791 ( -2.367 -11.904 3.073) 12.520 12.377 ( 6.050 1.968 7.033) 9.483 12.469 ( -8.296 -8.537 -11.872) 16.812 13.236 ( 0.611 -5.401 6.625) 8.569 13.289 ( 9.148 -5.788 -10.449) 15.046 14.025 ( -8.788 0.178 12.665) 15.416 14.041 ( 0.368 -1.428 1.147) 1.868 14.345 ( 2.424 2.056 -4.895) 5.836 14.489 ( -2.515 -12.183 0.890) 12.472 15.180 ( -8.382 4.761 4.923) 10.823 15.221 ( -3.991 -0.123 -0.674) 4.049 15.637 ( -0.885 0.459 -0.351) 1.057 15.819 ( 1.098 -3.249 -1.446) 3.722 16.264 ( 0.618 -0.891 -0.108) 1.090 18.175 ( 3.884 8.225 -10.167) 13.642 18.988 ( 1.758 0.221 5.012) 5.316 22.417 ( -1.614 -0.590 -4.364) 4.690 22.754 ( 1.685 0.363 1.915) 2.576 24.240 ( 0.430 -1.325 4.725) 4.926 24.819 ( 5.457 -1.149 2.895) 6.283 26.848 ( -23.250 -4.111 -7.199) 24.683 27.639 ( 15.891 37.340 11.912) 42.293 28.994 ( -7.961 2.920 -3.259) 9.084 29.426 ( -0.678 3.187 -6.784) 7.526 29.688 ( -2.998 -1.552 7.442) 8.172 29.752 ( 0.374 -6.191 -13.160) 14.549 29.992 ( -6.135 -10.177 -2.463) 12.136 30.917 ( 6.832 10.893 5.731) 14.077 31.270 ( 7.187 9.813 2.050) 12.335 32.291 ( -2.293 -33.829 6.316) 34.489 ======================= Grid point 12 (8/186) ======================= q-point: ( 0.38 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.863 ( 22.153 2.233 16.122) 27.490 2.048 ( 11.304 -10.001 6.314) 16.361 2.792 ( 2.173 0.754 3.075) 3.840 2.958 ( 1.482 6.077 -6.623) 9.110 3.167 ( 8.774 -4.874 4.847) 11.146 3.561 ( -4.980 -4.633 -2.176) 7.142 3.593 ( 6.496 -6.583 8.849) 12.799 4.224 ( 3.025 -4.874 -5.960) 8.272 4.610 ( -2.786 -0.326 7.627) 8.127 4.803 ( -0.382 -1.738 -9.991) 10.149 5.080 ( 8.157 -5.275 4.139) 10.559 5.418 ( -14.863 -6.831 -0.422) 16.363 6.082 ( 12.097 14.699 -3.878) 19.428 6.693 ( 4.717 12.261 -0.286) 13.140 6.926 ( -0.477 -1.533 -1.483) 2.185 7.697 ( -1.588 2.833 1.040) 3.410 8.102 ( 0.509 1.033 5.241) 5.366 8.180 ( -2.305 4.309 -8.541) 9.840 8.440 ( -0.824 -6.480 6.638) 9.313 8.824 ( 3.914 -0.308 -2.840) 4.846 8.853 ( 0.585 -7.587 -1.451) 7.747 9.059 ( -0.053 -1.397 -8.502) 8.616 9.388 ( -4.395 -8.204 0.027) 9.307 9.803 ( -6.679 -2.274 -7.126) 10.028 10.044 ( -2.635 -7.349 -3.333) 8.488 10.165 ( -10.800 3.603 -7.784) 13.792 10.293 ( 10.650 15.618 6.235) 19.905 10.692 ( 5.254 19.551 14.578) 24.948 11.129 ( -2.039 6.278 0.909) 6.663 11.512 ( 1.285 5.290 2.325) 5.920 11.921 ( -2.822 -10.203 0.896) 10.624 12.393 ( -1.617 1.059 -5.621) 5.944 12.486 ( 4.240 -2.966 2.607) 5.794 13.303 ( -3.292 -4.298 0.164) 5.416 13.468 ( 9.051 -6.893 -1.560) 11.483 13.945 ( -7.748 1.356 3.808) 8.739 14.065 ( -0.473 -0.949 0.362) 1.121 14.326 ( 2.740 2.655 -3.311) 5.051 14.666 ( -0.004 -14.767 1.165) 14.813 15.032 ( -6.599 5.490 4.213) 9.562 15.191 ( -0.678 -0.472 -0.415) 0.924 15.611 ( -3.297 -0.780 0.193) 3.394 15.852 ( -0.500 -1.573 0.032) 1.651 16.276 ( -0.281 -0.953 -1.240) 1.589 18.075 ( 5.608 9.094 -5.885) 12.198 19.014 ( -0.302 0.494 3.578) 3.624 22.401 ( -0.171 -1.013 -2.228) 2.454 22.767 ( 0.554 0.827 1.203) 1.562 24.288 ( 1.956 -0.637 2.505) 3.242 24.904 ( 3.091 -0.511 3.245) 4.511 26.555 ( -28.454 -6.915 -8.824) 30.583 27.483 ( 21.285 27.499 9.053) 35.933 28.855 ( -5.628 1.954 -2.009) 6.287 29.382 ( -0.551 -0.651 -3.571) 3.671 29.704 ( -3.298 -1.992 5.162) 6.441 29.760 ( 0.499 -1.987 -6.820) 7.121 30.043 ( -7.991 -12.534 -4.875) 15.643 30.890 ( 9.394 13.524 5.564) 17.381 31.247 ( 1.348 2.706 0.208) 3.031 32.649 ( 1.434 -18.252 3.203) 18.587 ======================= Grid point 13 (9/186) ======================= q-point: ( 0.50 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.047 ( 2.917 3.326 0.919) 4.519 2.218 ( 9.738 8.376 -3.393) 13.286 2.781 ( 3.129 1.797 2.585) 4.439 2.964 ( 7.852 1.652 5.593) 9.781 3.289 ( 2.919 0.175 1.926) 3.501 3.463 ( -5.314 -0.617 -1.432) 5.538 3.831 ( 3.003 -3.998 3.255) 5.966 4.239 ( -1.613 -2.427 -17.943) 18.178 4.435 ( -10.090 6.131 10.606) 15.871 4.919 ( 0.313 -8.463 -1.052) 8.534 5.286 ( -0.628 1.536 6.559) 6.766 5.348 ( -1.898 -10.216 1.380) 10.482 6.007 ( 7.698 13.397 -4.848) 16.194 6.574 ( 2.871 11.406 -2.673) 12.062 6.904 ( -0.758 -1.246 0.557) 1.561 7.664 ( 2.942 1.554 3.509) 4.836 8.054 ( -3.066 0.535 -1.493) 3.452 8.155 ( 1.949 -0.424 -5.186) 5.557 8.549 ( 2.028 -2.553 7.277) 7.974 8.869 ( 3.396 -0.053 1.253) 3.620 8.915 ( 0.647 -0.956 -1.826) 2.160 9.075 ( 0.639 -5.253 -6.400) 8.305 9.467 ( -7.774 -11.058 4.564) 14.267 9.764 ( -3.869 -7.687 -8.756) 12.277 9.893 ( -12.518 7.790 -5.641) 15.786 10.131 ( 0.871 -6.459 1.834) 6.771 10.193 ( 4.121 12.436 -1.479) 13.184 10.624 ( 5.278 13.368 18.191) 23.184 11.070 ( 4.965 3.175 -3.127) 6.671 11.467 ( 0.351 4.039 1.334) 4.268 12.000 ( -3.888 -8.598 -4.723) 10.552 12.344 ( 1.774 3.399 -2.697) 4.688 12.614 ( 7.110 -1.842 7.355) 10.394 13.293 ( -4.758 -3.528 -3.049) 6.662 13.627 ( 2.470 -0.749 1.536) 3.003 13.871 ( -1.869 -2.441 0.550) 3.123 14.059 ( -1.692 -0.544 -0.921) 2.001 14.303 ( 1.653 2.878 -3.424) 4.768 14.890 ( 2.746 -11.917 1.827) 12.365 14.918 ( -2.071 3.322 2.876) 4.858 15.213 ( 2.803 -0.675 0.165) 2.888 15.582 ( -4.834 -2.926 -0.018) 5.651 15.854 ( -1.348 -0.069 1.508) 2.024 16.271 ( -1.551 -1.162 -2.035) 2.811 18.020 ( 6.784 7.724 -1.935) 10.461 18.998 ( -2.532 0.813 1.391) 3.001 22.419 ( 1.182 -1.257 0.388) 1.768 22.757 ( -0.554 1.113 0.287) 1.276 24.326 ( 3.297 0.827 -0.105) 3.401 24.930 ( -0.200 1.650 2.485) 2.990 26.230 ( -32.156 -8.918 -10.536) 34.993 27.485 ( 20.765 18.318 7.063) 28.576 28.798 ( -1.602 -1.741 -0.237) 2.378 29.384 ( 0.186 -1.673 -1.631) 2.344 29.698 ( -2.905 -1.888 -1.889) 3.946 29.772 ( 0.100 -1.159 1.643) 2.014 30.080 ( -9.553 -12.640 -5.673) 16.829 30.819 ( 8.766 17.403 4.666) 20.037 31.227 ( -3.029 -1.454 -0.732) 3.438 32.906 ( 8.112 -9.430 2.894) 12.771 ======================= Grid point 14 (10/186) ======================= q-point: (-0.38 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.873 ( 2.324 22.783 -8.401) 24.393 2.001 ( -5.181 18.955 -7.761) 21.127 2.968 ( 14.153 -5.124 3.073) 15.362 3.044 ( 5.044 4.367 7.384) 9.951 3.155 ( -9.793 12.371 2.858) 16.035 3.495 ( -0.573 0.184 -2.399) 2.473 3.740 ( -1.350 4.820 -10.537) 11.666 4.156 ( -9.074 1.611 -5.651) 10.811 4.385 ( -6.298 -11.412 9.854) 16.340 4.972 ( 0.250 0.302 -1.588) 1.635 5.186 ( -7.786 -0.241 1.215) 7.884 5.552 ( 5.980 -4.783 9.970) 12.571 5.877 ( 3.371 8.733 -4.898) 10.565 6.409 ( -3.116 9.457 -7.393) 12.402 6.978 ( 2.499 -3.341 3.584) 5.500 7.755 ( 6.675 -0.527 4.326) 7.972 8.059 ( 2.551 -1.829 -4.455) 5.450 8.131 ( -1.389 -0.062 -1.348) 1.937 8.619 ( 3.175 2.032 4.659) 5.993 8.885 ( 1.431 4.483 -2.102) 5.154 8.930 ( 1.839 -2.952 1.579) 3.820 9.135 ( 0.155 -4.098 0.327) 4.114 9.498 ( -12.412 -8.869 3.546) 15.662 9.628 ( -9.503 3.681 -2.729) 10.550 9.831 ( -1.045 -8.623 -3.953) 9.544 10.085 ( -0.355 3.632 -3.834) 5.293 10.255 ( 3.915 -4.487 4.277) 7.331 10.590 ( 2.914 9.039 8.860) 12.989 11.133 ( 9.350 0.876 -1.096) 9.455 11.431 ( 0.133 1.786 0.178) 1.800 12.012 ( -4.989 -6.837 -9.985) 13.089 12.307 ( 4.057 7.250 0.641) 8.333 12.783 ( 8.079 -1.771 10.102) 13.056 13.279 ( -2.728 -4.868 -2.895) 6.287 13.535 ( -4.851 8.606 2.457) 10.180 13.993 ( 4.634 -6.935 0.244) 8.344 14.032 ( -2.716 -1.410 -1.404) 3.367 14.254 ( 0.150 2.669 -4.763) 5.462 14.863 ( -0.975 1.703 4.047) 4.498 15.123 ( 8.989 -7.244 -0.644) 11.562 15.277 ( 5.043 -0.777 1.307) 5.267 15.583 ( -3.807 -6.457 -1.104) 7.576 15.837 ( -1.885 0.743 2.227) 3.011 16.248 ( -3.613 -1.537 -2.312) 4.556 18.011 ( 6.211 5.960 1.556) 8.747 18.945 ( -3.872 0.897 -0.651) 4.028 22.467 ( 2.204 -1.334 2.604) 3.663 22.727 ( -1.463 1.203 -0.801) 2.056 24.349 ( 4.394 2.258 -1.758) 5.244 24.879 ( -2.692 4.026 1.339) 5.025 25.882 ( -35.079 -10.596 -12.444) 38.699 27.539 ( 16.358 13.644 5.002) 21.880 28.864 ( 2.557 -6.107 1.527) 6.794 29.416 ( 1.512 -1.921 0.159) 2.450 29.671 ( -2.575 -1.533 -4.317) 5.255 29.805 ( -0.196 -1.436 4.775) 4.990 30.088 ( -10.723 -11.429 -6.222) 16.862 30.687 ( 5.979 17.740 3.106) 18.976 31.200 ( -4.151 -1.921 -0.739) 4.633 33.161 ( 14.440 -4.909 3.511) 15.651 ======================= Grid point 15 (11/186) ======================= q-point: (-0.25 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.473 ( 5.282 33.910 -9.629) 35.645 1.558 ( -6.622 28.487 -5.378) 29.737 2.568 ( -19.055 40.992 -6.164) 45.623 3.095 ( 2.450 1.421 3.988) 4.892 3.186 ( 10.395 2.483 2.184) 10.908 3.399 ( -1.593 1.035 -2.265) 2.956 3.798 ( 3.235 -7.788 -0.241) 8.436 3.970 ( -11.309 -0.862 0.338) 11.347 4.584 ( -0.978 -16.023 1.823) 16.156 4.913 ( 2.762 8.519 -1.273) 9.046 5.150 ( -2.790 -2.984 2.399) 4.737 5.692 ( 5.271 1.642 12.475) 13.642 5.886 ( 4.061 -3.598 -7.777) 9.482 6.189 ( -9.889 0.730 -7.954) 12.713 7.006 ( -0.090 5.000 3.399) 6.047 7.787 ( 0.721 7.900 1.239) 8.029 8.054 ( 4.535 0.190 -9.160) 10.223 8.206 ( -1.406 -8.318 7.906) 11.561 8.583 ( 1.736 8.286 -2.959) 8.968 8.853 ( 0.906 2.439 4.241) 4.975 9.024 ( 6.039 -2.765 0.383) 6.653 9.177 ( -0.511 -1.137 2.182) 2.513 9.430 ( -14.709 -5.671 0.122) 15.765 9.566 ( -1.426 -4.427 3.057) 5.566 9.907 ( -0.459 -4.479 -0.689) 4.555 10.059 ( -2.241 -5.737 -6.201) 8.740 10.389 ( 4.695 -3.007 5.892) 8.111 10.537 ( 0.643 5.138 0.552) 5.208 11.227 ( 5.480 0.198 0.417) 5.499 11.430 ( 1.036 -0.502 -0.209) 1.170 11.979 ( -4.573 -4.943 -9.624) 11.746 12.238 ( 2.931 10.389 1.534) 10.903 12.934 ( 4.405 -2.519 4.957) 7.094 13.337 ( 3.759 5.712 -8.232) 10.701 13.386 ( -3.450 -1.528 15.776) 16.221 13.985 ( -2.537 0.056 -2.364) 3.468 14.143 ( 4.791 -2.990 -3.344) 6.563 14.208 ( -2.089 -2.140 -1.311) 3.266 14.878 ( 2.179 -0.646 2.096) 3.092 15.275 ( 5.147 -1.976 -0.872) 5.582 15.374 ( 5.772 -0.395 3.395) 6.708 15.685 ( 6.479 -7.335 -2.322) 10.059 15.813 ( -2.340 -1.013 1.579) 2.999 16.194 ( -7.035 -1.994 -2.293) 7.663 18.005 ( 1.813 5.311 3.162) 6.442 18.882 ( -3.081 0.572 -1.441) 3.449 22.533 ( 2.815 -1.369 3.511) 4.704 22.681 ( -2.144 1.231 -1.821) 3.071 24.370 ( 5.963 2.788 -0.790) 6.629 24.780 ( -2.800 5.098 0.423) 5.831 25.501 ( -35.842 -8.825 -13.931) 39.454 27.550 ( 8.822 11.241 2.515) 14.509 29.020 ( 3.742 -8.007 1.917) 9.043 29.481 ( 3.801 -2.023 2.282) 4.873 29.636 ( -2.979 -1.538 -4.463) 5.582 29.856 ( 1.042 -1.954 6.060) 6.452 30.056 ( -10.661 -8.319 -7.097) 15.271 30.526 ( 2.690 14.901 1.383) 15.205 31.174 ( -2.536 -1.049 -0.360) 2.768 33.446 ( 17.452 -4.014 4.177) 18.388 ======================= Grid point 16 (12/186) ======================= q-point: (-0.12 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.004 ( -0.000 34.839 0.000) 34.839 1.060 ( -0.000 37.304 0.000) 37.304 1.678 ( -0.000 57.217 0.000) 57.217 3.076 ( -0.000 5.271 0.000) 5.271 3.215 ( -0.000 1.358 0.000) 1.358 3.379 ( -0.000 0.844 0.000) 0.844 3.942 ( 0.000 -6.123 -0.000) 6.123 3.950 ( 0.000 -7.098 -0.000) 7.098 4.779 ( 0.000 -12.665 -0.000) 12.665 4.836 ( -0.000 7.227 0.000) 7.227 5.176 ( 0.000 -0.220 -0.000) 0.220 5.700 ( -0.000 10.790 0.000) 10.790 5.896 ( 0.000 -9.975 -0.000) 9.975 6.261 ( 0.000 -17.742 -0.000) 17.742 6.883 ( -0.000 13.061 0.000) 13.061 7.625 ( -0.000 13.452 0.000) 13.452 8.065 ( 0.000 -0.495 -0.000) 0.495 8.363 ( 0.000 -11.208 -0.000) 11.208 8.454 ( -0.000 8.962 0.000) 8.962 8.849 ( -0.000 1.448 0.000) 1.448 9.161 ( 0.000 -3.767 -0.000) 3.767 9.169 ( -0.000 0.865 0.000) 0.865 9.296 ( -0.000 2.868 0.000) 2.868 9.676 ( 0.000 -7.556 -0.000) 7.556 9.934 ( 0.000 -0.829 -0.000) 0.829 10.119 ( 0.000 -7.932 -0.000) 7.932 10.474 ( -0.000 2.846 0.000) 2.846 10.494 ( 0.000 -2.876 -0.000) 2.876 11.263 ( 0.000 -0.545 -0.000) 0.545 11.458 ( 0.000 -2.573 -0.000) 2.573 11.975 ( 0.000 -3.094 -0.000) 3.094 12.111 ( -0.000 11.030 0.000) 11.030 13.010 ( 0.000 -2.842 -0.000) 2.842 13.197 ( -0.000 8.991 0.000) 8.991 13.527 ( 0.000 -5.637 -0.000) 5.637 13.958 ( 0.000 -0.303 -0.000) 0.303 14.136 ( -0.000 2.652 0.000) 2.652 14.280 ( 0.000 -6.115 -0.000) 6.115 14.948 ( 0.000 -4.776 -0.000) 4.776 15.331 ( 0.000 -2.017 -0.000) 2.017 15.423 ( -0.000 0.458 0.000) 0.458 15.718 ( -0.000 6.295 0.000) 6.295 16.003 ( 0.000 -15.337 -0.000) 15.337 16.109 ( -0.000 0.274 0.000) 0.274 17.923 ( -0.000 6.748 0.000) 6.748 18.852 ( -0.000 0.148 0.000) 0.148 22.599 ( 0.000 -2.015 -0.000) 2.015 22.627 ( -0.000 1.811 0.000) 1.811 24.415 ( -0.000 0.460 0.000) 0.460 24.693 ( -0.000 4.292 0.000) 4.292 25.175 ( -0.000 1.419 0.000) 1.419 27.477 ( -0.000 8.513 0.000) 8.513 29.153 ( 0.000 -6.283 -0.000) 6.283 29.567 ( 0.000 -1.460 -0.000) 1.460 29.604 ( 0.000 -1.361 -0.000) 1.361 29.960 ( 0.000 -3.794 -0.000) 3.794 29.995 ( 0.000 -3.654 -0.000) 3.654 30.371 ( -0.000 10.491 0.000) 10.491 31.165 ( 0.000 -0.205 -0.000) 0.205 33.695 ( 0.000 -6.825 -0.000) 6.825 ======================= Grid point 19 (13/186) ======================= q-point: ( 0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.753 ( 5.109 0.000 13.233) 14.185 2.071 ( 26.976 0.000 11.488) 29.321 2.779 ( 6.745 0.000 5.580) 8.754 2.964 ( 30.330 0.000 11.434) 32.413 3.183 ( 1.952 0.000 3.347) 3.875 3.340 ( -7.386 -0.000 -1.938) 7.637 3.614 ( 4.397 0.000 -4.472) 6.271 4.151 ( 2.141 0.000 -3.685) 4.261 4.408 ( 2.737 0.000 6.873) 7.397 4.889 ( 4.369 0.000 2.051) 4.826 5.128 ( 3.937 0.000 -5.734) 6.956 5.229 ( -18.691 -0.000 -1.116) 18.725 6.379 ( 8.381 0.000 -11.068) 13.883 6.748 ( 3.056 0.000 1.032) 3.225 6.997 ( 2.828 0.000 4.847) 5.612 7.691 ( 8.575 0.000 -1.203) 8.659 8.186 ( -13.209 -0.000 -1.432) 13.287 8.278 ( 8.674 0.000 11.561) 14.453 8.321 ( -5.805 -0.000 -7.647) 9.600 8.624 ( 0.404 0.000 -5.394) 5.409 8.836 ( 6.487 0.000 -1.824) 6.739 9.072 ( -0.629 -0.000 -2.223) 2.310 9.276 ( -5.195 -0.000 -5.797) 7.784 9.841 ( -10.015 -0.000 -12.588) 16.086 9.847 ( -4.562 -0.000 1.305) 4.745 10.190 ( -12.605 -0.000 -5.154) 13.618 10.559 ( 11.980 0.000 15.605) 19.673 11.106 ( 0.259 0.000 -4.726) 4.734 11.275 ( -3.026 -0.000 1.051) 3.203 11.646 ( -1.618 -0.000 9.699) 9.833 11.727 ( 3.959 0.000 -0.082) 3.959 12.264 ( -3.606 -0.000 -6.218) 7.188 12.501 ( 5.430 0.000 3.208) 6.307 13.188 ( -3.341 -0.000 1.853) 3.820 13.357 ( 10.710 0.000 -2.635) 11.029 13.965 ( -8.415 -0.000 8.664) 12.078 14.036 ( -1.257 -0.000 1.602) 2.036 14.371 ( 3.677 0.000 -6.059) 7.087 14.404 ( 0.487 0.000 2.518) 2.565 15.130 ( -8.275 -0.000 5.300) 9.827 15.182 ( -1.051 -0.000 -0.614) 1.217 15.616 ( -2.779 -0.000 -1.111) 2.992 15.800 ( 0.807 0.000 -1.849) 2.017 16.269 ( 0.621 0.000 -0.068) 0.625 18.234 ( 4.531 0.000 -9.042) 10.114 19.023 ( -0.507 -0.000 5.119) 5.144 22.384 ( -0.173 -0.000 -3.031) 3.036 22.781 ( 0.761 0.000 1.632) 1.801 24.276 ( 3.002 0.000 3.621) 4.703 24.895 ( 4.323 0.000 4.554) 6.280 26.463 ( -26.524 -0.000 -8.151) 27.748 28.031 ( 4.349 0.000 7.406) 8.589 28.883 ( -9.124 -0.000 -3.466) 9.760 29.426 ( -1.702 -0.000 -7.624) 7.812 29.524 ( -5.399 -0.000 -6.192) 8.215 29.719 ( 1.318 0.000 -0.016) 1.318 29.882 ( -2.731 -0.000 -0.762) 2.835 30.974 ( -1.148 -0.000 2.796) 3.023 31.561 ( 9.297 0.000 1.143) 9.367 32.166 ( 12.231 0.000 10.418) 16.066 ======================= Grid point 20 (14/186) ======================= q-point: ( 0.38 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.815 ( -6.752 -8.174 -2.132) 10.814 2.408 ( 22.124 0.900 8.711) 23.794 2.938 ( 11.102 1.499 11.314) 15.922 3.142 ( 7.946 12.695 -2.972) 15.269 3.173 ( -3.460 -0.267 5.999) 6.930 3.499 ( 11.027 -6.986 1.680) 13.162 3.641 ( 5.092 -1.782 -0.846) 5.460 4.169 ( 0.489 -1.556 -3.737) 4.077 4.566 ( 3.536 -9.791 8.967) 13.740 4.727 ( -15.266 7.554 -7.578) 18.643 5.161 ( 2.586 -3.653 -5.512) 7.100 5.246 ( 7.843 -2.868 11.259) 14.018 6.333 ( 5.426 8.884 -10.106) 14.509 6.797 ( 0.238 -1.352 -0.633) 1.512 6.974 ( 1.035 7.581 0.040) 7.652 7.755 ( 2.329 3.803 3.300) 5.547 8.056 ( -6.152 -5.357 -2.607) 8.564 8.159 ( -5.740 5.687 -4.849) 9.424 8.473 ( 10.027 -1.919 6.008) 11.845 8.689 ( 0.548 -9.237 -2.733) 9.649 8.902 ( 3.749 -0.036 -1.087) 3.903 9.046 ( 1.896 2.560 -3.204) 4.518 9.243 ( -4.301 -5.164 1.720) 6.937 9.647 ( -7.705 0.567 -10.595) 13.113 9.877 ( -4.375 -9.351 -0.449) 10.334 9.976 ( -14.635 0.648 -5.191) 15.541 10.685 ( 9.903 14.285 7.754) 19.033 11.032 ( 3.011 9.527 9.183) 13.571 11.172 ( -3.358 5.510 -1.883) 6.722 11.623 ( 0.668 6.001 3.663) 7.062 11.795 ( 0.385 -4.645 -2.155) 5.135 12.284 ( 0.510 -6.459 -1.911) 6.755 12.582 ( 6.374 -0.155 1.741) 6.609 13.161 ( -7.126 -4.955 -2.381) 9.000 13.513 ( 9.349 -3.608 1.757) 10.174 13.886 ( -6.724 1.400 3.040) 7.511 14.031 ( -2.335 -1.706 0.570) 2.948 14.380 ( 3.820 1.974 -5.403) 6.906 14.503 ( 1.275 -10.004 3.678) 10.735 15.035 ( -6.331 3.127 4.770) 8.521 15.193 ( 2.214 -0.567 0.098) 2.287 15.561 ( -4.404 0.482 -0.455) 4.453 15.808 ( -1.049 -2.080 -1.313) 2.674 16.269 ( 0.047 0.454 -0.774) 0.898 18.229 ( 6.850 5.211 -6.181) 10.597 19.020 ( -2.820 0.543 3.989) 4.915 22.385 ( 1.005 -0.853 -1.253) 1.819 22.787 ( -0.176 0.711 1.143) 1.357 24.338 ( 4.479 0.149 1.667) 4.782 24.958 ( 2.004 0.445 4.737) 5.162 26.096 ( -26.983 -1.925 -8.443) 28.338 28.001 ( 8.215 15.465 5.370) 18.316 28.768 ( -7.156 -1.153 -2.216) 7.580 29.351 ( -0.971 0.561 -4.177) 4.324 29.525 ( -6.793 -10.087 -5.864) 13.501 29.740 ( 0.656 -0.737 1.391) 1.705 29.862 ( -2.358 -2.481 -2.276) 4.110 30.991 ( -0.584 -2.035 2.501) 3.276 31.521 ( 8.456 18.519 1.880) 20.445 32.501 ( 9.288 -16.611 5.640) 19.850 ======================= Grid point 21 (15/186) ======================= q-point: ( 0.50 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.822 ( -8.150 -10.887 -8.363) 15.965 2.717 ( 21.058 1.205 5.980) 21.924 2.880 ( -0.079 18.247 1.482) 18.307 3.091 ( 1.265 1.619 5.603) 5.967 3.320 ( 9.396 -6.624 7.178) 13.553 3.487 ( 1.750 9.424 -4.428) 10.559 3.836 ( 5.353 -5.565 2.743) 8.195 4.128 ( -2.977 2.410 -11.028) 11.674 4.391 ( -14.799 6.709 1.325) 16.303 4.795 ( 1.322 -10.234 4.536) 11.272 5.134 ( -5.396 -1.921 -6.727) 8.835 5.494 ( 12.192 -0.354 15.204) 19.492 6.196 ( 0.729 10.264 -9.691) 14.135 6.774 ( 3.373 10.634 -2.980) 11.548 6.870 ( -2.019 -0.093 0.158) 2.028 7.764 ( 4.949 1.276 6.254) 8.076 8.018 ( -3.448 2.070 -1.908) 4.451 8.108 ( 0.252 -5.423 -4.050) 6.773 8.623 ( 7.333 -0.428 3.989) 8.359 8.803 ( -1.519 -6.483 1.982) 6.947 8.935 ( 2.100 -3.123 -3.991) 5.486 9.027 ( 2.191 1.695 -5.086) 5.791 9.279 ( -6.568 -6.023 5.650) 10.552 9.553 ( -4.431 -5.641 -12.152) 14.112 9.729 ( -16.072 -0.408 0.429) 16.083 10.026 ( 1.935 -10.770 -0.345) 10.948 10.499 ( 2.226 21.474 -0.631) 21.599 10.939 ( -0.476 15.261 12.397) 19.667 11.182 ( 8.567 0.262 4.276) 9.579 11.553 ( 0.205 6.021 1.287) 6.161 11.824 ( -2.573 -5.306 -8.336) 10.211 12.390 ( 5.602 -2.100 1.464) 6.160 12.702 ( 6.416 -3.361 4.051) 8.299 13.114 ( -8.854 -6.523 -5.109) 12.126 13.667 ( 3.622 -0.727 3.159) 4.861 13.815 ( -1.376 -1.726 -0.560) 2.277 14.020 ( -2.562 -0.910 -0.035) 2.719 14.355 ( 1.971 3.755 -4.679) 6.314 14.727 ( 2.098 -16.220 3.025) 16.633 14.948 ( -2.972 3.161 3.729) 5.721 15.250 ( 4.195 -1.076 0.829) 4.410 15.496 ( -4.938 -0.240 0.045) 4.944 15.813 ( -2.314 -2.308 -0.438) 3.297 16.249 ( -0.700 1.162 -1.447) 1.983 18.219 ( 8.346 7.212 -2.859) 11.395 18.976 ( -4.377 1.115 2.143) 4.999 22.418 ( 1.593 -1.742 0.408) 2.396 22.769 ( -0.776 1.475 0.443) 1.724 24.394 ( 4.745 1.072 -0.128) 4.866 24.969 ( -0.433 2.312 3.544) 4.254 25.747 ( -24.893 -1.247 -8.128) 26.216 27.937 ( 10.503 14.310 4.105) 18.220 28.725 ( -3.435 -3.957 -0.595) 5.273 29.347 ( 0.084 -2.506 -2.020) 3.220 29.539 ( -7.131 -8.553 -4.826) 12.136 29.768 ( -0.092 -1.112 3.237) 3.424 29.862 ( -2.483 -4.016 -3.941) 6.151 31.026 ( 0.205 -1.300 2.434) 2.767 31.340 ( 4.393 20.040 0.701) 20.528 32.857 ( 8.334 -15.621 3.238) 17.998 ======================= Grid point 22 (16/186) ======================= q-point: (-0.38 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.810 ( -5.003 -3.745 -7.327) 9.630 2.514 ( 4.824 33.300 0.294) 33.649 3.034 ( 9.338 -9.201 -0.358) 13.114 3.123 ( -1.044 -1.244 4.390) 4.681 3.334 ( 1.941 14.443 7.652) 16.460 3.539 ( 8.319 -1.399 4.648) 9.632 3.768 ( -1.673 14.071 -14.818) 20.503 4.020 ( -8.234 -0.490 -6.503) 10.504 4.209 ( -8.216 -4.627 7.219) 11.875 4.924 ( 0.412 -6.116 1.189) 6.244 5.056 ( -5.889 -1.931 -2.366) 6.634 5.674 ( 6.434 0.841 11.804) 13.470 6.009 ( -0.285 9.330 -6.424) 11.331 6.548 ( -0.859 18.239 -6.246) 19.298 6.954 ( 1.640 -6.567 2.389) 7.178 7.881 ( 7.735 0.785 4.356) 8.912 8.022 ( -1.600 -5.008 8.240) 9.775 8.116 ( 1.603 0.813 -11.993) 12.127 8.702 ( 2.325 1.242 3.533) 4.408 8.866 ( 0.281 -3.687 4.878) 6.121 8.978 ( 3.836 1.208 -6.992) 8.066 9.029 ( -3.262 -7.294 -1.841) 8.200 9.289 ( -6.738 -5.905 2.319) 9.254 9.479 ( -7.272 -1.373 -4.559) 8.692 9.681 ( -2.574 -8.677 -0.753) 9.082 10.203 ( 2.584 -9.143 0.451) 9.512 10.239 ( -0.118 15.983 0.860) 16.006 10.782 ( -0.281 11.993 3.897) 12.613 11.290 ( 6.355 3.746 5.426) 9.157 11.503 ( 2.542 4.893 3.225) 6.388 11.807 ( -4.407 -6.567 -11.016) 13.561 12.461 ( 5.509 4.847 2.367) 7.710 12.843 ( 2.336 -4.363 3.406) 6.008 13.121 ( -2.890 -10.689 -2.378) 11.325 13.607 ( -2.502 7.098 1.366) 7.649 13.929 ( 3.669 -7.611 -0.913) 8.499 13.991 ( -2.606 -0.049 0.345) 2.629 14.290 ( 0.291 4.392 -3.396) 5.559 14.897 ( -0.140 1.572 2.962) 3.356 15.025 ( 3.116 -17.864 0.260) 18.135 15.324 ( 3.418 -1.649 0.987) 3.921 15.456 ( -3.479 -2.330 0.264) 4.196 15.811 ( -2.007 -1.770 0.255) 2.688 16.206 ( -1.494 2.068 -1.521) 2.970 18.208 ( 6.480 7.841 -0.146) 10.173 18.909 ( -3.710 1.326 0.389) 3.959 22.472 ( 1.423 -2.549 1.196) 3.155 22.733 ( -0.874 2.165 -0.218) 2.345 24.427 ( 3.841 1.630 -0.673) 4.227 24.920 ( -1.416 4.533 1.650) 5.027 25.430 ( -18.505 1.178 -6.349) 19.599 27.890 ( 7.382 12.631 2.367) 14.820 28.790 ( 0.260 -8.033 0.686) 8.066 29.399 ( 2.131 -3.794 -0.054) 4.352 29.534 ( -6.343 -6.366 -3.782) 9.750 29.802 ( -0.348 -1.683 4.609) 4.919 29.869 ( -2.413 -4.514 -4.916) 7.096 31.020 ( 4.407 13.789 3.426) 14.876 31.134 ( -3.026 5.064 -1.992) 6.226 33.173 ( 6.894 -14.313 1.956) 16.007 ======================= Grid point 23 (17/186) ======================= q-point: (-0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.702 ( -0.000 12.107 0.000) 12.107 2.076 ( -0.000 35.958 0.000) 35.958 2.966 ( -0.000 28.460 0.000) 28.460 3.138 ( -0.000 0.363 0.000) 0.363 3.324 ( -0.000 2.872 0.000) 2.872 3.406 ( -0.000 6.677 0.000) 6.677 3.762 ( 0.000 -4.773 -0.000) 4.773 3.831 ( -0.000 2.037 0.000) 2.037 4.361 ( 0.000 -15.559 -0.000) 15.559 4.983 ( -0.000 0.141 0.000) 0.141 5.051 ( 0.000 -5.118 -0.000) 5.118 5.766 ( 0.000 -5.379 -0.000) 5.379 5.901 ( -0.000 6.274 0.000) 6.274 6.247 ( -0.000 18.736 0.000) 18.736 7.038 ( 0.000 -2.090 -0.000) 2.090 7.911 ( -0.000 6.036 0.000) 6.036 8.064 ( 0.000 -0.243 -0.000) 0.243 8.117 ( 0.000 -4.966 -0.000) 4.966 8.683 ( -0.000 4.508 0.000) 4.508 8.903 ( -0.000 1.811 0.000) 1.811 9.029 ( 0.000 -3.801 -0.000) 3.801 9.086 ( 0.000 -7.909 -0.000) 7.909 9.306 ( 0.000 -2.289 -0.000) 2.289 9.463 ( 0.000 -5.701 -0.000) 5.701 9.794 ( 0.000 -9.283 -0.000) 9.283 10.066 ( -0.000 7.859 0.000) 7.859 10.351 ( 0.000 -7.971 -0.000) 7.971 10.643 ( -0.000 9.324 0.000) 9.324 11.290 ( -0.000 2.770 0.000) 2.770 11.474 ( -0.000 4.175 0.000) 4.175 11.837 ( 0.000 -6.873 -0.000) 6.873 12.402 ( -0.000 9.126 0.000) 9.126 12.915 ( 0.000 -3.985 -0.000) 3.985 13.282 ( 0.000 -12.003 -0.000) 12.003 13.475 ( -0.000 9.725 0.000) 9.725 13.962 ( -0.000 0.475 0.000) 0.475 14.066 ( 0.000 -8.375 -0.000) 8.375 14.225 ( -0.000 3.861 0.000) 3.861 14.889 ( -0.000 0.353 0.000) 0.353 15.251 ( 0.000 -7.628 -0.000) 7.628 15.398 ( 0.000 -3.579 -0.000) 3.579 15.516 ( 0.000 -13.271 -0.000) 13.271 15.813 ( -0.000 0.065 0.000) 0.065 16.150 ( -0.000 2.785 0.000) 2.785 18.142 ( -0.000 8.413 0.000) 8.413 18.867 ( -0.000 1.025 0.000) 1.025 22.526 ( 0.000 -3.023 -0.000) 3.023 22.691 ( -0.000 2.614 0.000) 2.614 24.437 ( -0.000 1.131 0.000) 1.131 24.840 ( -0.000 5.750 0.000) 5.750 25.239 ( -0.000 3.300 0.000) 3.300 27.775 ( -0.000 12.285 0.000) 12.285 28.926 ( 0.000 -9.564 -0.000) 9.564 29.494 ( 0.000 -3.945 -0.000) 3.945 29.532 ( 0.000 -4.300 -0.000) 4.300 29.853 ( 0.000 -3.266 -0.000) 3.266 29.884 ( 0.000 -3.918 -0.000) 3.918 30.787 ( -0.000 19.698 0.000) 19.698 31.128 ( 0.000 -2.678 -0.000) 2.678 33.421 ( 0.000 -12.995 -0.000) 12.995 ======================= Grid point 28 (18/186) ======================= q-point: ( 0.38 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.621 ( -9.039 -0.000 -7.380) 11.669 2.619 ( 9.295 0.000 4.859) 10.489 3.074 ( -6.013 -0.000 5.635) 8.240 3.196 ( 15.236 0.000 12.378) 19.630 3.407 ( 6.074 0.000 -2.284) 6.490 3.608 ( 7.630 0.000 -5.924) 9.660 3.678 ( 9.342 0.000 2.368) 9.638 4.164 ( 0.685 0.000 -0.628) 0.929 4.533 ( -17.101 -0.000 -2.665) 17.307 4.589 ( 5.705 0.000 7.400) 9.343 5.112 ( 1.134 0.000 -9.471) 9.539 5.482 ( 15.562 0.000 16.512) 22.690 6.356 ( -1.528 -0.000 -13.695) 13.780 6.772 ( -1.226 -0.000 -0.022) 1.226 7.036 ( -0.011 -0.000 -1.626) 1.626 7.870 ( -8.081 -0.000 -1.807) 8.281 7.893 ( 6.893 0.000 6.579) 9.529 8.105 ( -6.126 -0.000 -2.403) 6.580 8.568 ( 4.758 0.000 -5.115) 6.985 8.696 ( 9.553 0.000 4.580) 10.594 8.906 ( 0.665 0.000 -5.744) 5.782 9.106 ( 1.952 0.000 1.328) 2.361 9.163 ( -3.569 -0.000 4.317) 5.601 9.524 ( -4.837 -0.000 -13.462) 14.305 9.672 ( -17.244 -0.000 2.145) 17.377 9.839 ( -1.521 -0.000 -1.848) 2.393 10.978 ( 6.720 0.000 5.501) 8.684 11.027 ( -1.998 -0.000 -6.032) 6.354 11.240 ( -0.420 -0.000 17.134) 17.139 11.695 ( -0.878 -0.000 3.979) 4.075 11.752 ( 2.120 0.000 -13.204) 13.374 12.283 ( 5.944 0.000 6.420) 8.749 12.650 ( 4.940 0.000 -0.675) 4.986 12.992 ( -10.072 -0.000 -5.919) 11.682 13.618 ( 8.021 0.000 4.518) 9.206 13.836 ( -5.008 -0.000 2.093) 5.428 13.983 ( -2.263 -0.000 -0.508) 2.320 14.419 ( 3.466 0.000 -5.316) 6.346 14.472 ( 1.715 0.000 3.223) 3.651 15.003 ( -4.946 -0.000 4.412) 6.628 15.231 ( 3.855 0.000 0.929) 3.966 15.503 ( -4.723 -0.000 -0.524) 4.752 15.769 ( -1.698 -0.000 -1.615) 2.343 16.270 ( -0.111 -0.000 -0.690) 0.698 18.329 ( 7.458 0.000 -4.751) 8.843 18.993 ( -4.585 -0.000 3.322) 5.662 22.391 ( 1.462 0.000 -0.346) 1.502 22.791 ( -0.609 -0.000 0.817) 1.019 24.408 ( 4.976 0.000 0.603) 5.012 25.001 ( 0.518 0.000 4.423) 4.453 25.740 ( -21.299 -0.000 -6.722) 22.335 28.192 ( 3.640 0.000 3.347) 4.945 28.652 ( -6.214 -0.000 -1.763) 6.459 29.337 ( -4.159 -0.000 -5.244) 6.693 29.338 ( -1.134 -0.000 -3.213) 3.407 29.752 ( 0.068 0.000 3.104) 3.105 29.821 ( -0.760 -0.000 -2.950) 3.047 30.976 ( -0.541 -0.000 1.723) 1.806 31.774 ( 6.005 0.000 0.843) 6.064 32.512 ( 8.283 0.000 4.692) 9.519 ======================= Grid point 29 (19/186) ======================= q-point: ( 0.50 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.554 ( -5.569 -8.807 -5.593) 11.826 2.754 ( 3.085 -6.518 1.493) 7.365 3.052 ( -1.629 -0.758 4.023) 4.406 3.297 ( 3.685 18.379 1.560) 18.810 3.463 ( 12.677 -1.905 6.272) 14.272 3.599 ( 1.765 3.133 -3.007) 4.687 3.818 ( 1.683 -4.739 -2.764) 5.739 4.142 ( -0.451 4.936 -0.371) 4.970 4.314 ( -7.740 5.760 -1.297) 9.735 4.732 ( 1.864 -5.699 6.115) 8.564 5.068 ( -0.419 1.649 -7.024) 7.227 5.736 ( 12.169 1.641 15.347) 19.654 6.202 ( -6.366 4.049 -13.060) 15.083 6.781 ( -0.834 -4.087 0.245) 4.178 6.967 ( 0.665 9.102 -2.213) 9.391 7.815 ( -0.315 -3.524 1.218) 3.742 8.010 ( -2.638 2.845 -0.410) 3.902 8.043 ( 3.648 -3.675 3.779) 6.411 8.647 ( 3.130 -6.989 -2.477) 8.048 8.779 ( 0.867 1.322 0.725) 1.740 8.917 ( 3.642 -1.441 -2.970) 4.915 9.059 ( -0.323 5.529 -2.687) 6.156 9.198 ( -1.532 -1.756 4.840) 5.372 9.413 ( -0.964 -2.184 -12.050) 12.284 9.500 ( -15.672 -4.445 5.578) 17.218 9.917 ( 2.549 -8.161 0.219) 8.553 10.781 ( -0.582 18.345 -1.375) 18.406 11.074 ( -1.826 2.332 -2.266) 3.729 11.363 ( 6.484 1.920 23.105) 24.074 11.621 ( -0.296 5.028 -6.662) 8.352 11.721 ( -1.215 -0.495 -9.437) 9.528 12.464 ( 9.781 -4.022 7.546) 12.992 12.717 ( 2.138 -2.891 -0.605) 3.647 12.864 ( -10.557 -6.522 -6.970) 14.233 13.721 ( 1.734 0.790 3.340) 3.845 13.795 ( 0.869 -0.861 -0.055) 1.225 13.971 ( -1.820 -1.564 0.049) 2.400 14.403 ( 1.071 3.133 -3.400) 4.746 14.575 ( 1.369 -9.922 1.723) 10.163 14.963 ( -2.055 1.558 2.687) 3.724 15.290 ( 3.196 -0.837 0.986) 3.448 15.445 ( -3.199 0.302 -0.159) 3.217 15.751 ( -1.774 -1.674 -1.087) 2.670 16.257 ( -0.231 1.160 -0.585) 1.319 18.375 ( 5.956 3.535 -2.260) 7.286 18.942 ( -4.072 0.761 1.742) 4.494 22.416 ( 1.079 -1.202 0.203) 1.628 22.780 ( -0.546 0.974 0.329) 1.164 24.460 ( 3.349 0.655 -0.112) 3.415 25.007 ( -0.434 1.629 2.526) 3.037 25.485 ( -12.728 1.699 -4.110) 13.482 28.186 ( 3.402 7.386 1.838) 8.337 28.615 ( -3.226 -4.086 -0.690) 5.252 29.300 ( -0.900 -2.967 -1.863) 3.617 29.346 ( -2.645 -4.702 -2.621) 5.998 29.771 ( -0.304 -0.567 3.940) 3.992 29.805 ( -0.158 -0.804 -3.856) 3.942 30.993 ( -0.369 -2.261 0.922) 2.469 31.687 ( 3.212 18.854 0.649) 19.136 32.733 ( 4.495 -14.976 2.027) 15.767 ======================= Grid point 30 (20/186) ======================= q-point: (-0.38 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.651 ( 0.000 -10.987 -0.000) 10.987 2.850 ( -0.000 2.774 0.000) 2.774 3.056 ( -0.000 13.553 0.000) 13.553 3.084 ( 0.000 -3.098 -0.000) 3.098 3.522 ( -0.000 8.347 0.000) 8.347 3.614 ( 0.000 -1.952 -0.000) 1.952 3.878 ( 0.000 -5.568 -0.000) 5.568 3.982 ( -0.000 15.618 0.000) 15.618 4.178 ( -0.000 5.978 0.000) 5.978 4.836 ( 0.000 -7.033 -0.000) 7.033 5.013 ( -0.000 1.940 0.000) 1.940 5.819 ( -0.000 6.045 0.000) 6.045 6.051 ( -0.000 3.500 0.000) 3.500 6.783 ( -0.000 16.805 0.000) 16.805 6.866 ( 0.000 -7.716 -0.000) 7.716 7.934 ( 0.000 -9.130 -0.000) 9.130 7.962 ( -0.000 1.228 0.000) 1.228 8.097 ( 0.000 -0.006 -0.000) 0.006 8.749 ( -0.000 2.332 0.000) 2.332 8.802 ( 0.000 -11.103 -0.000) 11.103 8.933 ( -0.000 1.724 0.000) 1.724 8.993 ( -0.000 0.627 0.000) 0.627 9.194 ( 0.000 -1.678 -0.000) 1.678 9.419 ( 0.000 -0.219 -0.000) 0.219 9.521 ( 0.000 -10.691 -0.000) 10.691 10.073 ( 0.000 -11.103 -0.000) 11.103 10.502 ( -0.000 20.540 0.000) 20.540 10.951 ( -0.000 11.332 0.000) 11.332 11.422 ( -0.000 6.576 0.000) 6.576 11.623 ( 0.000 -7.358 -0.000) 7.358 11.633 ( -0.000 5.414 0.000) 5.414 12.581 ( -0.000 3.829 0.000) 3.829 12.767 ( 0.000 -7.466 -0.000) 7.466 12.923 ( 0.000 -12.495 -0.000) 12.495 13.676 ( -0.000 4.875 0.000) 4.875 13.870 ( 0.000 -5.320 -0.000) 5.320 13.970 ( 0.000 -0.327 -0.000) 0.327 14.345 ( -0.000 4.468 0.000) 4.468 14.781 ( 0.000 -17.520 -0.000) 17.520 14.932 ( -0.000 2.072 0.000) 2.072 15.329 ( 0.000 -1.114 -0.000) 1.114 15.423 ( 0.000 -0.282 -0.000) 0.282 15.764 ( 0.000 -2.481 -0.000) 2.481 16.229 ( -0.000 2.355 0.000) 2.355 18.348 ( -0.000 5.927 0.000) 5.927 18.902 ( -0.000 1.282 0.000) 1.282 22.449 ( 0.000 -2.293 -0.000) 2.293 22.756 ( -0.000 1.881 0.000) 1.881 24.470 ( -0.000 1.097 0.000) 1.097 24.973 ( -0.000 3.516 0.000) 3.516 25.346 ( -0.000 3.942 0.000) 3.942 28.098 ( -0.000 10.190 0.000) 10.190 28.676 ( 0.000 -7.642 -0.000) 7.642 29.369 ( 0.000 -6.724 -0.000) 6.724 29.371 ( 0.000 -4.161 -0.000) 4.161 29.795 ( 0.000 -1.109 -0.000) 1.109 29.805 ( 0.000 -1.730 -0.000) 1.730 31.033 ( 0.000 -3.547 -0.000) 3.547 31.407 ( -0.000 23.755 0.000) 23.755 32.997 ( 0.000 -17.274 -0.000) 17.274 ======================= Grid point 38 (21/186) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 106 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.436 ( 0.000 0.000 0.000) 0.000 2.727 ( 0.000 0.000 0.000) 0.000 3.043 ( 0.000 0.000 0.000) 0.000 3.478 ( 0.000 0.000 0.000) 0.000 3.575 ( -0.000 -0.000 0.000) 0.000 3.602 ( 0.000 0.000 -0.000) 0.000 3.743 ( 0.000 0.000 0.000) 0.000 4.187 ( 0.000 0.000 0.000) 0.000 4.312 ( 0.000 0.000 0.000) 0.000 4.731 ( 0.000 0.000 -0.000) 0.000 5.066 ( 0.000 0.000 0.000) 0.000 5.924 ( -0.000 -0.000 -0.000) 0.000 6.095 ( 0.000 0.000 0.000) 0.000 6.740 ( 0.000 0.000 0.000) 0.000 7.032 ( 0.000 0.000 0.000) 0.000 7.762 ( 0.000 0.000 0.000) 0.000 8.014 ( 0.000 0.000 0.000) 0.000 8.076 ( 0.000 0.000 0.000) 0.000 8.604 ( 0.000 0.000 0.000) 0.000 8.778 ( 0.000 0.000 0.000) 0.000 8.929 ( 0.000 0.000 0.000) 0.000 9.147 ( 0.000 0.000 -0.000) 0.000 9.247 ( -0.000 -0.000 0.000) 0.000 9.260 ( 0.000 0.000 -0.000) 0.000 9.381 ( 0.000 0.000 0.000) 0.000 9.879 ( 0.000 0.000 0.000) 0.000 10.953 ( 0.000 0.000 0.000) 0.000 11.007 ( 0.000 0.000 0.000) 0.000 11.559 ( 0.000 0.000 0.000) 0.000 11.562 ( -0.000 -0.000 -0.000) 0.000 11.697 ( 0.000 0.000 0.000) 0.000 12.596 ( 0.000 0.000 0.000) 0.000 12.636 ( -0.000 -0.000 -0.000) 0.000 12.715 ( 0.000 0.000 0.000) 0.000 13.750 ( 0.000 0.000 0.000) 0.000 13.795 ( 0.000 0.000 0.000) 0.000 13.947 ( 0.000 0.000 0.000) 0.000 14.429 ( 0.000 0.000 0.000) 0.000 14.514 ( 0.000 0.000 0.000) 0.000 14.966 ( 0.000 0.000 0.000) 0.000 15.309 ( 0.000 0.000 0.000) 0.000 15.425 ( 0.000 0.000 0.000) 0.000 15.724 ( 0.000 0.000 0.000) 0.000 16.263 ( 0.000 0.000 0.000) 0.000 18.434 ( 0.000 0.000 0.000) 0.000 18.922 ( 0.000 0.000 0.000) 0.000 22.415 ( 0.000 0.000 0.000) 0.000 22.784 ( 0.000 0.000 0.000) 0.000 24.487 ( 0.000 0.000 -0.000) 0.000 25.022 ( 0.000 0.000 0.000) 0.000 25.409 ( 0.000 0.000 0.000) 0.000 28.258 ( 0.000 0.000 0.000) 0.000 28.561 ( 0.000 0.000 0.000) 0.000 29.253 ( 0.000 0.000 0.000) 0.000 29.308 ( 0.000 0.000 0.000) 0.000 29.781 ( -0.000 -0.000 0.000) 0.000 29.783 ( 0.000 0.000 -0.000) 0.000 30.977 ( 0.000 0.000 0.000) 0.000 31.858 ( 0.000 0.000 0.000) 0.000 32.644 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 67 (22/186) ======================= q-point: ( 0.00 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.580 ( 9.207 0.000 30.651) 32.004 0.745 ( 23.789 0.000 37.634) 44.522 1.571 ( 4.124 0.000 72.809) 72.926 2.981 ( -1.320 -0.000 -0.377) 1.373 3.391 ( -16.876 -0.000 18.418) 24.981 3.750 ( -9.075 -0.000 26.657) 28.159 3.996 ( -9.514 -0.000 1.550) 9.639 4.126 ( -7.789 -0.000 13.721) 15.778 4.147 ( 11.447 0.000 3.993) 12.123 4.963 ( 0.578 0.000 -0.262) 0.635 5.066 ( -0.950 -0.000 -8.261) 8.315 5.672 ( 12.011 0.000 8.406) 14.661 6.342 ( -15.332 -0.000 -3.014) 15.625 6.515 ( 1.911 0.000 1.769) 2.604 6.692 ( 8.789 0.000 4.329) 9.797 7.256 ( 1.704 0.000 -2.309) 2.870 8.046 ( 4.987 0.000 -3.395) 6.033 8.184 ( 5.175 0.000 -9.890) 11.163 8.598 ( 0.337 0.000 -7.686) 7.694 8.653 ( 0.210 0.000 -12.951) 12.953 8.659 ( -5.354 -0.000 4.470) 6.975 9.154 ( -1.382 -0.000 -0.137) 1.389 9.256 ( 15.450 0.000 0.464) 15.457 9.679 ( -1.413 -0.000 -7.620) 7.750 9.931 ( 1.529 0.000 -1.104) 1.886 10.389 ( 1.312 0.000 -2.000) 2.392 10.440 ( -1.590 -0.000 -0.863) 1.808 10.562 ( 5.939 0.000 10.284) 11.875 11.104 ( 1.376 0.000 -2.522) 2.873 11.613 ( -0.158 -0.000 7.784) 7.785 11.732 ( 1.472 0.000 3.288) 3.603 12.152 ( 8.252 0.000 9.408) 12.514 12.525 ( -6.252 -0.000 -6.665) 9.139 13.171 ( -5.976 -0.000 -4.840) 7.690 13.178 ( 2.584 0.000 8.580) 8.960 14.008 ( 1.088 0.000 3.846) 3.997 14.238 ( 1.177 0.000 -10.601) 10.666 14.394 ( 1.479 0.000 -3.609) 3.900 15.372 ( -3.433 -0.000 8.952) 9.587 15.372 ( 0.294 0.000 -0.544) 0.618 15.592 ( -0.888 -0.000 0.550) 1.045 15.723 ( -1.605 -0.000 -1.074) 1.931 16.124 ( 3.909 0.000 -8.969) 9.784 17.309 ( -70.859 -0.000 -2.751) 70.913 17.860 ( -17.622 -0.000 4.565) 18.204 18.896 ( 0.670 0.000 4.548) 4.597 22.322 ( 3.450 0.000 -22.251) 22.517 22.502 ( 7.987 0.000 -13.775) 15.923 24.310 ( 1.189 0.000 10.161) 10.231 24.721 ( -2.758 -0.000 8.672) 9.100 25.527 ( 89.473 0.000 -3.396) 89.537 27.288 ( -2.967 -0.000 -6.597) 7.233 29.282 ( -4.321 -0.000 3.782) 5.742 29.630 ( 7.925 0.000 0.644) 7.951 29.710 ( -18.085 -0.000 -8.157) 19.840 29.759 ( -2.599 -0.000 -0.414) 2.632 30.233 ( 6.587 0.000 13.183) 14.737 31.102 ( 1.763 0.000 6.038) 6.290 31.172 ( -1.976 -0.000 1.540) 2.505 32.904 ( -24.899 -0.000 -2.453) 25.020 ======================= Grid point 68 (23/186) ======================= q-point: ( 0.12 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.994 ( 19.006 -5.874 24.994) 31.944 1.409 ( 26.914 -17.291 29.919) 43.800 2.215 ( 17.556 -21.527 55.809) 62.340 3.004 ( -0.545 -3.161 -2.878) 4.309 3.257 ( -17.376 -0.388 22.806) 28.674 3.695 ( -6.711 4.990 15.466) 17.582 3.943 ( -11.504 -3.400 7.084) 13.932 4.082 ( -3.967 2.457 13.852) 14.616 4.428 ( 2.932 -18.673 -0.514) 18.909 4.891 ( -2.099 6.267 -3.605) 7.529 5.025 ( -3.373 -2.815 -1.522) 4.650 5.790 ( 8.545 8.955 -3.702) 12.919 6.105 ( -15.608 0.867 7.138) 17.184 6.575 ( 12.979 8.619 3.807) 16.039 6.713 ( 0.858 0.292 -0.735) 1.167 7.449 ( 6.599 -14.928 -1.350) 16.377 8.074 ( 4.575 1.809 -5.271) 7.210 8.219 ( 4.365 0.222 -8.937) 9.948 8.556 ( -4.078 4.131 -4.664) 7.446 8.622 ( 1.849 -2.892 -6.981) 7.779 8.703 ( -2.188 -12.514 -9.482) 15.852 9.121 ( -3.359 0.372 -1.905) 3.879 9.401 ( 5.581 1.840 -6.410) 8.697 9.706 ( 20.779 10.168 -9.608) 25.050 9.935 ( 0.723 1.188 -1.374) 1.955 10.253 ( -9.285 1.974 -7.601) 12.161 10.456 ( -2.310 -3.133 3.228) 5.056 10.698 ( 8.736 9.246 9.943) 16.146 11.173 ( 4.035 -6.451 -7.095) 10.404 11.566 ( 0.952 7.870 4.639) 9.185 11.882 ( -0.988 -12.720 3.529) 13.238 12.273 ( 6.555 2.481 4.997) 8.608 12.472 ( -4.967 -7.364 -12.382) 15.239 13.129 ( 0.785 -1.169 2.606) 2.962 13.267 ( 1.838 -3.308 4.125) 5.598 14.045 ( 1.023 -0.563 3.955) 4.124 14.186 ( 1.366 2.630 -10.889) 11.285 14.391 ( 0.588 0.916 -0.057) 1.090 15.305 ( -19.523 1.435 21.750) 29.262 15.337 ( -4.468 0.373 1.147) 4.628 15.492 ( -8.218 15.401 4.571) 18.045 15.671 ( -4.574 0.145 0.945) 4.673 16.001 ( -18.572 5.605 6.883) 20.584 16.263 ( -29.186 -7.802 8.908) 31.497 17.918 ( 7.609 4.526 -5.566) 10.457 18.953 ( 3.902 0.576 4.852) 6.253 22.277 ( 3.221 -1.439 -20.081) 20.389 22.538 ( 8.223 -0.078 -14.959) 17.071 24.374 ( -3.617 -2.874 8.902) 10.029 24.780 ( 2.288 -1.857 10.410) 10.819 26.337 ( 72.356 29.747 -23.331) 81.637 27.164 ( -9.654 -1.410 -10.229) 14.136 29.188 ( -7.716 4.088 1.659) 8.888 29.506 ( -9.530 -1.063 0.387) 9.597 29.706 ( 3.992 1.041 -0.936) 4.230 29.803 ( -4.048 -9.126 0.694) 10.007 30.367 ( 2.988 0.926 16.524) 16.818 30.861 ( -1.845 26.037 22.193) 34.262 31.191 ( 1.897 -0.385 1.347) 2.358 32.763 ( -32.021 -32.490 -9.910) 46.681 ======================= Grid point 69 (24/186) ======================= q-point: ( 0.25 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.422 ( 17.377 -7.041 18.195) 26.127 2.079 ( 16.122 -18.619 26.975) 36.527 2.878 ( 9.649 -13.186 19.466) 25.414 2.967 ( -2.279 3.050 -5.989) 7.097 3.211 ( -13.851 -2.706 34.236) 37.031 3.702 ( 0.821 -4.921 14.839) 15.655 3.840 ( -11.988 1.331 9.594) 15.412 4.092 ( -1.286 -0.538 9.850) 9.948 4.684 ( 1.484 -14.486 -3.092) 14.886 4.791 ( -2.592 4.268 8.304) 9.689 5.053 ( -1.093 -6.615 4.527) 8.090 5.712 ( 4.401 6.271 -4.104) 8.691 5.920 ( -11.617 6.524 4.169) 13.960 6.528 ( 5.697 12.596 0.376) 13.830 6.862 ( 5.340 -8.476 0.853) 10.054 7.669 ( 3.707 -5.191 -2.236) 6.759 8.070 ( 2.182 0.056 -6.920) 7.256 8.194 ( -0.799 3.218 -3.019) 4.485 8.427 ( -1.746 1.986 -8.518) 8.919 8.701 ( 3.922 -5.920 -2.410) 7.499 8.797 ( -0.394 -9.584 -8.750) 12.984 9.051 ( -4.669 -1.102 -2.123) 5.246 9.405 ( 2.035 -2.418 -5.059) 5.965 9.759 ( 19.808 13.944 -7.836) 25.460 9.878 ( -1.971 3.854 -4.515) 6.255 10.132 ( -6.937 -4.354 -2.976) 8.714 10.443 ( -6.784 -0.242 3.392) 7.588 10.663 ( 5.686 14.079 12.703) 19.797 11.210 ( -1.607 0.567 -5.772) 6.019 11.496 ( 1.428 6.032 2.551) 6.703 12.036 ( -3.939 -11.396 1.729) 12.181 12.296 ( 4.385 4.960 -1.837) 6.870 12.454 ( -3.180 -6.405 -9.166) 11.626 13.229 ( 5.403 -3.170 1.641) 6.475 13.358 ( 2.679 -4.341 3.513) 6.194 14.078 ( 0.624 1.080 -0.458) 1.329 14.092 ( -1.028 3.080 -6.584) 7.341 14.384 ( -1.902 1.130 5.835) 6.240 15.016 ( -21.307 6.233 21.045) 30.590 15.267 ( -5.534 0.556 -1.156) 5.681 15.298 ( -8.965 1.207 8.593) 12.477 15.650 ( -1.158 -0.808 -1.649) 2.171 15.904 ( -1.516 0.939 4.897) 5.211 16.220 ( -2.494 -4.389 -4.958) 7.076 17.896 ( 2.698 3.223 -4.424) 6.103 19.008 ( 3.234 1.463 4.114) 5.434 22.256 ( 4.083 -1.642 -16.868) 17.433 22.568 ( 7.943 0.215 -15.609) 17.515 24.384 ( -4.982 -1.695 6.454) 8.328 24.902 ( 3.338 -1.823 11.898) 12.491 26.570 ( 46.051 27.719 -12.836) 55.261 27.001 ( -15.010 -6.064 -13.885) 21.327 29.021 ( -7.709 5.313 1.048) 9.421 29.451 ( -5.130 -2.316 2.191) 6.040 29.725 ( 1.306 0.458 -0.011) 1.384 29.868 ( -5.522 -7.298 4.331) 10.125 30.427 ( -7.273 -1.672 19.188) 20.588 30.697 ( 7.312 17.375 14.665) 23.883 31.240 ( 1.770 -1.713 2.867) 3.780 32.761 ( -15.504 -18.918 -14.407) 28.387 ======================= Grid point 70 (25/186) ======================= q-point: ( 0.38 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.773 ( 12.590 -3.765 11.149) 17.233 2.472 ( -5.242 -7.424 17.229) 19.479 2.824 ( -4.980 3.122 -5.712) 8.197 3.108 ( 8.221 -5.885 5.276) 11.404 3.221 ( -9.128 3.405 30.941) 32.438 3.721 ( -10.834 2.078 15.502) 19.027 3.865 ( 1.306 -0.575 -2.240) 2.656 4.168 ( -3.598 -7.022 14.435) 16.450 4.772 ( -1.005 0.696 21.199) 21.234 4.886 ( 1.220 -10.449 -0.692) 10.542 5.221 ( 3.775 -6.180 10.182) 12.495 5.697 ( -2.247 11.781 1.666) 12.109 5.730 ( -1.879 -6.075 -0.629) 6.390 6.438 ( 2.263 5.577 -5.029) 7.843 6.965 ( -0.828 -0.846 3.176) 3.389 7.652 ( -0.625 4.904 -3.398) 5.999 8.056 ( -1.681 -0.999 -6.056) 6.364 8.131 ( -1.044 0.770 -1.147) 1.732 8.387 ( 5.697 1.758 -11.787) 13.209 8.818 ( 1.711 -5.277 0.944) 5.627 8.865 ( 2.294 -3.324 -5.426) 6.764 9.055 ( -3.575 -7.892 -2.088) 8.912 9.504 ( 6.544 -6.981 -5.541) 11.058 9.767 ( 12.599 9.746 -5.165) 16.745 9.790 ( -1.773 0.595 -3.338) 3.826 10.131 ( -4.322 -5.277 -1.797) 7.054 10.329 ( -9.049 2.221 2.413) 9.625 10.613 ( 7.643 15.425 15.820) 23.380 11.088 ( -6.750 3.186 -5.229) 9.114 11.463 ( 1.612 3.921 1.863) 4.631 12.087 ( -7.080 -7.484 -5.305) 11.588 12.260 ( 2.748 3.992 -3.509) 5.983 12.514 ( 3.844 -4.107 1.907) 5.940 13.291 ( 1.336 -1.058 -5.378) 5.641 13.519 ( 6.095 -6.309 4.898) 10.047 13.943 ( -2.358 6.287 -7.255) 9.886 14.104 ( -1.508 -1.639 2.178) 3.115 14.352 ( -4.619 1.747 5.656) 7.509 14.888 ( -2.883 1.028 7.112) 7.743 15.198 ( -4.734 0.308 3.836) 6.101 15.218 ( -8.878 0.285 8.155) 12.058 15.633 ( -0.405 0.327 -2.361) 2.418 15.905 ( 1.356 2.735 5.364) 6.171 16.230 ( -0.426 -3.518 -6.398) 7.314 17.882 ( 1.240 -0.184 -1.771) 2.169 19.029 ( 1.410 2.167 2.480) 3.583 22.267 ( 5.374 -1.783 -13.778) 14.897 22.582 ( 7.090 0.761 -16.143) 17.648 24.361 ( -4.182 -0.063 3.934) 5.742 25.002 ( 0.839 -0.056 11.679) 11.710 26.670 ( 17.204 9.992 -18.289) 27.024 26.845 ( -2.363 0.268 -6.896) 7.294 28.888 ( -4.611 2.844 2.236) 5.861 29.440 ( -3.108 -1.857 2.468) 4.382 29.733 ( -0.314 -0.024 2.637) 2.656 29.907 ( -5.526 -4.913 7.049) 10.216 30.438 ( -11.832 -6.625 14.402) 19.781 30.648 ( 8.810 14.881 10.417) 20.189 31.299 ( 0.145 -1.946 4.498) 4.903 32.751 ( -2.896 -7.329 -14.788) 16.757 ======================= Grid point 71 (26/186) ======================= q-point: (-0.50 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.829 ( -2.808 13.122 2.462) 13.644 2.384 ( -14.024 7.220 10.186) 18.776 2.755 ( 0.102 -3.284 -2.645) 4.218 3.139 ( 0.291 3.283 2.741) 4.287 3.411 ( -2.091 -6.052 27.235) 27.978 3.657 ( -7.967 1.490 10.445) 13.221 3.744 ( -4.556 6.275 4.011) 8.731 4.272 ( -5.967 -6.418 12.924) 15.614 4.830 ( -4.930 2.512 17.045) 17.921 5.009 ( -3.175 -5.890 6.573) 9.380 5.285 ( 3.654 9.927 6.038) 12.180 5.608 ( 1.463 1.420 3.986) 4.477 5.786 ( -5.952 -6.240 2.158) 8.890 6.392 ( -0.792 -1.010 -7.233) 7.346 6.978 ( 0.460 -1.744 5.921) 6.190 7.603 ( 4.294 0.953 -2.869) 5.251 7.964 ( -5.205 1.931 -11.366) 12.650 8.169 ( 2.709 -3.933 3.783) 6.092 8.384 ( 8.584 4.533 -12.280) 15.653 8.877 ( -0.886 -1.364 1.753) 2.392 8.893 ( 1.563 -0.783 -5.320) 5.600 9.131 ( 0.595 -6.829 -1.563) 7.031 9.595 ( 4.791 2.219 -5.410) 7.559 9.754 ( -2.647 -3.879 -7.721) 9.037 9.880 ( 2.682 -9.002 6.461) 11.400 10.071 ( -5.871 0.457 -6.959) 9.116 10.272 ( -1.459 -1.280 7.302) 7.555 10.587 ( 9.322 14.665 14.590) 22.690 10.962 ( -3.444 0.476 -4.663) 5.816 11.440 ( 0.227 1.706 0.114) 1.725 12.039 ( -5.340 -3.380 -9.283) 11.230 12.224 ( 1.509 3.704 -2.084) 4.510 12.659 ( 7.757 -1.914 7.644) 11.057 13.261 ( -1.133 0.219 -9.179) 9.251 13.648 ( 0.167 0.204 2.807) 2.819 13.851 ( 2.608 -0.655 -3.665) 4.546 14.111 ( -2.604 -1.969 1.989) 3.822 14.282 ( -4.192 1.460 0.284) 4.448 14.936 ( 3.750 -1.593 4.290) 5.917 15.129 ( -7.693 3.324 13.724) 16.081 15.196 ( 1.692 0.128 1.906) 2.552 15.612 ( -0.612 -0.109 -2.936) 3.001 15.911 ( 0.873 2.276 5.452) 5.972 16.241 ( 0.119 -2.630 -5.939) 6.496 17.923 ( 0.847 -4.081 1.471) 4.420 19.008 ( -0.796 2.468 0.886) 2.740 22.307 ( 6.541 -1.628 -11.638) 13.449 22.573 ( 5.985 1.311 -16.913) 17.988 24.322 ( -2.265 1.688 2.322) 3.657 25.025 ( -3.049 2.400 10.331) 11.035 26.501 ( -22.298 -11.256 -25.116) 35.422 26.935 ( 26.076 12.024 -1.844) 28.774 28.861 ( -0.243 -1.415 3.750) 4.016 29.439 ( -1.300 -0.704 1.126) 1.858 29.748 ( -1.769 -0.959 6.898) 7.185 29.935 ( -4.433 -3.303 8.226) 9.911 30.443 ( -13.710 -9.711 8.212) 18.701 30.599 ( 5.141 12.540 10.512) 17.152 31.325 ( -2.832 -0.695 5.123) 5.895 32.761 ( 9.197 1.389 -13.772) 16.619 ======================= Grid point 72 (27/186) ======================= q-point: (-0.38 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.449 ( -12.789 23.173 -1.508) 26.511 2.001 ( -19.542 21.537 8.834) 30.394 2.914 ( 8.253 -6.296 -0.942) 10.423 3.022 ( -11.806 17.610 1.975) 21.294 3.309 ( -10.356 -0.992 5.205) 11.633 3.665 ( -7.055 0.760 32.499) 33.265 3.779 ( 0.588 -3.830 10.998) 11.660 4.291 ( -9.870 -1.207 12.315) 15.828 4.741 ( -3.271 8.972 5.863) 11.206 4.993 ( -10.815 -1.016 7.579) 13.246 5.221 ( 4.231 8.912 8.464) 12.999 5.654 ( 8.208 3.499 -1.470) 9.043 5.813 ( -8.282 -10.357 7.080) 15.032 6.350 ( -8.354 -7.075 -7.992) 13.554 7.064 ( 1.086 -0.411 7.024) 7.119 7.708 ( 8.546 -3.843 -1.396) 9.473 7.786 ( -3.359 5.199 -15.543) 16.730 8.325 ( 3.247 -6.417 8.210) 10.914 8.349 ( 8.014 5.814 -12.632) 16.050 8.861 ( -1.338 1.095 -1.324) 2.178 8.886 ( 2.354 0.216 -8.189) 8.523 9.204 ( 2.020 0.259 1.751) 2.686 9.607 ( 1.983 -1.856 1.510) 3.107 9.716 ( -10.227 -7.460 -9.535) 15.848 9.927 ( -3.469 -0.610 -1.945) 4.023 10.092 ( -2.018 -9.574 -2.133) 10.014 10.346 ( 3.804 -1.078 9.178) 9.994 10.585 ( 4.601 7.820 11.194) 14.409 10.967 ( 6.270 -1.175 -4.259) 7.671 11.428 ( -0.416 -0.732 -1.131) 1.410 11.973 ( -2.573 -0.984 -8.638) 9.066 12.168 ( 1.283 6.097 -1.444) 6.395 12.813 ( 8.901 1.216 8.004) 12.032 13.166 ( -2.224 2.766 -13.317) 13.782 13.592 ( -4.682 2.266 3.883) 6.491 13.933 ( 4.205 -1.231 -1.115) 4.521 14.127 ( -2.051 -5.514 -0.201) 5.887 14.240 ( -1.184 -1.079 -0.058) 1.603 15.015 ( -1.927 -0.959 11.306) 11.509 15.108 ( 5.062 1.847 7.400) 9.154 15.258 ( 6.984 2.072 7.217) 10.255 15.597 ( -1.513 -1.809 -2.817) 3.674 15.913 ( -0.806 1.286 4.609) 4.852 16.246 ( 0.560 -0.919 -4.273) 4.406 18.025 ( -0.236 -7.821 4.439) 8.996 18.956 ( -2.557 2.154 0.279) 3.355 22.362 ( 7.280 -1.185 -11.135) 13.356 22.539 ( 5.055 1.706 -17.911) 18.689 24.288 ( 0.571 3.132 2.591) 4.105 24.964 ( -6.329 3.991 8.975) 11.685 26.224 ( -30.849 -16.455 -29.221) 45.566 27.092 ( 22.744 9.488 -3.064) 24.833 28.953 ( 3.892 -5.224 4.871) 8.135 29.437 ( 0.836 0.521 -1.119) 1.491 29.780 ( -3.065 -1.731 10.994) 11.543 29.966 ( -2.941 -2.380 8.316) 9.136 30.419 ( -16.051 -9.943 2.963) 19.112 30.546 ( 0.139 7.785 13.554) 15.631 31.295 ( -4.960 0.713 4.237) 6.562 32.821 ( 21.467 9.794 -11.075) 26.066 ======================= Grid point 73 (28/186) ======================= q-point: (-0.25 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.939 ( -13.545 24.712 3.200) 28.361 1.455 ( -19.295 27.197 11.901) 35.407 2.323 ( -29.666 37.664 12.436) 49.531 3.078 ( 2.605 -0.419 2.950) 3.958 3.369 ( -1.886 -8.731 6.832) 11.245 3.711 ( -9.718 -0.028 34.115) 35.472 3.889 ( 3.319 -2.269 7.632) 8.626 4.194 ( -13.196 1.006 14.867) 19.905 4.564 ( 2.286 17.015 -1.470) 17.231 4.932 ( -7.115 -4.538 3.422) 9.107 5.237 ( 4.154 3.319 9.497) 10.884 5.630 ( 1.225 7.521 -10.301) 12.813 5.962 ( -2.586 -15.473 10.562) 18.912 6.347 ( -8.182 -14.141 -5.639) 17.283 6.994 ( -5.076 10.797 4.728) 12.833 7.581 ( -2.557 9.027 -9.495) 13.349 7.891 ( 9.736 -4.853 -5.652) 12.259 8.278 ( 4.593 4.246 -11.990) 13.524 8.500 ( 0.284 -5.692 9.590) 11.155 8.808 ( -0.922 1.240 -8.264) 8.407 8.883 ( 6.579 3.135 -7.382) 10.374 9.197 ( 0.777 3.297 1.994) 3.930 9.602 ( -15.362 -8.361 -15.636) 23.461 9.714 ( -0.017 -7.613 3.559) 8.404 9.911 ( 0.445 -0.368 -2.291) 2.363 10.145 ( -2.083 -6.072 -3.901) 7.512 10.468 ( 4.154 -1.799 8.104) 9.283 10.581 ( -1.882 2.644 7.847) 8.491 11.064 ( 9.143 -0.038 -5.806) 10.831 11.444 ( -0.097 -2.938 -0.717) 3.026 11.927 ( 2.098 3.064 -3.894) 5.381 12.074 ( -0.059 7.242 -1.317) 7.361 12.880 ( 6.690 9.513 -3.610) 12.177 13.045 ( -2.115 -0.566 -4.891) 5.359 13.500 ( -5.731 3.564 -1.833) 6.993 13.962 ( 0.764 -0.033 1.277) 1.488 14.211 ( 0.865 -7.572 -6.577) 10.067 14.286 ( 1.528 -3.485 5.256) 6.488 15.112 ( 1.726 -5.662 19.835) 20.699 15.223 ( 6.800 -1.910 1.666) 7.258 15.411 ( 16.451 4.147 21.011) 27.005 15.596 ( -3.717 -4.158 -0.468) 5.597 15.902 ( -1.570 0.073 3.677) 3.999 16.249 ( 2.655 1.197 1.433) 3.246 18.160 ( -4.837 -12.183 6.046) 14.435 18.899 ( -2.950 0.995 1.375) 3.403 22.413 ( 7.545 -0.781 -13.140) 15.173 22.487 ( 4.600 2.110 -18.095) 18.789 24.284 ( 4.459 4.485 4.948) 8.030 24.858 ( -7.711 3.804 8.317) 11.963 25.858 ( -40.340 -17.866 -38.065) 58.271 27.215 ( 15.412 5.884 -3.697) 16.906 29.125 ( 5.182 -6.406 5.474) 9.892 29.443 ( 4.017 1.127 -3.045) 5.165 29.809 ( -3.955 -0.943 10.507) 11.267 30.008 ( -0.890 -1.928 7.495) 7.790 30.317 ( -18.862 -6.605 -1.780) 20.064 30.551 ( -5.170 -2.841 21.577) 22.369 31.235 ( -4.633 0.869 2.726) 5.446 32.930 ( 34.204 20.117 -6.890) 40.275 ======================= Grid point 74 (29/186) ======================= q-point: (-0.12 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.562 ( -0.601 19.865 22.828) 30.267 0.884 ( -21.081 28.040 12.971) 37.402 1.583 ( -20.540 33.011 51.157) 64.255 3.051 ( -2.466 4.269 2.618) 5.582 3.451 ( -9.695 -5.318 12.039) 16.347 3.741 ( -11.361 -0.834 31.290) 33.300 4.005 ( 6.513 -0.778 4.338) 7.864 4.109 ( -9.414 -0.414 10.612) 14.191 4.343 ( 6.708 22.933 -3.269) 24.117 4.947 ( -2.198 -3.849 0.016) 4.432 5.203 ( -10.291 3.562 -6.441) 12.652 5.520 ( 7.487 3.220 2.147) 8.428 6.222 ( -2.567 -18.080 11.358) 21.505 6.464 ( -1.459 -13.325 -5.020) 14.313 6.748 ( -4.837 15.237 3.599) 16.386 7.380 ( -0.834 11.427 -4.932) 12.473 8.000 ( 6.001 -0.232 -4.867) 7.731 8.240 ( 1.072 -0.652 -13.985) 14.042 8.588 ( -0.974 -3.680 5.505) 6.693 8.728 ( -0.801 0.853 -14.064) 14.112 8.855 ( 5.177 10.832 -7.586) 14.202 9.173 ( 0.013 1.914 1.285) 2.305 9.352 ( -23.721 -3.190 -18.732) 30.393 9.758 ( -7.040 -4.547 -6.423) 10.559 9.913 ( 1.680 -0.229 -2.152) 2.740 10.241 ( 6.854 -2.928 8.384) 11.218 10.497 ( -3.377 2.088 -2.264) 4.570 10.562 ( 0.121 2.125 5.901) 6.273 11.113 ( 5.354 2.458 -5.929) 8.359 11.509 ( 0.008 -6.133 2.953) 6.807 11.843 ( 3.675 14.634 -0.673) 15.104 12.031 ( 2.632 -0.097 5.388) 5.997 12.702 ( -2.343 9.980 -11.257) 15.225 13.092 ( 2.020 -1.643 6.993) 7.462 13.331 ( -7.032 4.842 -6.539) 10.754 13.981 ( 0.715 0.027 2.799) 2.889 14.254 ( 0.898 -3.211 -9.960) 10.503 14.373 ( 1.709 -2.556 -0.880) 3.198 15.307 ( 3.571 -4.010 6.068) 8.103 15.329 ( 4.286 -2.237 0.449) 4.856 15.591 ( -0.346 -1.273 -1.319) 1.865 15.726 ( -0.884 -3.564 9.926) 10.583 16.046 ( 7.799 -10.096 -0.061) 12.757 16.539 ( 37.098 -18.144 52.280) 66.623 18.258 ( -23.231 -21.861 1.385) 31.930 18.882 ( -2.237 -1.567 4.219) 5.025 22.407 ( 4.574 1.750 -22.936) 23.453 22.467 ( 7.363 0.538 -11.672) 13.811 24.319 ( 8.069 7.874 6.386) 12.957 24.760 ( -6.716 2.160 8.219) 10.832 25.287 ( -40.375 -4.250 -30.432) 50.737 27.289 ( 6.089 0.778 -3.921) 7.284 29.264 ( 0.329 -3.517 5.281) 6.353 29.504 ( 9.582 -0.068 -2.864) 10.001 29.792 ( -4.732 0.226 3.888) 6.128 30.029 ( -9.932 -0.631 -8.823) 13.300 30.134 ( -7.612 -0.002 9.334) 12.045 30.761 ( -7.218 -23.837 28.004) 37.477 31.191 ( -3.155 -0.194 1.827) 3.651 33.054 ( 40.750 30.153 -5.322) 50.972 ======================= Grid point 76 (30/186) ======================= q-point: ( 0.12 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.481 ( 30.528 0.000 22.421) 37.877 1.765 ( 22.771 0.000 32.289) 39.510 2.542 ( 17.877 0.000 41.293) 44.996 3.008 ( 5.209 0.000 -3.998) 6.567 3.154 ( -16.081 -0.000 33.437) 37.103 3.717 ( -14.215 -0.000 6.103) 15.470 3.784 ( -5.448 -0.000 17.293) 18.131 4.099 ( -4.344 -0.000 10.937) 11.768 4.363 ( 3.803 0.000 0.475) 3.832 4.869 ( -2.731 -0.000 2.679) 3.826 5.018 ( 2.822 0.000 -0.089) 2.824 5.735 ( -17.399 -0.000 -9.569) 19.857 6.110 ( 5.117 0.000 6.864) 8.561 6.654 ( 5.521 0.000 2.701) 6.147 6.912 ( 6.663 0.000 0.243) 6.668 7.408 ( 9.866 0.000 -0.786) 9.897 8.131 ( 6.112 0.000 -6.361) 8.822 8.222 ( 1.512 0.000 -12.001) 12.096 8.489 ( -9.585 -0.000 -3.216) 10.110 8.559 ( -0.009 -0.000 -6.417) 6.417 8.634 ( 8.530 0.000 -3.771) 9.327 9.076 ( -2.939 -0.000 -3.647) 4.683 9.358 ( -4.428 -0.000 -2.609) 5.139 9.934 ( -1.186 -0.000 -0.463) 1.274 9.943 ( 2.886 0.000 -15.707) 15.970 10.268 ( 11.337 0.000 -3.884) 11.984 10.336 ( -5.500 -0.000 -4.618) 7.181 11.011 ( 15.074 0.000 0.609) 15.086 11.076 ( -0.596 -0.000 -5.261) 5.295 11.705 ( 0.355 0.000 5.616) 5.628 11.758 ( -1.433 -0.000 4.130) 4.371 12.320 ( -4.693 -0.000 -4.066) 6.209 12.369 ( 4.838 0.000 -2.130) 5.287 13.197 ( 6.509 0.000 9.443) 11.469 13.271 ( -0.849 -0.000 3.656) 3.754 14.059 ( 0.000 0.000 1.107) 1.107 14.170 ( 1.451 0.000 -11.720) 11.810 14.414 ( 1.403 0.000 1.732) 2.229 15.041 ( -45.117 -0.000 46.949) 65.114 15.265 ( -5.814 -0.000 -1.276) 5.952 15.504 ( -22.235 -0.000 11.907) 25.223 15.639 ( -1.061 -0.000 -0.051) 1.063 15.734 ( 2.776 0.000 -2.790) 3.935 16.157 ( 4.365 0.000 -7.168) 8.393 18.005 ( 5.255 0.000 -9.928) 11.233 19.032 ( 3.521 0.000 5.012) 6.125 22.227 ( 4.600 0.000 -17.767) 18.352 22.572 ( 8.464 0.000 -15.733) 17.866 24.353 ( -3.526 -0.000 7.888) 8.641 24.874 ( 4.684 0.000 13.107) 13.918 26.851 ( -7.081 -0.000 -23.873) 24.901 27.255 ( 38.666 0.000 -32.781) 50.692 29.110 ( -9.754 -0.000 0.656) 9.776 29.400 ( -5.349 -0.000 0.488) 5.372 29.639 ( -5.767 -0.000 -1.916) 6.077 29.775 ( 1.437 0.000 3.683) 3.953 30.428 ( -10.787 -0.000 26.968) 29.045 31.104 ( -3.913 -0.000 8.624) 9.470 31.317 ( 8.767 0.000 -0.037) 8.767 32.132 ( -13.935 -0.000 10.844) 17.657 ======================= Grid point 77 (31/186) ======================= q-point: ( 0.25 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.884 ( 28.165 8.367 19.530) 35.280 2.175 ( 4.924 -8.160 28.247) 29.811 2.878 ( 4.188 -3.103 13.291) 14.276 3.050 ( 5.748 2.645 1.064) 6.416 3.247 ( -1.391 -2.511 35.663) 35.778 3.614 ( -11.178 -6.961 9.163) 16.042 3.797 ( -5.174 0.291 18.400) 19.115 4.094 ( -2.315 0.006 4.394) 4.966 4.489 ( 2.383 -12.623 -2.407) 13.070 4.914 ( 2.812 5.184 12.155) 13.510 5.041 ( 3.442 -1.587 6.946) 7.913 5.510 ( -17.763 -7.001 -3.580) 19.426 6.103 ( 5.302 11.044 -0.316) 12.255 6.744 ( 2.524 3.946 -2.039) 5.109 6.893 ( 7.014 5.097 1.656) 8.827 7.619 ( 6.775 -8.583 -1.547) 11.043 8.080 ( -0.516 4.824 -10.830) 11.867 8.226 ( 2.531 1.427 -4.859) 5.662 8.336 ( -5.376 -1.767 -6.521) 8.634 8.614 ( 1.290 -9.106 -6.310) 11.153 8.767 ( 10.274 -0.169 3.152) 10.748 8.997 ( -3.354 2.034 -4.944) 6.311 9.335 ( -1.891 -4.354 0.484) 4.771 9.788 ( -8.080 2.028 -8.896) 12.187 9.951 ( -3.369 -5.519 -2.437) 6.910 10.171 ( 0.403 8.116 -8.078) 11.458 10.404 ( 7.751 5.445 -1.255) 9.555 10.971 ( 4.919 8.634 4.940) 11.097 11.177 ( 2.374 0.942 -4.720) 5.367 11.621 ( 0.606 7.142 1.598) 7.344 11.853 ( -3.926 -8.136 0.668) 9.059 12.288 ( -2.195 -2.931 -3.033) 4.755 12.417 ( 5.948 -0.462 -1.467) 6.144 13.252 ( -1.563 -0.555 -0.611) 1.767 13.382 ( 6.937 -3.538 11.381) 13.790 14.056 ( -1.657 -0.940 -1.602) 2.489 14.100 ( -0.315 3.585 -10.274) 10.886 14.417 ( -2.536 3.247 8.207) 9.183 14.792 ( -27.232 -7.759 31.556) 42.398 15.198 ( -3.591 -0.270 -1.059) 3.754 15.300 ( -7.927 6.396 6.371) 12.014 15.634 ( -0.836 0.178 -0.541) 1.012 15.820 ( -0.922 -7.660 -0.062) 7.716 16.174 ( 3.281 0.239 -6.819) 7.571 17.988 ( 5.199 4.627 -7.832) 10.478 19.080 ( 1.591 1.183 4.458) 4.879 22.223 ( 5.619 -1.068 -14.785) 15.852 22.599 ( 7.905 0.357 -16.033) 17.879 24.351 ( -2.427 -0.412 5.655) 6.167 24.997 ( 3.252 -0.201 14.053) 14.426 26.582 ( -19.638 -3.354 -19.630) 27.969 27.391 ( 31.748 20.502 -23.414) 44.458 28.968 ( -9.314 1.996 0.405) 9.534 29.370 ( -3.210 -2.239 1.126) 4.073 29.611 ( -6.317 -7.647 -3.128) 10.400 29.808 ( -0.273 -0.709 5.405) 5.458 30.370 ( -17.441 0.152 29.515) 34.283 31.072 ( 1.340 6.785 10.324) 12.426 31.299 ( 6.971 10.494 0.642) 12.615 32.310 ( 1.074 -21.259 -4.356) 21.727 ======================= Grid point 78 (32/186) ======================= q-point: ( 0.38 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.183 ( 25.457 9.944 13.763) 30.600 2.343 ( -13.188 -6.858 24.434) 28.600 2.841 ( 0.138 10.146 -5.812) 11.693 3.217 ( 10.673 -2.524 14.045) 17.820 3.317 ( -5.212 3.429 24.547) 25.327 3.608 ( -12.232 -4.346 10.055) 16.420 3.888 ( 1.381 -0.371 7.085) 7.228 4.082 ( -5.334 -3.892 7.392) 9.911 4.701 ( -0.541 -13.913 -0.996) 13.959 4.861 ( -3.878 2.680 15.244) 15.956 5.296 ( 5.712 -9.255 18.415) 21.386 5.418 ( -9.141 -5.117 1.641) 10.604 6.009 ( 7.637 12.121 -3.284) 14.698 6.609 ( 4.784 14.065 -7.313) 16.559 6.948 ( -1.334 -1.619 3.508) 4.087 7.696 ( 1.329 2.617 -2.104) 3.612 7.979 ( -1.465 -0.390 -11.121) 11.223 8.139 ( -2.350 2.608 -0.393) 3.532 8.401 ( 6.906 -4.331 -7.663) 11.187 8.758 ( 2.939 -11.099 -5.659) 12.800 8.870 ( 7.219 3.191 -0.259) 7.897 8.927 ( -3.504 -1.857 -2.554) 4.717 9.436 ( 1.422 -7.956 3.513) 8.813 9.647 ( -8.192 -3.007 -6.892) 11.120 9.975 ( -6.046 -3.885 -4.414) 8.434 10.028 ( -0.121 3.016 -5.055) 5.887 10.351 ( 4.714 11.816 1.372) 12.796 10.992 ( 9.245 6.899 8.085) 14.087 11.063 ( -2.664 10.696 -0.454) 11.032 11.558 ( 0.812 5.223 0.652) 5.325 11.862 ( -6.719 -6.438 -7.285) 11.818 12.303 ( 2.203 -0.231 -0.212) 2.225 12.545 ( 7.403 -4.720 3.038) 9.290 13.219 ( -4.096 -2.591 -6.756) 8.315 13.568 ( 6.740 -3.061 8.728) 11.445 13.951 ( -4.309 5.346 -5.591) 8.855 14.058 ( -1.469 -1.692 -1.690) 2.807 14.352 ( -5.092 3.130 6.429) 8.778 14.827 ( -6.380 -9.821 12.971) 17.476 15.172 ( -7.465 3.689 9.967) 12.988 15.182 ( 0.532 -0.437 0.479) 0.839 15.604 ( -2.765 0.109 -1.205) 3.018 15.898 ( -2.627 -5.815 3.302) 7.185 16.169 ( 2.249 0.226 -7.852) 8.171 17.963 ( 6.528 4.979 -4.703) 9.461 19.080 ( -0.828 2.333 3.365) 4.177 22.256 ( 6.506 -1.752 -12.283) 14.009 22.607 ( 6.699 1.003 -16.121) 17.486 24.354 ( -0.562 0.621 3.920) 4.009 25.077 ( -0.206 1.261 13.056) 13.118 26.269 ( -24.113 -5.292 -19.391) 31.392 27.393 ( 26.992 19.153 -13.483) 35.738 28.852 ( -6.186 0.340 1.545) 6.386 29.377 ( -2.498 -2.979 1.550) 4.185 29.631 ( -6.126 -8.376 -2.711) 10.725 29.844 ( -1.109 -1.680 6.627) 6.926 30.292 ( -16.653 -1.989 24.632) 29.800 31.032 ( 6.889 14.376 8.476) 18.055 31.265 ( -1.033 0.946 1.911) 2.369 32.576 ( 8.089 -13.833 -9.915) 18.844 ======================= Grid point 79 (33/186) ======================= q-point: (-0.50 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.235 ( 3.455 24.265 9.714) 26.365 2.342 ( -4.503 4.383 18.487) 19.525 2.752 ( 6.311 -1.484 -4.076) 7.658 3.234 ( 2.513 6.783 1.599) 7.408 3.428 ( -6.205 1.942 15.231) 16.561 3.607 ( -4.842 -7.087 14.505) 16.854 3.798 ( -4.094 8.754 7.461) 12.209 4.156 ( -6.938 -7.541 13.979) 17.332 4.765 ( -15.523 -6.966 17.395) 24.333 4.929 ( 1.516 -2.298 2.808) 3.932 5.304 ( -13.569 -6.310 0.345) 14.968 5.607 ( 9.139 -0.950 17.512) 19.777 5.924 ( 5.448 11.401 -1.153) 12.688 6.438 ( 2.113 12.047 -10.302) 15.991 6.977 ( -0.124 -3.393 6.360) 7.210 7.679 ( 5.960 1.878 -2.719) 6.815 7.909 ( 0.236 2.651 -11.809) 12.105 8.140 ( -0.330 -4.600 3.234) 5.633 8.492 ( 9.276 1.413 -8.903) 12.935 8.835 ( 0.020 -2.517 -8.838) 9.189 8.901 ( 1.393 2.373 0.037) 2.752 8.993 ( 2.494 -12.457 -2.448) 12.938 9.525 ( -6.072 -5.246 -1.229) 8.118 9.599 ( -6.094 -5.626 -5.129) 9.752 9.839 ( -7.440 0.464 0.816) 7.499 10.090 ( 6.216 -0.267 -1.539) 6.409 10.272 ( -0.085 3.603 5.308) 6.416 10.870 ( -3.733 10.286 0.782) 10.970 11.073 ( 13.397 8.409 7.530) 17.518 11.493 ( 0.058 5.261 1.018) 5.359 11.825 ( -5.942 -7.212 -10.295) 13.904 12.336 ( 5.225 3.669 2.092) 6.719 12.739 ( 7.712 -5.741 5.102) 10.884 13.158 ( -4.812 -2.938 -10.059) 11.531 13.682 ( 1.151 1.741 2.256) 3.074 13.839 ( -0.055 -1.158 -3.466) 3.655 14.053 ( -2.615 -1.137 0.588) 2.911 14.276 ( -2.339 2.915 0.953) 3.857 14.965 ( 2.753 -6.068 4.254) 7.905 15.096 ( -7.461 0.260 11.924) 14.068 15.242 ( 3.617 -2.050 5.572) 6.953 15.556 ( -3.857 -0.904 -2.570) 4.723 15.940 ( -3.536 -2.425 6.731) 7.981 16.159 ( 0.945 -1.743 -8.683) 8.907 17.981 ( 7.393 3.303 -1.370) 8.212 19.030 ( -3.024 2.988 2.358) 4.861 22.314 ( 6.944 -2.052 -11.291) 13.413 22.588 ( 5.433 1.696 -16.179) 17.150 24.359 ( 1.621 1.988 3.481) 4.324 25.074 ( -4.041 3.558 10.861) 12.122 25.930 ( -26.700 -5.879 -18.699) 33.123 27.433 ( 23.263 14.355 -9.871) 29.063 28.831 ( -1.990 -3.505 3.129) 5.102 29.398 ( -1.481 -2.877 0.564) 3.285 29.656 ( -6.264 -7.576 0.575) 9.848 29.889 ( -1.283 -2.223 7.653) 8.072 30.234 ( -15.253 -3.744 19.311) 24.891 30.926 ( 6.371 17.916 5.722) 19.857 31.252 ( -5.839 -2.955 3.666) 7.501 32.816 ( 14.464 -8.125 -11.281) 20.062 ======================= Grid point 80 (34/186) ======================= q-point: (-0.38 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.883 ( 5.032 35.896 4.395) 36.513 2.153 ( -10.549 19.574 17.898) 28.544 2.961 ( 13.506 -7.585 -4.406) 16.105 3.162 ( -16.230 15.774 0.997) 22.655 3.219 ( 4.058 5.483 4.519) 8.182 3.677 ( -9.175 -5.876 11.097) 15.552 3.780 ( -3.654 1.170 28.729) 28.984 4.191 ( -10.796 -2.673 12.983) 17.095 4.710 ( -16.080 -4.780 18.921) 25.287 4.932 ( -0.637 2.245 -1.674) 2.872 5.242 ( -8.800 -4.119 3.737) 10.410 5.719 ( 1.519 -0.901 -3.226) 3.678 5.903 ( 8.914 7.796 17.816) 21.392 6.215 ( -4.645 9.888 -11.713) 16.016 7.081 ( 0.226 -3.597 6.346) 7.298 7.770 ( 8.733 -1.156 -8.936) 12.549 7.798 ( 2.810 5.728 -8.373) 10.527 8.284 ( 1.485 -9.314 9.030) 13.058 8.490 ( 7.707 7.475 -11.855) 15.994 8.816 ( 0.462 -1.671 -13.223) 13.336 8.892 ( 2.335 0.325 -1.732) 2.925 9.174 ( 0.863 -8.637 1.829) 8.870 9.448 ( -11.170 -4.252 -6.616) 13.661 9.540 ( -4.708 -1.960 -3.834) 6.380 9.838 ( -2.606 -5.947 1.577) 6.682 10.096 ( 1.282 5.450 6.335) 8.455 10.348 ( 1.196 -7.094 3.427) 7.968 10.711 ( -3.356 7.377 3.632) 8.881 11.154 ( 11.297 6.327 0.440) 12.956 11.440 ( 0.602 3.229 0.408) 3.310 11.833 ( -1.460 -6.468 -4.282) 7.893 12.334 ( 5.004 8.101 1.739) 9.679 12.916 ( 4.278 -4.209 4.837) 7.708 13.092 ( -0.345 -0.753 -14.543) 14.567 13.591 ( -4.296 4.655 0.205) 6.338 13.941 ( 4.649 -7.535 -4.547) 9.953 14.015 ( -3.423 0.565 -0.202) 3.475 14.249 ( 0.625 0.477 3.359) 3.449 15.032 ( -2.968 0.114 11.274) 11.659 15.147 ( 4.268 -4.863 0.430) 6.484 15.385 ( 5.071 -5.056 11.157) 13.257 15.516 ( -3.095 -2.749 -4.648) 6.224 15.936 ( -3.900 1.060 7.200) 8.257 16.164 ( -1.077 -4.322 -5.510) 7.086 18.037 ( 5.693 1.551 1.564) 6.104 18.953 ( -4.062 2.729 2.068) 5.312 22.374 ( 6.699 -1.970 -12.539) 14.352 22.548 ( 4.734 2.230 -15.943) 16.780 24.382 ( 4.162 2.691 5.009) 7.046 24.989 ( -6.547 5.222 8.658) 12.045 25.574 ( -26.853 -4.562 -17.056) 32.137 27.474 ( 17.423 11.622 -9.522) 23.007 28.925 ( 1.585 -7.520 4.210) 8.763 29.425 ( 0.771 -2.331 -1.495) 2.875 29.684 ( -7.283 -7.140 4.317) 11.075 29.945 ( -0.827 -2.158 8.922) 9.217 30.183 ( -14.074 -3.706 15.705) 21.412 30.772 ( 2.310 15.915 5.344) 16.946 31.226 ( -6.029 -1.971 3.506) 7.248 33.067 ( 19.051 -5.283 -12.110) 23.184 ======================= Grid point 81 (35/186) ======================= q-point: (-0.25 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.500 ( 12.438 38.283 9.087) 41.266 1.750 ( -9.150 31.156 12.368) 34.747 2.608 ( -15.311 32.903 17.490) 40.286 3.205 ( 3.523 7.084 3.878) 8.811 3.235 ( 3.428 -10.362 0.799) 10.943 3.687 ( -11.941 -4.391 19.278) 23.098 3.867 ( -1.586 -3.758 15.461) 15.990 4.094 ( -15.822 -0.300 18.698) 24.496 4.702 ( -4.791 -2.481 7.219) 9.012 4.873 ( 0.770 3.559 -0.499) 3.676 5.228 ( -5.675 -3.645 4.683) 8.211 5.690 ( -2.616 3.876 -10.139) 11.165 6.014 ( 10.477 6.667 9.692) 15.753 6.060 ( -5.832 -8.558 4.313) 11.218 7.058 ( -5.090 5.639 1.015) 7.664 7.667 ( 3.654 7.463 -10.990) 13.778 7.922 ( 8.407 -3.417 -3.345) 9.671 8.346 ( -1.677 4.975 -2.789) 5.945 8.495 ( 4.462 -2.519 2.080) 5.530 8.755 ( 0.280 0.880 -15.287) 15.315 8.962 ( 9.250 -2.056 -6.051) 11.243 9.213 ( -5.192 -0.413 0.043) 5.209 9.314 ( -8.860 0.394 -7.130) 11.379 9.556 ( -2.693 -8.386 -3.702) 9.554 9.886 ( 0.335 -2.593 -2.641) 3.716 10.121 ( 0.892 -2.966 11.950) 12.344 10.441 ( -2.098 -4.775 -1.370) 5.392 10.626 ( -2.957 2.947 7.341) 8.445 11.186 ( 6.247 3.346 -4.463) 8.375 11.427 ( 0.926 0.139 -0.119) 0.944 11.928 ( 4.646 -4.251 3.481) 7.195 12.250 ( 1.851 11.302 1.093) 11.504 12.950 ( -3.086 1.175 -15.934) 16.273 13.056 ( 6.470 2.269 -0.311) 6.863 13.469 ( -4.839 4.096 -4.333) 7.678 13.985 ( -0.024 0.498 3.422) 3.458 14.080 ( 2.952 -8.602 -7.661) 11.891 14.298 ( 1.424 -1.746 5.913) 6.328 15.086 ( -3.752 -6.416 15.070) 16.804 15.258 ( 4.776 -2.702 -1.304) 5.640 15.485 ( -4.150 -2.435 1.400) 5.012 15.646 ( 10.477 -10.161 3.898) 15.107 15.883 ( -4.993 1.820 3.957) 6.626 16.215 ( -1.890 -7.315 5.921) 9.599 18.062 ( -2.036 1.694 3.102) 4.079 18.889 ( -2.536 1.392 2.679) 3.943 22.406 ( 5.008 -1.264 -16.933) 17.703 22.508 ( 5.590 2.098 -14.080) 15.294 24.445 ( 5.778 2.170 7.265) 9.532 24.867 ( -6.368 5.259 7.534) 11.179 25.236 ( -16.736 0.378 -10.664) 19.848 27.451 ( 9.133 9.711 -10.209) 16.791 29.083 ( 0.556 -8.848 4.053) 9.748 29.480 ( 5.498 -2.051 -2.895) 6.543 29.694 ( -9.245 -5.953 4.593) 11.916 30.012 ( -0.307 -1.458 9.526) 9.642 30.127 ( -10.487 -1.564 14.262) 17.771 30.623 ( -2.559 9.301 9.189) 13.323 31.195 ( -3.479 -0.503 2.562) 4.350 33.311 ( 17.815 -3.912 -15.857) 24.169 ======================= Grid point 82 (36/186) ======================= q-point: (-0.12 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.194 ( -9.835 34.432 9.173) 36.965 1.302 ( 22.588 31.670 20.215) 43.839 2.201 ( 3.125 33.479 47.276) 58.014 3.112 ( -3.277 5.972 0.241) 6.816 3.334 ( -7.630 -2.188 12.038) 14.419 3.678 ( -10.661 -3.306 16.844) 20.207 3.979 ( -0.537 -5.226 5.569) 7.656 4.032 ( -11.219 -2.287 21.511) 24.369 4.670 ( 4.621 10.380 -6.322) 13.003 4.867 ( -3.439 -2.268 1.876) 4.526 5.140 ( -6.242 5.709 -2.390) 8.790 5.603 ( 2.871 -4.392 -2.892) 5.991 6.155 ( -4.444 -4.012 13.606) 14.865 6.223 ( 8.609 -13.522 1.838) 16.135 6.858 ( -4.374 10.839 -3.087) 12.089 7.565 ( 5.269 10.876 -4.370) 12.851 8.021 ( 4.808 -1.211 -4.084) 6.424 8.249 ( 1.041 3.339 -8.143) 8.863 8.558 ( -2.752 -3.302 2.933) 5.204 8.675 ( 2.212 2.496 -12.859) 13.285 8.996 ( -2.387 10.206 -16.937) 19.918 9.161 ( 5.940 -4.593 -1.594) 7.676 9.194 ( 0.384 1.660 -1.051) 2.002 9.591 ( -3.383 -5.132 -4.794) 7.795 9.910 ( 1.341 -1.696 -2.623) 3.400 10.310 ( 5.430 -7.333 13.167) 16.019 10.396 ( -7.567 -1.071 -4.495) 8.867 10.604 ( -3.035 0.376 6.390) 7.084 11.197 ( 4.867 2.282 -4.812) 7.214 11.462 ( 0.867 -3.513 1.115) 3.786 12.046 ( 4.526 7.097 -1.564) 8.561 12.131 ( 2.538 3.133 9.561) 10.377 12.733 ( -2.763 9.131 -22.609) 24.539 13.119 ( 1.499 -0.234 4.790) 5.025 13.323 ( -1.939 5.707 -4.579) 7.569 14.014 ( 1.169 0.176 4.837) 4.979 14.164 ( 1.734 -5.269 -9.755) 11.222 14.362 ( 0.745 -1.784 2.486) 3.149 15.247 ( -6.174 -13.510 15.500) 21.468 15.331 ( 1.635 -2.069 0.408) 2.668 15.457 ( -6.565 -3.039 0.953) 7.296 15.759 ( -3.861 4.587 3.219) 6.805 15.940 ( 0.931 -12.770 -5.270) 13.846 16.420 ( -11.584 -20.123 22.074) 32.037 17.938 ( -9.213 5.281 2.291) 10.864 18.889 ( 1.402 -0.121 3.887) 4.134 22.362 ( 2.414 0.896 -20.518) 20.679 22.510 ( 7.460 0.651 -13.604) 15.529 24.455 ( -4.400 4.180 5.002) 7.864 24.780 ( -2.749 3.956 8.303) 9.599 25.294 ( 35.725 -5.929 6.374) 36.770 27.343 ( -0.496 6.677 -10.835) 12.737 29.183 ( -4.634 -6.829 2.665) 8.673 29.591 ( 5.947 -1.795 -0.168) 6.214 29.642 ( -8.260 -2.857 -0.632) 8.763 29.974 ( -6.371 5.918 5.734) 10.416 30.194 ( 5.297 -3.213 12.678) 14.110 30.589 ( -7.464 -5.576 21.292) 23.241 31.181 ( -0.285 0.423 1.757) 1.830 33.363 ( -1.937 4.197 -24.917) 25.342 ======================= Grid point 85 (37/186) ======================= q-point: ( 0.25 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.204 ( -13.231 -0.000 30.470) 33.218 2.345 ( 20.497 0.000 15.050) 25.429 3.104 ( 14.473 0.000 25.766) 29.552 3.166 ( 9.647 0.000 -3.660) 10.318 3.398 ( 3.518 0.000 22.091) 22.369 3.427 ( -13.682 -0.000 9.396) 16.598 3.826 ( -6.421 -0.000 23.807) 24.658 4.100 ( 0.741 0.000 0.671) 0.999 4.403 ( 3.560 0.000 -8.213) 8.951 5.056 ( -13.908 -0.000 14.379) 20.005 5.078 ( 1.643 0.000 1.930) 2.535 5.294 ( 5.389 0.000 11.288) 12.509 6.216 ( 2.752 0.000 -5.056) 5.756 6.784 ( 1.885 0.000 2.871) 3.434 7.010 ( 1.365 0.000 -3.558) 3.811 7.660 ( 10.956 0.000 -2.909) 11.336 7.997 ( -8.547 -0.000 -12.206) 14.901 8.238 ( -6.000 -0.000 -4.459) 7.476 8.273 ( 10.100 0.000 -8.242) 13.036 8.552 ( 3.439 0.000 -2.175) 4.069 8.908 ( -0.137 -0.000 3.013) 3.016 8.989 ( 8.928 0.000 -3.047) 9.434 9.286 ( -1.701 -0.000 5.944) 6.183 9.633 ( -10.891 -0.000 -8.772) 13.984 9.846 ( -4.672 -0.000 -1.440) 4.889 10.054 ( -11.124 -0.000 -7.082) 13.187 10.664 ( 16.788 0.000 -5.601) 17.697 10.994 ( -0.871 -0.000 -6.519) 6.577 11.293 ( 6.344 0.000 6.774) 9.281 11.661 ( -3.034 -0.000 -7.377) 7.977 11.748 ( -1.796 -0.000 0.407) 1.842 12.262 ( 0.987 0.000 4.663) 4.767 12.484 ( 6.600 0.000 -1.147) 6.699 13.170 ( -7.270 -0.000 -3.832) 8.218 13.531 ( 7.888 0.000 15.343) 17.252 14.012 ( -1.895 -0.000 -3.975) 4.404 14.064 ( -2.542 -0.000 -8.689) 9.053 14.484 ( 0.409 0.000 4.980) 4.996 14.528 ( -21.222 -0.000 27.910) 35.062 15.172 ( 0.210 0.000 0.332) 0.393 15.273 ( -8.752 -0.000 8.673) 12.321 15.611 ( -2.939 -0.000 -0.177) 2.944 15.764 ( 1.934 0.000 -4.221) 4.643 16.189 ( 2.455 0.000 -5.180) 5.732 18.056 ( 6.760 0.000 -8.187) 10.618 19.115 ( -0.908 -0.000 4.472) 4.563 22.229 ( 6.513 0.000 -12.330) 13.945 22.621 ( 7.115 0.000 -16.340) 17.822 24.361 ( 0.294 0.000 4.646) 4.655 25.094 ( 0.906 0.000 14.272) 14.301 26.199 ( -22.303 -0.000 -17.988) 28.653 27.744 ( 22.381 0.000 -25.730) 34.102 28.852 ( -9.817 -0.000 0.069) 9.817 29.327 ( -1.707 -0.000 0.383) 1.750 29.455 ( -6.808 -0.000 -0.804) 6.855 29.828 ( -0.840 -0.000 7.230) 7.278 30.276 ( -19.198 -0.000 30.502) 36.041 31.089 ( -3.864 -0.000 8.561) 9.393 31.549 ( 9.625 0.000 -2.130) 9.858 32.229 ( 11.779 0.000 -3.539) 12.299 ======================= Grid point 86 (38/186) ======================= q-point: ( 0.38 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.174 ( -18.984 -4.776 34.116) 39.333 2.606 ( 13.833 0.756 9.830) 16.987 3.115 ( 9.312 19.276 0.033) 21.407 3.329 ( -9.309 -1.656 10.644) 14.238 3.440 ( 10.778 -0.763 26.593) 28.704 3.514 ( -0.570 0.854 8.059) 8.125 3.907 ( -4.712 -5.744 22.323) 23.527 4.062 ( 1.611 6.194 -5.777) 8.621 4.503 ( 0.471 -10.455 -6.216) 12.172 4.850 ( -15.175 -1.964 13.140) 20.170 5.136 ( -2.909 -2.767 4.193) 5.805 5.562 ( 13.574 -2.375 17.867) 22.564 6.175 ( 1.733 5.599 -3.396) 6.774 6.785 ( 1.755 5.197 -1.942) 5.819 6.939 ( -1.785 3.978 -1.884) 4.750 7.752 ( 3.795 3.072 -4.593) 6.704 7.892 ( 0.932 -4.178 -9.347) 10.281 8.124 ( -4.452 2.432 -2.398) 5.611 8.401 ( 9.697 -4.931 -7.700) 13.328 8.658 ( 5.532 -6.857 -2.375) 9.125 8.846 ( -3.290 -0.108 -7.579) 8.263 9.057 ( 5.683 7.700 3.972) 10.361 9.365 ( -1.961 -6.685 9.271) 11.597 9.461 ( -9.737 -0.635 -7.225) 12.142 9.839 ( -1.645 -4.534 -3.775) 6.125 9.898 ( -10.321 -4.139 -1.188) 11.183 10.665 ( 8.255 16.411 -5.043) 19.050 11.005 ( 1.605 -1.933 -8.020) 8.404 11.354 ( 7.160 7.581 9.437) 14.064 11.573 ( -1.700 0.165 -5.699) 5.950 11.719 ( -3.645 0.053 -4.115) 5.498 12.346 ( 5.247 -1.617 6.737) 8.691 12.589 ( 6.601 -3.158 1.386) 7.448 13.056 ( -9.329 -3.311 -7.347) 12.327 13.685 ( 5.742 0.762 11.655) 13.015 13.930 ( -5.479 4.089 -2.528) 7.289 14.006 ( -1.241 -2.045 -3.732) 4.433 14.374 ( -4.575 4.589 6.863) 9.439 14.632 ( -4.829 -13.283 10.025) 17.328 15.183 ( -6.603 3.256 9.205) 11.787 15.206 ( 2.325 -0.498 2.536) 3.477 15.557 ( -4.578 0.473 -0.620) 4.644 15.798 ( -0.149 -4.471 -1.686) 4.781 16.181 ( 1.665 1.163 -5.420) 5.788 18.096 ( 8.889 3.184 -6.734) 11.597 19.098 ( -3.448 1.484 4.185) 5.622 22.267 ( 6.667 -1.042 -10.629) 12.590 22.622 ( 5.996 0.658 -16.566) 17.631 24.396 ( 2.330 0.669 4.110) 4.772 25.142 ( -2.488 1.255 12.603) 12.907 25.846 ( -21.431 -1.078 -16.133) 26.847 27.805 ( 18.388 10.123 -19.722) 28.802 28.754 ( -7.411 -2.187 0.670) 7.756 29.322 ( -1.509 -1.755 0.423) 2.352 29.425 ( -5.757 -6.695 -0.626) 8.852 29.856 ( -1.279 -0.441 9.503) 9.598 30.185 ( -16.597 -0.471 26.311) 31.112 31.099 ( -4.029 -2.563 8.139) 9.437 31.515 ( 8.517 17.103 -2.180) 19.230 32.475 ( 11.979 -13.465 -7.693) 19.596 ======================= Grid point 87 (39/186) ======================= q-point: (-0.50 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.192 ( -16.531 -5.964 36.357) 40.382 2.794 ( 8.607 -3.692 -0.277) 9.369 2.895 ( 9.065 29.296 3.576) 30.874 3.294 ( -8.820 -1.626 9.483) 13.053 3.471 ( -0.871 5.966 4.489) 7.517 3.638 ( 8.531 5.758 9.465) 13.983 3.940 ( -2.021 8.211 14.601) 16.873 4.031 ( -5.822 -7.200 11.712) 14.930 4.525 ( -14.953 -6.410 11.847) 20.125 4.883 ( -5.487 -10.404 2.663) 12.060 5.127 ( -3.140 1.782 6.607) 7.530 5.761 ( 5.081 1.787 4.296) 6.889 6.104 ( 0.184 5.645 6.935) 8.944 6.654 ( 5.963 16.169 -7.412) 18.760 6.929 ( -2.186 -5.197 4.839) 7.430 7.743 ( 4.789 -0.892 -6.789) 8.356 7.927 ( 5.082 1.798 -9.828) 11.209 8.077 ( -2.024 -3.341 1.163) 4.075 8.558 ( 9.598 -4.103 -7.961) 13.128 8.759 ( -0.447 -0.784 -8.120) 8.170 8.858 ( 4.982 -9.279 -2.083) 10.736 8.997 ( 0.280 6.674 0.279) 6.685 9.340 ( -8.155 -2.623 -5.121) 9.981 9.434 ( -6.823 -6.584 4.949) 10.695 9.754 ( -7.262 -0.002 2.569) 7.703 10.030 ( 2.720 -12.260 1.138) 12.609 10.480 ( 2.480 16.944 -0.310) 17.127 10.933 ( -0.739 7.005 -6.288) 9.442 11.354 ( 4.246 5.862 -3.284) 7.948 11.587 ( 3.099 4.665 1.765) 5.872 11.648 ( -1.831 -3.628 0.637) 4.114 12.468 ( 7.408 1.451 5.028) 9.070 12.745 ( 4.695 -6.975 1.829) 8.605 12.968 ( -7.531 -6.198 -9.082) 13.328 13.742 ( -0.301 4.259 1.198) 4.435 13.810 ( -0.921 0.822 -0.675) 1.407 14.022 ( -0.971 -1.734 1.549) 2.520 14.307 ( -0.212 3.451 0.687) 3.525 14.832 ( -1.559 -15.767 6.253) 17.033 15.101 ( -6.182 3.283 11.114) 13.135 15.275 ( 2.853 -1.995 2.172) 4.103 15.486 ( -4.514 0.201 -1.273) 4.695 15.853 ( -2.436 -5.050 3.449) 6.583 16.152 ( 1.649 1.789 -6.444) 6.888 18.138 ( 9.861 4.222 -4.749) 11.731 19.032 ( -5.166 2.568 3.878) 6.951 22.319 ( 6.102 -1.731 -10.519) 12.283 22.600 ( 5.210 1.370 -16.616) 17.467 24.438 ( 3.388 1.459 4.647) 5.933 25.112 ( -5.426 3.319 9.821) 11.700 25.530 ( -17.668 0.339 -13.042) 21.963 27.794 ( 15.634 10.674 -15.615) 24.540 28.740 ( -3.901 -5.656 1.737) 7.087 29.340 ( -0.701 -3.098 -0.483) 3.213 29.462 ( -4.899 -8.041 0.600) 9.435 29.900 ( -1.551 -1.049 12.217) 12.359 30.118 ( -13.740 -1.149 21.798) 25.793 31.123 ( -4.023 -2.931 7.218) 8.768 31.326 ( 4.850 20.721 -1.904) 21.366 32.777 ( 11.721 -14.289 -10.655) 21.333 ======================= Grid point 88 (40/186) ======================= q-point: (-0.38 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.221 ( -9.332 4.147 34.123) 35.618 2.568 ( 3.901 31.393 6.283) 32.252 2.971 ( 9.112 -5.990 -6.708) 12.803 3.157 ( -5.806 11.642 -5.226) 14.020 3.401 ( -8.510 -2.080 6.895) 11.149 3.635 ( 9.897 11.456 4.039) 15.669 3.929 ( -5.045 4.552 31.802) 32.520 4.067 ( -10.510 -2.131 10.481) 14.995 4.484 ( -16.075 -8.625 20.141) 27.174 4.951 ( -1.908 -4.693 0.613) 5.103 5.086 ( -4.229 -0.526 5.708) 7.123 5.690 ( -3.426 3.447 -8.434) 9.734 6.098 ( -0.985 5.233 10.819) 12.059 6.471 ( 9.000 19.917 1.760) 21.926 7.018 ( -2.666 -6.725 3.608) 8.084 7.798 ( 4.402 -0.200 -13.062) 13.785 7.880 ( 4.535 2.445 -7.295) 8.931 8.202 ( 2.191 -10.594 4.060) 11.555 8.618 ( 4.763 6.061 -7.900) 11.038 8.731 ( 2.431 -3.089 -14.638) 15.157 8.923 ( 0.987 1.531 -0.663) 1.939 9.070 ( 4.034 -9.182 3.390) 10.587 9.270 ( -5.522 -2.293 -3.182) 6.774 9.427 ( -5.445 -3.405 -0.468) 6.439 9.741 ( -2.584 -5.118 3.852) 6.907 10.209 ( 1.234 -5.330 2.012) 5.829 10.298 ( -1.564 8.526 4.059) 9.572 10.777 ( -2.580 8.010 -3.962) 9.301 11.297 ( 1.264 3.759 -5.051) 6.422 11.505 ( -0.426 4.363 -2.906) 5.259 11.787 ( 5.522 -4.395 8.210) 10.826 12.499 ( 3.039 6.534 1.595) 7.381 12.850 ( -2.747 -5.658 -3.479) 7.187 13.005 ( 3.680 -8.028 -6.315) 10.857 13.616 ( -3.180 6.752 -1.757) 7.667 13.863 ( 3.160 -4.757 -4.677) 7.382 14.024 ( -1.125 0.619 3.436) 3.668 14.292 ( 1.914 1.402 2.603) 3.522 15.038 ( -5.420 0.457 9.089) 10.592 15.074 ( 1.328 -13.798 3.718) 14.352 15.345 ( -0.567 -5.388 1.360) 5.586 15.440 ( -2.460 -0.892 -0.542) 2.672 15.897 ( -4.172 -2.838 8.080) 9.526 16.125 ( 2.498 0.817 -5.945) 6.500 18.171 ( 6.828 4.884 -2.990) 8.912 18.947 ( -4.669 2.562 3.721) 6.496 22.361 ( 4.842 -1.776 -12.387) 13.418 22.565 ( 5.279 1.830 -16.166) 17.104 24.487 ( 2.841 1.219 6.260) 6.982 25.017 ( -6.150 5.027 7.358) 10.827 25.283 ( -8.292 2.732 -7.881) 11.762 27.746 ( 10.069 10.605 -14.763) 20.780 28.823 ( -1.378 -9.268 2.331) 9.655 29.391 ( 2.376 -4.045 -2.173) 5.170 29.514 ( -4.802 -6.859 3.241) 8.978 29.963 ( -1.659 -1.652 15.223) 15.401 30.074 ( -11.068 -1.595 18.398) 21.529 31.068 ( 1.122 20.715 -0.475) 20.751 31.145 ( -3.541 -2.812 5.157) 6.858 33.052 ( 9.714 -13.524 -13.395) 21.371 ======================= Grid point 89 (41/186) ======================= q-point: (-0.25 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.132 ( -1.107 25.191 15.490) 29.593 2.168 ( 0.206 31.053 17.229) 35.513 2.880 ( -1.173 14.488 1.314) 14.594 3.103 ( 1.299 -5.667 -6.003) 8.357 3.361 ( -11.682 -3.355 11.229) 16.547 3.647 ( 8.681 8.875 8.208) 14.883 3.950 ( -17.709 -3.168 19.941) 26.857 3.976 ( 1.023 6.049 22.509) 23.330 4.555 ( -9.432 -10.392 17.459) 22.400 4.949 ( 2.450 3.872 -1.542) 4.834 5.129 ( -2.581 -6.180 6.351) 9.230 5.592 ( -4.789 -2.495 -10.038) 11.398 5.977 ( -2.787 7.978 0.380) 8.459 6.404 ( 8.214 14.028 16.166) 22.926 7.027 ( -4.754 -0.480 -2.004) 5.181 7.721 ( 1.950 2.552 -13.311) 13.693 7.960 ( 5.712 -3.613 -2.947) 7.373 8.326 ( -5.404 -2.293 6.976) 9.117 8.507 ( 1.635 3.241 -17.042) 17.424 8.749 ( 6.483 -0.153 -9.150) 11.215 9.001 ( 7.347 -4.628 -2.522) 9.042 9.110 ( -5.725 2.417 -2.022) 6.535 9.270 ( 0.926 -1.071 -1.020) 1.745 9.447 ( 1.839 -4.338 -1.326) 4.895 9.823 ( 0.655 -5.620 -1.220) 5.788 10.172 ( -1.265 2.557 11.536) 11.884 10.324 ( -3.180 -5.283 -1.736) 6.406 10.635 ( -4.502 3.429 -2.004) 6.003 11.249 ( 0.300 2.301 -0.988) 2.522 11.447 ( -0.477 2.014 -1.313) 2.451 11.960 ( 5.821 -5.462 5.616) 9.760 12.400 ( -1.826 9.011 1.521) 9.319 12.819 ( -4.597 -1.904 -13.838) 14.705 13.128 ( 6.255 -2.696 -3.082) 7.476 13.480 ( -1.526 6.990 -2.082) 7.451 13.954 ( 2.585 -6.270 -5.950) 9.022 14.039 ( 0.801 -0.650 4.558) 4.674 14.327 ( 1.185 -0.319 4.943) 5.093 15.001 ( -7.926 -2.707 9.210) 12.448 15.261 ( 3.103 -4.999 -0.248) 5.889 15.420 ( -5.138 -2.140 2.200) 5.984 15.487 ( 0.906 -15.803 -0.666) 15.843 15.875 ( -4.778 2.290 4.760) 7.123 16.167 ( 3.094 -3.282 2.136) 4.990 18.116 ( -1.689 7.042 -1.781) 7.458 18.901 ( -0.704 1.087 3.535) 3.764 22.363 ( 3.138 -0.682 -15.638) 15.964 22.540 ( 6.351 1.417 -15.148) 16.487 24.513 ( -2.542 0.992 6.568) 7.113 24.913 ( -3.684 5.183 7.080) 9.517 25.247 ( 14.071 1.214 0.415) 14.129 27.603 ( 1.702 10.933 -15.341) 18.915 28.945 ( -2.968 -9.705 1.849) 10.316 29.498 ( 6.040 -5.265 -3.916) 8.919 29.549 ( -4.401 -3.703 5.454) 7.926 30.022 ( -7.484 -0.845 18.222) 19.717 30.087 ( -1.183 -3.350 15.305) 15.712 30.799 ( -3.067 16.312 1.822) 16.697 31.169 ( -0.589 -1.466 3.979) 4.281 33.235 ( 2.377 -10.660 -17.312) 20.469 ======================= Grid point 90 (42/186) ======================= q-point: (-0.12 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( -6.042 32.605 6.647) 33.820 2.056 ( 15.109 25.695 24.790) 38.769 2.805 ( 8.741 11.865 18.457) 23.619 3.069 ( -5.841 0.888 -5.362) 7.979 3.294 ( -14.954 -0.163 21.488) 26.180 3.677 ( 3.429 5.239 11.765) 13.327 3.892 ( -10.609 -3.471 12.451) 16.723 4.043 ( 0.513 1.609 17.788) 17.868 4.664 ( -3.376 -7.549 9.224) 12.389 4.894 ( -0.029 6.928 -1.763) 7.148 5.169 ( -2.149 4.808 4.237) 6.759 5.531 ( 1.120 -4.759 -4.375) 6.560 5.952 ( -3.634 -7.141 -0.475) 8.027 6.400 ( 2.409 5.604 12.947) 14.312 6.931 ( 0.227 5.881 -3.996) 7.114 7.684 ( 2.833 1.092 -6.686) 7.344 8.052 ( 3.905 -2.029 -3.262) 5.478 8.235 ( -5.095 3.304 0.601) 6.102 8.446 ( -0.606 -3.477 -14.279) 14.709 8.768 ( 5.636 6.769 -3.605) 9.517 8.951 ( -6.342 2.563 -6.205) 9.235 9.152 ( -1.159 0.695 -0.505) 1.443 9.286 ( 14.943 -2.123 -9.454) 17.810 9.518 ( 2.977 -2.222 -1.508) 4.009 9.873 ( 0.687 -2.853 -4.775) 5.605 10.277 ( -5.341 0.137 -3.618) 6.453 10.316 ( 1.839 -9.135 16.652) 19.082 10.552 ( -6.048 -1.432 0.549) 6.240 11.232 ( -0.702 0.070 0.438) 0.830 11.430 ( -0.297 -1.710 -0.818) 1.919 12.134 ( 6.590 -4.584 1.761) 8.219 12.241 ( -4.073 9.320 3.337) 10.705 12.656 ( -5.888 3.500 -17.673) 18.954 13.201 ( 5.937 2.162 -0.964) 6.391 13.384 ( 1.509 5.739 0.403) 5.948 14.032 ( 1.457 -4.758 -4.261) 6.551 14.082 ( 0.373 -1.504 1.169) 1.941 14.364 ( -0.594 -0.830 4.981) 5.084 15.010 ( -10.953 -9.042 10.628) 17.739 15.311 ( -1.654 -1.502 -0.003) 2.234 15.372 ( -8.111 -0.635 5.938) 10.073 15.685 ( -4.146 -8.345 -1.615) 9.457 15.819 ( 1.402 -1.482 1.868) 2.766 16.269 ( -0.944 -3.759 4.276) 5.771 17.948 ( -4.780 6.623 -1.579) 8.319 18.932 ( 2.862 -0.643 3.630) 4.667 22.316 ( 2.729 1.001 -17.452) 17.692 22.544 ( 7.371 0.420 -15.068) 16.779 24.456 ( -6.190 2.308 6.346) 9.160 24.865 ( 0.426 3.903 8.851) 9.683 25.691 ( 40.804 -13.188 4.034) 43.071 27.344 ( -7.563 10.085 -16.035) 20.397 29.014 ( -5.949 -7.645 1.304) 9.774 29.523 ( -5.842 -0.831 2.962) 6.602 29.646 ( 6.417 -3.232 -0.994) 7.253 29.987 ( -8.045 2.504 13.589) 15.989 30.270 ( 7.362 -6.917 13.880) 17.167 30.592 ( -6.856 7.139 9.949) 14.034 31.208 ( 2.112 -0.123 3.125) 3.774 33.175 ( -11.030 0.309 -20.426) 23.216 ======================= Grid point 94 (43/186) ======================= q-point: ( 0.38 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.072 ( -19.901 -0.000 43.495) 47.832 2.740 ( 3.196 0.000 6.646) 7.374 3.214 ( -9.110 -0.000 8.216) 12.268 3.387 ( 6.931 0.000 0.629) 6.959 3.587 ( 1.966 0.000 7.445) 7.700 3.721 ( 9.759 0.000 29.270) 30.854 3.879 ( -7.720 -0.000 18.930) 20.444 4.151 ( 2.972 0.000 -0.189) 2.978 4.428 ( 7.902 0.000 -17.935) 19.599 4.624 ( -19.905 -0.000 13.916) 24.287 5.189 ( 2.102 0.000 12.335) 12.513 5.768 ( 10.822 0.000 6.190) 12.467 6.190 ( -3.756 -0.000 2.191) 4.348 6.788 ( -2.714 -0.000 1.636) 3.169 6.969 ( 2.027 0.000 -4.260) 4.717 7.734 ( -2.955 -0.000 -8.810) 9.292 7.908 ( 9.568 0.000 -6.353) 11.485 8.073 ( -3.753 -0.000 -3.122) 4.882 8.451 ( 9.134 0.000 -6.290) 11.090 8.698 ( 9.297 0.000 -3.270) 9.855 8.775 ( -1.129 -0.000 -7.119) 7.208 9.156 ( -3.682 -0.000 3.079) 4.800 9.251 ( -8.744 -0.000 -2.461) 9.084 9.423 ( 1.038 0.000 9.604) 9.660 9.706 ( -12.063 -0.000 1.014) 12.106 9.803 ( 2.622 0.000 -1.152) 2.864 10.891 ( 6.380 0.000 -8.471) 10.605 10.930 ( 0.267 0.000 -3.561) 3.571 11.369 ( -1.670 -0.000 -21.759) 21.823 11.664 ( 6.244 0.000 18.156) 19.200 11.670 ( -1.323 -0.000 -5.825) 5.973 12.463 ( 8.277 0.000 9.562) 12.647 12.649 ( 4.932 0.000 1.869) 5.274 12.847 ( -12.620 -0.000 -7.873) 14.874 13.804 ( 1.584 0.000 9.044) 9.181 13.915 ( -4.502 -0.000 3.765) 5.868 13.931 ( -0.624 -0.000 -4.595) 4.638 14.410 ( -3.650 -0.000 9.038) 9.747 14.508 ( -0.115 -0.000 -0.053) 0.127 15.162 ( -7.676 -0.000 10.925) 13.352 15.246 ( 3.204 0.000 0.163) 3.208 15.495 ( -4.822 -0.000 -0.694) 4.872 15.770 ( 0.575 0.000 0.733) 0.931 16.181 ( 1.438 0.000 -6.071) 6.239 18.205 ( 10.014 0.000 -7.229) 12.351 19.071 ( -5.589 -0.000 4.772) 7.349 22.293 ( 5.933 0.000 -9.625) 11.306 22.619 ( 5.473 0.000 -17.287) 18.133 24.459 ( 3.229 0.000 4.541) 5.572 25.158 ( -5.038 -0.000 10.439) 11.591 25.543 ( -14.344 -0.000 -12.569) 19.072 27.969 ( 12.985 0.000 -20.935) 24.635 28.647 ( -6.065 -0.000 1.035) 6.153 29.298 ( -0.609 -0.000 -0.851) 1.046 29.325 ( -3.706 -0.000 3.917) 5.393 29.886 ( -1.886 -0.000 12.825) 12.963 30.105 ( -14.025 -0.000 23.349) 27.238 31.066 ( -3.863 -0.000 7.164) 8.139 31.736 ( 6.905 0.000 -4.315) 8.142 32.470 ( 9.750 0.000 -8.352) 12.838 ======================= Grid point 95 (44/186) ======================= q-point: (-0.50 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.094 ( -16.352 -5.527 46.343) 49.453 2.798 ( 0.108 -3.569 2.426) 4.316 3.158 ( -8.238 -1.745 7.206) 11.083 3.330 ( 2.699 16.770 3.488) 17.340 3.606 ( 2.354 7.103 5.540) 9.311 3.864 ( -10.386 -3.341 11.613) 15.934 3.935 ( 7.721 2.183 15.577) 17.522 4.116 ( 0.158 7.286 11.567) 13.671 4.387 ( -8.609 1.703 9.359) 12.830 4.613 ( -4.449 -13.760 -7.199) 16.154 5.242 ( 0.367 5.071 15.194) 16.022 5.813 ( -1.989 2.984 -10.116) 10.733 6.186 ( 1.851 1.136 12.818) 13.001 6.792 ( -0.973 -3.603 0.721) 3.801 6.941 ( 3.735 7.940 0.836) 8.815 7.705 ( 1.624 -3.768 -8.381) 9.331 7.945 ( 2.639 0.149 -13.499) 13.755 8.025 ( -1.293 -0.923 -1.745) 2.360 8.569 ( 8.343 -4.232 -6.296) 11.277 8.745 ( 1.538 0.905 -3.991) 4.372 8.859 ( 11.696 -4.009 -1.017) 12.405 9.041 ( -6.322 4.957 1.166) 8.118 9.217 ( -1.887 -6.825 -4.805) 8.557 9.376 ( -5.036 8.456 8.348) 12.906 9.648 ( -8.594 -4.999 9.012) 13.419 9.909 ( 2.835 -9.667 -0.753) 10.103 10.732 ( 2.093 16.337 -2.730) 16.695 10.983 ( 2.388 2.799 -7.364) 8.232 11.256 ( -3.073 -5.393 -19.821) 20.770 11.617 ( -0.398 2.311 -6.401) 6.817 11.795 ( 5.481 4.148 16.658) 18.020 12.611 ( 5.708 2.174 4.080) 7.345 12.676 ( -5.285 -5.102 -1.881) 7.583 12.764 ( 0.317 -7.142 -1.180) 7.246 13.776 ( -3.459 3.958 0.914) 5.335 13.851 ( 1.020 3.425 1.005) 3.712 13.979 ( -1.824 -3.996 3.851) 5.842 14.373 ( 1.473 4.195 1.323) 4.638 14.619 ( -2.060 -13.499 3.621) 14.127 15.102 ( -7.394 1.813 10.199) 12.727 15.281 ( 1.602 -1.109 -2.489) 3.161 15.439 ( -2.594 0.461 -0.062) 2.635 15.805 ( -0.822 -2.406 6.078) 6.588 16.165 ( 2.368 1.016 -7.362) 7.800 18.279 ( 9.064 2.373 -6.713) 11.526 19.008 ( -6.004 1.404 5.027) 7.955 22.321 ( 4.661 -0.858 -9.788) 10.875 22.600 ( 5.504 0.658 -17.838) 18.679 24.513 ( 1.854 0.556 5.289) 5.632 25.114 ( -6.339 1.818 7.581) 10.048 25.358 ( -4.658 1.914 -8.321) 9.726 27.976 ( 9.524 5.078 -19.619) 22.392 28.625 ( -3.003 -4.262 1.641) 5.466 29.299 ( 0.296 -1.891 -1.560) 2.469 29.350 ( -1.744 -4.085 5.798) 7.304 29.932 ( -2.645 -0.575 17.012) 17.226 30.050 ( -11.001 -0.295 19.544) 22.429 31.064 ( -3.777 -2.019 6.054) 7.416 31.648 ( 3.885 17.562 -4.246) 18.481 32.639 ( 6.369 -13.915 -11.035) 18.867 ======================= Grid point 96 (45/186) ======================= q-point: (-0.38 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.228 ( -11.090 -7.894 41.678) 43.844 2.865 ( 0.572 0.115 1.382) 1.500 3.061 ( -0.935 15.389 2.141) 15.565 3.136 ( -11.132 -2.083 6.155) 12.890 3.437 ( 2.351 20.825 -6.424) 21.920 3.819 ( -13.631 -4.923 10.524) 17.911 3.976 ( 3.496 7.677 8.586) 12.037 4.178 ( 1.905 4.727 25.147) 25.658 4.299 ( -11.315 -4.029 16.295) 20.243 4.748 ( -0.581 -14.503 -4.141) 15.094 5.207 ( -0.516 8.640 13.269) 15.842 5.620 ( -8.549 3.567 -12.023) 15.178 6.248 ( 3.775 7.423 11.114) 13.888 6.818 ( 5.314 10.239 5.013) 12.578 6.888 ( -4.255 -3.591 1.452) 5.754 7.733 ( -0.713 -2.621 -13.272) 13.547 7.909 ( 4.338 0.212 -8.161) 9.245 8.080 ( 1.246 -9.583 -5.179) 10.964 8.680 ( 4.753 -2.853 -7.671) 9.464 8.692 ( -0.642 4.943 -6.431) 8.137 8.948 ( -0.073 1.022 2.041) 2.283 9.089 ( 9.458 -6.072 6.595) 13.031 9.225 ( -5.214 4.706 2.440) 7.435 9.326 ( 4.908 -6.819 -4.338) 9.456 9.667 ( -2.918 -3.599 7.218) 8.577 10.076 ( -0.972 -11.331 1.584) 11.482 10.508 ( 0.240 17.403 1.185) 17.445 10.828 ( -2.118 9.711 -14.121) 17.268 11.259 ( -0.935 -4.327 -4.928) 6.624 11.540 ( -0.291 4.185 -4.009) 5.803 11.865 ( 2.202 0.401 8.484) 8.774 12.550 ( -6.429 0.134 -0.507) 6.451 12.727 ( -0.129 -2.828 -6.477) 7.069 12.937 ( 6.844 -8.535 2.629) 11.252 13.677 ( -0.928 6.040 -0.165) 6.113 13.843 ( 1.459 -0.445 -3.021) 3.384 14.015 ( -1.827 -2.272 5.627) 6.337 14.361 ( 2.893 2.705 0.851) 4.051 14.823 ( -3.933 -18.322 3.795) 19.119 15.026 ( -6.715 1.751 8.086) 10.656 15.294 ( -0.317 -1.864 -3.476) 3.957 15.423 ( 0.508 0.547 1.692) 1.849 15.857 ( -2.570 -2.505 8.428) 9.160 16.154 ( 3.916 1.014 -6.848) 7.954 18.289 ( 3.829 4.985 -5.160) 8.132 18.944 ( -3.311 1.752 4.347) 5.738 22.337 ( 3.377 -1.003 -11.204) 11.744 22.576 ( 6.051 1.010 -17.801) 18.829 24.533 ( -2.014 0.544 5.751) 6.118 25.034 ( -5.149 3.202 5.831) 8.412 25.315 ( 8.847 2.932 -3.064) 9.811 27.881 ( 3.888 8.351 -19.232) 21.324 28.698 ( -0.342 -7.385 2.250) 7.727 29.347 ( 2.184 -4.763 -3.938) 6.555 29.432 ( 0.015 -4.400 8.033) 9.159 29.989 ( -6.281 -1.132 20.665) 21.628 30.030 ( -5.075 -0.936 17.133) 17.894 31.075 ( -3.351 -2.222 3.952) 5.638 31.377 ( 0.362 21.335 -2.487) 21.482 32.852 ( 2.343 -16.275 -14.039) 21.621 ======================= Grid point 97 (46/186) ======================= q-point: (-0.25 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.391 ( -6.689 -5.296 32.673) 33.768 2.523 ( -10.624 31.823 1.112) 33.568 3.036 ( -0.577 -0.698 -6.161) 6.227 3.103 ( -14.120 -12.043 12.318) 22.274 3.160 ( 9.907 20.977 -5.892) 23.935 3.751 ( -19.140 -4.945 21.930) 29.525 3.913 ( 1.662 6.330 -0.077) 6.545 4.222 ( 2.332 7.953 21.535) 23.075 4.425 ( -1.566 -9.014 21.786) 23.629 4.927 ( 0.283 -10.195 2.204) 10.434 5.159 ( 2.560 5.442 6.884) 9.141 5.449 ( -6.335 -0.880 -8.360) 10.526 6.154 ( 0.598 14.996 6.486) 16.350 6.692 ( -3.073 13.067 7.351) 15.304 6.926 ( -1.903 -4.839 0.011) 5.200 7.660 ( -1.844 -1.124 -12.610) 12.793 7.962 ( 4.642 -1.570 -1.576) 5.147 8.212 ( 0.886 -8.866 -6.034) 10.761 8.501 ( -5.530 7.402 -11.274) 14.577 8.759 ( 5.430 -3.840 -5.324) 8.520 9.015 ( 3.027 -2.507 0.807) 4.012 9.114 ( -2.099 3.170 -1.329) 4.027 9.281 ( 3.562 -4.019 5.804) 7.907 9.498 ( 14.760 -0.958 -1.951) 14.919 9.750 ( 1.541 -6.027 0.576) 6.247 10.186 ( -2.903 -6.072 2.567) 7.203 10.304 ( -1.914 10.678 6.087) 12.439 10.596 ( -5.604 5.846 -12.740) 15.096 11.254 ( -3.368 0.751 2.870) 4.488 11.461 ( -0.915 3.356 -3.755) 5.118 11.958 ( 2.848 -5.869 3.046) 7.199 12.453 ( -5.115 3.987 1.826) 6.737 12.674 ( -4.599 -0.897 -11.920) 12.808 13.141 ( 7.248 -5.928 -0.088) 9.363 13.590 ( 2.229 7.475 -0.277) 7.805 13.868 ( 0.173 -4.350 -5.023) 6.647 14.063 ( 0.186 -1.434 7.104) 7.250 14.366 ( 0.879 1.486 2.356) 2.921 14.915 ( -6.380 -1.403 2.629) 7.041 15.098 ( -4.400 -17.220 7.383) 19.245 15.286 ( -3.005 -2.014 -2.868) 4.617 15.459 ( 3.789 -0.861 2.740) 4.755 15.868 ( -2.771 0.629 4.439) 5.270 16.187 ( 4.259 -1.507 -2.375) 5.104 18.177 ( -3.624 8.521 -2.633) 9.627 18.930 ( 0.910 0.525 2.716) 2.912 22.326 ( 2.916 -0.176 -13.172) 13.492 22.561 ( 6.687 0.729 -17.175) 18.445 24.495 ( -6.247 0.745 5.022) 8.050 24.969 ( -2.158 3.264 6.517) 7.601 25.514 ( 25.243 -1.735 1.868) 25.371 27.651 ( -4.488 11.298 -19.559) 23.029 28.807 ( -0.931 -6.925 2.456) 7.406 29.430 ( 0.716 -5.483 -2.380) 6.020 29.548 ( 4.167 -3.800 5.674) 8.000 29.990 ( -7.801 -0.905 17.100) 18.817 30.126 ( -0.021 -3.228 20.805) 21.054 30.969 ( -5.462 14.537 -1.606) 15.612 31.193 ( 1.290 2.433 4.195) 5.018 32.978 ( -3.399 -12.799 -16.888) 21.461 ======================= Grid point 98 (47/186) ======================= q-point: (-0.12 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.953 ( -9.053 26.919 2.956) 28.554 2.494 ( -2.116 2.211 21.573) 21.789 2.910 ( -4.740 3.500 -3.517) 6.862 3.091 ( 7.243 6.497 -2.233) 9.982 3.171 ( -10.416 -4.733 23.269) 25.930 3.715 ( -13.053 -4.685 23.180) 27.012 3.875 ( 1.571 0.701 -5.840) 6.088 4.220 ( -0.727 7.918 18.832) 20.442 4.633 ( 1.190 -3.963 23.605) 23.965 4.977 ( 0.486 3.727 0.105) 3.760 5.217 ( 1.870 -1.207 3.725) 4.340 5.442 ( 2.375 -8.253 -1.509) 8.719 5.964 ( -3.774 12.780 4.420) 14.040 6.493 ( -5.572 7.628 0.589) 9.465 6.958 ( -0.556 -1.297 2.147) 2.570 7.626 ( -1.043 -3.515 -7.241) 8.117 8.038 ( 3.142 -2.126 0.220) 3.800 8.223 ( -6.133 2.763 -0.820) 6.777 8.349 ( 3.736 -2.270 -17.987) 18.511 8.851 ( 4.129 -2.428 -4.391) 6.498 8.931 ( -4.097 6.971 -0.370) 8.095 9.158 ( 0.607 -0.169 0.010) 0.631 9.397 ( 11.298 -2.940 -3.878) 12.302 9.627 ( 11.787 7.520 -1.522) 14.064 9.820 ( 1.381 -2.129 -6.115) 6.621 10.218 ( -2.573 -1.037 1.719) 3.264 10.292 ( -0.035 -6.493 14.491) 15.879 10.432 ( -7.564 -1.016 -5.475) 9.393 11.178 ( -7.770 0.377 0.528) 7.797 11.417 ( 0.871 0.238 -1.329) 1.607 12.110 ( 3.136 -8.069 0.032) 8.657 12.316 ( -4.115 8.171 -0.522) 9.163 12.562 ( -3.236 1.164 -7.929) 8.643 13.266 ( 5.156 -1.728 -3.162) 6.290 13.532 ( 4.634 7.689 1.724) 9.142 13.911 ( -1.121 -6.319 -6.592) 9.200 14.107 ( -0.185 0.038 5.808) 5.811 14.362 ( -2.371 -0.160 4.019) 4.670 14.878 ( -3.683 -1.405 3.593) 5.334 15.236 ( -9.763 -6.638 8.042) 14.285 15.254 ( -3.789 -2.538 0.890) 4.646 15.579 ( 4.075 -5.979 -0.067) 7.236 15.841 ( 0.477 0.926 1.932) 2.195 16.253 ( 2.006 -1.709 -1.375) 2.972 17.979 ( -5.021 8.377 -0.934) 9.811 18.969 ( 2.421 -1.079 2.014) 3.329 22.296 ( 3.811 1.040 -14.243) 14.780 22.564 ( 7.046 -0.038 -16.528) 17.967 24.419 ( -6.733 0.706 4.234) 7.985 24.958 ( 0.216 1.949 9.059) 9.269 26.021 ( 36.747 -11.989 1.228) 38.673 27.274 ( -13.900 12.407 -19.465) 26.945 28.874 ( -2.997 -4.798 2.446) 6.163 29.469 ( -2.296 -1.675 1.857) 3.395 29.673 ( 4.068 -2.799 2.394) 5.488 29.977 ( -7.263 0.746 14.876) 16.571 30.322 ( 5.424 -7.835 16.382) 18.952 30.674 ( -8.187 13.364 3.146) 15.985 31.253 ( 3.019 -1.277 4.579) 5.631 32.937 ( -7.757 -3.847 -17.937) 19.917 ======================= Grid point 103 (48/186) ======================= q-point: (-0.50 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.085 ( -14.501 -0.000 49.050) 51.149 2.752 ( -3.428 -0.000 2.070) 4.004 3.079 ( -6.646 -0.000 3.765) 7.638 3.501 ( 0.603 0.000 2.100) 2.184 3.661 ( -16.224 -0.000 5.915) 17.268 3.746 ( 1.117 0.000 17.284) 17.320 4.123 ( 3.421 0.000 14.616) 15.011 4.188 ( -13.957 -0.000 21.976) 26.033 4.374 ( -2.191 -0.000 6.398) 6.763 4.426 ( 5.104 0.000 -18.644) 19.330 5.349 ( -2.441 -0.000 17.066) 17.239 5.677 ( -11.451 -0.000 -14.234) 18.268 6.345 ( 9.533 0.000 14.223) 17.123 6.749 ( -0.015 -0.000 0.539) 0.539 7.047 ( 1.649 0.000 2.052) 2.632 7.663 ( 3.322 0.000 -7.607) 8.301 7.862 ( -1.647 -0.000 -18.114) 18.189 8.013 ( 1.788 0.000 -2.475) 3.054 8.610 ( 4.875 0.000 -0.291) 4.884 8.746 ( 0.692 0.000 -7.296) 7.329 8.987 ( 1.581 0.000 8.342) 8.490 9.082 ( -0.800 -0.000 -1.536) 1.731 9.110 ( 14.924 0.000 -6.849) 16.420 9.378 ( -14.587 -0.000 4.739) 15.338 9.622 ( 2.079 0.000 18.927) 19.041 9.839 ( -0.226 -0.000 -4.300) 4.306 10.932 ( 3.583 0.000 -6.157) 7.124 10.988 ( 4.627 0.000 3.200) 5.625 11.040 ( -4.095 -0.000 -26.986) 27.295 11.596 ( 1.088 0.000 -10.156) 10.214 11.947 ( 0.396 0.000 13.690) 13.696 12.454 ( -11.442 -0.000 -4.890) 12.443 12.720 ( -0.654 -0.000 -0.444) 0.790 12.796 ( 10.311 0.000 7.207) 12.580 13.776 ( -2.742 -0.000 2.748) 3.882 13.909 ( 2.063 0.000 -3.818) 4.339 13.912 ( -5.445 -0.000 10.562) 11.883 14.458 ( 1.160 0.000 3.812) 3.985 14.481 ( -1.045 -0.000 -2.794) 2.983 15.062 ( -7.188 -0.000 8.051) 10.793 15.264 ( 0.018 0.000 -4.789) 4.789 15.439 ( 0.919 0.000 2.717) 2.868 15.811 ( -1.392 -0.000 8.150) 8.268 16.172 ( 3.563 0.000 -8.312) 9.043 18.361 ( 5.844 0.000 -6.558) 8.784 18.973 ( -4.402 -0.000 5.098) 6.736 22.321 ( 3.363 0.000 -9.537) 10.113 22.590 ( 6.141 0.000 -19.066) 20.031 24.541 ( -2.078 -0.000 5.131) 5.535 25.078 ( -5.682 -0.000 5.393) 7.834 25.363 ( 7.658 0.000 -4.442) 8.853 28.007 ( 5.759 0.000 -21.593) 22.348 28.588 ( 0.396 0.000 2.627) 2.657 29.277 ( 0.761 0.000 -3.766) 3.842 29.358 ( 0.745 0.000 10.160) 10.187 29.972 ( -5.803 -0.000 21.133) 21.915 30.020 ( -6.225 -0.000 17.956) 19.005 31.032 ( -3.392 -0.000 5.383) 6.363 31.798 ( 1.464 0.000 -5.646) 5.833 32.515 ( 1.117 0.000 -12.748) 12.797 ======================= Grid point 104 (49/186) ======================= q-point: (-0.38 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.174 ( -12.333 -5.683 39.964) 42.208 2.760 ( -6.061 -8.310 2.645) 10.620 3.003 ( -5.940 1.555 -0.896) 6.205 3.287 ( -8.783 17.936 2.848) 20.173 3.586 ( -15.149 -6.715 10.896) 19.832 3.739 ( -0.301 14.488 10.755) 18.046 4.014 ( -14.244 2.492 7.338) 16.215 4.202 ( -2.717 -3.651 19.118) 19.652 4.416 ( 4.814 3.180 5.672) 8.091 4.552 ( 4.821 -12.854 0.255) 13.731 5.337 ( -5.080 4.848 10.780) 12.866 5.455 ( -11.717 -0.593 -8.858) 14.700 6.476 ( 5.172 6.903 12.703) 15.355 6.781 ( 0.452 -2.847 -0.200) 2.890 7.013 ( -0.948 6.814 3.129) 7.558 7.653 ( 1.203 2.042 -11.641) 11.880 7.863 ( 5.381 -10.495 -12.418) 17.126 8.035 ( 5.355 2.013 -1.294) 5.865 8.632 ( -5.944 0.574 -8.595) 10.466 8.698 ( 1.399 -0.573 -2.841) 3.218 8.973 ( 0.121 1.120 2.998) 3.203 9.140 ( 3.446 -4.351 5.681) 7.942 9.196 ( -8.864 2.792 2.634) 9.660 9.403 ( 20.321 -4.417 -2.546) 20.950 9.688 ( 1.627 2.893 10.196) 10.723 9.920 ( -0.600 -10.813 3.855) 11.495 10.736 ( -2.584 13.235 -9.801) 16.670 10.855 ( 1.460 11.252 -17.304) 20.692 11.171 ( 2.527 -7.642 3.015) 8.595 11.547 ( 0.363 1.356 -11.078) 11.167 11.924 ( -3.879 4.159 7.337) 9.283 12.386 ( -6.595 -7.077 0.035) 9.674 12.678 ( -3.552 0.707 -4.906) 6.098 12.977 ( 8.914 -3.943 3.697) 10.425 13.730 ( -3.039 2.993 4.103) 5.918 13.860 ( -0.595 2.925 2.594) 3.954 13.978 ( -0.033 -4.581 4.993) 6.777 14.430 ( 1.917 2.144 -1.307) 3.159 14.565 ( -4.218 -11.736 1.136) 12.523 15.008 ( -4.563 1.484 6.202) 7.841 15.241 ( -1.431 -1.137 -4.241) 4.618 15.479 ( 3.175 1.075 5.079) 6.085 15.840 ( -1.677 -1.501 6.890) 7.249 16.179 ( 3.970 0.278 -7.491) 8.482 18.355 ( 0.754 3.693 -4.002) 5.498 18.952 ( -1.131 0.696 3.267) 3.527 22.316 ( 2.828 -0.334 -9.920) 10.321 22.577 ( 6.697 0.324 -19.690) 20.801 24.507 ( -6.308 0.178 3.881) 7.409 25.031 ( -4.020 1.172 4.993) 6.517 25.513 ( 19.123 0.574 -1.123) 19.165 27.908 ( 1.121 6.098 -22.826) 23.653 28.656 ( 3.494 -3.529 3.559) 6.110 29.293 ( 1.997 -3.193 -5.374) 6.563 29.449 ( 2.297 -2.558 11.255) 11.769 29.972 ( -7.135 -0.343 16.251) 17.752 30.077 ( -3.235 -0.665 25.934) 26.144 31.028 ( -2.813 -1.814 4.350) 5.488 31.624 ( -2.171 17.986 -5.315) 18.880 32.558 ( -2.785 -15.006 -15.197) 21.538 ======================= Grid point 105 (50/186) ======================= q-point: (-0.25 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.260 ( -14.241 -8.033 18.953) 25.031 2.650 ( -26.428 7.854 -0.066) 27.570 2.890 ( -1.661 0.855 6.772) 7.025 3.046 ( 1.396 4.413 -2.319) 5.177 3.519 ( -9.666 8.199 23.303) 26.527 3.577 ( -3.142 2.250 5.299) 6.559 3.849 ( -14.271 -0.494 6.791) 15.812 4.346 ( -3.325 -3.082 18.780) 19.320 4.486 ( 6.324 -3.126 5.851) 9.165 4.819 ( 5.753 -10.638 9.350) 15.287 5.212 ( -5.519 0.501 -6.187) 8.306 5.362 ( -5.293 0.090 7.682) 9.330 6.385 ( -4.138 13.828 8.638) 16.821 6.753 ( -3.454 7.073 -4.286) 8.963 6.935 ( 0.252 2.725 6.113) 6.697 7.590 ( 1.558 1.191 -9.033) 9.243 8.041 ( 7.273 -3.042 -2.466) 8.261 8.097 ( 6.196 -3.964 -4.666) 8.711 8.412 ( -10.714 3.165 -14.383) 18.212 8.756 ( 4.346 -3.244 -2.584) 6.008 9.001 ( -2.649 -1.090 3.186) 4.284 9.105 ( -1.059 -0.497 -1.216) 1.687 9.293 ( 4.026 -5.142 8.083) 10.391 9.672 ( 11.114 -4.344 -2.182) 12.130 9.791 ( 14.819 0.287 5.343) 15.755 10.078 ( -1.091 -8.588 7.872) 11.701 10.467 ( -6.649 11.224 -6.448) 14.552 10.581 ( -1.001 16.551 -14.898) 22.291 11.226 ( -4.802 1.147 3.942) 6.318 11.473 ( 0.737 2.360 -8.448) 8.803 11.908 ( -1.275 -4.596 2.456) 5.364 12.420 ( -1.717 -2.785 3.746) 4.974 12.564 ( -5.646 1.134 -9.413) 11.035 13.151 ( 6.704 -5.437 -1.396) 8.744 13.675 ( -2.594 2.054 3.569) 4.867 13.837 ( 1.418 2.108 0.078) 2.541 14.070 ( 0.637 -3.026 7.007) 7.659 14.404 ( -0.508 2.885 -0.872) 3.056 14.728 ( -3.042 -17.327 2.356) 17.749 14.975 ( -2.494 0.714 6.467) 6.968 15.218 ( -2.181 -1.295 -2.668) 3.681 15.531 ( 3.560 1.262 5.389) 6.581 15.865 ( -0.855 -0.555 3.468) 3.615 16.201 ( 3.420 -1.157 -4.816) 6.019 18.240 ( -3.533 8.615 -0.650) 9.334 18.956 ( 0.977 0.066 0.934) 1.353 22.309 ( 3.455 0.004 -10.702) 11.246 22.566 ( 6.851 0.156 -19.408) 20.582 24.426 ( -7.849 -0.065 2.354) 8.194 24.998 ( -2.927 0.939 6.426) 7.123 25.834 ( 28.726 -3.051 0.615) 28.894 27.634 ( -7.032 12.653 -23.501) 27.602 28.771 ( 3.397 -2.846 3.982) 5.958 29.360 ( 2.451 -5.215 -4.505) 7.314 29.582 ( 3.682 -3.566 8.788) 10.174 29.969 ( -5.779 -0.575 14.360) 15.490 30.192 ( -2.000 -2.128 28.274) 28.424 31.023 ( -3.829 3.094 1.670) 5.198 31.310 ( -3.048 13.815 -1.465) 14.223 32.650 ( -4.764 -15.646 -17.001) 23.591 ======================= Grid point 106 (51/186) ======================= q-point: (-0.12 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.999 ( -23.944 7.867 -2.235) 25.303 2.402 ( -12.770 -7.483 6.966) 16.358 2.842 ( -5.008 3.279 3.374) 6.872 3.081 ( -0.678 -3.748 4.392) 5.813 3.414 ( 0.861 11.815 21.716) 24.737 3.638 ( -4.373 -5.507 19.346) 20.585 3.732 ( -11.540 -4.844 -1.379) 12.591 4.350 ( -3.849 4.128 12.173) 13.418 4.695 ( 1.495 -8.388 15.350) 17.556 5.003 ( 0.625 -2.424 9.681) 9.999 5.180 ( -1.975 -4.112 -1.606) 4.836 5.413 ( 5.046 -5.900 5.053) 9.263 6.104 ( -12.248 15.382 5.504) 20.419 6.538 ( -3.249 10.624 -5.379) 12.344 6.959 ( 0.778 0.734 5.760) 5.858 7.574 ( 2.971 0.578 -5.249) 6.059 8.079 ( -4.497 0.891 -1.993) 4.999 8.155 ( 2.007 1.366 -2.830) 3.729 8.286 ( 5.663 -4.449 -15.693) 17.266 8.854 ( 4.654 -2.783 -2.664) 6.041 8.936 ( -4.999 1.708 1.271) 5.434 9.152 ( 1.824 -2.069 -1.528) 3.153 9.450 ( 6.646 -4.388 3.363) 8.645 9.800 ( 4.584 -1.641 -4.302) 6.497 9.981 ( 15.529 13.935 1.122) 20.895 10.187 ( -1.760 -1.762 2.007) 3.198 10.247 ( -7.370 -1.784 6.421) 9.937 10.335 ( -1.447 2.310 -5.267) 5.931 11.091 ( -8.568 3.778 -1.750) 9.526 11.436 ( 1.142 1.456 -2.250) 2.913 12.013 ( 0.802 -8.684 -1.158) 8.797 12.335 ( -5.730 5.801 -7.518) 11.091 12.548 ( 3.632 -2.039 4.220) 5.929 13.261 ( 3.077 -3.506 -6.178) 7.741 13.646 ( -1.277 0.864 3.071) 3.436 13.839 ( 2.503 0.736 -2.124) 3.364 14.125 ( -0.633 -0.384 5.559) 5.608 14.339 ( -3.540 1.645 -0.851) 3.996 14.890 ( 3.502 -0.870 2.387) 4.327 15.033 ( -6.546 -11.820 12.545) 18.438 15.197 ( -1.585 -0.667 -1.461) 2.257 15.588 ( 2.818 -0.817 1.948) 3.522 15.870 ( 0.660 0.626 1.999) 2.196 16.246 ( 2.331 -1.884 -3.364) 4.505 18.050 ( -4.153 10.428 1.489) 11.323 18.979 ( 0.804 -1.256 0.147) 1.498 22.304 ( 5.028 0.789 -11.398) 12.483 22.564 ( 6.554 -0.496 -18.295) 19.440 24.349 ( -6.060 -0.839 1.787) 6.374 24.995 ( -2.675 -0.547 8.573) 8.997 26.318 ( 32.923 -9.182 -2.179) 34.249 27.163 ( -17.738 15.985 -22.107) 32.540 28.842 ( 1.391 -0.423 3.942) 4.201 29.429 ( 0.474 -2.999 -0.690) 3.114 29.701 ( 2.257 -2.107 6.667) 7.348 29.970 ( -5.375 0.233 13.447) 14.484 30.358 ( 1.529 -5.811 20.580) 21.439 30.761 ( -10.580 15.278 -0.486) 18.590 31.282 ( 1.695 -2.454 5.284) 6.067 32.704 ( -1.082 -10.107 -16.762) 19.603 ======================= Grid point 112 (52/186) ======================= q-point: (-0.38 -0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.131 ( -15.654 -0.000 29.822) 33.681 2.568 ( -15.458 -0.000 -0.061) 15.458 2.993 ( 2.471 0.000 -2.876) 3.791 3.225 ( -22.061 -0.000 7.425) 23.277 3.458 ( -4.869 -0.000 2.566) 5.504 3.755 ( -24.135 -0.000 26.293) 35.691 3.955 ( -7.542 -0.000 12.768) 14.829 4.236 ( -0.890 -0.000 14.029) 14.057 4.343 ( 0.594 0.000 -11.999) 12.014 4.699 ( 13.815 0.000 15.101) 20.466 5.213 ( -12.904 -0.000 -10.015) 16.335 5.357 ( -7.122 -0.000 10.501) 12.688 6.636 ( 0.377 0.000 13.091) 13.097 6.775 ( 0.660 0.000 -0.187) 0.687 7.036 ( -3.817 -0.000 -0.610) 3.866 7.709 ( 2.399 0.000 -10.786) 11.049 7.780 ( 13.120 0.000 -8.304) 15.527 8.159 ( 10.060 0.000 0.082) 10.061 8.452 ( -13.557 -0.000 -14.904) 20.147 8.694 ( -0.851 -0.000 3.201) 3.312 8.994 ( -0.990 -0.000 2.848) 3.015 9.110 ( -6.955 -0.000 0.065) 6.955 9.191 ( 6.578 0.000 7.349) 9.863 9.623 ( 16.131 0.000 -2.220) 16.283 9.842 ( 9.023 0.000 -1.604) 9.165 9.854 ( 1.951 0.000 19.262) 19.360 10.625 ( -8.463 -0.000 -22.177) 23.737 11.013 ( 6.791 0.000 -11.624) 13.462 11.163 ( 3.249 0.000 7.610) 8.274 11.485 ( -0.203 -0.000 -16.325) 16.326 11.909 ( -8.065 -0.000 2.962) 8.592 12.289 ( -0.739 -0.000 6.742) 6.782 12.594 ( -5.941 -0.000 -7.302) 9.414 13.061 ( 6.336 0.000 1.029) 6.419 13.717 ( -7.567 -0.000 11.010) 13.360 13.936 ( -0.347 -0.000 14.966) 14.970 13.950 ( 3.326 0.000 -3.640) 4.931 14.411 ( -1.876 -0.000 -2.321) 2.985 14.467 ( -1.199 -0.000 -2.082) 2.402 15.012 ( -0.784 -0.000 5.067) 5.127 15.196 ( -1.465 -0.000 -3.032) 3.368 15.565 ( 3.684 0.000 7.532) 8.384 15.839 ( -0.916 -0.000 4.305) 4.401 16.190 ( 3.150 0.000 -7.490) 8.125 18.370 ( -0.814 -0.000 -1.038) 1.319 18.961 ( -0.006 -0.000 1.199) 1.199 22.307 ( 3.198 0.000 -9.077) 9.624 22.569 ( 6.989 0.000 -21.113) 22.240 24.424 ( -8.332 -0.000 1.557) 8.476 25.011 ( -4.272 -0.000 5.449) 6.925 25.799 ( 25.757 0.000 -0.589) 25.764 27.847 ( -0.248 -0.000 -26.889) 26.890 28.720 ( 6.753 0.000 5.015) 8.412 29.270 ( 2.883 0.000 -7.051) 7.618 29.521 ( 2.564 0.000 12.707) 12.963 29.961 ( -5.401 -0.000 13.609) 14.642 30.169 ( -4.042 -0.000 34.206) 34.444 30.999 ( -2.590 -0.000 3.971) 4.741 31.707 ( -4.121 -0.000 -5.409) 6.801 32.282 ( -7.413 -0.000 -18.035) 19.499 ======================= Grid point 113 (53/186) ======================= q-point: (-0.25 -0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.028 ( -21.253 -3.858 12.218) 24.816 2.293 ( -30.037 0.926 -2.861) 30.187 2.905 ( -9.919 0.866 0.867) 9.995 3.111 ( -0.753 -1.309 -0.017) 1.510 3.385 ( -5.951 -1.628 1.331) 6.312 3.585 ( -23.367 1.119 39.983) 46.324 3.848 ( -5.285 7.215 8.824) 12.564 4.320 ( -4.370 -3.934 14.565) 15.707 4.393 ( -0.504 -11.132 -1.911) 11.306 4.932 ( 6.548 -0.155 10.402) 12.293 5.090 ( 0.713 -2.466 -1.423) 2.935 5.310 ( -6.332 -1.921 5.410) 8.547 6.523 ( -8.474 14.580 8.122) 18.717 6.801 ( -0.301 2.615 -2.349) 3.528 6.955 ( -4.118 -1.257 1.039) 4.429 7.665 ( 6.149 5.206 -5.500) 9.755 7.989 ( 7.731 -6.171 -6.298) 11.726 8.194 ( -11.180 -1.737 -17.742) 21.043 8.265 ( 10.448 4.685 1.874) 11.603 8.732 ( 0.968 -4.711 0.223) 4.815 8.960 ( -5.680 0.771 3.108) 6.521 9.076 ( 1.066 -1.873 -1.901) 2.874 9.352 ( 6.910 -2.408 12.171) 14.201 9.739 ( 7.292 -0.614 -2.098) 7.613 10.026 ( 5.293 -5.671 14.992) 16.880 10.038 ( 15.212 -1.392 2.403) 15.464 10.379 ( -9.282 4.518 -18.135) 20.867 10.837 ( 2.331 21.677 -14.473) 26.169 11.207 ( -4.655 2.290 2.266) 5.661 11.452 ( 4.043 -2.688 -12.257) 13.184 11.821 ( -5.778 -2.722 1.331) 6.524 12.405 ( 4.062 -5.357 9.132) 11.340 12.455 ( -7.002 1.321 -10.439) 12.639 13.142 ( 3.180 -3.338 -3.345) 5.695 13.657 ( -7.704 1.200 11.006) 13.488 13.924 ( 2.781 4.223 1.048) 5.164 14.076 ( 1.292 -3.320 12.510) 13.007 14.417 ( -1.841 2.425 -3.686) 4.781 14.491 ( -0.132 -14.441 3.439) 14.845 15.026 ( 1.759 2.427 4.224) 5.180 15.177 ( -0.377 -0.573 -1.696) 1.829 15.626 ( 2.288 2.332 7.791) 8.448 15.859 ( -0.130 -1.507 2.389) 2.827 16.195 ( 2.267 -1.017 -6.500) 6.958 18.315 ( -1.600 6.386 1.928) 6.860 18.962 ( -0.173 -0.155 -0.483) 0.536 22.312 ( 4.434 -0.012 -8.924) 9.965 22.555 ( 6.749 -0.153 -21.471) 22.507 24.327 ( -7.500 -0.578 0.222) 7.526 24.980 ( -5.191 -0.397 6.659) 8.452 26.165 ( 29.435 -2.537 -1.653) 29.590 27.599 ( -6.107 12.113 -29.875) 32.810 28.845 ( 7.219 0.072 5.493) 9.071 29.309 ( 4.003 -4.068 -7.059) 9.077 29.629 ( 2.604 -2.251 11.032) 11.556 29.963 ( -4.088 -0.246 12.146) 12.818 30.295 ( -3.953 -0.013 38.133) 38.338 31.002 ( -2.658 -1.116 3.445) 4.492 31.446 ( -7.268 17.454 -5.110) 19.585 32.258 ( -6.138 -19.436 -17.893) 27.122 ======================= Grid point 114 (54/186) ======================= q-point: (-0.12 -0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.672 ( -32.823 4.114 -3.599) 33.276 1.996 ( -25.366 -15.919 2.643) 30.064 2.880 ( -8.322 -9.959 3.767) 13.514 3.041 ( -2.859 5.502 -0.278) 6.207 3.388 ( -7.558 -5.835 -1.429) 9.654 3.572 ( -9.617 -1.761 41.701) 42.832 3.763 ( -1.183 4.928 11.350) 12.430 4.344 ( -7.626 -1.959 11.373) 13.832 4.572 ( -1.325 -14.271 3.759) 14.817 5.014 ( 1.417 -5.442 7.903) 9.700 5.109 ( -7.042 2.093 7.114) 10.227 5.433 ( 11.619 -7.082 1.460) 13.686 6.167 ( -14.545 17.815 4.970) 23.530 6.616 ( -5.317 11.516 -6.976) 14.476 7.006 ( -0.151 -3.238 6.280) 7.067 7.671 ( 7.657 4.339 -2.511) 9.152 7.894 ( -10.322 -2.041 -13.963) 17.483 8.228 ( 7.591 -5.990 -12.087) 15.479 8.318 ( 7.710 6.695 4.897) 11.325 8.830 ( 2.382 -5.941 -4.241) 7.679 8.897 ( -3.207 0.697 1.205) 3.496 9.137 ( 2.566 -3.506 -0.789) 4.416 9.519 ( 5.768 -1.186 11.443) 12.869 9.832 ( 5.034 -0.642 -2.966) 5.878 10.085 ( -10.258 3.962 -11.403) 15.841 10.220 ( 3.255 -2.646 11.524) 12.264 10.309 ( 12.886 -5.202 7.597) 15.838 10.423 ( -2.168 24.013 -13.689) 27.726 11.060 ( -5.122 6.130 -3.768) 8.832 11.459 ( 1.365 1.775 -4.129) 4.697 11.892 ( 0.907 -9.848 -0.469) 9.901 12.265 ( -7.095 3.340 -11.609) 14.009 12.613 ( 7.828 -5.242 9.432) 13.331 13.187 ( -0.130 -4.233 -8.861) 9.821 13.610 ( -5.820 -0.592 7.611) 9.600 13.914 ( 3.218 2.614 -0.585) 4.187 14.150 ( 0.094 0.814 8.833) 8.871 14.325 ( -2.162 3.941 -5.096) 6.795 14.808 ( 2.732 -18.677 16.230) 24.894 15.028 ( 2.953 4.305 4.119) 6.650 15.186 ( 1.759 -0.384 -0.825) 1.980 15.633 ( 0.081 2.580 3.705) 4.516 15.888 ( 0.347 -0.617 2.270) 2.378 16.224 ( 2.051 -2.758 -4.517) 5.676 18.174 ( -2.356 11.699 3.940) 12.568 18.958 ( -1.145 -1.088 -0.812) 1.776 22.334 ( 6.122 0.345 -9.598) 11.389 22.543 ( 5.992 -0.801 -20.331) 21.211 24.268 ( -4.196 -1.981 0.614) 4.680 24.960 ( -5.912 -2.044 8.082) 10.220 26.576 ( 26.535 -5.257 -10.053) 28.858 27.070 ( -17.543 20.071 -24.194) 35.999 28.929 ( 5.355 3.093 5.039) 7.977 29.392 ( 2.930 -3.970 -3.470) 6.032 29.735 ( 1.180 -1.832 9.575) 9.819 29.975 ( -3.493 0.070 11.478) 11.998 30.414 ( -2.939 -0.837 28.236) 28.401 30.806 ( -13.726 15.001 -3.247) 20.591 31.279 ( -1.103 -1.743 4.613) 5.053 32.461 ( 7.002 -20.770 -14.284) 26.162 ======================= Grid point 121 (55/186) ======================= q-point: (-0.25 -0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.712 ( -29.189 -0.000 6.050) 29.810 1.926 ( -31.877 -0.000 -2.561) 31.980 2.506 ( -37.839 -0.000 -4.796) 38.141 3.121 ( 4.505 0.000 -2.422) 5.115 3.403 ( 2.548 0.000 3.586) 4.400 3.544 ( -18.052 -0.000 50.011) 53.169 3.825 ( -10.208 -0.000 10.092) 14.354 4.257 ( -0.731 -0.000 -5.593) 5.640 4.330 ( -6.729 -0.000 19.821) 20.932 4.930 ( -1.556 -0.000 5.571) 5.785 5.208 ( -7.943 -0.000 0.908) 7.995 5.285 ( 18.456 0.000 4.108) 18.908 6.631 ( -10.555 -0.000 13.717) 17.308 6.732 ( -4.274 -0.000 -0.704) 4.332 6.834 ( -5.726 -0.000 -10.947) 12.354 7.718 ( -4.201 -0.000 1.152) 4.356 7.931 ( -6.095 -0.000 -20.580) 21.463 8.096 ( 14.200 0.000 -7.440) 16.031 8.459 ( 10.891 0.000 3.726) 11.510 8.685 ( -1.541 -0.000 0.878) 1.773 8.910 ( -4.098 -0.000 0.387) 4.117 9.074 ( 2.110 0.000 -1.376) 2.519 9.512 ( 8.341 0.000 16.777) 18.736 9.802 ( 5.575 0.000 -3.067) 6.363 10.112 ( 3.319 0.000 9.056) 9.645 10.222 ( -4.923 -0.000 -11.078) 12.122 10.245 ( 13.919 0.000 1.757) 14.029 10.939 ( 0.469 0.000 -30.140) 30.143 11.168 ( -5.212 -0.000 -1.322) 5.377 11.439 ( 7.491 0.000 -6.725) 10.067 11.719 ( -6.327 -0.000 0.979) 6.403 12.317 ( -7.335 -0.000 -13.203) 15.104 12.480 ( 5.276 0.000 13.581) 14.570 13.119 ( -0.099 -0.000 -4.377) 4.378 13.607 ( -9.597 -0.000 10.862) 14.494 13.975 ( 1.107 0.000 -3.498) 3.669 14.218 ( 5.369 0.000 34.277) 34.695 14.373 ( 0.405 0.000 -1.387) 1.445 14.409 ( -0.386 -0.000 -1.263) 1.320 15.102 ( 4.201 0.000 3.006) 5.165 15.179 ( 2.170 0.000 -0.923) 2.359 15.713 ( 0.368 0.000 10.929) 10.935 15.846 ( -0.731 -0.000 0.864) 1.132 16.175 ( 1.431 0.000 -7.598) 7.731 18.375 ( 0.886 0.000 4.031) 4.127 18.946 ( -1.568 -0.000 -0.716) 1.724 22.336 ( 5.689 0.000 -8.347) 10.101 22.531 ( 6.203 0.000 -22.742) 23.573 24.236 ( -5.443 -0.000 -0.293) 5.450 24.929 ( -7.066 -0.000 7.315) 10.170 26.494 ( 27.515 0.000 -6.559) 28.286 27.467 ( -5.799 -0.000 -38.272) 38.709 28.986 ( 8.671 0.000 6.640) 10.921 29.297 ( 5.267 0.000 -8.484) 9.986 29.691 ( 1.615 0.000 10.277) 10.403 29.973 ( -2.805 -0.000 10.798) 11.157 30.449 ( -5.129 -0.000 46.177) 46.461 30.982 ( -1.360 -0.000 3.451) 3.709 31.511 ( -7.351 -0.000 -3.507) 8.145 31.852 ( -9.820 -0.000 -18.054) 20.551 ======================= Grid point 122 (56/186) ======================= q-point: (-0.12 -0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.307 ( -40.145 13.269 -3.677) 42.440 1.439 ( -29.392 -13.826 6.329) 33.093 2.238 ( -37.171 -30.149 3.354) 47.978 3.106 ( -3.207 2.585 2.254) 4.696 3.432 ( 4.598 7.211 6.719) 10.876 3.625 ( -7.372 -2.826 40.032) 40.803 3.790 ( -4.623 -3.868 11.817) 13.266 4.248 ( -6.662 -2.938 5.670) 9.229 4.372 ( -6.045 -10.083 8.244) 14.358 5.029 ( 6.008 -3.361 9.785) 11.964 5.084 ( -6.741 3.255 1.313) 7.600 5.520 ( 11.659 -3.970 -4.273) 13.036 6.295 ( -12.048 21.295 7.308) 25.535 6.649 ( -6.040 9.396 -9.263) 14.511 6.859 ( -6.169 -15.298 4.910) 17.210 7.609 ( -11.596 -5.257 -5.668) 13.937 7.860 ( 8.741 3.654 -10.507) 14.147 8.224 ( 8.782 -1.430 -10.583) 13.826 8.527 ( 4.324 7.177 7.074) 10.966 8.749 ( 2.529 -7.173 -1.662) 7.785 8.863 ( -1.745 -0.421 -4.921) 5.238 9.122 ( 2.496 -2.779 0.476) 3.765 9.678 ( 6.638 2.547 15.971) 17.482 9.867 ( 4.110 -1.152 -1.931) 4.685 9.958 ( -9.236 4.802 -15.893) 18.999 10.323 ( 7.470 0.508 6.891) 10.176 10.388 ( 4.015 1.264 1.214) 4.381 10.605 ( -3.707 13.722 -21.848) 26.065 11.075 ( -0.836 3.889 -4.983) 6.376 11.491 ( 2.553 2.850 -3.234) 5.010 11.760 ( 1.015 -11.554 0.802) 11.626 12.151 ( -6.648 1.380 -11.752) 13.573 12.662 ( 5.942 -7.359 8.783) 12.908 13.092 ( -1.922 -1.262 -5.892) 6.324 13.540 ( -7.957 -1.869 4.866) 9.512 13.961 ( 0.710 1.140 -1.229) 1.821 14.277 ( 2.651 7.244 9.791) 12.465 14.336 ( -0.205 3.403 -5.992) 6.894 14.755 ( 11.023 -16.234 40.932) 45.393 15.154 ( 5.401 3.107 2.538) 6.728 15.220 ( 4.556 -0.308 -0.338) 4.579 15.698 ( -2.775 5.753 7.652) 9.968 15.876 ( -0.790 -3.061 3.502) 4.717 16.181 ( 1.805 -3.363 -5.935) 7.057 18.342 ( 0.575 10.719 5.366) 12.001 18.921 ( -2.467 -0.427 0.253) 2.516 22.375 ( 6.944 0.021 -9.326) 11.627 22.502 ( 5.307 -0.898 -22.221) 22.863 24.204 ( -1.628 -2.279 1.344) 3.107 24.880 ( -7.896 -1.733 8.107) 11.448 26.687 ( 3.882 6.822 -41.517) 42.253 27.072 ( -2.131 12.952 -13.292) 18.681 29.090 ( 7.081 3.986 5.867) 10.023 29.367 ( 5.412 -3.782 -5.698) 8.721 29.765 ( 0.496 -1.922 8.418) 8.649 29.993 ( -1.798 0.096 10.028) 10.188 30.530 ( -8.425 3.780 32.388) 33.678 30.820 ( -13.626 19.514 -2.717) 23.955 31.266 ( -4.382 3.153 3.627) 6.504 32.149 ( 13.847 -38.525 -3.111) 41.056 ======================= Grid point 130 (57/186) ======================= q-point: (-0.12 -0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.898 ( -35.968 -0.000 0.537) 35.972 1.006 ( -37.790 -0.000 3.489) 37.951 1.474 ( -41.301 -0.000 34.662) 53.918 3.065 ( -5.245 -0.000 1.991) 5.610 3.580 ( -12.003 -0.000 22.332) 25.354 3.721 ( -10.923 -0.000 33.111) 34.867 3.727 ( 16.425 0.000 2.230) 16.576 4.175 ( -3.805 -0.000 -1.439) 4.068 4.243 ( -11.547 -0.000 15.271) 19.145 5.027 ( -4.696 -0.000 -2.096) 5.142 5.176 ( 9.532 0.000 11.149) 14.668 5.509 ( -1.674 -0.000 -15.125) 15.218 6.476 ( -6.669 -0.000 15.785) 17.136 6.571 ( -5.838 -0.000 -0.964) 5.917 6.620 ( -3.990 -0.000 -7.819) 8.778 7.393 ( -9.538 -0.000 -5.100) 10.816 7.936 ( 6.961 0.000 -6.432) 9.478 8.279 ( 7.495 0.000 -13.464) 15.410 8.651 ( -0.699 -0.000 -1.732) 1.868 8.713 ( 3.210 0.000 7.166) 7.852 8.796 ( -1.821 -0.000 -10.163) 10.325 9.136 ( 2.080 0.000 1.116) 2.361 9.788 ( -10.075 -0.000 -20.542) 22.880 9.865 ( 2.394 0.000 8.382) 8.718 9.889 ( 3.150 0.000 -2.176) 3.829 10.366 ( -10.223 -0.000 -40.220) 41.499 10.451 ( 1.739 0.000 0.890) 1.954 10.501 ( 3.276 0.000 6.499) 7.278 11.082 ( 1.189 0.000 -3.322) 3.528 11.607 ( 6.331 0.000 0.968) 6.404 11.615 ( -4.056 -0.000 4.189) 5.831 12.042 ( -3.802 -0.000 -6.004) 7.107 12.665 ( -0.892 -0.000 4.814) 4.896 13.063 ( 0.242 0.000 0.995) 1.024 13.421 ( -8.747 -0.000 -1.132) 8.819 13.968 ( 0.286 0.000 0.249) 0.379 14.315 ( 0.377 0.000 -8.859) 8.867 14.385 ( 1.803 0.000 -3.144) 3.624 15.216 ( 26.354 0.000 55.246) 61.209 15.269 ( 12.739 0.000 11.046) 16.861 15.280 ( 5.420 0.000 -0.528) 5.446 15.804 ( -2.934 -0.000 -0.035) 2.935 15.850 ( 3.706 0.000 40.465) 40.635 16.135 ( 1.906 0.000 -8.665) 8.872 18.497 ( 4.921 0.000 3.145) 5.840 18.901 ( -1.796 -0.000 4.939) 5.256 22.421 ( 7.571 0.000 -11.014) 13.365 22.446 ( 4.240 0.000 -22.704) 23.096 24.189 ( 0.793 0.000 3.879) 3.959 24.802 ( -8.198 -0.000 8.368) 11.714 26.318 ( -31.398 -0.000 -83.331) 89.049 27.198 ( 10.202 0.000 -1.874) 10.372 29.229 ( 4.338 0.000 6.396) 7.729 29.398 ( 8.676 0.000 -5.644) 10.351 29.779 ( -0.424 -0.000 4.563) 4.583 30.029 ( 0.161 0.000 9.069) 9.070 30.437 ( -20.922 -0.000 -2.035) 21.021 31.007 ( 0.875 0.000 3.873) 3.971 31.299 ( -7.186 -0.000 -0.216) 7.190 31.973 ( 23.456 0.000 47.089) 52.608 ======================= Grid point 131 (58/186) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.205 ( 7.535 0.000 31.796) 32.677 1.461 ( 17.358 0.000 34.017) 38.190 2.771 ( 4.339 0.000 48.345) 48.539 2.913 ( -2.157 -0.000 -6.217) 6.581 3.599 ( 1.097 0.000 -3.635) 3.797 4.098 ( -9.101 -0.000 4.705) 10.245 4.227 ( -21.168 -0.000 22.957) 31.227 4.233 ( 7.703 0.000 8.109) 11.185 4.815 ( -15.937 -0.000 44.478) 47.247 4.968 ( 1.797 0.000 0.921) 2.019 5.039 ( -5.903 -0.000 14.382) 15.547 5.750 ( 1.031 0.000 0.981) 1.423 6.399 ( -7.755 -0.000 4.884) 9.164 6.544 ( 3.831 0.000 0.538) 3.868 6.810 ( -2.639 -0.000 12.227) 12.508 7.225 ( 4.054 0.000 -0.518) 4.087 7.883 ( 3.998 0.000 -13.807) 14.374 8.013 ( 5.524 0.000 -6.554) 8.571 8.307 ( 9.264 0.000 -13.568) 16.429 8.496 ( -0.769 -0.000 -7.641) 7.680 8.701 ( -8.629 -0.000 -0.251) 8.633 9.139 ( -2.920 -0.000 -1.350) 3.217 9.244 ( 10.208 0.000 -1.934) 10.390 9.565 ( -3.053 -0.000 -3.967) 5.006 9.887 ( 2.723 0.000 -3.612) 4.524 10.307 ( -5.668 -0.000 -2.344) 6.134 10.416 ( -2.380 -0.000 -1.863) 3.022 10.844 ( 7.083 0.000 14.930) 16.525 10.998 ( 1.333 0.000 -8.150) 8.258 11.777 ( 1.949 0.000 0.084) 1.951 11.807 ( -1.665 -0.000 10.316) 10.449 12.256 ( 2.514 0.000 -1.653) 3.009 12.426 ( -6.731 -0.000 -3.129) 7.423 13.168 ( 2.278 0.000 7.846) 8.171 13.287 ( 2.114 0.000 1.186) 2.424 14.020 ( 1.016 0.000 -10.467) 10.516 14.087 ( -1.652 -0.000 1.678) 2.355 14.327 ( 6.075 0.000 -0.880) 6.139 15.391 ( -1.705 -0.000 2.788) 3.268 15.500 ( 5.160 0.000 2.291) 5.646 15.562 ( 3.711 0.000 -16.159) 16.580 15.625 ( -3.296 -0.000 3.053) 4.493 16.014 ( 1.406 0.000 0.308) 1.440 17.223 ( -32.246 -0.000 -6.069) 32.812 18.037 ( -24.964 -0.000 14.151) 28.695 19.034 ( -1.084 -0.000 9.617) 9.678 21.776 ( 10.803 0.000 -31.740) 33.528 22.116 ( 9.848 0.000 -24.342) 26.258 24.525 ( 0.069 0.000 10.435) 10.436 24.951 ( -1.609 -0.000 14.140) 14.231 25.432 ( 44.832 0.000 -6.072) 45.241 27.096 ( -5.370 -0.000 -12.700) 13.789 29.378 ( -7.627 -0.000 5.430) 9.362 29.564 ( -7.029 -0.000 -5.646) 9.016 29.647 ( 10.611 0.000 0.371) 10.618 29.736 ( -3.755 -0.000 -2.074) 4.289 30.518 ( 5.569 0.000 15.157) 16.148 31.170 ( 1.898 0.000 1.575) 2.466 31.326 ( -3.227 -0.000 12.987) 13.382 32.829 ( -15.991 -0.000 -5.103) 16.786 ======================= Grid point 132 (59/186) ======================= q-point: ( 0.12 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.513 ( 16.116 1.236 26.528) 31.065 1.959 ( 23.178 -10.536 25.841) 36.276 2.884 ( -0.820 -0.857 -7.901) 7.990 3.095 ( 3.615 -5.906 32.692) 33.418 3.575 ( 5.267 3.343 -1.209) 6.354 3.984 ( -10.554 2.847 5.231) 12.118 4.113 ( -17.476 -6.730 21.600) 28.587 4.432 ( 1.602 -13.574 2.531) 13.900 4.777 ( -15.433 4.579 37.965) 41.237 5.006 ( -1.552 -2.156 16.649) 16.859 5.121 ( -0.779 -4.110 20.290) 20.717 5.705 ( -1.995 3.321 -0.423) 3.897 6.232 ( -7.438 11.407 2.035) 13.769 6.670 ( 1.853 -1.826 -1.841) 3.187 6.748 ( 2.133 4.473 14.539) 15.360 7.423 ( 6.190 -13.849 -2.279) 15.340 7.876 ( 5.398 0.383 -12.443) 13.568 8.049 ( 5.149 -0.109 -6.296) 8.134 8.402 ( 9.403 1.490 -7.360) 12.033 8.508 ( -0.053 -7.415 -8.659) 11.400 8.563 ( -7.532 -0.685 -4.516) 8.808 9.087 ( -4.893 -1.065 -2.076) 5.421 9.328 ( 6.576 4.345 -2.245) 8.195 9.551 ( 8.148 2.745 -6.249) 10.629 9.879 ( 1.652 2.960 -4.151) 5.359 10.190 ( -6.910 1.482 1.317) 7.189 10.448 ( -4.559 -8.479 -2.880) 10.049 10.910 ( 3.592 6.747 4.634) 8.939 11.034 ( 4.731 -2.346 -2.144) 5.700 11.643 ( -0.777 10.620 1.059) 10.701 11.954 ( -3.298 -11.001 0.345) 11.490 12.256 ( 2.676 1.826 -2.607) 4.158 12.359 ( -3.527 -2.389 -1.575) 4.542 13.253 ( 2.842 3.113 4.539) 6.194 13.341 ( 4.526 -3.057 7.435) 9.225 13.966 ( 0.779 2.253 -10.456) 10.724 14.077 ( -2.099 -2.697 -2.414) 4.184 14.420 ( 5.827 -0.471 5.028) 7.711 15.334 ( -5.966 1.205 0.888) 6.151 15.425 ( 0.164 11.629 -9.977) 15.324 15.571 ( 3.859 0.031 1.901) 4.302 15.655 ( -4.522 -4.574 0.858) 6.489 16.025 ( 2.860 3.857 3.515) 5.950 16.538 ( -49.321 5.576 11.557) 50.963 17.924 ( -6.754 -0.268 7.320) 9.964 19.080 ( 1.757 1.132 8.602) 8.853 21.790 ( 10.955 -2.213 -28.245) 30.376 22.131 ( 10.841 -0.030 -25.278) 27.505 24.538 ( -5.635 -1.078 7.163) 9.177 25.056 ( 3.913 -1.070 16.682) 17.168 25.925 ( 44.678 7.132 -18.009) 48.696 26.925 ( -8.895 0.879 -14.157) 16.743 29.240 ( -9.992 4.841 3.150) 11.541 29.489 ( -5.334 -3.007 -1.097) 6.221 29.695 ( 1.300 -0.913 -1.219) 2.002 29.829 ( 2.097 -7.202 2.019) 7.768 30.672 ( 8.503 2.237 14.428) 16.896 31.204 ( 2.847 3.163 4.355) 6.089 31.272 ( -5.224 7.256 15.856) 18.203 32.601 ( -21.745 -9.010 -7.196) 24.613 ======================= Grid point 133 (60/186) ======================= q-point: ( 0.25 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.801 ( 15.570 2.435 19.251) 24.879 2.485 ( 15.551 -11.658 16.468) 25.474 2.799 ( -1.688 4.311 -8.772) 9.919 3.215 ( -2.180 4.742 12.976) 13.986 3.625 ( 3.117 0.898 -2.666) 4.199 3.852 ( -5.879 2.900 6.591) 9.296 4.185 ( -13.781 -14.486 29.110) 35.314 4.660 ( 0.912 -15.760 0.601) 15.798 4.741 ( -13.667 -2.232 38.494) 40.909 5.065 ( -4.068 -0.234 15.727) 16.247 5.344 ( 4.977 -5.187 25.838) 26.819 5.674 ( 1.535 1.249 6.898) 7.176 5.967 ( -8.108 11.170 1.087) 13.845 6.519 ( -5.170 9.441 1.247) 10.836 6.951 ( 4.806 -6.925 7.180) 11.073 7.610 ( 2.968 -4.719 -4.855) 7.393 7.882 ( 2.779 -0.623 -9.360) 9.784 8.095 ( 4.537 -0.222 -4.238) 6.212 8.286 ( -4.757 4.964 -6.097) 9.189 8.600 ( 3.367 -8.194 -11.398) 14.436 8.632 ( 7.281 -5.701 -4.369) 10.227 9.032 ( -5.858 -2.574 -3.220) 7.163 9.327 ( 5.538 2.251 -0.529) 6.001 9.592 ( 9.835 4.137 -8.287) 13.509 9.826 ( 2.436 4.766 -1.316) 5.512 10.136 ( -6.601 -3.630 2.136) 7.830 10.438 ( -6.678 -2.526 -2.139) 7.453 10.895 ( 3.796 4.806 4.058) 7.347 11.049 ( 1.391 5.260 -3.624) 6.537 11.520 ( 0.914 6.197 -2.224) 6.647 11.985 ( -8.124 -7.357 -7.609) 13.342 12.257 ( 2.213 2.460 1.992) 3.862 12.424 ( 4.204 -5.489 3.218) 7.626 13.215 ( -0.469 2.611 -5.093) 5.742 13.503 ( 6.601 -1.494 10.640) 12.610 13.881 ( 0.123 3.660 -9.795) 10.457 14.091 ( -2.141 -4.818 -1.947) 5.621 14.512 ( 2.007 0.559 8.064) 8.329 15.149 ( -5.938 14.976 -6.028) 17.202 15.246 ( -5.006 0.870 0.019) 5.081 15.603 ( -6.096 -0.793 0.927) 6.217 15.610 ( -3.911 1.089 11.493) 12.189 16.027 ( 1.397 2.606 7.987) 8.516 16.153 ( -18.201 -4.702 0.657) 18.810 17.896 ( -3.875 -1.159 5.811) 7.080 19.114 ( 1.134 2.507 7.379) 7.875 21.838 ( 11.166 -2.414 -24.878) 27.375 22.149 ( 11.222 0.325 -25.880) 28.210 24.495 ( -6.485 -0.282 4.688) 8.007 25.198 ( 3.201 -0.176 17.022) 17.322 26.185 ( 26.982 7.446 -22.289) 35.781 26.750 ( -4.047 1.465 -12.617) 13.331 29.066 ( -8.357 4.458 3.078) 9.959 29.474 ( -3.665 -2.662 0.552) 4.564 29.733 ( -0.527 -4.499 -0.759) 4.592 29.939 ( -1.321 -6.028 4.372) 7.563 30.784 ( 4.540 3.993 14.470) 15.682 31.073 ( -7.648 13.904 21.971) 27.102 31.322 ( 3.019 -3.823 5.311) 7.206 32.464 ( -11.726 -8.910 -14.457) 20.637 ======================= Grid point 134 (61/186) ======================= q-point: ( 0.38 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.999 ( 9.778 5.399 10.374) 15.244 2.591 ( -3.244 5.223 -3.088) 6.880 2.820 ( -1.661 -3.327 6.138) 7.176 3.121 ( 0.388 7.712 -1.161) 7.808 3.586 ( -0.708 2.714 1.890) 3.382 3.850 ( 0.593 -0.885 9.164) 9.225 4.349 ( -16.267 -11.199 40.084) 44.685 4.782 ( -10.610 -1.578 33.237) 34.925 4.881 ( -3.270 -10.664 3.751) 11.768 5.138 ( -0.450 -6.685 13.977) 15.500 5.491 ( 2.646 5.778 8.098) 10.294 5.675 ( 7.989 10.760 -3.357) 13.816 5.913 ( -11.531 -12.187 28.291) 32.892 6.347 ( -3.793 5.444 -1.150) 6.734 7.067 ( -0.176 -1.832 6.345) 6.606 7.568 ( -0.508 6.401 -4.933) 8.097 7.855 ( -3.042 -2.066 -11.796) 12.355 8.122 ( 2.473 -0.856 -1.277) 2.912 8.211 ( 4.967 4.025 -4.961) 8.092 8.668 ( 4.002 -3.331 -13.074) 14.072 8.805 ( 5.483 -8.262 -2.635) 10.260 8.960 ( -4.766 -3.567 -9.454) 11.172 9.439 ( 8.922 -1.203 0.923) 9.050 9.613 ( 3.067 -0.937 -6.864) 7.576 9.851 ( 8.654 1.141 4.657) 9.893 10.079 ( -8.988 -1.546 -4.142) 10.016 10.388 ( -4.723 -2.079 4.445) 6.811 10.899 ( 6.184 9.822 9.294) 14.869 10.921 ( -2.726 4.836 -7.685) 9.480 11.464 ( 1.882 3.914 -3.022) 5.291 11.918 ( -8.923 -5.733 -8.700) 13.718 12.264 ( 2.721 3.522 3.940) 5.944 12.603 ( 7.248 -5.777 5.536) 10.796 13.135 ( -1.534 1.791 -10.354) 10.620 13.633 ( 4.441 -1.451 5.187) 6.981 13.788 ( -0.133 2.983 -7.405) 7.985 14.131 ( -1.953 -4.524 1.484) 5.146 14.466 ( -7.776 6.367 5.349) 11.385 14.946 ( 1.101 4.124 -3.026) 5.233 15.199 ( -0.606 1.056 1.168) 1.687 15.516 ( -8.981 1.143 10.293) 13.708 15.614 ( -1.784 0.057 5.330) 5.621 16.030 ( 1.287 5.985 2.850) 6.753 16.100 ( -4.969 -8.699 -1.005) 10.068 17.922 ( -2.232 -3.910 7.217) 8.506 19.109 ( -0.542 3.407 6.565) 7.417 21.897 ( 11.442 -1.663 -23.602) 26.282 22.158 ( 10.701 0.927 -25.760) 27.909 24.434 ( -4.707 1.203 3.478) 5.975 25.282 ( -0.827 1.944 15.504) 15.648 26.183 ( -2.170 -1.375 -26.122) 26.248 26.716 ( 15.174 6.198 -8.241) 18.346 28.955 ( -4.739 1.565 3.940) 6.359 29.462 ( -2.460 -0.845 0.301) 2.619 29.796 ( -2.014 -6.948 0.845) 7.283 30.010 ( -2.276 -4.290 6.109) 7.804 30.822 ( -3.433 1.858 16.237) 16.699 30.901 ( -6.491 11.675 18.693) 22.976 31.437 ( 0.107 -3.631 9.372) 10.052 32.399 ( 1.319 -3.358 -19.260) 19.595 ======================= Grid point 135 (62/186) ======================= q-point: (-0.50 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.894 ( -6.123 17.427 3.914) 18.881 2.568 ( -2.094 7.340 7.373) 10.612 2.661 ( -5.563 0.993 -5.332) 7.770 3.106 ( 5.285 1.049 -0.692) 5.432 3.514 ( -7.118 4.232 0.036) 8.281 3.968 ( 2.693 -2.226 16.646) 17.009 4.453 ( -17.657 -6.832 43.381) 47.332 4.769 ( -13.538 1.606 30.328) 33.251 4.925 ( -2.216 1.335 1.336) 2.911 5.270 ( -4.862 -1.884 11.935) 13.024 5.406 ( 1.095 6.116 4.352) 7.586 5.671 ( 1.442 2.393 3.213) 4.258 5.978 ( -10.250 -2.105 14.663) 18.014 6.309 ( -5.120 -3.980 6.672) 9.304 7.127 ( 1.671 -2.574 8.254) 8.806 7.490 ( 5.109 3.110 -7.898) 9.907 7.741 ( -5.881 1.508 -10.067) 11.756 8.145 ( 6.530 4.501 -7.913) 11.203 8.260 ( 6.613 -3.251 0.950) 7.430 8.663 ( 0.522 -1.486 -16.612) 16.687 8.820 ( -0.309 1.258 -7.340) 7.454 9.087 ( 5.393 -11.435 -1.673) 12.753 9.501 ( 4.594 2.415 -3.793) 6.429 9.622 ( -5.528 -5.545 -6.134) 9.946 9.933 ( -6.695 1.709 -7.075) 9.889 10.055 ( 10.003 -4.372 9.677) 14.589 10.417 ( -3.277 -4.663 7.472) 9.397 10.788 ( 3.114 10.094 2.378) 10.828 10.907 ( 3.544 3.409 1.111) 5.041 11.418 ( 1.173 3.315 -2.575) 4.358 11.860 ( -5.897 -5.399 -5.893) 9.932 12.255 ( 3.064 6.429 4.662) 8.512 12.799 ( 7.812 -4.024 6.119) 10.708 13.027 ( -2.760 1.639 -13.339) 13.720 13.660 ( -2.203 0.590 -3.079) 3.831 13.795 ( 4.243 -3.922 -1.838) 6.063 14.139 ( -5.464 0.964 1.925) 5.873 14.299 ( -4.004 3.086 1.189) 5.193 14.978 ( 4.583 -2.598 -1.774) 5.558 15.202 ( 2.093 1.686 2.367) 3.581 15.450 ( -3.879 2.581 8.120) 9.362 15.634 ( -2.399 -2.255 10.038) 10.564 15.972 ( 1.736 4.494 -3.673) 6.059 16.174 ( -2.270 -6.791 4.428) 8.419 18.014 ( -0.991 -6.698 9.135) 11.371 19.075 ( -2.371 3.295 6.704) 7.837 21.942 ( 11.621 -0.192 -25.607) 28.122 22.151 ( 9.507 1.351 -24.462) 26.279 24.385 ( -1.272 2.578 3.957) 4.891 25.268 ( -5.533 3.840 12.957) 14.603 25.973 ( -17.338 -5.655 -25.991) 31.751 26.839 ( 21.672 6.592 -7.262) 23.789 28.948 ( -0.159 -2.227 4.472) 4.998 29.439 ( -1.273 0.553 -0.288) 1.417 29.871 ( -3.897 -8.036 1.394) 9.039 30.062 ( -1.225 -1.923 7.773) 8.101 30.740 ( -13.379 4.295 17.861) 22.726 30.838 ( -1.551 2.837 13.428) 13.811 31.480 ( -6.681 -1.352 10.156) 12.231 32.426 ( 15.289 1.343 -18.168) 23.783 ======================= Grid point 136 (63/186) ======================= q-point: (-0.38 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.527 ( -12.208 19.838 8.849) 24.918 2.178 ( -15.497 22.858 9.749) 29.287 2.857 ( 8.460 -11.782 -4.434) 15.167 3.139 ( 1.753 6.061 4.685) 7.858 3.299 ( -10.791 6.542 3.199) 13.018 4.064 ( -1.378 1.511 15.497) 15.631 4.506 ( -18.226 -4.345 42.680) 46.612 4.710 ( -6.033 6.566 18.034) 20.118 4.819 ( -9.219 3.508 7.832) 12.595 5.158 ( -8.723 7.809 8.308) 14.356 5.402 ( -2.362 1.744 8.618) 9.105 5.658 ( -1.489 4.730 5.585) 7.469 5.958 ( -5.434 -7.674 3.077) 9.894 6.334 ( -8.375 -6.077 14.139) 17.521 7.212 ( -1.210 1.413 6.859) 7.107 7.461 ( 2.446 3.319 -13.201) 13.830 7.680 ( 4.543 -2.575 -4.367) 6.808 8.102 ( 6.679 6.942 -10.675) 14.379 8.449 ( 7.958 -8.456 -1.293) 11.683 8.578 ( -0.890 0.204 -16.471) 16.496 8.769 ( 1.310 2.930 -6.804) 7.524 9.244 ( 3.269 -1.000 2.290) 4.115 9.498 ( -6.887 -2.871 -9.728) 12.260 9.561 ( -3.987 -7.240 -6.944) 10.795 9.846 ( -0.782 0.190 -5.580) 5.638 10.215 ( 2.784 0.276 11.110) 11.457 10.495 ( -2.141 -6.323 4.871) 8.264 10.747 ( 3.415 5.857 5.096) 8.481 10.919 ( 6.287 3.171 -1.986) 7.316 11.397 ( 1.251 -0.165 -1.564) 2.009 11.869 ( -0.334 -3.699 -0.107) 3.716 12.210 ( 2.845 8.923 5.057) 10.643 12.862 ( -2.478 4.552 -8.713) 10.138 12.990 ( 4.695 -4.151 1.846) 6.533 13.572 ( -6.676 1.768 -5.530) 8.847 13.916 ( 4.291 -6.450 -3.849) 8.651 14.031 ( -2.884 1.940 -1.442) 3.763 14.294 ( 0.336 -0.499 2.117) 2.201 15.089 ( 5.790 -4.539 -1.267) 7.465 15.227 ( 2.442 0.245 3.205) 4.037 15.435 ( 0.879 0.430 2.707) 2.878 15.727 ( 1.285 -3.424 15.084) 15.522 15.918 ( 0.649 2.514 -4.919) 5.562 16.281 ( -0.240 -7.487 10.917) 13.240 18.157 ( -1.019 -8.564 10.299) 13.433 19.032 ( -3.826 1.899 8.096) 9.154 21.947 ( 11.569 1.749 -29.957) 32.161 22.135 ( 8.430 1.169 -22.530) 24.084 24.378 ( 3.152 3.570 5.995) 7.656 25.174 ( -8.830 4.068 10.769) 14.508 25.662 ( -23.602 -4.818 -24.631) 34.452 26.989 ( 18.402 4.491 -7.128) 20.239 29.048 ( 4.262 -5.227 4.094) 7.890 29.417 ( -0.087 1.011 -0.271) 1.050 29.912 ( -6.174 -6.438 -0.584) 8.939 30.102 ( 0.294 1.097 7.850) 7.932 30.587 ( -13.712 3.338 12.037) 18.548 30.866 ( -4.797 -2.911 16.667) 17.586 31.413 ( -9.182 1.182 7.055) 11.640 32.574 ( 23.843 3.824 -11.567) 26.775 ======================= Grid point 137 (64/186) ======================= q-point: (-0.25 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.202 ( -9.218 15.035 20.251) 26.854 1.703 ( -17.200 24.249 16.382) 33.945 2.806 ( -12.756 18.885 26.717) 35.116 3.145 ( 1.139 1.690 1.815) 2.730 3.273 ( 5.294 -10.910 -7.795) 14.416 4.071 ( -0.656 2.484 9.898) 10.226 4.499 ( -18.323 0.519 37.350) 41.606 4.541 ( -4.366 14.295 6.586) 16.333 4.772 ( -11.209 -2.778 24.649) 27.220 4.997 ( -6.078 5.361 7.558) 11.082 5.327 ( -8.094 5.990 -0.426) 10.078 5.577 ( -1.827 1.914 10.502) 10.830 6.120 ( 0.126 -16.700 0.932) 16.727 6.408 ( -4.876 -5.599 16.769) 18.339 7.054 ( -10.154 9.274 1.241) 13.807 7.407 ( 3.549 6.010 -5.340) 8.788 7.800 ( 8.043 -3.184 -4.842) 9.913 8.040 ( 4.840 4.678 -11.191) 13.060 8.433 ( 0.217 0.810 -24.864) 24.878 8.665 ( 0.193 -1.049 5.440) 5.543 8.719 ( 5.652 -0.515 -8.873) 10.533 9.244 ( 0.457 4.022 2.200) 4.607 9.322 ( -12.643 -1.462 -11.641) 17.248 9.636 ( -3.145 -8.746 -6.173) 11.158 9.824 ( 1.564 -0.635 -5.596) 5.845 10.296 ( 4.130 0.569 10.382) 11.188 10.533 ( -3.882 -2.306 1.440) 4.739 10.718 ( 0.123 5.466 4.518) 7.092 10.964 ( 7.170 1.094 -4.623) 8.601 11.454 ( 1.355 -5.766 2.094) 6.282 11.933 ( 3.421 0.649 4.415) 5.623 12.149 ( 3.006 7.899 6.882) 10.899 12.703 ( -6.032 3.440 -8.345) 10.856 13.117 ( 4.673 -2.664 4.350) 6.918 13.390 ( -8.789 4.182 -7.557) 12.322 14.004 ( 1.315 -5.698 -10.464) 11.987 14.040 ( 3.143 0.319 6.188) 6.948 14.298 ( 1.050 0.832 -3.213) 3.481 15.225 ( 5.684 -4.220 0.465) 7.095 15.297 ( 4.546 -2.336 1.153) 5.239 15.477 ( 1.890 -2.934 -2.141) 4.094 15.807 ( 5.040 7.017 -1.888) 8.843 15.924 ( -3.897 -8.195 5.190) 10.454 16.569 ( 9.145 -17.493 23.876) 30.979 18.298 ( -5.036 -9.352 9.976) 14.572 19.013 ( -4.814 -1.051 10.115) 11.252 21.905 ( 11.110 3.383 -33.329) 35.295 22.121 ( 8.201 0.731 -22.206) 23.683 24.423 ( 7.106 4.733 8.261) 11.880 25.052 ( -9.965 2.633 9.371) 13.930 25.287 ( -22.488 -0.286 -17.762) 28.658 27.106 ( 11.357 1.318 -7.455) 13.649 29.221 ( 6.906 -6.190 3.267) 9.832 29.411 ( 1.345 0.749 0.258) 1.561 29.874 ( -8.622 -3.093 -3.733) 9.892 30.079 ( -1.151 6.825 1.330) 7.048 30.435 ( -11.422 1.771 12.597) 17.097 30.965 ( -4.200 -7.940 17.314) 19.506 31.316 ( -7.148 1.055 5.690) 9.197 32.789 ( 23.982 4.603 -6.145) 25.181 ======================= Grid point 138 (65/186) ======================= q-point: (-0.12 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.109 ( -2.684 6.500 28.436) 29.293 1.315 ( -7.670 17.395 30.407) 35.860 2.624 ( -3.505 14.401 46.815) 49.105 3.032 ( -4.129 6.005 -5.182) 8.942 3.498 ( 2.915 -12.825 -3.909) 13.721 4.101 ( 2.579 0.169 4.976) 5.607 4.301 ( -0.981 18.243 7.865) 19.890 4.395 ( -21.761 0.710 28.285) 35.694 4.795 ( -13.627 -2.042 35.816) 38.375 4.940 ( -1.865 0.380 4.788) 5.153 5.124 ( -8.615 4.774 5.102) 11.093 5.665 ( 2.451 -3.634 9.175) 10.169 6.352 ( 0.507 -14.445 -4.472) 15.130 6.497 ( -1.395 -2.139 12.991) 13.240 6.826 ( -10.238 4.419 8.131) 13.800 7.304 ( 2.726 11.372 -1.862) 11.841 7.881 ( 5.137 -0.363 -7.693) 9.258 8.000 ( 3.719 1.281 -10.557) 11.266 8.324 ( 3.976 1.733 -21.791) 22.218 8.587 ( 0.078 5.680 -7.165) 9.144 8.770 ( -4.288 -2.350 0.616) 4.929 9.170 ( -3.689 -0.278 -3.721) 5.247 9.204 ( -1.543 1.232 -0.421) 2.019 9.627 ( -5.558 -3.316 -5.427) 8.446 9.854 ( 3.204 -1.553 -4.017) 5.368 10.349 ( -1.033 -0.176 -0.642) 1.228 10.501 ( 0.514 5.525 1.416) 5.727 10.699 ( 0.818 -0.745 10.876) 10.932 11.005 ( 4.177 0.299 -6.402) 7.650 11.601 ( 1.117 -10.250 4.984) 11.452 11.912 ( 1.323 10.088 6.227) 11.928 12.188 ( 5.127 0.122 6.352) 8.164 12.549 ( -7.422 1.580 -5.146) 9.169 13.188 ( -3.948 0.131 -0.895) 4.051 13.242 ( 2.241 1.594 1.145) 2.979 14.035 ( 1.341 -3.052 -10.209) 10.740 14.087 ( 0.464 1.229 6.899) 7.023 14.287 ( 3.742 0.837 -6.412) 7.471 15.340 ( 3.605 -2.817 2.119) 5.042 15.409 ( 6.316 -2.176 0.670) 6.714 15.525 ( 0.513 -4.961 -6.729) 8.376 15.722 ( 0.902 7.353 -3.743) 8.300 15.988 ( -1.990 -4.167 0.867) 4.699 17.126 ( 10.274 -23.086 10.411) 27.330 18.314 ( -21.187 -7.071 8.255) 23.813 19.024 ( -6.058 -2.614 10.037) 12.011 21.828 ( 10.306 3.638 -34.196) 35.900 22.113 ( 8.785 0.330 -23.224) 24.832 24.477 ( 4.722 5.216 9.419) 11.756 24.964 ( -6.870 1.344 11.639) 13.582 25.075 ( 5.672 0.561 -2.301) 6.147 27.158 ( 2.541 -1.165 -9.492) 9.895 29.379 ( -1.300 -4.677 5.638) 7.440 29.463 ( 10.622 -0.597 -1.441) 10.736 29.745 ( -11.102 -0.725 -7.305) 13.309 29.893 ( -4.368 11.201 -2.742) 12.331 30.413 ( -1.972 -0.413 15.960) 16.087 31.108 ( -0.527 -5.718 9.398) 11.014 31.280 ( -5.255 -3.054 9.171) 11.003 32.938 ( 9.818 3.993 -6.080) 12.219 ======================= Grid point 140 (66/186) ======================= q-point: ( 0.12 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.938 ( 23.444 0.000 22.126) 32.237 2.298 ( 21.509 0.000 22.644) 31.231 2.895 ( 6.241 0.000 -6.430) 8.960 3.231 ( 0.116 0.000 30.176) 30.176 3.657 ( 5.066 0.000 -0.826) 5.133 3.873 ( -12.550 -0.000 7.260) 14.498 3.953 ( -12.019 -0.000 14.421) 18.773 4.339 ( -1.915 -0.000 0.077) 1.916 4.777 ( -20.861 -0.000 44.581) 49.221 5.028 ( 2.500 0.000 0.324) 2.521 5.265 ( 5.267 0.000 34.024) 34.429 5.647 ( -10.374 -0.000 9.962) 14.383 6.246 ( -7.054 -0.000 2.690) 7.550 6.711 ( 6.542 0.000 2.954) 7.178 6.886 ( 2.632 0.000 0.642) 2.709 7.365 ( 7.775 0.000 -5.868) 9.741 7.939 ( 9.514 0.000 -7.451) 12.084 8.043 ( -1.127 -0.000 -6.054) 6.158 8.384 ( -11.514 -0.000 -6.448) 13.197 8.432 ( 2.691 0.000 -7.483) 7.952 8.578 ( 16.033 0.000 -3.632) 16.439 8.999 ( -5.278 -0.000 -3.557) 6.364 9.371 ( -0.673 -0.000 2.587) 2.673 9.659 ( 6.726 0.000 -11.999) 13.756 9.891 ( 0.160 0.000 -4.345) 4.348 10.240 ( 5.719 0.000 2.868) 6.398 10.248 ( -9.038 -0.000 -4.412) 10.057 10.925 ( 0.305 0.000 -8.884) 8.889 11.161 ( 7.748 0.000 7.918) 11.078 11.724 ( -6.810 -0.000 -5.434) 8.712 11.776 ( -0.810 -0.000 -3.105) 3.209 12.302 ( -1.722 -0.000 1.200) 2.099 12.327 ( 5.950 0.000 2.942) 6.638 13.262 ( -2.996 -0.000 -4.684) 5.560 13.488 ( 9.040 0.000 17.999) 20.141 13.938 ( 0.514 0.000 -10.997) 11.009 14.008 ( -2.094 -0.000 -6.127) 6.475 14.513 ( 3.848 0.000 7.355) 8.301 15.255 ( -6.414 -0.000 0.313) 6.422 15.537 ( 5.770 0.000 -17.095) 18.042 15.542 ( -6.158 -0.000 8.869) 10.797 15.605 ( 0.610 0.000 -3.120) 3.179 15.937 ( -52.499 -0.000 26.933) 59.005 16.115 ( 3.182 0.000 4.585) 5.581 17.907 ( -0.846 -0.000 1.079) 1.371 19.153 ( 1.647 0.000 8.050) 8.217 21.799 ( 12.265 0.000 -24.923) 27.777 22.153 ( 11.464 0.000 -25.757) 28.193 24.488 ( -5.608 -0.000 5.696) 7.993 25.195 ( 4.627 0.000 18.268) 18.845 26.268 ( 13.568 0.000 -28.690) 31.737 26.852 ( 11.212 0.000 -15.746) 19.330 29.143 ( -11.890 -0.000 2.174) 12.087 29.406 ( -3.409 -0.000 0.153) 3.413 29.613 ( -5.120 -0.000 -0.951) 5.208 29.886 ( 4.263 0.000 6.746) 7.980 30.855 ( 3.910 0.000 16.827) 17.276 31.243 ( 2.114 0.000 1.371) 2.520 31.397 ( -0.637 -0.000 12.087) 12.104 32.218 ( -19.433 -0.000 -0.254) 19.435 ======================= Grid point 141 (67/186) ======================= q-point: ( 0.25 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.253 ( 21.470 8.659 16.369) 28.353 2.639 ( 10.049 -2.697 18.914) 21.587 2.890 ( 6.150 9.887 -4.068) 12.334 3.336 ( 1.057 4.761 15.501) 16.250 3.684 ( 1.436 3.744 2.177) 4.563 3.804 ( -7.546 -4.901 4.095) 9.886 3.974 ( -6.228 -9.246 22.127) 24.776 4.412 ( -2.457 -15.713 -1.426) 15.968 4.722 ( -18.420 -1.251 41.947) 45.830 5.077 ( 1.133 -0.878 5.181) 5.376 5.437 ( -1.849 -2.820 5.974) 6.860 5.679 ( -6.265 -4.014 45.255) 45.863 6.099 ( 0.148 11.542 -1.536) 11.645 6.684 ( 1.815 14.622 -2.927) 15.023 6.945 ( 3.263 -5.394 4.136) 7.540 7.524 ( 6.773 -9.320 -9.093) 14.677 7.890 ( -3.798 5.363 -6.835) 9.482 8.098 ( 5.257 -4.203 -5.788) 8.877 8.218 ( -5.598 0.078 -5.109) 7.579 8.488 ( 4.459 -5.606 -6.990) 10.008 8.732 ( 9.856 1.481 -8.374) 13.017 8.944 ( -0.572 0.439 -0.127) 0.732 9.399 ( 3.299 -0.583 6.152) 7.005 9.609 ( -3.825 0.116 -8.853) 9.645 9.883 ( 0.029 -2.655 -4.856) 5.534 10.069 ( -7.106 3.332 -2.634) 8.278 10.374 ( 6.435 0.634 0.766) 6.512 10.894 ( 0.796 -0.205 -8.384) 8.425 11.235 ( 5.565 4.827 1.329) 7.486 11.566 ( -2.002 5.165 -4.820) 7.343 11.783 ( -4.753 -4.479 -5.753) 8.703 12.311 ( 2.041 0.305 3.788) 4.314 12.457 ( 6.600 -3.280 6.446) 9.792 13.172 ( -5.202 0.798 -7.293) 8.994 13.662 ( 6.884 2.651 14.208) 16.009 13.876 ( 0.492 2.260 -10.702) 10.949 13.987 ( -1.312 -4.753 -4.455) 6.645 14.563 ( -1.464 1.013 6.569) 6.806 15.181 ( -7.460 5.134 -1.653) 9.206 15.260 ( -8.876 10.016 4.405) 14.089 15.497 ( -12.007 -0.985 14.928) 19.183 15.632 ( -0.916 -0.173 1.673) 1.915 15.740 ( -11.232 -15.099 -2.166) 18.943 16.156 ( 1.285 2.071 6.198) 6.660 17.903 ( 1.306 1.085 0.494) 1.768 19.190 ( 0.072 1.827 7.558) 7.776 21.855 ( 12.476 -1.051 -22.081) 25.383 22.173 ( 11.172 0.221 -26.256) 28.535 24.453 ( -3.451 0.236 4.663) 5.806 25.321 ( 1.541 0.733 17.665) 17.747 26.117 ( -12.210 -1.854 -25.442) 28.281 26.975 ( 25.717 8.250 -18.475) 32.723 28.996 ( -10.257 0.893 1.974) 10.484 29.391 ( -3.049 -2.739 0.854) 4.187 29.582 ( -5.698 -5.575 -0.419) 7.983 29.967 ( 2.130 -0.225 9.874) 10.104 30.894 ( -8.646 2.963 21.350) 23.224 31.301 ( 0.299 -3.503 3.473) 4.941 31.330 ( 0.376 14.265 12.322) 18.854 32.158 ( -1.960 -11.501 -9.720) 15.185 ======================= Grid point 142 (68/186) ======================= q-point: ( 0.38 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.417 ( 18.815 13.699 7.824) 24.554 2.703 ( 2.655 14.142 2.702) 14.641 2.819 ( -3.391 2.884 11.518) 12.348 3.283 ( 4.887 10.596 0.048) 11.669 3.627 ( -1.987 5.286 2.286) 6.092 3.839 ( -4.291 -7.000 10.279) 13.155 4.187 ( -7.728 -11.322 32.241) 35.034 4.608 ( -11.392 -14.614 15.289) 24.023 4.797 ( -5.136 -9.216 25.446) 27.546 5.132 ( -0.028 -1.137 10.986) 11.045 5.429 ( -11.009 -5.068 5.687) 13.387 5.768 ( -6.719 1.585 7.139) 9.931 6.094 ( 12.475 8.703 27.412) 31.349 6.454 ( -0.206 14.901 -6.338) 16.194 7.053 ( -1.354 -4.153 6.636) 7.944 7.604 ( 1.739 1.205 -7.016) 7.328 7.756 ( -1.733 0.428 -10.639) 10.788 8.094 ( -0.816 -1.666 -4.492) 4.860 8.273 ( 5.686 -3.505 -5.262) 8.503 8.596 ( 4.664 -4.111 -11.653) 13.208 8.753 ( 1.115 -6.682 -6.836) 9.625 8.916 ( 3.727 7.107 -0.574) 8.046 9.501 ( -2.465 -2.120 -1.374) 3.530 9.553 ( 1.254 -2.961 0.711) 3.293 9.902 ( -6.159 -4.247 -3.969) 8.469 9.978 ( 2.188 -1.343 0.488) 2.613 10.397 ( 3.129 5.294 4.298) 7.503 10.855 ( 0.070 0.757 -9.313) 9.344 11.202 ( 4.631 8.267 -1.591) 9.609 11.507 ( 2.605 2.449 -3.135) 4.755 11.731 ( -5.409 -2.195 -3.158) 6.637 12.369 ( 4.619 1.594 5.428) 7.304 12.636 ( 6.490 -5.847 6.234) 10.732 13.051 ( -5.941 0.035 -10.084) 11.703 13.707 ( 1.655 3.483 1.588) 4.171 13.799 ( 0.858 3.148 -6.708) 7.460 14.061 ( 0.390 -5.493 3.627) 6.594 14.473 ( -8.616 6.537 4.936) 11.888 14.956 ( -4.551 2.156 -3.186) 5.959 15.255 ( 2.910 1.337 6.031) 6.829 15.448 ( -9.394 -1.754 14.359) 17.248 15.596 ( -5.084 0.157 4.208) 6.602 15.835 ( -1.952 -12.983 -9.548) 16.234 16.153 ( -0.604 3.486 7.436) 8.235 17.929 ( 3.000 -0.035 2.594) 3.966 19.176 ( -1.972 3.424 7.385) 8.376 21.924 ( 12.006 -0.878 -21.205) 24.383 22.178 ( 10.090 0.563 -26.508) 28.369 24.439 ( -0.365 1.311 4.748) 4.939 25.365 ( -3.260 2.837 14.853) 15.469 25.841 ( -17.968 -3.479 -22.238) 28.801 27.087 ( 24.541 9.758 -16.377) 31.076 28.899 ( -6.688 -1.476 2.766) 7.386 29.395 ( -3.219 -2.884 0.423) 4.343 29.609 ( -5.411 -8.627 -0.025) 10.184 30.045 ( 1.518 -0.112 12.605) 12.697 30.795 ( -16.255 2.275 23.468) 28.638 31.175 ( 4.197 16.728 5.066) 17.975 31.376 ( -5.735 -5.285 10.487) 13.069 32.303 ( 10.437 -9.446 -16.317) 21.550 ======================= Grid point 143 (69/186) ======================= q-point: (-0.50 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.310 ( 10.413 32.097 0.004) 33.744 2.652 ( 7.250 0.962 -4.369) 8.519 2.705 ( -6.227 10.452 12.989) 17.797 3.235 ( 4.862 6.693 2.198) 8.560 3.510 ( -4.149 7.215 3.083) 8.876 3.964 ( -6.454 -9.182 17.628) 20.897 4.346 ( -10.859 -6.228 33.806) 36.049 4.653 ( -16.510 -6.477 25.775) 31.287 4.965 ( 0.556 -2.102 9.342) 9.592 5.207 ( -7.092 -4.065 21.391) 22.900 5.335 ( -14.897 -2.955 5.921) 16.301 5.689 ( -1.420 2.079 -5.680) 6.213 6.183 ( 8.952 17.705 -0.522) 19.846 6.300 ( -2.420 2.334 22.050) 22.304 7.130 ( -0.698 -5.017 8.344) 9.761 7.566 ( 4.631 2.923 -7.064) 8.938 7.682 ( 0.309 2.275 -11.410) 11.639 8.140 ( 1.567 -7.142 -4.815) 8.755 8.334 ( 6.760 1.118 -8.548) 10.955 8.569 ( 0.802 0.468 -14.382) 14.412 8.849 ( 2.896 3.367 -3.553) 5.687 8.961 ( 5.277 -12.303 -0.341) 13.392 9.433 ( -9.157 -3.636 -5.700) 11.382 9.567 ( -1.443 2.896 -0.723) 3.315 9.830 ( -4.700 -1.253 -3.191) 5.817 10.150 ( 7.162 -6.847 5.170) 11.176 10.381 ( -0.908 2.597 7.848) 8.316 10.795 ( -1.867 0.653 -5.844) 6.169 11.144 ( 6.173 7.972 -2.576) 10.407 11.472 ( 1.117 4.207 -4.540) 6.289 11.737 ( 0.713 -4.019 2.593) 4.835 12.412 ( 4.914 5.157 5.237) 8.841 12.831 ( 5.478 -6.954 4.031) 9.727 12.929 ( -4.871 -0.133 -11.617) 12.598 13.639 ( -1.728 3.658 -6.548) 7.696 13.780 ( 1.188 -1.376 -2.120) 2.793 14.117 ( -2.891 0.893 5.767) 6.513 14.312 ( -2.804 3.776 2.415) 5.288 14.960 ( 3.221 -4.591 -5.184) 7.637 15.274 ( -0.043 3.047 5.643) 6.413 15.438 ( -4.017 -0.854 6.045) 7.308 15.583 ( -6.161 -4.984 11.288) 13.792 15.939 ( 2.459 -8.191 -10.032) 13.183 16.128 ( -3.242 1.586 9.544) 10.203 18.007 ( 3.510 -2.247 5.443) 6.855 19.122 ( -3.810 4.017 7.784) 9.552 21.972 ( 11.168 0.227 -23.123) 25.680 22.163 ( 8.867 0.749 -25.999) 27.480 24.457 ( 3.104 2.224 6.201) 7.283 25.298 ( -7.829 4.595 8.937) 12.738 25.557 ( -18.754 -2.779 -15.840) 24.706 27.180 ( 20.699 8.267 -14.646) 26.670 28.901 ( -2.512 -5.229 3.468) 6.759 29.391 ( -2.740 -2.339 -0.585) 3.650 29.670 ( -5.087 -9.168 0.701) 10.508 30.129 ( 1.773 0.450 14.690) 14.804 30.666 ( -16.931 1.176 21.791) 27.620 31.026 ( 2.380 14.087 4.393) 14.946 31.388 ( -8.718 -2.921 9.945) 13.544 32.514 ( 17.012 -7.301 -17.584) 25.532 ======================= Grid point 144 (70/186) ======================= q-point: (-0.38 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.962 ( 9.417 34.882 2.612) 36.225 2.403 ( -7.243 23.301 10.767) 26.671 2.835 ( 10.574 -6.829 -6.815) 14.314 3.189 ( -7.232 0.497 2.013) 7.523 3.389 ( 3.998 13.115 9.138) 16.476 4.046 ( -11.452 -6.089 19.229) 23.195 4.409 ( -14.754 -3.419 34.801) 37.953 4.657 ( -12.362 -4.564 23.580) 27.012 4.920 ( -0.461 10.717 3.040) 11.149 5.154 ( -16.644 2.434 24.012) 29.318 5.330 ( -6.390 -7.165 8.385) 12.747 5.630 ( -4.290 -3.079 -1.648) 5.532 5.979 ( 0.182 12.991 -8.970) 15.788 6.399 ( 4.384 5.259 28.690) 29.496 7.194 ( -6.020 -1.390 4.018) 7.370 7.512 ( 3.892 4.695 -9.152) 10.997 7.703 ( 8.919 -3.308 -7.546) 12.142 8.220 ( 5.662 0.851 -12.687) 13.919 8.358 ( 3.262 -3.355 -12.869) 13.693 8.530 ( 2.426 -1.576 -5.487) 6.203 8.813 ( 2.799 3.715 -4.363) 6.377 9.190 ( 2.230 -10.062 0.113) 10.306 9.315 ( -8.816 -1.070 -6.545) 11.032 9.486 ( -2.926 1.547 -1.857) 3.795 9.797 ( -1.231 -1.744 -5.081) 5.511 10.301 ( 2.179 -1.369 7.237) 7.681 10.394 ( -2.838 -3.453 6.741) 8.088 10.742 ( -4.225 -1.262 -1.668) 4.714 11.128 ( 8.071 6.741 -0.572) 10.531 11.412 ( 0.679 2.050 -4.312) 4.822 11.852 ( 4.828 -4.146 3.948) 7.489 12.397 ( 3.560 8.251 4.512) 10.055 12.792 ( -4.964 1.464 -12.902) 13.901 13.008 ( 4.613 -5.378 3.077) 7.725 13.512 ( -4.269 4.672 -7.004) 9.440 13.828 ( 1.180 -5.424 -5.409) 7.751 14.074 ( 0.542 2.613 5.697) 6.291 14.314 ( 1.248 0.104 2.347) 2.660 15.079 ( 6.455 -6.249 -4.704) 10.141 15.249 ( -2.725 -0.038 2.708) 3.842 15.431 ( -0.785 -0.582 3.711) 3.837 15.667 ( -5.697 -8.816 11.053) 15.243 15.983 ( 3.146 3.201 -5.185) 6.858 16.179 ( -2.386 -9.798 10.354) 14.454 18.116 ( 1.092 -3.768 7.925) 8.843 19.053 ( -4.926 3.242 8.638) 10.459 21.975 ( 10.122 1.786 -27.004) 28.894 22.142 ( 8.329 0.591 -24.765) 26.135 24.520 ( 6.173 2.380 8.239) 10.567 25.144 ( -9.614 3.742 0.657) 10.338 25.299 ( -15.306 1.227 -4.285) 15.942 27.234 ( 14.183 6.912 -13.951) 21.062 29.006 ( 0.644 -8.804 3.492) 9.493 29.391 ( -0.756 -1.977 -1.388) 2.531 29.720 ( -5.434 -6.903 0.543) 8.802 30.212 ( 2.448 2.145 14.862) 15.215 30.534 ( -14.199 2.849 16.659) 22.074 30.910 ( -1.938 6.799 9.277) 11.664 31.340 ( -8.050 -0.143 7.898) 11.278 32.754 ( 17.878 -6.533 -17.418) 25.801 ======================= Grid point 145 (71/186) ======================= q-point: (-0.25 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.663 ( 10.974 30.649 5.924) 33.090 1.998 ( -7.165 29.163 19.133) 35.608 2.973 ( 2.110 1.284 7.018) 7.440 3.112 ( -6.215 -4.141 -4.800) 8.877 3.348 ( 10.067 10.401 7.546) 16.324 4.042 ( -11.298 -3.777 15.200) 19.312 4.400 ( -17.454 -0.212 35.623) 39.670 4.685 ( -11.579 -3.843 25.792) 28.532 4.765 ( 1.192 12.384 1.743) 12.562 5.045 ( -9.842 3.069 20.000) 22.501 5.334 ( -5.286 3.937 8.109) 10.449 5.562 ( -6.329 1.575 0.207) 6.525 5.919 ( 1.060 -9.906 -2.541) 10.282 6.525 ( 5.109 4.967 26.688) 27.622 7.017 ( -11.612 7.007 -3.823) 14.091 7.515 ( 5.356 2.189 -2.822) 6.437 7.844 ( 9.377 -2.981 -5.402) 11.225 8.125 ( 2.524 7.596 -16.586) 18.417 8.348 ( 3.261 -0.970 -17.735) 18.059 8.628 ( 0.757 -5.882 1.804) 6.199 8.784 ( 6.423 4.878 -9.658) 12.583 9.134 ( -8.515 -0.038 -5.201) 9.978 9.283 ( -2.536 1.734 1.657) 3.490 9.483 ( -0.967 -5.470 -3.327) 6.474 9.792 ( 0.774 -2.479 -6.596) 7.089 10.350 ( -1.158 -1.033 1.775) 2.358 10.463 ( -0.988 -5.155 12.050) 13.144 10.700 ( -5.134 -1.884 -1.030) 5.565 11.129 ( 7.185 7.676 -2.016) 10.706 11.409 ( 0.660 -3.128 -1.781) 3.659 11.992 ( 5.526 -3.330 3.539) 7.359 12.325 ( 0.864 8.955 3.997) 9.844 12.633 ( -5.254 3.592 -10.786) 12.523 13.127 ( 2.087 -3.846 1.400) 4.594 13.360 ( -1.993 5.747 -4.188) 7.385 13.897 ( 1.972 -6.079 -8.243) 10.430 14.120 ( 2.452 0.761 8.709) 9.079 14.323 ( 2.222 1.448 -2.293) 3.506 15.228 ( 5.855 -6.153 -3.587) 9.220 15.250 ( -2.592 -5.223 -1.919) 6.139 15.477 ( 1.688 -0.731 6.085) 6.357 15.765 ( -4.741 -10.185 2.940) 11.612 15.915 ( -1.345 5.420 1.018) 5.676 16.424 ( -0.448 -19.467 11.720) 22.727 18.175 ( -7.408 -2.652 9.884) 12.633 19.003 ( -4.172 1.200 9.183) 10.158 21.927 ( 9.055 3.049 -30.011) 31.496 22.126 ( 8.716 0.429 -24.399) 25.913 24.602 ( 3.547 2.698 7.844) 9.022 25.026 ( -0.351 2.849 4.486) 5.325 25.119 ( -4.820 2.715 1.506) 5.733 27.209 ( 5.308 5.215 -13.835) 15.710 29.160 ( -1.389 -10.143 3.345) 10.770 29.430 ( 4.705 -2.182 -2.061) 5.581 29.711 ( -6.188 -2.282 -0.414) 6.608 30.230 ( 0.402 9.729 6.794) 11.874 30.414 ( -7.353 1.244 15.597) 17.288 30.907 ( -4.938 -3.540 17.652) 18.669 31.280 ( -5.117 1.115 6.316) 8.205 32.945 ( 11.240 -4.739 -18.477) 22.140 ======================= Grid point 146 (72/186) ======================= q-point: (-0.12 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.421 ( 0.845 18.905 16.317) 24.987 1.792 ( 15.198 21.751 26.810) 37.720 3.002 ( 2.019 7.792 27.591) 28.741 3.008 ( -5.268 2.988 -8.437) 10.386 3.448 ( 9.511 -1.424 -0.499) 9.630 4.023 ( -10.183 -4.460 10.094) 15.016 4.302 ( -17.230 4.480 28.296) 33.431 4.612 ( 2.368 15.779 2.971) 16.230 4.721 ( -12.508 -4.716 29.210) 32.123 5.007 ( -5.583 4.120 21.890) 22.963 5.168 ( -4.127 9.283 9.021) 13.586 5.607 ( -0.417 -8.806 3.736) 9.575 6.105 ( -1.079 -15.788 -3.937) 16.307 6.636 ( 1.745 3.529 25.352) 25.656 6.765 ( -7.620 5.832 -4.462) 10.583 7.512 ( 5.638 8.159 -0.408) 9.926 7.913 ( 3.664 3.387 -8.754) 10.076 8.012 ( 5.154 0.275 -14.058) 14.976 8.339 ( 6.468 0.168 -12.281) 13.881 8.650 ( -4.286 0.074 -0.308) 4.297 8.688 ( 1.167 8.166 -13.568) 15.879 9.118 ( 3.792 -4.196 -2.363) 6.130 9.207 ( -3.185 1.499 1.306) 3.755 9.511 ( -1.403 -3.344 -3.908) 5.331 9.829 ( 1.944 -3.841 -5.164) 6.723 10.292 ( -6.027 1.658 -1.374) 6.400 10.587 ( -0.719 3.170 3.918) 5.090 10.694 ( 0.408 -8.558 8.823) 12.298 11.078 ( 4.504 6.189 -7.830) 10.950 11.500 ( 0.435 -8.367 2.104) 8.639 12.076 ( 3.253 5.299 4.644) 7.760 12.240 ( -1.051 1.799 -1.228) 2.418 12.474 ( -5.168 3.441 -6.023) 8.650 13.174 ( 1.101 -0.805 1.992) 2.414 13.312 ( 3.322 2.696 2.294) 4.854 13.953 ( 1.565 -4.534 -9.641) 10.768 14.140 ( -1.290 2.980 4.918) 5.893 14.343 ( 5.599 0.948 -0.882) 5.747 15.307 ( -1.372 -8.550 -4.122) 9.590 15.345 ( 1.283 -5.952 -4.034) 7.303 15.522 ( 1.315 0.718 5.667) 5.862 15.772 ( -3.912 3.036 -2.398) 5.502 15.912 ( 0.346 -5.711 4.441) 7.243 16.710 ( -16.964 -24.599 6.950) 30.678 18.065 ( -17.018 1.989 11.816) 20.814 19.013 ( -0.691 -0.825 9.005) 9.070 21.847 ( 9.059 3.686 -30.524) 32.053 22.121 ( 9.711 0.249 -24.816) 26.650 24.587 ( -3.027 3.075 7.362) 8.533 24.999 ( -2.215 3.205 13.362) 13.919 25.334 ( 33.722 -5.103 -1.888) 34.158 27.096 ( -4.040 2.439 -14.117) 14.885 29.245 ( -7.071 -7.918 3.264) 11.106 29.552 ( 6.119 -3.355 -2.634) 7.459 29.634 ( -2.862 2.074 0.215) 3.541 30.027 ( -3.966 14.283 -0.505) 14.832 30.487 ( 3.324 -1.831 16.379) 16.813 31.034 ( -4.578 -9.939 19.747) 22.576 31.248 ( -2.351 0.877 6.044) 6.544 32.931 ( -5.304 1.800 -17.699) 18.564 ======================= Grid point 149 (73/186) ======================= q-point: ( 0.25 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.608 ( 14.513 0.000 10.090) 17.676 2.795 ( -0.778 -0.000 25.929) 25.940 3.115 ( 12.743 0.000 -0.978) 12.780 3.510 ( 5.545 0.000 12.959) 14.095 3.620 ( -12.729 -0.000 8.632) 15.380 3.783 ( 4.477 0.000 8.395) 9.514 4.011 ( 5.747 0.000 10.931) 12.350 4.216 ( -3.577 -0.000 -5.985) 6.972 4.645 ( -21.164 -0.000 42.425) 47.410 5.143 ( 6.466 0.000 2.765) 7.033 5.344 ( -13.280 -0.000 16.601) 21.259 5.763 ( -7.891 -0.000 23.862) 25.133 6.254 ( 6.955 0.000 16.939) 18.311 6.860 ( 0.951 0.000 4.309) 4.413 6.880 ( -0.626 -0.000 -7.964) 7.988 7.528 ( 11.835 0.000 -10.646) 15.919 7.797 ( -9.195 -0.000 -7.543) 11.893 8.121 ( -4.948 -0.000 -6.598) 8.248 8.129 ( 8.621 0.000 -6.368) 10.717 8.496 ( 6.109 0.000 -3.179) 6.887 8.711 ( -1.558 -0.000 -14.138) 14.224 9.088 ( 12.120 0.000 5.101) 13.150 9.461 ( -2.674 -0.000 4.449) 5.191 9.492 ( -3.221 -0.000 0.736) 3.304 9.792 ( -5.059 -0.000 -4.318) 6.651 9.952 ( -7.974 -0.000 -3.234) 8.605 10.550 ( 13.028 0.000 -2.706) 13.306 10.871 ( 0.884 0.000 -5.400) 5.472 11.221 ( -2.369 -0.000 -17.910) 18.066 11.647 ( 4.601 0.000 9.195) 10.282 11.666 ( -3.439 -0.000 -8.543) 9.209 12.376 ( 4.763 0.000 5.723) 7.446 12.553 ( 6.093 0.000 7.793) 9.892 13.048 ( -8.601 -0.000 -8.106) 11.819 13.825 ( 1.262 0.000 1.226) 1.759 13.886 ( 5.988 0.000 4.621) 7.564 13.891 ( -1.376 -0.000 -7.945) 8.063 14.560 ( -3.402 -0.000 1.929) 3.911 15.082 ( -29.388 -0.000 21.510) 36.419 15.200 ( 0.512 0.000 0.322) 0.605 15.477 ( -6.804 -0.000 12.613) 14.331 15.554 ( 8.927 0.000 -13.592) 16.261 15.609 ( -4.781 -0.000 1.537) 5.022 16.199 ( -1.357 -0.000 6.440) 6.581 17.944 ( 4.325 0.000 -1.971) 4.753 19.229 ( -1.952 -0.000 7.950) 8.186 21.909 ( 12.381 0.000 -19.866) 23.408 22.184 ( 10.202 0.000 -27.091) 28.948 24.457 ( 0.094 0.000 5.137) 5.138 25.407 ( -2.254 -0.000 16.495) 16.648 25.792 ( -16.939 -0.000 -22.018) 27.781 27.251 ( 23.533 0.000 -23.158) 33.017 28.871 ( -10.083 -0.000 1.514) 10.196 29.340 ( -2.591 -0.000 0.453) 2.630 29.483 ( -4.857 -0.000 3.041) 5.731 30.044 ( 1.440 0.000 13.488) 13.565 30.847 ( -18.728 -0.000 25.674) 31.778 31.272 ( -3.103 -0.000 7.266) 7.901 31.521 ( 4.583 0.000 2.187) 5.078 32.067 ( 9.271 0.000 -11.670) 14.905 ======================= Grid point 150 (74/186) ======================= q-point: ( 0.38 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.734 ( 7.469 5.971 5.513) 11.038 2.853 ( -7.269 3.058 26.547) 27.694 3.144 ( 13.066 18.695 2.047) 22.900 3.468 ( -0.391 5.938 2.556) 6.477 3.662 ( -6.263 -7.470 9.707) 13.757 3.752 ( 2.236 11.413 1.826) 11.773 4.194 ( 4.212 -4.043 21.260) 22.047 4.343 ( -2.541 -16.816 3.002) 17.270 4.653 ( -16.342 -10.678 35.099) 40.163 5.234 ( 3.528 2.655 12.234) 13.007 5.279 ( -13.850 -1.116 23.012) 26.881 5.720 ( -3.634 -0.096 -3.115) 4.787 6.392 ( -1.157 3.225 23.015) 23.269 6.689 ( 6.606 15.655 -3.477) 17.344 6.965 ( -3.565 -6.935 3.638) 8.605 7.608 ( 3.541 1.103 -9.599) 10.291 7.697 ( 1.048 -2.430 -9.735) 10.088 8.031 ( -2.638 -0.167 -6.734) 7.234 8.232 ( 6.835 -4.976 -11.148) 13.991 8.593 ( 6.502 -1.939 -5.701) 8.863 8.655 ( 1.582 -3.502 -6.324) 7.400 9.139 ( 5.024 10.959 4.042) 12.715 9.339 ( -9.731 -2.389 -4.579) 11.017 9.567 ( -2.416 0.507 7.607) 7.998 9.791 ( 1.542 -5.301 -1.036) 5.618 9.897 ( -3.774 -6.718 1.496) 7.849 10.601 ( 7.088 9.335 -0.298) 11.725 10.840 ( 1.111 2.545 -9.413) 9.814 11.141 ( -2.503 -6.797 -16.113) 17.666 11.563 ( -1.948 1.646 -9.439) 9.777 11.756 ( 6.839 3.644 10.139) 12.761 12.482 ( 6.890 0.402 6.234) 9.300 12.678 ( 4.590 -3.004 7.154) 9.015 12.895 ( -9.651 -1.275 -8.646) 13.020 13.763 ( 0.356 4.718 -6.766) 8.256 13.825 ( 0.383 2.374 -5.359) 5.874 14.043 ( 2.626 -4.024 9.827) 10.939 14.479 ( -5.749 5.285 2.207) 8.115 14.868 ( -11.844 -1.325 8.129) 14.426 15.251 ( -2.033 -6.583 1.424) 7.035 15.421 ( -6.521 3.221 13.644) 15.461 15.540 ( -5.088 0.632 0.086) 5.127 15.690 ( 7.796 -6.820 -5.730) 11.837 16.187 ( -3.818 1.129 6.232) 7.395 17.998 ( 6.362 0.577 -1.753) 6.624 19.214 ( -4.135 2.049 8.497) 9.670 21.970 ( 11.261 -0.194 -19.307) 22.352 22.174 ( 8.971 0.111 -28.055) 29.455 24.499 ( 2.908 0.796 6.310) 6.994 25.403 ( -7.003 2.594 10.847) 13.169 25.502 ( -14.601 -1.363 -15.553) 21.377 27.377 ( 19.420 4.724 -22.227) 29.891 28.782 ( -7.540 -2.810 1.911) 8.270 29.322 ( -2.737 -1.974 -0.406) 3.399 29.480 ( -3.095 -3.767 5.279) 7.186 30.134 ( 1.357 0.013 16.885) 16.939 30.703 ( -19.688 1.296 24.370) 31.356 31.280 ( -5.195 -2.543 7.635) 9.578 31.475 ( 4.712 13.812 0.854) 14.618 32.236 ( 12.446 -10.640 -15.365) 22.454 ======================= Grid point 151 (75/186) ======================= q-point: (-0.50 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.738 ( 5.149 7.968 -4.431) 10.471 2.791 ( -4.214 6.222 18.154) 19.647 2.980 ( 11.595 27.894 4.734) 30.577 3.352 ( -5.618 9.721 2.070) 11.417 3.682 ( 8.147 7.228 2.763) 11.236 3.749 ( -13.466 -11.626 18.724) 25.828 4.341 ( -2.357 -1.201 18.711) 18.897 4.486 ( -10.126 -8.110 22.810) 26.241 4.828 ( -8.497 -17.454 13.632) 23.721 5.175 ( -21.874 0.928 37.820) 43.700 5.288 ( 3.934 6.851 8.026) 11.262 5.660 ( -1.868 1.918 -8.144) 8.573 6.313 ( -3.528 7.482 0.699) 8.302 6.663 ( 11.670 12.359 15.945) 23.306 7.035 ( -4.437 -7.656 5.485) 10.411 7.596 ( 3.228 -1.110 -6.829) 7.635 7.671 ( 1.477 1.293 -15.253) 15.378 8.013 ( -1.083 -5.848 -8.055) 10.013 8.329 ( 8.748 -3.791 -13.838) 16.805 8.589 ( 3.331 2.876 -8.025) 9.153 8.845 ( 8.849 -9.980 0.323) 13.342 9.032 ( 0.855 10.509 3.592) 11.139 9.262 ( -5.816 -2.926 -2.515) 6.979 9.502 ( -8.063 -0.698 0.590) 8.115 9.782 ( -2.684 1.170 -1.507) 3.294 10.092 ( 2.843 -11.681 4.967) 13.008 10.529 ( 1.796 9.780 6.208) 11.723 10.744 ( -2.008 2.122 -12.574) 12.908 11.173 ( 1.915 -5.232 -6.819) 8.806 11.479 ( -0.908 1.243 -9.913) 10.032 11.831 ( 6.871 4.133 8.157) 11.438 12.566 ( 5.473 3.876 4.917) 8.316 12.758 ( -6.947 -2.880 -7.159) 10.383 12.835 ( 3.128 -6.305 2.548) 7.485 13.661 ( 0.303 5.954 -7.409) 9.510 13.779 ( 0.089 1.623 -2.409) 2.906 14.130 ( -1.322 -0.569 8.034) 8.162 14.352 ( -1.987 4.419 3.224) 5.820 14.887 ( 0.989 -7.493 -2.899) 8.095 15.286 ( -4.845 -0.867 -1.255) 5.079 15.373 ( -8.208 -4.042 13.086) 15.967 15.494 ( -3.069 -0.535 4.595) 5.552 15.863 ( 7.824 -6.502 -2.439) 10.462 16.137 ( -5.754 1.485 6.453) 8.772 18.073 ( 6.488 0.064 -0.154) 6.490 19.154 ( -5.768 3.400 9.132) 11.323 22.007 ( 9.668 0.582 -21.116) 23.231 22.148 ( 8.371 -0.062 -28.132) 29.351 24.566 ( 4.250 1.129 7.906) 9.047 25.236 ( -8.250 2.545 -10.465) 13.566 25.346 ( -10.845 1.895 7.594) 13.374 27.422 ( 14.934 5.823 -20.696) 26.177 28.782 ( -4.169 -6.654 2.410) 8.214 29.318 ( -2.193 -2.881 -1.416) 3.888 29.544 ( -1.570 -5.145 6.733) 8.618 30.239 ( 1.655 0.310 19.755) 19.827 30.562 ( -17.228 0.583 21.611) 27.644 31.239 ( -2.287 6.796 -0.594) 7.195 31.343 ( -1.918 7.821 8.937) 12.030 32.479 ( 12.403 -12.526 -18.077) 25.249 ======================= Grid point 152 (76/186) ======================= q-point: (-0.38 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.530 ( 5.824 25.525 -3.593) 26.426 2.770 ( 6.030 26.027 13.228) 29.812 2.842 ( 4.844 -2.841 -3.031) 6.381 3.113 ( -12.388 6.471 4.307) 14.625 3.692 ( 7.158 9.259 3.200) 12.133 3.817 ( -15.751 -10.779 20.579) 28.067 4.383 ( -6.158 -0.796 21.794) 22.661 4.565 ( -9.909 -5.217 26.618) 28.878 4.954 ( -9.569 -9.382 4.063) 14.003 5.108 ( -11.732 3.636 34.005) 36.155 5.255 ( -3.151 2.606 16.577) 17.074 5.533 ( -6.657 1.924 -4.256) 8.132 6.154 ( 1.657 14.306 -1.231) 14.454 6.742 ( 9.549 9.578 20.437) 24.507 7.064 ( -9.189 -4.472 0.557) 10.235 7.553 ( 0.376 1.970 -8.548) 8.781 7.719 ( 9.467 -5.587 -10.205) 15.000 8.061 ( -1.115 -9.694 -15.388) 18.221 8.423 ( 10.274 1.272 -11.647) 15.583 8.537 ( 1.386 2.132 -6.313) 6.806 8.911 ( 2.739 6.597 0.270) 7.148 9.125 ( 7.899 -7.527 2.315) 11.154 9.201 ( -4.404 0.727 -3.587) 5.726 9.430 ( -5.258 -1.774 0.705) 5.594 9.728 ( -2.340 -1.296 -5.593) 6.200 10.252 ( 0.256 -6.388 1.561) 6.581 10.455 ( -2.241 6.199 10.492) 12.391 10.639 ( -5.128 -1.312 -6.423) 8.323 11.247 ( 4.557 -0.798 0.387) 4.643 11.411 ( -0.052 1.490 -9.108) 9.230 11.905 ( 4.574 -0.459 4.339) 6.321 12.550 ( 1.180 6.777 1.613) 7.066 12.669 ( -5.688 -1.559 -8.810) 10.602 12.986 ( 4.083 -6.361 0.400) 7.569 13.540 ( 0.228 7.368 -4.851) 8.824 13.774 ( 1.425 -1.677 -3.570) 4.194 14.143 ( 0.624 1.000 7.963) 8.050 14.343 ( 0.992 0.264 2.276) 2.497 15.025 ( 4.500 -9.031 -6.600) 12.056 15.186 ( -6.313 0.594 -1.284) 6.470 15.428 ( -5.033 -6.955 10.177) 13.314 15.511 ( -3.393 -2.925 7.424) 8.671 16.006 ( 2.879 -0.943 -5.032) 5.873 16.100 ( -3.244 -4.351 11.050) 12.311 18.144 ( 2.864 0.070 2.168) 3.592 19.072 ( -6.007 3.381 9.427) 11.678 21.994 ( 8.177 1.824 -24.935) 26.305 22.129 ( 8.715 -0.298 -26.629) 28.021 24.640 ( 1.981 0.625 8.334) 8.589 25.109 ( 2.605 3.017 -5.513) 6.803 25.210 ( -9.537 3.482 7.765) 12.782 27.389 ( 8.081 6.678 -20.092) 22.662 28.874 ( -1.837 -9.748 2.814) 10.311 29.340 ( 0.171 -4.021 -2.588) 4.785 29.626 ( -0.898 -3.556 7.233) 8.110 30.350 ( 1.968 1.381 21.085) 21.222 30.455 ( -13.968 0.175 18.163) 22.913 31.057 ( -1.841 12.644 0.919) 12.810 31.296 ( -5.030 0.702 9.355) 10.644 32.702 ( 9.229 -12.207 -20.246) 25.379 ======================= Grid point 153 (77/186) ======================= q-point: (-0.25 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.164 ( -0.757 31.018 -2.345) 31.116 2.519 ( 8.602 28.923 16.727) 34.501 2.911 ( -4.489 -6.261 -7.126) 10.494 3.020 ( -0.480 -2.762 5.253) 5.954 3.644 ( 5.216 9.125 -0.056) 10.511 3.840 ( -14.667 -8.637 16.476) 23.689 4.416 ( -9.170 2.102 32.432) 33.769 4.636 ( -7.212 -2.774 25.753) 26.888 4.953 ( -5.052 1.494 15.611) 16.476 5.014 ( -5.592 6.572 13.788) 16.266 5.329 ( -3.672 -3.502 18.715) 19.390 5.451 ( -7.566 -4.029 -0.366) 8.579 5.983 ( 3.365 13.303 3.794) 14.236 6.793 ( -2.827 7.940 20.461) 22.129 6.931 ( -4.222 2.989 -6.827) 8.566 7.553 ( 2.054 -2.313 -2.139) 3.761 7.882 ( 9.212 -5.064 -5.678) 11.948 8.063 ( -0.027 -3.841 -22.341) 22.669 8.351 ( -1.567 5.382 -5.840) 8.095 8.602 ( 7.453 -3.318 -8.206) 11.571 8.905 ( 7.830 4.931 -6.637) 11.387 9.049 ( -4.834 2.756 -1.395) 5.737 9.303 ( 2.725 1.938 3.277) 4.682 9.415 ( 0.246 -2.929 -2.418) 3.806 9.717 ( 0.384 -3.778 -7.984) 8.841 10.299 ( -2.131 -1.869 0.077) 2.836 10.446 ( -2.480 -4.454 10.058) 11.276 10.595 ( -5.140 -2.390 2.632) 6.250 11.272 ( 1.037 5.679 -1.158) 5.888 11.357 ( 0.442 -2.292 -7.015) 7.394 12.017 ( 4.559 -4.578 3.452) 7.325 12.431 ( -3.733 7.950 -1.918) 8.990 12.565 ( -4.152 1.785 -7.121) 8.434 13.103 ( 3.848 -4.146 -3.132) 6.466 13.447 ( 3.003 6.783 0.220) 7.422 13.816 ( 1.891 -4.155 -6.141) 7.652 14.195 ( 0.501 0.614 9.440) 9.473 14.364 ( 2.877 0.242 -0.009) 2.887 15.067 ( -7.233 -5.925 -4.986) 10.596 15.215 ( 4.583 -5.151 -3.721) 7.835 15.536 ( 0.809 0.592 10.227) 10.276 15.549 ( -6.166 -13.168 5.414) 15.515 15.939 ( -4.478 2.990 1.857) 5.696 16.249 ( -0.437 -9.668 5.435) 11.099 18.133 ( -5.301 2.724 5.476) 8.094 19.018 ( -3.403 1.414 8.725) 9.471 21.937 ( 7.828 2.737 -27.184) 28.421 22.123 ( 9.431 -0.223 -25.897) 27.562 24.645 ( -4.752 1.084 6.060) 7.776 25.103 ( -4.340 3.879 11.515) 12.902 25.236 ( 21.234 -1.599 -1.702) 21.362 27.245 ( -0.668 7.296 -19.761) 21.075 28.996 ( -3.374 -9.501 3.265) 10.597 29.419 ( 3.587 -5.923 -3.632) 7.819 29.674 ( -0.164 0.312 6.390) 6.399 30.342 ( -9.365 5.757 9.747) 14.692 30.453 ( 1.264 0.655 20.330) 20.380 30.919 ( -4.893 3.982 12.130) 13.672 31.279 ( -2.077 0.667 6.935) 7.270 32.825 ( 1.628 -8.926 -21.968) 23.768 ======================= Grid point 154 (78/186) ======================= q-point: (-0.12 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.763 ( -0.919 21.149 10.439) 23.602 2.420 ( 16.688 21.158 15.976) 31.327 2.857 ( -6.961 -3.850 -9.352) 12.277 3.118 ( -0.071 -4.191 9.565) 10.443 3.607 ( 5.141 3.923 -3.986) 7.596 3.848 ( -10.580 -6.401 11.534) 16.910 4.367 ( -12.699 8.567 34.377) 37.635 4.691 ( -6.932 -0.049 26.517) 27.408 4.867 ( 1.000 14.848 12.768) 19.608 5.023 ( -5.975 -3.231 18.490) 19.698 5.336 ( -4.336 7.966 16.670) 18.978 5.501 ( 2.848 -10.369 2.091) 10.954 5.950 ( -0.484 -0.615 4.055) 4.129 6.603 ( -15.632 2.588 4.997) 16.614 6.929 ( 7.111 5.964 6.819) 11.517 7.607 ( 1.639 -1.779 -0.295) 2.437 7.956 ( 2.084 4.666 -15.385) 16.212 8.025 ( 7.264 -2.719 -6.290) 9.986 8.285 ( -3.113 -4.225 -5.605) 7.678 8.644 ( 5.191 3.364 -9.437) 11.284 8.784 ( 0.501 10.003 -9.667) 13.920 9.109 ( 4.907 -4.083 -4.086) 7.580 9.227 ( 0.524 5.179 2.403) 5.733 9.471 ( 4.401 -1.950 -3.495) 5.949 9.762 ( 1.540 -4.591 -4.853) 6.855 10.254 ( -4.639 2.404 0.591) 5.258 10.533 ( -6.089 -3.712 -1.634) 7.316 10.652 ( 2.473 -8.888 15.768) 18.268 11.134 ( -2.710 4.900 -11.106) 12.438 11.420 ( 2.011 -5.181 -0.219) 5.562 12.157 ( 4.102 -4.624 2.530) 6.679 12.228 ( -7.207 8.343 -5.271) 12.220 12.467 ( -0.546 4.257 -2.154) 4.802 13.176 ( 3.127 -2.759 -3.737) 5.600 13.435 ( 5.020 4.523 5.263) 8.565 13.862 ( 0.921 -4.534 -8.326) 9.525 14.181 ( -2.436 3.643 3.089) 5.361 14.429 ( 4.555 -0.389 4.854) 6.668 15.069 ( -6.443 -11.097 -5.147) 13.826 15.278 ( -1.867 -2.977 -2.171) 4.131 15.565 ( -0.483 -0.513 7.804) 7.836 15.670 ( -5.352 -5.984 1.594) 8.184 15.905 ( 0.367 -1.976 7.767) 8.023 16.332 ( -10.172 -7.034 1.966) 12.522 18.000 ( -9.726 5.174 8.394) 13.850 19.038 ( 0.160 -1.361 7.685) 7.806 21.872 ( 9.065 3.116 -26.951) 28.605 22.129 ( 10.426 -0.250 -25.830) 27.856 24.573 ( -7.455 1.016 5.031) 9.051 25.104 ( 1.337 2.149 14.505) 14.725 25.666 ( 35.224 -8.843 -5.483) 36.729 26.995 ( -8.865 6.156 -18.479) 21.400 29.064 ( -6.269 -7.081 3.441) 10.064 29.512 ( -0.247 -3.390 -2.054) 3.971 29.700 ( 4.255 1.464 3.985) 6.011 30.136 ( -7.351 11.371 1.768) 13.655 30.589 ( 4.372 -2.771 17.212) 17.973 30.939 ( -8.150 -5.785 22.336) 24.470 31.294 ( 2.125 1.625 5.421) 6.045 32.749 ( -8.370 -0.778 -20.720) 22.360 ======================= Grid point 158 (79/186) ======================= q-point: ( 0.38 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.846 ( 0.205 0.000 3.062) 3.069 2.924 ( -10.862 -0.000 37.565) 39.103 3.373 ( -3.864 -0.000 6.797) 7.818 3.443 ( 0.956 0.000 5.278) 5.364 3.652 ( 2.831 0.000 0.457) 2.868 4.002 ( 6.071 0.000 -3.017) 6.779 4.126 ( 2.821 0.000 -9.080) 9.508 4.357 ( 7.736 0.000 19.102) 20.609 4.509 ( -21.126 -0.000 41.328) 46.414 5.196 ( -21.726 -0.000 43.440) 48.570 5.414 ( 8.757 0.000 8.880) 12.471 5.666 ( 1.009 0.000 -10.613) 10.661 6.416 ( -7.982 -0.000 11.332) 13.861 6.821 ( -4.749 -0.000 0.815) 4.818 6.953 ( 8.505 0.000 6.183) 10.515 7.589 ( -2.341 -0.000 -5.060) 5.576 7.645 ( 3.919 0.000 -18.665) 19.072 7.961 ( -2.490 -0.000 -7.476) 7.880 8.265 ( 12.631 0.000 -12.889) 18.047 8.621 ( 3.586 0.000 -7.819) 8.602 8.679 ( 9.164 0.000 1.837) 9.346 9.185 ( -7.949 -0.000 -2.206) 8.250 9.243 ( -4.697 -0.000 5.970) 7.596 9.646 ( -2.368 -0.000 -7.253) 7.630 9.739 ( 4.809 0.000 18.694) 19.302 9.807 ( -3.776 -0.000 -0.181) 3.780 10.740 ( 5.256 0.000 -8.566) 10.050 10.887 ( 3.548 0.000 -1.041) 3.698 10.922 ( -4.518 -0.000 -17.216) 17.799 11.479 ( -1.989 -0.000 -12.706) 12.860 11.941 ( 7.982 0.000 8.616) 11.745 12.615 ( 8.362 0.000 5.404) 9.957 12.710 ( -10.999 -0.000 -5.919) 12.491 12.729 ( 1.502 0.000 5.677) 5.873 13.784 ( 1.345 0.000 -5.900) 6.051 13.810 ( 1.047 0.000 -7.312) 7.386 14.094 ( 0.192 0.000 11.200) 11.201 14.478 ( -1.648 -0.000 -2.413) 2.922 14.732 ( -13.893 -0.000 17.664) 22.473 15.166 ( 0.865 0.000 -10.034) 10.071 15.395 ( -10.284 -0.000 9.569) 14.047 15.507 ( -2.440 -0.000 5.845) 6.333 15.764 ( 10.840 0.000 -0.608) 10.857 16.155 ( -6.201 -0.000 4.729) 7.798 18.081 ( 7.916 0.000 -3.784) 8.774 19.206 ( -6.098 -0.000 9.586) 11.361 22.013 ( 9.629 0.000 -18.724) 21.055 22.146 ( 8.347 0.000 -29.716) 30.866 24.582 ( 3.551 0.000 7.682) 8.463 25.272 ( -7.162 -0.000 -14.246) 15.945 25.377 ( -9.692 -0.000 11.162) 14.782 27.509 ( 14.357 0.000 -24.230) 28.164 28.684 ( -5.590 -0.000 2.472) 6.113 29.270 ( -2.392 -0.000 -1.704) 2.937 29.470 ( -0.588 -0.000 9.780) 9.798 30.242 ( 1.433 0.000 20.942) 20.991 30.575 ( -18.655 -0.000 22.655) 29.347 31.236 ( -5.496 -0.000 8.826) 10.397 31.639 ( 4.728 0.000 -3.942) 6.156 32.214 ( 9.697 0.000 -16.489) 19.129 ======================= Grid point 159 (80/186) ======================= q-point: (-0.50 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.814 ( -2.876 2.321 1.540) 4.003 2.896 ( -8.895 5.865 26.623) 28.676 3.356 ( -11.031 -4.092 11.005) 16.110 3.424 ( 2.695 12.566 5.429) 13.951 3.633 ( 0.759 9.991 0.410) 10.028 3.850 ( 3.553 6.502 -2.434) 7.799 4.324 ( -0.892 -10.207 2.777) 10.616 4.489 ( 0.555 -1.334 10.078) 10.181 4.536 ( -13.470 -9.135 34.375) 38.033 5.125 ( -21.926 0.616 50.293) 54.868 5.488 ( 3.064 7.436 7.106) 10.732 5.612 ( -3.992 0.841 -5.286) 6.677 6.396 ( 3.477 3.498 6.132) 7.869 6.809 ( -2.869 -5.713 0.032) 6.393 7.037 ( 4.248 4.875 9.003) 11.085 7.564 ( -1.423 -1.348 -5.674) 6.003 7.585 ( 2.367 -2.703 -19.288) 19.620 7.907 ( -0.726 -1.211 -9.414) 9.519 8.393 ( 14.358 -0.583 -11.195) 18.216 8.603 ( 0.758 1.009 -9.569) 9.651 8.884 ( 13.431 -5.636 2.147) 14.723 9.101 ( -4.143 1.978 3.276) 5.640 9.212 ( -3.080 -1.757 5.251) 6.336 9.468 ( -5.572 8.799 -0.224) 10.417 9.738 ( -4.139 1.242 -4.166) 6.002 9.998 ( 2.655 -11.333 12.716) 17.239 10.674 ( -1.844 3.016 -19.104) 19.428 10.717 ( 0.321 11.023 1.859) 11.183 11.067 ( 4.411 -10.678 -2.594) 11.841 11.414 ( -0.067 -0.959 -12.295) 12.333 12.010 ( 3.713 5.490 5.110) 8.369 12.573 ( -8.852 -3.890 -4.201) 10.542 12.694 ( 1.766 4.060 2.426) 5.049 12.816 ( 4.677 -5.289 3.060) 7.695 13.734 ( 2.590 5.724 -5.053) 8.062 13.797 ( 1.324 1.421 -3.487) 3.991 14.138 ( -2.021 -1.116 9.784) 10.053 14.406 ( -1.228 4.560 1.033) 4.834 14.742 ( -5.823 -9.846 5.866) 12.855 15.161 ( -0.377 -3.957 -9.757) 10.536 15.291 ( -9.636 0.778 8.051) 12.581 15.525 ( -0.236 1.009 11.199) 11.247 15.913 ( 8.939 -2.504 0.549) 9.300 16.085 ( -7.607 0.051 4.045) 8.616 18.159 ( 7.294 0.584 -3.748) 8.222 19.155 ( -7.023 1.928 10.317) 12.629 22.027 ( 7.743 0.597 -21.376) 22.743 22.115 ( 8.796 -0.443 -28.909) 30.221 24.650 ( 0.897 0.195 8.010) 8.063 25.175 ( 2.819 1.427 -9.550) 10.059 25.284 ( -10.035 1.555 9.196) 13.700 27.527 ( 9.594 2.780 -24.402) 26.367 28.675 ( -2.191 -4.037 3.306) 5.659 29.246 ( -1.819 -2.132 -2.944) 4.065 29.543 ( 1.097 -1.921 12.225) 12.424 30.369 ( 1.629 0.184 24.519) 24.573 30.455 ( -15.603 0.216 20.140) 25.478 31.210 ( -5.658 -0.482 7.607) 9.493 31.553 ( 2.213 13.934 -3.780) 14.607 32.332 ( 6.282 -12.540 -18.833) 23.481 ======================= Grid point 160 (81/186) ======================= q-point: (-0.38 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.737 ( -5.246 4.245 7.339) 9.970 2.849 ( -1.073 2.156 1.227) 2.703 3.156 ( -9.475 19.980 2.415) 22.245 3.249 ( -0.380 13.415 3.449) 13.857 3.523 ( -10.012 -0.011 14.714) 17.798 3.871 ( -0.400 -0.430 3.583) 3.631 4.430 ( 2.154 -3.327 8.608) 9.477 4.515 ( -9.891 -1.333 25.776) 27.641 4.695 ( -6.793 -13.281 15.064) 21.200 5.134 ( -14.458 -1.477 45.415) 47.683 5.366 ( -7.493 5.994 4.271) 10.503 5.520 ( -2.033 6.705 5.526) 8.924 6.399 ( 6.520 11.846 5.186) 14.482 6.855 ( -5.944 -6.637 -3.674) 9.637 7.031 ( 1.220 7.505 12.694) 14.797 7.493 ( -2.008 -1.495 -9.146) 9.483 7.694 ( 9.803 -8.964 -12.412) 18.180 7.891 ( 1.613 -3.164 -11.309) 11.853 8.499 ( 1.185 2.389 -11.958) 12.251 8.530 ( 6.342 -0.330 -9.294) 11.257 9.002 ( -0.753 2.372 2.555) 3.567 9.184 ( 6.417 -1.257 1.787) 6.779 9.237 ( 7.504 1.078 -0.388) 7.591 9.348 ( -2.722 -1.995 6.279) 7.128 9.653 ( -1.533 0.064 -8.210) 8.352 10.193 ( 0.742 -6.238 8.533) 10.596 10.500 ( -5.027 3.084 -14.978) 16.098 10.595 ( -2.987 7.479 8.635) 11.808 11.245 ( 5.171 -6.749 -3.534) 9.207 11.368 ( -1.113 0.209 -8.418) 8.494 11.980 ( 0.281 3.190 4.201) 5.282 12.529 ( -4.343 -3.882 -4.696) 7.482 12.611 ( -5.036 4.658 -1.653) 7.056 12.967 ( 6.131 -4.917 -0.905) 7.911 13.659 ( 3.520 7.935 -1.929) 8.893 13.779 ( 1.609 1.425 -2.511) 3.305 14.183 ( -0.586 -1.288 10.289) 10.386 14.369 ( 0.620 1.167 0.512) 1.417 14.852 ( -4.318 -12.524 -3.298) 13.651 15.131 ( -0.413 -0.065 -5.326) 5.343 15.261 ( -7.303 -5.838 8.371) 12.549 15.572 ( 1.035 1.846 13.129) 13.299 15.986 ( -2.994 0.551 -4.557) 5.481 16.074 ( 1.814 -4.232 8.372) 9.555 18.201 ( 3.506 2.034 -1.701) 4.396 19.083 ( -6.232 2.754 10.046) 12.138 21.994 ( 7.329 1.327 -25.799) 26.852 22.108 ( 9.100 -0.713 -26.102) 27.651 24.658 ( -5.116 0.084 5.970) 7.863 25.190 ( -5.929 2.328 8.683) 10.769 25.236 ( 14.646 0.909 -3.536) 15.094 27.435 ( 2.968 5.689 -24.389) 25.219 28.762 ( 0.509 -6.832 4.135) 8.002 29.262 ( 0.038 -4.710 -4.096) 6.242 29.649 ( 1.729 -1.708 12.573) 12.805 30.366 ( -12.585 -0.488 17.450) 21.520 30.506 ( 1.698 1.461 26.751) 26.844 31.155 ( -4.105 4.923 2.715) 6.962 31.357 ( -1.882 10.617 2.371) 11.040 32.487 ( 2.391 -14.721 -21.286) 25.990 ======================= Grid point 161 (82/186) ======================= q-point: (-0.25 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.516 ( -7.729 28.810 -1.607) 29.872 2.691 ( -14.084 -3.072 5.163) 15.312 2.940 ( 1.918 4.293 -1.592) 4.964 3.108 ( 3.708 10.313 1.740) 11.096 3.491 ( -11.006 -6.171 11.294) 16.934 3.851 ( -1.852 2.832 4.681) 5.776 4.491 ( -11.925 2.467 40.134) 41.941 4.616 ( -0.308 -8.431 9.269) 12.533 4.859 ( -2.628 -8.487 16.726) 18.939 5.139 ( -5.314 2.198 12.734) 13.972 5.309 ( -10.906 -3.040 27.079) 29.351 5.439 ( 2.021 7.232 6.075) 9.658 6.288 ( 3.610 17.188 8.881) 19.681 6.720 ( -14.234 3.292 -3.902) 15.122 7.032 ( 1.482 2.963 9.112) 9.695 7.483 ( -1.716 -4.407 -4.265) 6.368 7.902 ( 11.170 -8.047 -13.319) 19.155 7.930 ( 5.334 -3.024 -8.191) 10.231 8.312 ( -9.460 3.923 -9.961) 14.286 8.623 ( 8.508 -2.207 -9.823) 13.182 9.019 ( 4.749 0.231 -2.370) 5.312 9.065 ( -3.579 6.879 -0.656) 7.782 9.366 ( -0.236 0.482 -1.915) 1.989 9.488 ( 16.801 0.393 2.818) 17.041 9.656 ( 4.391 -1.654 -5.998) 7.615 10.256 ( -2.315 -0.596 -0.873) 2.546 10.367 ( -3.858 -2.348 -1.713) 4.830 10.544 ( -6.179 -0.815 13.397) 14.776 11.252 ( -4.637 2.438 -13.146) 14.151 11.348 ( 2.097 -1.127 1.053) 2.603 12.017 ( 1.203 -3.867 4.513) 6.064 12.429 ( -7.308 5.783 -7.750) 12.121 12.523 ( -0.503 -0.819 0.405) 1.043 13.085 ( 5.187 -3.811 -5.983) 8.788 13.604 ( 4.805 7.379 1.454) 8.925 13.777 ( 1.134 -0.654 -3.804) 4.024 14.232 ( -1.900 -0.027 8.342) 8.556 14.389 ( 1.170 -1.649 1.599) 2.577 14.885 ( -4.508 -5.201 -6.190) 9.257 15.176 ( 3.161 -4.333 -5.209) 7.477 15.328 ( -6.718 -11.489 11.755) 17.757 15.613 ( 0.484 2.102 10.354) 10.576 15.916 ( -3.783 0.786 1.028) 3.998 16.189 ( 1.299 -4.073 3.513) 5.533 18.158 ( -2.836 5.444 2.686) 6.700 19.034 ( -3.363 1.240 8.348) 9.085 21.943 ( 8.212 1.900 -26.710) 28.008 22.114 ( 9.598 -0.802 -25.658) 27.407 24.584 ( -8.993 -0.096 3.526) 9.660 25.160 ( -1.938 1.761 11.985) 12.267 25.502 ( 26.327 -3.341 -2.677) 26.673 27.209 ( -5.256 8.360 -23.712) 25.687 28.880 ( -0.460 -6.018 4.615) 7.597 29.344 ( 2.688 -7.234 -4.279) 8.825 29.739 ( 2.018 0.370 10.641) 10.837 30.302 ( -9.894 0.552 12.901) 16.267 30.607 ( 0.324 3.727 23.665) 23.958 30.991 ( -5.428 9.115 6.133) 12.254 31.306 ( 0.137 -0.032 7.181) 7.182 32.567 ( -2.454 -11.597 -22.851) 25.742 ======================= Grid point 162 (83/186) ======================= q-point: (-0.12 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.043 ( -7.581 18.904 5.990) 21.230 2.619 ( -7.930 -3.821 -1.031) 8.863 2.880 ( 2.661 8.080 0.860) 8.550 3.073 ( -1.950 -1.841 0.016) 2.681 3.531 ( -1.847 -5.392 3.889) 6.900 3.824 ( -1.157 1.549 7.056) 7.316 4.467 ( -16.271 5.040 44.998) 48.114 4.737 ( -3.419 -2.776 18.023) 18.554 4.962 ( -3.776 -1.334 10.079) 10.845 5.171 ( 2.339 6.766 20.658) 21.864 5.305 ( -4.724 -6.572 6.362) 10.294 5.501 ( 4.916 -1.985 10.297) 11.582 6.124 ( -2.999 16.117 15.185) 22.346 6.456 ( -13.446 3.694 -1.938) 14.078 7.055 ( 0.630 1.265 6.292) 6.449 7.514 ( -2.146 -6.552 -3.960) 7.951 7.962 ( 4.022 1.293 -15.538) 16.103 8.062 ( 6.468 -1.740 -1.047) 6.780 8.150 ( -4.533 -3.851 -5.977) 8.433 8.691 ( 6.452 -0.018 -12.120) 13.730 8.904 ( 0.302 8.921 -3.173) 9.473 9.071 ( 0.236 -0.763 -7.816) 7.857 9.351 ( 6.507 2.498 -2.248) 7.324 9.606 ( 10.948 9.826 -0.227) 14.713 9.726 ( 5.487 -3.638 -1.062) 6.669 10.198 ( -5.669 -1.184 -5.133) 7.739 10.423 ( -2.813 -3.747 5.732) 7.403 10.607 ( -1.237 -9.347 14.720) 17.481 11.063 ( -6.776 3.701 -11.043) 13.474 11.398 ( 2.242 -2.673 -1.408) 3.762 12.103 ( -2.941 -3.005 -0.648) 4.254 12.219 ( -4.633 3.804 -5.143) 7.899 12.555 ( 5.190 2.656 4.328) 7.261 13.143 ( 2.596 -2.733 -9.380) 10.109 13.595 ( 5.242 5.214 3.953) 8.384 13.784 ( 0.154 -2.271 -5.716) 6.153 14.205 ( -2.924 2.724 3.188) 5.112 14.439 ( -3.368 -4.518 4.845) 7.432 14.889 ( 0.404 -3.620 -3.681) 5.178 15.204 ( -1.745 -2.140 -2.552) 3.760 15.487 ( -5.489 -10.420 12.043) 16.845 15.617 ( -0.439 1.420 2.162) 2.624 15.913 ( 0.052 -2.363 7.105) 7.488 16.224 ( -2.332 0.138 -0.791) 2.467 18.026 ( -5.933 7.476 7.215) 11.964 19.048 ( -0.787 -1.638 6.717) 6.958 21.905 ( 9.842 2.096 -25.672) 27.574 22.132 ( 10.386 -0.953 -25.651) 27.690 24.490 ( -8.193 -0.683 2.873) 8.709 25.200 ( -0.187 -0.063 14.408) 14.409 25.938 ( 30.952 -8.149 -8.917) 33.225 26.868 ( -11.594 8.315 -20.066) 24.621 28.946 ( -2.906 -3.780 4.420) 6.501 29.450 ( 1.095 -4.910 -1.947) 5.394 29.798 ( 3.092 1.721 7.256) 8.072 30.175 ( -8.339 7.367 3.927) 11.800 30.676 ( 0.856 -1.340 17.378) 17.450 30.890 ( -9.694 0.890 18.762) 21.137 31.383 ( 4.086 -0.001 8.463) 9.398 32.522 ( -4.741 -4.711 -22.237) 23.220 ======================= Grid point 167 (84/186) ======================= q-point: (-0.50 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.778 ( -4.280 -0.000 -0.157) 4.283 2.918 ( -17.870 -0.000 32.079) 36.720 3.198 ( -12.287 -0.000 8.293) 14.824 3.546 ( -0.059 -0.000 2.258) 2.259 3.687 ( -3.494 -0.000 1.007) 3.637 4.005 ( 0.286 0.000 -8.779) 8.784 4.161 ( 4.750 0.000 -6.413) 7.980 4.411 ( -8.474 -0.000 28.483) 29.717 4.633 ( -6.502 -0.000 29.247) 29.961 5.112 ( -17.247 -0.000 50.106) 52.992 5.466 ( -12.529 -0.000 -2.250) 12.729 5.616 ( -2.283 -0.000 9.111) 9.393 6.560 ( 11.180 0.000 7.103) 13.246 6.728 ( 0.166 0.000 -3.705) 3.708 7.140 ( 0.795 0.000 7.576) 7.618 7.483 ( 2.119 0.000 -17.945) 18.070 7.523 ( -0.743 -0.000 -5.938) 5.984 7.883 ( 5.346 0.000 -9.816) 11.177 8.517 ( 8.190 0.000 -12.375) 14.840 8.543 ( 0.742 0.000 -9.876) 9.904 9.006 ( 7.298 0.000 -3.001) 7.891 9.122 ( 2.949 0.000 4.660) 5.515 9.208 ( 3.260 0.000 12.328) 12.752 9.422 ( -10.694 -0.000 -0.239) 10.697 9.696 ( 0.234 0.000 -10.307) 10.310 10.035 ( 2.523 0.000 21.281) 21.430 10.557 ( -4.160 -0.000 -20.469) 20.887 10.835 ( 0.822 0.000 -1.863) 2.036 11.034 ( 7.487 0.000 -1.750) 7.688 11.356 ( 0.504 0.000 -9.608) 9.622 12.083 ( -1.624 -0.000 0.871) 1.843 12.430 ( -6.308 -0.000 1.401) 6.462 12.682 ( -6.377 -0.000 -3.228) 7.147 12.887 ( 8.402 0.000 1.805) 8.593 13.808 ( 3.535 0.000 -5.752) 6.751 13.813 ( 2.823 0.000 0.172) 2.829 14.158 ( -1.252 -0.000 12.648) 12.710 14.430 ( -0.923 -0.000 -1.958) 2.165 14.581 ( -9.704 -0.000 5.949) 11.382 15.105 ( 2.943 0.000 -11.468) 11.840 15.224 ( -7.987 -0.000 9.683) 12.552 15.607 ( 1.930 0.000 14.490) 14.618 15.990 ( -1.252 -0.000 -7.826) 7.925 16.009 ( 0.232 0.000 10.099) 10.102 18.232 ( 6.378 0.000 -4.640) 7.887 19.128 ( -7.004 -0.000 10.912) 12.966 22.011 ( 7.374 0.000 -26.864) 27.858 22.096 ( 8.782 0.000 -24.837) 26.344 24.658 ( -5.313 -0.000 5.829) 7.887 25.227 ( -7.210 -0.000 9.574) 11.985 25.250 ( 13.248 0.000 -6.622) 14.811 27.520 ( 5.250 0.000 -26.222) 26.743 28.661 ( 1.485 0.000 4.632) 4.865 29.193 ( -1.213 -0.000 -4.150) 4.323 29.618 ( 2.002 0.000 15.039) 15.171 30.359 ( -13.105 -0.000 17.878) 22.167 30.527 ( 2.126 0.000 29.255) 29.332 31.174 ( -5.536 -0.000 8.241) 9.928 31.669 ( 1.303 0.000 -6.266) 6.400 32.171 ( 0.308 0.000 -20.927) 20.929 ======================= Grid point 168 (85/186) ======================= q-point: (-0.38 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.683 ( -13.738 2.795 10.552) 17.547 2.848 ( -5.555 -3.698 6.138) 9.068 3.042 ( -21.506 -0.220 4.958) 22.071 3.372 ( -5.505 19.554 4.368) 20.778 3.669 ( -7.959 -4.640 2.479) 9.541 3.855 ( 2.043 10.376 1.140) 10.636 4.301 ( -1.023 -11.890 -1.616) 12.043 4.541 ( 3.226 -4.216 12.913) 13.962 4.649 ( -13.278 -0.575 43.901) 45.868 5.148 ( -10.346 -0.122 29.934) 31.672 5.300 ( -14.200 0.873 18.626) 23.438 5.574 ( -6.624 1.055 5.533) 8.695 6.649 ( 4.880 7.847 4.504) 10.280 6.743 ( 1.048 -0.308 -3.807) 3.961 7.140 ( -4.047 3.453 10.107) 11.422 7.430 ( 2.359 0.919 -10.125) 10.437 7.605 ( 9.675 -10.594 -12.771) 19.207 7.932 ( 10.487 1.860 -7.982) 13.310 8.371 ( -10.221 0.493 -15.170) 18.298 8.618 ( 8.745 0.950 -8.345) 12.125 9.014 ( -0.351 0.070 0.482) 0.600 9.190 ( -8.934 2.366 -2.971) 9.708 9.273 ( 6.925 -5.451 6.583) 11.001 9.448 ( 11.620 -0.858 4.352) 12.438 9.677 ( 8.266 2.033 -3.930) 9.376 10.188 ( 0.287 -4.221 16.859) 17.382 10.385 ( -5.867 2.085 -16.822) 17.937 10.729 ( -1.410 11.276 -0.600) 11.380 11.175 ( 5.864 -7.419 -12.817) 15.928 11.331 ( -1.350 -0.175 0.802) 1.580 12.008 ( -5.158 2.236 1.456) 5.808 12.434 ( -0.451 -3.703 3.969) 5.447 12.542 ( -8.567 2.014 -7.945) 11.857 12.998 ( 6.190 -1.893 -1.516) 6.648 13.797 ( 3.782 5.172 -1.153) 6.511 13.824 ( 1.797 2.849 -0.783) 3.458 14.220 ( 0.026 0.605 14.111) 14.124 14.386 ( -0.560 1.329 -2.446) 2.840 14.585 ( -6.526 -13.099 -0.561) 14.645 15.106 ( 3.130 -1.313 -8.871) 9.498 15.188 ( -6.065 -0.285 12.444) 13.846 15.693 ( 2.124 2.853 15.281) 15.689 15.909 ( -4.558 -1.155 -3.749) 6.014 16.096 ( 2.889 -2.175 4.439) 5.726 18.267 ( 3.708 2.134 -2.916) 5.177 19.084 ( -5.875 1.573 10.365) 12.018 21.972 ( 8.562 0.322 -29.906) 31.109 22.095 ( 8.342 -0.388 -22.843) 24.321 24.578 ( -9.909 -0.209 2.740) 10.283 25.197 ( -4.447 0.789 11.282) 12.153 25.453 ( 21.999 -0.742 -4.578) 22.482 27.398 ( -0.335 4.350 -27.140) 27.488 28.749 ( 4.415 -2.992 5.616) 7.745 29.186 ( 0.390 -3.325 -4.974) 5.995 29.723 ( 1.763 -0.842 15.232) 15.357 30.291 ( -10.533 -0.386 15.713) 18.921 30.694 ( 2.074 2.036 32.292) 32.422 31.150 ( -4.336 -0.334 7.298) 8.495 31.507 ( -2.419 14.662 -5.486) 15.840 32.172 ( -2.868 -15.048 -22.247) 27.011 ======================= Grid point 169 (86/186) ======================= q-point: (-0.25 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.458 ( -24.672 4.466 7.480) 26.165 2.674 ( -19.818 7.191 2.150) 21.192 2.942 ( -2.617 -10.246 -2.127) 10.787 3.060 ( -2.695 16.454 1.700) 16.760 3.596 ( -4.415 2.905 0.529) 5.311 3.822 ( -2.017 0.601 11.873) 12.058 4.448 ( -4.220 -11.034 9.532) 15.180 4.590 ( -9.582 0.852 32.615) 34.004 4.834 ( 0.780 -7.691 19.806) 21.261 5.112 ( -5.156 -0.972 7.539) 9.185 5.305 ( -10.248 -0.949 35.481) 36.944 5.512 ( -5.695 -0.800 6.628) 8.775 6.535 ( -5.962 11.714 6.787) 14.793 6.640 ( -3.681 8.559 -5.450) 10.794 7.096 ( -2.507 1.761 9.216) 9.712 7.425 ( 4.119 0.231 -8.269) 9.241 7.845 ( 11.882 -8.916 -12.541) 19.441 8.028 ( 12.650 0.929 -3.933) 13.280 8.131 ( -14.095 0.600 -13.324) 19.405 8.663 ( 6.256 -0.292 -8.321) 10.414 9.010 ( -3.970 0.546 -8.321) 9.235 9.065 ( -1.451 -1.063 2.777) 3.308 9.423 ( 6.546 2.065 1.867) 7.113 9.604 ( 10.335 -4.133 -2.902) 11.503 9.866 ( 19.989 2.068 5.442) 20.820 10.183 ( -6.792 2.229 -11.228) 13.311 10.309 ( -1.280 -2.318 5.126) 5.770 10.543 ( -7.638 6.201 8.908) 13.272 11.163 ( -2.898 1.416 -14.714) 15.063 11.354 ( 0.828 -1.143 2.279) 2.681 11.973 ( -3.459 -3.767 4.366) 6.725 12.342 ( -8.731 3.510 -10.997) 14.474 12.540 ( 4.855 -3.147 6.678) 8.835 13.070 ( 3.475 -2.118 -6.456) 7.632 13.753 ( 0.833 5.733 2.922) 6.489 13.803 ( 3.334 3.175 -2.817) 5.397 14.242 ( -2.405 1.062 5.984) 6.536 14.354 ( -3.191 -0.990 -1.857) 3.822 14.754 ( 4.361 -11.324 -0.224) 12.137 15.137 ( 2.279 -2.439 -5.564) 6.488 15.206 ( -5.272 -4.356 16.098) 17.490 15.698 ( -0.521 4.262 4.689) 6.358 15.892 ( -0.938 -0.617 4.311) 4.455 16.179 ( 1.120 -2.881 4.329) 5.319 18.229 ( -0.301 6.113 1.482) 6.297 19.044 ( -3.945 1.226 8.540) 9.487 21.941 ( 9.801 0.482 -29.692) 31.272 22.103 ( 8.786 -0.873 -23.055) 24.688 24.464 ( -9.785 -0.993 1.403) 9.934 25.197 ( -3.717 -0.094 12.760) 13.291 25.778 ( 27.318 -3.653 -5.889) 28.183 27.126 ( -7.715 9.120 -25.918) 28.538 28.870 ( 3.553 -1.894 5.536) 6.845 29.260 ( 3.315 -7.269 -4.403) 9.122 29.819 ( 1.260 -0.299 12.993) 13.057 30.247 ( -8.347 -0.323 12.682) 15.186 30.787 ( -1.643 6.515 26.601) 27.437 31.072 ( -6.778 9.768 3.955) 12.530 31.344 ( 0.460 0.158 6.768) 6.786 32.239 ( -2.876 -15.023 -22.674) 27.351 ======================= Grid point 170 (87/186) ======================= q-point: (-0.12 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.016 ( -25.818 5.571 4.141) 26.735 2.517 ( -11.541 -6.491 6.675) 14.828 2.814 ( -6.572 6.982 -4.875) 10.757 3.049 ( 3.722 -1.776 -2.556) 4.851 3.540 ( -3.636 -2.099 -1.050) 4.328 3.873 ( 1.042 0.599 15.911) 15.957 4.520 ( -15.557 1.302 42.803) 45.561 4.675 ( -3.610 -8.706 14.114) 16.971 4.944 ( -5.728 -2.063 12.492) 13.896 5.187 ( -0.100 -6.872 10.249) 12.340 5.333 ( -3.494 1.070 14.624) 15.074 5.558 ( -0.530 -4.192 14.191) 14.807 6.243 ( -16.811 11.547 6.995) 21.561 6.451 ( -3.300 10.291 1.401) 10.898 7.103 ( 0.522 1.884 7.802) 8.044 7.442 ( 4.719 -0.509 -8.412) 9.659 7.887 ( -9.278 0.175 -12.611) 15.657 8.019 ( 6.062 -6.227 -9.146) 12.616 8.177 ( 10.762 0.554 0.786) 10.805 8.703 ( 4.853 -0.845 -11.933) 12.910 8.891 ( -4.786 0.065 -9.689) 10.807 9.109 ( 4.145 1.683 0.986) 4.581 9.455 ( 7.752 3.715 -4.370) 9.643 9.735 ( 3.532 1.445 -2.395) 4.506 9.981 ( 11.290 11.927 1.564) 16.497 10.045 ( -6.046 -0.978 -9.043) 10.921 10.385 ( 1.737 -7.319 8.985) 11.719 10.540 ( -1.745 -5.744 13.587) 14.854 10.996 ( -5.738 4.643 -7.246) 10.343 11.382 ( 1.488 -1.355 -2.358) 3.100 12.012 ( -5.081 -2.068 -0.571) 5.515 12.167 ( -3.234 -0.416 -4.504) 5.560 12.687 ( 7.790 -0.513 7.601) 10.896 13.079 ( 0.349 -1.819 -11.320) 11.470 13.701 ( -1.215 2.583 0.832) 2.974 13.797 ( 4.810 3.850 -1.840) 6.430 14.199 ( -4.505 0.343 0.166) 4.521 14.318 ( -5.107 -2.263 0.579) 5.616 14.921 ( 7.761 -0.696 -0.197) 7.795 15.162 ( 0.911 -1.564 -1.925) 2.643 15.346 ( -3.687 -10.184 16.658) 19.870 15.649 ( -0.022 2.648 0.004) 2.648 15.916 ( -0.379 -0.833 5.464) 5.540 16.226 ( -0.098 0.656 3.309) 3.375 18.118 ( -2.918 9.005 6.943) 11.739 19.040 ( -2.370 -1.129 6.808) 7.297 21.929 ( 10.979 0.474 -27.964) 30.046 22.124 ( 9.452 -1.350 -23.645) 25.500 24.387 ( -6.291 -2.039 2.068) 6.929 25.225 ( -4.193 -2.009 13.512) 14.289 26.126 ( 19.630 -4.394 -16.844) 26.237 26.764 ( -7.304 8.244 -16.070) 19.482 28.934 ( 1.344 0.259 4.743) 4.936 29.389 ( 2.688 -6.005 -1.824) 6.827 29.887 ( 1.542 0.810 9.584) 9.741 30.174 ( -7.360 4.105 5.408) 10.014 30.745 ( -4.658 4.248 13.731) 15.109 30.884 ( -10.479 4.665 15.685) 19.432 31.457 ( 1.109 -2.261 12.512) 12.762 32.308 ( 4.392 -9.871 -21.149) 23.749 ======================= Grid point 176 (88/186) ======================= q-point: (-0.38 -0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.547 ( -27.908 -0.000 13.407) 30.961 2.618 ( -16.146 -0.000 4.894) 16.871 2.940 ( -3.497 -0.000 -2.675) 4.403 3.382 ( -23.852 -0.000 11.396) 26.435 3.530 ( -3.193 -0.000 6.149) 6.929 3.924 ( -1.265 -0.000 -8.166) 8.263 4.209 ( 1.666 0.000 -1.290) 2.107 4.619 ( -4.613 -0.000 23.334) 23.786 4.684 ( -7.368 -0.000 41.603) 42.250 5.106 ( -8.360 -0.000 8.001) 11.572 5.299 ( -10.698 -0.000 42.908) 44.222 5.459 ( -11.136 -0.000 -0.509) 11.148 6.758 ( 2.288 0.000 -1.257) 2.610 6.768 ( 0.658 0.000 -1.186) 1.356 7.091 ( -11.737 -0.000 6.530) 13.431 7.491 ( 8.226 0.000 -11.347) 14.015 7.629 ( 16.260 0.000 -4.694) 16.924 8.078 ( 14.999 0.000 -7.024) 16.562 8.135 ( -14.789 -0.000 -15.982) 21.775 8.669 ( 4.166 0.000 -8.028) 9.044 9.007 ( 0.039 0.000 -2.898) 2.898 9.045 ( -9.770 -0.000 -5.090) 11.016 9.405 ( 11.651 0.000 11.956) 16.694 9.574 ( 8.571 0.000 -4.459) 9.661 9.858 ( 16.387 0.000 5.910) 17.420 10.237 ( -3.591 -0.000 7.403) 8.228 10.242 ( -4.384 -0.000 -6.402) 7.759 10.783 ( -3.255 -0.000 -7.585) 8.254 11.101 ( 3.800 0.000 -18.627) 19.011 11.344 ( 0.145 0.000 8.169) 8.170 11.930 ( -8.082 -0.000 1.073) 8.153 12.392 ( -9.132 -0.000 -11.687) 14.832 12.473 ( 4.619 0.000 9.769) 10.806 13.041 ( 3.664 0.000 -2.967) 4.715 13.863 ( 4.148 0.000 -4.286) 5.964 13.864 ( -2.282 -0.000 3.597) 4.260 14.339 ( -6.542 -0.000 -7.708) 10.110 14.383 ( -1.700 -0.000 -0.693) 1.836 14.387 ( 7.776 0.000 20.896) 22.296 15.100 ( 3.435 0.000 -7.038) 7.831 15.188 ( -4.100 -0.000 13.526) 14.134 15.813 ( -2.776 -0.000 -8.720) 9.151 15.844 ( 2.858 0.000 20.440) 20.639 16.122 ( 0.750 0.000 3.345) 3.428 18.318 ( 3.440 0.000 -2.103) 4.032 19.073 ( -5.298 -0.000 10.319) 11.599 21.943 ( 10.250 0.000 -33.282) 34.824 22.092 ( 7.663 0.000 -20.430) 21.819 24.448 ( -10.528 -0.000 0.811) 10.559 25.196 ( -5.373 -0.000 12.527) 13.630 25.729 ( 25.765 0.000 -6.171) 26.494 27.274 ( -3.714 -0.000 -29.028) 29.264 28.840 ( 7.615 0.000 6.728) 10.161 29.145 ( 1.295 0.000 -5.491) 5.642 29.807 ( 0.582 0.000 15.399) 15.410 30.238 ( -8.362 -0.000 13.777) 16.116 30.914 ( 2.518 0.000 36.937) 37.023 31.119 ( -4.503 -0.000 7.685) 8.907 31.591 ( -2.722 -0.000 -5.489) 6.127 31.843 ( -7.276 -0.000 -24.650) 25.702 ======================= Grid point 177 (89/186) ======================= q-point: (-0.25 -0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.239 ( -26.876 1.734 10.854) 29.037 2.298 ( -35.529 1.598 3.790) 35.766 2.925 ( 4.914 -0.249 -1.564) 5.163 3.220 ( -18.578 -5.413 12.344) 22.952 3.377 ( -6.763 9.499 1.951) 11.823 3.906 ( -0.113 -1.424 0.350) 1.471 4.291 ( 0.122 -9.982 2.041) 10.190 4.616 ( -16.071 0.772 42.438) 45.386 4.841 ( -1.623 -4.115 18.383) 18.907 5.095 ( -3.299 -1.289 18.143) 18.486 5.298 ( -10.169 -0.038 5.800) 11.707 5.423 ( -5.830 -4.591 25.163) 26.234 6.619 ( -8.419 14.343 -1.831) 16.732 6.693 ( -3.134 5.562 -2.416) 6.827 7.061 ( -5.172 -7.319 7.238) 11.520 7.510 ( 8.700 4.191 -11.248) 14.825 7.857 ( 12.102 -5.145 -6.298) 14.580 7.875 ( -14.090 -0.725 -12.182) 18.640 8.237 ( 17.311 3.409 -3.057) 17.906 8.669 ( 2.188 -0.935 -8.949) 9.260 8.883 ( -7.055 -0.246 -10.740) 12.853 9.052 ( 2.362 -2.982 0.552) 3.844 9.587 ( 9.327 3.725 4.832) 11.145 9.685 ( 10.236 -3.059 0.876) 10.720 10.050 ( -7.776 2.066 -13.300) 15.544 10.129 ( 15.926 -3.326 7.501) 17.915 10.300 ( -0.754 -0.442 2.373) 2.529 10.593 ( -7.138 9.528 1.492) 11.998 11.064 ( -0.862 -1.613 -15.779) 15.885 11.389 ( 1.926 1.507 5.804) 6.298 11.877 ( -5.518 -4.186 4.960) 8.519 12.213 ( -7.878 1.438 -11.702) 14.180 12.617 ( 6.626 -2.617 10.097) 12.358 13.053 ( 0.952 -0.262 -5.489) 5.577 13.791 ( -6.551 3.013 2.341) 7.581 13.885 ( 3.969 1.680 -2.074) 4.783 14.224 ( -2.118 1.593 -10.605) 10.931 14.331 ( -1.375 2.547 2.340) 3.722 14.726 ( 12.577 -10.918 15.631) 22.841 15.124 ( 3.136 -0.912 -3.773) 4.990 15.209 ( -2.599 0.148 15.178) 15.400 15.730 ( 0.315 2.201 -9.712) 9.963 15.956 ( 0.513 2.901 18.361) 18.596 16.168 ( -0.073 -3.750 6.124) 7.182 18.322 ( 2.143 4.458 0.864) 5.021 19.049 ( -4.504 1.102 9.673) 10.726 21.922 ( 11.314 -0.603 -34.203) 36.030 22.097 ( 7.836 -0.474 -19.898) 21.391 24.339 ( -7.803 -1.139 1.037) 7.953 25.184 ( -6.678 -0.805 12.983) 14.622 26.026 ( 23.199 -2.127 -12.395) 26.388 27.017 ( -7.358 7.111 -25.832) 27.785 28.965 ( 6.995 1.636 5.887) 9.288 29.193 ( 4.148 -6.225 -4.156) 8.557 29.880 ( -0.697 -0.699 13.154) 13.191 30.206 ( -6.558 -0.098 11.197) 12.977 30.988 ( -3.398 8.509 23.081) 24.834 31.101 ( -10.102 6.359 3.924) 12.565 31.401 ( -0.608 4.591 6.737) 8.175 31.887 ( 1.095 -19.286 -15.829) 24.974 ======================= Grid point 178 (90/186) ======================= q-point: (-0.12 -0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.720 ( -34.565 6.013 8.484) 36.095 2.109 ( -23.842 -16.261 8.878) 30.194 2.968 ( -0.937 4.045 1.666) 4.474 3.081 ( 0.012 6.464 3.578) 7.388 3.300 ( -10.301 -10.604 0.936) 14.813 3.962 ( 1.269 -2.340 9.855) 10.208 4.473 ( -2.510 -11.295 12.165) 16.789 4.611 ( -14.596 -0.911 38.855) 41.516 4.880 ( -10.806 -1.486 17.762) 20.844 5.148 ( -4.878 -2.463 3.459) 6.468 5.287 ( -2.885 -6.418 15.401) 16.932 5.552 ( -1.480 -5.153 16.374) 17.229 6.251 ( -12.623 16.052 1.233) 20.458 6.524 ( -7.294 8.996 2.409) 11.830 7.147 ( -0.984 -4.590 6.945) 8.382 7.485 ( 4.092 1.844 -15.110) 15.763 7.714 ( -5.064 -0.155 -4.427) 6.728 7.994 ( 7.321 -3.855 -10.226) 13.154 8.387 ( 14.585 5.057 1.710) 15.531 8.660 ( 0.911 -1.589 -15.633) 15.740 8.776 ( -3.269 -1.948 -9.148) 9.908 9.152 ( 3.915 -3.912 2.202) 5.956 9.614 ( 6.420 7.381 -4.027) 10.579 9.765 ( -3.850 2.713 -7.777) 9.092 9.896 ( -2.644 0.790 -5.860) 6.477 10.184 ( -3.225 3.423 -1.885) 5.067 10.439 ( 14.935 -4.936 8.509) 17.884 10.539 ( -1.078 -1.348 12.310) 12.430 10.963 ( -3.114 3.302 -7.040) 8.377 11.399 ( 2.044 2.241 0.136) 3.036 11.920 ( -3.652 -3.440 1.983) 5.395 12.091 ( -2.301 -2.553 -2.951) 4.530 12.781 ( 5.050 -3.841 5.998) 8.731 13.020 ( -0.070 1.081 -7.044) 7.127 13.674 ( -7.323 0.897 -1.563) 7.542 13.908 ( 4.519 2.194 0.583) 5.057 14.118 ( -2.489 2.223 -10.875) 11.376 14.301 ( -0.992 1.386 2.578) 3.091 15.034 ( 10.758 -0.634 2.561) 11.077 15.168 ( 3.913 -0.969 -0.829) 4.116 15.307 ( 1.230 -5.060 19.705) 20.381 15.683 ( 2.825 1.163 -6.008) 6.741 15.950 ( -2.478 4.161 9.214) 10.409 16.262 ( 0.943 -0.847 11.913) 11.980 18.256 ( -0.188 9.084 6.144) 10.969 19.029 ( -3.761 0.252 8.543) 9.338 21.924 ( 11.827 -1.432 -32.770) 34.868 22.114 ( 8.310 -1.035 -20.758) 22.383 24.306 ( -2.711 -2.829 3.119) 5.008 25.176 ( -7.751 -2.553 12.729) 15.121 26.097 ( -4.971 2.331 -30.766) 31.252 26.801 ( 8.272 4.197 -7.115) 11.690 29.025 ( 5.194 3.382 3.879) 7.311 29.341 ( 4.212 -6.354 -0.825) 7.668 29.938 ( -0.684 -1.284 9.420) 9.532 30.158 ( -5.788 2.349 5.118) 8.075 30.767 ( -14.888 8.971 1.437) 17.441 30.923 ( -6.339 6.313 18.853) 20.868 31.447 ( -5.634 -2.780 10.239) 12.013 32.201 ( 17.993 -14.975 -8.005) 24.741 ======================= Grid point 185 (91/186) ======================= q-point: (-0.25 -0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.838 ( -33.695 -0.000 8.940) 34.861 1.986 ( -33.668 -0.000 8.733) 34.782 2.765 ( -34.696 -0.000 25.776) 43.223 3.048 ( 8.817 0.000 -5.245) 10.259 3.538 ( -0.756 -0.000 11.564) 11.588 3.794 ( -2.797 -0.000 -6.997) 7.536 4.236 ( -0.111 -0.000 3.218) 3.220 4.620 ( -16.669 -0.000 45.583) 48.535 4.843 ( -7.658 -0.000 17.746) 19.328 5.151 ( -8.705 -0.000 -6.313) 10.753 5.176 ( 0.348 0.000 24.643) 24.645 5.467 ( -3.832 -0.000 22.108) 22.438 6.598 ( -5.819 -0.000 -11.858) 13.209 6.723 ( -5.235 -0.000 -0.155) 5.238 6.902 ( -9.252 -0.000 13.670) 16.507 7.528 ( -2.882 -0.000 -19.214) 19.429 7.715 ( -0.522 -0.000 -1.876) 1.947 7.944 ( 9.840 0.000 -7.060) 12.111 8.491 ( 17.361 0.000 1.331) 17.411 8.621 ( 0.079 0.000 -12.643) 12.644 8.747 ( -5.272 -0.000 -11.091) 12.280 9.064 ( 3.417 0.000 -0.103) 3.419 9.729 ( 7.106 0.000 -4.422) 8.369 9.785 ( 2.825 0.000 -3.722) 4.673 9.921 ( -3.418 -0.000 0.062) 3.419 10.248 ( -4.664 -0.000 -12.644) 13.477 10.308 ( 11.223 0.000 4.472) 12.081 10.601 ( -4.569 -0.000 10.518) 11.468 10.983 ( 1.451 0.000 -12.842) 12.924 11.482 ( 4.435 0.000 6.683) 8.021 11.795 ( -5.487 -0.000 6.718) 8.674 12.086 ( -5.247 -0.000 -8.168) 9.708 12.715 ( 3.527 0.000 8.535) 9.235 13.039 ( 0.898 0.000 -3.458) 3.573 13.685 ( -11.968 -0.000 -1.519) 12.064 13.932 ( 3.254 0.000 -0.450) 3.285 14.175 ( 1.128 0.000 -13.115) 13.163 14.333 ( -1.091 -0.000 -2.622) 2.840 14.958 ( 19.180 0.000 18.178) 26.425 15.155 ( 4.362 0.000 -1.419) 4.587 15.271 ( 0.795 0.000 16.095) 16.115 15.698 ( 2.484 0.000 -15.118) 15.321 16.122 ( -2.673 -0.000 2.590) 3.722 16.152 ( 3.457 0.000 33.921) 34.096 18.399 ( 3.617 0.000 1.100) 3.780 19.053 ( -4.079 -0.000 11.291) 12.005 21.893 ( 11.685 0.000 -36.697) 38.512 22.100 ( 7.649 0.000 -18.949) 20.435 24.260 ( -4.017 -0.000 2.657) 4.816 25.140 ( -8.708 -0.000 12.986) 15.636 26.116 ( 3.933 0.000 -29.530) 29.791 26.919 ( 2.452 0.000 -15.157) 15.354 29.128 ( 8.699 0.000 7.268) 11.336 29.169 ( 4.861 0.000 -5.007) 6.979 29.907 ( -2.999 -0.000 10.952) 11.355 30.180 ( -5.040 -0.000 8.280) 9.694 30.954 ( -20.357 -0.000 -2.976) 20.574 31.098 ( -2.859 -0.000 7.729) 8.241 31.450 ( -4.961 -0.000 -1.901) 5.313 31.807 ( 16.392 0.000 20.397) 26.168 ======================= Grid point 186 (92/186) ======================= q-point: (-0.12 -0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.410 ( -36.309 7.185 15.135) 39.988 1.653 ( -26.686 -10.909 14.706) 32.363 2.644 ( -26.572 -18.305 30.446) 44.363 3.127 ( 0.541 -3.216 -2.290) 3.985 3.408 ( 6.470 18.302 -0.694) 19.424 3.911 ( 1.582 -12.010 4.128) 12.798 4.318 ( -2.043 -10.718 6.167) 12.533 4.607 ( -19.073 1.137 44.072) 48.035 4.815 ( -11.699 -0.510 22.648) 25.496 5.031 ( -5.972 -0.547 -4.493) 7.494 5.307 ( 0.227 -2.750 12.690) 12.986 5.507 ( -6.087 -3.357 15.223) 16.735 6.372 ( -3.853 15.944 -2.274) 16.560 6.559 ( -7.387 7.832 3.697) 11.384 6.987 ( -7.543 -12.871 8.324) 17.084 7.390 ( -4.477 -2.388 -12.661) 13.640 7.753 ( 7.081 1.369 -3.255) 7.912 8.002 ( 5.701 -0.195 -10.489) 11.940 8.543 ( -1.043 -1.187 -22.394) 22.449 8.645 ( 6.387 3.708 3.481) 8.165 8.680 ( 3.009 -1.417 -6.073) 6.924 9.145 ( 3.402 -4.272 1.130) 5.577 9.600 ( -12.289 2.946 -17.627) 21.689 9.767 ( 4.824 3.631 -4.010) 7.248 9.895 ( -4.447 4.190 -8.299) 10.306 10.174 ( 2.468 -1.430 7.626) 8.142 10.488 ( 5.002 -8.065 0.324) 9.496 10.619 ( 0.256 1.752 11.691) 11.825 10.954 ( 2.648 1.645 -7.343) 7.978 11.507 ( 3.022 6.969 4.072) 8.618 11.839 ( -1.620 -7.013 6.618) 9.778 12.034 ( -0.067 -1.472 0.706) 1.634 12.754 ( -3.507 -2.245 -0.516) 4.195 13.061 ( 4.559 1.203 2.021) 5.130 13.519 ( -11.862 -1.582 -5.726) 13.267 13.976 ( 3.098 0.088 2.978) 4.298 14.108 ( 1.308 3.447 -12.250) 12.792 14.305 ( -0.206 0.194 -3.276) 3.289 15.189 ( 7.552 2.422 1.893) 8.154 15.227 ( 7.066 -0.490 0.885) 7.138 15.422 ( 8.566 -0.289 13.772) 16.221 15.681 ( 5.102 -2.571 -12.569) 13.807 16.044 ( -3.398 6.378 6.142) 9.484 16.420 ( 9.955 2.524 35.938) 37.376 18.405 ( 1.800 6.741 4.181) 8.134 19.044 ( -3.695 2.331 11.651) 12.443 21.882 ( 11.630 -2.282 -36.066) 37.963 22.110 ( 7.882 -0.486 -20.095) 21.591 24.278 ( 1.265 -2.788 5.700) 6.471 25.093 ( -9.696 -1.603 12.458) 15.867 25.786 ( -23.134 3.076 -37.663) 44.308 26.972 ( 13.858 2.296 -4.560) 14.769 29.177 ( 7.670 4.228 1.160) 8.834 29.322 ( 5.401 -5.317 2.077) 7.858 29.920 ( -3.790 -2.477 6.893) 8.247 30.132 ( -5.474 1.423 -0.067) 5.657 30.614 ( -20.496 3.356 -1.823) 20.848 31.048 ( -2.860 7.332 12.310) 14.611 31.373 ( -6.492 0.105 4.289) 7.781 32.302 ( 25.652 -12.825 14.922) 32.329 ======================= Grid point 194 (93/186) ======================= q-point: (-0.12 -0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.187 ( -23.715 -0.000 27.325) 36.181 1.256 ( -29.573 -0.000 20.627) 36.056 2.400 ( -16.939 -0.000 48.143) 51.036 3.059 ( -3.809 -0.000 -3.613) 5.250 3.663 ( -2.320 -0.000 -5.732) 6.184 3.834 ( 13.559 0.000 10.395) 17.085 4.233 ( -4.634 -0.000 6.058) 7.627 4.537 ( -22.418 -0.000 33.843) 40.594 4.796 ( -12.308 -0.000 34.130) 36.282 4.962 ( -1.649 -0.000 -3.786) 4.130 5.220 ( -12.230 -0.000 0.980) 12.269 5.564 ( 3.146 0.000 19.865) 20.113 6.481 ( 1.672 0.000 -5.260) 5.520 6.558 ( -4.767 -0.000 -0.900) 4.851 6.817 ( -9.657 -0.000 19.219) 21.508 7.254 ( -3.909 -0.000 -7.253) 8.240 7.834 ( 7.071 0.000 -4.969) 8.642 8.009 ( 3.188 0.000 -11.629) 12.058 8.407 ( -0.424 -0.000 -24.891) 24.895 8.595 ( -1.673 -0.000 -6.139) 6.363 8.800 ( 2.469 0.000 2.916) 3.821 9.152 ( 2.215 0.000 0.266) 2.231 9.362 ( -13.867 -0.000 -14.059) 19.747 9.780 ( -8.443 -0.000 -9.199) 12.486 9.834 ( 4.195 0.000 -3.591) 5.522 10.282 ( 6.744 0.000 8.743) 11.042 10.453 ( 0.636 0.000 -1.024) 1.205 10.662 ( -2.010 -0.000 9.266) 9.481 10.986 ( 4.402 0.000 -6.153) 7.566 11.665 ( 5.322 0.000 3.244) 6.233 11.760 ( -3.525 -0.000 10.041) 10.642 12.078 ( 4.990 0.000 7.218) 8.775 12.656 ( -7.403 -0.000 -3.178) 8.057 13.154 ( 5.376 0.000 4.521) 7.024 13.321 ( -11.052 -0.000 -7.122) 13.148 14.030 ( 2.037 0.000 6.051) 6.385 14.094 ( 1.249 0.000 -11.317) 11.386 14.283 ( 1.363 0.000 -7.164) 7.292 15.291 ( 5.393 0.000 1.980) 5.745 15.327 ( 6.380 0.000 2.568) 6.877 15.585 ( 6.269 0.000 4.924) 7.972 15.632 ( 3.837 0.000 -16.751) 17.185 16.052 ( -3.576 -0.000 0.844) 3.675 16.902 ( 25.503 0.000 35.883) 44.023 18.488 ( -1.001 -0.000 2.327) 2.533 19.087 ( -4.020 -0.000 11.692) 12.363 21.831 ( 10.841 0.000 -36.283) 37.868 22.110 ( 8.104 0.000 -21.439) 22.920 24.324 ( 4.148 0.000 8.938) 9.853 25.014 ( -9.958 -0.000 12.301) 15.827 25.296 ( -26.811 -0.000 -25.915) 37.289 27.126 ( 10.237 0.000 -6.182) 11.958 29.323 ( 10.662 0.000 -2.685) 10.995 29.366 ( 3.504 0.000 6.839) 7.685 29.860 ( -5.612 -0.000 3.376) 6.549 30.001 ( -12.323 -0.000 -13.650) 18.390 30.425 ( -11.731 -0.000 11.099) 16.149 31.120 ( -0.866 -0.000 6.452) 6.509 31.335 ( -4.503 -0.000 4.851) 6.619 32.633 ( 24.738 0.000 16.784) 29.894 ======================= Grid point 195 (94/186) ======================= q-point: ( 0.00 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.795 ( 4.424 0.000 26.928) 27.289 2.058 ( 11.537 0.000 25.738) 28.205 2.779 ( -3.074 -0.000 -6.200) 6.921 3.336 ( 5.101 0.000 -8.814) 10.184 3.589 ( -0.950 -0.000 22.485) 22.505 4.123 ( -4.597 -0.000 0.160) 4.600 4.375 ( -8.663 -0.000 1.679) 8.824 4.482 ( -1.744 -0.000 13.575) 13.687 5.000 ( 0.424 0.000 2.231) 2.271 5.450 ( 3.556 0.000 6.522) 7.428 5.614 ( -12.355 -0.000 31.792) 34.108 6.094 ( -10.500 -0.000 42.255) 43.540 6.383 ( -4.804 -0.000 -1.973) 5.193 6.522 ( 7.414 0.000 -2.703) 7.891 7.157 ( 1.947 0.000 -10.449) 10.629 7.282 ( -17.513 -0.000 31.808) 36.310 7.652 ( 8.637 0.000 -2.963) 9.131 7.950 ( 4.824 0.000 0.721) 4.877 8.091 ( 12.481 0.000 -10.291) 16.176 8.354 ( 1.722 0.000 -5.590) 5.849 8.651 ( -11.919 -0.000 -4.937) 12.901 9.095 ( -4.472 -0.000 -3.499) 5.678 9.199 ( 8.886 0.000 -1.830) 9.072 9.508 ( -2.561 -0.000 -1.294) 2.869 9.774 ( 3.427 0.000 -8.290) 8.971 10.343 ( -1.915 -0.000 -6.327) 6.611 10.347 ( -4.599 -0.000 6.029) 7.582 10.803 ( 1.430 0.000 -10.652) 10.748 11.091 ( 4.281 0.000 8.412) 9.438 11.701 ( 2.416 0.000 -8.259) 8.605 11.893 ( -9.717 -0.000 -3.086) 10.196 12.244 ( 4.512 0.000 6.538) 7.944 12.389 ( -5.180 -0.000 -1.062) 5.288 13.213 ( 1.600 0.000 -8.561) 8.709 13.446 ( 7.659 0.000 16.359) 18.063 13.853 ( -0.342 -0.000 -5.358) 5.369 13.991 ( -2.083 -0.000 -9.721) 9.941 14.402 ( 8.510 0.000 4.973) 9.857 15.217 ( 3.973 0.000 -14.567) 15.099 15.473 ( -5.839 -0.000 4.696) 7.493 15.484 ( 5.104 0.000 -3.003) 5.922 15.669 ( -0.171 -0.000 0.674) 0.695 16.100 ( 2.795 0.000 7.524) 8.027 17.065 ( -19.071 -0.000 -9.920) 21.496 18.428 ( -28.738 -0.000 25.110) 38.163 19.290 ( -4.594 -0.000 16.694) 17.315 21.106 ( 17.401 0.000 -35.451) 39.491 21.567 ( 11.008 0.000 -30.750) 32.660 24.706 ( -3.846 -0.000 7.976) 8.855 25.266 ( 1.976 0.000 17.466) 17.577 25.295 ( 29.231 0.000 -7.579) 30.197 26.796 ( -6.744 -0.000 -17.335) 18.601 29.479 ( -9.901 -0.000 4.530) 10.888 29.486 ( -3.726 -0.000 -2.180) 4.317 29.647 ( 15.635 0.000 -0.484) 15.643 29.678 ( -3.615 -0.000 -3.689) 5.165 30.812 ( 3.665 0.000 13.995) 14.467 31.205 ( -0.729 -0.000 1.867) 2.004 31.623 ( -1.575 -0.000 16.403) 16.479 32.700 ( -12.256 -0.000 -8.064) 14.671 ======================= Grid point 196 (95/186) ======================= q-point: ( 0.12 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.995 ( 10.809 3.794 21.355) 24.233 2.408 ( 16.777 -6.810 18.840) 26.131 2.735 ( -0.607 1.048 -6.256) 6.372 3.363 ( 7.241 0.120 -12.079) 14.084 3.608 ( -1.213 6.789 14.922) 16.438 4.043 ( -7.141 1.553 1.570) 7.474 4.403 ( -5.965 -13.534 13.674) 20.143 4.549 ( -4.937 -8.103 6.863) 11.710 5.009 ( -0.575 -0.781 1.741) 1.993 5.492 ( 1.879 0.442 4.582) 4.972 5.643 ( -9.773 -0.070 31.257) 32.749 6.084 ( -5.395 12.844 6.520) 15.381 6.312 ( -5.143 -0.052 38.545) 38.887 6.660 ( 6.413 -3.241 0.499) 7.203 7.114 ( -10.864 0.615 12.429) 16.519 7.295 ( -1.076 -10.570 -1.863) 10.787 7.788 ( 8.713 -0.957 4.433) 9.823 7.990 ( 3.255 0.785 0.123) 3.350 8.206 ( 8.764 -1.875 -11.587) 14.649 8.397 ( 1.442 -1.131 -2.741) 3.298 8.453 ( -6.859 0.323 -6.040) 9.146 9.011 ( -5.900 -0.658 -6.133) 8.535 9.296 ( 9.422 2.608 -1.186) 9.848 9.476 ( 0.970 2.160 -0.198) 2.376 9.764 ( 3.236 1.202 -7.760) 8.493 10.231 ( -5.530 1.798 -2.465) 6.316 10.404 ( -3.402 -7.167 2.285) 8.256 10.780 ( 1.397 -0.814 -8.595) 8.746 11.132 ( 3.258 4.077 1.294) 5.377 11.571 ( -1.857 9.583 -6.635) 11.803 11.854 ( -6.576 -8.898 -5.598) 12.400 12.316 ( 1.202 1.944 4.179) 4.763 12.389 ( 3.309 -3.154 6.465) 7.918 13.152 ( -0.378 2.786 -10.864) 11.222 13.600 ( 7.752 2.893 10.629) 13.470 13.809 ( -1.320 1.946 -3.847) 4.509 13.971 ( -1.330 -6.678 -5.738) 8.905 14.536 ( 7.935 -1.083 3.167) 8.612 15.145 ( 0.895 6.320 -12.057) 13.642 15.367 ( -5.921 3.832 1.355) 7.182 15.537 ( 1.395 -2.185 -3.259) 4.165 15.696 ( -0.732 -3.524 1.414) 3.867 16.172 ( 3.808 2.534 10.380) 11.343 16.647 ( -28.138 8.023 -0.488) 29.264 18.233 ( -21.033 -2.038 23.633) 31.703 19.317 ( -2.266 1.573 15.958) 16.194 21.189 ( 17.680 -2.218 -32.129) 36.739 21.566 ( 12.326 0.328 -31.458) 33.789 24.656 ( -7.921 -0.118 5.088) 9.415 25.410 ( 5.627 0.256 18.238) 19.088 25.608 ( 27.286 1.733 -14.115) 30.769 26.611 ( -6.773 0.863 -17.397) 18.689 29.297 ( -10.605 4.928 2.500) 11.958 29.484 ( -4.050 -4.119 0.720) 5.821 29.649 ( 0.110 -2.034 -3.206) 3.798 29.862 ( 10.220 -4.134 0.854) 11.058 30.937 ( 6.493 1.538 12.196) 13.902 31.239 ( 2.351 -3.530 1.157) 4.396 31.631 ( -4.407 5.882 18.630) 20.027 32.461 ( -17.638 -0.253 -7.265) 19.077 ======================= Grid point 197 (96/186) ======================= q-point: ( 0.25 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.140 ( 9.810 7.518 14.440) 19.007 2.642 ( -1.902 5.166 -4.793) 7.299 2.780 ( 13.261 -6.095 11.200) 18.396 3.308 ( -3.557 7.664 -3.754) 9.246 3.622 ( 5.246 2.068 7.264) 9.196 3.966 ( -3.221 -0.033 5.548) 6.415 4.644 ( -4.073 -17.216 5.430) 18.506 4.688 ( 1.283 -14.591 10.270) 17.889 5.043 ( -0.627 -4.422 3.079) 5.425 5.515 ( 8.201 12.662 5.473) 16.048 5.651 ( -13.203 -7.324 20.527) 25.482 5.814 ( -9.638 11.109 3.212) 15.054 6.522 ( -1.970 -2.917 46.515) 46.648 6.672 ( -9.698 4.905 16.000) 19.342 7.095 ( -1.887 -4.333 5.914) 7.570 7.434 ( 4.156 -7.672 -9.045) 12.568 7.835 ( -4.920 3.018 1.967) 6.097 8.031 ( 2.447 -1.692 -1.822) 3.489 8.176 ( 0.852 4.602 -4.278) 6.341 8.351 ( 1.432 -5.293 -12.958) 14.070 8.565 ( 9.330 -4.715 -1.911) 10.626 8.889 ( -5.674 2.427 -9.565) 11.382 9.376 ( 9.226 2.301 1.335) 9.602 9.487 ( 2.868 -0.371 -0.050) 2.892 9.781 ( 6.041 -0.154 -2.967) 6.732 10.111 ( -7.484 1.119 -7.105) 10.380 10.467 ( -3.254 -5.448 6.708) 9.234 10.766 ( -0.452 -1.556 -8.219) 8.377 11.093 ( 2.756 6.574 -2.155) 7.447 11.418 ( 0.612 6.230 -5.107) 8.079 11.850 ( -6.891 -6.136 -3.786) 9.974 12.332 ( 2.046 0.951 3.929) 4.531 12.541 ( 6.582 -3.357 8.098) 10.962 13.036 ( -1.457 3.818 -12.393) 13.050 13.666 ( 5.109 2.756 2.689) 6.398 13.728 ( -2.514 2.739 -5.424) 6.576 14.073 ( 0.776 -8.046 2.738) 8.534 14.647 ( 3.345 -1.663 2.263) 4.368 14.937 ( -4.440 12.007 -10.318) 16.442 15.269 ( -1.908 3.261 1.763) 4.169 15.550 ( -0.133 -1.125 -3.810) 3.975 15.744 ( -0.795 -3.163 2.065) 3.860 16.196 ( -9.026 1.970 7.561) 11.938 16.266 ( -10.258 5.609 8.351) 14.368 18.169 ( -13.925 -4.817 22.240) 26.678 19.331 ( -2.356 3.055 15.319) 15.798 21.289 ( 16.709 -1.230 -30.485) 34.786 21.573 ( 13.182 0.170 -31.781) 34.407 24.574 ( -7.001 0.754 3.549) 7.885 25.536 ( 3.092 2.157 14.499) 14.981 25.772 ( 11.504 0.201 -16.693) 20.274 26.482 ( 3.484 2.038 -14.563) 15.112 29.127 ( -8.604 3.275 2.767) 9.613 29.488 ( -2.999 -1.845 0.925) 3.641 29.688 ( -1.326 -6.959 -3.182) 7.766 30.024 ( 6.695 -2.465 3.302) 7.861 31.019 ( 2.997 2.947 9.754) 10.621 31.388 ( 6.427 -6.042 5.106) 10.192 31.529 ( -8.108 8.915 19.012) 22.509 32.224 ( -13.673 -0.667 -9.374) 16.591 ======================= Grid point 198 (97/186) ======================= q-point: ( 0.38 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.155 ( 2.375 9.549 6.100) 11.577 2.529 ( -0.810 4.091 -2.129) 4.682 2.974 ( -0.810 1.219 8.747) 8.869 3.117 ( -0.808 8.376 1.593) 8.564 3.656 ( -0.388 3.821 7.193) 8.154 4.051 ( 4.013 -5.427 9.545) 11.690 4.812 ( 1.200 -7.933 -1.440) 8.152 4.978 ( -0.145 -14.312 12.530) 19.022 5.148 ( -0.827 -6.652 3.481) 7.553 5.399 ( 12.358 19.475 -3.953) 23.401 5.606 ( -12.868 2.381 12.833) 18.329 5.733 ( -11.870 -12.857 15.747) 23.541 6.503 ( -17.846 4.651 23.970) 30.244 6.722 ( -4.802 -0.453 39.423) 39.717 7.171 ( 2.529 -1.697 2.234) 3.777 7.449 ( 0.284 4.855 -6.557) 8.164 7.705 ( -8.137 -1.051 -1.331) 8.312 8.053 ( 0.244 -1.225 -5.768) 5.902 8.150 ( 4.794 4.025 -1.687) 6.483 8.367 ( 2.512 -2.222 -15.228) 15.593 8.749 ( 1.689 4.781 -5.549) 7.517 8.782 ( 6.146 -12.564 -3.896) 14.519 9.440 ( 6.582 3.602 -2.861) 8.030 9.538 ( -0.210 -2.684 -0.849) 2.823 9.912 ( 0.597 -2.353 -3.118) 3.952 9.963 ( 3.728 0.218 -2.590) 4.544 10.539 ( -4.005 -5.462 10.412) 12.421 10.741 ( -0.282 -1.810 -7.639) 7.855 11.006 ( 2.955 9.737 -0.791) 10.206 11.362 ( 2.290 2.117 -6.305) 7.034 11.829 ( -5.938 -4.943 0.336) 7.733 12.363 ( 3.172 3.106 4.701) 6.466 12.712 ( 7.049 -3.832 4.704) 9.301 12.910 ( -1.776 2.702 -10.687) 11.165 13.627 ( -3.202 1.923 -6.944) 7.885 13.709 ( 3.563 -0.288 0.390) 3.595 14.201 ( 0.851 -5.295 5.529) 7.703 14.547 ( -11.773 12.015 2.872) 17.065 14.791 ( 4.595 -2.515 -10.947) 12.135 15.239 ( 2.725 4.147 1.911) 5.317 15.535 ( -0.832 0.016 -2.320) 2.465 15.773 ( 0.431 0.178 2.375) 2.420 16.018 ( -13.383 -1.708 4.338) 14.171 16.269 ( 0.870 0.946 10.355) 10.435 18.213 ( -9.312 -7.107 22.818) 25.649 19.321 ( -3.391 3.618 15.424) 16.201 21.341 ( 15.445 2.014 -32.458) 36.002 21.596 ( 12.775 -0.776 -30.593) 33.162 24.503 ( -3.402 2.005 3.678) 5.397 25.533 ( -4.376 2.783 0.555) 5.216 25.759 ( -4.413 -1.778 -7.186) 8.619 26.518 ( 16.380 3.189 -11.579) 20.311 29.027 ( -4.741 0.649 3.068) 5.684 29.466 ( -2.187 0.256 -0.015) 2.202 29.767 ( -3.135 -10.000 -2.328) 10.735 30.138 ( 5.280 -0.124 5.256) 7.451 31.045 ( 0.018 2.012 9.053) 9.274 31.316 ( -14.579 8.834 19.479) 25.885 31.634 ( 5.323 -6.359 8.847) 12.126 32.055 ( -1.924 1.032 -13.689) 13.862 ======================= Grid point 199 (98/186) ======================= q-point: (-0.50 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.994 ( -8.019 11.427 6.551) 15.420 2.546 ( 3.839 -5.646 -2.744) 7.358 2.776 ( -10.438 14.258 11.348) 21.000 3.153 ( 5.807 2.107 4.863) 7.861 3.583 ( -6.123 5.040 6.961) 10.552 4.243 ( 4.385 -4.876 11.225) 13.000 4.871 ( 0.586 0.460 -0.153) 0.761 5.083 ( -1.473 7.840 -1.924) 8.206 5.138 ( -8.348 -3.391 15.339) 17.790 5.301 ( 2.458 8.116 -7.037) 11.019 5.590 ( -5.149 -5.306 13.813) 15.668 5.838 ( -8.250 -11.134 12.862) 18.907 6.345 ( -20.990 1.838 31.672) 38.040 6.790 ( -7.434 2.180 30.449) 31.419 7.234 ( 5.100 -0.586 -0.039) 5.133 7.351 ( 4.027 6.376 -4.789) 8.934 7.620 ( -8.665 -1.369 1.064) 8.837 8.014 ( 2.950 4.770 -7.528) 9.387 8.144 ( 0.580 -1.511 -13.492) 13.589 8.372 ( 4.790 -2.094 -7.322) 8.997 8.710 ( 3.434 2.859 -2.966) 5.363 9.052 ( 7.463 -13.798 -2.592) 15.899 9.426 ( 1.606 3.449 -4.369) 5.794 9.502 ( -5.540 0.193 -5.442) 7.768 9.782 ( -2.934 1.695 -7.924) 8.618 10.196 ( 9.478 -6.379 3.572) 11.970 10.599 ( -4.657 -3.249 11.051) 12.424 10.745 ( 2.008 -1.175 -4.530) 5.093 10.918 ( 4.790 8.959 -0.728) 10.185 11.340 ( 0.659 -1.063 -5.541) 5.681 11.860 ( -1.695 -4.824 5.301) 7.365 12.358 ( 2.865 6.490 4.035) 8.162 12.775 ( -1.385 0.365 -10.816) 10.910 12.906 ( 5.529 -2.803 4.717) 7.789 13.531 ( -3.872 0.213 -9.078) 9.872 13.771 ( 2.273 -2.861 -0.479) 3.685 14.208 ( -7.607 7.984 4.398) 11.872 14.326 ( -0.553 1.034 1.970) 2.293 14.876 ( 4.765 -6.699 -7.586) 11.186 15.221 ( 3.118 4.280 -1.201) 5.429 15.515 ( -0.320 1.227 1.201) 1.746 15.771 ( 3.841 4.094 -2.397) 6.104 15.961 ( -8.052 -5.263 8.290) 12.698 16.348 ( -0.416 -5.935 9.406) 11.130 18.332 ( -6.359 -8.211 23.669) 25.847 19.300 ( -4.736 2.736 16.415) 17.302 21.322 ( 14.959 4.743 -36.005) 39.277 21.619 ( 11.008 -0.999 -29.497) 31.500 24.477 ( 1.512 2.983 5.381) 6.335 25.377 ( -11.511 -0.246 -11.990) 16.622 25.658 ( -10.470 1.795 4.480) 11.529 26.661 ( 18.982 2.284 -10.531) 21.827 29.020 ( -0.063 -2.082 2.649) 3.370 29.435 ( -1.433 0.411 -0.356) 1.533 29.841 ( -5.099 -9.301 -2.156) 10.824 30.211 ( 4.774 2.873 5.211) 7.629 31.031 ( -6.454 6.466 11.289) 14.522 31.125 ( -11.172 0.462 14.453) 18.273 31.681 ( -9.875 1.282 8.823) 13.305 32.125 ( 18.110 -4.165 -10.697) 21.442 ======================= Grid point 200 (99/186) ======================= q-point: (-0.38 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.768 ( -11.467 8.569 14.792) 20.585 2.457 ( -12.610 17.627 18.259) 28.339 2.769 ( 7.164 -14.333 -3.938) 16.500 3.187 ( 2.426 3.977 2.942) 5.510 3.448 ( -8.099 6.002 8.861) 13.421 4.342 ( -1.121 2.954 12.175) 12.578 4.791 ( -2.278 9.589 1.711) 10.004 4.929 ( -3.703 3.793 -3.417) 6.306 5.101 ( -10.748 3.696 8.960) 14.473 5.208 ( 5.206 3.670 -4.864) 8.014 5.623 ( -7.805 -0.743 17.889) 19.532 5.960 ( -7.298 -11.381 14.287) 19.670 6.212 ( -20.786 0.700 34.184) 40.014 6.781 ( -6.396 4.362 19.089) 20.599 7.298 ( -0.118 2.436 6.047) 6.521 7.336 ( 7.202 2.668 -0.522) 7.698 7.585 ( -0.821 -4.777 -1.751) 5.154 7.927 ( 1.452 5.943 -11.421) 12.957 8.076 ( 1.303 1.172 -16.480) 16.573 8.470 ( 5.629 -4.749 -7.574) 10.564 8.708 ( 2.556 1.749 0.878) 3.219 9.258 ( 0.886 -4.575 -3.304) 5.712 9.317 ( -5.000 2.509 -5.533) 7.868 9.451 ( 0.951 -4.247 -4.219) 6.062 9.718 ( -1.030 0.192 -7.124) 7.201 10.348 ( 2.590 -3.184 0.557) 4.142 10.611 ( -2.101 1.143 7.275) 7.658 10.762 ( -0.864 -2.273 -2.276) 3.330 10.882 ( 8.128 7.963 -1.464) 11.473 11.383 ( 0.364 -6.476 -0.477) 6.504 11.958 ( 1.776 -4.117 7.844) 9.035 12.304 ( 2.564 8.145 2.623) 8.933 12.685 ( -4.558 0.349 -7.040) 8.394 13.037 ( 5.671 -2.739 1.302) 6.430 13.417 ( -6.206 1.227 -8.519) 10.611 13.819 ( -0.188 -3.119 -3.070) 4.381 14.086 ( 2.524 4.269 3.374) 5.998 14.319 ( -1.736 1.954 1.511) 3.019 15.012 ( 5.778 -7.461 -6.769) 11.613 15.206 ( 2.862 1.070 -2.988) 4.274 15.508 ( 1.324 2.351 3.684) 4.566 15.745 ( 5.039 4.999 -4.896) 8.623 16.001 ( -4.987 -5.446 7.632) 10.620 16.539 ( 1.094 -15.085 10.589) 18.463 18.487 ( -5.344 -8.163 23.949) 25.860 19.288 ( -6.317 0.496 17.760) 18.857 21.258 ( 14.916 6.151 -38.686) 41.916 21.619 ( 9.452 -0.606 -29.554) 31.035 24.513 ( 6.194 3.590 7.694) 10.509 25.161 ( -13.492 -1.446 -14.394) 19.782 25.495 ( -12.807 4.431 9.685) 16.657 26.814 ( 15.203 0.615 -10.536) 18.508 29.101 ( 4.679 -3.701 1.245) 6.094 29.421 ( -1.002 -0.874 0.205) 1.346 29.855 ( -6.919 -5.336 -2.954) 9.223 30.208 ( 2.527 7.687 1.572) 8.243 30.842 ( -12.743 5.928 13.143) 19.242 31.153 ( -3.201 -3.926 12.298) 13.300 31.550 ( -8.323 3.718 6.813) 11.380 32.410 ( 18.479 -6.513 -5.609) 20.381 ======================= Grid point 201 (100/186) ======================= q-point: (-0.25 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.648 ( -9.117 2.549 23.687) 25.508 2.133 ( -13.507 18.517 24.882) 33.830 3.020 ( 0.444 -6.850 -4.846) 8.403 3.171 ( 2.865 -4.920 1.035) 5.787 3.332 ( -4.815 5.457 13.693) 15.507 4.274 ( -3.249 7.625 9.499) 12.607 4.609 ( -4.667 10.272 3.176) 11.721 4.837 ( -8.994 7.933 -3.058) 12.376 4.925 ( 2.987 5.051 3.960) 7.079 5.259 ( 3.653 -1.700 0.612) 4.075 5.630 ( -10.950 -1.838 29.102) 31.148 6.048 ( -17.262 -6.770 30.488) 35.684 6.185 ( -5.982 -6.483 15.230) 17.600 6.674 ( -3.073 8.130 0.843) 8.732 7.275 ( -9.600 1.781 26.936) 28.651 7.380 ( 5.375 4.942 1.465) 7.447 7.695 ( 7.605 -4.898 -5.223) 10.445 7.772 ( -1.933 3.759 -20.161) 20.599 8.022 ( 5.532 3.785 -9.124) 11.322 8.493 ( 2.247 1.996 -11.940) 12.312 8.756 ( -0.239 -4.458 0.738) 4.525 9.152 ( -6.868 -0.036 -5.061) 8.532 9.264 ( 0.618 5.306 -0.520) 5.367 9.543 ( -2.255 -7.148 -3.095) 8.109 9.692 ( 2.682 -1.932 -8.046) 8.699 10.376 ( -1.379 -0.621 -0.722) 1.676 10.572 ( 2.088 7.360 -0.928) 7.706 10.801 ( -2.277 -6.094 6.459) 9.168 10.874 ( 6.297 4.645 -4.487) 9.020 11.502 ( 0.832 -8.686 0.964) 8.779 12.060 ( 2.036 -0.397 7.432) 7.716 12.236 ( 1.298 6.048 0.176) 6.188 12.585 ( -6.520 0.148 -4.017) 7.659 13.130 ( 3.555 -2.749 -3.545) 5.724 13.298 ( -2.904 2.343 0.522) 3.767 13.844 ( 0.614 -3.314 -4.975) 6.009 14.135 ( 7.877 2.289 -2.578) 8.598 14.249 ( -3.391 3.329 3.632) 5.981 15.131 ( 4.967 -5.487 -11.253) 13.469 15.263 ( 4.207 -3.695 0.256) 5.605 15.518 ( 3.125 3.345 4.149) 6.178 15.718 ( 3.812 4.413 -3.423) 6.762 16.031 ( -4.555 -3.726 4.286) 7.280 16.871 ( 2.693 -21.412 5.829) 22.354 18.623 ( -8.661 -6.916 23.545) 26.023 19.292 ( -8.540 -2.125 18.000) 20.036 21.173 ( 14.968 6.474 -39.959) 43.159 21.600 ( 9.030 -0.332 -29.929) 31.263 24.597 ( 7.889 4.055 9.414) 12.935 24.978 ( -5.912 -0.726 -8.963) 10.761 25.329 ( -11.684 3.703 12.181) 17.280 26.915 ( 7.932 -1.007 -11.975) 14.399 29.243 ( 9.220 -3.561 -0.424) 9.893 29.436 ( -1.490 -3.085 1.138) 3.610 29.778 ( -7.537 0.522 -3.932) 8.517 30.065 ( -2.738 11.750 -2.468) 12.315 30.725 ( -7.446 1.962 15.264) 17.096 31.220 ( -2.482 -1.996 9.040) 9.585 31.477 ( -4.351 -0.116 10.539) 11.402 32.677 ( 12.624 -6.079 -6.125) 15.292 ======================= Grid point 202 (101/186) ======================= q-point: (-0.12 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.674 ( -5.377 -0.365 27.946) 28.461 1.928 ( -2.544 11.108 28.983) 31.143 2.904 ( -6.178 4.499 -5.778) 9.581 3.306 ( 2.188 0.165 0.380) 2.227 3.419 ( 1.595 -9.583 17.537) 20.048 4.187 ( -3.097 3.557 3.314) 5.764 4.467 ( -2.393 6.268 6.575) 9.394 4.576 ( -6.548 11.052 1.660) 12.953 4.967 ( 2.318 -0.014 3.874) 4.515 5.345 ( 2.916 -3.004 5.374) 6.812 5.643 ( -12.580 1.007 33.258) 35.572 6.056 ( -15.706 -2.630 37.626) 40.857 6.307 ( -2.540 -11.388 1.671) 11.787 6.550 ( 2.402 6.673 -4.554) 8.428 7.234 ( -5.466 5.504 12.940) 15.087 7.347 ( -6.900 4.224 18.279) 19.990 7.630 ( 2.197 1.604 -14.503) 14.756 7.844 ( 7.012 -4.626 -3.919) 9.270 8.025 ( 9.783 4.385 -7.451) 13.056 8.408 ( 0.238 3.416 -9.739) 10.324 8.768 ( -7.006 -3.674 -2.808) 8.394 9.105 ( 0.173 -2.057 -1.831) 2.759 9.188 ( -0.925 3.982 -1.809) 4.471 9.543 ( -4.178 -2.919 -2.932) 5.880 9.745 ( 4.285 -2.432 -7.461) 8.941 10.346 ( -3.318 -0.839 -0.176) 3.427 10.468 ( -0.016 7.926 -2.296) 8.252 10.835 ( 1.915 0.511 -9.095) 9.308 10.956 ( 3.631 -4.157 11.055) 12.356 11.631 ( 1.630 -7.994 -3.448) 8.857 12.047 ( -2.595 7.164 4.723) 8.965 12.194 ( 0.469 -0.315 -1.803) 1.890 12.479 ( -6.819 0.278 -2.472) 7.259 13.188 ( 3.132 -3.134 -4.948) 6.642 13.309 ( 3.671 1.403 10.648) 11.350 13.866 ( 0.441 -2.115 -5.896) 6.279 14.089 ( -0.663 4.010 -9.594) 10.420 14.281 ( 6.310 0.774 7.273) 9.660 15.197 ( 4.562 -4.192 -13.905) 15.223 15.381 ( 4.236 -4.519 0.183) 6.197 15.522 ( 1.208 3.740 4.445) 5.933 15.688 ( 1.607 3.254 -1.233) 3.833 16.047 ( -1.627 -2.180 4.368) 5.146 17.142 ( -3.745 -15.219 -6.022) 16.790 18.631 ( -20.592 -3.351 23.195) 31.197 19.288 ( -9.252 -1.848 16.935) 19.386 21.100 ( 15.844 4.374 -38.721) 42.065 21.579 ( 9.717 -0.214 -30.272) 31.794 24.672 ( 3.562 2.253 10.080) 10.926 25.015 ( 14.882 -0.744 -3.274) 15.256 25.232 ( -6.827 1.633 14.197) 15.838 26.915 ( -0.592 -1.272 -14.907) 14.973 29.426 ( 12.454 -3.219 -0.874) 12.893 29.471 ( -3.036 -4.909 1.252) 5.906 29.633 ( -5.461 4.994 -2.436) 7.791 29.841 ( -6.016 9.278 -2.847) 11.419 30.729 ( -1.617 0.281 15.331) 15.418 31.220 ( -2.144 0.952 3.952) 4.596 31.537 ( -1.481 -3.269 14.922) 15.347 32.799 ( 0.805 -3.110 -8.386) 8.980 ======================= Grid point 204 (102/186) ======================= q-point: ( 0.12 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.300 ( 15.746 0.000 13.964) 21.046 2.671 ( 18.089 0.000 14.768) 23.352 2.790 ( 8.623 0.000 -3.681) 9.376 3.417 ( 10.403 0.000 -14.902) 18.174 3.701 ( -1.640 -0.000 13.336) 13.437 3.968 ( -8.848 -0.000 4.247) 9.814 4.283 ( -6.570 -0.000 19.900) 20.957 4.434 ( -8.925 -0.000 7.857) 11.891 5.011 ( 2.061 0.000 -1.931) 2.824 5.425 ( -10.184 -0.000 15.155) 18.259 5.768 ( -4.792 -0.000 32.066) 32.422 6.094 ( -4.528 -0.000 -16.002) 16.631 6.489 ( -0.474 -0.000 51.302) 51.304 6.756 ( 9.654 0.000 0.756) 9.684 7.084 ( -16.980 -0.000 20.558) 26.664 7.149 ( 7.629 0.000 -13.896) 15.852 7.904 ( 7.134 0.000 0.529) 7.154 7.977 ( -5.490 -0.000 -0.722) 5.537 8.249 ( 8.788 0.000 -9.590) 13.008 8.259 ( -11.742 -0.000 -5.552) 12.989 8.515 ( 9.410 0.000 -1.147) 9.480 8.921 ( -1.513 -0.000 -5.524) 5.728 9.419 ( 7.405 0.000 -1.723) 7.603 9.515 ( 1.514 0.000 2.195) 2.666 9.758 ( 1.988 0.000 -8.726) 8.950 10.136 ( -8.324 -0.000 -7.816) 11.418 10.368 ( 2.006 0.000 8.661) 8.891 10.769 ( 2.434 0.000 -6.262) 6.718 11.131 ( -2.560 -0.000 -10.981) 11.275 11.628 ( -0.945 -0.000 -11.433) 11.472 11.688 ( -2.571 -0.000 6.414) 6.910 12.338 ( 0.999 0.000 2.043) 2.275 12.492 ( 6.582 0.000 11.199) 12.991 13.093 ( -2.890 -0.000 -12.357) 12.691 13.730 ( 2.798 0.000 -4.930) 5.669 13.843 ( -1.998 -0.000 -9.782) 9.984 13.865 ( 4.369 0.000 14.301) 14.954 14.612 ( 3.720 0.000 -0.976) 3.846 15.151 ( 0.715 0.000 -11.287) 11.310 15.339 ( -2.964 -0.000 2.450) 3.846 15.499 ( -1.590 -0.000 -7.542) 7.707 15.663 ( -2.031 -0.000 4.587) 5.016 16.288 ( 2.521 0.000 11.797) 12.064 16.311 ( -31.825 -0.000 9.529) 33.221 18.100 ( -13.549 -0.000 19.261) 23.549 19.381 ( -1.810 -0.000 15.617) 15.721 21.263 ( 18.419 0.000 -28.956) 34.318 21.579 ( 12.854 0.000 -31.867) 34.362 24.583 ( -6.434 -0.000 4.213) 7.690 25.569 ( 4.003 0.000 19.335) 19.745 25.766 ( 7.345 0.000 -22.539) 23.706 26.535 ( 8.399 0.000 -16.551) 18.560 29.180 ( -12.890 -0.000 1.474) 12.974 29.417 ( -2.441 -0.000 1.094) 2.675 29.592 ( -2.609 -0.000 -1.388) 2.955 30.004 ( 10.594 0.000 4.495) 11.508 31.118 ( 9.201 0.000 10.280) 13.796 31.234 ( 2.497 0.000 -0.999) 2.690 31.709 ( -4.708 -0.000 17.750) 18.363 32.173 ( -20.487 -0.000 -3.634) 20.807 ======================= Grid point 205 (103/186) ======================= q-point: ( 0.25 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.487 ( 13.689 8.264 7.591) 17.701 2.808 ( 10.516 13.241 -1.649) 16.990 2.961 ( 13.034 -0.539 10.904) 17.002 3.408 ( 3.559 9.568 -6.696) 12.209 3.738 ( 2.974 2.144 9.957) 10.611 3.916 ( -5.115 -4.678 4.758) 8.407 4.391 ( -7.004 -12.207 9.952) 17.237 4.505 ( -3.244 -17.903 17.261) 25.080 5.049 ( 5.750 0.115 -2.064) 6.110 5.429 ( -10.545 -7.109 19.860) 23.583 5.743 ( -15.333 4.048 19.572) 25.190 5.918 ( 4.272 12.832 -6.525) 15.016 6.701 ( -1.888 6.004 21.390) 22.297 6.761 ( -5.658 6.868 34.904) 36.021 7.043 ( 0.193 -7.004 5.388) 8.839 7.300 ( 5.430 -11.521 -10.347) 16.410 7.803 ( -8.993 5.614 -3.426) 11.141 7.986 ( -0.795 -2.730 -6.121) 6.749 8.143 ( -4.808 -3.400 -3.014) 6.615 8.326 ( 8.578 -0.144 -7.416) 11.340 8.580 ( 1.290 -2.574 -4.035) 4.957 8.927 ( 8.667 5.323 -2.714) 10.527 9.451 ( -0.601 -1.004 -6.544) 6.647 9.558 ( 5.693 3.003 8.312) 10.513 9.782 ( 2.238 -5.030 -3.823) 6.703 9.991 ( -7.427 0.163 -6.603) 9.939 10.462 ( 3.999 -0.865 6.537) 7.712 10.742 ( 0.565 3.193 -6.420) 7.193 11.058 ( -2.495 -4.639 -11.710) 12.840 11.503 ( -0.516 5.676 -8.614) 10.329 11.743 ( -0.053 -1.276 5.824) 5.962 12.388 ( 4.084 -0.528 3.260) 5.252 12.636 ( 6.001 -1.449 10.341) 12.044 12.973 ( -4.408 1.450 -12.705) 13.526 13.697 ( -0.938 1.840 -7.343) 7.629 13.751 ( 0.347 2.726 -5.413) 6.071 14.048 ( 4.873 -4.683 11.107) 13.002 14.621 ( -2.405 -2.058 -3.518) 4.732 15.002 ( -3.509 11.853 -10.750) 16.382 15.326 ( 2.096 2.545 4.224) 5.358 15.480 ( -1.655 -6.128 -7.410) 9.756 15.677 ( -3.062 -2.990 4.583) 6.271 16.004 ( -22.207 0.840 13.613) 26.061 16.347 ( -0.428 1.926 11.755) 11.919 18.067 ( -8.359 -2.795 17.423) 19.526 19.412 ( -2.671 2.153 15.595) 15.967 21.362 ( 17.291 -0.018 -27.728) 32.677 21.587 ( 12.429 -0.010 -32.471) 34.768 24.540 ( -2.640 0.670 4.389) 5.166 25.605 ( -7.319 2.023 -13.489) 15.480 25.700 ( -2.690 -1.918 8.162) 8.806 26.629 ( 19.865 3.269 -17.152) 26.448 29.032 ( -10.478 -0.150 1.569) 10.596 29.410 ( -3.451 -2.863 1.169) 4.634 29.577 ( -2.156 -2.978 -0.322) 3.691 30.151 ( 8.416 0.521 7.646) 11.383 31.159 ( 2.466 6.462 5.568) 8.879 31.375 ( 2.209 -8.069 5.880) 10.225 31.641 ( -7.381 9.240 15.874) 19.795 31.983 ( -10.005 -5.563 -6.223) 13.030 ======================= Grid point 206 (104/186) ======================= q-point: ( 0.38 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.473 ( 9.237 17.575 -0.251) 19.856 2.705 ( 8.316 16.782 0.877) 18.750 3.067 ( -0.338 6.864 10.564) 12.603 3.300 ( 7.748 8.769 1.866) 11.850 3.733 ( -3.604 5.786 9.700) 11.855 4.027 ( 0.991 -9.712 7.112) 12.079 4.591 ( -3.157 -18.400 2.900) 18.893 4.818 ( -5.315 -17.885 19.139) 26.729 5.138 ( 8.878 -0.330 -1.217) 8.967 5.485 ( -17.912 0.432 17.954) 25.365 5.545 ( -2.373 -4.173 -3.995) 6.245 5.817 ( 5.509 14.798 14.827) 21.661 6.478 ( -15.299 9.108 16.025) 23.954 6.881 ( -3.214 4.108 36.383) 36.755 7.177 ( 1.297 -5.411 4.495) 7.153 7.416 ( 0.666 -5.322 -10.007) 11.354 7.622 ( -4.616 3.764 -2.453) 6.442 7.956 ( -2.691 -3.607 -9.016) 10.076 8.135 ( -2.717 -3.907 -7.693) 9.046 8.380 ( 6.782 2.000 -6.557) 9.643 8.667 ( 4.293 -8.224 -2.385) 9.578 8.922 ( 8.348 9.341 -0.027) 12.528 9.404 ( -5.490 -2.483 -5.004) 7.833 9.601 ( 2.584 3.568 0.300) 4.416 9.809 ( -4.997 -0.566 -5.719) 7.615 10.005 ( 6.953 -7.000 2.304) 10.132 10.541 ( 2.133 -0.186 7.995) 8.277 10.676 ( -0.605 -0.257 -6.622) 6.654 11.064 ( 0.733 -2.424 -6.377) 6.862 11.389 ( -0.306 3.583 -10.612) 11.205 11.781 ( 1.622 0.630 7.073) 7.284 12.467 ( 5.365 1.231 3.463) 6.504 12.770 ( 3.899 -1.387 3.314) 5.302 12.846 ( -3.457 -0.409 -6.812) 7.650 13.591 ( -2.172 3.808 -8.490) 9.555 13.735 ( 1.398 -0.199 -2.266) 2.670 14.201 ( 2.868 -3.209 8.583) 9.602 14.552 ( -9.412 4.807 3.225) 11.049 14.758 ( 0.671 4.275 -14.358) 14.996 15.331 ( 0.626 2.147 -0.685) 2.339 15.528 ( 3.043 -1.422 -0.440) 3.388 15.703 ( -4.219 -6.006 -0.966) 7.403 15.860 ( -11.556 -1.825 13.972) 18.224 16.344 ( -2.493 2.972 10.312) 11.018 18.126 ( -5.433 -5.769 18.539) 20.162 19.403 ( -4.133 3.769 16.029) 16.977 21.420 ( 15.344 2.265 -30.043) 33.810 21.590 ( 11.303 -0.926 -31.975) 33.927 24.543 ( 1.850 1.713 5.809) 6.333 25.371 ( -12.507 -0.280 -19.023) 22.767 25.704 ( -7.070 1.452 13.425) 15.242 26.758 ( 20.417 3.902 -16.869) 26.770 28.948 ( -6.875 -2.765 2.058) 7.691 29.403 ( -4.167 -2.503 0.401) 4.878 29.618 ( -1.116 -5.582 0.881) 5.760 30.279 ( 7.637 1.782 9.572) 12.375 31.119 ( -2.134 3.827 7.814) 8.958 31.322 ( -14.575 7.605 11.636) 20.141 31.624 ( -2.635 -2.865 12.387) 12.984 31.993 ( 6.853 -5.896 -13.005) 15.838 ======================= Grid point 207 (105/186) ======================= q-point: (-0.50 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.273 ( 6.219 23.666 -1.395) 24.509 2.626 ( 7.431 8.093 1.245) 11.057 2.934 ( -3.729 13.378 11.367) 17.946 3.337 ( 7.137 7.219 6.517) 12.063 3.617 ( -5.971 6.723 7.912) 11.978 4.212 ( -1.188 -9.767 8.390) 12.930 4.743 ( -6.064 -10.538 0.944) 12.194 4.980 ( -11.920 -9.999 15.736) 22.129 5.206 ( 4.548 6.953 2.561) 8.694 5.261 ( -10.054 1.963 -6.717) 12.250 5.672 ( 1.152 -6.062 9.285) 11.148 5.804 ( 4.731 8.776 19.987) 22.336 6.274 ( -17.733 4.485 26.917) 32.544 6.907 ( -4.331 5.168 25.710) 26.580 7.271 ( 1.716 -3.170 3.274) 4.870 7.425 ( 0.864 -4.157 -8.198) 9.232 7.520 ( -3.695 5.061 1.561) 6.458 7.938 ( -1.051 -4.708 -14.566) 15.344 8.124 ( 2.215 -0.796 -7.014) 7.399 8.393 ( 4.305 1.334 -5.988) 7.494 8.797 ( 5.324 2.359 -2.443) 6.315 8.974 ( 6.645 -7.014 0.610) 9.681 9.325 ( -7.554 -0.958 -4.916) 9.063 9.537 ( -1.876 3.949 -1.904) 4.768 9.726 ( -2.260 0.880 -6.959) 7.370 10.199 ( 4.823 -6.481 0.795) 8.118 10.590 ( -2.093 -1.721 4.431) 5.194 10.691 ( 0.497 -2.188 3.439) 4.106 11.081 ( 5.683 1.658 -2.932) 6.606 11.296 ( -0.234 1.223 -11.978) 12.043 11.853 ( 2.985 -1.767 7.962) 8.685 12.496 ( 3.716 5.217 1.328) 6.541 12.710 ( -3.196 0.791 -8.248) 8.881 12.931 ( 2.995 -4.492 4.314) 6.910 13.474 ( -1.537 3.529 -8.844) 9.645 13.752 ( 0.066 -1.411 -0.565) 1.522 14.247 ( -3.637 4.147 6.650) 8.640 14.376 ( -1.131 4.865 4.060) 6.437 14.785 ( 4.889 -7.876 -11.488) 14.761 15.268 ( -2.410 2.605 -4.775) 5.949 15.572 ( 2.436 2.340 6.504) 7.329 15.719 ( -4.776 -6.719 -3.925) 9.131 15.888 ( -0.955 -3.771 9.802) 10.545 16.323 ( -3.718 -0.233 8.854) 9.605 18.253 ( -4.483 -7.901 20.389) 22.321 19.362 ( -5.808 4.059 16.812) 18.245 21.405 ( 13.774 4.318 -34.171) 37.094 21.594 ( 10.182 -1.219 -30.920) 32.576 24.596 ( 5.729 2.378 7.754) 9.930 25.138 ( -10.977 -0.315 -15.695) 19.156 25.607 ( -11.573 3.555 11.680) 16.823 26.873 ( 16.888 3.028 -16.263) 23.640 28.956 ( -2.864 -6.039 2.136) 7.017 29.382 ( -3.570 -2.009 -0.371) 4.114 29.692 ( -0.983 -5.434 1.804) 5.810 30.381 ( 7.560 4.375 8.867) 12.447 31.040 ( -17.357 4.357 15.300) 23.545 31.117 ( -0.727 5.243 5.396) 7.559 31.613 ( -9.616 0.432 11.916) 15.318 32.187 ( 15.155 -9.198 -14.213) 22.722 ======================= Grid point 208 (106/186) ======================= q-point: (-0.38 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.021 ( 4.553 22.784 5.278) 23.827 2.686 ( 3.173 9.836 12.308) 16.072 2.738 ( 1.107 6.234 1.274) 6.458 3.293 ( -4.131 6.333 8.451) 11.340 3.506 ( 0.101 7.873 3.734) 8.715 4.293 ( -9.477 -5.507 7.472) 13.265 4.767 ( -3.484 -3.914 -1.534) 5.460 4.968 ( -12.289 -0.696 11.056) 16.545 5.103 ( 2.335 10.804 5.442) 12.320 5.167 ( -2.788 -4.140 -10.141) 11.303 5.758 ( -0.015 3.812 13.680) 14.201 5.854 ( -4.066 1.143 24.349) 24.713 6.165 ( -15.104 2.421 36.918) 39.961 6.881 ( -2.559 6.240 11.542) 13.368 7.307 ( -8.871 -0.494 11.684) 14.678 7.444 ( 3.099 -1.088 -1.899) 3.794 7.524 ( 8.396 -3.387 -3.351) 9.654 7.894 ( -0.215 -0.168 -17.236) 17.238 8.130 ( 6.023 4.015 -5.403) 9.033 8.422 ( 3.229 -4.346 -8.951) 10.461 8.761 ( 1.149 4.845 -3.164) 5.899 9.163 ( -1.936 -2.109 -2.399) 3.735 9.234 ( 0.134 -6.849 -1.263) 6.966 9.455 ( -1.848 3.507 -1.608) 4.278 9.658 ( -2.235 -0.723 -8.456) 8.776 10.304 ( 0.994 -4.167 -1.783) 4.640 10.606 ( -4.047 -5.534 3.444) 7.672 10.715 ( -0.600 2.610 6.009) 6.579 11.111 ( 8.380 8.648 -3.582) 12.564 11.271 ( -0.197 -7.163 -8.127) 10.835 11.974 ( 3.270 -3.858 8.556) 9.939 12.440 ( 1.192 6.903 -1.315) 7.128 12.618 ( -3.812 2.092 -5.081) 6.688 13.025 ( 0.631 -4.589 -2.180) 5.120 13.380 ( 0.402 3.715 -4.564) 5.899 13.764 ( -0.992 -2.101 -0.896) 2.490 14.199 ( 3.482 3.159 5.913) 7.554 14.351 ( -0.770 3.295 2.132) 3.999 14.934 ( 6.152 -9.055 -9.137) 14.259 15.190 ( -2.762 -0.983 -4.982) 5.781 15.599 ( 2.378 2.936 8.237) 9.062 15.734 ( -2.944 -5.009 -3.128) 6.598 15.965 ( 0.563 -1.058 4.830) 4.976 16.382 ( -3.138 -10.169 7.834) 13.214 18.403 ( -6.199 -8.337 21.790) 24.140 19.309 ( -7.586 2.943 17.435) 19.240 21.340 ( 13.144 5.214 -36.680) 39.312 21.585 ( 9.642 -0.709 -31.056) 32.526 24.690 ( 7.134 2.441 8.869) 11.641 24.971 ( -4.230 0.290 -10.171) 11.019 25.446 ( -12.439 4.365 10.979) 17.156 26.936 ( 10.205 2.246 -16.109) 19.201 29.057 ( 0.681 -8.854 1.745) 9.050 29.371 ( -1.928 -2.157 -0.739) 2.986 29.739 ( -1.848 -2.253 1.754) 3.402 30.404 ( 5.595 10.365 2.555) 12.052 30.824 ( -12.831 5.134 14.223) 19.831 31.134 ( -2.085 -2.117 12.081) 12.441 31.523 ( -8.512 2.294 10.007) 13.337 32.442 ( 12.390 -10.560 -13.453) 21.119 ======================= Grid point 209 (107/186) ======================= q-point: (-0.25 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.848 ( 2.887 15.287 13.626) 20.681 2.429 ( -3.480 23.178 21.385) 31.728 2.885 ( 1.738 -7.980 -5.961) 10.111 3.222 ( -0.349 0.975 8.692) 8.753 3.421 ( 1.327 7.331 0.966) 7.513 4.220 ( -11.707 -1.978 3.021) 12.251 4.766 ( -2.290 -0.788 -1.042) 2.636 4.805 ( -3.570 14.178 10.055) 17.744 5.051 ( 1.325 4.396 3.165) 5.576 5.195 ( -0.962 -7.366 -4.388) 8.628 5.739 ( -2.529 6.205 21.272) 22.302 5.884 ( -13.237 -3.512 30.251) 33.207 6.177 ( -8.447 0.911 35.668) 36.666 6.772 ( -0.203 8.384 -3.315) 9.018 7.237 ( -15.023 -0.975 25.252) 29.399 7.538 ( 7.668 1.302 4.091) 8.788 7.655 ( 5.383 -2.648 -16.336) 17.403 7.794 ( 4.634 3.549 -7.740) 9.694 8.127 ( 6.803 3.783 -5.286) 9.409 8.483 ( 3.774 -3.325 -12.303) 13.291 8.674 ( -3.393 2.153 -6.302) 7.474 9.078 ( -3.833 0.625 0.346) 3.899 9.309 ( -1.959 3.538 -0.561) 4.083 9.425 ( -1.088 -4.878 -1.913) 5.351 9.636 ( 1.746 -4.188 -8.931) 10.018 10.330 ( -1.545 -1.748 -2.440) 3.376 10.646 ( -3.545 -0.040 -1.825) 3.987 10.729 ( 1.983 -4.073 11.041) 11.935 11.016 ( 3.411 9.587 -8.927) 13.537 11.376 ( 0.298 -9.475 -2.479) 9.798 12.108 ( 3.622 -3.016 7.703) 9.031 12.318 ( -2.814 8.369 -3.862) 9.637 12.510 ( -4.646 2.128 -3.353) 6.112 13.067 ( 0.679 -5.019 -6.947) 8.597 13.363 ( 4.127 2.653 3.707) 6.149 13.786 ( -0.116 -3.039 -2.525) 3.953 14.247 ( 2.481 5.982 -4.460) 7.864 14.304 ( 3.369 0.917 8.809) 9.476 15.044 ( 1.883 -6.064 -10.719) 12.458 15.222 ( 1.599 -6.851 -1.966) 7.305 15.621 ( 1.485 3.398 6.070) 7.113 15.747 ( -0.575 -2.083 -2.729) 3.481 15.984 ( -0.930 -0.350 5.393) 5.483 16.578 ( -4.624 -19.340 3.383) 20.171 18.497 ( -12.822 -5.892 23.003) 26.986 19.262 ( -8.089 0.848 17.213) 19.037 21.256 ( 13.465 5.655 -37.284) 40.042 21.568 ( 10.034 -0.469 -31.377) 32.946 24.747 ( 0.281 2.403 6.965) 7.373 24.989 ( 12.937 -0.824 -3.590) 13.451 25.309 ( -7.797 3.667 12.698) 15.345 26.908 ( 1.590 1.435 -16.624) 16.761 29.211 ( -0.024 -10.149 1.958) 10.336 29.397 ( 2.622 -2.615 -1.371) 3.949 29.718 ( -2.792 2.054 1.344) 3.718 30.237 ( -0.784 16.037 -4.411) 16.651 30.753 ( -3.866 1.583 17.347) 17.843 31.211 ( -1.386 -2.695 11.311) 11.710 31.460 ( -6.089 -0.287 12.153) 13.596 32.629 ( 4.393 -9.106 -13.636) 16.976 ======================= Grid point 210 (108/186) ======================= q-point: (-0.12 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.814 ( 1.449 4.760 21.671) 22.235 2.287 ( 8.812 15.630 21.958) 28.357 2.834 ( -7.103 1.079 -6.863) 9.936 3.346 ( 9.049 2.871 -9.379) 13.345 3.412 ( -0.567 -8.498 16.094) 18.209 4.117 ( -9.132 -1.786 0.446) 9.315 4.606 ( -3.332 14.823 9.752) 18.053 4.693 ( -1.791 8.560 2.485) 9.092 5.025 ( -0.130 3.481 5.668) 6.653 5.316 ( 3.596 -9.286 1.380) 10.053 5.722 ( -8.094 5.966 27.007) 28.818 5.941 ( -10.992 -10.044 23.070) 27.458 6.225 ( -6.871 0.546 31.486) 32.231 6.670 ( 3.182 6.156 -2.565) 7.390 7.189 ( -14.944 -1.343 24.839) 29.019 7.475 ( 0.353 11.104 -10.795) 15.491 7.674 ( 8.684 0.368 -0.110) 8.692 7.896 ( 8.504 -1.399 -0.435) 8.629 8.159 ( 8.061 1.536 -6.358) 10.381 8.450 ( 3.408 5.825 -10.386) 12.386 8.575 ( -9.038 -3.572 -7.311) 12.162 9.079 ( 0.237 -2.125 -1.776) 2.780 9.211 ( -0.727 2.762 -1.350) 3.159 9.448 ( -1.667 -3.038 -1.204) 3.669 9.711 ( 4.006 -4.554 -7.119) 9.352 10.294 ( -3.921 0.178 -1.534) 4.214 10.545 ( -3.018 6.191 -1.464) 7.041 10.837 ( 0.992 2.529 -4.685) 5.416 10.971 ( 3.930 -5.944 3.649) 8.006 11.489 ( -0.811 -9.365 -4.363) 10.363 12.103 ( -6.806 9.363 -6.695) 13.372 12.221 ( 3.956 -1.674 6.527) 7.814 12.423 ( -2.795 2.372 0.007) 3.666 13.127 ( 1.938 -5.465 -8.176) 10.024 13.439 ( 6.249 0.278 9.203) 11.128 13.809 ( -0.433 -2.769 -4.045) 4.922 14.116 ( -1.727 7.471 -5.196) 9.263 14.422 ( 8.475 0.966 5.973) 10.413 15.094 ( 0.436 -7.268 -10.987) 13.181 15.331 ( 0.466 -6.411 -1.276) 6.553 15.587 ( -1.528 3.690 1.849) 4.401 15.739 ( 0.601 2.225 -1.228) 2.611 16.045 ( 2.215 -2.754 8.362) 9.078 16.742 ( -14.277 -18.697 -2.651) 23.674 18.426 ( -22.264 -0.302 24.554) 33.146 19.261 ( -4.963 -1.348 16.473) 17.257 21.189 ( 15.310 4.827 -35.536) 38.994 21.559 ( 11.155 -0.466 -31.418) 33.343 24.724 ( -5.057 1.047 6.419) 8.238 25.237 ( 19.844 -2.826 -3.245) 20.305 25.308 ( 7.131 1.954 13.677) 15.548 26.784 ( -5.965 0.319 -17.449) 18.444 29.303 ( -6.548 -7.785 2.706) 10.526 29.512 ( 5.685 -4.279 -1.626) 7.299 29.643 ( -0.109 4.805 0.863) 4.883 29.973 ( -1.220 15.017 -4.544) 15.737 30.809 ( 1.812 0.295 15.583) 15.691 31.247 ( 0.602 1.869 4.393) 4.812 31.512 ( -4.718 -5.968 18.030) 19.569 32.646 ( -7.337 -4.561 -12.151) 14.909 ======================= Grid point 213 (109/186) ======================= q-point: ( 0.25 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.725 ( 10.315 0.000 2.766) 10.679 3.112 ( 15.609 0.000 0.138) 15.609 3.179 ( 11.166 0.000 12.758) 16.954 3.536 ( 8.035 0.000 -10.734) 13.408 3.763 ( -11.189 -0.000 7.403) 13.416 3.857 ( 3.654 0.000 10.230) 10.863 4.254 ( -9.923 -0.000 8.106) 12.812 4.413 ( 1.084 0.000 20.636) 20.664 5.157 ( 11.496 0.000 -1.321) 11.572 5.375 ( -8.069 -0.000 26.891) 28.075 5.596 ( -15.495 -0.000 -1.336) 15.552 6.046 ( -4.135 -0.000 21.180) 21.580 6.781 ( -12.284 -0.000 6.891) 14.085 6.912 ( 0.347 0.000 -0.610) 0.702 6.999 ( -1.210 -0.000 38.890) 38.909 7.273 ( 11.146 0.000 -14.322) 18.148 7.694 ( -10.071 -0.000 -3.174) 10.560 7.928 ( 1.817 0.000 -14.671) 14.783 8.025 ( -6.320 -0.000 -0.858) 6.378 8.405 ( 7.239 0.000 -5.397) 9.030 8.556 ( 1.918 0.000 -0.389) 1.957 9.121 ( 13.401 0.000 -2.961) 13.724 9.360 ( -6.551 -0.000 -4.934) 8.201 9.686 ( -4.424 -0.000 -5.023) 6.693 9.741 ( 7.734 0.000 14.649) 16.565 9.880 ( -3.976 -0.000 -5.541) 6.820 10.538 ( 4.828 0.000 -2.461) 5.419 10.792 ( 2.657 0.000 -2.695) 3.785 10.900 ( -3.620 -0.000 -7.239) 8.094 11.436 ( -4.183 -0.000 -13.539) 14.170 11.835 ( 5.299 0.000 8.851) 10.316 12.464 ( 6.361 0.000 2.804) 6.952 12.742 ( 4.244 0.000 10.083) 10.940 12.853 ( -6.306 -0.000 -11.888) 13.457 13.682 ( 0.487 0.000 -6.029) 6.048 13.718 ( -0.489 -0.000 -8.750) 8.764 14.147 ( 4.759 0.000 12.122) 13.023 14.531 ( -4.191 -0.000 -6.536) 7.765 15.035 ( -0.861 -0.000 -12.102) 12.133 15.226 ( -12.814 -0.000 -3.959) 13.412 15.485 ( 9.517 0.000 4.676) 10.604 15.645 ( -4.138 -0.000 5.485) 6.870 15.839 ( -15.126 -0.000 15.688) 21.793 16.390 ( -3.865 -0.000 11.869) 12.482 18.046 ( -3.900 -0.000 14.020) 14.552 19.461 ( -4.072 -0.000 16.126) 16.632 21.449 ( 16.055 0.000 -26.987) 31.401 21.577 ( 10.808 0.000 -33.483) 35.184 24.567 ( 2.002 0.000 6.090) 6.411 25.366 ( -12.447 -0.000 -20.596) 24.065 25.726 ( -5.751 -0.000 15.677) 16.698 26.822 ( 20.089 0.000 -20.678) 28.829 28.903 ( -9.613 -0.000 1.625) 9.749 29.348 ( -3.761 -0.000 0.513) 3.796 29.551 ( -0.194 -0.000 3.420) 3.425 30.303 ( 7.655 0.000 11.291) 13.641 31.266 ( -12.532 -0.000 16.529) 20.743 31.295 ( 3.170 0.000 -2.381) 3.965 31.719 ( -6.596 -0.000 15.043) 16.426 31.816 ( 2.858 0.000 -12.515) 12.837 ======================= Grid point 214 (110/186) ======================= q-point: ( 0.38 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.754 ( 5.129 10.371 -1.223) 11.634 3.164 ( 15.240 21.102 0.688) 26.039 3.252 ( 0.589 11.628 12.587) 17.147 3.484 ( 5.394 2.855 -0.337) 6.112 3.820 ( -6.252 3.606 10.443) 12.694 3.882 ( -1.741 -10.095 7.028) 12.423 4.327 ( -2.600 -16.553 2.998) 17.022 4.619 ( -2.159 -11.506 15.974) 19.805 5.292 ( 5.778 3.582 1.424) 6.946 5.365 ( -10.776 0.780 12.679) 16.658 5.496 ( 3.742 -3.901 7.415) 9.176 6.055 ( -7.422 5.188 32.626) 33.860 6.521 ( -10.185 12.579 4.873) 16.903 6.970 ( -7.243 -7.592 5.119) 11.675 7.128 ( -1.318 0.014 22.267) 22.306 7.331 ( 4.009 -2.070 -15.777) 16.409 7.591 ( -3.692 -0.580 -1.965) 4.223 7.873 ( 1.177 1.707 -9.284) 9.513 8.003 ( -0.889 -5.807 -6.337) 8.641 8.442 ( 4.268 0.910 -7.056) 8.296 8.655 ( 7.513 -4.397 2.663) 9.104 9.172 ( 7.799 9.898 -3.346) 13.039 9.269 ( -6.112 -1.985 -2.758) 6.993 9.583 ( -7.023 0.357 -1.879) 7.278 9.783 ( -0.817 3.090 -3.779) 4.949 9.996 ( 6.327 -8.301 9.256) 13.950 10.541 ( -0.062 -0.926 -10.475) 10.516 10.736 ( 2.357 5.993 5.368) 8.383 10.964 ( 0.674 -7.951 -2.694) 8.422 11.326 ( -2.672 -0.320 -11.975) 12.274 11.912 ( 5.543 3.924 6.099) 9.128 12.569 ( 7.261 0.155 1.642) 7.446 12.714 ( -6.416 -0.080 -9.547) 11.503 12.835 ( 1.404 -1.860 7.494) 7.848 13.607 ( 0.800 5.391 -7.303) 9.112 13.719 ( 1.231 -2.075 -4.371) 4.993 14.250 ( 1.633 -0.951 9.310) 9.500 14.473 ( -3.564 -2.166 -3.928) 5.729 14.813 ( -2.516 12.250 -8.938) 15.371 15.194 ( -7.277 -10.420 -7.143) 14.580 15.587 ( -4.070 0.529 3.718) 5.538 15.632 ( 5.376 0.745 5.842) 7.974 15.789 ( -5.972 -2.578 14.165) 15.587 16.366 ( -6.477 1.242 10.623) 12.504 18.098 ( -1.535 -2.916 13.704) 14.094 19.460 ( -5.902 2.264 16.797) 17.948 21.486 ( 12.345 1.453 -32.566) 34.858 21.563 ( 11.153 -0.718 -30.260) 32.258 24.641 ( 4.989 0.886 8.061) 9.521 25.136 ( -8.942 0.031 -16.784) 19.017 25.678 ( -10.658 1.453 12.706) 16.647 26.944 ( 16.895 1.644 -21.509) 27.401 28.823 ( -6.890 -2.843 2.231) 7.780 29.313 ( -4.359 -2.155 -0.369) 4.877 29.599 ( 2.211 -1.421 6.171) 6.708 30.453 ( 7.627 1.116 13.613) 15.644 31.109 ( -16.977 2.588 16.010) 23.478 31.305 ( -0.754 2.936 -1.599) 3.427 31.644 ( -5.514 4.447 12.098) 14.019 31.927 ( 8.893 -9.195 -13.723) 18.761 ======================= Grid point 215 (111/186) ======================= q-point: (-0.50 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.617 ( 5.380 15.301 -4.983) 16.967 2.952 ( 4.320 21.912 2.410) 22.464 3.177 ( 4.990 14.612 12.183) 19.669 3.489 ( -5.768 6.188 9.846) 12.981 3.719 ( 2.122 5.535 1.700) 6.167 4.054 ( -6.051 -11.122 11.425) 17.054 4.514 ( -3.425 -13.783 -0.357) 14.207 4.745 ( -8.943 -9.274 8.543) 15.459 5.136 ( -9.278 2.429 -0.912) 9.634 5.421 ( 7.501 7.696 5.870) 12.246 5.671 ( 0.224 -4.411 19.672) 20.162 6.053 ( -5.946 5.744 34.896) 35.862 6.311 ( -4.497 8.720 12.687) 16.038 6.972 ( -6.555 -3.068 4.045) 8.291 7.199 ( -4.841 -3.579 13.774) 15.032 7.324 ( 3.629 -3.318 -15.140) 15.918 7.567 ( -0.756 0.529 2.622) 2.779 7.823 ( -2.265 -1.301 -7.715) 8.145 8.090 ( 7.537 -5.045 -9.657) 13.248 8.422 ( 1.541 1.779 -9.025) 9.327 8.859 ( 9.984 -5.432 0.696) 11.388 9.080 ( 3.793 9.400 -1.643) 10.269 9.218 ( -3.753 -0.326 -2.665) 4.614 9.497 ( -5.556 -0.312 1.449) 5.751 9.681 ( -4.618 2.370 -8.452) 9.918 10.190 ( 4.236 -4.186 4.556) 7.499 10.494 ( -3.401 -2.688 -8.403) 9.455 10.764 ( 0.827 1.692 14.111) 14.236 11.053 ( 2.456 -6.408 -9.460) 11.687 11.279 ( 2.005 0.316 -6.045) 6.376 11.947 ( 4.155 2.843 5.020) 7.110 12.567 ( -2.268 2.128 -6.377) 7.095 12.668 ( 1.673 1.058 -0.367) 2.013 12.899 ( -1.116 -4.068 1.736) 4.561 13.515 ( 2.891 6.155 -6.081) 9.123 13.735 ( 0.428 -0.538 -1.587) 1.729 14.287 ( -1.440 1.455 7.310) 7.591 14.433 ( -2.595 2.263 4.971) 6.048 14.710 ( 5.694 -3.081 -13.217) 14.718 15.162 ( -7.251 -3.943 -9.656) 12.703 15.559 ( -5.968 -4.310 5.657) 9.284 15.689 ( 2.231 3.187 10.220) 10.936 15.874 ( 2.200 -4.215 5.522) 7.287 16.309 ( -6.697 0.845 8.840) 11.123 18.207 ( -1.585 -5.265 15.324) 16.281 19.412 ( -7.687 3.729 17.364) 19.352 21.435 ( 10.070 1.392 -37.145) 38.510 21.575 ( 11.468 0.351 -28.584) 30.800 24.736 ( 4.958 1.064 9.066) 10.388 24.988 ( -2.073 0.776 -11.969) 12.172 25.550 ( -12.594 2.923 10.710) 16.789 27.003 ( 12.078 2.119 -21.348) 24.619 28.833 ( -3.326 -6.401 2.748) 7.719 29.292 ( -4.086 -3.253 -1.218) 5.363 29.690 ( 3.440 -1.173 7.484) 8.320 30.588 ( 7.939 3.487 12.914) 15.555 30.932 ( -17.280 2.011 15.538) 23.326 31.213 ( -0.208 7.083 0.276) 7.092 31.573 ( -8.237 2.047 12.323) 14.963 32.125 ( 9.590 -12.021 -16.296) 22.406 ======================= Grid point 216 (112/186) ======================= q-point: (-0.38 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.425 ( 6.452 21.517 -2.655) 22.620 2.803 ( 3.384 6.794 -1.274) 7.697 3.065 ( 3.757 19.843 14.872) 25.080 3.295 ( -15.338 5.856 13.341) 21.155 3.681 ( 3.414 7.498 -3.163) 8.825 4.099 ( -11.499 -4.900 10.124) 16.085 4.642 ( -1.268 -9.698 1.198) 9.853 4.794 ( -4.835 -9.519 0.843) 10.710 5.030 ( -4.628 -1.332 -3.583) 6.002 5.361 ( 4.480 13.989 2.702) 14.936 5.751 ( -11.686 -0.993 31.527) 33.638 6.065 ( -4.827 6.753 31.544) 32.617 6.284 ( 0.126 6.908 27.093) 27.960 6.917 ( -5.353 0.297 -4.194) 6.807 7.212 ( -9.120 -1.119 14.086) 16.818 7.415 ( 9.357 -6.841 -11.411) 16.266 7.606 ( 2.099 -1.341 7.154) 7.575 7.786 ( -1.677 -3.922 -10.093) 10.958 8.206 ( 9.014 -1.582 -9.965) 13.530 8.358 ( -0.733 -0.274 -11.649) 11.675 8.885 ( 4.567 10.833 -5.467) 12.965 9.139 ( -4.265 2.683 -0.578) 5.072 9.176 ( 9.540 -7.861 1.634) 12.469 9.444 ( -4.431 2.120 -1.301) 5.081 9.563 ( -3.197 -1.457 -8.272) 8.987 10.268 ( 0.623 -1.717 -0.924) 2.047 10.467 ( -4.291 -5.367 -1.088) 6.957 10.799 ( -2.003 2.607 14.646) 15.011 11.113 ( 0.333 -7.224 -14.513) 16.214 11.278 ( 5.493 4.968 -2.912) 7.958 12.016 ( 3.236 -2.138 7.596) 8.529 12.486 ( -2.069 2.445 -3.517) 4.757 12.604 ( -3.780 4.852 -3.319) 6.989 12.938 ( -0.174 -4.280 -5.405) 6.897 13.468 ( 5.204 5.242 -1.833) 7.611 13.734 ( -0.312 -0.401 -0.795) 0.944 14.306 ( 3.401 0.762 7.877) 8.613 14.395 ( -1.953 3.168 3.459) 5.081 14.839 ( 6.043 -9.291 -10.749) 15.440 15.065 ( -5.836 -3.467 -9.264) 11.485 15.594 ( -5.012 -6.326 5.817) 9.949 15.715 ( 1.219 3.482 9.379) 10.079 15.966 ( 0.934 -2.812 2.422) 3.827 16.285 ( -4.024 -2.724 6.823) 8.377 18.329 ( -4.475 -5.738 17.792) 19.222 19.335 ( -8.861 3.897 17.431) 19.938 21.365 ( 10.486 1.672 -37.831) 39.293 21.569 ( 11.094 0.981 -29.787) 31.801 24.792 ( -1.444 0.942 6.711) 6.928 24.980 ( 9.852 0.165 -6.127) 11.603 25.412 ( -8.811 3.512 11.566) 14.958 26.978 ( 4.972 2.987 -21.141) 21.922 28.934 ( -0.457 -9.148 3.294) 9.734 29.294 ( -2.142 -4.461 -2.085) 5.370 29.769 ( 3.077 1.461 6.922) 7.715 30.614 ( 0.216 10.123 1.506) 10.236 30.806 ( -6.938 1.937 19.239) 20.543 31.160 ( -1.346 1.484 9.474) 9.683 31.496 ( -7.757 1.833 10.381) 13.088 32.320 ( 5.624 -12.897 -17.174) 22.201 ======================= Grid point 217 (113/186) ======================= q-point: (-0.25 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.183 ( 1.781 21.107 5.183) 21.807 2.761 ( 0.501 5.324 -1.651) 5.597 2.870 ( -2.190 16.112 11.998) 20.208 3.207 ( -5.093 -4.175 13.932) 15.410 3.567 ( 0.898 8.473 -6.183) 10.527 4.039 ( -10.725 -2.572 6.741) 12.926 4.734 ( 2.116 -1.653 -0.113) 2.688 4.903 ( 0.951 -7.201 3.277) 7.969 5.025 ( -2.326 -6.250 -2.077) 6.984 5.216 ( 4.528 13.671 -3.270) 14.768 5.737 ( -14.312 0.313 32.405) 35.427 6.025 ( -7.933 9.205 32.314) 34.523 6.339 ( -1.915 6.741 37.309) 37.962 6.801 ( -6.101 2.277 -3.280) 7.291 7.163 ( -8.784 0.145 15.073) 17.446 7.584 ( 9.342 -4.394 -18.472) 21.162 7.642 ( -2.891 -2.347 8.041) 8.861 7.852 ( 7.837 -3.614 -0.880) 8.675 8.196 ( -0.300 2.352 -8.403) 8.731 8.375 ( 4.248 -5.904 -13.981) 15.759 8.752 ( 4.677 11.665 -9.234) 15.595 9.058 ( -3.313 1.581 1.101) 3.832 9.315 ( -4.966 2.229 -6.674) 8.612 9.393 ( 8.105 -1.706 4.762) 9.554 9.561 ( 2.649 -3.789 -7.041) 8.423 10.258 ( -3.179 -2.396 -5.424) 6.729 10.540 ( -1.849 -7.383 6.131) 9.773 10.796 ( -0.918 2.069 10.214) 10.462 11.058 ( -4.185 2.604 -13.045) 13.946 11.293 ( 4.314 -1.776 -4.199) 6.277 12.141 ( 2.564 -3.791 8.047) 9.258 12.347 ( -7.378 7.754 -4.375) 11.563 12.498 ( -0.057 2.387 -1.697) 2.929 12.973 ( 2.019 -4.716 -9.319) 10.638 13.485 ( 5.988 3.244 2.532) 7.266 13.737 ( -0.443 -1.681 -1.980) 2.635 14.314 ( -2.836 5.686 1.163) 6.460 14.424 ( 7.598 -1.045 7.395) 10.654 14.896 ( -4.520 -6.223 -9.739) 12.410 15.116 ( 3.502 -9.140 -6.517) 11.759 15.649 ( -3.623 -4.623 3.978) 7.094 15.702 ( -1.338 1.742 4.617) 5.113 16.017 ( 1.126 -0.751 7.082) 7.210 16.334 ( -4.833 -7.842 2.633) 9.581 18.390 ( -10.682 -2.558 21.026) 23.722 19.264 ( -7.628 2.028 16.615) 18.395 21.301 ( 12.038 2.360 -36.599) 38.600 21.556 ( 11.618 0.689 -30.936) 33.053 24.748 ( -7.213 0.540 4.523) 8.531 25.157 ( 18.105 -2.399 -4.738) 18.868 25.376 ( 1.020 2.637 14.674) 14.944 26.844 ( -2.967 3.717 -20.636) 21.177 29.069 ( -2.167 -8.780 4.015) 9.895 29.356 ( 2.341 -6.539 -2.856) 7.510 29.787 ( 2.418 5.020 5.174) 7.604 30.384 ( -5.931 13.434 -3.922) 15.200 30.843 ( 0.246 2.241 18.631) 18.767 31.223 ( -0.348 -2.693 14.729) 14.977 31.439 ( -5.424 0.690 9.718) 11.151 32.433 ( -1.514 -10.754 -16.855) 20.051 ======================= Grid point 218 (114/186) ======================= q-point: (-0.12 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.010 ( 0.348 8.989 13.988) 16.631 2.690 ( 1.452 4.236 -1.348) 4.676 2.725 ( 0.049 9.166 8.836) 12.732 3.298 ( -7.330 -7.123 6.308) 12.011 3.498 ( 8.128 2.589 -1.921) 8.745 3.985 ( -6.317 -1.567 5.324) 8.409 4.749 ( 3.321 3.701 -1.531) 5.203 4.886 ( -1.409 15.914 11.506) 19.689 5.110 ( 2.498 4.520 -1.071) 5.275 5.192 ( 4.344 -14.797 -1.765) 15.522 5.720 ( -9.245 -3.550 17.819) 20.386 5.906 ( -14.546 9.474 29.935) 34.605 6.403 ( -2.711 6.079 41.955) 42.480 6.699 ( -8.840 -0.120 8.848) 12.508 7.138 ( -5.184 0.872 11.623) 12.756 7.518 ( 0.741 2.903 -13.814) 14.135 7.779 ( 4.527 -2.944 6.136) 8.173 7.987 ( 7.068 -0.547 -0.389) 7.100 8.145 ( -2.142 -3.945 -7.744) 8.951 8.416 ( 2.749 -1.905 -12.561) 12.999 8.606 ( 5.614 11.777 -8.067) 15.340 8.997 ( -5.776 -1.481 -8.027) 10.000 9.257 ( 4.185 0.845 0.086) 4.271 9.453 ( 3.895 2.826 3.049) 5.697 9.679 ( 6.729 -5.084 -4.123) 9.387 10.207 ( -5.304 -2.159 -7.322) 9.296 10.569 ( -4.161 3.820 6.770) 8.816 10.868 ( 0.090 2.903 -3.789) 4.774 10.913 ( -0.401 -7.469 -0.461) 7.494 11.363 ( 1.732 -4.973 -5.579) 7.671 12.081 ( -9.368 7.522 -6.063) 13.458 12.262 ( 1.848 -2.330 5.297) 6.075 12.492 ( 4.493 3.944 3.888) 7.132 13.024 ( 1.535 -5.572 -11.069) 12.487 13.554 ( 5.985 0.374 4.943) 7.771 13.741 ( -1.404 -2.402 -3.897) 4.788 14.189 ( -1.912 7.769 -0.093) 8.002 14.566 ( 7.308 -0.006 6.219) 9.596 14.894 ( -5.171 -9.733 -9.426) 14.502 15.229 ( 0.057 -6.263 -3.116) 6.996 15.603 ( -2.678 2.467 -1.147) 3.818 15.742 ( -0.575 -2.586 3.431) 4.335 16.102 ( 3.295 -1.451 10.474) 11.076 16.354 ( -12.992 -9.129 0.363) 15.883 18.317 ( -16.036 3.071 23.697) 28.777 19.262 ( -4.091 -1.495 15.559) 16.157 21.268 ( 14.485 2.367 -33.864) 36.908 21.557 ( 12.673 0.071 -31.488) 33.943 24.656 ( -9.156 -0.312 3.596) 9.841 25.383 ( 8.530 -1.814 8.234) 11.994 25.544 ( 20.587 -1.991 -0.886) 20.702 26.626 ( -7.746 2.763 -18.759) 20.482 29.137 ( -5.975 -6.241 3.721) 9.407 29.476 ( 2.135 -5.466 -1.587) 6.079 29.759 ( 3.542 6.362 2.144) 7.591 30.114 ( -3.720 12.144 -3.375) 13.142 30.915 ( 1.495 0.463 15.157) 15.238 31.330 ( 2.886 -0.228 11.231) 11.598 31.443 ( -5.186 -3.422 13.985) 15.303 32.401 ( -9.457 -5.583 -14.191) 17.944 ======================= Grid point 222 (115/186) ======================= q-point: ( 0.38 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.852 ( -0.595 -0.000 -1.232) 1.368 3.466 ( 7.826 0.000 2.760) 8.299 3.498 ( 2.796 0.000 17.569) 17.790 3.583 ( -7.498 -0.000 8.475) 11.316 3.616 ( 2.665 0.000 -3.500) 4.399 3.921 ( -4.235 -0.000 -0.443) 4.258 4.127 ( -5.043 -0.000 8.008) 9.464 4.643 ( 3.549 0.000 10.314) 10.908 5.195 ( -13.572 -0.000 5.915) 14.805 5.524 ( 14.029 0.000 2.372) 14.228 5.590 ( 3.001 0.000 21.145) 21.357 6.130 ( -13.015 -0.000 43.834) 45.725 6.546 ( -7.172 -0.000 8.227) 10.914 6.760 ( -6.901 -0.000 -8.796) 11.180 7.206 ( -2.739 -0.000 13.546) 13.820 7.271 ( 1.086 0.000 -16.151) 16.187 7.551 ( -0.149 -0.000 0.849) 0.861 7.842 ( -8.639 -0.000 -1.064) 8.704 7.987 ( 14.813 0.000 -14.390) 20.652 8.448 ( 1.661 0.000 -9.430) 9.576 8.755 ( 9.703 0.000 4.643) 10.757 9.163 ( -4.361 -0.000 -0.347) 4.374 9.319 ( 5.115 0.000 -6.885) 8.577 9.495 ( -5.327 -0.000 -0.100) 5.328 9.731 ( -6.811 -0.000 -8.100) 10.583 10.092 ( 7.481 0.000 15.776) 17.460 10.464 ( -2.113 -0.000 -12.333) 12.513 10.846 ( 3.626 0.000 -5.247) 6.378 10.897 ( -0.819 -0.000 9.171) 9.208 11.254 ( 0.468 0.000 -6.648) 6.664 12.027 ( 4.272 0.000 1.870) 4.663 12.580 ( -6.519 -0.000 -7.722) 10.106 12.678 ( 8.345 0.000 0.485) 8.359 12.838 ( -3.736 -0.000 4.326) 5.716 13.673 ( 2.336 0.000 -5.461) 5.940 13.682 ( 3.631 0.000 -3.786) 5.245 14.292 ( -0.667 -0.000 8.510) 8.536 14.406 ( 0.015 0.000 -6.306) 6.306 14.904 ( 0.425 0.000 -12.814) 12.821 14.909 ( -10.666 -0.000 -0.874) 10.702 15.534 ( -6.954 -0.000 7.974) 10.580 15.773 ( -3.659 -0.000 16.015) 16.428 15.775 ( 9.080 0.000 1.267) 9.168 16.321 ( -9.227 -0.000 10.450) 13.940 18.134 ( 0.730 0.000 11.167) 11.191 19.471 ( -7.743 -0.000 17.558) 19.190 21.443 ( 8.464 0.000 -38.899) 39.809 21.588 ( 12.502 0.000 -26.035) 28.881 24.751 ( 3.925 0.000 9.143) 9.949 25.001 ( -1.043 -0.000 -12.822) 12.865 25.592 ( -12.643 -0.000 10.691) 16.558 27.034 ( 12.595 0.000 -23.659) 26.802 28.741 ( -4.397 -0.000 3.330) 5.515 29.238 ( -4.288 -0.000 -1.544) 4.558 29.674 ( 4.324 0.000 10.244) 11.119 30.630 ( 7.699 0.000 16.168) 17.907 30.963 ( -18.514 -0.000 16.161) 24.575 31.331 ( 0.294 0.000 -0.054) 0.299 31.673 ( -5.389 -0.000 8.174) 9.790 31.872 ( 6.932 0.000 -16.467) 17.867 ======================= Grid point 223 (116/186) ======================= q-point: (-0.50 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.774 ( -1.108 5.687 -2.354) 6.254 3.254 ( -5.173 20.128 8.556) 22.474 3.518 ( 3.738 8.571 3.777) 10.085 3.539 ( -6.077 12.980 9.952) 17.449 3.676 ( -8.298 -5.004 1.910) 9.877 3.912 ( -0.418 -11.816 6.100) 13.304 4.264 ( -1.595 -14.533 -1.093) 14.662 4.688 ( -1.946 2.686 10.721) 11.222 5.071 ( -5.545 1.943 -0.532) 5.900 5.633 ( 5.485 5.570 5.547) 9.585 5.725 ( -5.397 -1.145 30.673) 31.166 6.165 ( -12.882 1.484 45.011) 46.842 6.482 ( 5.371 7.027 6.286) 10.851 6.742 ( -6.257 -10.080 -4.876) 12.827 7.209 ( -0.946 0.508 0.946) 1.431 7.259 ( 3.647 -3.838 -6.677) 8.521 7.569 ( -1.662 -0.561 5.624) 5.891 7.718 ( -6.309 -0.517 -6.685) 9.207 8.134 ( 15.216 -1.894 -14.663) 21.216 8.387 ( -2.287 0.828 -12.161) 12.402 8.926 ( 8.808 -4.112 1.850) 9.895 9.150 ( 1.129 -0.179 1.944) 2.255 9.271 ( 3.021 7.338 -9.004) 12.002 9.463 ( -1.645 0.466 7.113) 7.316 9.564 ( -9.036 0.767 -11.648) 14.762 10.252 ( 4.700 -0.145 8.990) 10.146 10.381 ( -3.738 -1.301 -7.556) 8.530 10.841 ( 0.163 1.218 3.854) 4.045 10.955 ( 0.235 -3.862 -3.310) 5.092 11.294 ( 4.464 -2.090 1.662) 5.201 12.043 ( 1.643 2.667 0.264) 3.144 12.489 ( -3.590 -0.901 -4.751) 6.022 12.723 ( -3.254 3.536 -0.669) 4.852 12.825 ( 1.502 -3.904 -2.070) 4.667 13.635 ( 5.068 5.776 -3.701) 8.529 13.738 ( 2.853 -0.501 -2.456) 3.798 14.321 ( -0.296 0.054 8.170) 8.176 14.413 ( -0.155 -2.372 -1.010) 2.582 14.705 ( -1.875 3.102 -8.094) 8.869 14.936 ( -4.573 -7.171 -11.707) 14.470 15.503 ( -5.544 -0.230 12.406) 13.590 15.805 ( 1.279 2.700 12.184) 12.545 15.887 ( 3.339 -2.293 1.811) 4.437 16.256 ( -7.865 -0.719 9.601) 12.433 18.215 ( 0.658 -2.215 11.447) 11.678 19.432 ( -9.034 2.311 18.051) 20.317 21.364 ( 8.754 -0.676 -40.759) 41.694 21.609 ( 11.482 1.151 -26.313) 28.732 24.806 ( -2.162 0.208 7.395) 7.707 24.991 ( 8.262 0.384 -8.741) 12.034 25.483 ( -9.826 1.400 11.054) 14.856 27.042 ( 7.652 1.297 -24.294) 25.503 28.751 ( -0.739 -3.627 4.332) 5.698 29.192 ( -3.740 -2.297 -2.570) 5.086 29.789 ( 4.836 0.178 12.064) 12.998 30.753 ( -5.388 1.215 10.733) 12.071 30.859 ( -2.108 1.577 21.004) 21.168 31.294 ( -1.014 4.769 0.775) 4.937 31.579 ( -6.078 5.545 6.503) 10.487 31.958 ( 3.265 -12.165 -16.970) 21.134 ======================= Grid point 224 (117/186) ======================= q-point: (-0.38 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.684 ( 3.278 8.394 -3.433) 9.643 2.976 ( -3.997 15.555 4.044) 16.562 3.248 ( -15.497 12.138 10.376) 22.252 3.377 ( -7.318 10.459 7.510) 14.810 3.635 ( -5.027 0.599 -0.244) 5.068 4.059 ( -3.081 -2.313 12.157) 12.753 4.429 ( -0.024 -14.977 -6.025) 16.143 4.721 ( 2.332 -3.178 9.886) 10.643 4.978 ( -2.017 2.443 -5.629) 6.459 5.578 ( 1.593 9.189 -1.668) 9.474 5.770 ( -13.945 1.314 44.542) 46.692 6.184 ( -12.815 2.445 41.678) 43.672 6.542 ( 7.315 6.127 13.327) 16.390 6.756 ( -6.451 -4.893 -1.963) 8.331 7.193 ( -1.227 1.172 1.123) 2.035 7.405 ( 11.219 -7.104 -7.744) 15.372 7.523 ( -12.558 -3.877 5.575) 14.276 7.723 ( 6.943 -3.641 -4.507) 9.043 8.245 ( -0.972 0.258 -13.183) 13.222 8.279 ( 7.616 -0.980 -16.258) 17.980 9.019 ( -0.335 1.775 -2.362) 2.974 9.141 ( 1.006 5.458 -6.375) 8.453 9.256 ( 8.778 -1.726 1.690) 9.104 9.369 ( -4.311 0.456 -10.683) 11.529 9.559 ( 7.441 0.772 6.844) 10.139 10.232 ( -4.334 1.072 -6.805) 8.139 10.389 ( -0.240 -2.290 5.705) 6.152 10.846 ( -4.899 0.102 13.161) 14.044 10.975 ( 1.555 -3.427 -13.444) 13.961 11.370 ( 3.124 1.680 1.366) 3.801 12.050 ( 0.776 -1.490 4.232) 4.553 12.469 ( -0.305 -0.016 -0.608) 0.681 12.557 ( -9.802 2.893 -5.112) 11.427 12.892 ( 4.298 -1.631 -6.373) 7.858 13.616 ( 6.509 5.760 -1.679) 8.852 13.742 ( 1.286 1.773 -1.851) 2.867 14.379 ( 2.206 -0.789 8.389) 8.710 14.402 ( -3.891 0.477 3.267) 5.103 14.709 ( -1.136 -8.301 -9.305) 12.522 14.915 ( 2.069 -4.311 -13.605) 14.420 15.513 ( -5.335 -2.339 13.024) 14.267 15.797 ( -2.527 3.668 3.459) 5.639 15.966 ( 1.985 -1.776 8.596) 8.999 16.249 ( -2.554 -1.575 6.974) 7.592 18.306 ( -1.879 -2.779 14.114) 14.508 19.356 ( -9.326 3.775 17.919) 20.550 21.304 ( 10.202 -1.429 -40.825) 42.104 21.602 ( 11.194 2.057 -27.247) 29.529 24.754 ( -9.261 -0.013 3.856) 10.032 25.119 ( 16.554 -0.515 -5.931) 17.592 25.435 ( -3.225 1.495 13.791) 14.242 26.952 ( 1.128 3.473 -24.133) 24.408 28.855 ( 1.882 -6.198 5.073) 8.228 29.189 ( -1.587 -4.905 -3.389) 6.170 29.889 ( 3.925 2.154 11.240) 12.099 30.626 ( -11.585 3.460 6.068) 13.528 30.962 ( 5.098 6.164 17.352) 19.107 31.227 ( -0.405 3.619 8.161) 8.937 31.473 ( -6.664 2.031 7.554) 10.276 32.082 ( -0.220 -14.191 -17.919) 22.859 ======================= Grid point 225 (118/186) ======================= q-point: (-0.25 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.496 ( -2.205 21.268 0.773) 21.396 2.761 ( -8.507 7.076 1.301) 11.141 3.012 ( -8.412 3.671 9.251) 13.031 3.196 ( -11.105 2.086 6.248) 12.911 3.551 ( -2.166 2.779 0.991) 3.660 4.044 ( -2.267 4.773 11.769) 12.901 4.637 ( 1.829 -16.375 -3.947) 16.943 4.859 ( 6.903 -0.304 -5.164) 8.626 4.961 ( 1.279 -5.395 6.265) 8.366 5.435 ( 1.793 11.679 -5.847) 13.184 5.764 ( -14.750 3.980 42.953) 45.590 6.146 ( -14.078 5.809 35.767) 38.874 6.594 ( 1.149 6.320 22.423) 23.325 6.685 ( -11.648 -0.393 7.467) 13.841 7.162 ( -1.085 1.778 3.811) 4.343 7.436 ( -7.988 -6.566 -8.412) 13.330 7.647 ( 9.911 -5.846 1.570) 11.614 7.889 ( 9.251 -5.648 -1.052) 10.890 8.090 ( -8.307 -0.811 -12.181) 14.766 8.361 ( 10.200 -1.241 -16.060) 19.066 8.901 ( -2.272 5.765 -9.049) 10.967 9.055 ( 0.215 6.556 -4.236) 7.808 9.250 ( 0.586 -0.622 -5.202) 5.272 9.510 ( 11.755 -5.981 -2.163) 13.365 9.657 ( 11.577 8.495 6.243) 15.658 10.126 ( -6.639 -2.093 -8.528) 11.009 10.472 ( -0.365 -6.697 8.171) 10.571 10.827 ( -7.040 0.878 12.306) 14.204 10.949 ( -0.561 -0.531 -13.501) 13.523 11.345 ( 1.718 3.737 -1.948) 4.551 12.136 ( -0.053 -4.547 6.860) 8.230 12.290 ( -11.591 5.147 -5.523) 13.833 12.557 ( 6.205 -0.116 2.376) 6.646 12.916 ( 3.078 -1.366 -10.273) 10.811 13.625 ( 6.399 4.549 0.512) 7.867 13.716 ( -0.241 1.100 -2.915) 3.125 14.343 ( -4.201 2.529 4.151) 6.424 14.472 ( -1.687 -5.492 4.802) 7.488 14.726 ( 0.497 -3.320 -8.113) 8.780 15.024 ( 6.799 -8.027 -9.261) 14.015 15.562 ( -3.216 -5.310 9.131) 11.042 15.700 ( -5.954 2.419 0.711) 6.466 16.057 ( 0.803 -1.045 11.699) 11.773 16.269 ( -0.684 0.277 3.269) 3.351 18.357 ( -6.443 -0.223 18.708) 19.788 19.279 ( -7.693 2.803 16.845) 18.729 21.277 ( 12.115 -1.660 -39.024) 40.896 21.588 ( 11.949 1.996 -28.346) 30.826 24.638 ( -11.056 -0.914 2.190) 11.308 25.334 ( 14.905 -1.157 -1.147) 14.994 25.507 ( 7.644 -1.107 10.011) 12.644 26.749 ( -5.254 5.407 -22.435) 23.668 28.976 ( -0.321 -5.189 4.788) 7.068 29.272 ( 3.165 -8.081 -3.031) 9.192 29.929 ( 2.807 5.040 8.498) 10.271 30.421 ( -9.198 8.640 -1.431) 12.701 30.972 ( -1.162 4.426 15.056) 15.736 31.266 ( -3.402 0.041 18.252) 18.566 31.455 ( 2.359 0.331 6.953) 7.350 32.151 ( -4.574 -12.204 -17.538) 21.851 ======================= Grid point 226 (119/186) ======================= q-point: (-0.12 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.178 ( -7.364 12.374 7.644) 16.303 2.590 ( -7.066 2.486 -1.839) 7.713 2.961 ( 0.392 4.070 7.368) 8.426 3.095 ( -12.236 -6.238 2.577) 13.974 3.567 ( 3.103 -1.627 4.120) 5.408 4.026 ( 1.533 4.558 10.889) 11.903 4.809 ( 3.577 -2.346 -1.659) 4.588 4.994 ( 8.241 -15.737 -7.566) 19.309 5.084 ( 0.139 2.958 13.745) 14.061 5.271 ( 4.262 10.699 -7.588) 13.791 5.690 ( -13.401 4.527 28.584) 31.892 5.989 ( -15.136 10.700 24.074) 30.383 6.573 ( -16.612 -1.872 20.366) 26.349 6.638 ( -3.320 4.694 33.125) 33.621 7.159 ( 0.110 0.795 3.285) 3.382 7.412 ( -3.686 -7.032 -7.840) 11.158 7.784 ( -0.135 -0.939 0.999) 1.377 8.007 ( -1.981 -6.380 -5.586) 8.709 8.055 ( 8.213 -1.744 -3.166) 8.974 8.406 ( 6.457 -0.203 -15.626) 16.908 8.766 ( -1.047 2.936 -9.639) 10.131 8.923 ( 2.138 10.092 -6.883) 12.401 9.309 ( 6.045 -2.851 -1.191) 6.789 9.590 ( 3.029 4.783 -2.812) 6.321 9.786 ( 15.338 2.854 6.688) 16.974 10.035 ( -7.487 -3.880 -10.717) 13.637 10.608 ( -1.420 -0.970 11.662) 11.788 10.771 ( -5.167 -4.275 -2.765) 7.254 10.882 ( 0.382 0.643 -2.177) 2.302 11.337 ( 2.500 -0.415 -3.927) 4.674 12.024 ( -10.164 6.092 -3.710) 12.417 12.258 ( 1.108 -4.634 5.225) 7.072 12.647 ( 7.999 3.342 4.351) 9.700 12.923 ( 1.010 -3.357 -11.614) 12.131 13.656 ( 3.868 2.077 1.838) 4.759 13.681 ( -0.467 -0.054 -5.140) 5.161 14.264 ( -2.230 5.179 3.712) 6.752 14.518 ( -10.012 -10.789 1.787) 14.827 14.773 ( 7.570 0.638 -6.257) 9.842 15.149 ( 2.596 -5.518 -3.164) 6.870 15.580 ( -2.527 0.922 -4.111) 4.913 15.694 ( -1.300 -6.290 8.256) 10.460 16.110 ( -5.727 -2.918 8.578) 10.719 16.246 ( 0.324 4.147 4.083) 5.829 18.317 ( -10.169 4.733 22.915) 25.513 19.263 ( -4.709 -0.907 15.546) 16.269 21.288 ( 14.102 -1.706 -35.870) 38.580 21.586 ( 12.907 1.254 -29.427) 32.157 24.539 ( -8.343 -1.732 2.335) 8.835 25.474 ( 2.245 -1.879 9.450) 9.893 25.731 ( 15.840 -2.702 -7.436) 17.706 26.506 ( -3.837 3.971 -16.644) 17.536 29.030 ( -2.984 -3.295 3.706) 5.787 29.419 ( 2.973 -6.420 -1.232) 7.181 29.907 ( 1.860 7.479 3.642) 8.524 30.181 ( -5.342 8.328 -2.094) 10.113 30.989 ( -1.765 0.364 13.906) 14.022 31.289 ( -10.755 -4.742 19.300) 22.597 31.560 ( 9.873 3.679 8.042) 13.255 32.131 ( -6.939 -7.505 -15.655) 18.697 ======================= Grid point 231 (120/186) ======================= q-point: (-0.50 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.755 ( -3.825 -0.000 -0.792) 3.906 3.377 ( -24.365 -0.000 15.054) 28.640 3.393 ( -16.002 -0.000 10.516) 19.148 3.607 ( 1.917 0.000 4.759) 5.130 3.740 ( 3.733 0.000 4.917) 6.174 3.757 ( 0.831 0.000 -15.379) 15.402 4.176 ( 1.682 0.000 6.507) 6.721 4.750 ( -2.927 -0.000 14.279) 14.576 5.029 ( -2.178 -0.000 -3.758) 4.344 5.690 ( -5.025 -0.000 -1.937) 5.386 5.792 ( -11.566 -0.000 45.121) 46.579 6.207 ( -14.839 -0.000 44.533) 46.940 6.599 ( 4.616 0.000 -7.654) 8.938 6.682 ( 6.235 0.000 10.448) 12.167 7.204 ( 4.698 0.000 -10.638) 11.629 7.283 ( 6.730 0.000 1.435) 6.881 7.484 ( -14.566 -0.000 7.305) 16.295 7.688 ( 7.493 0.000 -7.786) 10.806 8.232 ( 6.650 0.000 -15.500) 16.866 8.278 ( 0.806 0.000 -16.921) 16.940 8.969 ( 2.498 0.000 -2.380) 3.451 9.219 ( 7.702 0.000 4.051) 8.702 9.275 ( -6.668 -0.000 -8.451) 10.764 9.386 ( -3.185 -0.000 -12.597) 12.993 9.579 ( 9.703 0.000 10.383) 14.211 10.261 ( -4.880 -0.000 -9.347) 10.544 10.375 ( 2.312 0.000 10.801) 11.045 10.834 ( 3.063 0.000 -13.751) 14.088 10.936 ( -4.771 -0.000 13.171) 14.008 11.361 ( 4.768 0.000 6.483) 8.048 12.051 ( -1.758 -0.000 -1.949) 2.625 12.448 ( 0.993 0.000 -0.861) 1.314 12.604 ( -13.348 -0.000 -4.273) 14.016 12.866 ( 7.038 0.000 -3.923) 8.057 13.717 ( 3.744 0.000 -2.718) 4.627 13.785 ( 5.857 0.000 -2.555) 6.390 14.367 ( 1.255 0.000 7.479) 7.584 14.394 ( 1.365 0.000 -2.562) 2.903 14.582 ( -11.840 -0.000 -4.610) 12.706 14.841 ( 5.044 0.000 -13.360) 14.281 15.503 ( -5.768 -0.000 16.075) 17.079 15.864 ( -2.988 -0.000 -4.084) 5.061 15.940 ( 4.515 0.000 17.285) 17.865 16.211 ( -4.337 -0.000 9.021) 10.009 18.266 ( 1.270 0.000 10.282) 10.360 19.417 ( -9.467 -0.000 18.621) 20.889 21.275 ( 9.835 0.000 -42.766) 43.882 21.635 ( 10.609 0.000 -25.679) 27.784 24.753 ( -10.086 -0.000 3.744) 10.758 25.115 ( 16.372 0.000 -6.767) 17.715 25.455 ( -5.257 -0.000 13.472) 14.461 27.004 ( 3.409 0.000 -25.511) 25.738 28.763 ( 2.891 0.000 5.580) 6.284 29.118 ( -2.805 -0.000 -3.562) 4.534 29.914 ( 4.049 0.000 14.306) 14.868 30.656 ( -13.109 -0.000 10.605) 16.861 31.059 ( 9.299 0.000 22.527) 24.370 31.312 ( -3.107 -0.000 4.465) 5.439 31.605 ( -3.390 -0.000 1.000) 3.534 31.754 ( -3.507 -0.000 -18.665) 18.991 ======================= Grid point 232 (121/186) ======================= q-point: (-0.38 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.733 ( 0.377 -1.167 0.214) 1.245 3.046 ( -20.673 11.477 11.858) 26.452 3.149 ( -26.113 -0.865 5.420) 26.683 3.432 ( -1.912 21.302 1.242) 21.424 3.739 ( -1.586 5.377 4.121) 6.958 3.908 ( -1.651 -16.274 3.588) 16.746 4.286 ( 1.074 -7.252 3.178) 7.991 4.791 ( 2.474 -0.416 12.152) 12.408 4.968 ( -1.505 2.068 -4.240) 4.951 5.564 ( -9.673 -0.923 -5.747) 11.289 5.844 ( -14.176 1.496 49.453) 51.467 6.221 ( -14.845 0.599 41.678) 44.247 6.658 ( 4.498 0.574 -1.443) 4.759 6.748 ( -1.210 2.628 9.918) 10.331 7.220 ( 4.898 1.216 -7.917) 9.389 7.297 ( -8.867 -2.924 -6.743) 11.516 7.506 ( 10.605 -3.030 12.351) 16.559 7.786 ( 11.691 -0.982 -5.172) 12.821 8.066 ( -10.988 -0.735 -15.589) 19.086 8.338 ( 11.444 -0.726 -19.266) 22.420 8.955 ( -3.959 -0.852 -9.171) 10.025 9.100 ( -7.890 -0.353 -4.179) 8.936 9.343 ( 6.833 3.826 -10.473) 13.077 9.393 ( 12.306 -2.670 2.831) 12.907 9.787 ( 15.070 1.722 11.429) 18.992 10.133 ( -6.982 1.093 -8.924) 11.383 10.408 ( -2.002 1.060 4.917) 5.414 10.809 ( -0.390 -0.852 -6.722) 6.787 10.933 ( -4.174 -0.392 8.142) 9.158 11.436 ( 1.786 1.289 5.648) 6.062 12.027 ( -2.246 -2.105 1.723) 3.528 12.387 ( -13.887 1.693 -5.949) 15.202 12.513 ( 6.306 -1.668 2.353) 6.935 12.918 ( 4.748 0.407 -6.532) 8.085 13.739 ( 4.569 2.299 -2.285) 5.602 13.808 ( 3.918 4.324 -2.636) 6.403 14.319 ( -9.745 -1.019 -5.325) 11.152 14.409 ( -1.380 -1.140 3.301) 3.755 14.575 ( 4.730 -5.826 2.644) 7.956 14.877 ( 7.924 -2.354 -12.806) 15.243 15.502 ( -5.824 0.265 15.922) 16.956 15.759 ( -7.471 1.298 -4.089) 8.615 16.081 ( 4.931 2.337 16.953) 17.809 16.239 ( -0.174 -2.544 7.523) 7.943 18.335 ( 0.052 -0.704 12.203) 12.223 19.369 ( -9.126 2.484 18.660) 20.920 21.217 ( 11.528 -1.729 -43.198) 44.743 21.637 ( 10.410 1.135 -25.818) 27.861 24.616 ( -12.498 -0.493 1.486) 12.596 25.327 ( 19.996 0.311 -5.482) 20.736 25.475 ( -2.137 -0.983 14.136) 14.331 26.876 ( -1.613 2.952 -25.213) 25.437 28.867 ( 5.214 -2.384 6.051) 8.336 29.098 ( -0.459 -3.631 -3.978) 5.406 30.014 ( 2.122 1.313 13.741) 13.966 30.540 ( -11.162 1.062 7.421) 13.445 31.191 ( 1.190 9.431 9.543) 13.469 31.334 ( 4.049 1.180 17.121) 17.633 31.454 ( -5.274 3.557 0.569) 6.387 31.768 ( -4.454 -14.787 -15.464) 21.855 ======================= Grid point 233 (122/186) ======================= q-point: (-0.25 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.619 ( -23.710 15.530 6.813) 29.151 2.756 ( -4.912 1.100 7.028) 8.645 2.916 ( -19.027 -5.731 2.245) 19.997 3.117 ( -1.705 16.915 4.468) 17.578 3.632 ( -4.473 4.958 3.439) 7.511 4.075 ( -2.783 -6.289 12.320) 14.110 4.446 ( 4.085 -12.334 -0.705) 13.012 4.917 ( 3.779 0.963 -4.431) 5.903 4.961 ( 4.685 -5.592 8.083) 10.888 5.440 ( -8.943 -1.587 -4.823) 10.284 5.845 ( -15.116 4.173 43.098) 45.862 6.189 ( -14.157 3.883 32.931) 36.055 6.597 ( -11.917 3.937 11.670) 17.137 6.739 ( -2.272 2.379 13.663) 14.053 7.200 ( -0.030 1.420 -1.575) 2.121 7.248 ( -0.108 -2.967 -9.193) 9.660 7.724 ( 8.093 -2.581 3.699) 9.265 7.881 ( -9.341 -3.166 -12.107) 15.616 7.973 ( 14.721 -2.032 0.250) 14.862 8.382 ( 7.595 -1.529 -19.723) 21.190 8.803 ( -6.947 1.191 -12.045) 13.956 9.094 ( 0.733 -3.062 -0.409) 3.175 9.332 ( 9.527 6.342 -8.430) 14.214 9.595 ( 11.029 -1.868 -1.252) 11.256 9.946 ( -0.038 1.288 -5.396) 5.547 10.016 ( 7.664 5.642 2.860) 9.937 10.398 ( -3.403 -5.319 5.574) 8.423 10.776 ( -4.582 -0.277 1.155) 4.733 10.916 ( -1.921 0.472 1.092) 2.260 11.414 ( -0.122 4.922 2.953) 5.741 12.085 ( -1.540 -5.690 6.373) 8.682 12.164 ( -10.923 2.444 -5.735) 12.577 12.661 ( 9.094 -1.934 4.953) 10.535 12.908 ( 2.066 1.691 -9.662) 10.024 13.730 ( 0.491 3.574 -4.855) 6.049 13.772 ( 5.112 5.221 -0.783) 7.349 14.214 ( -10.719 -6.900 -4.382) 13.480 14.394 ( -3.656 0.570 2.686) 4.572 14.757 ( 10.498 -2.897 0.900) 10.928 14.987 ( 8.527 -5.123 -9.082) 13.470 15.516 ( -3.116 -2.320 10.417) 11.118 15.631 ( -7.316 0.641 -1.538) 7.503 16.129 ( -1.043 3.385 10.777) 11.344 16.330 ( 4.034 0.918 10.371) 11.166 18.391 ( -2.639 0.862 16.967) 17.193 19.304 ( -7.852 3.238 17.871) 19.786 21.208 ( 13.242 -3.430 -41.827) 44.006 21.629 ( 10.958 1.482 -26.520) 28.733 24.490 ( -9.891 -1.618 1.497) 10.134 25.453 ( 0.271 0.466 9.461) 9.476 25.639 ( 15.825 -3.641 -4.407) 16.826 26.656 ( -4.360 5.723 -21.195) 22.382 28.967 ( 2.320 -0.983 3.693) 4.471 29.199 ( 5.053 -8.313 -1.611) 9.861 30.056 ( 0.379 3.322 10.772) 11.279 30.389 ( -9.511 4.987 -0.142) 10.740 31.062 ( -5.196 6.619 7.500) 11.272 31.276 ( -9.110 2.734 11.572) 14.980 31.598 ( 9.520 -0.727 16.634) 19.179 31.839 ( -2.194 -12.982 -15.873) 20.623 ======================= Grid point 234 (123/186) ======================= q-point: (-0.12 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.154 ( -23.867 8.359 9.163) 26.897 2.661 ( 0.552 10.731 2.118) 10.952 2.751 ( -18.429 -7.262 5.796) 20.639 3.069 ( 2.719 0.169 4.566) 5.317 3.570 ( -4.166 -1.555 4.369) 6.233 4.166 ( 2.605 0.555 13.340) 13.603 4.707 ( 4.365 -15.505 0.689) 16.122 4.960 ( 7.274 -1.909 -5.104) 9.089 5.121 ( 0.607 -4.689 6.969) 8.422 5.325 ( -7.337 0.529 -2.061) 7.639 5.741 ( -14.329 7.356 26.749) 31.224 6.050 ( -11.831 9.536 17.796) 23.402 6.449 ( -19.841 0.486 28.591) 34.805 6.747 ( -6.403 1.240 24.110) 24.977 7.192 ( 2.597 0.829 -1.003) 2.905 7.267 ( 2.139 -4.371 -8.365) 9.678 7.727 ( -7.409 -0.608 -1.568) 7.597 7.899 ( 3.682 -6.646 -3.354) 8.305 8.156 ( 10.419 0.910 -3.829) 11.137 8.383 ( 3.924 -0.947 -16.792) 17.271 8.691 ( -1.101 -0.517 -8.339) 8.428 9.125 ( 6.171 6.399 -1.653) 9.042 9.347 ( 6.968 0.975 -5.066) 8.669 9.633 ( -1.191 2.777 -7.796) 8.361 9.842 ( -5.677 -2.482 -9.505) 11.346 10.103 ( 13.103 6.884 7.595) 16.636 10.574 ( 4.880 -11.425 6.886) 14.204 10.696 ( -6.295 2.747 2.409) 7.278 10.881 ( -0.924 1.280 -2.035) 2.575 11.367 ( 0.730 3.191 0.606) 3.330 11.970 ( -7.349 4.413 0.073) 8.572 12.214 ( 1.108 -7.236 5.054) 8.896 12.813 ( 9.013 1.320 4.318) 10.081 12.847 ( -0.907 -0.021 -10.574) 10.613 13.634 ( -3.109 2.524 -7.096) 8.147 13.775 ( 5.026 4.179 -0.830) 6.589 14.187 ( -10.033 -9.536 -0.059) 13.842 14.344 ( -2.451 1.643 1.867) 3.492 14.886 ( 8.761 2.477 -3.230) 9.660 15.115 ( 5.309 -4.539 -3.261) 7.708 15.530 ( -1.815 -0.556 -5.564) 5.879 15.632 ( 0.007 -6.845 9.163) 11.437 16.079 ( -5.549 3.756 7.111) 9.771 16.377 ( 3.114 6.287 10.036) 12.245 18.393 ( -5.568 4.948 22.264) 23.477 19.270 ( -5.749 0.636 16.692) 17.665 21.248 ( 14.575 -4.443 -39.083) 41.948 21.625 ( 11.444 1.175 -27.761) 30.050 24.436 ( -4.540 -2.682 3.038) 6.086 25.473 ( -4.903 -1.376 7.298) 8.899 25.767 ( 0.788 -1.369 -13.108) 13.203 26.511 ( 8.072 2.820 -10.946) 13.890 29.009 ( 1.038 -0.291 2.484) 2.708 29.372 ( 4.237 -6.309 0.005) 7.600 30.027 ( -1.983 6.897 3.717) 8.082 30.192 ( -5.132 4.396 -1.641) 6.954 31.000 ( -6.822 -1.433 12.729) 14.513 31.193 ( -9.912 0.589 13.150) 16.478 31.718 ( -4.711 -1.961 10.175) 11.383 31.964 ( 13.639 -3.788 -10.548) 17.653 ======================= Grid point 240 (124/186) ======================= q-point: (-0.38 -0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.732 ( -1.364 -0.000 5.729) 5.889 2.773 ( -30.521 -0.000 11.683) 32.681 2.942 ( -21.142 -0.000 5.120) 21.753 3.603 ( -8.110 -0.000 0.284) 8.115 3.739 ( -0.226 -0.000 14.853) 14.854 3.746 ( -5.662 -0.000 -0.643) 5.698 4.259 ( 0.779 0.000 5.208) 5.266 4.873 ( 3.123 0.000 9.217) 9.732 4.955 ( -0.683 -0.000 0.539) 0.870 5.348 ( -12.891 -0.000 -10.015) 16.324 5.900 ( -15.663 -0.000 48.843) 51.293 6.235 ( -14.162 -0.000 39.622) 42.077 6.719 ( -10.917 -0.000 4.783) 11.919 6.750 ( 5.037 0.000 0.916) 5.120 7.162 ( -4.964 -0.000 0.354) 4.976 7.252 ( 5.742 0.000 -12.752) 13.985 7.691 ( 9.461 0.000 10.335) 14.011 7.839 ( -10.862 -0.000 -14.186) 17.867 7.967 ( 20.287 0.000 -0.975) 20.310 8.345 ( 6.573 0.000 -23.157) 24.072 8.818 ( -7.209 -0.000 -13.516) 15.319 9.014 ( -1.590 -0.000 -0.986) 1.871 9.430 ( 9.961 0.000 -9.826) 13.992 9.559 ( 12.933 0.000 1.454) 13.014 10.001 ( -7.732 -0.000 -8.741) 11.669 10.046 ( 14.541 0.000 10.824) 18.127 10.376 ( -6.594 -0.000 0.910) 6.656 10.771 ( 2.649 0.000 -13.334) 13.595 10.915 ( -7.732 -0.000 17.568) 19.194 11.498 ( 1.256 0.000 6.194) 6.320 11.984 ( -2.765 -0.000 3.809) 4.706 12.200 ( -11.872 -0.000 -5.509) 13.088 12.622 ( 9.210 0.000 4.966) 10.464 12.939 ( 2.758 0.000 -7.455) 7.949 13.800 ( 4.727 0.000 -2.398) 5.301 13.871 ( 0.950 0.000 -2.462) 2.639 14.109 ( -11.271 -0.000 -12.530) 16.854 14.380 ( -2.031 -0.000 0.448) 2.080 14.689 ( 11.614 0.000 8.700) 14.511 14.917 ( 9.538 0.000 -10.652) 14.298 15.509 ( -5.380 -0.000 15.567) 16.471 15.638 ( -7.806 -0.000 -6.349) 10.062 16.222 ( -1.734 -0.000 4.777) 5.082 16.303 ( 8.371 0.000 22.791) 24.280 18.397 ( 0.687 0.000 12.992) 13.010 19.365 ( -8.458 -0.000 19.163) 20.947 21.150 ( 12.939 0.000 -44.376) 46.224 21.652 ( 9.920 0.000 -25.483) 27.345 24.465 ( -10.700 -0.000 1.224) 10.769 25.477 ( -5.922 -0.000 15.523) 16.614 25.569 ( 20.425 0.000 -9.637) 22.585 26.749 ( -2.889 -0.000 -23.619) 23.795 28.974 ( 8.209 0.000 6.580) 10.521 29.049 ( 0.736 0.000 -4.345) 4.407 30.099 ( -0.843 -0.000 13.703) 13.729 30.444 ( -9.813 -0.000 4.748) 10.901 31.275 ( -3.867 -0.000 7.284) 8.247 31.350 ( -14.826 -0.000 -12.741) 19.548 31.522 ( -2.955 -0.000 -1.061) 3.140 31.584 ( 15.444 0.000 20.108) 25.355 ======================= Grid point 241 (125/186) ======================= q-point: (-0.25 -0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.461 ( -32.770 2.907 12.499) 35.193 2.510 ( -27.194 3.059 16.576) 31.994 2.880 ( 8.048 -1.220 -0.110) 8.141 3.403 ( -1.184 22.357 -1.424) 22.433 3.523 ( -18.687 -2.868 14.156) 23.618 3.955 ( -0.691 -12.984 7.609) 15.065 4.375 ( 2.703 -8.841 7.046) 11.623 4.944 ( 2.721 -1.364 -0.850) 3.160 4.994 ( 3.145 -1.557 6.229) 7.150 5.188 ( -12.036 -5.967 -8.843) 16.083 5.891 ( -16.890 3.181 40.689) 44.170 6.224 ( -12.863 2.797 34.520) 36.945 6.526 ( -16.058 4.237 7.625) 18.275 6.777 ( -2.968 0.428 6.473) 7.134 7.174 ( 0.171 -2.541 4.728) 5.370 7.239 ( 3.683 0.698 -14.211) 14.698 7.690 ( -5.076 -1.358 -7.986) 9.560 7.809 ( 4.799 -0.118 2.234) 5.295 8.213 ( 15.128 3.890 -4.466) 16.246 8.325 ( 7.776 -3.239 -16.119) 18.187 8.681 ( -4.433 -0.404 -10.711) 11.599 9.051 ( 2.814 -4.595 -0.845) 5.454 9.496 ( 10.576 3.701 -8.576) 14.110 9.650 ( 0.175 -0.708 -10.547) 10.572 9.870 ( -2.439 3.240 -5.273) 6.652 10.249 ( 6.604 2.100 4.616) 8.326 10.320 ( 0.578 -5.035 6.748) 8.439 10.740 ( 0.997 1.299 -7.062) 7.250 10.902 ( -5.612 -0.110 11.461) 12.762 11.505 ( 0.801 4.617 4.613) 6.576 12.015 ( -3.056 -4.651 8.282) 9.978 12.054 ( -5.350 0.679 -3.091) 6.216 12.770 ( 6.600 -1.372 5.675) 8.812 12.915 ( 2.548 1.843 -8.964) 9.500 13.743 ( -6.455 4.685 -6.370) 10.207 13.874 ( 4.100 0.231 -0.590) 4.149 13.982 ( -3.910 -3.077 -10.556) 11.670 14.357 ( -3.574 -0.934 1.163) 3.873 14.899 ( 13.552 -0.806 3.489) 14.017 15.014 ( 9.649 -2.171 -7.511) 12.419 15.505 ( -2.610 0.376 -0.856) 2.772 15.540 ( -5.239 -1.459 6.666) 8.603 16.191 ( -2.853 3.066 4.795) 6.367 16.514 ( 8.673 2.855 21.893) 23.721 18.468 ( -0.074 0.968 16.858) 16.886 19.336 ( -7.433 2.595 19.035) 20.599 21.132 ( 14.136 -2.976 -43.791) 46.112 21.650 ( 9.830 0.531 -26.111) 27.905 24.374 ( -5.899 -1.401 2.801) 6.679 25.460 ( -7.403 0.158 13.763) 15.628 25.710 ( 6.195 -1.810 -17.100) 18.277 26.620 ( 3.903 3.341 -15.244) 16.086 29.028 ( 3.808 1.918 -0.546) 4.298 29.174 ( 7.675 -6.593 2.722) 10.478 30.121 ( -3.515 1.167 11.006) 11.612 30.314 ( -9.518 2.512 -2.838) 10.245 31.050 ( -13.802 4.641 -1.621) 14.652 31.252 ( -5.217 1.845 8.522) 10.161 31.542 ( -4.986 -7.457 -1.076) 9.034 31.904 ( 18.666 -1.107 15.774) 24.463 ======================= Grid point 242 (126/186) ======================= q-point: (-0.12 -0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.979 ( -29.627 8.993 16.356) 35.017 2.377 ( -21.203 -12.136 18.046) 30.373 2.935 ( 6.123 13.159 -1.939) 14.642 3.141 ( 0.381 6.781 2.425) 7.211 3.446 ( -12.020 -5.675 10.019) 16.645 4.168 ( 0.526 -11.623 11.132) 16.103 4.599 ( 3.914 -10.994 7.360) 13.797 4.979 ( -1.188 -2.026 -4.606) 5.171 5.092 ( 2.706 -2.722 5.425) 6.645 5.110 ( -9.732 -9.096 -5.068) 14.253 5.762 ( -16.598 6.611 26.155) 31.675 6.136 ( -8.915 9.050 19.532) 23.300 6.331 ( -20.109 1.196 25.715) 32.666 6.756 ( -7.968 -1.189 15.376) 17.359 7.233 ( 2.554 -2.280 -4.929) 6.001 7.242 ( 4.502 -0.754 0.409) 4.583 7.643 ( -1.668 0.455 -1.666) 2.401 7.865 ( 2.487 -2.643 -2.700) 4.523 8.167 ( 0.315 -0.820 -24.686) 24.702 8.458 ( 10.925 4.085 -0.899) 11.699 8.643 ( 1.756 -2.388 -3.890) 4.891 9.178 ( 4.951 -5.564 0.034) 7.448 9.459 ( -2.235 5.073 -10.905) 12.233 9.549 ( -0.012 3.246 -9.814) 10.337 9.775 ( -2.175 2.217 -5.915) 6.681 10.299 ( 4.104 0.658 7.525) 8.597 10.536 ( 6.557 -9.753 -0.649) 11.770 10.696 ( 0.800 3.250 2.998) 4.493 10.871 ( -3.005 1.183 1.048) 3.395 11.455 ( 0.660 6.444 3.772) 7.496 11.972 ( -2.034 2.696 5.190) 6.192 12.146 ( 1.411 -7.948 5.000) 9.496 12.780 ( -4.065 0.663 -5.678) 7.015 12.959 ( 8.965 1.095 0.707) 9.059 13.560 ( -8.735 1.398 -8.763) 12.452 13.877 ( 2.634 4.106 -5.255) 7.170 13.992 ( -0.006 -5.423 -0.166) 5.426 14.328 ( -3.380 -0.873 1.296) 3.724 15.030 ( 9.005 3.914 -2.989) 10.264 15.131 ( 7.106 -2.197 -3.449) 8.198 15.472 ( -0.202 -2.118 -4.922) 5.362 15.606 ( 2.378 -4.732 6.585) 8.450 16.112 ( -4.627 4.906 5.193) 8.512 16.613 ( 6.350 10.872 16.406) 20.680 18.514 ( -2.367 4.297 21.957) 22.498 19.297 ( -6.421 2.575 18.352) 19.613 21.175 ( 15.065 -5.476 -41.532) 44.518 21.640 ( 9.738 0.538 -27.574) 29.248 24.389 ( 0.487 -3.043 5.341) 6.166 25.393 ( -10.216 0.997 1.140) 10.328 25.600 ( -12.232 -2.438 -10.599) 16.368 26.660 ( 15.381 2.012 -7.938) 17.425 29.062 ( 4.860 1.219 0.068) 5.011 29.361 ( 5.427 -4.861 2.224) 7.617 30.059 ( -8.048 5.317 -0.834) 9.681 30.150 ( -4.669 -0.769 -1.105) 4.860 30.886 ( -13.101 -2.505 9.685) 16.484 31.199 ( -4.153 3.652 10.666) 12.014 31.561 ( -7.002 -5.940 2.377) 9.485 32.210 ( 20.820 1.716 5.550) 21.615 ======================= Grid point 249 (127/186) ======================= q-point: (-0.25 -0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.144 ( -29.255 -0.000 21.212) 36.136 2.258 ( -31.645 -0.000 17.724) 36.270 2.972 ( 7.046 0.000 -0.635) 7.074 3.304 ( -20.555 -0.000 23.991) 31.592 3.594 ( -1.161 -0.000 -10.453) 10.517 3.846 ( -1.829 -0.000 18.339) 18.430 4.358 ( 1.037 0.000 8.589) 8.651 4.926 ( -2.984 -0.000 -3.897) 4.909 4.980 ( -6.146 -0.000 -10.383) 12.065 5.066 ( 5.012 0.000 6.726) 8.388 5.874 ( -18.950 -0.000 36.240) 40.895 6.239 ( -18.795 -0.000 44.443) 48.254 6.415 ( -5.686 -0.000 -3.665) 6.765 6.710 ( -7.505 -0.000 -2.216) 7.825 7.205 ( -1.478 -0.000 18.176) 18.236 7.208 ( 1.425 0.000 -12.033) 12.117 7.642 ( 2.990 0.000 -5.232) 6.026 7.863 ( 1.932 0.000 0.557) 2.011 8.142 ( -1.006 -0.000 -30.121) 30.138 8.567 ( 18.419 0.000 6.777) 19.626 8.579 ( -2.766 -0.000 -9.938) 10.316 9.057 ( 4.279 0.000 -0.656) 4.329 9.504 ( -9.352 -0.000 -15.053) 17.722 9.613 ( 9.510 0.000 -7.773) 12.283 9.846 ( -3.627 -0.000 -7.590) 8.412 10.292 ( 0.452 0.000 10.021) 10.032 10.374 ( 5.045 0.000 1.247) 5.197 10.766 ( 6.010 0.000 -8.543) 10.445 10.880 ( -6.712 -0.000 13.277) 14.877 11.583 ( 2.813 0.000 1.867) 3.376 11.974 ( -4.882 -0.000 10.796) 11.849 12.036 ( 2.194 0.000 2.799) 3.556 12.792 ( -3.928 -0.000 -0.849) 4.019 12.975 ( 9.291 0.000 -2.932) 9.743 13.578 ( -14.522 -0.000 -7.476) 16.334 13.923 ( 6.971 0.000 -2.574) 7.431 13.947 ( 2.099 0.000 -8.920) 9.164 14.299 ( -4.505 -0.000 0.592) 4.543 15.086 ( 13.290 0.000 1.138) 13.339 15.094 ( 9.951 0.000 -6.486) 11.878 15.433 ( -2.288 -0.000 -6.936) 7.304 15.551 ( -0.283 -0.000 9.373) 9.378 16.185 ( -3.905 -0.000 2.601) 4.692 16.795 ( 12.416 0.000 23.417) 26.505 18.568 ( 0.718 0.000 19.199) 19.212 19.361 ( -6.191 -0.000 19.473) 20.434 21.082 ( 14.620 0.000 -44.183) 46.539 21.648 ( 9.054 0.000 -26.793) 28.282 24.340 ( -0.618 -0.000 5.532) 5.567 25.417 ( -10.054 -0.000 14.826) 17.914 25.553 ( -11.881 -0.000 -24.743) 27.448 26.708 ( 14.050 0.000 -9.036) 16.705 29.087 ( 5.447 0.000 -3.471) 6.459 29.258 ( 8.605 0.000 5.556) 10.243 30.105 ( -7.286 -0.000 8.904) 11.505 30.170 ( -11.392 -0.000 -10.514) 15.502 30.870 ( -15.216 -0.000 3.005) 15.510 31.259 ( -3.383 -0.000 7.783) 8.487 31.458 ( -1.965 -0.000 2.898) 3.501 32.228 ( 20.195 0.000 15.569) 25.499 ======================= Grid point 250 (128/186) ======================= q-point: (-0.12 -0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.826 ( -27.136 8.238 24.203) 37.283 2.048 ( -22.921 -9.911 24.307) 34.848 3.034 ( 0.911 -2.225 -1.017) 2.611 3.258 ( -13.393 -6.046 25.147) 29.126 3.362 ( 1.422 18.889 -5.897) 19.839 4.053 ( 2.896 -12.364 11.634) 17.222 4.493 ( -3.422 -12.256 11.006) 16.824 4.845 ( -7.639 -4.508 -8.205) 12.083 4.906 ( -1.440 -0.800 -5.875) 6.101 5.175 ( 6.178 -0.231 6.374) 8.879 5.751 ( -19.015 4.601 30.797) 36.485 6.171 ( -21.378 1.260 41.117) 46.359 6.318 ( -0.363 8.996 -0.061) 9.003 6.642 ( -6.818 -5.352 -0.543) 8.685 7.204 ( 0.435 -3.579 -0.572) 3.651 7.282 ( -2.389 -1.239 19.319) 19.506 7.675 ( 5.254 0.886 -4.443) 6.938 7.853 ( -0.244 1.532 -5.994) 6.192 8.011 ( 0.442 -2.980 -25.542) 25.719 8.513 ( -0.532 -0.947 -10.154) 10.212 8.748 ( 8.742 3.544 4.859) 10.611 9.153 ( 3.864 -5.402 -0.331) 6.650 9.308 ( -9.617 0.634 -11.257) 14.819 9.657 ( 5.540 4.494 -6.739) 9.813 9.730 ( -4.004 1.412 -6.535) 7.793 10.362 ( 1.627 -0.637 6.620) 6.847 10.456 ( 1.925 -6.520 -3.222) 7.523 10.794 ( 5.640 1.910 -2.365) 6.407 10.858 ( -3.445 1.147 6.368) 7.330 11.579 ( 2.523 6.246 1.293) 6.859 12.000 ( -1.778 -2.497 9.195) 9.692 12.123 ( 4.396 -2.513 5.471) 7.455 12.699 ( -6.788 0.801 -4.163) 8.003 13.080 ( 8.140 0.614 -1.031) 8.228 13.383 ( -11.158 -1.050 -5.158) 12.337 13.906 ( 1.371 2.840 -7.669) 8.292 14.019 ( 7.728 -1.473 -2.056) 8.131 14.256 ( -4.780 -1.908 1.117) 5.266 15.163 ( 7.982 2.778 -9.459) 12.685 15.217 ( 8.217 1.785 0.418) 8.419 15.427 ( 1.937 -3.185 -1.992) 4.227 15.616 ( 3.038 -2.637 3.353) 5.236 16.123 ( -4.814 2.540 2.614) 6.038 16.971 ( 10.869 11.585 14.349) 21.407 18.648 ( -1.788 2.980 22.320) 22.589 19.349 ( -6.603 3.541 18.780) 20.219 21.096 ( 15.221 -4.475 -42.570) 45.431 21.629 ( 8.762 0.148 -28.189) 29.520 24.418 ( 4.863 -2.524 8.397) 10.026 25.217 ( -16.367 2.258 -16.457) 23.320 25.378 ( -12.314 -3.533 10.779) 16.742 26.843 ( 13.989 1.758 -8.699) 16.567 29.156 ( 8.277 0.728 -1.958) 8.537 29.401 ( 5.864 -2.098 4.043) 7.425 29.944 ( -11.851 1.028 -11.874) 16.808 30.046 ( -8.230 -2.649 3.533) 9.339 30.749 ( -10.704 -1.256 11.907) 16.060 31.240 ( -3.215 1.398 7.700) 8.461 31.471 ( -2.369 -1.169 6.747) 7.246 32.526 ( 19.075 1.992 5.712) 20.011 ======================= Grid point 258 (129/186) ======================= q-point: (-0.12 -0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.746 ( -21.541 -0.000 26.852) 34.424 1.796 ( -14.628 -0.000 31.101) 34.370 2.966 ( -5.078 -0.000 -4.074) 6.510 3.224 ( -5.601 -0.000 29.120) 29.654 3.490 ( -0.168 -0.000 -5.140) 5.143 4.087 ( 5.805 0.000 12.067) 13.390 4.384 ( -3.852 -0.000 9.260) 10.029 4.652 ( -9.703 -0.000 -9.066) 13.280 4.919 ( 3.366 0.000 0.588) 3.417 5.279 ( 4.724 0.000 7.274) 8.673 5.692 ( -18.864 -0.000 34.346) 39.186 6.111 ( -18.097 -0.000 36.563) 40.796 6.426 ( 1.796 0.000 0.262) 1.815 6.502 ( -2.950 -0.000 -5.495) 6.237 7.163 ( 0.764 0.000 -1.643) 1.812 7.327 ( -9.654 -0.000 32.593) 33.993 7.681 ( 0.602 0.000 -13.681) 13.695 7.865 ( 1.013 0.000 -2.272) 2.488 7.911 ( 8.489 0.000 -19.566) 21.329 8.440 ( -1.290 -0.000 -9.527) 9.614 8.850 ( -0.258 -0.000 1.298) 1.324 9.149 ( 1.861 0.000 -0.605) 1.957 9.172 ( -5.067 -0.000 -6.411) 8.172 9.644 ( -5.286 -0.000 -4.731) 7.094 9.734 ( 5.553 0.000 -7.045) 8.970 10.393 ( -0.904 -0.000 4.174) 4.271 10.399 ( 0.508 0.000 -4.469) 4.498 10.838 ( 4.271 0.000 -9.067) 10.023 10.897 ( 0.201 0.000 13.134) 13.135 11.670 ( 4.277 0.000 -3.937) 5.814 11.984 ( -3.078 -0.000 11.681) 12.079 12.187 ( 2.959 0.000 0.939) 3.105 12.590 ( -7.858 -0.000 -3.573) 8.633 13.168 ( 6.288 0.000 -3.215) 7.063 13.262 ( -4.946 -0.000 4.262) 6.529 13.907 ( 0.831 0.000 -7.272) 7.319 14.083 ( 6.823 0.000 -10.026) 12.127 14.203 ( -2.381 -0.000 7.212) 7.594 15.223 ( 6.702 0.000 -14.093) 15.605 15.340 ( 7.536 0.000 -1.130) 7.621 15.436 ( 2.642 0.000 5.165) 5.802 15.640 ( 2.310 0.000 0.787) 2.440 16.089 ( -4.400 -0.000 2.111) 4.880 17.233 ( 7.941 0.000 1.689) 8.119 18.729 ( -7.298 -0.000 22.203) 23.372 19.363 ( -9.883 -0.000 16.759) 19.456 21.056 ( 15.569 0.000 -41.394) 44.225 21.604 ( 8.811 0.000 -29.125) 30.429 24.523 ( 6.942 0.000 10.974) 12.986 24.993 ( -6.543 -0.000 -9.170) 11.266 25.272 ( -10.894 -0.000 13.669) 17.479 26.949 ( 7.403 0.000 -11.719) 13.862 29.280 ( 12.046 0.000 -1.760) 12.174 29.478 ( 4.314 0.000 4.092) 5.946 29.731 ( -10.836 -0.000 -11.516) 15.813 29.913 ( -11.127 -0.000 2.246) 11.352 30.701 ( -5.810 -0.000 14.543) 15.661 31.230 ( -3.336 -0.000 4.732) 5.790 31.503 ( -0.146 -0.000 11.260) 11.261 32.761 ( 12.122 0.000 -1.144) 12.176 ======================= Grid point 259 (130/186) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.251 ( -0.042 -0.000 19.618) 19.618 2.446 ( 7.676 0.000 12.993) 15.091 2.691 ( -4.320 -0.000 -2.756) 5.125 3.020 ( 5.245 0.000 -18.284) 19.022 3.915 ( -5.514 -0.000 9.416) 10.912 4.130 ( -2.152 -0.000 -0.360) 2.181 4.537 ( 1.161 0.000 13.038) 13.089 4.697 ( -5.325 -0.000 7.508) 9.205 5.057 ( -3.581 -0.000 3.929) 5.316 5.401 ( 10.858 0.000 -7.818) 13.380 6.055 ( -10.801 -0.000 12.411) 16.452 6.357 ( -9.533 -0.000 8.946) 13.073 6.437 ( 11.967 0.000 -6.269) 13.509 6.857 ( 2.658 0.000 -15.857) 16.078 7.035 ( -6.212 -0.000 37.284) 37.798 7.728 ( 8.566 0.000 1.315) 8.666 7.877 ( -18.962 -0.000 24.105) 30.670 7.903 ( 11.523 0.000 -3.096) 11.931 8.074 ( 0.586 0.000 12.640) 12.654 8.302 ( 7.475 0.000 -0.022) 7.475 8.517 ( -10.612 -0.000 -7.036) 12.733 8.968 ( -6.508 -0.000 -10.852) 12.654 9.203 ( 4.677 0.000 2.920) 5.513 9.557 ( 4.552 0.000 -12.960) 13.736 9.561 ( -0.766 -0.000 7.820) 7.857 10.142 ( -1.709 -0.000 -14.141) 14.244 10.495 ( -3.185 -0.000 6.989) 7.681 10.627 ( 3.463 0.000 -6.057) 6.977 11.132 ( -2.269 -0.000 -1.737) 2.858 11.466 ( 3.219 0.000 -14.353) 14.709 11.930 ( -9.486 -0.000 9.882) 13.698 12.355 ( -1.190 -0.000 -3.575) 3.768 12.437 ( 6.393 0.000 10.625) 12.400 12.961 ( 0.167 0.000 -16.067) 16.068 13.624 ( 3.700 0.000 0.807) 3.787 13.782 ( -0.698 -0.000 -9.797) 9.822 13.929 ( 1.556 0.000 13.233) 13.324 14.395 ( 5.515 0.000 -6.323) 8.390 15.104 ( 0.991 0.000 3.137) 3.290 15.392 ( 3.267 0.000 -6.308) 7.104 15.556 ( -8.204 -0.000 3.500) 8.920 15.655 ( 3.452 0.000 -1.713) 3.854 16.297 ( 6.342 0.000 12.162) 13.716 16.836 ( -12.784 -0.000 -13.115) 18.315 19.003 ( -29.313 -0.000 32.368) 43.669 19.703 ( -7.967 -0.000 25.144) 26.376 20.393 ( 23.090 0.000 -36.407) 43.112 20.925 ( 11.314 0.000 -33.620) 35.473 24.850 ( -8.578 -0.000 6.981) 11.060 25.141 ( 20.356 0.000 -7.852) 21.818 25.632 ( 4.813 0.000 19.408) 19.996 26.425 ( -7.032 -0.000 -19.821) 21.032 29.476 ( -1.288 -0.000 1.028) 1.647 29.551 ( -10.200 -0.000 2.614) 10.530 29.599 ( -4.745 -0.000 -3.915) 6.152 29.629 ( 16.947 0.000 -1.237) 16.992 31.051 ( 2.770 0.000 9.872) 10.253 31.230 ( -2.262 -0.000 0.158) 2.268 31.951 ( 0.950 0.000 16.385) 16.413 32.509 ( -8.511 -0.000 -11.252) 14.109 ======================= Grid point 260 (131/186) ======================= q-point: ( 0.12 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.351 ( 4.204 2.635 15.314) 16.098 2.641 ( 1.659 2.942 -2.661) 4.300 2.681 ( 10.657 -5.492 7.639) 14.216 3.058 ( 9.894 -4.742 -16.711) 19.991 3.871 ( -2.312 4.416 12.665) 13.610 4.078 ( -3.503 2.491 1.618) 4.593 4.617 ( -1.561 -1.302 1.902) 2.784 4.666 ( -2.740 -3.415 8.082) 9.191 5.057 ( -4.365 -5.643 4.325) 8.343 5.483 ( 12.334 6.831 -8.383) 16.403 5.925 ( -14.047 -1.291 8.378) 16.407 6.243 ( -7.093 6.914 12.265) 15.765 6.660 ( 10.297 -9.679 -0.581) 14.144 6.914 ( 6.031 -8.204 -12.945) 16.470 7.153 ( -4.336 -3.499 30.165) 30.675 7.643 ( -11.484 8.353 11.217) 18.096 7.875 ( -3.679 -7.130 -1.432) 8.150 8.039 ( 9.661 2.279 8.626) 13.150 8.123 ( -3.209 -1.259 6.110) 7.015 8.329 ( -9.445 3.863 1.415) 10.302 8.423 ( 9.576 -0.023 2.436) 9.881 8.818 ( -6.679 0.529 -14.352) 15.838 9.282 ( 6.379 0.428 0.385) 6.405 9.515 ( 3.257 3.812 -4.657) 6.843 9.651 ( 4.168 -3.080 5.853) 7.818 10.035 ( -3.574 0.829 -14.747) 15.197 10.521 ( -2.370 -4.418 4.631) 6.825 10.659 ( 2.623 -1.228 -3.159) 4.286 11.065 ( -3.790 1.004 -1.925) 4.368 11.394 ( 1.381 4.761 -12.010) 12.992 11.904 ( -6.400 -2.137 10.708) 12.656 12.342 ( 1.666 0.023 -1.020) 1.954 12.578 ( 6.470 -0.564 10.098) 12.007 12.862 ( -0.330 1.845 -17.474) 17.574 13.643 ( 2.053 1.093 -0.589) 2.399 13.714 ( -2.277 1.226 -7.599) 8.027 14.059 ( 2.802 -4.383 11.617) 12.728 14.437 ( 5.356 -2.164 -11.798) 13.136 15.087 ( -2.800 5.003 4.435) 7.249 15.337 ( 0.095 4.911 -5.698) 7.523 15.502 ( -5.904 -3.603 1.254) 7.029 15.710 ( 2.973 -1.982 0.145) 3.576 16.411 ( 4.539 3.592 13.316) 14.520 16.550 ( -15.156 5.504 -8.169) 18.075 18.815 ( -26.115 -2.635 34.047) 42.990 19.722 ( -6.255 1.757 24.954) 25.786 20.534 ( 22.657 -1.221 -33.959) 40.842 20.912 ( 12.803 0.590 -33.978) 36.315 24.748 ( -10.119 0.453 4.447) 11.063 25.326 ( 15.889 1.178 -12.862) 20.476 25.802 ( 5.697 -0.087 19.830) 20.632 26.250 ( -3.779 0.389 -18.739) 19.120 29.339 ( -11.294 4.032 1.765) 12.121 29.513 ( -3.915 -4.057 1.990) 5.979 29.579 ( 0.441 -1.857 -3.470) 3.961 29.856 ( 14.930 -2.437 -1.301) 15.183 31.137 ( 2.689 0.827 7.375) 7.893 31.249 ( 2.788 -4.676 -0.197) 5.448 31.993 ( -3.107 4.688 17.608) 18.485 32.303 ( -12.618 1.894 -8.863) 15.535 ======================= Grid point 261 (132/186) ======================= q-point: ( 0.25 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.387 ( 1.313 8.574 11.434) 14.352 2.560 ( 1.077 4.996 -3.898) 6.428 2.949 ( 11.136 -5.321 5.422) 13.480 3.173 ( 5.835 -1.689 -8.363) 10.337 3.883 ( 0.937 3.588 17.652) 18.038 4.039 ( -1.055 -3.160 0.057) 3.332 4.639 ( 1.278 -5.434 -2.632) 6.171 4.750 ( 6.668 -1.737 -2.145) 7.217 5.155 ( -1.899 -9.813 5.442) 11.380 5.372 ( 6.224 15.752 -13.222) 21.487 5.933 ( -10.686 -11.082 18.223) 23.855 6.087 ( -11.559 6.199 10.421) 16.752 6.869 ( 4.965 -6.167 -1.698) 8.097 7.082 ( 6.627 -8.010 -1.949) 10.577 7.260 ( -9.360 -3.062 20.702) 22.925 7.456 ( -5.987 5.405 6.197) 10.171 7.828 ( -8.781 0.284 -4.250) 9.760 8.052 ( -5.562 -2.692 -5.948) 8.577 8.174 ( 6.164 3.513 5.656) 9.074 8.251 ( -4.271 2.050 17.800) 18.419 8.550 ( 7.171 -2.207 -0.141) 7.504 8.676 ( 0.813 3.205 -12.648) 13.073 9.350 ( 5.170 0.317 -1.343) 5.351 9.505 ( 3.680 1.863 -3.465) 5.387 9.813 ( 7.268 -4.272 8.800) 12.187 9.886 ( -4.238 2.933 -13.928) 14.851 10.583 ( -2.215 -6.560 -0.281) 6.930 10.681 ( -0.778 -1.543 2.195) 2.794 11.024 ( -0.671 0.691 0.627) 1.150 11.282 ( 0.880 5.444 -9.762) 11.212 11.904 ( -4.776 -1.695 9.048) 10.370 12.383 ( 3.543 -0.306 0.985) 3.690 12.667 ( 3.053 2.256 -3.985) 5.504 12.795 ( 3.196 -1.116 -3.514) 4.880 13.598 ( -4.049 2.397 -6.821) 8.287 13.680 ( 2.120 -0.438 0.720) 2.282 14.203 ( 2.584 -4.422 7.979) 9.482 14.480 ( 4.038 -4.674 -14.805) 16.042 14.906 ( -9.933 10.948 3.148) 15.114 15.272 ( 2.721 4.539 -2.784) 5.980 15.493 ( -2.970 -2.629 0.135) 3.969 15.769 ( 0.642 -2.342 0.592) 2.499 16.259 ( -12.278 4.402 -1.357) 13.114 16.458 ( 2.134 5.811 11.050) 12.666 18.750 ( -20.096 -6.621 35.299) 41.154 19.729 ( -5.859 3.216 24.706) 25.594 20.641 ( 19.278 2.017 -34.909) 39.930 20.923 ( 14.330 -0.720 -33.183) 36.153 24.644 ( -6.731 1.372 3.681) 7.794 25.360 ( 2.010 0.303 -16.956) 17.078 25.938 ( 1.494 1.034 17.960) 18.052 26.183 ( 7.849 0.615 -15.314) 17.220 29.171 ( -9.051 2.181 1.800) 9.483 29.496 ( -1.989 0.910 -0.828) 2.339 29.643 ( -1.613 -8.863 -0.286) 9.013 30.051 ( 12.494 -0.811 -0.533) 12.532 31.163 ( -0.340 0.102 4.277) 4.292 31.429 ( 10.183 -7.741 0.048) 12.792 31.872 ( -12.376 9.187 12.160) 19.632 32.108 ( -8.752 2.446 -0.572) 9.105 ======================= Grid point 262 (133/186) ======================= q-point: (-0.62 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.277 ( -4.237 8.192 6.041) 11.025 2.507 ( 2.138 4.886 -0.219) 5.338 3.132 ( -1.846 1.359 5.734) 6.176 3.153 ( 6.238 1.353 1.465) 6.549 3.899 ( -3.363 6.075 17.380) 18.716 4.161 ( 5.533 -9.385 -0.650) 10.914 4.735 ( 5.281 -3.754 -5.919) 8.775 4.908 ( 12.360 -3.456 -7.376) 14.803 5.179 ( 3.751 6.027 -11.309) 13.353 5.272 ( -0.537 -0.468 2.769) 2.859 5.902 ( -15.039 1.254 11.918) 19.230 6.043 ( -8.693 -9.444 16.376) 20.807 6.951 ( -1.992 -2.652 3.514) 4.832 7.172 ( -9.267 -1.001 12.042) 15.227 7.258 ( 6.147 -1.183 -1.593) 6.459 7.359 ( -9.226 4.776 8.868) 13.659 7.722 ( -3.815 -1.454 -3.991) 5.709 7.978 ( -5.152 -0.105 -3.997) 6.521 8.131 ( -1.651 7.191 5.411) 9.149 8.303 ( -1.230 -0.318 12.742) 12.806 8.624 ( 4.311 -0.792 -5.621) 7.128 8.729 ( 11.355 -4.576 -4.421) 13.016 9.380 ( 1.918 1.001 -2.781) 3.524 9.494 ( 0.788 2.440 -3.936) 4.698 9.717 ( -3.304 2.956 -10.769) 11.646 10.040 ( 8.941 -5.819 6.209) 12.344 10.621 ( -2.134 -5.197 -3.838) 6.804 10.739 ( 0.230 -3.000 7.486) 8.068 10.996 ( 0.370 4.805 1.667) 5.099 11.192 ( 0.198 1.074 -9.276) 9.340 11.935 ( -2.202 -3.437 9.565) 10.400 12.416 ( 2.423 2.716 0.303) 3.652 12.622 ( 2.320 0.563 -10.496) 10.764 12.894 ( 4.683 -1.942 5.532) 7.504 13.468 ( -4.678 2.543 -8.144) 9.731 13.730 ( 1.936 -1.483 2.069) 3.198 14.317 ( 1.796 -3.253 5.335) 6.502 14.505 ( -0.220 1.567 -11.025) 11.138 14.649 ( -7.360 3.694 1.374) 8.349 15.222 ( 2.301 5.568 -4.054) 7.262 15.500 ( 0.730 -0.180 0.383) 0.844 15.781 ( -2.576 -1.096 -0.291) 2.814 16.121 ( -6.206 -0.457 3.829) 7.306 16.445 ( 0.424 3.681 7.505) 8.370 18.807 ( -15.174 -8.976 36.201) 40.265 19.723 ( -6.217 3.430 24.868) 25.862 20.634 ( 16.607 6.067 -38.385) 42.261 20.971 ( 13.504 -2.002 -32.059) 34.845 24.587 ( -1.069 2.334 5.014) 5.633 25.236 ( -8.076 -1.452 -17.703) 19.512 25.970 ( -4.987 2.757 15.333) 16.358 26.272 ( 16.032 0.130 -12.849) 20.546 29.073 ( -4.869 0.354 1.658) 5.156 29.450 ( -1.463 1.284 -1.672) 2.566 29.750 ( -2.865 -9.806 1.096) 10.275 30.188 ( 9.837 1.648 -0.077) 9.974 31.184 ( -0.534 -1.062 4.575) 4.727 31.589 ( -12.226 8.312 3.504) 15.193 31.708 ( 9.601 -9.342 1.840) 13.522 31.969 ( -7.317 5.761 5.597) 10.865 ======================= Grid point 263 (134/186) ======================= q-point: (-0.50 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.147 ( -7.567 4.058 8.095) 11.801 2.519 ( 3.838 -3.397 -0.811) 5.190 3.007 ( -6.769 8.738 10.522) 15.261 3.255 ( 4.485 1.469 4.276) 6.368 3.800 ( -8.184 7.808 15.290) 19.019 4.381 ( 6.427 -9.986 0.497) 11.886 4.793 ( 0.583 -1.276 -9.687) 9.788 4.917 ( 7.994 10.804 -5.656) 14.581 5.121 ( -4.207 2.412 -8.583) 9.858 5.274 ( -0.173 0.269 1.771) 1.800 5.842 ( -6.236 -5.377 10.993) 13.734 6.133 ( -4.995 -6.330 13.507) 15.731 6.946 ( -8.028 -2.103 11.483) 14.168 7.111 ( -5.117 4.434 1.728) 6.988 7.206 ( -7.996 3.657 10.235) 13.493 7.350 ( 6.460 -0.285 1.638) 6.671 7.687 ( -1.433 -1.136 -7.538) 7.756 7.909 ( -5.310 2.504 11.091) 12.548 8.057 ( 0.544 4.974 4.974) 7.056 8.316 ( -2.546 -0.489 1.164) 2.842 8.667 ( 4.107 0.486 -2.895) 5.048 8.953 ( 10.829 -10.260 -7.993) 16.924 9.330 ( -3.842 1.762 -4.238) 5.985 9.428 ( 0.946 4.650 -2.583) 5.403 9.640 ( -1.267 -0.193 -5.445) 5.594 10.224 ( 4.469 -5.360 0.256) 6.983 10.649 ( 0.906 -1.970 -3.523) 4.137 10.786 ( -0.790 0.584 4.902) 4.999 10.924 ( 2.235 8.529 1.531) 8.948 11.206 ( -0.224 -9.222 -6.262) 11.150 12.028 ( 0.251 -4.217 10.631) 11.440 12.373 ( 1.478 5.665 -2.550) 6.386 12.613 ( 0.771 -0.660 -5.459) 5.552 12.988 ( 2.931 -1.245 2.370) 3.970 13.351 ( -3.285 0.840 -7.281) 8.032 13.780 ( 0.983 -1.660 1.166) 2.254 14.288 ( -6.210 11.213 3.711) 13.344 14.380 ( 0.262 -0.038 2.830) 2.842 14.712 ( 3.985 -9.637 -8.112) 13.212 15.153 ( 1.838 3.982 -4.728) 6.449 15.517 ( 3.764 1.998 0.022) 4.261 15.748 ( -2.553 0.397 0.386) 2.613 16.110 ( -3.595 -1.990 5.432) 6.811 16.478 ( 0.625 -4.912 3.564) 6.101 18.936 ( -12.123 -9.400 36.374) 39.477 19.718 ( -7.187 2.182 25.278) 26.370 20.555 ( 16.171 7.886 -40.928) 44.708 21.000 ( 10.951 -1.732 -32.400) 34.244 24.603 ( 4.438 2.962 7.485) 9.192 25.058 ( -10.396 -2.061 -15.352) 18.655 25.887 ( -10.915 4.002 13.545) 17.851 26.432 ( 16.499 -0.964 -12.453) 20.693 29.053 ( -0.092 -1.199 0.910) 1.508 29.416 ( -1.098 -0.099 -1.362) 1.753 29.828 ( -3.811 -6.415 0.892) 7.515 30.245 ( 5.737 4.631 -1.084) 7.452 31.203 ( -3.579 1.697 6.097) 7.270 31.351 ( -10.199 3.125 7.690) 13.150 31.812 ( -6.315 7.398 5.245) 11.051 32.010 ( 12.854 -11.356 -2.604) 17.348 ======================= Grid point 264 (135/186) ======================= q-point: (-0.38 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.071 ( -8.641 -0.786 14.653) 17.030 2.688 ( 4.541 -11.845 -4.895) 13.597 2.834 ( -8.434 10.255 17.734) 22.154 3.247 ( -0.087 6.213 1.688) 6.439 3.658 ( -8.902 5.478 13.719) 17.247 4.523 ( -6.345 0.253 5.563) 8.442 4.703 ( 4.106 -2.688 -15.526) 16.283 4.839 ( 1.323 9.322 0.756) 9.445 5.025 ( -3.773 1.044 -7.374) 8.349 5.203 ( -0.591 5.579 3.553) 6.641 5.941 ( -1.391 -5.101 12.424) 13.502 6.228 ( -0.636 -4.691 10.519) 11.535 6.891 ( -7.779 10.571 0.833) 13.151 6.932 ( -13.767 0.286 24.874) 28.431 7.214 ( 3.888 -4.206 -1.610) 5.950 7.434 ( 7.271 2.438 -3.848) 8.581 7.632 ( 1.160 3.238 -7.093) 7.883 7.892 ( -6.812 1.068 26.613) 27.491 8.050 ( 0.936 2.473 6.721) 7.222 8.281 ( -0.542 -0.640 -8.581) 8.622 8.674 ( -0.692 -1.978 -6.714) 7.034 9.151 ( 6.008 -4.870 -7.677) 10.897 9.248 ( -1.687 1.426 -1.920) 2.927 9.394 ( 1.845 -0.296 -1.436) 2.357 9.596 ( -3.703 -0.776 -3.975) 5.487 10.301 ( 0.154 -3.401 -4.389) 5.555 10.632 ( 3.224 6.410 -1.954) 7.437 10.813 ( -1.669 -5.093 3.374) 6.333 10.842 ( 2.895 7.356 -1.256) 8.004 11.338 ( 0.378 -11.110 -4.391) 11.952 12.134 ( 0.961 -2.476 8.802) 9.194 12.292 ( 1.223 6.175 -2.664) 6.835 12.582 ( -3.032 0.140 -4.734) 5.623 13.016 ( -0.240 -1.157 -3.273) 3.480 13.314 ( 0.529 -1.259 -0.817) 1.591 13.806 ( -0.541 -1.325 0.611) 1.556 14.129 ( 0.872 9.720 2.603) 10.100 14.372 ( -1.374 1.569 2.953) 3.615 14.850 ( 4.565 -7.025 -8.251) 11.759 15.153 ( 3.559 -1.848 -2.196) 4.572 15.544 ( 5.321 2.498 0.315) 5.887 15.718 ( -0.564 1.771 1.432) 2.346 16.108 ( -3.595 -1.326 3.576) 5.241 16.637 ( 1.404 -14.172 -0.081) 14.242 19.087 ( -11.267 -8.679 35.550) 38.290 19.720 ( -8.973 0.231 25.215) 26.765 20.451 ( 16.569 8.406 -42.113) 46.029 20.992 ( 9.286 -1.383 -32.958) 34.269 24.685 ( 8.097 3.016 9.722) 13.007 24.900 ( -7.584 -1.440 -10.868) 13.331 25.734 ( -13.548 3.810 13.033) 19.181 26.576 ( 11.941 -1.747 -13.468) 18.084 29.108 ( 4.802 -1.984 -0.255) 5.202 29.414 ( -1.056 -2.273 -0.598) 2.577 29.824 ( -3.688 0.265 -0.698) 3.763 30.185 ( -1.185 7.066 -2.402) 7.556 31.078 ( -8.462 4.850 9.930) 13.919 31.357 ( -1.803 -2.393 8.562) 9.071 31.680 ( -3.424 4.801 5.911) 8.349 32.303 ( 11.589 -10.968 -6.295) 17.153 ======================= Grid point 265 (136/186) ======================= q-point: (-0.25 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.091 ( -7.088 -4.189 19.967) 21.598 2.581 ( -11.326 12.642 17.735) 24.549 2.925 ( -0.185 -9.840 -5.227) 11.144 3.111 ( -2.386 8.102 -4.004) 9.347 3.626 ( -3.403 -5.021 15.294) 16.453 4.346 ( -10.457 3.427 -2.103) 11.203 4.701 ( -1.261 11.096 -0.712) 11.191 4.765 ( -0.768 2.434 2.780) 3.774 4.961 ( 5.313 -1.866 -3.044) 6.401 5.208 ( 2.978 0.004 1.345) 3.267 6.040 ( -3.090 -4.946 12.695) 13.970 6.341 ( -0.166 -4.319 10.298) 11.168 6.601 ( -7.561 13.115 -2.913) 15.416 6.912 ( -11.674 0.689 34.665) 36.585 7.287 ( -1.010 4.079 -17.595) 18.090 7.406 ( 9.980 3.212 3.106) 10.934 7.642 ( 5.265 -1.130 -0.928) 5.464 7.948 ( -4.172 0.301 26.489) 26.817 8.054 ( -3.066 1.977 11.864) 12.412 8.245 ( 2.798 0.532 -12.341) 12.665 8.658 ( -3.556 -5.796 -9.939) 12.043 9.160 ( -4.510 0.356 5.724) 7.296 9.195 ( 1.415 3.738 -8.366) 9.272 9.484 ( 5.845 -4.939 -7.009) 10.377 9.543 ( -4.752 -2.263 -1.371) 5.439 10.288 ( -1.395 -0.774 -8.481) 8.630 10.572 ( 1.726 6.174 2.067) 6.736 10.739 ( 1.787 7.334 -5.551) 9.370 10.950 ( 1.094 -9.314 4.507) 10.405 11.436 ( 0.417 -6.288 -7.746) 9.986 12.184 ( -1.392 2.063 0.820) 2.620 12.225 ( 0.151 1.990 5.523) 5.873 12.497 ( -3.977 0.753 -6.294) 7.483 13.010 ( -0.335 -2.520 -6.775) 7.236 13.384 ( 3.683 -2.797 5.412) 7.119 13.819 ( -0.766 -1.406 0.538) 1.689 14.027 ( 3.143 9.869 -2.502) 10.655 14.354 ( 0.297 1.760 3.266) 3.722 14.952 ( 4.122 -5.099 -4.758) 8.102 15.245 ( 4.279 -4.185 -2.102) 6.344 15.586 ( 4.670 1.531 0.766) 4.974 15.696 ( 0.335 2.732 1.959) 3.379 16.105 ( -1.738 -1.560 3.673) 4.353 16.851 ( -0.448 -16.148 -6.150) 17.285 19.201 ( -14.297 -6.563 33.740) 37.227 19.716 ( -11.551 -1.262 24.562) 27.172 20.356 ( 17.798 7.671 -41.925) 46.188 20.968 ( 9.068 -1.174 -33.270) 34.504 24.800 ( 6.058 2.631 10.998) 12.829 24.832 ( 2.962 -1.207 -5.804) 6.627 25.588 ( -11.588 2.348 13.873) 18.228 26.638 ( 4.431 -1.777 -15.829) 16.533 29.225 ( 9.658 -2.151 -1.126) 9.959 29.442 ( -1.609 -4.028 0.012) 4.338 29.731 ( -1.558 6.576 -1.821) 6.999 30.016 ( -8.412 6.362 -1.513) 10.655 30.998 ( -4.311 2.664 11.723) 12.772 31.351 ( -4.369 2.062 4.642) 6.700 31.697 ( 2.224 -1.883 10.783) 11.170 32.522 ( 6.824 -8.541 -9.850) 14.715 ======================= Grid point 266 (137/186) ======================= q-point: (-0.12 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.171 ( -4.935 -3.082 21.797) 22.560 2.398 ( -4.156 8.674 17.788) 20.222 2.830 ( -9.710 4.413 -1.915) 10.836 3.047 ( 3.708 -0.827 -16.269) 16.707 3.822 ( -1.853 -12.192 15.089) 19.488 4.189 ( -6.167 1.849 -2.285) 6.831 4.546 ( 0.495 9.141 3.568) 9.825 4.719 ( -2.232 3.125 8.608) 9.426 5.061 ( 1.979 -0.036 4.985) 5.364 5.285 ( 7.422 -3.797 -6.291) 10.444 6.101 ( -7.998 -2.623 14.567) 16.824 6.352 ( -6.345 0.378 3.594) 7.302 6.443 ( 3.602 2.920 -1.685) 4.934 6.946 ( -7.666 1.074 33.822) 34.696 7.034 ( -2.840 11.555 -11.994) 16.895 7.571 ( 10.382 -0.466 7.375) 12.743 7.753 ( 6.976 -5.039 -3.420) 9.260 7.996 ( -12.391 0.080 25.313) 28.183 8.022 ( 2.504 5.013 8.383) 10.083 8.240 ( 4.555 0.177 -5.869) 7.431 8.631 ( -6.600 -5.341 -9.967) 13.093 9.087 ( -4.196 1.601 -6.292) 7.731 9.157 ( 0.007 0.713 3.966) 4.029 9.522 ( -0.473 -3.026 -4.645) 5.564 9.566 ( 2.740 -1.015 -3.756) 4.759 10.222 ( -1.172 0.389 -11.723) 11.788 10.527 ( -1.622 3.722 6.087) 7.317 10.648 ( 1.952 3.634 -7.826) 8.846 11.099 ( 1.259 -5.775 2.588) 6.452 11.464 ( 2.280 -3.231 -12.401) 13.016 12.056 ( -9.381 3.988 3.621) 10.817 12.299 ( 3.632 -2.040 6.844) 8.012 12.420 ( -1.697 1.726 -3.613) 4.349 13.005 ( 0.656 -2.266 -11.879) 12.111 13.518 ( 5.001 -3.555 6.252) 8.760 13.822 ( -0.773 -1.071 -3.983) 4.196 13.926 ( 1.833 7.726 2.055) 8.202 14.363 ( 3.494 1.439 -0.571) 3.821 15.048 ( 2.804 -3.350 0.124) 4.370 15.337 ( 4.402 -3.214 -4.091) 6.815 15.614 ( 0.424 0.625 1.540) 1.716 15.658 ( -0.879 2.786 0.100) 2.923 16.166 ( 3.608 -1.706 7.936) 8.883 16.954 ( -6.068 -9.725 -12.125) 16.685 19.186 ( -23.241 -2.401 31.870) 39.517 19.699 ( -11.429 -1.115 24.694) 27.233 20.320 ( 20.835 4.255 -39.865) 45.182 20.943 ( 9.955 -0.786 -33.385) 34.847 24.868 ( 0.578 -0.176 8.967) 8.988 24.939 ( 13.287 0.120 -3.309) 13.693 25.536 ( -3.516 0.877 16.561) 16.953 26.582 ( -3.108 -0.945 -18.520) 18.803 29.401 ( 13.505 -2.644 -1.539) 13.847 29.472 ( -2.483 -3.728 0.349) 4.493 29.622 ( 1.091 6.724 -0.838) 6.863 29.800 ( -12.444 4.602 -0.577) 13.280 30.996 ( -0.688 1.252 11.254) 11.344 31.279 ( -3.713 2.007 1.693) 4.548 31.831 ( 2.824 -2.620 14.353) 14.861 32.599 ( -0.772 -4.261 -11.920) 12.682 ======================= Grid point 268 (138/186) ======================= q-point: ( 0.12 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.513 ( 8.390 0.000 8.855) 12.198 2.752 ( 9.958 0.000 -0.363) 9.965 2.868 ( 16.581 0.000 5.131) 17.357 3.068 ( 12.390 0.000 -18.658) 22.397 3.934 ( 0.241 0.000 11.362) 11.364 4.081 ( -5.017 -0.000 5.999) 7.820 4.545 ( -7.499 -0.000 1.598) 7.667 4.652 ( -2.210 -0.000 15.196) 15.356 4.988 ( -1.370 -0.000 1.130) 1.776 5.629 ( 8.591 0.000 -18.542) 20.435 5.752 ( -13.610 -0.000 11.509) 17.824 6.335 ( -5.051 -0.000 21.232) 21.825 6.703 ( 11.949 0.000 -6.686) 13.692 6.882 ( 8.225 0.000 -12.528) 14.986 7.193 ( -5.685 -0.000 21.193) 21.943 7.593 ( -16.398 -0.000 17.115) 23.702 7.773 ( 1.763 0.000 -13.736) 13.848 8.014 ( -12.728 -0.000 2.105) 12.901 8.211 ( 7.449 0.000 5.818) 9.452 8.292 ( -7.868 -0.000 18.371) 19.985 8.534 ( 2.808 0.000 1.575) 3.219 8.731 ( 6.219 0.000 -14.412) 15.696 9.347 ( 3.562 0.000 -2.483) 4.342 9.575 ( 5.691 0.000 -9.250) 10.861 9.720 ( 4.550 0.000 15.155) 15.823 9.922 ( -4.444 -0.000 -13.454) 14.168 10.485 ( -1.008 -0.000 0.846) 1.316 10.686 ( 3.625 0.000 -2.413) 4.354 10.993 ( -5.770 -0.000 2.710) 6.375 11.368 ( -0.739 -0.000 -13.231) 13.252 11.908 ( -2.127 -0.000 14.277) 14.434 12.364 ( 2.937 0.000 -0.038) 2.937 12.709 ( 6.337 0.000 10.081) 11.907 12.775 ( -0.889 -0.000 -19.199) 19.220 13.647 ( -0.386 -0.000 -1.546) 1.594 13.663 ( -1.698 -0.000 -7.413) 7.605 14.137 ( 4.401 0.000 11.407) 12.227 14.406 ( 2.969 0.000 -16.559) 16.824 15.098 ( -5.546 -0.000 3.636) 6.632 15.315 ( -3.021 -0.000 -10.575) 10.998 15.433 ( -1.240 -0.000 5.800) 5.932 15.732 ( 1.414 0.000 2.157) 2.580 16.343 ( -16.164 -0.000 -4.291) 16.724 16.554 ( 2.110 0.000 14.701) 14.852 18.644 ( -22.157 -0.000 34.217) 40.764 19.781 ( -5.412 -0.000 24.868) 25.450 20.660 ( 21.877 0.000 -32.186) 38.917 20.920 ( 13.126 0.000 -33.886) 36.340 24.663 ( -6.398 -0.000 4.028) 7.560 25.364 ( 0.233 0.000 -18.445) 18.446 25.952 ( 2.307 0.000 19.322) 19.459 26.201 ( 9.355 0.000 -17.147) 19.533 29.202 ( -13.025 -0.000 0.890) 13.055 29.450 ( -2.746 -0.000 2.132) 3.476 29.557 ( -0.043 -0.000 -1.977) 1.978 30.049 ( 15.979 0.000 0.108) 15.979 31.206 ( 1.177 0.000 -2.151) 2.451 31.272 ( 7.998 0.000 5.434) 9.669 32.066 ( -5.116 -0.000 17.837) 18.556 32.081 ( -16.956 -0.000 -5.794) 17.919 ======================= Grid point 269 (139/186) ======================= q-point: ( 0.25 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.614 ( 6.324 7.845 6.981) 12.258 2.765 ( 12.617 14.181 -3.541) 19.309 3.102 ( 14.972 -0.642 2.709) 15.229 3.218 ( 11.459 -3.214 -10.369) 15.784 3.981 ( -3.023 0.029 2.059) 3.657 4.022 ( 0.151 2.294 16.429) 16.589 4.515 ( -5.454 -6.625 3.700) 9.345 4.803 ( 4.215 -9.906 8.466) 13.696 5.018 ( 1.371 -3.794 1.550) 4.322 5.417 ( -8.307 4.886 -23.196) 25.119 5.838 ( 0.153 -3.877 18.200) 18.609 6.237 ( -3.210 16.389 14.585) 22.172 6.869 ( 6.210 -5.144 -0.725) 8.097 6.985 ( 4.854 -8.904 -10.794) 14.811 7.195 ( -9.642 -2.635 14.417) 17.543 7.470 ( -5.992 3.805 6.496) 9.622 7.706 ( -5.487 0.164 -6.528) 8.530 7.881 ( -9.813 -4.228 -2.663) 11.012 8.274 ( -7.549 2.454 20.762) 22.227 8.303 ( 1.883 -0.067 5.491) 5.806 8.542 ( 1.640 -1.339 -1.026) 2.352 8.798 ( 13.078 3.444 -10.667) 17.224 9.356 ( -1.108 -1.307 -2.998) 3.453 9.586 ( 5.200 3.041 -4.775) 7.687 9.790 ( -4.500 1.816 -9.301) 10.491 9.904 ( 7.258 -4.058 11.505) 14.195 10.485 ( -1.623 -2.926 -3.737) 5.016 10.704 ( 2.356 1.130 0.896) 2.762 10.992 ( -1.889 -2.752 5.883) 6.764 11.277 ( -1.860 1.556 -10.562) 10.836 11.939 ( -0.555 2.640 12.663) 12.947 12.423 ( 4.360 -1.257 0.013) 4.538 12.662 ( -0.208 1.546 -16.458) 16.532 12.838 ( 4.585 -1.527 7.734) 9.120 13.566 ( -2.486 4.055 -5.861) 7.548 13.671 ( 0.242 -2.998 -0.643) 3.076 14.251 ( 4.191 -1.158 7.839) 8.964 14.374 ( 1.471 -4.004 -17.572) 18.082 14.938 ( -9.342 10.095 1.612) 13.849 15.252 ( -3.666 -3.986 -8.833) 10.361 15.484 ( 3.723 0.085 5.228) 6.419 15.747 ( -1.797 -0.602 1.385) 2.347 16.143 ( -11.085 1.264 1.806) 11.302 16.595 ( -1.568 4.300 13.110) 13.886 18.591 ( -17.100 -5.048 34.296) 38.653 19.815 ( -5.705 2.215 24.929) 25.669 20.749 ( 18.044 2.124 -34.843) 39.296 20.931 ( 13.133 -0.738 -32.459) 35.023 24.634 ( -0.481 0.922 5.270) 5.372 25.207 ( -9.037 -0.600 -19.017) 21.064 26.025 ( -3.740 1.133 16.929) 17.375 26.291 ( 16.796 0.740 -16.946) 23.871 29.059 ( -10.158 -0.654 1.237) 10.254 29.436 ( -4.404 -2.483 1.322) 5.226 29.571 ( 1.789 -1.754 0.103) 2.507 30.240 ( 14.490 1.370 1.179) 14.603 31.198 ( 1.800 2.004 -0.445) 2.730 31.452 ( 9.153 -6.948 1.087) 11.542 31.802 ( -17.262 4.890 -0.642) 17.953 32.060 ( -7.966 1.015 14.056) 16.188 ======================= Grid point 270 (140/186) ======================= q-point: ( 0.38 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.491 ( 2.931 17.551 2.741) 18.004 2.731 ( 11.109 14.859 1.112) 18.585 3.205 ( 1.470 6.425 2.453) 7.033 3.311 ( 13.014 1.575 -1.098) 13.155 4.012 ( -6.239 7.565 17.665) 20.204 4.070 ( 4.336 -11.049 -3.258) 12.308 4.625 ( -2.816 -11.441 1.886) 11.933 5.036 ( 13.019 -5.083 0.796) 13.998 5.127 ( -6.500 -7.379 1.154) 9.901 5.162 ( -2.414 1.897 -19.487) 19.728 5.911 ( -5.735 4.488 15.587) 17.204 6.080 ( 4.112 9.083 13.916) 17.119 6.916 ( -6.308 0.341 11.185) 12.846 7.078 ( -3.035 -6.858 -4.513) 8.753 7.241 ( 2.731 -6.879 -0.614) 7.427 7.357 ( -6.545 5.560 4.717) 9.798 7.635 ( -3.766 -1.540 -0.903) 4.168 7.849 ( -4.642 -5.677 -2.037) 7.611 8.213 ( -9.180 4.161 19.986) 22.384 8.324 ( 0.041 0.319 -1.268) 1.308 8.634 ( 6.689 -3.137 -0.732) 7.424 8.837 ( 9.229 3.419 -9.703) 13.821 9.326 ( -4.710 -1.665 -2.971) 5.812 9.568 ( 2.606 4.506 -3.721) 6.399 9.671 ( -2.915 2.079 -6.650) 7.553 10.101 ( 6.664 -3.533 7.549) 10.671 10.494 ( -2.225 -5.135 -4.001) 6.880 10.771 ( 4.257 -3.531 4.256) 6.979 11.003 ( -1.593 1.045 -0.996) 2.150 11.202 ( -0.315 2.553 -2.959) 3.921 11.963 ( 0.595 1.109 11.211) 11.281 12.469 ( 2.816 1.302 -4.643) 5.584 12.600 ( 1.622 -0.801 -8.914) 9.096 12.937 ( 2.099 -1.815 5.148) 5.848 13.441 ( -2.005 5.213 -5.876) 8.107 13.721 ( 0.355 -2.896 1.242) 3.171 14.343 ( 2.785 -1.514 4.032) 5.129 14.406 ( 3.175 -7.815 -15.247) 17.425 14.667 ( -9.367 11.734 4.537) 15.684 15.210 ( -3.827 -1.983 -8.506) 9.536 15.549 ( 4.687 1.313 1.445) 5.077 15.726 ( -2.716 -1.175 0.943) 3.106 16.062 ( -5.151 -0.911 6.916) 8.672 16.536 ( -3.816 5.995 9.208) 11.631 18.662 ( -13.482 -9.088 34.649) 38.274 19.813 ( -6.759 3.701 25.167) 26.320 20.729 ( 14.541 4.411 -39.246) 42.085 20.959 ( 12.341 -1.024 -31.456) 33.806 24.673 ( 4.783 2.023 7.530) 9.147 25.012 ( -9.391 -1.280 -16.282) 18.840 25.982 ( -10.065 2.731 13.809) 17.305 26.423 ( 16.901 0.121 -16.837) 23.857 28.983 ( -6.559 -2.985 1.577) 7.377 29.409 ( -4.470 -1.523 0.120) 4.724 29.651 ( 2.545 -4.125 2.809) 5.602 30.383 ( 12.728 4.193 0.686) 13.418 31.203 ( 1.365 0.629 2.113) 2.593 31.510 ( -17.446 5.499 4.521) 18.842 31.696 ( 10.542 -10.262 -3.862) 15.211 31.975 ( -8.785 3.978 10.622) 14.346 ======================= Grid point 272 (141/186) ======================= q-point: (-0.50 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.309 ( 2.774 15.915 4.779) 16.847 2.651 ( 7.298 11.735 0.349) 13.824 3.130 ( 0.429 8.913 6.776) 11.204 3.418 ( 10.024 5.676 0.774) 11.545 3.858 ( -12.096 8.183 16.703) 22.187 4.282 ( 4.227 -12.214 -3.139) 13.300 4.674 ( -6.308 -4.678 -5.272) 9.459 4.955 ( -7.713 0.870 -13.538) 15.606 5.152 ( -2.798 -1.089 -3.617) 4.701 5.217 ( 5.111 2.140 2.797) 6.207 5.889 ( 5.808 2.153 12.157) 13.644 6.170 ( 4.525 0.827 16.278) 16.915 6.894 ( -6.844 -0.979 16.938) 18.295 7.061 ( -6.486 -2.179 -3.267) 7.582 7.225 ( -4.678 5.521 6.017) 9.411 7.385 ( 5.190 -5.528 -0.244) 7.587 7.629 ( -0.148 -2.415 -1.846) 3.043 7.876 ( -4.149 -3.155 7.656) 9.262 8.147 ( -5.546 2.508 14.236) 15.483 8.283 ( -2.343 1.279 -4.364) 5.116 8.687 ( 3.440 2.867 -10.580) 11.488 8.932 ( 9.220 -6.697 -5.074) 12.474 9.261 ( -5.241 -0.195 -1.095) 5.358 9.494 ( -0.503 4.871 -5.392) 7.283 9.597 ( -2.775 0.753 -2.519) 3.823 10.221 ( 2.912 -1.816 1.642) 3.804 10.534 ( -2.232 -6.968 -1.982) 7.581 10.910 ( 3.382 6.033 7.263) 10.030 10.957 ( 2.167 -8.746 -9.199) 12.877 11.142 ( 0.097 5.807 0.343) 5.818 12.045 ( 1.731 -2.831 11.074) 11.561 12.433 ( 1.652 2.743 -6.812) 7.527 12.596 ( 0.245 0.788 -4.178) 4.259 12.975 ( -2.191 -1.648 -0.275) 2.755 13.346 ( 1.427 3.750 -3.263) 5.172 13.759 ( -0.822 -2.068 0.998) 2.439 14.363 ( -1.829 3.987 4.373) 6.194 14.441 ( 1.619 5.345 -0.832) 5.647 14.578 ( 2.762 -10.517 -4.903) 11.928 15.129 ( -4.524 -0.745 -7.945) 9.173 15.585 ( 4.068 0.244 -2.789) 4.939 15.736 ( 0.642 0.072 3.481) 3.540 16.071 ( -3.161 -1.907 7.545) 8.400 16.457 ( -3.894 1.798 4.901) 6.513 18.807 ( -11.848 -10.740 34.661) 38.173 19.785 ( -8.449 3.786 25.462) 27.093 20.647 ( 13.780 5.149 -41.585) 44.110 20.964 ( 10.798 -0.315 -32.331) 34.088 24.760 ( 6.994 2.325 7.554) 10.554 24.867 ( -5.044 -0.935 -10.055) 11.288 25.841 ( -13.773 3.695 11.730) 18.465 26.544 ( 13.230 -0.714 -16.879) 21.458 28.991 ( -2.477 -5.503 1.483) 6.214 29.376 ( -3.628 -1.556 -0.257) 3.956 29.750 ( 1.714 -2.925 4.188) 5.388 30.437 ( 9.461 8.754 -2.885) 13.209 31.214 ( -4.750 3.332 5.184) 7.780 31.291 ( -8.140 -0.005 8.935) 12.087 31.831 ( -9.279 4.485 9.614) 14.094 31.970 ( 10.365 -11.848 -8.274) 17.784 ======================= Grid point 273 (142/186) ======================= q-point: (-0.38 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.185 ( 2.325 11.700 10.469) 15.871 2.653 ( 6.169 -0.373 -3.889) 7.302 3.016 ( -1.010 14.012 12.427) 18.756 3.400 ( 4.837 10.823 -1.145) 11.909 3.673 ( -12.684 5.774 16.466) 21.572 4.394 ( -10.352 -2.976 4.260) 11.583 4.625 ( 3.986 -5.749 -15.613) 17.109 4.812 ( -5.925 -3.240 -13.476) 15.073 5.108 ( 2.758 11.989 1.087) 12.350 5.172 ( -6.225 -4.078 2.372) 7.811 6.036 ( 6.919 2.531 14.382) 16.159 6.302 ( 5.119 0.599 16.818) 17.590 6.913 ( -9.381 5.254 4.522) 11.664 6.931 ( -5.526 1.366 20.318) 21.100 7.199 ( 3.432 -1.755 -2.143) 4.410 7.500 ( 2.568 -2.588 2.225) 4.271 7.666 ( 3.510 0.053 -3.491) 4.951 7.893 ( -7.253 -1.652 21.027) 22.304 8.142 ( -0.890 1.731 7.219) 7.477 8.219 ( -0.939 -2.078 -8.357) 8.663 8.593 ( -1.320 2.907 -13.835) 14.198 9.137 ( 9.427 -6.496 -6.724) 13.276 9.200 ( -4.602 -0.386 0.294) 4.627 9.391 ( -3.150 1.319 -3.823) 5.126 9.538 ( -3.134 1.343 -1.455) 3.707 10.248 ( -0.503 -1.161 -4.500) 4.674 10.619 ( -0.487 -8.043 2.058) 8.317 10.835 ( 0.872 5.911 0.485) 5.995 11.010 ( 3.451 10.973 -3.883) 12.141 11.157 ( 0.416 -11.870 -2.427) 12.123 12.161 ( 2.103 -2.444 8.480) 9.073 12.381 ( 2.149 5.239 -3.425) 6.617 12.522 ( -4.352 1.943 -5.654) 7.395 12.938 ( -4.508 -2.175 -4.272) 6.580 13.354 ( 5.056 0.816 0.950) 5.208 13.770 ( -1.852 -1.892 0.373) 2.674 14.295 ( 2.357 8.442 4.650) 9.922 14.408 ( 0.297 2.437 2.700) 3.649 14.760 ( 5.394 -9.786 -7.459) 13.435 15.083 ( -3.345 -5.939 -5.068) 8.494 15.628 ( 5.191 0.093 -3.386) 6.198 15.752 ( 0.549 1.843 3.928) 4.374 16.083 ( -2.271 -0.285 5.962) 6.386 16.468 ( -3.117 -7.901 1.283) 8.590 18.964 ( -12.399 -10.100 34.096) 37.660 19.738 ( -10.758 2.776 25.607) 27.913 20.554 ( 14.761 5.610 -42.147) 45.008 20.941 ( 10.032 -0.163 -33.335) 34.812 24.797 ( 2.337 -1.050 -7.443) 7.872 24.874 ( 5.441 2.324 10.021) 11.638 25.673 ( -12.290 3.531 11.950) 17.502 26.602 ( 6.575 -0.773 -17.532) 18.740 29.083 ( 1.910 -7.468 1.083) 7.784 29.362 ( -2.658 -2.503 -0.130) 3.653 29.797 ( -0.031 0.815 4.096) 4.177 30.338 ( 3.175 13.677 -7.288) 15.820 31.094 ( -6.386 3.968 11.875) 14.055 31.343 ( -1.038 -2.830 8.725) 9.231 31.710 ( -5.951 3.072 8.175) 10.567 32.215 ( 6.990 -12.946 -10.277) 17.946 ======================= Grid point 274 (143/186) ======================= q-point: (-0.25 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.158 ( 1.080 4.804 16.137) 16.872 2.691 ( -0.950 2.916 -0.432) 3.098 2.872 ( -1.910 8.994 8.403) 12.456 3.250 ( 2.979 13.955 -6.043) 15.496 3.594 ( -6.455 -2.402 17.614) 18.913 4.238 ( -10.528 2.171 0.716) 10.774 4.689 ( -1.379 -1.919 -6.885) 7.280 4.787 ( 3.683 -3.991 -18.999) 19.760 4.995 ( 2.209 3.979 6.784) 8.169 5.200 ( -2.631 -4.499 2.178) 5.648 6.088 ( -0.741 5.481 16.475) 17.379 6.417 ( -0.566 3.100 20.508) 20.749 6.680 ( -2.894 10.357 -4.516) 11.663 6.994 ( -4.520 1.872 32.347) 32.715 7.253 ( 2.915 0.587 -11.009) 11.404 7.556 ( 0.221 -1.662 8.120) 8.291 7.671 ( 3.398 1.742 1.434) 4.079 7.968 ( -3.198 -2.902 19.866) 20.330 8.123 ( -0.557 1.254 2.525) 2.874 8.253 ( 4.583 -2.192 -7.236) 8.841 8.470 ( -4.816 -1.085 -12.918) 13.829 9.118 ( -7.032 0.449 -4.056) 8.130 9.199 ( 1.680 1.559 -4.606) 5.144 9.447 ( 5.040 -6.747 -0.706) 8.451 9.477 ( -2.194 0.827 -0.643) 2.432 10.208 ( -2.455 -1.200 -10.082) 10.446 10.684 ( 0.717 4.216 3.661) 5.629 10.849 ( -0.432 5.355 0.584) 5.404 10.863 ( 2.392 -2.709 -2.875) 4.618 11.287 ( -0.219 -8.988 -6.177) 10.908 12.220 ( 0.743 3.625 -1.746) 4.091 12.272 ( -4.182 3.869 4.084) 7.009 12.457 ( 0.991 0.498 -1.791) 2.107 12.907 ( -2.522 -4.057 -7.638) 9.009 13.442 ( 5.944 -1.262 3.720) 7.124 13.772 ( -2.189 -2.269 -1.032) 3.317 14.201 ( 1.412 10.692 1.761) 10.927 14.419 ( 3.846 2.021 1.457) 4.583 14.896 ( 2.625 -7.097 -2.826) 8.077 15.158 ( -0.196 -9.688 -4.195) 10.559 15.672 ( 5.102 1.929 -2.177) 5.873 15.723 ( -2.923 2.031 1.832) 4.003 16.112 ( 1.773 -1.139 7.233) 7.534 16.572 ( -5.228 -13.861 -3.416) 15.203 19.063 ( -16.684 -6.527 33.438) 37.935 19.685 ( -11.930 0.999 25.403) 28.083 20.479 ( 17.103 5.630 -40.811) 44.606 20.915 ( 10.481 -0.633 -33.969) 35.554 24.853 ( 5.015 -0.787 0.809) 5.141 24.947 ( 5.087 0.290 2.537) 5.692 25.584 ( -3.969 2.542 15.100) 15.818 26.558 ( -1.158 -0.360 -18.674) 18.714 29.243 ( 4.040 -8.547 1.212) 9.531 29.377 ( -0.727 -3.383 -0.396) 3.483 29.766 ( -1.475 4.550 3.504) 5.930 30.105 ( -1.269 15.154 -7.867) 17.122 31.060 ( -1.395 3.194 13.023) 13.481 31.353 ( -2.775 2.194 3.861) 5.236 31.723 ( -1.101 -3.932 13.180) 13.798 32.383 ( 1.171 -10.905 -12.017) 16.270 ======================= Grid point 275 (144/186) ======================= q-point: (-0.12 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.221 ( -0.331 -0.722 18.803) 18.820 2.605 ( 3.376 8.736 7.906) 12.257 2.754 ( -7.044 4.115 -0.193) 8.160 3.105 ( 7.462 8.652 -13.769) 17.893 3.727 ( -1.543 -8.948 16.745) 19.049 4.117 ( -5.673 0.530 0.234) 5.702 4.642 ( 0.159 1.957 -3.863) 4.333 4.729 ( -1.160 3.425 -3.592) 5.097 5.108 ( 3.244 -0.768 4.563) 5.651 5.265 ( 3.648 -8.321 -2.342) 9.383 6.049 ( -7.700 3.060 13.866) 16.153 6.299 ( -12.542 5.455 11.982) 18.183 6.642 ( 11.354 7.587 1.727) 13.765 7.028 ( -3.182 4.326 9.487) 10.901 7.150 ( -0.629 9.251 10.828) 14.255 7.607 ( -7.985 -6.353 10.656) 14.754 7.812 ( 12.946 -2.661 5.393) 14.275 7.999 ( -4.436 3.675 9.609) 11.204 8.124 ( 0.645 1.123 4.256) 4.448 8.313 ( 7.501 0.578 -1.563) 7.683 8.391 ( -8.452 -6.593 -8.812) 13.877 8.976 ( -8.320 -0.145 -11.480) 14.179 9.205 ( 3.218 0.677 2.956) 4.421 9.465 ( 0.789 -1.821 -2.639) 3.302 9.586 ( 5.424 -2.055 1.185) 5.920 10.131 ( -3.011 -1.170 -13.716) 14.091 10.613 ( -1.705 7.219 5.026) 8.960 10.705 ( 0.389 6.267 -4.581) 7.773 11.023 ( 1.394 -7.972 0.616) 8.117 11.349 ( -0.046 -6.673 -9.258) 11.412 12.038 ( -8.704 6.755 2.538) 11.306 12.309 ( 2.376 -1.985 -0.700) 3.174 12.485 ( 4.205 2.188 6.949) 8.412 12.898 ( -0.446 -4.007 -13.366) 13.961 13.560 ( 5.098 -2.453 3.254) 6.527 13.758 ( -2.799 -1.938 -4.548) 5.681 14.089 ( 1.113 9.249 5.638) 10.889 14.440 ( 5.818 2.855 -5.114) 8.256 15.007 ( -0.384 -6.657 2.993) 7.309 15.265 ( 1.005 -7.873 -5.313) 9.551 15.620 ( -5.695 3.292 1.681) 6.790 15.705 ( 3.880 2.413 -2.276) 5.105 16.235 ( 5.166 -3.466 10.610) 12.300 16.633 ( -10.486 -12.234 -7.861) 17.928 19.007 ( -24.198 -0.210 33.427) 41.267 19.672 ( -9.002 -1.475 25.110) 26.716 20.463 ( 20.457 3.965 -37.599) 42.987 20.906 ( 11.723 -0.966 -34.061) 36.035 24.846 ( -8.779 -0.310 6.126) 10.710 25.111 ( 18.704 -2.026 -7.125) 20.117 25.648 ( 4.312 1.160 18.520) 19.051 26.416 ( -6.408 -0.144 -19.461) 20.490 29.358 ( -5.575 -6.539 2.929) 9.078 29.474 ( 6.806 -5.320 -2.401) 8.966 29.678 ( -2.474 6.746 2.822) 7.720 29.865 ( 1.689 12.574 -5.930) 14.005 31.080 ( 1.067 2.235 11.333) 11.600 31.293 ( -0.433 3.878 0.232) 3.909 31.860 ( -1.054 -5.988 16.725) 17.796 32.416 ( -6.134 -6.691 -11.743) 14.842 ======================= Grid point 278 (145/186) ======================= q-point: ( 0.25 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.786 ( 5.831 0.000 5.139) 7.773 3.105 ( 17.124 0.000 -1.937) 17.233 3.231 ( 13.359 0.000 -14.188) 19.487 3.339 ( 15.229 0.000 0.168) 15.230 3.918 ( -11.282 -0.000 6.917) 13.233 4.124 ( 3.267 0.000 14.513) 14.876 4.437 ( -6.212 -0.000 9.140) 11.051 4.724 ( -3.166 -0.000 9.896) 10.390 5.115 ( 12.816 0.000 -2.086) 12.985 5.209 ( -7.784 -0.000 -24.216) 25.437 5.928 ( 0.694 0.000 22.434) 22.445 6.440 ( -1.180 -0.000 16.715) 16.756 6.776 ( -1.691 -0.000 -13.212) 13.320 6.998 ( 10.079 0.000 -12.950) 16.410 7.090 ( -13.658 -0.000 19.197) 23.560 7.475 ( -2.839 -0.000 5.186) 5.913 7.643 ( 1.634 0.000 -12.038) 12.149 7.691 ( -12.967 -0.000 5.045) 13.914 8.271 ( -13.156 -0.000 26.307) 29.413 8.320 ( 1.358 0.000 -5.503) 5.668 8.592 ( 6.430 0.000 3.188) 7.177 8.922 ( 11.660 0.000 -16.800) 20.449 9.289 ( -5.024 -0.000 -2.153) 5.466 9.634 ( 1.514 0.000 -2.439) 2.871 9.714 ( -2.600 -0.000 -9.135) 9.498 10.039 ( 7.811 0.000 14.979) 16.893 10.423 ( -1.847 -0.000 -4.387) 4.760 10.732 ( 1.859 0.000 -4.904) 5.245 11.010 ( 0.262 0.000 13.195) 13.197 11.208 ( -1.968 -0.000 -7.122) 7.388 12.025 ( 0.375 0.000 11.648) 11.654 12.469 ( 5.074 0.000 -3.466) 6.145 12.583 ( -0.762 -0.000 -14.053) 14.074 12.911 ( 2.294 0.000 6.333) 6.736 13.585 ( 0.624 0.000 -3.941) 3.990 13.619 ( -0.551 -0.000 -0.302) 0.628 14.265 ( 0.770 0.000 -18.171) 18.187 14.332 ( 3.421 0.000 6.498) 7.343 14.933 ( -7.424 -0.000 0.979) 7.488 15.074 ( -7.004 -0.000 -9.226) 11.584 15.589 ( 7.126 0.000 4.652) 8.510 15.705 ( -4.359 -0.000 -0.777) 4.428 16.056 ( -6.575 -0.000 7.020) 9.618 16.641 ( -5.834 -0.000 12.999) 14.248 18.521 ( -13.305 -0.000 33.183) 35.751 19.872 ( -6.710 -0.000 25.227) 26.104 20.787 ( 12.500 0.000 -39.378) 41.314 20.947 ( 14.011 0.000 -29.997) 33.108 24.703 ( 5.017 0.000 7.904) 9.362 24.993 ( -9.025 -0.000 -16.999) 19.246 26.023 ( -9.745 -0.000 14.303) 17.307 26.427 ( 16.729 0.000 -19.371) 25.595 28.937 ( -8.597 -0.000 1.876) 8.799 29.361 ( -5.231 -0.000 0.626) 5.268 29.614 ( 5.016 0.000 3.347) 6.030 30.443 ( 14.066 0.000 2.259) 14.247 31.240 ( 3.224 0.000 -3.124) 4.489 31.491 ( 0.457 0.000 5.495) 5.514 31.621 ( -10.271 -0.000 -5.799) 11.795 32.027 ( -9.952 -0.000 15.057) 18.049 ======================= Grid point 279 (146/186) ======================= q-point: ( 0.38 0.25 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.760 ( 1.966 12.831 3.114) 13.349 3.147 ( 15.684 16.864 -3.676) 23.322 3.348 ( 4.344 7.404 -3.529) 9.281 3.456 ( 11.475 -1.715 -0.997) 11.646 3.944 ( 0.693 -12.488 -0.179) 12.508 4.118 ( -9.737 9.845 17.499) 22.315 4.454 ( -4.599 -7.884 8.803) 12.680 4.815 ( -6.246 -11.485 2.830) 13.376 5.041 ( -1.496 -0.172 -19.813) 19.870 5.293 ( 17.911 1.393 -2.347) 18.118 6.033 ( 0.300 3.747 25.371) 25.648 6.349 ( 2.935 13.235 5.606) 14.670 6.805 ( -8.111 -12.963 -1.399) 15.356 6.953 ( -2.984 3.773 2.988) 5.663 7.158 ( -0.565 -9.291 5.412) 10.768 7.404 ( -3.765 6.374 4.239) 8.531 7.575 ( -3.501 -0.801 0.902) 3.703 7.715 ( 1.942 -7.217 -4.380) 8.663 8.193 ( -15.570 1.120 23.113) 27.890 8.299 ( 0.077 -0.112 -8.585) 8.586 8.714 ( 8.919 -0.878 1.947) 9.171 8.930 ( 7.889 3.517 -19.373) 21.211 9.225 ( -5.140 -1.623 -1.353) 5.557 9.604 ( -1.527 2.455 -8.008) 8.514 9.633 ( -3.655 1.260 0.162) 3.870 10.204 ( 6.268 -0.011 10.888) 12.564 10.397 ( -2.026 -2.523 -2.959) 4.385 10.739 ( 1.041 -3.812 -7.787) 8.732 11.059 ( 1.139 3.373 10.537) 11.122 11.208 ( 1.841 -1.614 1.967) 3.140 12.054 ( 0.141 2.647 9.678) 10.035 12.459 ( -0.143 0.017 -11.904) 11.905 12.582 ( 4.568 -1.643 -4.310) 6.491 12.940 ( -2.308 -0.656 2.633) 3.562 13.508 ( 1.863 7.227 -2.335) 7.820 13.681 ( 0.676 -4.216 0.665) 4.321 14.254 ( 3.728 -7.197 -16.121) 18.043 14.390 ( 1.141 0.007 4.662) 4.800 14.741 ( -6.355 10.442 1.517) 12.318 15.026 ( -7.152 -7.057 -8.368) 13.075 15.622 ( 0.051 2.683 -0.802) 2.800 15.719 ( 4.714 -1.541 2.674) 5.634 16.038 ( -3.560 -0.327 10.122) 10.735 16.576 ( -8.276 3.751 10.116) 13.597 18.566 ( -10.647 -5.391 32.811) 34.914 19.881 ( -8.353 2.327 25.483) 26.918 20.717 ( 9.072 0.538 -42.483) 43.444 20.981 ( 13.992 0.975 -30.275) 33.366 24.812 ( 4.449 1.475 3.968) 6.142 24.844 ( -1.793 -0.853 -7.333) 7.597 25.919 ( -13.805 1.638 11.663) 18.146 26.530 ( 13.922 -0.273 -20.319) 24.633 28.871 ( -5.640 -2.452 2.653) 6.698 29.307 ( -5.967 -2.338 -0.408) 6.422 29.720 ( 7.340 0.107 6.477) 9.790 30.606 ( 12.877 3.197 0.866) 13.296 31.251 ( 2.593 1.830 -0.527) 3.217 31.363 ( -16.537 1.678 6.397) 17.810 31.662 ( 6.873 -7.105 -6.174) 11.655 31.946 ( -10.400 1.826 11.344) 15.498 ======================= Grid point 280 (147/186) ======================= q-point: (-0.50 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.598 ( 3.020 15.454 3.151) 16.058 2.966 ( 3.910 20.659 -1.347) 21.069 3.333 ( 8.852 8.518 2.473) 12.532 3.591 ( 7.217 0.635 -1.611) 7.422 3.877 ( -15.833 9.589 15.543) 24.170 4.155 ( 4.171 -12.455 -3.850) 13.687 4.483 ( -8.964 -4.688 1.586) 10.239 4.828 ( -4.407 0.843 -3.982) 5.999 4.977 ( -4.628 -5.691 -5.464) 9.147 5.426 ( 9.226 7.509 -2.909) 12.246 6.101 ( 9.513 4.314 14.185) 17.615 6.354 ( 5.645 3.195 15.039) 16.378 6.845 ( -10.217 -8.210 6.348) 14.563 6.928 ( 0.553 -0.419 3.338) 3.409 7.281 ( -5.041 2.338 17.087) 17.968 7.331 ( 0.038 -6.653 -1.304) 6.779 7.590 ( 1.072 -3.205 -0.416) 3.405 7.824 ( 2.969 -4.715 -0.774) 5.625 8.088 ( -14.841 -1.436 16.651) 22.351 8.233 ( -2.886 0.815 -9.696) 10.149 8.778 ( 8.594 7.327 -15.539) 19.209 8.942 ( 7.201 -4.581 -5.923) 10.389 9.194 ( -2.477 -1.350 0.030) 2.821 9.459 ( -6.430 2.479 -11.471) 13.381 9.592 ( -2.092 2.391 5.661) 6.491 10.259 ( -0.100 2.050 1.610) 2.609 10.429 ( 0.104 -4.564 1.727) 4.881 10.792 ( 0.386 -8.161 -10.626) 13.404 11.072 ( 2.208 5.120 11.693) 12.954 11.248 ( 3.530 4.208 1.752) 5.766 12.090 ( 1.000 -1.191 9.891) 10.012 12.414 ( 0.328 -1.233 -8.906) 8.997 12.612 ( 2.325 2.352 -5.234) 6.191 12.892 ( -6.864 -1.281 -1.853) 7.224 13.447 ( 4.885 6.078 -0.982) 7.859 13.724 ( -0.651 -1.635 0.381) 1.801 14.403 ( 4.493 -8.362 -5.999) 11.230 14.410 ( 3.822 -3.288 -2.102) 5.462 14.570 ( -3.526 7.109 5.225) 9.501 14.957 ( -8.878 -4.536 -9.925) 14.068 15.616 ( 2.811 0.466 0.057) 2.850 15.796 ( 3.706 0.758 2.347) 4.452 16.059 ( -1.940 -0.660 9.980) 10.188 16.454 ( -7.475 3.712 5.815) 10.172 18.693 ( -9.803 -8.575 32.946) 35.427 19.840 ( -10.245 3.849 25.539) 27.786 20.623 ( 9.334 -0.180 -43.698) 44.684 20.981 ( 13.032 2.584 -31.449) 34.141 24.778 ( 3.298 -0.347 -9.165) 9.746 24.923 ( 3.070 1.184 9.845) 10.380 25.765 ( -12.698 2.799 11.174) 17.144 26.588 ( 9.123 -0.377 -20.538) 22.476 28.892 ( -1.804 -5.494 3.148) 6.584 29.269 ( -5.789 -3.745 -1.206) 7.000 29.839 ( 7.145 1.881 7.968) 10.866 30.657 ( 7.876 8.683 -5.446) 12.926 31.192 ( -10.364 2.518 10.938) 15.277 31.274 ( 1.461 -0.595 4.662) 4.921 31.783 ( -7.379 -1.682 6.327) 9.865 31.883 ( 2.475 -7.236 -6.314) 9.917 ======================= Grid point 281 (148/186) ======================= q-point: (-0.38 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.462 ( 4.056 14.517 5.749) 16.132 2.773 ( 2.557 10.906 -2.397) 11.455 3.286 ( 3.508 14.164 6.486) 15.968 3.584 ( 2.107 7.504 -5.312) 9.432 3.644 ( -16.279 4.663 20.633) 26.692 4.284 ( -6.171 -0.240 8.733) 10.696 4.462 ( 2.149 -11.364 -16.274) 19.965 4.703 ( -1.779 3.561 -8.500) 9.386 5.014 ( -3.390 -7.316 1.776) 8.256 5.302 ( 0.752 12.923 -5.616) 14.111 6.266 ( 8.415 4.432 16.541) 19.081 6.479 ( 4.679 1.651 20.070) 20.674 6.810 ( -10.104 -2.711 0.859) 10.496 7.007 ( 2.349 -1.203 13.910) 14.158 7.255 ( 2.813 2.785 3.699) 5.417 7.441 ( -6.777 -7.092 14.197) 17.256 7.678 ( 4.424 -3.878 -0.599) 5.914 7.891 ( -2.979 -1.408 12.370) 12.802 8.051 ( -5.967 -8.048 -2.793) 10.401 8.127 ( -4.467 -0.027 -8.133) 9.279 8.666 ( 7.157 10.725 -15.994) 20.544 9.054 ( -1.112 -5.938 -14.922) 16.099 9.217 ( 5.591 -0.438 2.699) 6.224 9.320 ( -5.045 -0.868 -1.845) 5.441 9.563 ( 0.903 4.376 4.722) 6.500 10.194 ( -4.417 0.726 -5.992) 7.479 10.533 ( 1.436 -6.746 5.612) 8.892 10.837 ( -0.609 -4.557 -9.354) 10.423 11.081 ( -2.790 2.764 10.448) 11.162 11.195 ( 6.098 8.820 -4.103) 11.481 12.191 ( 1.494 -3.064 8.292) 8.965 12.429 ( 3.737 -2.108 -4.108) 5.940 12.495 ( -5.310 7.745 -5.113) 10.692 12.818 ( -5.036 -2.358 -5.240) 7.641 13.461 ( 6.670 2.983 0.999) 7.375 13.722 ( -1.847 -0.984 -0.890) 2.274 14.440 ( 3.663 2.207 5.519) 6.982 14.469 ( -0.923 5.307 2.783) 6.063 14.649 ( 6.513 -12.273 -7.228) 15.662 14.871 ( -8.151 -8.137 -8.842) 14.520 15.665 ( 3.374 -0.762 1.177) 3.654 15.799 ( -1.225 2.618 1.164) 3.117 16.102 ( 0.966 -0.290 8.477) 8.537 16.369 ( -4.889 -0.586 2.105) 5.355 18.844 ( -10.786 -8.706 33.296) 36.066 19.763 ( -11.948 4.193 25.525) 28.493 20.553 ( 11.493 -0.589 -43.110) 44.620 20.950 ( 12.687 3.252 -32.538) 35.076 24.836 ( 8.889 -0.367 -4.120) 9.804 24.949 ( -2.825 -0.118 5.134) 5.861 25.664 ( -5.051 2.982 13.973) 15.155 26.564 ( 2.412 0.595 -20.645) 20.794 29.003 ( 1.677 -8.048 3.505) 8.937 29.255 ( -4.322 -5.044 -1.917) 6.913 29.908 ( 5.059 5.225 7.617) 10.532 30.507 ( -0.648 13.042 -9.868) 16.367 31.147 ( -2.008 2.573 14.381) 14.747 31.345 ( 1.254 -1.982 7.407) 7.769 31.688 ( -8.242 1.075 8.555) 11.928 32.042 ( 2.421 -12.980 -11.373) 17.426 ======================= Grid point 282 (149/186) ======================= q-point: (-0.25 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.349 ( 0.464 11.286 10.544) 15.452 2.688 ( -0.507 3.132 -4.790) 5.746 3.103 ( -2.994 16.371 9.598) 19.212 3.411 ( -3.968 8.674 -6.841) 11.738 3.586 ( -4.091 -0.005 21.670) 22.053 4.175 ( -6.904 4.343 6.928) 10.702 4.637 ( 2.904 -1.520 -11.950) 12.391 4.650 ( 8.508 -11.029 -16.325) 21.460 5.099 ( 0.360 -5.960 0.802) 6.024 5.117 ( -0.320 9.266 -1.353) 9.369 6.278 ( -4.210 10.715 22.955) 25.680 6.517 ( -10.358 6.445 14.962) 19.305 6.760 ( 5.105 0.157 3.676) 6.292 7.099 ( -0.406 0.636 11.406) 11.431 7.298 ( 4.602 1.128 2.048) 5.162 7.471 ( -13.017 -3.243 20.641) 24.617 7.778 ( 7.836 -0.674 1.130) 7.945 7.955 ( -4.372 -5.977 9.576) 12.105 8.057 ( -3.056 -6.578 -5.784) 9.277 8.131 ( 0.844 -6.405 -5.059) 8.205 8.535 ( 7.292 11.162 -12.334) 18.163 8.946 ( -8.460 -1.992 -15.673) 17.922 9.245 ( 0.722 1.542 2.375) 2.922 9.416 ( 5.979 -5.373 -4.570) 9.247 9.563 ( 6.459 4.960 9.960) 12.866 10.088 ( -5.665 -1.198 -11.432) 12.815 10.693 ( 1.293 -7.493 6.325) 9.890 10.823 ( -0.063 -1.380 -4.703) 4.902 10.953 ( -5.396 9.760 2.117) 11.352 11.204 ( 4.279 -0.607 -3.967) 5.866 12.255 ( -9.350 6.892 -2.162) 11.815 12.268 ( 1.999 -0.125 0.889) 2.191 12.520 ( 5.942 -0.200 4.296) 7.335 12.783 ( -1.556 -3.527 -8.746) 9.558 13.532 ( 6.285 0.601 2.782) 6.899 13.700 ( -2.918 -1.578 -2.959) 4.445 14.350 ( -1.528 8.767 3.357) 9.512 14.518 ( 6.695 2.150 -0.307) 7.039 14.769 ( -5.066 -9.796 -0.854) 11.061 14.972 ( 3.320 -13.380 -7.466) 15.677 15.693 ( -5.439 0.859 1.202) 5.636 15.743 ( 2.721 1.401 0.070) 3.061 16.178 ( 4.115 -0.448 7.911) 8.928 16.353 ( -5.766 -5.412 -0.691) 7.938 18.945 ( -14.354 -4.770 34.160) 37.359 19.680 ( -11.632 2.623 25.204) 27.882 20.526 ( 14.578 -0.571 -40.879) 43.404 20.917 ( 13.385 2.543 -33.254) 35.937 24.835 ( -10.099 -0.461 4.541) 11.083 25.048 ( 16.513 -2.208 -5.959) 17.694 25.691 ( 2.107 1.820 17.090) 17.315 26.438 ( -3.804 1.719 -20.300) 20.725 29.151 ( -1.247 -7.946 4.214) 9.080 29.299 ( 1.701 -7.009 -3.073) 7.839 29.896 ( 2.795 8.442 6.370) 10.938 30.241 ( -3.302 13.644 -9.432) 16.912 31.165 ( -0.459 3.330 13.408) 13.823 31.393 ( 2.762 2.510 2.657) 4.581 31.683 ( -5.213 -5.442 13.792) 15.716 32.159 ( -2.513 -11.531 -11.644) 16.579 ======================= Grid point 283 (150/186) ======================= q-point: (-0.12 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.291 ( -2.812 2.098 14.110) 14.540 2.596 ( -5.108 0.552 -5.394) 7.449 2.938 ( 3.182 11.988 8.714) 15.159 3.231 ( -0.520 6.335 -8.044) 10.252 3.718 ( 1.442 -4.733 19.730) 20.341 4.090 ( -2.357 3.268 3.685) 5.460 4.642 ( 4.906 0.249 -8.275) 9.623 4.767 ( 7.687 2.237 -15.994) 17.886 5.114 ( 3.260 -10.387 1.135) 10.946 5.188 ( 2.257 -1.290 1.805) 3.165 6.129 ( -11.289 10.591 22.193) 27.058 6.268 ( -15.593 8.765 8.303) 19.721 6.875 ( 8.188 4.019 4.339) 10.100 7.083 ( 0.707 3.013 1.661) 3.513 7.330 ( -3.058 6.525 20.109) 21.361 7.429 ( -10.924 -6.431 9.502) 15.842 7.902 ( 1.850 -3.725 -7.434) 8.518 8.008 ( -0.080 -4.868 9.568) 10.735 8.121 ( -3.084 -1.993 10.144) 10.788 8.192 ( 1.508 -4.517 -7.912) 9.234 8.471 ( 9.878 6.042 -4.681) 12.489 8.786 ( -8.381 -1.120 -13.466) 15.901 9.273 ( 4.065 -0.079 1.949) 4.508 9.470 ( 3.788 0.104 -4.902) 6.196 9.697 ( 9.843 1.468 9.467) 13.736 9.981 ( -5.574 -2.727 -14.635) 15.896 10.702 ( -1.649 4.703 -0.171) 4.986 10.764 ( -4.618 7.962 2.268) 9.480 10.938 ( 2.335 -8.789 1.811) 9.273 11.241 ( 1.806 -3.279 -7.516) 8.397 12.026 ( -8.682 6.504 1.784) 10.993 12.328 ( 3.386 -1.168 0.623) 3.636 12.602 ( 4.378 0.928 5.443) 7.047 12.787 ( 1.734 -3.020 -10.623) 11.179 13.616 ( 4.012 -0.432 2.238) 4.614 13.662 ( -3.408 -2.009 -5.044) 6.410 14.240 ( -0.120 7.757 5.356) 9.428 14.533 ( 5.964 4.088 -8.894) 11.462 14.848 ( -7.827 -11.639 4.047) 14.598 15.149 ( 4.169 -8.930 -4.664) 10.903 15.584 ( -6.171 2.100 0.040) 6.519 15.775 ( 2.877 1.474 0.035) 3.233 16.296 ( 3.740 -2.743 8.943) 10.074 16.338 ( -9.095 -7.314 -2.167) 11.871 18.909 ( -19.354 2.666 35.237) 40.291 19.662 ( -8.122 -1.385 24.690) 26.028 20.555 ( 17.665 -1.005 -37.642) 41.593 20.910 ( 14.370 1.287 -33.394) 36.377 24.724 ( -10.927 -1.303 3.479) 11.541 25.272 ( 16.787 -2.336 -9.881) 19.618 25.806 ( 3.858 0.080 18.067) 18.475 26.258 ( -4.352 1.481 -18.330) 18.897 29.204 ( -6.516 -5.603 2.878) 9.063 29.440 ( 4.019 -6.538 -2.206) 7.985 29.805 ( -0.523 10.831 2.932) 11.233 30.021 ( 2.595 9.076 -5.302) 10.827 31.162 ( -1.634 2.427 9.231) 9.683 31.405 ( 7.877 5.895 0.096) 9.839 31.790 ( -6.843 -8.821 16.987) 20.326 32.176 ( -7.334 -7.517 -9.273) 14.011 ======================= Grid point 288 (151/186) ======================= q-point: ( 0.38 0.38 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.869 ( -2.585 -0.000 4.329) 5.042 3.399 ( 9.480 0.000 -13.193) 16.246 3.465 ( 11.474 0.000 -3.488) 11.992 3.615 ( 7.460 0.000 -5.915) 9.520 3.764 ( -6.520 -0.000 9.177) 11.257 4.125 ( -17.522 -0.000 15.792) 23.588 4.359 ( -7.365 -0.000 13.819) 15.659 4.774 ( 7.636 0.000 3.474) 8.389 4.946 ( 0.848 0.000 -18.595) 18.614 5.514 ( 15.910 0.000 -3.524) 16.296 6.234 ( 3.596 0.000 32.467) 32.666 6.499 ( -5.130 -0.000 -13.773) 14.697 6.561 ( -0.102 -0.000 10.361) 10.362 7.029 ( -6.774 -0.000 21.278) 22.330 7.040 ( 2.069 0.000 -9.203) 9.433 7.406 ( -9.850 -0.000 14.727) 17.718 7.546 ( 0.058 0.000 0.900) 0.902 7.713 ( 11.410 0.000 -13.226) 17.467 8.083 ( -19.070 -0.000 22.878) 29.784 8.242 ( -1.870 -0.000 -11.718) 11.866 8.829 ( 8.057 0.000 0.634) 8.082 8.945 ( 7.860 0.000 -25.191) 26.388 9.160 ( -1.924 -0.000 -0.082) 1.926 9.496 ( -7.535 -0.000 -14.078) 15.967 9.635 ( -1.937 -0.000 8.487) 8.705 10.305 ( -1.707 -0.000 2.093) 2.701 10.372 ( 3.967 0.000 5.714) 6.956 10.673 ( 0.513 0.000 -9.685) 9.698 11.161 ( -0.156 -0.000 15.142) 15.142 11.264 ( 6.597 0.000 5.235) 8.422 12.101 ( -2.078 -0.000 7.692) 7.968 12.385 ( -0.737 -0.000 -11.519) 11.542 12.627 ( 7.082 0.000 -5.944) 9.246 12.875 ( -8.114 -0.000 -0.542) 8.132 13.630 ( 2.953 0.000 1.356) 3.250 13.641 ( 2.783 0.000 -0.432) 2.816 14.182 ( 6.119 0.000 -14.981) 16.183 14.420 ( 0.334 0.000 4.278) 4.291 14.770 ( -5.113 -0.000 -1.151) 5.241 14.800 ( -9.565 -0.000 -7.334) 12.053 15.643 ( 1.674 0.000 1.779) 2.443 15.797 ( 5.784 0.000 0.782) 5.837 16.056 ( -1.725 -0.000 11.804) 11.930 16.522 ( -10.855 -0.000 9.120) 14.178 18.562 ( -8.293 -0.000 31.673) 32.741 19.902 ( -10.068 -0.000 25.908) 27.796 20.608 ( 7.238 0.000 -44.826) 45.406 21.026 ( 13.946 0.000 -30.529) 33.564 24.774 ( 3.695 0.000 -10.007) 10.667 24.939 ( 2.089 0.000 9.928) 10.145 25.806 ( -12.949 -0.000 11.233) 17.142 26.582 ( 10.307 0.000 -22.010) 24.303 28.813 ( -2.884 -0.000 3.880) 4.834 29.208 ( -6.001 -0.000 -1.652) 6.224 29.869 ( 8.850 0.000 9.906) 13.283 30.780 ( 9.747 0.000 -2.475) 10.056 31.222 ( -11.898 -0.000 10.558) 15.907 31.299 ( 3.127 0.000 -2.111) 3.773 31.639 ( 2.816 0.000 -6.161) 6.774 31.869 ( -10.988 -0.000 9.485) 14.516 ======================= Grid point 289 (152/186) ======================= q-point: (-0.50 -0.62 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.788 ( -2.197 7.430 4.665) 9.044 3.256 ( 1.458 19.473 -7.331) 20.858 3.544 ( 5.912 4.390 -1.337) 7.484 3.622 ( 2.621 -0.756 -1.941) 3.348 3.826 ( -15.598 1.516 8.819) 17.982 3.978 ( -4.142 -10.654 4.927) 12.448 4.381 ( -4.849 -3.080 10.619) 12.073 4.848 ( 0.991 4.567 -8.665) 9.845 4.903 ( 4.074 0.022 3.477) 5.356 5.585 ( 3.276 6.037 -7.933) 10.493 6.352 ( 9.464 4.442 9.823) 14.346 6.508 ( 2.269 -1.824 21.488) 21.685 6.636 ( -5.579 -5.899 5.269) 9.680 6.979 ( 2.315 1.011 1.374) 2.875 7.145 ( -5.260 -10.678 0.981) 11.943 7.375 ( -3.949 3.113 24.923) 25.425 7.577 ( 2.422 -1.931 0.803) 3.200 7.824 ( 10.837 -3.395 -13.827) 17.893 7.945 ( -18.521 -0.093 21.719) 28.543 8.130 ( -6.118 0.025 -13.329) 14.666 8.898 ( 1.292 -2.927 -8.937) 9.492 8.908 ( 10.123 4.545 -24.437) 26.838 9.183 ( 3.819 -1.398 0.525) 4.101 9.323 ( -8.888 0.149 -8.358) 12.202 9.668 ( 3.229 2.501 10.346) 11.123 10.235 ( -5.885 1.211 -3.102) 6.761 10.456 ( 2.937 0.254 6.125) 6.797 10.669 ( 1.088 -4.011 -8.937) 9.856 11.199 ( -1.654 3.294 15.173) 15.614 11.371 ( 6.407 2.480 4.303) 8.107 12.108 ( -2.275 -1.643 7.641) 8.140 12.361 ( 2.721 -1.958 -8.168) 8.829 12.655 ( 0.572 3.703 -6.080) 7.142 12.754 ( -7.045 -2.422 -4.230) 8.567 13.604 ( 5.219 6.306 0.175) 8.188 13.708 ( 0.983 -0.946 -0.435) 1.432 14.291 ( 8.844 -9.977 -10.292) 16.843 14.442 ( 0.212 -0.209 3.254) 3.268 14.603 ( -6.422 3.498 -0.997) 7.380 14.736 ( -6.960 -3.283 -7.142) 10.499 15.683 ( 3.027 1.439 4.781) 5.839 15.842 ( 0.904 0.621 -0.327) 1.144 16.107 ( 1.711 0.514 11.468) 11.607 16.412 ( -8.856 1.615 5.822) 10.721 18.647 ( -7.393 -4.395 31.770) 32.913 19.870 ( -11.393 2.664 26.018) 28.528 20.501 ( 8.440 -1.851 -45.663) 46.473 21.039 ( 13.300 2.121 -31.010) 33.808 24.832 ( 11.197 -0.005 -6.755) 13.077 24.945 ( -7.266 -0.099 6.284) 9.608 25.728 ( -6.527 1.331 13.830) 15.351 26.578 ( 5.690 0.317 -22.441) 23.153 28.842 ( 0.770 -3.193 4.676) 5.714 29.141 ( -5.333 -2.516 -2.645) 6.463 30.016 ( 7.796 2.204 11.377) 13.967 30.772 ( -1.559 5.291 -8.198) 9.881 31.196 ( -0.302 1.619 12.478) 12.587 31.324 ( 3.047 0.340 2.376) 3.879 31.670 ( -3.495 -5.019 -1.678) 6.342 31.781 ( -6.691 -2.287 2.363) 7.455 ======================= Grid point 290 (153/186) ======================= q-point: (-0.38 -0.62 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.695 ( 1.744 9.413 4.628) 10.633 2.972 ( -0.549 17.435 -4.035) 17.904 3.443 ( -9.003 7.647 5.872) 13.191 3.528 ( -16.706 2.029 3.335) 17.156 3.689 ( -0.124 6.607 11.777) 13.504 4.191 ( 2.654 -16.565 -4.001) 17.246 4.375 ( -2.069 3.991 5.639) 7.212 4.740 ( 2.626 5.701 -9.654) 11.515 4.966 ( 1.640 -0.933 8.372) 8.582 5.422 ( -0.340 9.413 -12.391) 15.565 6.494 ( 4.890 3.726 16.893) 17.977 6.601 ( -8.964 0.471 11.020) 14.214 6.670 ( 1.613 -4.240 12.422) 13.224 7.054 ( 3.402 -3.143 1.390) 4.836 7.197 ( -5.794 -9.258 -1.909) 11.087 7.444 ( -3.346 2.229 29.240) 29.515 7.695 ( 7.174 -4.639 5.312) 10.060 7.835 ( -12.962 -0.855 17.388) 21.705 7.909 ( 3.079 -3.210 -19.810) 20.303 8.014 ( -1.801 -3.240 -6.842) 7.782 8.812 ( -0.255 4.307 -18.742) 19.232 8.874 ( 5.034 0.076 -21.213) 21.802 9.228 ( -5.116 -2.493 0.638) 5.726 9.302 ( 9.384 -2.202 0.031) 9.639 9.743 ( 9.246 6.005 10.372) 15.137 10.099 ( -7.793 1.905 -6.818) 10.528 10.512 ( -0.087 -2.964 5.454) 6.208 10.706 ( 0.368 -5.514 -8.639) 10.255 11.164 ( -4.640 6.174 12.962) 15.088 11.370 ( 4.638 8.008 -0.655) 9.277 12.173 ( -1.773 -5.110 7.152) 8.967 12.416 ( 0.278 0.185 -6.943) 6.951 12.495 ( -4.117 1.505 2.106) 4.863 12.736 ( 1.935 -0.244 -8.652) 8.870 13.604 ( 6.223 4.516 0.457) 7.702 13.697 ( -0.730 1.232 -2.707) 3.063 14.456 ( -6.419 -6.242 1.340) 9.054 14.504 ( -0.630 -4.934 1.515) 5.200 14.554 ( 6.528 -3.536 -3.365) 8.151 14.665 ( 0.750 -2.115 -9.424) 9.688 15.706 ( -1.671 1.503 6.084) 6.486 15.797 ( -3.358 1.665 -0.561) 3.790 16.188 ( 4.338 1.474 9.826) 10.842 16.333 ( -3.097 1.284 1.679) 3.750 18.780 ( -7.963 -5.984 32.958) 34.431 19.792 ( -12.040 4.517 25.716) 28.752 20.447 ( 10.826 -3.917 -44.562) 46.025 21.018 ( 13.320 3.614 -31.506) 34.396 24.823 ( -12.767 -0.353 3.502) 13.243 25.002 ( 16.763 -1.006 -5.646) 17.717 25.735 ( -1.379 1.210 16.505) 16.607 26.494 ( 0.144 1.981 -21.977) 22.066 28.956 ( 2.884 -5.629 5.048) 8.092 29.123 ( -2.638 -5.118 -3.432) 6.703 30.099 ( 5.135 5.684 10.658) 13.125 30.567 ( -6.421 9.251 -9.930) 15.014 31.225 ( -0.989 1.490 11.072) 11.216 31.419 ( 7.754 -0.081 5.795) 9.680 31.613 ( -9.288 -0.532 6.813) 11.531 31.833 ( -1.486 -10.744 -7.070) 12.947 ======================= Grid point 291 (154/186) ======================= q-point: (-0.25 -0.62 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.564 ( -1.602 14.817 5.758) 15.978 2.732 ( -4.475 10.718 -4.141) 12.331 3.239 ( -9.575 7.760 10.705) 16.324 3.316 ( -16.248 0.158 5.152) 17.046 3.669 ( -0.446 2.539 13.165) 13.415 4.267 ( -1.316 8.031 9.582) 12.572 4.475 ( 8.691 -15.961 -12.443) 22.025 4.690 ( 6.371 3.515 -8.591) 11.258 5.073 ( 3.575 -4.746 3.964) 7.143 5.248 ( 3.451 10.590 -10.093) 15.031 6.423 ( -16.065 7.184 16.087) 23.843 6.473 ( -10.063 6.053 11.867) 16.695 6.861 ( 8.721 -3.760 9.340) 13.320 7.106 ( -0.941 -1.856 -1.330) 2.470 7.253 ( -5.935 -7.148 5.896) 11.003 7.445 ( -13.725 2.167 29.924) 32.992 7.785 ( -1.487 -3.462 -9.004) 9.760 7.832 ( -0.690 -4.621 -0.489) 4.697 7.994 ( 9.830 -5.763 9.352) 14.741 8.076 ( 2.103 -4.168 -3.279) 5.705 8.652 ( -2.744 2.103 -16.086) 16.453 8.828 ( 7.812 5.660 -16.703) 19.289 9.236 ( -0.927 -3.310 1.389) 3.707 9.448 ( 8.727 -1.442 -3.619) 9.557 9.827 ( 10.356 6.922 9.032) 15.386 9.940 ( -6.340 1.117 -9.336) 11.340 10.605 ( -1.566 -8.220 3.664) 9.135 10.742 ( 0.127 -4.921 -5.165) 7.135 11.032 ( -6.419 9.196 7.194) 13.324 11.310 ( 4.078 7.504 -1.614) 8.692 12.215 ( -10.216 6.189 -1.088) 11.994 12.253 ( -0.633 -4.942 3.786) 6.257 12.611 ( 6.855 -1.134 1.634) 7.137 12.724 ( 3.658 -0.574 -6.900) 7.830 13.628 ( 0.048 1.286 -2.997) 3.262 13.649 ( 2.745 1.946 -0.880) 3.478 14.432 ( -3.528 4.169 4.300) 6.951 14.487 ( -11.512 -11.624 -2.366) 16.530 14.635 ( 7.759 1.859 -1.358) 8.093 14.850 ( 9.753 -11.821 -7.165) 16.917 15.624 ( -8.085 1.402 0.655) 8.232 15.777 ( -0.448 -0.352 4.091) 4.130 16.235 ( -2.032 0.130 4.243) 4.706 16.319 ( 4.627 3.215 3.007) 6.386 18.897 ( -10.209 -3.371 34.894) 36.512 19.701 ( -11.169 4.042 25.245) 27.899 20.459 ( 13.521 -5.276 -42.441) 44.854 20.989 ( 14.109 3.736 -31.825) 35.012 24.683 ( -12.372 -1.508 2.651) 12.743 25.219 ( 17.705 -1.323 -7.385) 19.229 25.803 ( -0.078 -0.329 17.082) 17.085 26.332 ( -2.813 3.470 -19.592) 20.095 29.054 ( -2.369 -4.749 2.650) 5.932 29.225 ( 5.479 -8.326 -1.609) 10.096 30.091 ( 2.122 9.092 8.446) 12.590 30.295 ( -6.426 9.972 -9.616) 15.271 31.230 ( -3.455 1.527 10.178) 10.856 31.528 ( 6.081 0.965 -0.728) 6.200 31.591 ( -3.511 -2.942 13.960) 14.693 31.916 ( -3.824 -10.332 -6.377) 12.729 ======================= Grid point 292 (155/186) ======================= q-point: (-0.12 -0.62 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.344 ( -9.234 8.537 8.592) 15.230 2.537 ( -4.641 4.480 -3.525) 7.351 3.123 ( -0.415 5.255 6.169) 8.114 3.171 ( -10.289 -0.459 5.720) 11.781 3.761 ( -0.257 -4.899 16.287) 17.010 4.204 ( 3.587 8.009 4.785) 9.995 4.705 ( 9.117 1.366 -9.645) 13.342 4.758 ( 10.866 -12.175 -13.023) 20.878 5.138 ( 5.124 7.918 -1.931) 9.627 5.199 ( 3.478 -4.932 0.061) 6.035 6.144 ( -19.887 7.367 11.354) 24.055 6.268 ( -12.949 10.631 14.387) 22.084 6.989 ( 2.373 2.038 0.012) 3.128 7.146 ( 4.075 -2.402 7.727) 9.060 7.253 ( -11.668 -3.085 9.681) 15.472 7.377 ( -12.263 -1.730 19.435) 23.046 7.778 ( -0.757 -2.115 -7.996) 8.306 7.931 ( 0.632 -9.264 -1.118) 9.352 8.106 ( -1.854 -2.575 -4.953) 5.882 8.216 ( 5.133 -0.749 16.858) 17.638 8.578 ( 2.253 -1.886 -9.347) 9.798 8.758 ( 8.795 10.033 -10.495) 16.975 9.302 ( 3.312 -3.355 -0.120) 4.716 9.503 ( 3.043 0.830 -5.234) 6.111 9.790 ( -5.811 -2.628 -12.746) 14.253 9.954 ( 12.023 6.499 8.852) 16.283 10.666 ( -2.052 -3.312 -2.581) 4.673 10.839 ( -0.941 2.164 -3.147) 3.933 10.861 ( -2.791 -2.113 11.120) 11.658 11.249 ( 2.364 4.867 -6.147) 8.189 12.025 ( -6.779 5.894 4.328) 9.971 12.336 ( 1.423 -4.079 2.276) 4.884 12.635 ( 2.497 0.553 -8.104) 8.498 12.813 ( 6.621 -0.339 3.243) 7.380 13.549 ( -4.636 -0.482 -7.826) 9.109 13.695 ( 4.094 0.997 2.357) 4.828 14.348 ( -0.865 5.375 4.154) 6.848 14.502 ( -8.898 -10.565 -2.837) 14.101 14.680 ( 3.477 1.823 -2.988) 4.934 15.077 ( 6.586 -9.224 -3.874) 11.978 15.526 ( -4.793 0.085 -0.329) 4.805 15.799 ( -0.912 -0.919 2.362) 2.693 16.190 ( -5.699 -0.005 1.314) 5.848 16.369 ( 4.145 1.433 5.891) 7.344 18.915 ( -13.855 3.692 36.490) 39.206 19.666 ( -8.083 -0.085 24.704) 25.993 20.528 ( 15.764 -5.995 -40.041) 43.448 20.975 ( 14.560 2.848 -31.952) 35.228 24.592 ( -7.605 -2.208 3.242) 8.557 25.350 ( 5.836 -0.254 -13.423) 14.639 25.896 ( -0.702 -2.003 15.814) 15.956 26.204 ( 4.548 2.328 -13.931) 14.839 29.084 ( -3.459 -3.795 1.673) 5.401 29.395 ( 4.165 -6.035 -1.254) 7.439 29.950 ( -4.151 11.993 0.400) 12.698 30.128 ( 2.487 4.718 -1.636) 5.579 31.201 ( -2.759 2.093 6.993) 7.803 31.574 ( -3.133 -5.030 2.652) 6.493 31.674 ( 4.897 2.668 9.109) 10.680 31.955 ( -6.054 -7.776 -2.107) 10.078 ======================= Grid point 297 (156/186) ======================= q-point: (-0.50 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.809 ( -4.221 -0.000 7.263) 8.401 3.405 ( 2.806 0.000 -19.035) 19.241 3.539 ( -14.879 -0.000 3.363) 15.255 3.542 ( -11.934 -0.000 3.728) 12.503 3.768 ( 5.907 0.000 10.878) 12.379 3.890 ( -2.950 -0.000 7.318) 7.890 4.362 ( -3.039 -0.000 11.252) 11.655 4.843 ( 2.379 0.000 -11.221) 11.470 5.031 ( 3.100 0.000 12.758) 13.130 5.544 ( -8.481 -0.000 -11.725) 14.471 6.515 ( 10.935 0.000 0.111) 10.935 6.554 ( -1.951 -0.000 6.076) 6.382 6.661 ( -7.076 -0.000 35.832) 36.523 6.996 ( -0.012 -0.000 -2.074) 2.074 7.023 ( 3.960 0.000 -8.140) 9.052 7.497 ( -5.434 -0.000 32.465) 32.917 7.621 ( 6.425 0.000 6.623) 9.228 7.847 ( -13.097 -0.000 24.222) 27.536 7.852 ( 8.477 0.000 -23.399) 24.887 7.962 ( -6.941 -0.000 -13.941) 15.574 8.774 ( -3.878 -0.000 -19.981) 20.354 8.960 ( 9.030 0.000 -23.280) 24.970 9.194 ( -5.962 -0.000 -1.793) 6.226 9.258 ( 9.253 0.000 -0.203) 9.255 9.832 ( 10.174 0.000 12.069) 15.786 10.137 ( -7.948 -0.000 -4.712) 9.240 10.498 ( -0.828 -0.000 3.310) 3.412 10.622 ( 1.359 0.000 -6.930) 7.062 11.264 ( -3.918 -0.000 16.262) 16.727 11.490 ( 4.352 0.000 4.712) 6.414 12.076 ( -3.999 -0.000 5.434) 6.747 12.381 ( 8.198 0.000 -5.541) 9.895 12.540 ( -14.819 -0.000 -1.394) 14.884 12.736 ( 6.626 0.000 -8.646) 10.893 13.701 ( 1.629 0.000 0.206) 1.642 13.729 ( 4.549 0.000 -2.632) 5.256 14.296 ( 9.444 0.000 -6.333) 11.371 14.353 ( -12.109 -0.000 -7.116) 14.046 14.572 ( 2.224 0.000 3.570) 4.206 14.666 ( -0.534 -0.000 -3.891) 3.927 15.744 ( -0.420 -0.000 7.277) 7.289 15.820 ( -5.186 -0.000 -0.800) 5.248 16.228 ( 7.874 0.000 10.975) 13.507 16.345 ( -6.221 -0.000 4.196) 7.504 18.686 ( -5.759 -0.000 31.911) 32.427 19.867 ( -11.879 -0.000 26.700) 29.223 20.380 ( 10.009 0.000 -47.002) 48.056 21.072 ( 12.720 0.000 -30.762) 33.288 24.818 ( -14.155 -0.000 3.214) 14.515 24.990 ( 17.388 0.000 -5.763) 18.319 25.752 ( -3.196 -0.000 16.498) 16.805 26.525 ( 2.246 0.000 -22.800) 22.910 28.874 ( 3.998 0.000 5.413) 6.729 29.049 ( -3.918 -0.000 -3.567) 5.298 30.181 ( 5.631 0.000 13.167) 14.320 30.699 ( -8.221 -0.000 -7.350) 11.027 31.312 ( 5.114 0.000 2.804) 5.832 31.351 ( 1.395 0.000 0.460) 1.469 31.603 ( -0.546 -0.000 4.922) 4.952 31.678 ( -8.515 -0.000 4.127) 9.463 ======================= Grid point 298 (157/186) ======================= q-point: (-0.38 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.806 ( 0.310 1.751 7.954) 8.151 3.149 ( -7.314 16.281 -4.685) 18.453 3.307 ( -22.925 0.184 9.919) 24.980 3.429 ( -8.818 4.106 1.850) 9.902 3.840 ( -0.771 7.493 5.541) 9.351 4.015 ( 5.593 -12.604 7.215) 15.563 4.402 ( -1.546 -2.297 7.089) 7.611 4.807 ( 4.163 3.427 -8.795) 10.317 5.054 ( -1.881 4.662 11.267) 12.337 5.374 ( -7.793 -2.466 -11.253) 13.908 6.487 ( -9.087 1.033 -0.834) 9.183 6.636 ( -4.429 3.604 18.519) 19.380 6.732 ( 3.207 -4.695 12.170) 13.433 7.022 ( 2.216 -0.696 -4.553) 5.111 7.094 ( 3.269 -4.261 3.088) 6.195 7.489 ( -16.767 1.170 32.775) 36.833 7.721 ( -6.502 -1.820 -17.140) 18.422 7.785 ( 1.962 -0.516 6.466) 6.777 7.887 ( 12.255 -0.089 6.071) 13.676 7.962 ( 3.917 -4.037 0.385) 5.639 8.628 ( -4.382 -1.633 -22.310) 22.794 8.945 ( 7.097 1.135 -17.477) 18.897 9.166 ( 1.505 -0.523 -2.082) 2.622 9.399 ( 10.681 -1.700 -2.873) 11.191 9.970 ( -4.104 3.766 -1.761) 5.841 10.028 ( 7.816 1.880 5.255) 9.605 10.478 ( -4.085 -0.766 3.005) 5.129 10.627 ( 0.888 -2.742 -6.066) 6.716 11.237 ( -6.644 5.035 13.793) 16.116 11.508 ( 2.127 4.573 1.087) 5.159 12.089 ( -3.313 -4.960 4.215) 7.304 12.338 ( -11.595 2.881 1.264) 12.014 12.523 ( 10.722 -3.629 -1.470) 11.415 12.760 ( 4.636 1.532 -7.915) 9.300 13.696 ( 1.052 2.852 -2.943) 4.231 13.743 ( 4.314 3.475 -2.896) 6.251 14.187 ( -13.913 -6.995 -6.073) 16.714 14.424 ( 2.283 -5.654 -0.146) 6.100 14.644 ( 7.949 0.793 0.615) 8.012 14.679 ( 6.489 -1.023 -4.121) 7.755 15.689 ( -9.032 2.890 1.547) 9.609 15.764 ( -3.998 -1.007 5.576) 6.935 16.286 ( -2.086 2.194 3.151) 4.369 16.398 ( 10.356 1.576 7.732) 13.020 18.794 ( -5.300 -2.705 33.596) 34.119 19.820 ( -11.734 3.216 26.432) 29.097 20.322 ( 12.148 -3.536 -46.264) 47.963 21.073 ( 12.488 1.802 -30.802) 33.286 24.651 ( -13.574 -0.653 2.410) 13.801 25.200 ( 18.577 -0.247 -6.713) 19.754 25.792 ( -3.658 -0.317 17.337) 17.722 26.415 ( -0.533 1.934 -21.290) 21.384 28.971 ( 2.513 -0.967 2.949) 3.994 29.032 ( 2.253 -4.815 -1.539) 5.534 30.269 ( 2.072 3.524 12.628) 13.273 30.511 ( -9.565 4.561 -9.801) 14.434 31.263 ( -3.420 2.820 3.419) 5.598 31.436 ( -1.955 -6.104 -3.016) 7.084 31.597 ( -1.872 0.076 4.665) 5.027 31.720 ( 5.336 -2.343 8.926) 10.660 ======================= Grid point 299 (158/186) ======================= q-point: (-0.25 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.719 ( -11.491 14.491 4.449) 19.022 2.847 ( -1.157 12.970 0.582) 13.034 3.092 ( -20.838 -2.553 11.959) 24.161 3.250 ( -8.150 5.129 10.488) 14.238 3.737 ( -4.804 3.991 7.181) 9.516 4.286 ( 1.742 -11.494 8.670) 14.502 4.440 ( 6.973 0.672 -0.847) 7.056 4.792 ( 7.005 3.341 -7.192) 10.581 5.059 ( 0.541 -3.567 1.015) 3.748 5.300 ( -3.975 -1.586 -5.112) 6.667 6.297 ( -13.684 4.614 0.078) 14.441 6.517 ( -13.222 6.938 16.822) 22.493 6.936 ( 7.125 -5.787 4.058) 10.036 7.038 ( 1.535 -3.325 -5.992) 7.023 7.157 ( -5.033 -1.375 9.005) 10.407 7.386 ( -20.227 1.564 33.093) 38.816 7.673 ( -0.643 -6.908 -5.266) 8.710 7.791 ( 2.029 1.163 -5.800) 6.253 7.998 ( 1.979 -4.652 -9.099) 10.409 8.201 ( 12.531 -0.332 20.977) 24.437 8.520 ( -0.713 -2.330 -16.503) 16.682 8.965 ( 10.444 1.791 -14.702) 18.123 9.207 ( 4.363 -1.154 -2.091) 4.974 9.499 ( 3.735 -1.414 -7.836) 8.795 9.803 ( -6.163 3.405 -5.996) 9.248 10.150 ( 11.861 6.285 6.845) 15.068 10.489 ( -2.584 -5.881 2.256) 6.808 10.660 ( 0.491 -4.678 -3.562) 5.901 11.097 ( -7.898 8.210 7.353) 13.559 11.455 ( 2.003 7.258 0.183) 7.532 12.125 ( -6.147 -2.654 2.363) 7.100 12.212 ( -3.348 -0.256 5.464) 6.414 12.673 ( 6.406 0.133 -8.293) 10.479 12.778 ( 6.410 -0.704 2.148) 6.797 13.602 ( -2.973 4.468 -7.714) 9.398 13.748 ( 4.523 2.661 -1.015) 5.345 14.149 ( -11.189 -12.508 -1.271) 16.830 14.442 ( -3.592 0.356 2.139) 4.196 14.762 ( 9.110 1.981 -1.178) 9.397 14.824 ( 11.458 -7.166 -5.788) 14.702 15.541 ( -8.250 1.620 0.479) 8.422 15.757 ( -4.085 -1.534 5.860) 7.306 16.237 ( -2.533 2.437 1.414) 3.789 16.508 ( 9.973 6.624 5.409) 13.138 18.924 ( -6.331 -1.917 35.933) 36.537 19.742 ( -10.753 4.532 25.560) 28.098 20.345 ( 14.253 -6.518 -44.150) 46.849 21.054 ( 12.588 2.463 -31.094) 33.636 24.535 ( -8.791 -1.729 3.322) 9.555 25.353 ( 9.504 0.403 -11.222) 14.711 25.836 ( -4.438 -2.069 16.312) 17.031 26.291 ( 3.105 3.354 -15.873) 16.518 28.994 ( 0.007 -2.245 -0.880) 2.412 29.203 ( 7.619 -6.911 1.689) 10.424 30.241 ( -6.586 8.201 -1.759) 10.665 30.271 ( -4.117 4.917 0.675) 6.448 31.220 ( -5.867 -1.135 7.233) 9.382 31.422 ( -6.776 -2.709 2.525) 7.722 31.657 ( 0.120 -7.225 -1.861) 7.462 31.867 ( 10.671 2.991 8.610) 14.034 ======================= Grid point 300 (159/186) ======================= q-point: (-0.12 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.338 ( -18.259 11.092 8.121) 22.856 2.636 ( 0.799 15.274 -1.451) 15.363 2.981 ( -14.199 -5.981 12.101) 19.591 3.212 ( -1.824 0.982 9.126) 9.358 3.725 ( -5.098 -4.605 11.835) 13.684 4.386 ( 4.077 4.215 7.820) 9.775 4.643 ( 10.995 -12.726 -9.544) 19.337 4.817 ( 6.915 2.598 -5.201) 9.035 5.137 ( -0.146 -5.493 -2.600) 6.079 5.251 ( -1.795 -0.407 -2.461) 3.073 6.042 ( -14.027 7.344 5.260) 16.684 6.304 ( -12.171 8.793 11.439) 18.876 7.007 ( -2.108 -0.232 0.887) 2.299 7.105 ( -3.337 -4.239 -2.324) 5.874 7.187 ( -3.314 -6.083 14.178) 15.780 7.280 ( -10.115 1.752 21.846) 24.137 7.744 ( 0.803 -0.222 -7.804) 7.849 7.811 ( -0.800 -8.488 4.235) 9.519 8.017 ( -1.017 -2.333 -2.874) 3.839 8.338 ( 0.559 2.020 6.581) 6.906 8.569 ( 7.807 -2.762 -1.347) 8.390 8.987 ( 12.560 8.070 -12.229) 19.299 9.284 ( 3.579 -3.830 -1.760) 5.530 9.458 ( -4.619 -1.356 -8.649) 9.898 9.694 ( -1.435 1.998 -5.232) 5.781 10.220 ( 8.880 6.791 3.530) 11.723 10.573 ( 1.176 -7.128 -2.527) 7.654 10.759 ( 1.772 -8.376 1.499) 8.691 10.910 ( -6.876 8.128 4.016) 11.378 11.355 ( 1.228 9.437 -2.920) 9.954 12.057 ( -3.342 3.803 8.065) 9.523 12.280 ( 0.470 -6.176 1.081) 6.287 12.647 ( 1.859 2.100 -7.797) 8.286 12.912 ( 6.589 -0.956 4.199) 7.871 13.458 ( -4.848 2.263 -9.281) 10.712 13.769 ( 3.268 1.584 0.405) 3.654 14.203 ( -8.725 -12.822 2.003) 15.638 14.395 ( -2.231 1.755 2.718) 3.930 14.793 ( 6.388 5.916 -6.140) 10.653 15.032 ( 7.791 -7.067 -3.955) 11.237 15.473 ( -1.929 -1.255 0.647) 2.390 15.758 ( -3.418 -2.212 3.276) 5.225 16.170 ( -3.458 2.698 2.393) 4.996 16.521 ( 5.834 8.683 3.498) 11.030 18.994 ( -9.482 3.584 37.230) 38.585 19.691 ( -8.474 1.820 25.034) 26.492 20.434 ( 15.915 -8.019 -42.131) 45.746 21.031 ( 12.183 2.206 -31.663) 33.998 24.516 ( -1.996 -2.650 5.216) 6.182 25.284 ( -6.204 2.001 -16.092) 17.362 25.881 ( -6.914 -3.553 14.644) 16.580 26.301 ( 13.886 2.161 -10.551) 17.573 29.031 ( 0.929 -2.138 -0.011) 2.331 29.377 ( 4.732 -4.357 0.140) 6.434 29.997 ( -7.191 6.807 -6.044) 11.601 30.206 ( -0.746 3.651 3.932) 5.417 31.204 ( -5.086 -1.583 7.156) 8.921 31.390 ( -8.528 -3.658 5.980) 11.039 31.747 ( -2.708 -8.406 0.093) 8.832 31.974 ( 12.868 7.877 3.851) 15.571 ======================= Grid point 306 (160/186) ======================= q-point: (-0.38 -0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.873 ( 2.331 0.000 9.813) 10.086 3.032 ( -24.171 -0.000 13.738) 27.802 3.141 ( -22.989 -0.000 13.331) 26.574 3.352 ( 2.595 0.000 -15.612) 15.826 3.897 ( -5.004 -0.000 5.719) 7.600 4.084 ( 3.973 0.000 18.806) 19.221 4.379 ( -0.156 -0.000 6.367) 6.369 4.847 ( 4.740 0.000 -7.632) 8.984 5.102 ( -13.298 -0.000 -13.670) 19.071 5.123 ( -5.257 -0.000 12.335) 13.409 6.389 ( -6.463 -0.000 -3.650) 7.423 6.634 ( -13.315 -0.000 19.644) 23.731 6.794 ( 5.330 0.000 2.968) 6.100 7.002 ( 0.305 0.000 -12.265) 12.268 7.165 ( 2.442 0.000 14.631) 14.834 7.426 ( -18.229 -0.000 36.694) 40.973 7.540 ( -2.444 -0.000 -17.721) 17.889 7.860 ( 1.223 0.000 -22.348) 22.381 7.888 ( 3.976 0.000 11.365) 12.040 8.199 ( 16.379 0.000 23.002) 28.237 8.477 ( -1.066 -0.000 -21.265) 21.292 8.936 ( 3.826 0.000 -10.089) 10.790 9.224 ( 9.857 0.000 -8.106) 12.763 9.468 ( 4.288 0.000 -8.305) 9.347 9.875 ( -5.782 -0.000 -4.838) 7.539 10.226 ( 10.281 0.000 6.649) 12.244 10.432 ( -4.407 -0.000 4.264) 6.132 10.590 ( 0.975 0.000 -5.610) 5.694 11.239 ( -9.239 -0.000 12.302) 15.385 11.547 ( 0.390 0.000 -1.971) 2.010 12.038 ( -1.206 -0.000 3.158) 3.380 12.251 ( -8.830 -0.000 8.967) 12.585 12.633 ( 12.474 0.000 -7.831) 14.729 12.794 ( 3.191 0.000 -2.497) 4.052 13.738 ( 3.329 0.000 -4.178) 5.342 13.794 ( 2.205 0.000 -4.397) 4.919 13.908 ( -14.562 -0.000 -6.314) 15.872 14.407 ( -0.783 -0.000 2.323) 2.452 14.740 ( 10.245 0.000 -6.034) 11.890 14.785 ( 10.185 0.000 1.879) 10.357 15.583 ( -10.127 -0.000 0.308) 10.131 15.728 ( -5.032 -0.000 6.659) 8.346 16.277 ( -2.182 -0.000 0.392) 2.217 16.619 ( 13.749 0.000 8.102) 15.958 18.886 ( -3.578 -0.000 35.528) 35.708 19.824 ( -11.289 -0.000 27.018) 29.282 20.237 ( 13.912 0.000 -47.211) 49.218 21.091 ( 11.549 0.000 -30.680) 32.782 24.509 ( -9.450 -0.000 3.495) 10.075 25.361 ( 11.438 0.000 -11.070) 15.918 25.803 ( -6.845 -0.000 17.446) 18.741 26.345 ( 3.272 0.000 -17.441) 17.745 28.968 ( 0.831 0.000 -3.906) 3.994 29.089 ( 8.151 0.000 4.935) 9.529 30.352 ( -2.612 -0.000 12.459) 12.730 30.355 ( -11.475 -0.000 -12.209) 16.755 31.201 ( -9.025 -0.000 0.030) 9.025 31.379 ( -0.080 -0.000 2.762) 2.763 31.542 ( -4.203 -0.000 2.284) 4.783 31.918 ( 14.304 0.000 10.338) 17.649 ======================= Grid point 307 (161/186) ======================= q-point: (-0.25 -0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.722 ( -22.918 12.107 11.290) 28.272 2.854 ( -20.761 -2.237 17.186) 27.044 3.002 ( 1.622 2.557 11.284) 11.683 3.277 ( -2.011 5.406 -7.205) 9.229 3.751 ( -8.834 8.021 8.611) 14.715 4.223 ( -2.087 -6.771 17.175) 18.579 4.523 ( 8.727 -5.486 5.875) 11.865 4.854 ( 2.318 0.202 -7.985) 8.317 4.950 ( -5.630 -7.598 -10.715) 14.291 5.116 ( -7.838 -3.103 4.497) 9.554 6.264 ( -5.014 7.206 0.816) 8.817 6.498 ( -13.126 5.340 12.610) 18.969 6.833 ( -8.276 -8.534 -3.154) 12.299 7.027 ( 7.979 -3.240 -4.850) 9.884 7.164 ( -12.354 2.962 21.784) 25.217 7.369 ( -4.145 5.536 14.995) 16.512 7.576 ( 2.204 -8.072 4.717) 9.605 7.742 ( -2.340 -0.574 -20.612) 20.753 7.984 ( 0.969 0.037 11.036) 11.079 8.382 ( 1.405 0.498 -12.034) 12.126 8.508 ( 13.599 -0.838 11.367) 17.744 8.990 ( 7.085 -3.897 -7.393) 10.956 9.303 ( 10.422 2.609 -8.957) 13.988 9.417 ( -4.726 -1.201 -10.113) 11.227 9.786 ( -2.645 2.974 -3.408) 5.239 10.351 ( 6.832 0.448 3.681) 7.774 10.417 ( -2.036 -1.022 2.753) 3.573 10.605 ( 2.712 -2.686 -4.549) 5.938 11.120 ( -9.054 5.772 7.287) 12.976 11.529 ( 0.686 1.785 -3.057) 3.606 12.073 ( 0.885 -1.562 4.697) 5.029 12.202 ( -4.569 0.815 9.499) 10.572 12.691 ( 3.558 0.307 -13.281) 13.753 12.869 ( 7.044 -1.101 4.480) 8.421 13.593 ( -7.006 7.166 -6.926) 12.182 13.811 ( 3.129 0.900 -3.572) 4.833 13.875 ( -3.886 -10.421 -1.837) 11.272 14.399 ( -3.625 -0.857 2.746) 4.628 14.861 ( 9.387 -1.321 -5.792) 11.109 14.924 ( 11.940 0.286 -0.795) 11.970 15.472 ( -5.807 0.861 2.287) 6.300 15.703 ( -4.585 -1.435 4.700) 6.721 16.236 ( -2.695 1.531 -0.076) 3.101 16.777 ( 12.402 6.794 4.373) 14.802 19.023 ( -3.715 -0.250 37.488) 37.673 19.787 ( -10.236 3.438 25.826) 27.992 20.237 ( 15.387 -5.068 -45.550) 48.345 21.078 ( 10.769 0.996 -31.098) 32.925 24.458 ( -3.099 -1.256 5.801) 6.696 25.335 ( -4.080 1.321 -16.282) 16.838 25.795 ( -9.091 -2.085 16.394) 18.862 26.365 ( 12.728 1.786 -11.434) 17.203 28.985 ( 3.320 -0.924 -2.845) 4.469 29.245 ( 8.339 -3.687 3.318) 9.703 30.119 ( -12.068 2.437 -13.379) 18.182 30.323 ( -6.699 2.927 9.786) 12.215 31.112 ( -9.430 -2.631 5.864) 11.412 31.385 ( -1.498 0.879 4.623) 4.939 31.549 ( -1.610 -4.575 1.965) 5.233 32.133 ( 15.990 3.149 5.556) 17.218 ======================= Grid point 308 (162/186) ======================= q-point: (-0.12 -0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.301 ( -21.299 12.801 14.663) 28.853 2.766 ( -16.216 -7.136 18.198) 25.397 2.905 ( 2.829 18.341 -1.818) 18.646 3.200 ( -3.523 -2.270 4.593) 6.218 3.646 ( -7.342 -1.162 10.888) 13.184 4.409 ( 0.589 -10.382 12.937) 16.598 4.690 ( 11.313 2.304 -4.908) 12.546 4.827 ( -4.601 -2.063 -5.976) 7.819 5.018 ( -9.242 -17.267 -1.000) 19.610 5.091 ( 3.151 0.147 -2.129) 3.805 6.074 ( -7.069 10.665 7.929) 15.053 6.325 ( -7.044 6.681 6.819) 11.864 6.844 ( -8.463 -11.024 -2.218) 14.074 7.032 ( -17.794 1.918 25.440) 31.104 7.174 ( 7.389 -1.690 -0.688) 7.611 7.348 ( 4.155 2.336 1.942) 5.147 7.644 ( -2.637 -3.475 -14.637) 15.274 7.761 ( 0.740 -6.444 16.536) 17.762 8.019 ( -1.201 1.176 9.696) 9.841 8.335 ( -0.322 -0.004 -9.432) 9.438 8.673 ( 6.741 1.581 3.528) 7.771 9.119 ( 9.245 -2.740 -8.381) 12.776 9.273 ( -3.501 0.665 -4.725) 5.918 9.385 ( 4.880 1.465 -6.019) 7.886 9.686 ( -3.693 2.978 -3.026) 5.627 10.369 ( 0.694 4.301 -1.414) 4.580 10.488 ( 3.654 -7.168 -1.279) 8.147 10.694 ( 3.711 -6.008 -1.494) 7.218 10.956 ( -5.594 7.865 4.464) 10.634 11.471 ( 0.774 6.359 -3.426) 7.264 12.116 ( 0.324 1.509 8.322) 8.464 12.217 ( -0.169 -3.534 1.881) 4.007 12.641 ( -0.957 0.854 -7.565) 7.673 12.986 ( 5.306 -1.108 1.048) 5.520 13.401 ( -5.433 4.152 -5.326) 8.667 13.815 ( 1.278 0.848 -0.834) 1.746 13.987 ( -0.817 -10.094 0.102) 10.128 14.374 ( -3.407 -0.719 2.865) 4.510 14.904 ( 5.315 3.612 -7.912) 10.193 15.075 ( 9.881 -1.143 -1.575) 10.071 15.459 ( 1.313 -1.224 3.196) 3.666 15.699 ( -2.772 -2.393 2.535) 4.453 16.171 ( -3.483 2.251 0.980) 4.261 16.777 ( 7.524 13.315 0.790) 15.314 19.118 ( -7.068 3.599 37.404) 38.236 19.734 ( -8.926 3.206 24.698) 26.456 20.325 ( 16.562 -8.162 -43.154) 46.938 21.044 ( 9.948 1.338 -31.949) 33.488 24.522 ( 3.628 -2.581 8.277) 9.398 25.119 ( -11.419 2.110 -15.485) 19.355 25.778 ( -11.594 -3.530 14.769) 19.105 26.479 ( 15.734 2.191 -10.388) 18.981 29.045 ( 5.113 -1.067 -1.421) 5.413 29.399 ( 5.271 -2.329 1.188) 5.884 29.902 ( -8.334 -0.009 -9.693) 12.783 30.220 ( -7.558 2.361 5.148) 9.445 31.080 ( -9.156 -4.570 8.667) 13.410 31.372 ( -1.914 1.705 7.039) 7.491 31.616 ( -1.622 -5.684 3.281) 6.760 32.275 ( 15.014 7.294 -0.535) 16.700 ======================= Grid point 315 (163/186) ======================= q-point: (-0.25 -0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.600 ( -23.096 -0.000 22.727) 32.403 2.616 ( -24.915 -0.000 16.847) 30.076 3.068 ( -1.831 -0.000 10.154) 10.317 3.253 ( 0.814 0.000 -15.153) 15.175 3.795 ( -7.403 -0.000 16.252) 17.858 4.211 ( -3.457 -0.000 17.651) 17.987 4.551 ( -1.414 -0.000 9.211) 9.319 4.777 ( 3.890 0.000 -8.151) 9.032 4.788 ( -7.788 -0.000 -8.658) 11.646 5.109 ( 4.320 0.000 -0.681) 4.373 6.314 ( -2.673 -0.000 7.980) 8.416 6.453 ( -10.555 -0.000 13.314) 16.990 6.586 ( -9.793 -0.000 -10.622) 14.448 7.076 ( 6.131 0.000 -3.612) 7.116 7.086 ( -20.968 -0.000 32.652) 38.805 7.493 ( 7.753 0.000 -16.801) 18.504 7.585 ( -4.187 -0.000 -15.373) 15.933 7.593 ( 4.308 0.000 20.867) 21.307 8.053 ( -3.450 -0.000 18.941) 19.253 8.320 ( 1.697 0.000 -16.185) 16.274 8.726 ( 9.678 0.000 6.808) 11.833 9.019 ( 7.071 0.000 -4.616) 8.444 9.287 ( -6.896 -0.000 -4.642) 8.313 9.423 ( 11.037 0.000 -10.474) 15.216 9.744 ( -4.737 -0.000 -3.137) 5.682 10.363 ( -0.837 -0.000 -1.774) 1.961 10.450 ( 0.541 0.000 6.451) 6.474 10.613 ( 5.603 0.000 -8.316) 10.028 11.093 ( -6.778 -0.000 7.810) 10.341 11.522 ( 1.820 0.000 -8.032) 8.236 12.123 ( 3.014 0.000 5.196) 6.007 12.203 ( -4.174 -0.000 11.297) 12.044 12.647 ( -0.203 -0.000 -13.579) 13.580 12.964 ( 6.421 0.000 1.419) 6.576 13.503 ( -11.146 -0.000 1.480) 11.244 13.803 ( 6.070 0.000 -8.080) 10.106 13.827 ( 1.269 0.000 -2.633) 2.923 14.359 ( -4.128 -0.000 3.937) 5.704 14.940 ( 7.651 0.000 -5.752) 9.572 15.068 ( 11.369 0.000 -2.639) 11.671 15.455 ( -0.551 -0.000 6.485) 6.509 15.657 ( -3.262 -0.000 2.051) 3.853 16.206 ( -3.345 -0.000 -0.650) 3.408 16.998 ( 11.445 0.000 -0.458) 11.454 19.160 ( -3.916 -0.000 38.048) 38.249 19.811 ( -9.723 -0.000 25.734) 27.509 20.183 ( 16.722 0.000 -46.102) 49.041 21.064 ( 9.470 0.000 -31.561) 32.951 24.482 ( 2.879 0.000 8.949) 9.401 25.153 ( -11.881 -0.000 -16.285) 20.159 25.723 ( -11.740 -0.000 16.192) 20.000 26.518 ( 15.712 0.000 -10.530) 18.914 29.027 ( 6.339 0.000 -2.696) 6.888 29.340 ( 7.926 0.000 2.664) 8.361 29.906 ( -12.632 -0.000 -12.908) 18.060 30.265 ( -11.342 -0.000 7.591) 13.648 31.014 ( -8.096 -0.000 8.618) 11.824 31.387 ( -3.624 -0.000 5.194) 6.333 31.543 ( 2.947 0.000 4.594) 5.458 32.379 ( 16.008 0.000 0.470) 16.015 ======================= Grid point 316 (164/186) ======================= q-point: (-0.12 -0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.281 ( -20.221 10.526 20.459) 30.631 2.532 ( -18.762 -8.464 22.273) 30.327 3.057 ( -5.422 -0.349 2.762) 6.095 3.148 ( -0.717 4.809 -11.902) 12.857 3.698 ( -3.440 11.019 17.025) 20.569 4.327 ( -2.790 -8.845 12.559) 15.613 4.649 ( -9.702 -3.696 -4.377) 11.267 4.672 ( -3.401 -14.951 0.270) 15.335 4.861 ( 9.643 1.529 3.634) 10.418 5.166 ( 7.044 1.425 -4.273) 8.361 6.171 ( -9.213 10.207 11.580) 17.976 6.397 ( 0.103 5.966 5.631) 8.204 6.546 ( -9.106 -12.099 -3.343) 15.507 6.957 ( -18.394 1.851 31.545) 36.563 7.189 ( 3.372 -9.164 -2.442) 10.065 7.401 ( 1.856 3.835 -17.508) 18.018 7.579 ( 6.538 0.820 -2.693) 7.119 7.789 ( 3.488 -5.199 17.270) 18.370 8.064 ( -7.355 1.549 20.397) 21.738 8.276 ( 1.192 -0.684 -13.092) 13.164 8.774 ( 2.149 4.073 -4.406) 6.373 9.119 ( 5.427 -4.558 -4.768) 8.542 9.202 ( -5.720 0.010 2.895) 6.411 9.484 ( 8.596 2.252 -10.223) 13.546 9.650 ( -5.386 2.191 -1.653) 6.045 10.341 ( -1.930 -1.449 -5.950) 6.421 10.485 ( 1.263 -1.003 4.351) 4.640 10.660 ( 3.985 -3.454 -7.675) 9.312 11.032 ( -1.812 5.811 6.706) 9.057 11.506 ( 2.128 0.998 -8.826) 9.134 12.174 ( 1.142 0.395 6.347) 6.461 12.194 ( -3.068 -0.213 4.584) 5.520 12.572 ( -3.011 -0.531 -9.592) 10.068 13.030 ( 3.762 -0.026 -3.331) 5.025 13.395 ( -3.268 3.476 5.240) 7.087 13.828 ( 0.294 0.316 0.510) 0.668 13.888 ( 4.870 -6.518 -7.854) 11.309 14.336 ( -2.993 -0.810 4.168) 5.195 14.975 ( 4.915 2.552 -5.921) 8.107 15.191 ( 9.485 0.164 -2.764) 9.881 15.510 ( 3.457 0.470 6.995) 7.817 15.650 ( -0.920 -2.386 0.574) 2.621 16.151 ( -3.451 1.172 0.407) 3.667 17.031 ( 6.371 10.098 -5.246) 13.042 19.248 ( -8.276 2.881 36.119) 37.167 19.776 ( -10.259 3.168 23.742) 26.057 20.234 ( 17.619 -6.037 -43.511) 47.330 21.023 ( 8.879 0.669 -32.317) 33.521 24.612 ( 7.426 -1.766 11.317) 13.651 24.936 ( -8.871 0.877 -11.097) 14.234 25.652 ( -12.942 -1.760 14.955) 19.856 26.630 ( 11.382 1.601 -12.692) 17.123 29.118 ( 8.944 -0.253 -1.798) 9.126 29.453 ( 5.358 -0.791 1.096) 5.526 29.722 ( -8.314 -2.780 -8.833) 12.445 30.128 ( -12.967 0.456 4.329) 13.679 30.982 ( -6.355 -1.862 10.524) 12.434 31.363 ( -4.583 -1.140 4.898) 6.804 31.624 ( 3.950 0.073 7.766) 8.713 32.524 ( 12.632 4.441 -5.363) 14.424 ======================= Grid point 324 (165/186) ======================= q-point: (-0.12 -0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.249 ( -16.731 -0.000 23.213) 28.614 2.331 ( -12.344 -0.000 21.499) 24.791 2.930 ( -10.602 -0.000 0.140) 10.603 3.117 ( 0.749 0.000 -16.018) 16.035 3.893 ( -2.387 -0.000 21.616) 21.748 4.213 ( -3.910 -0.000 0.385) 3.929 4.491 ( -4.953 -0.000 -4.573) 6.741 4.619 ( 1.877 0.000 14.455) 14.576 4.994 ( 5.417 0.000 5.829) 7.957 5.248 ( 8.014 0.000 -7.381) 10.895 6.186 ( -13.444 -0.000 18.725) 23.051 6.341 ( 0.335 0.000 -10.473) 10.478 6.483 ( -1.594 -0.000 6.107) 6.311 6.918 ( -15.524 -0.000 37.349) 40.447 7.041 ( -2.405 -0.000 -16.516) 16.690 7.438 ( 7.042 0.000 -0.109) 7.043 7.697 ( 10.908 0.000 -6.858) 12.885 7.875 ( 3.986 0.000 14.578) 15.114 8.053 ( -13.194 -0.000 26.094) 29.240 8.237 ( 2.265 0.000 -10.265) 10.512 8.773 ( -2.096 -0.000 -9.432) 9.662 9.110 ( 1.619 0.000 -4.566) 4.844 9.158 ( -4.527 -0.000 6.053) 7.558 9.543 ( 6.671 0.000 -11.914) 13.654 9.599 ( -4.552 -0.000 0.386) 4.569 10.276 ( -1.025 -0.000 -8.441) 8.503 10.500 ( -1.912 -0.000 6.812) 7.075 10.634 ( 3.175 0.000 -10.675) 11.137 11.105 ( 0.894 0.000 6.359) 6.421 11.497 ( 4.060 0.000 -12.993) 13.613 12.136 ( -8.317 -0.000 3.149) 8.893 12.231 ( 2.034 0.000 8.395) 8.638 12.481 ( -3.337 -0.000 -8.822) 9.432 13.047 ( 2.593 0.000 -8.106) 8.511 13.456 ( 2.007 0.000 10.666) 10.853 13.840 ( 0.189 0.000 2.745) 2.752 13.851 ( 3.912 0.000 -11.295) 11.953 14.325 ( -0.228 -0.000 3.094) 3.102 15.033 ( 4.017 0.000 -2.614) 4.793 15.288 ( 8.144 0.000 -3.910) 9.034 15.600 ( 1.689 0.000 8.880) 9.039 15.620 ( 0.833 0.000 -2.641) 2.769 16.134 ( -0.984 -0.000 2.811) 2.978 17.116 ( 1.060 0.000 -11.115) 11.165 19.296 ( -14.429 -0.000 33.373) 36.359 19.759 ( -13.426 -0.000 23.384) 26.964 20.221 ( 19.783 0.000 -42.582) 46.953 20.986 ( 8.988 0.000 -32.738) 33.949 24.757 ( 7.268 0.000 12.777) 14.699 24.852 ( 2.148 0.000 -5.896) 6.275 25.555 ( -11.090 -0.000 15.054) 18.698 26.671 ( 3.805 0.000 -16.063) 16.507 29.249 ( 12.744 0.000 -1.501) 12.832 29.519 ( 4.734 0.000 0.082) 4.735 29.570 ( -6.029 -0.000 -4.801) 7.707 29.962 ( -15.438 -0.000 2.854) 15.699 30.960 ( -3.473 -0.000 11.128) 11.657 31.309 ( -4.728 -0.000 2.964) 5.580 31.736 ( 4.733 0.000 11.484) 12.421 32.645 ( 6.669 0.000 -9.826) 11.875 ======================= Grid point 325 (166/186) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 93 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.556 ( 6.054 0.000 -5.444) 8.142 2.556 ( -6.054 -0.000 5.444) 8.142 2.698 ( 3.158 0.000 -9.041) 9.577 2.698 ( -3.158 -0.000 9.041) 9.577 4.066 ( 2.827 0.000 -6.153) 6.772 4.066 ( -2.827 -0.000 6.153) 6.772 4.735 ( -5.316 -0.000 -4.693) 7.091 4.735 ( 5.316 0.000 4.693) 7.091 5.197 ( 9.717 0.000 -10.569) 14.357 5.197 ( -9.717 -0.000 10.569) 14.357 6.262 ( 15.476 0.000 -10.687) 18.807 6.262 ( -15.476 -0.000 10.687) 18.807 6.590 ( 4.226 0.000 -12.042) 12.762 6.590 ( -4.226 -0.000 12.042) 12.762 7.525 ( 5.228 0.000 -16.042) 16.872 7.525 ( -5.228 -0.000 16.042) 16.872 8.036 ( -14.127 -0.000 -6.378) 15.500 8.036 ( 14.127 0.000 6.378) 15.500 8.303 ( -9.513 -0.000 2.172) 9.758 8.303 ( 9.513 0.000 -2.172) 9.758 8.625 ( -3.050 -0.000 -21.239) 21.457 8.625 ( 3.050 0.000 21.239) 21.457 9.324 ( 2.748 0.000 -9.303) 9.701 9.324 ( -2.748 -0.000 9.303) 9.701 9.819 ( -1.281 -0.000 -16.785) 16.834 9.819 ( 1.281 0.000 16.785) 16.834 10.567 ( -3.920 -0.000 1.244) 4.112 10.567 ( 3.920 0.000 -1.244) 4.112 11.202 ( 4.082 0.000 -10.158) 10.947 11.202 ( -4.082 -0.000 10.158) 10.947 12.194 ( 6.565 0.000 -13.098) 14.651 12.194 ( -6.565 -0.000 13.098) 14.651 12.657 ( -5.248 -0.000 -12.865) 13.894 12.657 ( 5.248 0.000 12.865) 13.894 13.648 ( -1.269 -0.000 -3.504) 3.727 13.648 ( 1.269 0.000 3.504) 3.727 14.200 ( 0.324 0.000 -12.471) 12.475 14.200 ( -0.324 -0.000 12.471) 12.475 15.241 ( 0.696 0.000 -8.459) 8.487 15.241 ( -0.696 -0.000 8.459) 8.487 15.613 ( 6.936 0.000 -2.457) 7.358 15.613 ( -6.936 -0.000 2.457) 7.358 16.562 ( -9.229 -0.000 -14.129) 16.876 16.562 ( 9.229 0.000 14.129) 16.876 19.679 ( 27.327 0.000 -35.601) 44.879 19.679 ( -27.327 -0.000 35.601) 44.879 20.271 ( 10.281 0.000 -31.733) 33.357 20.271 ( -10.281 -0.000 31.733) 33.357 24.990 ( 13.903 0.000 -7.328) 15.716 24.990 ( -13.903 -0.000 7.328) 15.716 26.026 ( -6.402 -0.000 -20.318) 21.302 26.026 ( 6.402 0.000 20.318) 21.302 29.520 ( 0.294 0.000 -3.198) 3.211 29.520 ( -0.294 -0.000 3.198) 3.211 29.599 ( -16.371 -0.000 1.779) 16.468 29.599 ( 16.371 0.000 -1.779) 16.468 31.192 ( -2.653 -0.000 -4.337) 5.084 31.192 ( 2.653 0.000 4.337) 5.084 32.256 ( -4.522 -0.000 -14.282) 14.981 32.256 ( 4.522 0.000 14.282) 14.981 ======================= Grid point 327 (167/186) ======================= q-point: ( 0.12 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.505 ( 1.249 3.417 -9.198) 9.891 2.612 ( 4.391 -0.189 -0.543) 4.429 2.766 ( 3.775 -4.511 5.609) 8.128 2.819 ( 11.316 -6.901 -1.973) 13.400 4.025 ( -0.336 5.143 -4.613) 6.917 4.108 ( 3.428 -0.641 6.309) 7.209 4.602 ( -5.527 1.937 -2.228) 6.266 4.770 ( 4.319 4.817 3.085) 7.167 5.152 ( -6.465 -2.064 2.298) 7.165 5.249 ( 3.355 -0.518 -9.585) 10.168 6.170 ( -10.580 -5.570 11.933) 16.893 6.318 ( 6.412 6.116 -3.587) 9.560 6.612 ( 2.724 -3.680 -9.305) 10.370 6.765 ( 6.685 -12.720 5.157) 15.267 7.500 ( 1.279 0.106 -16.219) 16.269 7.549 ( -5.300 -4.047 11.468) 13.266 7.808 ( -12.647 1.513 -8.650) 15.397 8.129 ( -4.391 5.211 0.499) 6.833 8.232 ( 4.662 0.100 4.022) 6.158 8.371 ( 7.211 -0.273 -14.243) 15.967 8.511 ( -0.614 3.144 -5.143) 6.060 8.762 ( -0.401 0.121 26.002) 26.005 9.319 ( 3.361 1.187 -5.962) 6.946 9.349 ( 1.953 -0.662 1.595) 2.607 9.726 ( -1.034 1.121 -14.167) 14.249 9.929 ( 2.768 -0.781 16.734) 16.979 10.547 ( -3.766 -3.414 0.888) 5.160 10.629 ( 3.126 -3.272 -1.681) 4.827 11.150 ( -2.380 4.559 -1.111) 5.261 11.215 ( -0.134 0.173 6.087) 6.091 12.164 ( -4.321 2.755 10.072) 11.301 12.250 ( 8.058 -1.631 -6.035) 10.199 12.532 ( -4.894 -0.257 -12.421) 13.353 12.782 ( 5.436 -0.174 9.978) 11.364 13.591 ( -3.162 2.114 -3.875) 5.430 13.688 ( 0.763 -1.458 5.129) 5.386 14.161 ( 0.355 -3.346 -14.695) 15.075 14.267 ( 0.487 -2.154 8.120) 8.415 15.142 ( -4.694 6.016 -5.210) 9.240 15.246 ( -0.535 1.383 2.990) 3.337 15.561 ( -5.169 -1.459 3.798) 6.578 15.699 ( 5.397 -1.458 -1.477) 5.782 16.354 ( -9.288 3.002 -10.487) 14.327 16.689 ( 5.725 5.918 14.129) 16.353 19.539 ( -24.843 -3.315 38.317) 45.786 19.852 ( 24.454 0.885 -34.052) 41.932 20.250 ( 8.219 1.741 -21.939) 23.493 20.300 ( -4.492 0.034 21.964) 22.418 24.838 ( -12.279 0.874 4.590) 13.138 25.088 ( 7.134 0.054 -11.225) 13.300 25.882 ( -0.288 -0.175 -18.283) 18.287 26.198 ( 4.823 0.495 19.968) 20.549 29.370 ( -12.607 2.970 1.531) 13.043 29.503 ( 0.680 2.249 -2.535) 3.457 29.578 ( -3.270 -7.411 2.886) 8.599 29.820 ( 15.903 -1.908 -1.989) 16.140 31.160 ( -0.819 -1.540 -4.973) 5.270 31.274 ( 5.163 -2.566 2.180) 6.164 32.090 ( -8.181 2.957 -11.480) 14.404 32.330 ( -0.174 3.767 14.997) 15.464 ======================= Grid point 328 (168/186) ======================= q-point: ( 0.25 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.403 ( 2.528 7.130 -11.002) 13.351 2.636 ( -0.079 5.153 10.294) 11.512 2.950 ( 10.212 -7.244 -7.002) 14.346 3.065 ( 9.021 -7.422 0.313) 11.686 3.914 ( 1.127 1.034 -12.151) 12.247 4.226 ( 4.475 -1.622 12.894) 13.744 4.582 ( 1.953 0.443 1.546) 2.530 4.776 ( 6.106 4.387 4.034) 8.533 5.050 ( -3.877 1.489 -11.737) 12.450 5.266 ( -1.202 -3.646 -1.399) 4.086 6.154 ( -5.393 0.234 1.478) 5.597 6.312 ( -7.744 -2.712 11.793) 14.367 6.705 ( 9.365 -6.686 -10.320) 15.457 7.019 ( 4.942 -7.814 0.483) 9.258 7.384 ( -6.309 1.648 -6.326) 9.085 7.586 ( -6.981 -6.051 -1.739) 9.401 7.641 ( -2.770 -0.105 -9.292) 9.696 7.998 ( -6.285 3.398 6.357) 9.563 8.282 ( 2.055 -0.277 -4.308) 4.781 8.376 ( 5.586 1.515 -11.374) 12.762 8.491 ( 7.156 4.411 -0.432) 8.417 8.840 ( -5.668 1.250 26.736) 27.359 9.320 ( 3.805 1.570 -5.886) 7.183 9.397 ( 2.719 -1.338 -1.969) 3.614 9.626 ( -0.111 3.439 -9.318) 9.933 10.064 ( 4.209 -1.350 13.480) 14.186 10.566 ( -4.167 -5.724 1.160) 7.174 10.718 ( 1.635 -6.115 -0.485) 6.349 11.024 ( -1.914 6.897 -4.943) 8.699 11.240 ( 0.118 2.475 9.521) 9.838 12.122 ( -3.073 2.105 9.511) 10.214 12.371 ( 8.718 -2.714 -3.044) 9.625 12.428 ( -3.922 -0.203 -8.541) 9.401 12.892 ( 5.153 -0.320 5.849) 7.802 13.477 ( -4.605 3.784 -4.903) 7.717 13.747 ( 0.676 -1.502 5.452) 5.696 14.173 ( 0.739 -7.820 -13.766) 15.849 14.340 ( 1.044 -2.524 4.052) 4.887 14.936 ( -7.878 9.090 -0.683) 12.048 15.216 ( -0.731 2.900 -0.577) 3.046 15.545 ( -2.963 -0.667 3.502) 4.635 15.755 ( 0.954 -1.749 -2.262) 3.015 16.188 ( -4.587 1.672 -4.647) 6.740 16.677 ( 1.431 10.450 10.616) 14.965 19.512 ( -20.497 -7.396 40.365) 45.871 19.913 ( 17.825 5.380 -35.551) 40.132 20.224 ( 3.357 2.961 -6.129) 7.590 20.372 ( 2.963 -1.302 6.635) 7.382 24.725 ( -5.410 1.559 4.686) 7.325 25.052 ( -3.868 -1.288 -14.120) 14.697 25.875 ( 10.414 -0.772 -15.059) 18.325 26.301 ( -1.148 1.617 17.902) 18.011 29.201 ( -9.535 1.730 1.321) 9.780 29.460 ( 0.089 2.919 -1.901) 3.484 29.680 ( -2.096 -9.678 3.066) 10.366 30.022 ( 13.314 -1.183 -1.658) 13.469 31.164 ( 0.801 -2.392 -4.475) 5.137 31.411 ( 7.509 -4.772 -1.730) 9.063 31.877 ( -9.811 3.917 -6.842) 12.586 32.289 ( -4.685 7.425 13.275) 15.916 ======================= Grid point 329 (169/186) ======================= q-point: ( 0.38 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.294 ( 1.368 5.463 -6.383) 8.513 2.565 ( -1.496 8.036 6.520) 10.456 3.090 ( 5.313 -3.141 -7.428) 9.657 3.232 ( 3.244 -4.932 2.928) 6.589 3.976 ( 8.593 -8.901 -15.968) 20.200 4.306 ( -6.160 4.884 21.902) 23.270 4.611 ( 8.784 0.805 -5.024) 10.151 4.848 ( 8.702 4.429 0.771) 9.795 5.008 ( -2.208 -7.792 -6.009) 10.085 5.268 ( -0.413 -0.543 -2.188) 2.292 6.058 ( -7.403 2.647 2.286) 8.188 6.286 ( -6.558 -2.235 5.330) 8.741 6.881 ( 3.980 -6.165 -1.354) 7.462 7.065 ( 3.840 1.552 -7.399) 8.480 7.332 ( -5.756 -4.479 3.869) 8.256 7.511 ( -1.672 -0.074 -10.848) 10.976 7.625 ( -2.731 -2.093 -2.177) 4.072 7.944 ( -3.279 1.431 8.516) 9.237 8.280 ( 1.251 -0.808 -6.807) 6.969 8.375 ( 3.142 2.099 -2.043) 4.296 8.549 ( 9.567 0.696 -6.291) 11.471 8.839 ( -8.740 1.993 20.953) 22.791 9.309 ( 1.891 1.372 -4.781) 5.321 9.408 ( 0.341 0.776 -3.445) 3.548 9.579 ( 2.623 1.299 -2.410) 3.792 10.181 ( 3.216 -0.803 7.366) 8.078 10.599 ( -4.169 -5.697 1.236) 7.166 10.824 ( 2.353 -2.795 2.009) 4.169 10.899 ( -1.225 1.071 -7.957) 8.121 11.215 ( -0.530 6.891 7.615) 10.284 12.141 ( -0.634 -1.885 8.785) 9.007 12.349 ( -1.985 0.677 -7.557) 7.843 12.499 ( 5.685 -2.200 0.821) 6.151 12.969 ( 3.365 -0.048 1.860) 3.845 13.347 ( -3.934 3.143 -3.656) 6.223 13.786 ( 0.356 -0.304 2.817) 2.856 14.262 ( 2.138 -9.906 -10.730) 14.759 14.393 ( 0.813 -1.463 1.289) 2.112 14.720 ( -7.086 8.553 4.887) 12.135 15.145 ( -1.294 3.864 -2.080) 4.575 15.531 ( -1.527 0.280 1.623) 2.246 15.759 ( -1.444 -1.579 -1.983) 2.917 16.150 ( 0.127 -0.854 -0.595) 1.049 16.574 ( -0.842 9.107 5.412) 10.627 19.588 ( -16.863 -9.496 40.730) 45.094 19.844 ( 14.875 8.304 -38.251) 41.873 20.198 ( 0.795 2.355 0.093) 2.487 20.448 ( 3.026 -1.023 0.587) 3.247 24.707 ( 1.868 2.165 7.176) 7.725 24.927 ( -8.043 -2.471 -13.327) 15.761 25.995 ( 14.675 -1.884 -13.138) 19.786 26.291 ( -7.967 2.565 14.967) 17.148 29.096 ( -4.917 0.818 0.860) 5.059 29.417 ( -0.058 2.016 -1.093) 2.294 29.795 ( -1.194 -7.181 2.513) 7.701 30.166 ( 8.102 -0.452 -0.857) 8.159 31.207 ( 2.699 -3.161 -2.678) 4.945 31.504 ( 0.848 1.501 -6.703) 6.921 31.755 ( -0.868 -4.711 -0.793) 4.855 32.143 ( -7.526 9.791 9.635) 15.663 ======================= Grid point 330 (170/186) ======================= q-point: (-0.50 0.00 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.247 ( 0.000 -0.000 0.000) 0.000 2.504 ( 0.000 -0.000 -0.000) 0.000 3.124 ( 0.000 -0.000 -0.000) 0.000 3.298 ( -0.000 -0.000 -0.000) 0.000 4.134 ( 0.000 -0.000 -0.000) 0.000 4.193 ( -0.000 -0.000 0.000) 0.000 4.680 ( 0.000 -0.000 -0.000) 0.000 4.897 ( -0.000 -0.000 -0.000) 0.000 5.002 ( 0.000 0.000 0.000) 0.000 5.296 ( -0.000 -0.000 -0.000) 0.000 5.973 ( 0.000 -0.000 -0.000) 0.000 6.273 ( 0.000 -0.000 -0.000) 0.000 6.917 ( 0.000 -0.000 -0.000) 0.000 7.099 ( -0.000 0.000 -0.000) 0.000 7.329 ( 0.000 0.000 -0.000) 0.000 7.473 ( -0.000 -0.000 -0.000) 0.000 7.611 ( 0.000 -0.000 0.000) 0.000 7.937 ( 0.000 -0.000 -0.000) 0.000 8.276 ( -0.000 -0.000 0.000) 0.000 8.377 ( 0.000 -0.000 0.000) 0.000 8.614 ( 0.000 -0.000 -0.000) 0.000 8.797 ( 0.000 -0.000 -0.000) 0.000 9.299 ( 0.000 -0.000 -0.000) 0.000 9.389 ( -0.000 -0.000 0.000) 0.000 9.591 ( 0.000 -0.000 -0.000) 0.000 10.226 ( 0.000 -0.000 -0.000) 0.000 10.618 ( 0.000 -0.000 -0.000) 0.000 10.814 ( 0.000 -0.000 -0.000) 0.000 10.930 ( 0.000 -0.000 -0.000) 0.000 11.158 ( 0.000 -0.000 -0.000) 0.000 12.196 ( 0.000 -0.000 0.000) 0.000 12.297 ( 0.000 -0.000 -0.000) 0.000 12.558 ( 0.000 -0.000 -0.000) 0.000 12.994 ( 0.000 -0.000 -0.000) 0.000 13.286 ( 0.000 -0.000 -0.000) 0.000 13.796 ( 0.000 -0.000 -0.000) 0.000 14.338 ( 0.000 -0.000 -0.000) 0.000 14.411 ( 0.000 -0.000 0.000) 0.000 14.613 ( -0.000 -0.000 -0.000) 0.000 15.096 ( 0.000 -0.000 -0.000) 0.000 15.521 ( 0.000 -0.000 -0.000) 0.000 15.755 ( 0.000 -0.000 -0.000) 0.000 16.165 ( 0.000 -0.000 -0.000) 0.000 16.508 ( 0.000 -0.000 -0.000) 0.000 19.693 ( 0.000 -0.000 -0.000) 0.000 19.741 ( 0.000 -0.000 0.000) 0.000 20.186 ( 0.000 -0.000 -0.000) 0.000 20.475 ( -0.000 -0.000 0.000) 0.000 24.748 ( 0.000 0.000 0.000) 0.000 24.834 ( -0.000 -0.000 -0.000) 0.000 26.115 ( -0.000 -0.000 0.000) 0.000 26.215 ( 0.000 -0.000 -0.000) 0.000 29.062 ( 0.000 -0.000 -0.000) 0.000 29.399 ( -0.000 -0.000 -0.000) 0.000 29.846 ( -0.000 -0.000 -0.000) 0.000 30.221 ( 0.000 -0.000 -0.000) 0.000 31.265 ( 0.000 -0.000 -0.000) 0.000 31.425 ( 0.000 0.000 -0.000) 0.000 31.886 ( 0.000 -0.000 -0.000) 0.000 31.973 ( -0.000 0.000 0.000) 0.000 ======================= Grid point 336 (171/186) ======================= q-point: ( 0.12 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.598 ( 10.643 0.000 -4.607) 11.597 2.667 ( 14.295 0.000 -19.748) 24.379 2.828 ( 2.998 0.000 11.015) 11.416 2.937 ( 14.772 0.000 0.332) 14.775 4.127 ( 1.860 0.000 -3.073) 3.591 4.133 ( 2.828 0.000 7.824) 8.319 4.505 ( -4.237 -0.000 -3.971) 5.807 4.825 ( 0.540 0.000 -0.225) 0.585 5.080 ( -5.612 -0.000 7.745) 9.564 5.186 ( -3.843 -0.000 -18.046) 18.451 6.084 ( -4.198 -0.000 15.842) 16.389 6.498 ( 12.067 0.000 -13.342) 17.990 6.655 ( 6.195 0.000 -10.622) 12.297 6.682 ( -0.414 -0.000 16.685) 16.690 7.456 ( 3.576 0.000 -18.827) 19.164 7.469 ( -8.894 -0.000 6.558) 11.050 7.634 ( -10.162 -0.000 -3.854) 10.869 8.068 ( -9.627 -0.000 5.882) 11.282 8.219 ( -0.021 -0.000 -15.849) 15.849 8.425 ( 10.674 0.000 -9.476) 14.273 8.584 ( 3.418 0.000 5.121) 6.157 8.844 ( -5.967 -0.000 25.052) 25.753 9.356 ( -1.544 -0.000 4.432) 4.693 9.368 ( 8.209 0.000 -12.566) 15.010 9.678 ( 0.560 0.000 -8.577) 8.595 10.040 ( 3.835 0.000 15.373) 15.844 10.487 ( -3.463 -0.000 2.867) 4.496 10.629 ( 2.576 0.000 -4.835) 5.478 11.180 ( -0.265 -0.000 -4.706) 4.713 11.205 ( -4.125 -0.000 15.060) 15.614 12.222 ( -2.754 -0.000 16.266) 16.497 12.295 ( 8.520 0.000 -8.876) 12.304 12.417 ( -2.858 -0.000 -13.127) 13.434 12.885 ( 4.089 0.000 8.100) 9.074 13.567 ( -2.031 -0.000 -2.956) 3.587 13.683 ( -1.834 -0.000 5.230) 5.543 14.063 ( 0.102 0.000 -16.832) 16.832 14.302 ( 2.151 0.000 5.111) 5.545 15.112 ( -3.684 -0.000 -8.824) 9.562 15.195 ( -8.068 -0.000 5.248) 9.625 15.543 ( -0.177 -0.000 4.979) 4.982 15.728 ( 1.627 0.000 -3.262) 3.646 16.222 ( -6.843 -0.000 -6.251) 9.268 16.851 ( 1.226 0.000 14.835) 14.886 19.394 ( -22.749 -0.000 40.681) 46.610 19.989 ( 20.099 0.000 -35.493) 40.789 20.284 ( 13.932 0.000 -29.682) 32.789 20.344 ( -7.971 -0.000 31.368) 32.365 24.748 ( -5.361 -0.000 4.730) 7.149 25.032 ( -4.790 -0.000 -15.248) 15.983 25.867 ( 10.507 0.000 -16.494) 19.557 26.327 ( -0.390 -0.000 18.468) 18.473 29.222 ( -12.885 -0.000 1.186) 12.940 29.494 ( -3.784 -0.000 2.107) 4.331 29.530 ( 2.423 0.000 -0.248) 2.436 30.020 ( 17.332 0.000 -2.670) 17.536 31.130 ( 1.687 0.000 -6.024) 6.256 31.333 ( 5.953 0.000 0.796) 6.006 31.938 ( -10.778 -0.000 -8.776) 13.899 32.395 ( -5.193 -0.000 15.075) 15.944 ======================= Grid point 337 (172/186) ======================= q-point: ( 0.25 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.609 ( 14.275 13.930 -12.397) 23.484 2.775 ( 7.125 2.818 4.519) 8.895 2.988 ( 11.923 -5.973 -6.086) 14.658 3.141 ( 12.616 -1.864 -2.085) 12.923 3.938 ( -1.781 9.926 -7.052) 12.305 4.325 ( 5.442 -4.179 11.428) 13.330 4.550 ( 2.275 -6.453 2.205) 7.189 4.859 ( 3.433 -4.891 -6.742) 9.009 4.948 ( -7.582 4.864 -10.685) 13.975 5.111 ( -6.204 -6.148 0.082) 8.734 6.157 ( 1.880 0.807 11.995) 12.168 6.416 ( -0.132 13.538 1.896) 13.670 6.697 ( 10.233 -4.876 -12.033) 16.532 6.912 ( -0.225 -13.835 7.345) 15.665 7.324 ( -7.106 4.925 -3.766) 9.431 7.446 ( 0.173 -2.842 -6.989) 7.546 7.559 ( -2.250 -2.796 -4.094) 5.444 7.984 ( -7.961 1.284 12.389) 14.782 8.169 ( 0.605 -3.967 -17.897) 18.341 8.471 ( 6.816 2.421 -12.150) 14.140 8.627 ( 4.073 3.554 4.577) 7.083 8.857 ( -10.484 -0.964 22.906) 25.210 9.334 ( -2.553 0.550 0.064) 2.612 9.407 ( 5.522 -0.196 -11.036) 12.342 9.654 ( 1.995 2.192 -2.405) 3.817 10.170 ( 5.034 -0.500 12.121) 13.135 10.473 ( -3.805 -1.901 3.430) 5.464 10.651 ( 0.893 -3.912 -5.543) 6.843 11.092 ( -0.737 6.931 -0.312) 6.977 11.277 ( -1.097 -2.914 11.768) 12.173 12.206 ( -0.935 6.046 10.514) 12.164 12.337 ( -0.660 -0.592 -12.076) 12.108 12.411 ( 5.425 -4.768 -0.377) 7.233 12.960 ( 2.381 -0.375 4.327) 4.953 13.482 ( -1.577 5.925 -3.198) 6.915 13.725 ( -1.629 -4.525 5.743) 7.491 14.020 ( 0.871 -5.075 -15.659) 16.484 14.359 ( 2.859 -0.754 2.183) 3.675 14.950 ( -6.880 7.384 -1.298) 10.175 15.146 ( -7.253 -3.618 -0.152) 8.107 15.567 ( 1.793 2.168 2.257) 3.607 15.707 ( -2.105 -1.874 -4.898) 5.651 16.150 ( -1.468 0.443 0.099) 1.536 16.848 ( -3.511 7.282 11.930) 14.411 19.360 ( -19.364 -5.362 42.117) 46.665 20.004 ( 13.990 2.993 -39.164) 41.696 20.295 ( 7.884 3.603 -14.328) 16.746 20.410 ( -2.375 -1.761 16.807) 17.065 24.755 ( 2.836 1.099 7.118) 7.741 24.872 ( -8.416 -1.253 -14.737) 17.017 25.960 ( 14.666 -0.637 -16.219) 21.876 26.349 ( -7.540 1.351 15.480) 17.271 29.085 ( -9.584 -0.606 1.488) 9.718 29.455 ( -4.625 -0.887 0.520) 4.738 29.603 ( 4.508 -3.014 3.535) 6.473 30.210 ( 15.789 1.569 -3.518) 16.252 31.142 ( 3.258 -1.235 -5.458) 6.475 31.435 ( 6.640 -3.263 -2.376) 7.770 31.748 ( -11.401 1.433 -4.487) 12.336 32.340 ( -9.314 3.920 12.606) 16.156 ======================= Grid point 338 (173/186) ======================= q-point: ( 0.38 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.505 ( 9.827 16.259 -4.644) 19.558 2.775 ( 5.293 13.527 5.004) 15.363 3.112 ( 7.869 0.167 -11.544) 13.972 3.284 ( 10.020 -1.383 -2.405) 10.397 3.895 ( 6.173 -5.685 -13.004) 15.477 4.382 ( -7.002 5.166 17.817) 19.828 4.654 ( -1.216 -0.377 -1.581) 2.030 4.803 ( -2.603 -7.086 -10.398) 12.849 5.038 ( 14.649 -2.363 0.372) 14.843 5.112 ( -7.348 -9.043 -4.057) 12.338 6.131 ( -0.319 10.599 4.461) 11.504 6.315 ( 2.948 3.716 7.373) 8.767 6.844 ( 4.058 -5.058 -2.569) 6.975 7.092 ( 3.804 -7.534 0.585) 8.460 7.174 ( -7.597 -0.056 -0.501) 7.614 7.482 ( 2.378 -2.908 -1.503) 4.046 7.567 ( 1.593 -1.516 -5.124) 5.575 7.950 ( -6.032 0.446 13.590) 14.875 8.163 ( 0.594 -5.614 -16.855) 17.776 8.432 ( 3.263 2.565 -13.366) 13.996 8.641 ( 0.517 2.658 5.836) 6.433 8.830 ( -8.768 0.245 16.577) 18.754 9.286 ( -3.512 -0.482 -1.719) 3.939 9.400 ( 1.278 0.341 -8.867) 8.965 9.644 ( 2.216 3.180 1.507) 4.159 10.268 ( 3.360 2.254 7.885) 8.863 10.473 ( -3.965 -4.827 0.905) 6.312 10.714 ( -0.270 -8.101 -4.676) 9.357 10.999 ( 3.288 8.207 -0.190) 8.843 11.323 ( -0.849 3.339 10.099) 10.671 12.181 ( 0.201 2.007 7.796) 8.053 12.293 ( 0.243 -0.701 -9.982) 10.010 12.525 ( 2.571 -3.084 1.417) 4.258 12.989 ( -0.831 -0.449 0.679) 1.164 13.372 ( 0.260 6.109 -1.378) 6.268 13.776 ( -1.658 -1.898 3.478) 4.295 14.100 ( 4.368 -11.328 -12.011) 17.078 14.406 ( 2.093 -0.262 0.362) 2.140 14.770 ( -6.285 7.199 5.750) 11.153 15.084 ( -7.172 -1.952 -3.292) 8.129 15.536 ( 0.013 1.939 -3.083) 3.642 15.725 ( 1.841 -2.230 -0.604) 2.954 16.154 ( 0.581 0.070 2.649) 2.712 16.702 ( -5.965 10.343 7.034) 13.857 19.436 ( -16.662 -9.227 42.138) 46.243 19.916 ( 11.396 4.254 -41.943) 43.671 20.260 ( 4.626 4.673 -8.724) 10.924 20.467 ( -2.037 -0.800 10.229) 10.460 24.719 ( -5.916 -1.360 -11.083) 12.636 24.865 ( 7.598 1.451 9.787) 12.474 26.082 ( 12.678 -1.519 -15.146) 19.810 26.256 ( -12.190 2.028 11.363) 16.787 29.014 ( -5.831 -2.346 1.628) 6.492 29.409 ( -4.427 -0.940 -0.083) 4.527 29.740 ( 4.984 -3.628 6.375) 8.868 30.328 ( 12.067 4.816 -5.139) 13.972 31.198 ( 4.446 -2.803 -2.995) 6.049 31.485 ( -3.347 1.782 -4.561) 5.931 31.665 ( 0.698 -6.922 -1.126) 7.048 32.181 ( -11.241 6.821 8.469) 15.640 ======================= Grid point 339 (174/186) ======================= q-point: ( 0.50 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.404 ( 7.212 12.569 2.437) 14.694 2.631 ( 4.213 13.819 -1.478) 14.522 3.154 ( 5.911 1.218 -4.424) 7.483 3.369 ( 7.521 3.819 -5.554) 10.099 4.039 ( 8.113 -10.751 -18.144) 22.597 4.234 ( -13.207 7.875 19.324) 24.695 4.609 ( -5.523 -3.148 -3.471) 7.243 4.775 ( -8.221 1.004 -2.774) 8.734 5.095 ( 1.147 -2.835 -0.055) 3.059 5.248 ( 2.408 -0.762 -0.350) 2.550 6.068 ( 7.540 3.572 3.413) 9.015 6.378 ( 9.346 4.055 4.395) 11.095 6.920 ( 1.995 -2.666 2.980) 4.469 7.081 ( -6.171 1.173 -0.888) 6.344 7.258 ( 2.698 -7.551 0.775) 8.056 7.565 ( 7.307 0.579 2.143) 7.637 7.601 ( 1.881 -2.404 1.048) 3.227 7.923 ( -3.639 0.401 2.953) 4.704 8.167 ( -1.303 -6.000 -13.773) 15.079 8.386 ( 0.778 0.484 -6.161) 6.228 8.587 ( -11.771 2.288 14.143) 18.542 8.809 ( 1.639 0.193 -5.359) 5.607 9.258 ( -3.012 -2.210 0.334) 3.751 9.374 ( -0.226 -0.784 -1.808) 1.984 9.622 ( -0.356 3.526 2.622) 4.408 10.247 ( -2.200 4.222 0.385) 4.777 10.536 ( -0.580 -7.420 1.376) 7.569 10.796 ( -1.381 -6.852 -4.176) 8.142 10.962 ( 6.944 5.751 -0.779) 9.050 11.253 ( -1.801 9.199 6.943) 11.665 12.215 ( 1.206 1.563 0.269) 1.993 12.276 ( 2.024 -3.153 -4.606) 5.938 12.552 ( -2.156 0.860 1.101) 2.569 12.959 ( -4.760 -0.732 -0.824) 4.886 13.336 ( 3.878 2.811 2.330) 5.327 13.775 ( -2.162 -0.739 0.274) 2.301 14.292 ( 7.414 -10.460 -7.239) 14.723 14.424 ( 1.227 0.858 0.270) 1.522 14.654 ( -3.736 5.197 7.317) 9.721 15.014 ( -6.624 -4.320 -2.723) 8.364 15.522 ( 2.591 -0.012 -3.399) 4.274 15.779 ( 3.061 -0.367 0.760) 3.175 16.171 ( 0.193 0.301 2.440) 2.466 16.527 ( -5.283 6.121 2.149) 8.366 19.568 ( -15.225 -10.254 40.754) 44.697 19.801 ( 12.060 4.192 -42.917) 44.776 20.213 ( 3.905 3.811 -8.252) 9.893 20.472 ( -4.610 0.687 9.007) 10.142 24.648 ( -1.010 -1.971 -8.283) 8.574 24.996 ( 7.659 2.369 12.718) 15.034 26.059 ( -12.817 2.561 8.654) 15.676 26.221 ( 7.658 -2.402 -14.003) 16.140 29.018 ( -1.565 -4.075 1.180) 4.522 29.375 ( -3.977 -2.131 0.181) 4.516 29.860 ( 3.792 -0.136 6.769) 7.760 30.322 ( 5.878 8.598 -7.050) 12.577 31.273 ( 1.343 0.003 0.098) 1.346 31.411 ( -1.029 -1.993 3.087) 3.816 31.827 ( 5.092 -9.770 -6.470) 12.777 31.973 ( -9.610 6.469 4.017) 12.262 ======================= Grid point 340 (175/186) ======================= q-point: (-0.38 0.12 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.380 ( 5.669 6.578 7.516) 11.485 2.548 ( 4.783 3.745 -6.297) 8.750 3.155 ( 2.256 6.541 2.014) 7.207 3.311 ( 2.639 9.529 -6.552) 11.861 4.057 ( -10.268 7.993 18.676) 22.762 4.181 ( 6.455 -8.620 -24.352) 26.627 4.521 ( -11.042 2.255 8.320) 14.008 4.647 ( -8.490 -4.567 -3.837) 10.376 5.144 ( -0.239 6.270 1.431) 6.436 5.178 ( -5.119 -5.802 -0.624) 7.763 6.214 ( 14.348 2.473 1.999) 14.696 6.478 ( 14.778 5.829 -0.452) 15.893 6.908 ( -6.926 6.273 0.119) 9.346 7.036 ( -1.717 -3.174 7.300) 8.143 7.368 ( 2.370 -3.522 2.093) 4.733 7.643 ( 4.708 1.630 5.107) 7.135 7.699 ( 7.650 0.147 2.962) 8.205 7.908 ( 0.100 -3.430 -3.410) 4.838 8.156 ( -3.105 -5.784 -13.181) 14.725 8.386 ( -1.912 -0.563 7.422) 7.685 8.446 ( -13.904 1.669 12.826) 18.990 8.782 ( 2.561 -2.142 -23.558) 23.793 9.271 ( -1.906 -2.260 3.609) 4.665 9.406 ( -0.618 -1.514 4.148) 4.459 9.582 ( -0.279 2.189 6.375) 6.746 10.123 ( -5.657 3.379 -7.819) 10.226 10.653 ( 3.065 -5.386 0.187) 6.200 10.806 ( -0.481 0.836 -0.783) 1.242 10.992 ( 3.823 2.304 0.134) 4.465 11.143 ( -1.788 3.825 1.002) 4.340 12.165 ( 2.704 3.955 -7.438) 8.847 12.369 ( 2.364 -3.849 -1.194) 4.672 12.474 ( -4.481 3.758 5.459) 8.000 12.887 ( -7.128 -0.978 -2.466) 7.606 13.408 ( 6.073 -0.646 5.158) 7.994 13.749 ( -2.687 -0.697 -2.465) 3.713 14.405 ( 1.102 5.733 4.504) 7.373 14.417 ( 1.620 2.131 -0.381) 2.703 14.668 ( 4.971 -8.199 -1.847) 9.765 15.028 ( -5.546 -9.292 0.098) 10.821 15.561 ( 5.456 0.159 -3.133) 6.293 15.805 ( 0.522 1.364 1.377) 2.007 16.176 ( 1.016 0.805 2.929) 3.203 16.451 ( -3.366 -3.061 -2.595) 5.238 19.682 ( -1.785 -2.042 3.523) 4.446 19.728 ( 1.586 -2.563 -7.394) 7.984 20.187 ( 3.376 1.495 -6.272) 7.278 20.415 ( -7.328 1.921 7.066) 10.360 24.674 ( 5.830 -1.981 -5.109) 8.001 25.093 ( 1.302 1.515 12.149) 12.313 25.917 ( -9.722 2.336 12.646) 16.122 26.253 ( 3.300 -1.821 -17.380) 17.784 29.098 ( 3.257 -5.460 0.186) 6.360 29.371 ( -3.739 -3.973 1.027) 5.551 29.893 ( 2.484 5.189 5.108) 7.693 30.185 ( -0.787 10.571 -6.767) 12.576 31.247 ( 0.272 3.229 2.787) 4.274 31.489 ( -3.014 -1.588 6.542) 7.376 31.810 ( 0.427 1.378 0.445) 1.510 32.020 ( 3.148 -11.240 -8.675) 14.543 ======================= Grid point 341 (176/186) ======================= q-point: (-0.25 0.12 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.434 ( 3.567 0.718 10.581) 11.189 2.554 ( 2.544 -1.744 -10.503) 10.946 3.038 ( -1.484 12.739 4.257) 13.513 3.121 ( -3.769 13.424 -3.429) 14.358 3.975 ( -2.865 2.904 16.859) 17.346 4.139 ( -1.746 1.460 -17.919) 18.063 4.498 ( -0.809 -6.025 1.174) 6.191 4.601 ( -7.543 -5.183 -1.713) 9.311 5.104 ( 2.081 -1.221 3.184) 3.995 5.212 ( -4.395 -5.576 -0.755) 7.140 6.314 ( 10.180 7.992 4.097) 13.576 6.511 ( 8.959 12.315 -13.773) 20.533 6.751 ( -3.549 4.905 13.430) 14.732 7.002 ( -8.157 3.136 -1.381) 8.847 7.480 ( 6.463 -1.837 7.121) 9.791 7.656 ( -0.790 0.728 -4.714) 4.835 7.819 ( 10.058 3.660 10.896) 15.273 8.000 ( 6.365 -4.482 -2.361) 8.134 8.122 ( -6.291 -5.942 -7.906) 11.722 8.301 ( -13.812 -3.630 4.048) 14.843 8.467 ( 1.911 -0.819 16.443) 16.574 8.718 ( 0.518 -3.117 -26.702) 26.888 9.293 ( -0.562 -0.715 3.802) 3.910 9.375 ( -4.136 1.187 -0.140) 4.305 9.671 ( 4.103 -1.814 14.818) 15.483 9.958 ( -5.738 1.539 -14.349) 15.530 10.701 ( 3.921 5.202 -0.296) 6.521 10.770 ( -0.802 3.842 -2.387) 4.594 11.013 ( 0.831 -1.838 9.654) 9.863 11.128 ( -1.242 -4.640 -8.323) 9.610 12.141 ( 6.035 1.974 -7.266) 9.649 12.299 ( -8.735 2.253 1.678) 9.176 12.531 ( 6.094 -0.626 8.083) 10.142 12.783 ( -7.509 -0.456 -5.644) 9.405 13.532 ( 5.580 -1.835 5.851) 8.290 13.701 ( -3.310 -0.528 -4.971) 5.996 14.328 ( -0.559 7.893 7.834) 11.134 14.367 ( 0.495 4.688 -3.698) 5.991 14.903 ( 8.048 -11.075 0.404) 13.697 15.093 ( -5.437 -9.511 -0.720) 10.979 15.614 ( 6.736 1.654 -2.752) 7.462 15.758 ( -4.390 2.421 1.399) 5.205 16.249 ( 5.587 -3.033 6.095) 8.807 16.463 ( -4.526 -7.779 -7.247) 11.555 19.661 ( 17.906 3.729 -36.749) 41.049 19.780 ( -16.542 -4.736 32.867) 37.098 20.200 ( 1.876 -0.550 0.437) 2.003 20.315 ( -6.381 1.614 0.617) 6.611 24.797 ( 12.191 -1.851 -3.884) 12.928 25.083 ( -9.246 -0.291 8.882) 12.824 25.902 ( 0.552 1.501 16.886) 16.962 26.182 ( -3.059 -0.506 -18.968) 19.220 29.245 ( 7.252 -6.211 -1.149) 9.617 29.394 ( -4.262 -5.502 2.053) 7.256 29.838 ( 2.698 9.612 2.153) 10.212 29.974 ( -5.510 9.946 -3.392) 11.865 31.235 ( 2.733 3.580 3.277) 5.571 31.387 ( -7.412 4.716 0.680) 8.811 31.947 ( 6.771 -6.737 7.921) 12.409 32.139 ( 0.000 -9.585 -11.612) 15.057 ======================= Grid point 342 (177/186) ======================= q-point: (-0.12 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.535 ( -1.265 -2.169 -11.758) 12.023 2.535 ( 1.265 -2.169 11.758) 12.023 2.866 ( 3.082 12.640 -9.089) 15.871 2.866 ( -3.082 12.640 9.089) 15.871 4.036 ( -1.245 -0.749 -11.430) 11.522 4.036 ( 1.245 -0.749 11.430) 11.522 4.606 ( -1.340 -6.333 -3.065) 7.162 4.606 ( 1.340 -6.333 3.065) 7.162 5.210 ( -2.963 -3.005 -4.277) 6.008 5.210 ( 2.963 -3.005 4.277) 6.008 6.308 ( -1.157 8.299 -9.398) 12.591 6.308 ( 1.157 8.299 9.398) 12.591 6.778 ( -4.838 7.708 -11.676) 14.804 6.778 ( 4.838 7.708 11.676) 14.804 7.580 ( -0.016 2.416 -12.610) 12.840 7.580 ( 0.016 2.416 12.610) 12.840 7.977 ( -6.886 -1.868 -10.621) 12.795 7.977 ( 6.886 -1.868 10.621) 12.795 8.230 ( -4.870 -5.736 -4.030) 8.536 8.230 ( 4.870 -5.736 4.030) 8.536 8.614 ( -3.113 -1.127 -22.808) 23.047 8.614 ( 3.113 -1.127 22.808) 23.047 9.318 ( 1.723 0.007 -7.593) 7.786 9.318 ( -1.723 0.007 7.593) 7.786 9.816 ( -3.458 -0.473 -16.545) 16.909 9.816 ( 3.458 -0.473 16.545) 16.909 10.659 ( -1.590 6.185 -1.609) 6.586 10.659 ( 1.590 6.185 1.609) 6.586 11.134 ( 0.688 -4.726 -10.660) 11.681 11.134 ( -0.688 -4.726 10.660) 11.681 12.187 ( 6.577 0.376 -9.640) 11.676 12.187 ( -6.577 0.376 9.640) 11.676 12.659 ( -5.699 -0.025 -10.196) 11.680 12.659 ( 5.699 -0.025 10.196) 11.680 13.638 ( -3.513 -0.791 -5.548) 6.614 13.638 ( 3.513 -0.791 5.548) 6.614 14.274 ( 1.043 5.030 -10.340) 11.546 14.274 ( -1.043 5.030 10.340) 11.546 15.132 ( -1.094 -7.587 -7.343) 10.615 15.132 ( 1.094 -7.587 7.343) 10.615 15.658 ( -1.108 2.544 -0.491) 2.818 15.658 ( 1.108 2.544 0.491) 2.818 16.448 ( -7.564 -6.781 -10.484) 14.598 16.448 ( 7.564 -6.781 10.484) 14.598 19.712 ( 22.940 1.470 -37.057) 43.607 19.712 ( -22.940 1.470 37.057) 43.607 20.247 ( 10.560 -1.009 -31.611) 33.344 20.247 ( -10.560 -1.009 31.611) 33.344 24.972 ( 7.843 -1.218 -5.436) 9.620 24.972 ( -7.843 -1.218 5.436) 9.620 26.027 ( -5.807 0.257 -19.678) 20.518 26.027 ( 5.807 0.257 19.678) 20.518 29.418 ( 2.655 -5.730 -2.291) 6.718 29.418 ( -2.655 -5.730 2.291) 6.718 29.755 ( -0.200 9.234 -4.306) 10.190 29.755 ( 0.200 9.234 4.306) 10.190 31.245 ( -2.001 3.571 -5.132) 6.565 31.245 ( 2.001 3.571 5.132) 6.565 32.164 ( -3.146 -6.424 -13.949) 15.676 32.164 ( 3.146 -6.424 13.949) 15.676 ======================= Grid point 346 (178/186) ======================= q-point: ( 0.25 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.924 ( 17.400 0.000 -15.372) 23.218 2.934 ( 13.121 0.000 0.067) 13.121 2.999 ( 7.261 0.000 -0.403) 7.273 3.276 ( 12.071 0.000 -7.908) 14.430 3.977 ( -5.848 -0.000 -2.223) 6.256 4.368 ( 9.600 0.000 7.585) 12.235 4.612 ( 2.989 0.000 8.902) 9.390 4.733 ( -1.532 -0.000 -18.338) 18.402 4.788 ( -12.941 -0.000 -4.478) 13.694 5.094 ( 6.417 0.000 0.061) 6.418 6.314 ( 8.031 0.000 16.602) 18.442 6.493 ( -3.932 -0.000 -12.577) 13.177 6.736 ( 11.858 0.000 -14.019) 18.362 6.815 ( -5.331 -0.000 21.338) 21.993 7.272 ( -5.915 -0.000 1.756) 6.171 7.449 ( 5.738 0.000 -9.639) 11.217 7.489 ( -1.494 -0.000 1.051) 1.827 7.958 ( -8.902 -0.000 19.194) 21.158 8.068 ( 3.288 0.000 -21.690) 21.937 8.474 ( 3.951 0.000 -20.885) 21.255 8.732 ( 3.901 0.000 4.080) 5.645 8.780 ( -14.811 -0.000 20.670) 25.429 9.284 ( -6.233 -0.000 2.481) 6.708 9.403 ( 3.074 0.000 -13.942) 14.277 9.698 ( 2.236 0.000 1.940) 2.961 10.289 ( 6.048 0.000 7.942) 9.982 10.439 ( -4.326 -0.000 6.625) 7.912 10.588 ( -0.471 -0.000 -8.041) 8.055 11.165 ( 2.994 0.000 -0.158) 2.998 11.294 ( -0.302 -0.000 14.031) 14.034 12.272 ( -0.400 -0.000 -11.078) 11.085 12.319 ( -3.155 -0.000 17.510) 17.792 12.399 ( 5.516 0.000 -8.145) 9.837 12.980 ( -0.900 -0.000 0.779) 1.190 13.552 ( 3.804 0.000 -0.960) 3.923 13.666 ( -2.781 -0.000 4.962) 5.688 13.925 ( 1.164 0.000 -13.508) 13.558 14.401 ( 3.021 0.000 0.462) 3.057 14.926 ( -5.635 -0.000 -4.325) 7.103 14.996 ( -10.075 -0.000 4.146) 10.895 15.610 ( -2.811 -0.000 -7.713) 8.209 15.654 ( 5.202 0.000 1.905) 5.539 16.160 ( 0.494 0.000 3.858) 3.890 16.877 ( -8.353 -0.000 10.109) 13.113 19.292 ( -17.079 -0.000 43.260) 46.509 19.970 ( 8.552 0.000 -42.321) 43.177 20.359 ( 13.141 0.000 -29.284) 32.097 20.436 ( -8.740 -0.000 31.103) 32.308 24.697 ( -6.012 -0.000 -12.884) 14.218 24.888 ( 8.513 0.000 11.027) 13.931 26.059 ( 13.954 0.000 -17.854) 22.660 26.289 ( -13.519 -0.000 12.619) 18.493 28.978 ( -7.423 -0.000 2.292) 7.769 29.366 ( -6.715 -0.000 -0.269) 6.720 29.709 ( 9.406 0.000 6.959) 11.700 30.401 ( 14.859 0.000 -5.536) 15.857 31.158 ( 4.685 0.000 -5.635) 7.329 31.471 ( 4.294 0.000 -3.670) 5.649 31.600 ( -10.034 -0.000 -0.625) 10.053 32.280 ( -12.492 -0.000 9.727) 15.832 ======================= Grid point 347 (179/186) ======================= q-point: ( 0.38 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.847 ( 6.271 16.568 1.458) 17.775 3.050 ( 9.062 7.750 -1.828) 12.063 3.171 ( 11.772 -0.729 -13.386) 17.841 3.371 ( 10.536 -2.512 -9.455) 14.378 3.881 ( 2.140 2.351 -5.200) 6.095 4.434 ( -10.459 7.708 10.017) 16.406 4.598 ( -3.173 0.974 -9.448) 10.014 4.669 ( 2.683 -7.633 4.715) 9.364 4.845 ( -1.810 -13.228 -1.817) 13.474 5.223 ( 15.442 -0.004 -5.017) 16.237 6.295 ( -1.645 10.477 -1.712) 10.743 6.494 ( 10.338 3.465 12.002) 16.214 6.826 ( 2.963 -3.200 -0.803) 4.435 6.920 ( -4.609 -10.483 5.610) 12.751 7.196 ( -0.378 3.028 0.117) 3.053 7.476 ( 2.320 -2.137 1.394) 3.449 7.548 ( 3.002 -4.206 -2.854) 5.903 7.943 ( -7.982 0.652 21.004) 22.479 8.038 ( 3.469 -2.547 -19.714) 20.178 8.400 ( 3.359 0.529 -24.107) 24.346 8.654 ( -13.033 2.633 16.698) 21.345 8.790 ( -2.122 -2.158 -0.323) 3.044 9.216 ( -5.309 -0.500 0.743) 5.384 9.364 ( -0.190 -0.190 -7.509) 7.514 9.718 ( 1.080 2.414 3.943) 4.748 10.381 ( -5.194 -0.677 0.331) 5.248 10.393 ( 4.514 2.788 6.285) 8.225 10.591 ( -0.473 -5.517 -4.583) 7.188 11.173 ( 6.842 7.078 1.494) 9.957 11.382 ( 0.305 -1.188 10.946) 11.014 12.212 ( -0.688 0.130 -7.570) 7.602 12.295 ( 0.128 4.266 5.407) 6.889 12.490 ( 1.342 -5.435 -0.635) 5.634 12.940 ( -5.230 -0.367 -2.261) 5.710 13.507 ( 3.697 9.121 1.968) 10.036 13.734 ( -1.280 -3.737 4.148) 5.728 13.961 ( 5.693 -9.632 -11.161) 15.803 14.434 ( 2.134 0.072 -0.121) 2.139 14.791 ( -6.884 3.930 2.415) 8.286 14.917 ( -9.849 -3.079 -1.735) 10.464 15.556 ( 2.777 1.950 -4.996) 6.040 15.744 ( 5.166 -1.609 -0.080) 5.411 16.187 ( 0.692 0.592 4.968) 5.051 16.744 ( -10.775 6.140 6.178) 13.855 19.333 ( -14.993 -5.370 43.272) 46.110 19.849 ( 6.475 0.320 -44.103) 44.577 20.350 ( 9.705 4.375 -20.522) 23.119 20.473 ( -6.939 -0.780 20.961) 22.094 24.608 ( -0.163 -0.801 -9.507) 9.542 25.046 ( 7.019 1.042 12.907) 14.729 26.121 ( -2.018 1.654 -3.929) 4.717 26.167 ( -1.836 -1.382 -3.583) 4.256 28.927 ( -4.300 -1.897 2.940) 5.543 29.291 ( -7.372 -2.673 -1.385) 7.963 29.878 ( 10.720 1.009 10.108) 14.769 30.511 ( 10.943 4.011 -8.643) 14.510 31.213 ( 5.414 -2.033 -3.609) 6.817 31.427 ( -6.675 1.095 0.384) 6.775 31.592 ( 2.781 -5.274 -2.116) 6.327 32.126 ( -13.297 3.200 5.631) 14.790 ======================= Grid point 348 (180/186) ======================= q-point: ( 0.50 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.707 ( 4.412 15.462 6.022) 17.170 2.894 ( 2.095 16.576 -5.122) 17.476 3.280 ( 13.572 2.749 -6.934) 15.487 3.483 ( 8.883 0.842 -9.534) 13.059 3.928 ( 5.702 -6.297 -12.122) 14.802 4.223 ( -15.027 4.546 13.894) 20.965 4.522 ( -1.139 2.044 -4.672) 5.225 4.692 ( -6.859 0.709 -0.417) 6.908 4.990 ( 0.439 -6.378 4.176) 7.636 5.335 ( 4.039 3.983 -5.567) 7.948 6.248 ( 10.318 2.519 3.797) 11.279 6.626 ( 13.227 5.439 7.288) 16.052 6.904 ( -2.995 -6.095 5.712) 8.874 6.950 ( -4.492 -3.211 -1.074) 5.625 7.248 ( 5.337 -3.482 -0.992) 6.450 7.570 ( 0.415 -6.036 3.599) 7.040 7.636 ( 3.417 -4.192 -0.233) 5.413 7.919 ( -4.581 3.663 12.313) 13.638 8.018 ( 0.474 -3.665 -14.069) 14.546 8.354 ( 4.450 -1.108 -15.909) 16.557 8.520 ( -15.172 2.716 16.357) 22.474 8.734 ( -4.978 -2.008 -14.197) 15.178 9.196 ( -0.998 -2.591 0.178) 2.782 9.358 ( -1.037 -1.386 3.479) 3.886 9.701 ( 1.471 4.811 5.021) 7.107 10.246 ( -7.724 4.596 -2.760) 9.402 10.486 ( 3.933 -3.424 2.114) 5.627 10.657 ( -0.876 -7.191 -2.927) 7.814 11.165 ( 8.216 8.786 -0.209) 12.031 11.379 ( -2.053 6.980 7.821) 10.682 12.228 ( 3.580 -4.730 -6.087) 8.499 12.270 ( 1.209 3.168 1.370) 3.657 12.536 ( -1.520 -0.793 1.254) 2.124 12.844 ( -8.936 -1.367 -3.025) 9.533 13.473 ( 5.241 5.698 4.034) 8.730 13.737 ( -2.789 -0.112 0.513) 2.837 14.197 ( 10.102 -13.807 -6.760) 18.395 14.461 ( 2.420 0.183 0.676) 2.519 14.687 ( -5.886 2.896 5.549) 8.592 14.812 ( -10.997 -4.527 -3.966) 12.537 15.581 ( 7.313 1.732 -2.760) 8.006 15.814 ( 3.037 -0.551 -0.545) 3.134 16.206 ( 0.854 1.254 4.515) 4.763 16.535 ( -9.585 6.595 2.014) 11.808 19.451 ( -13.700 -8.135 42.245) 45.150 19.733 ( 7.924 -1.271 -43.918) 44.645 20.307 ( 8.455 5.684 -15.821) 18.818 20.464 ( -7.733 1.240 15.527) 17.391 24.627 ( 6.660 -1.271 -6.122) 9.135 25.129 ( -1.701 1.024 11.026) 11.204 25.994 ( -8.878 2.928 11.541) 14.852 26.202 ( 5.958 -1.808 -17.609) 18.677 28.953 ( -0.368 -4.264 2.882) 5.160 29.240 ( -7.240 -4.735 -1.736) 8.824 30.023 ( 8.905 4.222 10.909) 14.701 30.471 ( 4.070 8.694 -11.187) 14.741 31.302 ( 4.026 -0.842 -0.383) 4.131 31.380 ( -1.594 -2.623 5.477) 6.279 31.715 ( 3.078 -8.973 -5.481) 10.955 31.929 ( -11.128 4.229 1.887) 12.053 ======================= Grid point 349 (181/186) ======================= q-point: (-0.38 0.25 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.608 ( 3.470 11.205 7.769) 14.070 2.690 ( 2.205 12.306 -5.906) 13.827 3.336 ( 8.337 7.812 -0.598) 11.440 3.451 ( 2.753 8.679 -7.592) 11.855 4.036 ( 5.697 -6.684 -16.275) 18.494 4.091 ( -10.437 1.039 15.911) 19.057 4.464 ( -2.087 1.678 0.918) 2.831 4.546 ( -6.862 4.552 -0.908) 8.284 5.067 ( -0.475 -2.815 3.976) 4.895 5.192 ( -4.875 6.529 -4.632) 9.373 6.447 ( 15.882 0.173 3.285) 16.219 6.759 ( 14.008 5.620 0.022) 15.093 6.836 ( -11.444 -0.637 3.167) 11.891 7.005 ( -1.367 -1.481 1.740) 2.663 7.374 ( 5.521 -4.833 5.038) 8.901 7.619 ( -4.731 -4.291 -5.922) 8.710 7.773 ( 5.024 -8.395 0.381) 9.790 7.889 ( -2.480 -0.790 10.134) 10.463 8.033 ( 6.763 -0.007 -11.835) 13.631 8.322 ( -13.394 3.741 5.634) 15.005 8.411 ( -0.112 -2.500 7.841) 8.230 8.622 ( -4.157 -3.387 -20.007) 20.713 9.252 ( 2.963 -2.674 0.347) 4.006 9.371 ( -4.992 -1.857 4.083) 6.711 9.712 ( 6.483 4.886 10.073) 12.937 10.042 ( -9.112 4.705 -9.210) 13.784 10.614 ( 4.009 -6.281 1.876) 7.684 10.722 ( -2.519 -6.844 -2.335) 7.657 11.135 ( 7.140 8.770 -3.071) 11.719 11.241 ( -4.283 10.348 5.643) 12.541 12.240 ( 3.723 3.896 -2.578) 5.974 12.322 ( 0.685 -2.477 -4.342) 5.046 12.520 ( 1.105 0.850 6.302) 6.454 12.739 ( -9.349 -2.668 -3.617) 10.374 13.520 ( 6.000 1.648 5.097) 8.043 13.687 ( -3.995 0.127 -2.508) 4.718 14.464 ( 6.636 -2.721 -1.460) 7.320 14.497 ( 5.623 -0.285 -0.565) 5.659 14.605 ( -2.678 -2.280 1.552) 3.844 14.775 ( -10.392 -11.795 -0.156) 15.721 15.651 ( 8.433 1.634 -1.780) 8.772 15.812 ( -2.797 1.357 0.056) 3.109 16.228 ( 2.777 1.051 3.743) 4.778 16.376 ( -6.090 1.697 -1.456) 6.488 19.591 ( -13.192 -7.677 40.503) 43.284 19.677 ( 11.017 -2.887 -42.179) 43.689 20.271 ( 8.544 5.132 -12.641) 16.098 20.389 ( -9.425 3.283 12.567) 16.048 24.748 ( 12.646 -1.530 -4.010) 13.354 25.074 ( -11.940 -0.287 7.029) 13.859 25.964 ( -0.064 2.760 15.813) 16.052 26.172 ( 0.211 -0.292 -18.302) 18.306 29.061 ( 3.830 -6.421 1.880) 7.709 29.221 ( -6.697 -6.452 -1.214) 9.379 30.082 ( 5.931 8.230 10.002) 14.246 30.290 ( -1.544 11.299 -10.813) 15.715 31.329 ( 4.053 2.667 1.863) 5.197 31.450 ( -3.644 -1.832 5.044) 6.487 31.803 ( -0.426 -2.101 -1.577) 2.661 31.852 ( -0.803 -9.928 -4.208) 10.813 ======================= Grid point 350 (182/186) ======================= q-point: (-0.25 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.553 ( 0.077 5.635 -9.061) 10.670 2.553 ( -0.077 5.635 9.061) 10.670 3.263 ( -0.154 13.519 -7.368) 15.398 3.263 ( 0.154 13.519 7.368) 15.398 4.062 ( 4.513 0.937 -23.019) 23.476 4.062 ( -4.513 0.937 23.019) 23.476 4.462 ( -0.705 -2.177 -7.229) 7.582 4.462 ( 0.705 -2.177 7.229) 7.582 5.107 ( 1.439 -1.791 -1.337) 2.658 5.107 ( -1.439 -1.791 1.337) 2.658 6.596 ( -10.464 7.912 -6.204) 14.512 6.596 ( 10.464 7.912 6.204) 14.512 6.905 ( -3.427 2.420 -11.759) 12.485 6.905 ( 3.427 2.420 11.759) 12.485 7.557 ( -1.987 -3.658 -13.141) 13.784 7.557 ( 1.987 -3.658 13.141) 13.784 7.955 ( 1.401 -6.837 -7.995) 10.613 7.955 ( -1.401 -6.837 7.995) 10.613 8.094 ( 6.103 2.736 -11.232) 13.072 8.094 ( -6.103 2.736 11.232) 13.072 8.542 ( -1.406 -3.836 -20.428) 20.832 8.542 ( 1.406 -3.836 20.428) 20.832 9.325 ( -0.480 -0.317 -4.267) 4.305 9.325 ( 0.480 -0.317 4.267) 4.305 9.823 ( -7.733 2.143 -14.650) 16.704 9.823 ( 7.733 2.143 14.650) 16.704 10.752 ( -0.431 -3.831 -2.498) 4.594 10.752 ( 0.431 -3.831 2.498) 4.594 11.084 ( 3.464 5.833 -8.577) 10.936 11.084 ( -3.464 5.833 8.577) 10.936 12.244 ( -1.829 3.324 -0.445) 3.820 12.244 ( 1.829 3.324 0.445) 3.820 12.638 ( -7.122 -1.824 -6.485) 9.803 12.638 ( 7.122 -1.824 6.485) 9.803 13.612 ( -5.102 -0.577 -5.131) 7.258 13.612 ( 5.102 -0.577 5.131) 7.258 14.441 ( 2.868 6.325 -5.317) 8.747 14.441 ( -2.868 6.325 5.317) 8.747 14.838 ( -1.391 -13.401 -5.073) 14.397 14.838 ( 1.391 -13.401 5.073) 14.397 15.721 ( -5.333 1.957 0.497) 5.703 15.721 ( 5.333 1.957 -0.497) 5.703 16.303 ( -4.955 -2.330 -4.460) 7.062 16.303 ( 4.955 -2.330 4.460) 7.062 19.690 ( 14.606 -3.705 -39.616) 42.385 19.690 ( -14.606 -3.705 39.616) 42.385 20.272 ( 12.460 3.259 -30.705) 33.297 20.272 ( -12.460 3.259 30.705) 33.297 24.933 ( -1.530 -1.442 -2.107) 2.976 24.933 ( 1.530 -1.442 2.107) 2.976 26.048 ( -3.497 1.290 -18.991) 19.353 26.048 ( 3.497 1.290 18.991) 19.353 29.231 ( -2.411 -7.373 -3.190) 8.387 29.231 ( 2.411 -7.373 3.190) 8.387 30.050 ( -2.804 11.288 -9.118) 14.779 30.050 ( 2.804 11.288 9.118) 14.779 31.358 ( -1.145 3.847 -5.520) 6.825 31.358 ( 1.145 3.847 5.520) 6.825 31.936 ( -0.047 -9.235 -11.557) 14.793 31.936 ( 0.047 -9.235 11.557) 14.793 ======================= Grid point 356 (183/186) ======================= q-point: ( 0.38 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.037 ( -4.354 -0.000 12.005) 12.770 3.119 ( 5.281 0.000 -14.254) 15.200 3.317 ( 17.371 0.000 -10.863) 20.488 3.414 ( 11.455 0.000 -13.191) 17.471 3.908 ( -2.339 -0.000 4.253) 4.854 4.331 ( -17.484 -0.000 0.761) 17.501 4.566 ( 6.684 0.000 -16.778) 18.061 4.634 ( -6.753 -0.000 13.201) 14.828 4.869 ( 14.218 0.000 8.016) 16.322 5.368 ( 12.098 0.000 -11.093) 16.414 6.341 ( 1.628 0.000 -1.429) 2.166 6.751 ( 10.458 0.000 15.309) 18.540 6.772 ( -6.839 -0.000 10.168) 12.254 6.863 ( 5.717 0.000 -8.744) 10.447 7.186 ( -7.111 -0.000 10.384) 12.585 7.454 ( 3.379 0.000 -13.725) 14.135 7.571 ( 3.081 0.000 7.648) 8.245 7.971 ( 0.174 0.000 -16.698) 16.699 7.978 ( -6.380 -0.000 28.948) 29.642 8.341 ( 9.567 0.000 -32.297) 33.684 8.573 ( -16.664 -0.000 24.030) 29.243 8.679 ( -5.199 -0.000 -20.170) 20.829 9.160 ( -2.547 -0.000 0.407) 2.580 9.338 ( -1.822 -0.000 1.581) 2.412 9.777 ( 2.380 0.000 5.749) 6.222 10.303 ( -6.993 -0.000 -1.448) 7.142 10.498 ( 2.758 0.000 5.005) 5.714 10.524 ( 1.541 0.000 -5.459) 5.673 11.349 ( 9.038 0.000 0.932) 9.085 11.421 ( 0.610 0.000 10.314) 10.332 12.165 ( 1.399 0.000 -9.607) 9.708 12.353 ( -7.440 -0.000 16.239) 17.862 12.457 ( 6.747 0.000 -10.508) 12.487 12.832 ( -8.905 -0.000 -3.215) 9.468 13.662 ( -0.149 -0.000 2.656) 2.660 13.702 ( 2.030 0.000 4.981) 5.379 13.924 ( 10.063 0.000 -8.516) 13.183 14.452 ( 0.676 0.000 -1.113) 1.303 14.697 ( -9.787 -0.000 -1.840) 9.958 14.785 ( -8.130 -0.000 1.279) 8.230 15.622 ( 7.856 0.000 -2.676) 8.299 15.797 ( 4.730 0.000 -1.131) 4.863 16.228 ( 1.033 0.000 5.550) 5.645 16.653 ( -13.101 -0.000 3.403) 13.536 19.326 ( -13.054 -0.000 43.878) 45.779 19.707 ( 5.635 0.000 -45.258) 45.607 20.408 ( 13.436 0.000 -31.274) 34.038 20.472 ( -11.618 -0.000 31.031) 33.134 24.609 ( 7.129 0.000 -6.690) 9.777 25.144 ( -3.079 -0.000 10.782) 11.214 26.046 ( -9.715 -0.000 13.301) 16.471 26.169 ( 8.314 0.000 -19.705) 21.387 28.891 ( -1.575 -0.000 3.948) 4.250 29.165 ( -7.372 -0.000 -2.822) 7.894 30.089 ( 11.297 0.000 12.782) 17.058 30.602 ( 5.862 0.000 -12.491) 13.798 31.249 ( 5.406 0.000 -3.043) 6.204 31.370 ( -4.267 -0.000 3.979) 5.835 31.582 ( 2.878 0.000 -1.584) 3.285 31.994 ( -13.227 -0.000 2.076) 13.389 ======================= Grid point 357 (184/186) ======================= q-point: ( 0.50 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.954 ( -1.582 10.579 10.769) 15.179 3.032 ( 0.823 7.899 -12.807) 15.069 3.466 ( 13.328 2.126 -6.193) 14.850 3.532 ( 7.552 -1.642 -6.279) 9.957 3.898 ( 0.995 -1.338 0.261) 1.688 4.103 ( -15.232 0.930 1.732) 15.359 4.558 ( 3.358 2.560 -4.646) 6.278 4.624 ( -4.679 -0.272 3.730) 5.990 5.074 ( 10.599 2.234 9.314) 14.286 5.369 ( -1.187 4.007 -11.556) 12.288 6.420 ( 11.056 -0.350 4.280) 11.860 6.725 ( -9.945 -4.553 2.332) 11.183 6.864 ( 7.424 2.496 0.068) 7.833 6.937 ( 3.566 -1.892 0.679) 4.094 7.239 ( -1.490 -5.924 18.747) 19.717 7.445 ( 1.310 -3.625 -17.487) 17.907 7.652 ( 2.166 -1.467 8.018) 8.434 7.860 ( -6.709 -0.767 -11.024) 12.928 8.067 ( 1.577 1.018 25.433) 25.502 8.352 ( 13.586 -0.453 -27.693) 30.850 8.433 ( -12.782 3.142 1.684) 13.269 8.529 ( -11.022 -3.616 -3.346) 12.073 9.175 ( 3.383 -1.935 -1.149) 4.063 9.313 ( -6.257 -1.537 4.422) 7.815 9.848 ( 7.417 3.308 7.713) 11.200 10.163 ( -9.726 2.738 -5.068) 11.303 10.523 ( 3.288 -0.215 -0.345) 3.313 10.568 ( -0.277 -3.366 -0.467) 3.409 11.381 ( 6.640 7.532 0.073) 10.042 11.461 ( -1.442 3.424 5.574) 6.698 12.197 ( 6.445 -3.745 -7.088) 10.286 12.310 ( -5.511 0.745 9.138) 10.697 12.516 ( 4.648 -1.667 -5.585) 7.454 12.694 ( -10.436 0.035 -1.113) 10.495 13.630 ( 3.206 5.357 2.689) 6.797 13.712 ( -2.392 0.986 0.587) 2.653 14.142 ( 12.837 -10.435 -2.679) 16.758 14.440 ( -5.330 -4.596 -2.019) 7.321 14.604 ( -4.334 -0.281 1.051) 4.469 14.683 ( -6.368 1.795 -0.216) 6.620 15.711 ( 8.806 1.974 -0.803) 9.060 15.832 ( 0.692 0.163 -1.274) 1.459 16.268 ( 2.945 1.173 4.621) 5.603 16.474 ( -11.063 3.257 0.031) 11.532 19.410 ( -11.442 -4.159 43.669) 45.335 19.588 ( 7.556 -2.318 -44.660) 45.354 20.405 ( 10.837 3.370 -23.091) 25.729 20.458 ( -10.211 1.207 22.717) 24.936 24.719 ( 13.263 -0.549 -4.559) 14.035 25.070 ( -13.683 -0.074 6.411) 15.111 26.032 ( -2.130 1.718 16.659) 16.882 26.162 ( 3.971 -0.408 -19.246) 19.655 28.930 ( 1.861 -2.654 4.109) 5.234 29.082 ( -6.521 -2.992 -3.497) 7.982 30.259 ( 8.916 3.847 13.397) 16.546 30.531 ( -1.015 5.240 -13.819) 14.814 31.328 ( 4.701 -3.158 -1.681) 5.908 31.365 ( -1.049 -1.077 4.671) 4.907 31.644 ( 3.375 -3.558 -0.825) 4.973 31.828 ( -10.568 1.306 -0.811) 10.679 ======================= Grid point 358 (185/186) ======================= q-point: (-0.38 -0.62 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.837 ( -0.597 12.529 -8.449) 15.123 2.837 ( 0.597 12.529 8.449) 15.123 3.516 ( -3.047 4.780 -2.108) 6.048 3.516 ( 3.047 4.780 2.108) 6.048 3.992 ( 8.176 -3.995 -14.216) 16.878 3.992 ( -8.176 -3.995 14.216) 16.878 4.542 ( 3.463 4.542 -9.300) 10.914 4.542 ( -3.463 4.542 9.300) 10.914 5.167 ( -3.643 5.725 -11.688) 13.514 5.167 ( 3.643 5.725 11.688) 13.514 6.630 ( -13.502 -3.130 -2.114) 14.020 6.630 ( 13.502 -3.130 2.114) 14.020 6.954 ( -0.270 -0.237 -7.545) 7.553 6.954 ( 0.270 -0.237 7.545) 7.553 7.412 ( 1.082 -5.859 -20.808) 21.644 7.412 ( -1.082 -5.859 20.808) 21.644 7.767 ( -5.179 -3.890 -5.620) 8.575 7.767 ( 5.179 -3.890 5.620) 8.575 8.212 ( -5.536 3.135 -14.395) 15.738 8.212 ( 5.536 3.135 14.395) 15.738 8.444 ( 2.662 -2.663 -8.660) 9.443 8.444 ( -2.662 -2.663 8.660) 9.443 9.273 ( 4.590 -2.893 -2.038) 5.796 9.273 ( -4.590 -2.893 2.038) 5.796 9.943 ( -9.858 5.230 -9.222) 14.477 9.943 ( 9.858 5.230 9.222) 14.477 10.596 ( -0.634 -4.387 -3.567) 5.690 10.596 ( 0.634 -4.387 3.567) 5.690 11.336 ( 3.736 9.355 -3.962) 10.825 11.336 ( -3.736 9.355 3.962) 10.825 12.294 ( 2.594 -1.194 -5.397) 6.105 12.294 ( -2.594 -1.194 5.397) 6.105 12.581 ( -2.559 -1.135 -6.123) 6.733 12.581 ( 2.559 -1.135 6.123) 6.733 13.638 ( -4.200 2.577 -2.849) 5.692 13.638 ( 4.200 2.577 2.849) 5.692 14.454 ( -10.546 -12.777 0.840) 16.589 14.454 ( 10.546 -12.777 -0.840) 16.589 14.582 ( -0.231 3.263 -1.417) 3.565 14.582 ( 0.231 3.263 1.417) 3.565 15.777 ( -4.372 2.091 -1.227) 4.999 15.777 ( 4.372 2.091 1.227) 4.999 16.318 ( -5.159 2.327 -3.255) 6.529 16.318 ( 5.159 2.327 3.255) 6.529 19.547 ( 10.459 -5.388 -42.923) 44.506 19.547 ( -10.459 -5.388 42.923) 44.506 20.388 ( 13.450 4.059 -31.202) 34.219 20.388 ( -13.450 4.059 31.202) 34.219 24.901 ( -9.695 -0.802 1.405) 9.829 24.901 ( 9.695 -0.802 -1.405) 9.829 26.088 ( 0.169 1.302 -19.181) 19.226 26.088 ( -0.169 1.302 19.181) 19.226 29.049 ( -4.123 -5.292 -4.075) 7.849 29.049 ( 4.123 -5.292 4.075) 7.849 30.328 ( -5.192 8.246 -12.574) 15.908 30.328 ( 5.192 8.246 12.574) 15.908 31.399 ( 3.328 -1.665 -5.948) 7.016 31.399 ( -3.328 -1.665 5.948) 7.016 31.738 ( 2.359 -3.772 -4.781) 6.531 31.738 ( -2.359 -3.772 4.781) 6.531 ======================= Grid point 367 (186/186) ======================= q-point: (-0.50 -0.50 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.25e-05 1.25e-05 Number of triplets: 93 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.046 ( 4.101 0.000 -16.130) 16.643 3.046 ( -4.101 -0.000 16.130) 16.643 3.570 ( -0.701 -0.000 0.227) 0.737 3.570 ( 0.701 0.000 -0.227) 0.737 3.935 ( -7.468 -0.000 -3.790) 8.375 3.935 ( 7.468 0.000 3.790) 8.375 4.598 ( 5.932 0.000 -12.580) 13.909 4.598 ( -5.932 -0.000 12.580) 13.909 5.287 ( -7.664 -0.000 -13.255) 15.311 5.287 ( 7.664 0.000 13.255) 15.311 6.568 ( -10.409 -0.000 -2.933) 10.815 6.568 ( 10.409 0.000 2.933) 10.815 6.911 ( 3.657 0.000 -1.410) 3.919 6.911 ( -3.657 -0.000 1.410) 3.919 7.333 ( -0.056 -0.000 -29.192) 29.192 7.333 ( 0.056 0.000 29.192) 29.192 7.722 ( -4.469 -0.000 -9.922) 10.882 7.722 ( 4.469 0.000 9.922) 10.882 8.250 ( -4.322 -0.000 -32.083) 32.372 8.250 ( 4.322 0.000 32.083) 32.372 8.409 ( 16.953 0.000 -30.819) 35.174 8.409 ( -16.953 -0.000 30.819) 35.174 9.223 ( 7.380 0.000 -2.675) 7.850 9.223 ( -7.380 -0.000 2.675) 7.850 10.025 ( -10.175 -0.000 -7.375) 12.566 10.025 ( 10.175 0.000 7.375) 12.566 10.544 ( 1.449 0.000 -2.096) 2.548 10.544 ( -1.449 -0.000 2.096) 2.548 11.488 ( 2.458 0.000 -5.687) 6.195 11.488 ( -2.458 -0.000 5.687) 6.195 12.239 ( 9.871 0.000 -8.906) 13.295 12.239 ( -9.871 -0.000 8.906) 13.295 12.578 ( 9.698 0.000 -5.691) 11.244 12.578 ( -9.698 -0.000 5.691) 11.244 13.700 ( -1.786 -0.000 0.162) 1.793 13.700 ( 1.786 0.000 -0.162) 1.793 14.244 ( -13.641 -0.000 -2.159) 13.811 14.244 ( 13.641 0.000 2.159) 13.811 14.626 ( -3.591 -0.000 -1.672) 3.961 14.626 ( 3.591 0.000 1.672) 3.961 15.812 ( -4.110 -0.000 -0.811) 4.190 15.812 ( 4.110 0.000 0.811) 4.190 16.363 ( -7.820 -0.000 -2.732) 8.284 16.363 ( 7.820 0.000 2.732) 8.284 19.462 ( 9.174 0.000 -44.599) 45.533 19.462 ( -9.174 -0.000 44.599) 45.533 20.449 ( 13.195 0.000 -31.450) 34.106 20.449 ( -13.195 -0.000 31.450) 34.106 24.890 ( -16.606 -0.000 4.290) 17.151 24.890 ( 16.606 0.000 -4.290) 17.151 26.107 ( 2.179 0.000 -19.518) 19.639 26.107 ( -2.179 -0.000 19.518) 19.639 28.971 ( -4.384 -0.000 -4.384) 6.200 28.971 ( 4.384 0.000 4.384) 6.200 30.453 ( -5.962 -0.000 -14.441) 15.623 30.453 ( 5.962 0.000 14.441) 15.623 31.344 ( 2.601 0.000 -1.185) 2.858 31.344 ( -2.601 -0.000 1.185) 2.858 31.705 ( -7.964 -0.000 -2.227) 8.270 31.705 ( 7.964 0.000 2.227) 8.270 =================== 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 3/38400 10.0 1042.842 1140.617 1808.500 0.000 860.308 0.000 3/38400 20.0 389.969 427.350 481.726 0.000 146.267 0.000 3/38400 30.0 168.758 188.400 203.377 0.000 33.685 0.000 3/38400 40.0 94.749 105.573 117.077 0.000 10.132 0.000 3/38400 50.0 61.443 68.034 79.110 0.000 3.180 0.000 3/38400 60.0 43.611 47.903 58.504 0.000 0.675 0.000 3/38400 70.0 32.948 35.861 45.823 0.000 -0.343 0.000 3/38400 80.0 26.050 28.086 37.347 0.000 -0.778 0.000 3/38400 90.0 21.319 22.773 31.339 0.000 -0.960 0.000 3/38400 100.0 17.922 18.978 26.892 0.000 -1.024 0.000 3/38400 110.0 15.393 16.171 23.491 0.000 -1.030 0.000 3/38400 120.0 13.453 14.032 20.821 0.000 -1.010 0.000 3/38400 130.0 11.929 12.361 18.681 0.000 -0.977 0.000 3/38400 140.0 10.706 11.028 16.936 0.000 -0.941 0.000 3/38400 150.0 9.707 9.946 15.492 0.000 -0.904 0.000 3/38400 160.0 8.879 9.052 14.282 0.000 -0.869 0.000 3/38400 170.0 8.183 8.304 13.255 0.000 -0.837 0.000 3/38400 180.0 7.592 7.670 12.376 0.000 -0.808 0.000 3/38400 190.0 7.084 7.127 11.615 0.000 -0.782 0.000 3/38400 200.0 6.644 6.657 10.952 0.000 -0.758 0.000 3/38400 210.0 6.259 6.247 10.370 0.000 -0.736 0.000 3/38400 220.0 5.919 5.887 9.854 0.000 -0.716 0.000 3/38400 230.0 5.619 5.567 9.394 0.000 -0.698 0.000 3/38400 240.0 5.350 5.283 8.981 0.000 -0.682 0.000 3/38400 250.0 5.109 5.027 8.609 0.000 -0.667 0.000 3/38400 260.0 4.891 4.797 8.271 0.000 -0.652 0.000 3/38400 270.0 4.693 4.588 7.964 0.000 -0.639 0.000 3/38400 280.0 4.513 4.398 7.682 0.000 -0.627 0.000 3/38400 290.0 4.348 4.225 7.422 0.000 -0.615 0.000 3/38400 300.0 4.196 4.065 7.183 0.000 -0.604 0.000 3/38400 310.0 4.056 3.918 6.961 0.000 -0.593 0.000 3/38400 320.0 3.926 3.783 6.754 0.000 -0.583 0.000 3/38400 330.0 3.806 3.657 6.561 0.000 -0.573 0.000 3/38400 340.0 3.693 3.540 6.380 0.000 -0.563 0.000 3/38400 350.0 3.588 3.431 6.211 0.000 -0.554 0.000 3/38400 360.0 3.489 3.329 6.051 0.000 -0.545 0.000 3/38400 370.0 3.397 3.233 5.900 0.000 -0.536 0.000 3/38400 380.0 3.310 3.143 5.758 0.000 -0.528 0.000 3/38400 390.0 3.227 3.058 5.623 0.000 -0.520 0.000 3/38400 400.0 3.149 2.979 5.495 0.000 -0.512 0.000 3/38400 410.0 3.075 2.903 5.373 0.000 -0.504 0.000 3/38400 420.0 3.005 2.832 5.257 0.000 -0.497 0.000 3/38400 430.0 2.939 2.764 5.146 0.000 -0.490 0.000 3/38400 440.0 2.875 2.699 5.040 0.000 -0.483 0.000 3/38400 450.0 2.814 2.638 4.939 0.000 -0.476 0.000 3/38400 460.0 2.756 2.580 4.842 0.000 -0.469 0.000 3/38400 470.0 2.701 2.524 4.748 0.000 -0.462 0.000 3/38400 480.0 2.648 2.471 4.659 0.000 -0.456 0.000 3/38400 490.0 2.597 2.420 4.573 0.000 -0.450 0.000 3/38400 500.0 2.548 2.371 4.490 0.000 -0.443 0.000 3/38400 510.0 2.501 2.325 4.411 0.000 -0.437 0.000 3/38400 520.0 2.456 2.280 4.334 0.000 -0.431 0.000 3/38400 530.0 2.412 2.237 4.260 0.000 -0.426 0.000 3/38400 540.0 2.371 2.196 4.188 0.000 -0.420 0.000 3/38400 550.0 2.330 2.156 4.119 0.000 -0.415 0.000 3/38400 560.0 2.291 2.117 4.052 0.000 -0.409 0.000 3/38400 570.0 2.253 2.080 3.988 0.000 -0.404 0.000 3/38400 580.0 2.217 2.045 3.925 0.000 -0.399 0.000 3/38400 590.0 2.182 2.010 3.864 0.000 -0.394 0.000 3/38400 600.0 2.148 1.977 3.806 0.000 -0.389 0.000 3/38400 610.0 2.114 1.945 3.749 0.000 -0.384 0.000 3/38400 620.0 2.082 1.914 3.693 0.000 -0.379 0.000 3/38400 630.0 2.051 1.884 3.640 0.000 -0.375 0.000 3/38400 640.0 2.021 1.855 3.587 0.000 -0.370 0.000 3/38400 650.0 1.992 1.827 3.537 0.000 -0.366 0.000 3/38400 660.0 1.964 1.800 3.487 0.000 -0.362 0.000 3/38400 670.0 1.936 1.773 3.440 0.000 -0.357 0.000 3/38400 680.0 1.909 1.747 3.393 0.000 -0.353 0.000 3/38400 690.0 1.883 1.722 3.347 0.000 -0.349 0.000 3/38400 700.0 1.858 1.698 3.303 0.000 -0.345 0.000 3/38400 710.0 1.833 1.675 3.260 0.000 -0.341 0.000 3/38400 720.0 1.809 1.652 3.218 0.000 -0.337 0.000 3/38400 730.0 1.786 1.629 3.177 0.000 -0.334 0.000 3/38400 740.0 1.763 1.608 3.138 0.000 -0.330 0.000 3/38400 750.0 1.741 1.587 3.099 0.000 -0.326 0.000 3/38400 760.0 1.719 1.566 3.061 0.000 -0.323 0.000 3/38400 770.0 1.698 1.546 3.024 0.000 -0.319 0.000 3/38400 780.0 1.677 1.527 2.988 0.000 -0.316 0.000 3/38400 790.0 1.657 1.508 2.952 0.000 -0.313 0.000 3/38400 800.0 1.637 1.489 2.918 0.000 -0.309 0.000 3/38400 810.0 1.618 1.471 2.884 0.000 -0.306 0.000 3/38400 820.0 1.599 1.453 2.851 0.000 -0.303 0.000 3/38400 830.0 1.581 1.436 2.819 0.000 -0.300 0.000 3/38400 840.0 1.563 1.419 2.787 0.000 -0.297 0.000 3/38400 850.0 1.546 1.403 2.756 0.000 -0.294 0.000 3/38400 860.0 1.528 1.387 2.726 0.000 -0.291 0.000 3/38400 870.0 1.512 1.371 2.697 0.000 -0.288 0.000 3/38400 880.0 1.495 1.356 2.668 0.000 -0.285 0.000 3/38400 890.0 1.479 1.341 2.640 0.000 -0.283 0.000 3/38400 900.0 1.464 1.326 2.612 0.000 -0.280 0.000 3/38400 910.0 1.448 1.312 2.585 0.000 -0.277 0.000 3/38400 920.0 1.433 1.298 2.558 0.000 -0.275 0.000 3/38400 930.0 1.418 1.284 2.532 0.000 -0.272 0.000 3/38400 940.0 1.404 1.270 2.507 0.000 -0.269 0.000 3/38400 950.0 1.390 1.257 2.482 0.000 -0.267 0.000 3/38400 960.0 1.376 1.244 2.457 0.000 -0.265 0.000 3/38400 970.0 1.362 1.232 2.433 0.000 -0.262 0.000 3/38400 980.0 1.349 1.219 2.409 0.000 -0.260 0.000 3/38400 990.0 1.336 1.207 2.386 0.000 -0.257 0.000 3/38400 1000.0 1.323 1.195 2.364 0.000 -0.255 0.000 3/38400 Thermal conductivity related properties were written into "kappa-m8810.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 21:32:37]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|