----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 14:16:49]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 1 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pmna (53) Number of symmetry operations in supercell: 8 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 12.741145199999998 0.000000000000000 0.000000000000000 b 0.000000000000000 4.565224620000000 0.000000000000000 c 0.000000000000000 0.000000000000000 12.403882319999999 Atomic positions (fractional): *1 Tm 0.86453871565678 0.99777890339400 0.80601408647190 168.934 *2 Tm 0.63212302012343 0.00000000000000 0.00000000000000 168.934 3 Tm 0.13546128434322 0.00222109660600 0.19398591352809 168.934 4 Tm 0.13546128434322 0.99777890339400 0.80601408647190 168.934 5 Tm 0.13212302012343 0.00000000000000 0.50000000000000 168.934 6 Tm 0.36453871565678 0.99777890339400 0.69398591352810 168.934 7 Tm 0.36453871565678 0.00222109660600 0.30601408647190 168.934 8 Tm 0.86453871565678 0.00222109660600 0.19398591352809 168.934 9 Tm 0.36787697987657 0.00000000000000 0.00000000000000 168.934 10 Tm 0.86787697987657 0.00000000000000 0.50000000000000 168.934 11 Tm 0.63546128434322 0.00222109660600 0.30601408647190 168.934 12 Tm 0.63546128434322 0.99777890339400 0.69398591352810 168.934 *13 B 0.16169173482992 0.50000000000000 0.00000000000000 10.811 *14 B 0.29797068164826 0.53276736639311 0.15073222114947 10.811 15 B 0.79797068164826 0.46723263360689 0.65073222114947 10.811 16 B 0.70202931835174 0.46723263360689 0.84926777885053 10.811 *17 B 0.50000000000000 0.45685948783049 0.37320496653315 10.811 18 B 0.66169173482992 0.50000000000000 0.50000000000000 10.811 19 B 0.50000000000000 0.54314051216951 0.62679503346685 10.811 20 B 0.00000000000000 0.54314051216951 0.87320496653315 10.811 *21 B 0.50000000000000 0.53646494582378 0.85047609594852 10.811 22 B 0.20202931835174 0.53276736639311 0.34926777885053 10.811 23 B 0.33830826517008 0.50000000000000 0.50000000000000 10.811 24 B 0.83830826517008 0.50000000000000 0.00000000000000 10.811 25 B 0.00000000000000 0.46353505417622 0.35047609594852 10.811 26 B 0.00000000000000 0.53646494582378 0.64952390405148 10.811 27 B 0.79797068164826 0.53276736639311 0.34926777885053 10.811 28 B 0.20202931835174 0.46723263360689 0.65073222114947 10.811 29 B 0.50000000000000 0.46353505417622 0.14952390405148 10.811 30 B 0.29797068164826 0.46723263360689 0.84926777885053 10.811 31 B 0.70202931835174 0.53276736639311 0.15073222114947 10.811 32 B 0.00000000000000 0.45685948783049 0.12679503346685 10.811 *33 O 0.76673083872487 0.30713068364033 0.93571822759320 15.999 34 O 0.76673083872487 0.69286931635967 0.06428177240680 15.999 *35 O 0.40388815737447 0.33438109527899 0.42531327566666 15.999 *36 O 0.50000000000000 0.76202915657747 0.35989347580983 15.999 37 O 0.50000000000000 0.23797084342253 0.64010652419017 15.999 *38 O 0.59490671408930 0.33746355596868 0.85491223584074 15.999 39 O 0.59490671408930 0.66253644403132 0.14508776415926 15.999 *40 O 0.00000000000000 0.69649885350680 0.76106333662944 15.999 *41 O 0.79594214983555 0.21989916853513 0.34829953633683 15.999 42 O 0.09490671408930 0.66253644403132 0.35491223584074 15.999 43 O 0.00000000000000 0.30350114649320 0.23893666337056 15.999 44 O 0.26673083872487 0.30713068364033 0.56428177240680 15.999 45 O 0.73326916127513 0.69286931635967 0.43571822759320 15.999 46 O 0.40509328591070 0.33746355596868 0.85491223584074 15.999 47 O 0.20405785016445 0.78010083146487 0.65170046366317 15.999 *48 O 0.75000000000000 0.66040434189395 0.25000000000000 15.999 49 O 0.59611184262553 0.33438109527899 0.42531327566666 15.999 50 O 0.73326916127513 0.30713068364033 0.56428177240680 15.999 51 O 0.09490671408930 0.33746355596868 0.64508776415926 15.999 52 O 0.70405785016445 0.21989916853513 0.15170046366317 15.999 53 O 0.90509328591070 0.66253644403132 0.35491223584074 15.999 54 O 0.75000000000000 0.33959565810605 0.75000000000000 15.999 55 O 0.29594214983555 0.21989916853513 0.15170046366317 15.999 56 O 0.09611184262553 0.66561890472101 0.92531327566666 15.999 57 O 0.40509328591070 0.66253644403132 0.14508776415926 15.999 58 O 0.25000000000000 0.66040434189395 0.25000000000000 15.999 59 O 0.40388815737447 0.66561890472101 0.57468672433334 15.999 60 O 0.00000000000000 0.76202915657747 0.14010652419017 15.999 61 O 0.23326916127513 0.69286931635967 0.06428177240680 15.999 62 O 0.50000000000000 0.69649885350680 0.73893666337056 15.999 63 O 0.90509328591070 0.33746355596868 0.64508776415926 15.999 *64 O 0.50000000000000 0.24157147643315 0.06936343336490 15.999 65 O 0.59611184262553 0.66561890472101 0.57468672433334 15.999 66 O 0.00000000000000 0.23797084342253 0.85989347580983 15.999 67 O 0.29594214983555 0.78010083146487 0.84829953633683 15.999 68 O 0.90388815737447 0.66561890472101 0.92531327566666 15.999 69 O 0.79594214983555 0.78010083146487 0.65170046366317 15.999 70 O 0.50000000000000 0.30350114649320 0.26106333662944 15.999 71 O 0.00000000000000 0.75842852356685 0.56936343336490 15.999 72 O 0.23326916127513 0.30713068364033 0.93571822759320 15.999 73 O 0.09611184262553 0.33438109527899 0.07468672433334 15.999 74 O 0.50000000000000 0.75842852356685 0.93063656663510 15.999 75 O 0.00000000000000 0.24157147643315 0.43063656663510 15.999 76 O 0.25000000000000 0.33959565810605 0.75000000000000 15.999 77 O 0.20405785016445 0.21989916853513 0.34829953633683 15.999 78 O 0.70405785016445 0.78010083146487 0.84829953633683 15.999 79 O 0.26673083872487 0.69286931635967 0.43571822759320 15.999 80 O 0.90388815737447 0.33438109527899 0.07468672433334 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 12.741145199999998 0.000000000000000 0.000000000000000 b 0.000000000000000 4.565224620000000 0.000000000000000 c 0.000000000000000 0.000000000000000 12.403882319999999 Atomic positions (fractional): *1 Tm 0.86453871565678 0.99777890339400 0.80601408647190 168.934 > 1 *2 Tm 0.63212302012343 0.00000000000000 0.00000000000000 168.934 > 2 3 Tm 0.13546128434322 0.00222109660600 0.19398591352809 168.934 > 3 4 Tm 0.13546128434322 0.99777890339400 0.80601408647190 168.934 > 4 5 Tm 0.13212302012343 0.00000000000000 0.50000000000000 168.934 > 5 6 Tm 0.36453871565678 0.99777890339400 0.69398591352810 168.934 > 6 7 Tm 0.36453871565678 0.00222109660600 0.30601408647190 168.934 > 7 8 Tm 0.86453871565678 0.00222109660600 0.19398591352809 168.934 > 8 9 Tm 0.36787697987657 0.00000000000000 0.00000000000000 168.934 > 9 10 Tm 0.86787697987657 0.00000000000000 0.50000000000000 168.934 > 10 11 Tm 0.63546128434322 0.00222109660600 0.30601408647190 168.934 > 11 12 Tm 0.63546128434322 0.99777890339400 0.69398591352810 168.934 > 12 *13 B 0.16169173482992 0.50000000000000 0.00000000000000 10.811 > 13 *14 B 0.29797068164826 0.53276736639311 0.15073222114947 10.811 > 14 15 B 0.79797068164826 0.46723263360689 0.65073222114947 10.811 > 15 16 B 0.70202931835174 0.46723263360689 0.84926777885053 10.811 > 16 *17 B 0.50000000000000 0.45685948783049 0.37320496653315 10.811 > 17 18 B 0.66169173482992 0.50000000000000 0.50000000000000 10.811 > 18 19 B 0.50000000000000 0.54314051216951 0.62679503346685 10.811 > 19 20 B 0.00000000000000 0.54314051216951 0.87320496653315 10.811 > 20 *21 B 0.50000000000000 0.53646494582378 0.85047609594852 10.811 > 21 22 B 0.20202931835174 0.53276736639311 0.34926777885053 10.811 > 22 23 B 0.33830826517008 0.50000000000000 0.50000000000000 10.811 > 23 24 B 0.83830826517008 0.50000000000000 0.00000000000000 10.811 > 24 25 B 0.00000000000000 0.46353505417622 0.35047609594852 10.811 > 25 26 B 0.00000000000000 0.53646494582378 0.64952390405148 10.811 > 26 27 B 0.79797068164826 0.53276736639311 0.34926777885053 10.811 > 27 28 B 0.20202931835174 0.46723263360689 0.65073222114947 10.811 > 28 29 B 0.50000000000000 0.46353505417622 0.14952390405148 10.811 > 29 30 B 0.29797068164826 0.46723263360689 0.84926777885053 10.811 > 30 31 B 0.70202931835174 0.53276736639311 0.15073222114947 10.811 > 31 32 B 0.00000000000000 0.45685948783049 0.12679503346685 10.811 > 32 *33 O 0.76673083872487 0.30713068364033 0.93571822759320 15.999 > 33 34 O 0.76673083872487 0.69286931635967 0.06428177240680 15.999 > 34 *35 O 0.40388815737447 0.33438109527899 0.42531327566666 15.999 > 35 *36 O 0.50000000000000 0.76202915657747 0.35989347580983 15.999 > 36 37 O 0.50000000000000 0.23797084342253 0.64010652419017 15.999 > 37 *38 O 0.59490671408930 0.33746355596868 0.85491223584074 15.999 > 38 39 O 0.59490671408930 0.66253644403132 0.14508776415926 15.999 > 39 *40 O 0.00000000000000 0.69649885350680 0.76106333662944 15.999 > 40 *41 O 0.79594214983555 0.21989916853513 0.34829953633683 15.999 > 41 42 O 0.09490671408930 0.66253644403132 0.35491223584074 15.999 > 42 43 O 0.00000000000000 0.30350114649320 0.23893666337056 15.999 > 43 44 O 0.26673083872487 0.30713068364033 0.56428177240680 15.999 > 44 45 O 0.73326916127513 0.69286931635967 0.43571822759320 15.999 > 45 46 O 0.40509328591070 0.33746355596868 0.85491223584074 15.999 > 46 47 O 0.20405785016445 0.78010083146487 0.65170046366317 15.999 > 47 *48 O 0.75000000000000 0.66040434189395 0.25000000000000 15.999 > 48 49 O 0.59611184262553 0.33438109527899 0.42531327566666 15.999 > 49 50 O 0.73326916127513 0.30713068364033 0.56428177240680 15.999 > 50 51 O 0.09490671408930 0.33746355596868 0.64508776415926 15.999 > 51 52 O 0.70405785016445 0.21989916853513 0.15170046366317 15.999 > 52 53 O 0.90509328591070 0.66253644403132 0.35491223584074 15.999 > 53 54 O 0.75000000000000 0.33959565810605 0.75000000000000 15.999 > 54 55 O 0.29594214983555 0.21989916853513 0.15170046366317 15.999 > 55 56 O 0.09611184262553 0.66561890472101 0.92531327566666 15.999 > 56 57 O 0.40509328591070 0.66253644403132 0.14508776415926 15.999 > 57 58 O 0.25000000000000 0.66040434189395 0.25000000000000 15.999 > 58 59 O 0.40388815737447 0.66561890472101 0.57468672433334 15.999 > 59 60 O 0.00000000000000 0.76202915657747 0.14010652419017 15.999 > 60 61 O 0.23326916127513 0.69286931635967 0.06428177240680 15.999 > 61 62 O 0.50000000000000 0.69649885350680 0.73893666337056 15.999 > 62 63 O 0.90509328591070 0.33746355596868 0.64508776415926 15.999 > 63 *64 O 0.50000000000000 0.24157147643315 0.06936343336490 15.999 > 64 65 O 0.59611184262553 0.66561890472101 0.57468672433334 15.999 > 65 66 O 0.00000000000000 0.23797084342253 0.85989347580983 15.999 > 66 67 O 0.29594214983555 0.78010083146487 0.84829953633683 15.999 > 67 68 O 0.90388815737447 0.66561890472101 0.92531327566666 15.999 > 68 69 O 0.79594214983555 0.78010083146487 0.65170046366317 15.999 > 69 70 O 0.50000000000000 0.30350114649320 0.26106333662944 15.999 > 70 71 O 0.00000000000000 0.75842852356685 0.56936343336490 15.999 > 71 72 O 0.23326916127513 0.30713068364033 0.93571822759320 15.999 > 72 73 O 0.09611184262553 0.33438109527899 0.07468672433334 15.999 > 73 74 O 0.50000000000000 0.75842852356685 0.93063656663510 15.999 > 74 75 O 0.00000000000000 0.24157147643315 0.43063656663510 15.999 > 75 76 O 0.25000000000000 0.33959565810605 0.75000000000000 15.999 > 76 77 O 0.20405785016445 0.21989916853513 0.34829953633683 15.999 > 77 78 O 0.70405785016445 0.78010083146487 0.84829953633683 15.999 > 78 79 O 0.26673083872487 0.69286931635967 0.43571822759320 15.999 > 79 80 O 0.90388815737447 0.33438109527899 0.07468672433334 15.999 > 80 -------------------------------- super cell -------------------------------- Lattice vectors: a 12.741145199999998 0.000000000000000 0.000000000000000 b 0.000000000000000 4.565224620000000 0.000000000000000 c 0.000000000000000 0.000000000000000 12.403882319999999 Atomic positions (fractional): *1 Tm 0.86453871565678 0.99777890339400 0.80601408647190 168.934 > 1 *2 Tm 0.63212302012343 0.00000000000000 0.00000000000000 168.934 > 2 3 Tm 0.13546128434322 0.00222109660600 0.19398591352809 168.934 > 3 4 Tm 0.13546128434322 0.99777890339400 0.80601408647190 168.934 > 4 5 Tm 0.13212302012343 0.00000000000000 0.50000000000000 168.934 > 5 6 Tm 0.36453871565678 0.99777890339400 0.69398591352810 168.934 > 6 7 Tm 0.36453871565678 0.00222109660600 0.30601408647190 168.934 > 7 8 Tm 0.86453871565678 0.00222109660600 0.19398591352809 168.934 > 8 9 Tm 0.36787697987657 0.00000000000000 0.00000000000000 168.934 > 9 10 Tm 0.86787697987657 0.00000000000000 0.50000000000000 168.934 > 10 11 Tm 0.63546128434322 0.00222109660600 0.30601408647190 168.934 > 11 12 Tm 0.63546128434322 0.99777890339400 0.69398591352810 168.934 > 12 *13 B 0.16169173482992 0.50000000000000 0.00000000000000 10.811 > 13 *14 B 0.29797068164826 0.53276736639311 0.15073222114947 10.811 > 14 15 B 0.79797068164826 0.46723263360689 0.65073222114947 10.811 > 15 16 B 0.70202931835174 0.46723263360689 0.84926777885053 10.811 > 16 *17 B 0.50000000000000 0.45685948783049 0.37320496653315 10.811 > 17 18 B 0.66169173482992 0.50000000000000 0.50000000000000 10.811 > 18 19 B 0.50000000000000 0.54314051216951 0.62679503346685 10.811 > 19 20 B 0.00000000000000 0.54314051216951 0.87320496653315 10.811 > 20 *21 B 0.50000000000000 0.53646494582378 0.85047609594852 10.811 > 21 22 B 0.20202931835174 0.53276736639311 0.34926777885053 10.811 > 22 23 B 0.33830826517008 0.50000000000000 0.50000000000000 10.811 > 23 24 B 0.83830826517008 0.50000000000000 0.00000000000000 10.811 > 24 25 B 0.00000000000000 0.46353505417622 0.35047609594852 10.811 > 25 26 B 0.00000000000000 0.53646494582378 0.64952390405148 10.811 > 26 27 B 0.79797068164826 0.53276736639311 0.34926777885053 10.811 > 27 28 B 0.20202931835174 0.46723263360689 0.65073222114947 10.811 > 28 29 B 0.50000000000000 0.46353505417622 0.14952390405148 10.811 > 29 30 B 0.29797068164826 0.46723263360689 0.84926777885053 10.811 > 30 31 B 0.70202931835174 0.53276736639311 0.15073222114947 10.811 > 31 32 B 0.00000000000000 0.45685948783049 0.12679503346685 10.811 > 32 *33 O 0.76673083872487 0.30713068364033 0.93571822759320 15.999 > 33 34 O 0.76673083872487 0.69286931635967 0.06428177240680 15.999 > 34 *35 O 0.40388815737447 0.33438109527899 0.42531327566666 15.999 > 35 *36 O 0.50000000000000 0.76202915657747 0.35989347580983 15.999 > 36 37 O 0.50000000000000 0.23797084342253 0.64010652419017 15.999 > 37 *38 O 0.59490671408930 0.33746355596868 0.85491223584074 15.999 > 38 39 O 0.59490671408930 0.66253644403132 0.14508776415926 15.999 > 39 *40 O 0.00000000000000 0.69649885350680 0.76106333662944 15.999 > 40 *41 O 0.79594214983555 0.21989916853513 0.34829953633683 15.999 > 41 42 O 0.09490671408930 0.66253644403132 0.35491223584074 15.999 > 42 43 O 0.00000000000000 0.30350114649320 0.23893666337056 15.999 > 43 44 O 0.26673083872487 0.30713068364033 0.56428177240680 15.999 > 44 45 O 0.73326916127513 0.69286931635967 0.43571822759320 15.999 > 45 46 O 0.40509328591070 0.33746355596868 0.85491223584074 15.999 > 46 47 O 0.20405785016445 0.78010083146487 0.65170046366317 15.999 > 47 *48 O 0.75000000000000 0.66040434189395 0.25000000000000 15.999 > 48 49 O 0.59611184262553 0.33438109527899 0.42531327566666 15.999 > 49 50 O 0.73326916127513 0.30713068364033 0.56428177240680 15.999 > 50 51 O 0.09490671408930 0.33746355596868 0.64508776415926 15.999 > 51 52 O 0.70405785016445 0.21989916853513 0.15170046366317 15.999 > 52 53 O 0.90509328591070 0.66253644403132 0.35491223584074 15.999 > 53 54 O 0.75000000000000 0.33959565810605 0.75000000000000 15.999 > 54 55 O 0.29594214983555 0.21989916853513 0.15170046366317 15.999 > 55 56 O 0.09611184262553 0.66561890472101 0.92531327566666 15.999 > 56 57 O 0.40509328591070 0.66253644403132 0.14508776415926 15.999 > 57 58 O 0.25000000000000 0.66040434189395 0.25000000000000 15.999 > 58 59 O 0.40388815737447 0.66561890472101 0.57468672433334 15.999 > 59 60 O 0.00000000000000 0.76202915657747 0.14010652419017 15.999 > 60 61 O 0.23326916127513 0.69286931635967 0.06428177240680 15.999 > 61 62 O 0.50000000000000 0.69649885350680 0.73893666337056 15.999 > 62 63 O 0.90509328591070 0.33746355596868 0.64508776415926 15.999 > 63 *64 O 0.50000000000000 0.24157147643315 0.06936343336490 15.999 > 64 65 O 0.59611184262553 0.66561890472101 0.57468672433334 15.999 > 65 66 O 0.00000000000000 0.23797084342253 0.85989347580983 15.999 > 66 67 O 0.29594214983555 0.78010083146487 0.84829953633683 15.999 > 67 68 O 0.90388815737447 0.66561890472101 0.92531327566666 15.999 > 68 69 O 0.79594214983555 0.78010083146487 0.65170046366317 15.999 > 69 70 O 0.50000000000000 0.30350114649320 0.26106333662944 15.999 > 70 71 O 0.00000000000000 0.75842852356685 0.56936343336490 15.999 > 71 72 O 0.23326916127513 0.30713068364033 0.93571822759320 15.999 > 72 73 O 0.09611184262553 0.33438109527899 0.07468672433334 15.999 > 73 74 O 0.50000000000000 0.75842852356685 0.93063656663510 15.999 > 74 75 O 0.00000000000000 0.24157147643315 0.43063656663510 15.999 > 75 76 O 0.25000000000000 0.33959565810605 0.75000000000000 15.999 > 76 77 O 0.20405785016445 0.21989916853513 0.34829953633683 15.999 > 77 78 O 0.70405785016445 0.78010083146487 0.84829953633683 15.999 > 78 79 O 0.26673083872487 0.69286931635967 0.43571822759320 15.999 > 79 80 O 0.90388815737447 0.33438109527899 0.07468672433334 15.999 > 80 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.6715631 0.0000000 0.0000000 0.0000000 3.6581666 0.0000000 0.0000000 0.0000000 3.4791827 -------------------------- Born effective charges -------------------------- 1 Tm 3.9754949 -0.0294977 0.2287474 -0.0083454 3.8740412 -0.1369866 0.1354346 -0.1268572 3.1815253 2 Tm 3.7734164 0.0000000 0.0000000 -0.0000000 3.5759062 0.0548702 0.0000000 0.1308467 3.7565425 3 Tm 3.9754949 -0.0294977 0.2287474 -0.0083454 3.8740412 -0.1369866 0.1354346 -0.1268572 3.1815253 4 Tm 3.9754949 0.0294977 -0.2287474 0.0083454 3.8740412 -0.1369866 -0.1354346 -0.1268572 3.1815253 5 Tm 3.7734164 0.0000000 0.0000000 -0.0000000 3.5759062 -0.0548702 0.0000000 -0.1308467 3.7565425 6 Tm 3.9754949 -0.0294977 -0.2287474 -0.0083454 3.8740412 0.1369866 -0.1354346 0.1268572 3.1815253 7 Tm 3.9754949 0.0294977 0.2287474 0.0083454 3.8740412 0.1369866 0.1354346 0.1268572 3.1815253 8 Tm 3.9754949 0.0294977 -0.2287474 0.0083454 3.8740412 -0.1369866 -0.1354346 -0.1268572 3.1815253 9 Tm 3.7734164 0.0000000 0.0000000 -0.0000000 3.5759062 0.0548702 0.0000000 0.1308467 3.7565425 10 Tm 3.7734164 0.0000000 0.0000000 -0.0000000 3.5759062 -0.0548702 0.0000000 -0.1308467 3.7565425 11 Tm 3.9754949 -0.0294977 -0.2287474 -0.0083454 3.8740412 0.1369866 -0.1354346 0.1268572 3.1815253 12 Tm 3.9754949 0.0294977 0.2287474 0.0083454 3.8740412 0.1369866 0.1354346 0.1268572 3.1815253 13 B 2.6823983 0.0000000 0.0000000 -0.0000000 2.1578760 0.0267574 0.0000000 -0.1143542 3.0680834 14 B 2.3292242 -0.0672076 -0.0584436 -0.1210870 2.6885425 0.0753527 -0.0500945 -0.0540490 2.1827415 15 B 2.3292242 0.0672076 -0.0584436 0.1210870 2.6885425 -0.0753527 -0.0500945 0.0540490 2.1827415 16 B 2.3292242 -0.0672076 -0.0584436 -0.1210870 2.6885425 0.0753527 -0.0500945 -0.0540490 2.1827415 17 B 2.6496855 0.0000000 0.0000000 -0.0000000 2.6895255 0.0271434 0.0000000 -0.1703266 2.2036940 18 B 2.6823983 0.0000000 0.0000000 -0.0000000 2.1578760 -0.0267574 0.0000000 0.1143542 3.0680834 19 B 2.6496855 0.0000000 0.0000000 -0.0000000 2.6895255 0.0271434 0.0000000 -0.1703266 2.2036940 20 B 2.6496855 0.0000000 0.0000000 -0.0000000 2.6895255 -0.0271434 0.0000000 0.1703266 2.2036940 21 B 2.6123114 0.0000000 0.0000000 -0.0000000 2.7225266 0.1728446 0.0000000 0.1327173 2.6601231 22 B 2.3292242 0.0672076 -0.0584436 0.1210870 2.6885425 -0.0753527 -0.0500945 0.0540490 2.1827415 23 B 2.6823983 0.0000000 0.0000000 -0.0000000 2.1578760 -0.0267574 0.0000000 0.1143542 3.0680834 24 B 2.6823983 0.0000000 0.0000000 -0.0000000 2.1578760 0.0267574 0.0000000 -0.1143542 3.0680834 25 B 2.6123114 0.0000000 0.0000000 -0.0000000 2.7225266 -0.1728446 0.0000000 -0.1327173 2.6601231 26 B 2.6123114 0.0000000 0.0000000 -0.0000000 2.7225266 -0.1728446 0.0000000 -0.1327173 2.6601231 27 B 2.3292242 -0.0672076 0.0584436 -0.1210870 2.6885425 -0.0753527 0.0500945 0.0540490 2.1827415 28 B 2.3292242 -0.0672076 0.0584436 -0.1210870 2.6885425 -0.0753527 0.0500945 0.0540490 2.1827415 29 B 2.6123114 0.0000000 0.0000000 -0.0000000 2.7225266 0.1728446 0.0000000 0.1327173 2.6601231 30 B 2.3292242 0.0672076 0.0584436 0.1210870 2.6885425 0.0753527 0.0500945 -0.0540490 2.1827415 31 B 2.3292242 0.0672076 0.0584436 0.1210870 2.6885425 0.0753527 0.0500945 -0.0540490 2.1827415 32 B 2.6496855 0.0000000 0.0000000 -0.0000000 2.6895255 -0.0271434 0.0000000 0.1703266 2.2036940 33 O -1.9608989 -0.1829731 -0.2536853 -0.1880894 -1.7841080 -0.1145246 -0.3112119 -0.0304055 -1.9915288 34 O -1.9608989 0.1829731 0.2536853 0.1880894 -1.7841080 -0.1145246 0.3112119 -0.0304055 -1.9915288 35 O -2.0746556 -0.1257515 0.5567131 -0.1130508 -1.7199358 -0.5450862 0.5717778 -0.5068543 -2.0385124 36 O -2.3484676 0.0000000 0.0000000 -0.0000000 -2.6579763 0.4456282 0.0000000 0.3777036 -1.1826609 37 O -2.3484676 0.0000000 0.0000000 -0.0000000 -2.6579763 0.4456282 0.0000000 0.3777036 -1.1826609 38 O -2.3344730 0.1935696 -0.0108837 0.3063152 -1.8623306 0.0585052 0.0440243 0.1062651 -1.5004621 39 O -2.3344730 -0.1935696 0.0108837 -0.3063152 -1.8623306 0.0585052 -0.0440243 0.1062651 -1.5004621 40 O -1.7967438 0.0000000 0.0000000 -0.0000000 -1.8264288 -0.0691842 0.0000000 -0.2406972 -2.3445211 41 O -1.7392078 -0.0126995 -0.1518091 -0.0125714 -2.5187988 -0.0595721 -0.1270557 -0.0585253 -1.8065922 42 O -2.3344730 -0.1935696 -0.0108837 -0.3063152 -1.8623306 -0.0585052 0.0440243 -0.1062651 -1.5004621 43 O -1.7967438 0.0000000 0.0000000 -0.0000000 -1.8264288 -0.0691842 0.0000000 -0.2406972 -2.3445211 44 O -1.9608989 -0.1829731 0.2536853 -0.1880894 -1.7841080 0.1145246 0.3112119 0.0304055 -1.9915288 45 O -1.9608989 -0.1829731 0.2536853 -0.1880894 -1.7841080 0.1145246 0.3112119 0.0304055 -1.9915288 46 O -2.3344730 -0.1935696 0.0108837 -0.3063152 -1.8623306 0.0585052 -0.0440243 0.1062651 -1.5004621 47 O -1.7392078 -0.0126995 -0.1518091 -0.0125714 -2.5187988 -0.0595721 -0.1270557 -0.0585253 -1.8065922 48 O -1.8103503 0.0000000 -0.3787583 -0.0000000 -1.9161658 -0.0000000 -0.3537318 0.0000000 -2.2720448 49 O -2.0746556 0.1257515 -0.5567131 0.1130508 -1.7199358 -0.5450862 -0.5717778 -0.5068543 -2.0385124 50 O -1.9608989 0.1829731 -0.2536853 0.1880894 -1.7841080 0.1145246 -0.3112119 0.0304055 -1.9915288 51 O -2.3344730 0.1935696 0.0108837 0.3063152 -1.8623306 -0.0585052 -0.0440243 -0.1062651 -1.5004621 52 O -1.7392078 0.0126995 -0.1518091 0.0125714 -2.5187988 0.0595721 -0.1270557 0.0585253 -1.8065922 53 O -2.3344730 0.1935696 0.0108837 0.3063152 -1.8623306 -0.0585052 -0.0440243 -0.1062651 -1.5004621 54 O -1.8103503 0.0000000 0.3787583 -0.0000000 -1.9161658 -0.0000000 0.3537318 0.0000000 -2.2720448 55 O -1.7392078 -0.0126995 0.1518091 -0.0125714 -2.5187988 0.0595721 0.1270557 0.0585253 -1.8065922 56 O -2.0746556 -0.1257515 -0.5567131 -0.1130508 -1.7199358 0.5450862 -0.5717778 0.5068543 -2.0385124 57 O -2.3344730 0.1935696 -0.0108837 0.3063152 -1.8623306 0.0585052 0.0440243 0.1062651 -1.5004621 58 O -1.8103503 0.0000000 0.3787583 -0.0000000 -1.9161658 -0.0000000 0.3537318 0.0000000 -2.2720448 59 O -2.0746556 0.1257515 -0.5567131 0.1130508 -1.7199358 -0.5450862 -0.5717778 -0.5068543 -2.0385124 60 O -2.3484676 0.0000000 0.0000000 -0.0000000 -2.6579763 -0.4456282 0.0000000 -0.3777036 -1.1826609 61 O -1.9608989 -0.1829731 -0.2536853 -0.1880894 -1.7841080 -0.1145246 -0.3112119 -0.0304055 -1.9915288 62 O -1.7967438 0.0000000 0.0000000 -0.0000000 -1.8264288 0.0691842 0.0000000 0.2406972 -2.3445211 63 O -2.3344730 -0.1935696 -0.0108837 -0.3063152 -1.8623306 -0.0585052 0.0440243 -0.1062651 -1.5004621 64 O -2.1532178 0.0000000 0.0000000 -0.0000000 -2.1000846 -0.8272746 0.0000000 -0.8705378 -1.9435589 65 O -2.0746556 -0.1257515 0.5567131 -0.1130508 -1.7199358 -0.5450862 0.5717778 -0.5068543 -2.0385124 66 O -2.3484676 0.0000000 0.0000000 -0.0000000 -2.6579763 -0.4456282 0.0000000 -0.3777036 -1.1826609 67 O -1.7392078 0.0126995 -0.1518091 0.0125714 -2.5187988 0.0595721 -0.1270557 0.0585253 -1.8065922 68 O -2.0746556 0.1257515 0.5567131 0.1130508 -1.7199358 0.5450862 0.5717778 0.5068543 -2.0385124 69 O -1.7392078 0.0126995 0.1518091 0.0125714 -2.5187988 -0.0595721 0.1270557 -0.0585253 -1.8065922 70 O -1.7967438 0.0000000 0.0000000 -0.0000000 -1.8264288 0.0691842 0.0000000 0.2406972 -2.3445211 71 O -2.1532178 0.0000000 0.0000000 -0.0000000 -2.1000846 0.8272746 0.0000000 0.8705378 -1.9435589 72 O -1.9608989 0.1829731 0.2536853 0.1880894 -1.7841080 -0.1145246 0.3112119 -0.0304055 -1.9915288 73 O -2.0746556 0.1257515 0.5567131 0.1130508 -1.7199358 0.5450862 0.5717778 0.5068543 -2.0385124 74 O -2.1532178 0.0000000 0.0000000 -0.0000000 -2.1000846 -0.8272746 0.0000000 -0.8705378 -1.9435589 75 O -2.1532178 0.0000000 0.0000000 -0.0000000 -2.1000846 0.8272746 0.0000000 0.8705378 -1.9435589 76 O -1.8103503 0.0000000 -0.3787583 -0.0000000 -1.9161658 -0.0000000 -0.3537318 0.0000000 -2.2720448 77 O -1.7392078 0.0126995 0.1518091 0.0125714 -2.5187988 -0.0595721 0.1270557 -0.0585253 -1.8065922 78 O -1.7392078 -0.0126995 0.1518091 -0.0125714 -2.5187988 0.0595721 0.1270557 0.0585253 -1.8065922 79 O -1.9608989 0.1829731 -0.2536853 0.1880894 -1.7841080 0.1145246 -0.3112119 0.0304055 -1.9915288 80 O -2.0746556 -0.1257515 -0.5567131 -0.1130508 -1.7199358 0.5450862 -0.5717778 0.5068543 -2.0385124 ---------------------------------------------------------------------------- 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: 28680/28680 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3750 Number of blocks in projector: 3750 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: 856 Use submatrix version of eigh solver. (1) Block: 500 / 856 (2) Block: 250 / 500 (2) 224 eigenvectors found. (2) Block: 500 / 500 (2) 224 eigenvectors found. (2) Complementary block size: 52 (2) Compute compressed projector. (2) Use standard solver. (2) 26 eigenvectors found. (1) 474 eigenvectors found. (1) Block: 856 / 856 (1) 330 eigenvectors found. (1) Complementary block size: 52 (1) Compute compressed projector. (1) Use standard solver. (1) 26 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 744 Use submatrix version of eigh solver. (1) Block: 500 / 744 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 744 / 744 (1) 232 eigenvectors found. (1) Complementary block size: 26 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 740 Use submatrix version of eigh solver. (1) Block: 500 / 740 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 740 / 740 (1) 230 eigenvectors found. (1) Complementary block size: 22 (1) Compute compressed projector. (1) Use standard solver. (1) 10 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 470 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 470 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 470 Use standard eigh solver. Tree of FC basis block matrices: - (3750, 3656), data: False |-- (470, 456), data: True |-- (470, 456), data: True |-- (470, 456), data: True |-- (740, 728), data: False |-- (740, 10), data: (740, 22) @ (22, 10) |-- (240, 230), data: True |-- (500, 488), data: False |-- (500, 12), data: (500, 24) @ (24, 12) |-- (250, 238), data: True |-- (250, 238), data: True |-- (744, 730), data: False |-- (744, 12), data: (744, 26) @ (26, 12) |-- (244, 232), data: True |-- (500, 486), data: False |-- (500, 14), data: (500, 28) @ (28, 14) |-- (250, 236), data: True |-- (250, 236), data: True |-- (856, 830), data: False |-- (856, 26), data: (856, 52) @ (52, 26) |-- (356, 330), data: True |-- (500, 474), data: False |-- (500, 26), data: (500, 52) @ (52, 26) |-- (250, 224), data: True |-- (250, 224), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 1200 - Time: 0.742 Solver_block: 200 / 1200 - Time: 0.640 Solver_block: 300 / 1200 - Time: 0.638 Solver_block: 400 / 1200 - Time: 0.635 Solver_block: 500 / 1200 - Time: 0.635 Solver_block: 600 / 1200 - Time: 0.636 Solver_block: 700 / 1200 - Time: 0.632 Solver_block: 800 / 1200 - Time: 0.629 Solver_block: 900 / 1200 - Time: 0.633 Solver_block: 1000 / 1200 - Time: 0.638 Solver_block: 1100 / 1200 - Time: 0.637 Solver_block: 1200 / 1200 - Time: 0.639 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 7.914 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (yy) 0.00000000 (yy) Permutation basis: 240/240 Permutation basis: 28680/28680 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3750 Number of blocks in projector: 3750 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: 856 Use submatrix version of eigh solver. (1) Block: 500 / 856 (2) Block: 250 / 500 (2) 224 eigenvectors found. (2) Block: 500 / 500 (2) 224 eigenvectors found. (2) Complementary block size: 52 (2) Compute compressed projector. (2) Use standard solver. (2) 26 eigenvectors found. (1) 474 eigenvectors found. (1) Block: 856 / 856 (1) 330 eigenvectors found. (1) Complementary block size: 52 (1) Compute compressed projector. (1) Use standard solver. (1) 26 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 744 Use submatrix version of eigh solver. (1) Block: 500 / 744 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 744 / 744 (1) 232 eigenvectors found. (1) Complementary block size: 26 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 740 Use submatrix version of eigh solver. (1) Block: 500 / 740 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 740 / 740 (1) 230 eigenvectors found. (1) Complementary block size: 22 (1) Compute compressed projector. (1) Use standard solver. (1) 10 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 470 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 470 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 470 Use standard eigh solver. Tree of FC basis block matrices: - (3750, 3656), data: False |-- (470, 456), data: True |-- (470, 456), data: True |-- (470, 456), data: True |-- (740, 728), data: False |-- (740, 10), data: (740, 22) @ (22, 10) |-- (240, 230), data: True |-- (500, 488), data: False |-- (500, 12), data: (500, 24) @ (24, 12) |-- (250, 238), data: True |-- (250, 238), data: True |-- (744, 730), data: False |-- (744, 12), data: (744, 26) @ (26, 12) |-- (244, 232), data: True |-- (500, 486), data: False |-- (500, 14), data: (500, 28) @ (28, 14) |-- (250, 236), data: True |-- (250, 236), data: True |-- (856, 830), data: False |-- (856, 26), data: (856, 52) @ (52, 26) |-- (356, 330), data: True |-- (500, 474), data: False |-- (500, 26), data: (500, 52) @ (52, 26) |-- (250, 224), data: True |-- (250, 224), data: True Max drift after symmetrization by symfc projector: 0.00000000 (yy) 0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 14:17:34]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 14:17:35]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 1 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pmna (53) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 12.741145199999998 0.000000000000000 0.000000000000000 b 0.000000000000000 4.565224620000000 0.000000000000000 c 0.000000000000000 0.000000000000000 12.403882319999999 Atomic positions (fractional): 1 Tm 0.86453871565678 0.99777890339400 0.80601408647190 168.934 2 Tm 0.63212302012343 0.00000000000000 0.00000000000000 168.934 3 Tm 0.13546128434322 0.00222109660600 0.19398591352809 168.934 4 Tm 0.13546128434322 0.99777890339400 0.80601408647190 168.934 5 Tm 0.13212302012343 0.00000000000000 0.50000000000000 168.934 6 Tm 0.36453871565678 0.99777890339400 0.69398591352810 168.934 7 Tm 0.36453871565678 0.00222109660600 0.30601408647190 168.934 8 Tm 0.86453871565678 0.00222109660600 0.19398591352809 168.934 9 Tm 0.36787697987657 0.00000000000000 0.00000000000000 168.934 10 Tm 0.86787697987657 0.00000000000000 0.50000000000000 168.934 11 Tm 0.63546128434322 0.00222109660600 0.30601408647190 168.934 12 Tm 0.63546128434322 0.99777890339400 0.69398591352810 168.934 13 B 0.16169173482992 0.50000000000000 0.00000000000000 10.811 14 B 0.29797068164826 0.53276736639311 0.15073222114947 10.811 15 B 0.79797068164826 0.46723263360689 0.65073222114947 10.811 16 B 0.70202931835174 0.46723263360689 0.84926777885053 10.811 17 B 0.50000000000000 0.45685948783049 0.37320496653315 10.811 18 B 0.66169173482992 0.50000000000000 0.50000000000000 10.811 19 B 0.50000000000000 0.54314051216951 0.62679503346685 10.811 20 B 0.00000000000000 0.54314051216951 0.87320496653315 10.811 21 B 0.50000000000000 0.53646494582378 0.85047609594852 10.811 22 B 0.20202931835174 0.53276736639311 0.34926777885053 10.811 23 B 0.33830826517008 0.50000000000000 0.50000000000000 10.811 24 B 0.83830826517008 0.50000000000000 0.00000000000000 10.811 25 B 0.00000000000000 0.46353505417622 0.35047609594852 10.811 26 B 0.00000000000000 0.53646494582378 0.64952390405148 10.811 27 B 0.79797068164826 0.53276736639311 0.34926777885053 10.811 28 B 0.20202931835174 0.46723263360689 0.65073222114947 10.811 29 B 0.50000000000000 0.46353505417622 0.14952390405148 10.811 30 B 0.29797068164826 0.46723263360689 0.84926777885053 10.811 31 B 0.70202931835174 0.53276736639311 0.15073222114947 10.811 32 B 0.00000000000000 0.45685948783049 0.12679503346685 10.811 33 O 0.76673083872487 0.30713068364033 0.93571822759320 15.999 34 O 0.76673083872487 0.69286931635967 0.06428177240680 15.999 35 O 0.40388815737447 0.33438109527899 0.42531327566666 15.999 36 O 0.50000000000000 0.76202915657747 0.35989347580983 15.999 37 O 0.50000000000000 0.23797084342253 0.64010652419017 15.999 38 O 0.59490671408930 0.33746355596868 0.85491223584074 15.999 39 O 0.59490671408930 0.66253644403132 0.14508776415926 15.999 40 O 0.00000000000000 0.69649885350680 0.76106333662944 15.999 41 O 0.79594214983555 0.21989916853513 0.34829953633683 15.999 42 O 0.09490671408930 0.66253644403132 0.35491223584074 15.999 43 O 0.00000000000000 0.30350114649320 0.23893666337056 15.999 44 O 0.26673083872487 0.30713068364033 0.56428177240680 15.999 45 O 0.73326916127513 0.69286931635967 0.43571822759320 15.999 46 O 0.40509328591070 0.33746355596868 0.85491223584074 15.999 47 O 0.20405785016445 0.78010083146487 0.65170046366317 15.999 48 O 0.75000000000000 0.66040434189395 0.25000000000000 15.999 49 O 0.59611184262553 0.33438109527899 0.42531327566666 15.999 50 O 0.73326916127513 0.30713068364033 0.56428177240680 15.999 51 O 0.09490671408930 0.33746355596868 0.64508776415926 15.999 52 O 0.70405785016445 0.21989916853513 0.15170046366317 15.999 53 O 0.90509328591070 0.66253644403132 0.35491223584074 15.999 54 O 0.75000000000000 0.33959565810605 0.75000000000000 15.999 55 O 0.29594214983555 0.21989916853513 0.15170046366317 15.999 56 O 0.09611184262553 0.66561890472101 0.92531327566666 15.999 57 O 0.40509328591070 0.66253644403132 0.14508776415926 15.999 58 O 0.25000000000000 0.66040434189395 0.25000000000000 15.999 59 O 0.40388815737447 0.66561890472101 0.57468672433334 15.999 60 O 0.00000000000000 0.76202915657747 0.14010652419017 15.999 61 O 0.23326916127513 0.69286931635967 0.06428177240680 15.999 62 O 0.50000000000000 0.69649885350680 0.73893666337056 15.999 63 O 0.90509328591070 0.33746355596868 0.64508776415926 15.999 64 O 0.50000000000000 0.24157147643315 0.06936343336490 15.999 65 O 0.59611184262553 0.66561890472101 0.57468672433334 15.999 66 O 0.00000000000000 0.23797084342253 0.85989347580983 15.999 67 O 0.29594214983555 0.78010083146487 0.84829953633683 15.999 68 O 0.90388815737447 0.66561890472101 0.92531327566666 15.999 69 O 0.79594214983555 0.78010083146487 0.65170046366317 15.999 70 O 0.50000000000000 0.30350114649320 0.26106333662944 15.999 71 O 0.00000000000000 0.75842852356685 0.56936343336490 15.999 72 O 0.23326916127513 0.30713068364033 0.93571822759320 15.999 73 O 0.09611184262553 0.33438109527899 0.07468672433334 15.999 74 O 0.50000000000000 0.75842852356685 0.93063656663510 15.999 75 O 0.00000000000000 0.24157147643315 0.43063656663510 15.999 76 O 0.25000000000000 0.33959565810605 0.75000000000000 15.999 77 O 0.20405785016445 0.21989916853513 0.34829953633683 15.999 78 O 0.70405785016445 0.78010083146487 0.84829953633683 15.999 79 O 0.26673083872487 0.69286931635967 0.43571822759320 15.999 80 O 0.90388815737447 0.33438109527899 0.07468672433334 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.741145199999998 0.000000000000000 0.000000000000000 b 0.000000000000000 4.565224620000000 0.000000000000000 c 0.000000000000000 0.000000000000000 12.403882319999999 Atomic positions (fractional): 1 Tm 0.86453871565678 0.99777890339400 0.80601408647190 168.934 > 1 2 Tm 0.63212302012343 0.00000000000000 0.00000000000000 168.934 > 2 3 Tm 0.13546128434322 0.00222109660600 0.19398591352809 168.934 > 3 4 Tm 0.13546128434322 0.99777890339400 0.80601408647190 168.934 > 4 5 Tm 0.13212302012343 0.00000000000000 0.50000000000000 168.934 > 5 6 Tm 0.36453871565678 0.99777890339400 0.69398591352810 168.934 > 6 7 Tm 0.36453871565678 0.00222109660600 0.30601408647190 168.934 > 7 8 Tm 0.86453871565678 0.00222109660600 0.19398591352809 168.934 > 8 9 Tm 0.36787697987657 0.00000000000000 0.00000000000000 168.934 > 9 10 Tm 0.86787697987657 0.00000000000000 0.50000000000000 168.934 > 10 11 Tm 0.63546128434322 0.00222109660600 0.30601408647190 168.934 > 11 12 Tm 0.63546128434322 0.99777890339400 0.69398591352810 168.934 > 12 13 B 0.16169173482992 0.50000000000000 0.00000000000000 10.811 > 13 14 B 0.29797068164826 0.53276736639311 0.15073222114947 10.811 > 14 15 B 0.79797068164826 0.46723263360689 0.65073222114947 10.811 > 15 16 B 0.70202931835174 0.46723263360689 0.84926777885053 10.811 > 16 17 B 0.50000000000000 0.45685948783049 0.37320496653315 10.811 > 17 18 B 0.66169173482992 0.50000000000000 0.50000000000000 10.811 > 18 19 B 0.50000000000000 0.54314051216951 0.62679503346685 10.811 > 19 20 B 0.00000000000000 0.54314051216951 0.87320496653315 10.811 > 20 21 B 0.50000000000000 0.53646494582378 0.85047609594852 10.811 > 21 22 B 0.20202931835174 0.53276736639311 0.34926777885053 10.811 > 22 23 B 0.33830826517008 0.50000000000000 0.50000000000000 10.811 > 23 24 B 0.83830826517008 0.50000000000000 0.00000000000000 10.811 > 24 25 B 0.00000000000000 0.46353505417622 0.35047609594852 10.811 > 25 26 B 0.00000000000000 0.53646494582378 0.64952390405148 10.811 > 26 27 B 0.79797068164826 0.53276736639311 0.34926777885053 10.811 > 27 28 B 0.20202931835174 0.46723263360689 0.65073222114947 10.811 > 28 29 B 0.50000000000000 0.46353505417622 0.14952390405148 10.811 > 29 30 B 0.29797068164826 0.46723263360689 0.84926777885053 10.811 > 30 31 B 0.70202931835174 0.53276736639311 0.15073222114947 10.811 > 31 32 B 0.00000000000000 0.45685948783049 0.12679503346685 10.811 > 32 33 O 0.76673083872487 0.30713068364033 0.93571822759320 15.999 > 33 34 O 0.76673083872487 0.69286931635967 0.06428177240680 15.999 > 34 35 O 0.40388815737447 0.33438109527899 0.42531327566666 15.999 > 35 36 O 0.50000000000000 0.76202915657747 0.35989347580983 15.999 > 36 37 O 0.50000000000000 0.23797084342253 0.64010652419017 15.999 > 37 38 O 0.59490671408930 0.33746355596868 0.85491223584074 15.999 > 38 39 O 0.59490671408930 0.66253644403132 0.14508776415926 15.999 > 39 40 O 0.00000000000000 0.69649885350680 0.76106333662944 15.999 > 40 41 O 0.79594214983555 0.21989916853513 0.34829953633683 15.999 > 41 42 O 0.09490671408930 0.66253644403132 0.35491223584074 15.999 > 42 43 O 0.00000000000000 0.30350114649320 0.23893666337056 15.999 > 43 44 O 0.26673083872487 0.30713068364033 0.56428177240680 15.999 > 44 45 O 0.73326916127513 0.69286931635967 0.43571822759320 15.999 > 45 46 O 0.40509328591070 0.33746355596868 0.85491223584074 15.999 > 46 47 O 0.20405785016445 0.78010083146487 0.65170046366317 15.999 > 47 48 O 0.75000000000000 0.66040434189395 0.25000000000000 15.999 > 48 49 O 0.59611184262553 0.33438109527899 0.42531327566666 15.999 > 49 50 O 0.73326916127513 0.30713068364033 0.56428177240680 15.999 > 50 51 O 0.09490671408930 0.33746355596868 0.64508776415926 15.999 > 51 52 O 0.70405785016445 0.21989916853513 0.15170046366317 15.999 > 52 53 O 0.90509328591070 0.66253644403132 0.35491223584074 15.999 > 53 54 O 0.75000000000000 0.33959565810605 0.75000000000000 15.999 > 54 55 O 0.29594214983555 0.21989916853513 0.15170046366317 15.999 > 55 56 O 0.09611184262553 0.66561890472101 0.92531327566666 15.999 > 56 57 O 0.40509328591070 0.66253644403132 0.14508776415926 15.999 > 57 58 O 0.25000000000000 0.66040434189395 0.25000000000000 15.999 > 58 59 O 0.40388815737447 0.66561890472101 0.57468672433334 15.999 > 59 60 O 0.00000000000000 0.76202915657747 0.14010652419017 15.999 > 60 61 O 0.23326916127513 0.69286931635967 0.06428177240680 15.999 > 61 62 O 0.50000000000000 0.69649885350680 0.73893666337056 15.999 > 62 63 O 0.90509328591070 0.33746355596868 0.64508776415926 15.999 > 63 64 O 0.50000000000000 0.24157147643315 0.06936343336490 15.999 > 64 65 O 0.59611184262553 0.66561890472101 0.57468672433334 15.999 > 65 66 O 0.00000000000000 0.23797084342253 0.85989347580983 15.999 > 66 67 O 0.29594214983555 0.78010083146487 0.84829953633683 15.999 > 67 68 O 0.90388815737447 0.66561890472101 0.92531327566666 15.999 > 68 69 O 0.79594214983555 0.78010083146487 0.65170046366317 15.999 > 69 70 O 0.50000000000000 0.30350114649320 0.26106333662944 15.999 > 70 71 O 0.00000000000000 0.75842852356685 0.56936343336490 15.999 > 71 72 O 0.23326916127513 0.30713068364033 0.93571822759320 15.999 > 72 73 O 0.09611184262553 0.33438109527899 0.07468672433334 15.999 > 73 74 O 0.50000000000000 0.75842852356685 0.93063656663510 15.999 > 74 75 O 0.00000000000000 0.24157147643315 0.43063656663510 15.999 > 75 76 O 0.25000000000000 0.33959565810605 0.75000000000000 15.999 > 76 77 O 0.20405785016445 0.21989916853513 0.34829953633683 15.999 > 77 78 O 0.70405785016445 0.78010083146487 0.84829953633683 15.999 > 78 79 O 0.26673083872487 0.69286931635967 0.43571822759320 15.999 > 79 80 O 0.90388815737447 0.33438109527899 0.07468672433334 15.999 > 80 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.6715631 0.0000000 0.0000000 0.0000000 3.6581666 0.0000000 0.0000000 0.0000000 3.4791827 -------------------------- Born effective charges -------------------------- 1 Tm 3.9754949 -0.0294977 0.2287474 -0.0083454 3.8740412 -0.1369866 0.1354346 -0.1268572 3.1815253 2 Tm 3.7734164 0.0000000 0.0000000 -0.0000000 3.5759062 0.0548702 0.0000000 0.1308467 3.7565425 3 Tm 3.9754949 -0.0294977 0.2287474 -0.0083454 3.8740412 -0.1369866 0.1354346 -0.1268572 3.1815253 4 Tm 3.9754949 0.0294977 -0.2287474 0.0083454 3.8740412 -0.1369866 -0.1354346 -0.1268572 3.1815253 5 Tm 3.7734164 0.0000000 0.0000000 -0.0000000 3.5759062 -0.0548702 0.0000000 -0.1308467 3.7565425 6 Tm 3.9754949 -0.0294977 -0.2287474 -0.0083454 3.8740412 0.1369866 -0.1354346 0.1268572 3.1815253 7 Tm 3.9754949 0.0294977 0.2287474 0.0083454 3.8740412 0.1369866 0.1354346 0.1268572 3.1815253 8 Tm 3.9754949 0.0294977 -0.2287474 0.0083454 3.8740412 -0.1369866 -0.1354346 -0.1268572 3.1815253 9 Tm 3.7734164 0.0000000 0.0000000 -0.0000000 3.5759062 0.0548702 0.0000000 0.1308467 3.7565425 10 Tm 3.7734164 0.0000000 0.0000000 -0.0000000 3.5759062 -0.0548702 0.0000000 -0.1308467 3.7565425 11 Tm 3.9754949 -0.0294977 -0.2287474 -0.0083454 3.8740412 0.1369866 -0.1354346 0.1268572 3.1815253 12 Tm 3.9754949 0.0294977 0.2287474 0.0083454 3.8740412 0.1369866 0.1354346 0.1268572 3.1815253 13 B 2.6823983 0.0000000 0.0000000 -0.0000000 2.1578760 0.0267574 0.0000000 -0.1143542 3.0680834 14 B 2.3292242 -0.0672076 -0.0584436 -0.1210870 2.6885425 0.0753527 -0.0500945 -0.0540490 2.1827415 15 B 2.3292242 0.0672076 -0.0584436 0.1210870 2.6885425 -0.0753527 -0.0500945 0.0540490 2.1827415 16 B 2.3292242 -0.0672076 -0.0584436 -0.1210870 2.6885425 0.0753527 -0.0500945 -0.0540490 2.1827415 17 B 2.6496855 0.0000000 0.0000000 -0.0000000 2.6895255 0.0271434 0.0000000 -0.1703266 2.2036940 18 B 2.6823983 0.0000000 0.0000000 -0.0000000 2.1578760 -0.0267574 0.0000000 0.1143542 3.0680834 19 B 2.6496855 0.0000000 0.0000000 -0.0000000 2.6895255 0.0271434 0.0000000 -0.1703266 2.2036940 20 B 2.6496855 0.0000000 0.0000000 -0.0000000 2.6895255 -0.0271434 0.0000000 0.1703266 2.2036940 21 B 2.6123114 0.0000000 0.0000000 -0.0000000 2.7225266 0.1728446 0.0000000 0.1327173 2.6601231 22 B 2.3292242 0.0672076 -0.0584436 0.1210870 2.6885425 -0.0753527 -0.0500945 0.0540490 2.1827415 23 B 2.6823983 0.0000000 0.0000000 -0.0000000 2.1578760 -0.0267574 0.0000000 0.1143542 3.0680834 24 B 2.6823983 0.0000000 0.0000000 -0.0000000 2.1578760 0.0267574 0.0000000 -0.1143542 3.0680834 25 B 2.6123114 0.0000000 0.0000000 -0.0000000 2.7225266 -0.1728446 0.0000000 -0.1327173 2.6601231 26 B 2.6123114 0.0000000 0.0000000 -0.0000000 2.7225266 -0.1728446 0.0000000 -0.1327173 2.6601231 27 B 2.3292242 -0.0672076 0.0584436 -0.1210870 2.6885425 -0.0753527 0.0500945 0.0540490 2.1827415 28 B 2.3292242 -0.0672076 0.0584436 -0.1210870 2.6885425 -0.0753527 0.0500945 0.0540490 2.1827415 29 B 2.6123114 0.0000000 0.0000000 -0.0000000 2.7225266 0.1728446 0.0000000 0.1327173 2.6601231 30 B 2.3292242 0.0672076 0.0584436 0.1210870 2.6885425 0.0753527 0.0500945 -0.0540490 2.1827415 31 B 2.3292242 0.0672076 0.0584436 0.1210870 2.6885425 0.0753527 0.0500945 -0.0540490 2.1827415 32 B 2.6496855 0.0000000 0.0000000 -0.0000000 2.6895255 -0.0271434 0.0000000 0.1703266 2.2036940 33 O -1.9608989 -0.1829731 -0.2536853 -0.1880894 -1.7841080 -0.1145246 -0.3112119 -0.0304055 -1.9915288 34 O -1.9608989 0.1829731 0.2536853 0.1880894 -1.7841080 -0.1145246 0.3112119 -0.0304055 -1.9915288 35 O -2.0746556 -0.1257515 0.5567131 -0.1130508 -1.7199358 -0.5450862 0.5717778 -0.5068543 -2.0385124 36 O -2.3484676 0.0000000 0.0000000 -0.0000000 -2.6579763 0.4456282 0.0000000 0.3777036 -1.1826609 37 O -2.3484676 0.0000000 0.0000000 -0.0000000 -2.6579763 0.4456282 0.0000000 0.3777036 -1.1826609 38 O -2.3344730 0.1935696 -0.0108837 0.3063152 -1.8623306 0.0585052 0.0440243 0.1062651 -1.5004621 39 O -2.3344730 -0.1935696 0.0108837 -0.3063152 -1.8623306 0.0585052 -0.0440243 0.1062651 -1.5004621 40 O -1.7967438 0.0000000 0.0000000 -0.0000000 -1.8264288 -0.0691842 0.0000000 -0.2406972 -2.3445211 41 O -1.7392078 -0.0126995 -0.1518091 -0.0125714 -2.5187988 -0.0595721 -0.1270557 -0.0585253 -1.8065922 42 O -2.3344730 -0.1935696 -0.0108837 -0.3063152 -1.8623306 -0.0585052 0.0440243 -0.1062651 -1.5004621 43 O -1.7967438 0.0000000 0.0000000 -0.0000000 -1.8264288 -0.0691842 0.0000000 -0.2406972 -2.3445211 44 O -1.9608989 -0.1829731 0.2536853 -0.1880894 -1.7841080 0.1145246 0.3112119 0.0304055 -1.9915288 45 O -1.9608989 -0.1829731 0.2536853 -0.1880894 -1.7841080 0.1145246 0.3112119 0.0304055 -1.9915288 46 O -2.3344730 -0.1935696 0.0108837 -0.3063152 -1.8623306 0.0585052 -0.0440243 0.1062651 -1.5004621 47 O -1.7392078 -0.0126995 -0.1518091 -0.0125714 -2.5187988 -0.0595721 -0.1270557 -0.0585253 -1.8065922 48 O -1.8103503 0.0000000 -0.3787583 -0.0000000 -1.9161658 -0.0000000 -0.3537318 0.0000000 -2.2720448 49 O -2.0746556 0.1257515 -0.5567131 0.1130508 -1.7199358 -0.5450862 -0.5717778 -0.5068543 -2.0385124 50 O -1.9608989 0.1829731 -0.2536853 0.1880894 -1.7841080 0.1145246 -0.3112119 0.0304055 -1.9915288 51 O -2.3344730 0.1935696 0.0108837 0.3063152 -1.8623306 -0.0585052 -0.0440243 -0.1062651 -1.5004621 52 O -1.7392078 0.0126995 -0.1518091 0.0125714 -2.5187988 0.0595721 -0.1270557 0.0585253 -1.8065922 53 O -2.3344730 0.1935696 0.0108837 0.3063152 -1.8623306 -0.0585052 -0.0440243 -0.1062651 -1.5004621 54 O -1.8103503 0.0000000 0.3787583 -0.0000000 -1.9161658 -0.0000000 0.3537318 0.0000000 -2.2720448 55 O -1.7392078 -0.0126995 0.1518091 -0.0125714 -2.5187988 0.0595721 0.1270557 0.0585253 -1.8065922 56 O -2.0746556 -0.1257515 -0.5567131 -0.1130508 -1.7199358 0.5450862 -0.5717778 0.5068543 -2.0385124 57 O -2.3344730 0.1935696 -0.0108837 0.3063152 -1.8623306 0.0585052 0.0440243 0.1062651 -1.5004621 58 O -1.8103503 0.0000000 0.3787583 -0.0000000 -1.9161658 -0.0000000 0.3537318 0.0000000 -2.2720448 59 O -2.0746556 0.1257515 -0.5567131 0.1130508 -1.7199358 -0.5450862 -0.5717778 -0.5068543 -2.0385124 60 O -2.3484676 0.0000000 0.0000000 -0.0000000 -2.6579763 -0.4456282 0.0000000 -0.3777036 -1.1826609 61 O -1.9608989 -0.1829731 -0.2536853 -0.1880894 -1.7841080 -0.1145246 -0.3112119 -0.0304055 -1.9915288 62 O -1.7967438 0.0000000 0.0000000 -0.0000000 -1.8264288 0.0691842 0.0000000 0.2406972 -2.3445211 63 O -2.3344730 -0.1935696 -0.0108837 -0.3063152 -1.8623306 -0.0585052 0.0440243 -0.1062651 -1.5004621 64 O -2.1532178 0.0000000 0.0000000 -0.0000000 -2.1000846 -0.8272746 0.0000000 -0.8705378 -1.9435589 65 O -2.0746556 -0.1257515 0.5567131 -0.1130508 -1.7199358 -0.5450862 0.5717778 -0.5068543 -2.0385124 66 O -2.3484676 0.0000000 0.0000000 -0.0000000 -2.6579763 -0.4456282 0.0000000 -0.3777036 -1.1826609 67 O -1.7392078 0.0126995 -0.1518091 0.0125714 -2.5187988 0.0595721 -0.1270557 0.0585253 -1.8065922 68 O -2.0746556 0.1257515 0.5567131 0.1130508 -1.7199358 0.5450862 0.5717778 0.5068543 -2.0385124 69 O -1.7392078 0.0126995 0.1518091 0.0125714 -2.5187988 -0.0595721 0.1270557 -0.0585253 -1.8065922 70 O -1.7967438 0.0000000 0.0000000 -0.0000000 -1.8264288 0.0691842 0.0000000 0.2406972 -2.3445211 71 O -2.1532178 0.0000000 0.0000000 -0.0000000 -2.1000846 0.8272746 0.0000000 0.8705378 -1.9435589 72 O -1.9608989 0.1829731 0.2536853 0.1880894 -1.7841080 -0.1145246 0.3112119 -0.0304055 -1.9915288 73 O -2.0746556 0.1257515 0.5567131 0.1130508 -1.7199358 0.5450862 0.5717778 0.5068543 -2.0385124 74 O -2.1532178 0.0000000 0.0000000 -0.0000000 -2.1000846 -0.8272746 0.0000000 -0.8705378 -1.9435589 75 O -2.1532178 0.0000000 0.0000000 -0.0000000 -2.1000846 0.8272746 0.0000000 0.8705378 -1.9435589 76 O -1.8103503 0.0000000 -0.3787583 -0.0000000 -1.9161658 -0.0000000 -0.3537318 0.0000000 -2.2720448 77 O -1.7392078 0.0126995 0.1518091 0.0125714 -2.5187988 -0.0595721 0.1270557 -0.0585253 -1.8065922 78 O -1.7392078 -0.0126995 0.1518091 -0.0125714 -2.5187988 0.0595721 0.1270557 0.0585253 -1.8065922 79 O -1.9608989 0.1829731 -0.2536853 0.1880894 -1.7841080 0.1145246 -0.3112119 0.0304055 -1.9915288 80 O -2.0746556 -0.1257515 -0.5567131 -0.1130508 -1.7199358 0.5450862 -0.5717778 0.5068543 -2.0385124 ---------------------------------------------------------------------------- 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 2, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 13, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 14, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 21, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 35, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 36, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 38, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 40, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 41, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 48, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 64, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000000 (yyy) 0.00000000 (yyy) 0.00000000 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 14:18:12]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 14:18:12]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 1 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pmna (53) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 12.741145199999998 0.000000000000000 0.000000000000000 b 0.000000000000000 4.565224620000000 0.000000000000000 c 0.000000000000000 0.000000000000000 12.403882319999999 Atomic positions (fractional): 1 Tm 0.86453871565678 0.99777890339400 0.80601408647190 168.934 2 Tm 0.63212302012343 0.00000000000000 0.00000000000000 168.934 3 Tm 0.13546128434322 0.00222109660600 0.19398591352809 168.934 4 Tm 0.13546128434322 0.99777890339400 0.80601408647190 168.934 5 Tm 0.13212302012343 0.00000000000000 0.50000000000000 168.934 6 Tm 0.36453871565678 0.99777890339400 0.69398591352810 168.934 7 Tm 0.36453871565678 0.00222109660600 0.30601408647190 168.934 8 Tm 0.86453871565678 0.00222109660600 0.19398591352809 168.934 9 Tm 0.36787697987657 0.00000000000000 0.00000000000000 168.934 10 Tm 0.86787697987657 0.00000000000000 0.50000000000000 168.934 11 Tm 0.63546128434322 0.00222109660600 0.30601408647190 168.934 12 Tm 0.63546128434322 0.99777890339400 0.69398591352810 168.934 13 B 0.16169173482992 0.50000000000000 0.00000000000000 10.811 14 B 0.29797068164826 0.53276736639311 0.15073222114947 10.811 15 B 0.79797068164826 0.46723263360689 0.65073222114947 10.811 16 B 0.70202931835174 0.46723263360689 0.84926777885053 10.811 17 B 0.50000000000000 0.45685948783049 0.37320496653315 10.811 18 B 0.66169173482992 0.50000000000000 0.50000000000000 10.811 19 B 0.50000000000000 0.54314051216951 0.62679503346685 10.811 20 B 0.00000000000000 0.54314051216951 0.87320496653315 10.811 21 B 0.50000000000000 0.53646494582378 0.85047609594852 10.811 22 B 0.20202931835174 0.53276736639311 0.34926777885053 10.811 23 B 0.33830826517008 0.50000000000000 0.50000000000000 10.811 24 B 0.83830826517008 0.50000000000000 0.00000000000000 10.811 25 B 0.00000000000000 0.46353505417622 0.35047609594852 10.811 26 B 0.00000000000000 0.53646494582378 0.64952390405148 10.811 27 B 0.79797068164826 0.53276736639311 0.34926777885053 10.811 28 B 0.20202931835174 0.46723263360689 0.65073222114947 10.811 29 B 0.50000000000000 0.46353505417622 0.14952390405148 10.811 30 B 0.29797068164826 0.46723263360689 0.84926777885053 10.811 31 B 0.70202931835174 0.53276736639311 0.15073222114947 10.811 32 B 0.00000000000000 0.45685948783049 0.12679503346685 10.811 33 O 0.76673083872487 0.30713068364033 0.93571822759320 15.999 34 O 0.76673083872487 0.69286931635967 0.06428177240680 15.999 35 O 0.40388815737447 0.33438109527899 0.42531327566666 15.999 36 O 0.50000000000000 0.76202915657747 0.35989347580983 15.999 37 O 0.50000000000000 0.23797084342253 0.64010652419017 15.999 38 O 0.59490671408930 0.33746355596868 0.85491223584074 15.999 39 O 0.59490671408930 0.66253644403132 0.14508776415926 15.999 40 O 0.00000000000000 0.69649885350680 0.76106333662944 15.999 41 O 0.79594214983555 0.21989916853513 0.34829953633683 15.999 42 O 0.09490671408930 0.66253644403132 0.35491223584074 15.999 43 O 0.00000000000000 0.30350114649320 0.23893666337056 15.999 44 O 0.26673083872487 0.30713068364033 0.56428177240680 15.999 45 O 0.73326916127513 0.69286931635967 0.43571822759320 15.999 46 O 0.40509328591070 0.33746355596868 0.85491223584074 15.999 47 O 0.20405785016445 0.78010083146487 0.65170046366317 15.999 48 O 0.75000000000000 0.66040434189395 0.25000000000000 15.999 49 O 0.59611184262553 0.33438109527899 0.42531327566666 15.999 50 O 0.73326916127513 0.30713068364033 0.56428177240680 15.999 51 O 0.09490671408930 0.33746355596868 0.64508776415926 15.999 52 O 0.70405785016445 0.21989916853513 0.15170046366317 15.999 53 O 0.90509328591070 0.66253644403132 0.35491223584074 15.999 54 O 0.75000000000000 0.33959565810605 0.75000000000000 15.999 55 O 0.29594214983555 0.21989916853513 0.15170046366317 15.999 56 O 0.09611184262553 0.66561890472101 0.92531327566666 15.999 57 O 0.40509328591070 0.66253644403132 0.14508776415926 15.999 58 O 0.25000000000000 0.66040434189395 0.25000000000000 15.999 59 O 0.40388815737447 0.66561890472101 0.57468672433334 15.999 60 O 0.00000000000000 0.76202915657747 0.14010652419017 15.999 61 O 0.23326916127513 0.69286931635967 0.06428177240680 15.999 62 O 0.50000000000000 0.69649885350680 0.73893666337056 15.999 63 O 0.90509328591070 0.33746355596868 0.64508776415926 15.999 64 O 0.50000000000000 0.24157147643315 0.06936343336490 15.999 65 O 0.59611184262553 0.66561890472101 0.57468672433334 15.999 66 O 0.00000000000000 0.23797084342253 0.85989347580983 15.999 67 O 0.29594214983555 0.78010083146487 0.84829953633683 15.999 68 O 0.90388815737447 0.66561890472101 0.92531327566666 15.999 69 O 0.79594214983555 0.78010083146487 0.65170046366317 15.999 70 O 0.50000000000000 0.30350114649320 0.26106333662944 15.999 71 O 0.00000000000000 0.75842852356685 0.56936343336490 15.999 72 O 0.23326916127513 0.30713068364033 0.93571822759320 15.999 73 O 0.09611184262553 0.33438109527899 0.07468672433334 15.999 74 O 0.50000000000000 0.75842852356685 0.93063656663510 15.999 75 O 0.00000000000000 0.24157147643315 0.43063656663510 15.999 76 O 0.25000000000000 0.33959565810605 0.75000000000000 15.999 77 O 0.20405785016445 0.21989916853513 0.34829953633683 15.999 78 O 0.70405785016445 0.78010083146487 0.84829953633683 15.999 79 O 0.26673083872487 0.69286931635967 0.43571822759320 15.999 80 O 0.90388815737447 0.33438109527899 0.07468672433334 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.741145199999998 0.000000000000000 0.000000000000000 b 0.000000000000000 4.565224620000000 0.000000000000000 c 0.000000000000000 0.000000000000000 12.403882319999999 Atomic positions (fractional): 1 Tm 0.86453871565678 0.99777890339400 0.80601408647190 168.934 > 1 2 Tm 0.63212302012343 0.00000000000000 0.00000000000000 168.934 > 2 3 Tm 0.13546128434322 0.00222109660600 0.19398591352809 168.934 > 3 4 Tm 0.13546128434322 0.99777890339400 0.80601408647190 168.934 > 4 5 Tm 0.13212302012343 0.00000000000000 0.50000000000000 168.934 > 5 6 Tm 0.36453871565678 0.99777890339400 0.69398591352810 168.934 > 6 7 Tm 0.36453871565678 0.00222109660600 0.30601408647190 168.934 > 7 8 Tm 0.86453871565678 0.00222109660600 0.19398591352809 168.934 > 8 9 Tm 0.36787697987657 0.00000000000000 0.00000000000000 168.934 > 9 10 Tm 0.86787697987657 0.00000000000000 0.50000000000000 168.934 > 10 11 Tm 0.63546128434322 0.00222109660600 0.30601408647190 168.934 > 11 12 Tm 0.63546128434322 0.99777890339400 0.69398591352810 168.934 > 12 13 B 0.16169173482992 0.50000000000000 0.00000000000000 10.811 > 13 14 B 0.29797068164826 0.53276736639311 0.15073222114947 10.811 > 14 15 B 0.79797068164826 0.46723263360689 0.65073222114947 10.811 > 15 16 B 0.70202931835174 0.46723263360689 0.84926777885053 10.811 > 16 17 B 0.50000000000000 0.45685948783049 0.37320496653315 10.811 > 17 18 B 0.66169173482992 0.50000000000000 0.50000000000000 10.811 > 18 19 B 0.50000000000000 0.54314051216951 0.62679503346685 10.811 > 19 20 B 0.00000000000000 0.54314051216951 0.87320496653315 10.811 > 20 21 B 0.50000000000000 0.53646494582378 0.85047609594852 10.811 > 21 22 B 0.20202931835174 0.53276736639311 0.34926777885053 10.811 > 22 23 B 0.33830826517008 0.50000000000000 0.50000000000000 10.811 > 23 24 B 0.83830826517008 0.50000000000000 0.00000000000000 10.811 > 24 25 B 0.00000000000000 0.46353505417622 0.35047609594852 10.811 > 25 26 B 0.00000000000000 0.53646494582378 0.64952390405148 10.811 > 26 27 B 0.79797068164826 0.53276736639311 0.34926777885053 10.811 > 27 28 B 0.20202931835174 0.46723263360689 0.65073222114947 10.811 > 28 29 B 0.50000000000000 0.46353505417622 0.14952390405148 10.811 > 29 30 B 0.29797068164826 0.46723263360689 0.84926777885053 10.811 > 30 31 B 0.70202931835174 0.53276736639311 0.15073222114947 10.811 > 31 32 B 0.00000000000000 0.45685948783049 0.12679503346685 10.811 > 32 33 O 0.76673083872487 0.30713068364033 0.93571822759320 15.999 > 33 34 O 0.76673083872487 0.69286931635967 0.06428177240680 15.999 > 34 35 O 0.40388815737447 0.33438109527899 0.42531327566666 15.999 > 35 36 O 0.50000000000000 0.76202915657747 0.35989347580983 15.999 > 36 37 O 0.50000000000000 0.23797084342253 0.64010652419017 15.999 > 37 38 O 0.59490671408930 0.33746355596868 0.85491223584074 15.999 > 38 39 O 0.59490671408930 0.66253644403132 0.14508776415926 15.999 > 39 40 O 0.00000000000000 0.69649885350680 0.76106333662944 15.999 > 40 41 O 0.79594214983555 0.21989916853513 0.34829953633683 15.999 > 41 42 O 0.09490671408930 0.66253644403132 0.35491223584074 15.999 > 42 43 O 0.00000000000000 0.30350114649320 0.23893666337056 15.999 > 43 44 O 0.26673083872487 0.30713068364033 0.56428177240680 15.999 > 44 45 O 0.73326916127513 0.69286931635967 0.43571822759320 15.999 > 45 46 O 0.40509328591070 0.33746355596868 0.85491223584074 15.999 > 46 47 O 0.20405785016445 0.78010083146487 0.65170046366317 15.999 > 47 48 O 0.75000000000000 0.66040434189395 0.25000000000000 15.999 > 48 49 O 0.59611184262553 0.33438109527899 0.42531327566666 15.999 > 49 50 O 0.73326916127513 0.30713068364033 0.56428177240680 15.999 > 50 51 O 0.09490671408930 0.33746355596868 0.64508776415926 15.999 > 51 52 O 0.70405785016445 0.21989916853513 0.15170046366317 15.999 > 52 53 O 0.90509328591070 0.66253644403132 0.35491223584074 15.999 > 53 54 O 0.75000000000000 0.33959565810605 0.75000000000000 15.999 > 54 55 O 0.29594214983555 0.21989916853513 0.15170046366317 15.999 > 55 56 O 0.09611184262553 0.66561890472101 0.92531327566666 15.999 > 56 57 O 0.40509328591070 0.66253644403132 0.14508776415926 15.999 > 57 58 O 0.25000000000000 0.66040434189395 0.25000000000000 15.999 > 58 59 O 0.40388815737447 0.66561890472101 0.57468672433334 15.999 > 59 60 O 0.00000000000000 0.76202915657747 0.14010652419017 15.999 > 60 61 O 0.23326916127513 0.69286931635967 0.06428177240680 15.999 > 61 62 O 0.50000000000000 0.69649885350680 0.73893666337056 15.999 > 62 63 O 0.90509328591070 0.33746355596868 0.64508776415926 15.999 > 63 64 O 0.50000000000000 0.24157147643315 0.06936343336490 15.999 > 64 65 O 0.59611184262553 0.66561890472101 0.57468672433334 15.999 > 65 66 O 0.00000000000000 0.23797084342253 0.85989347580983 15.999 > 66 67 O 0.29594214983555 0.78010083146487 0.84829953633683 15.999 > 67 68 O 0.90388815737447 0.66561890472101 0.92531327566666 15.999 > 68 69 O 0.79594214983555 0.78010083146487 0.65170046366317 15.999 > 69 70 O 0.50000000000000 0.30350114649320 0.26106333662944 15.999 > 70 71 O 0.00000000000000 0.75842852356685 0.56936343336490 15.999 > 71 72 O 0.23326916127513 0.30713068364033 0.93571822759320 15.999 > 72 73 O 0.09611184262553 0.33438109527899 0.07468672433334 15.999 > 73 74 O 0.50000000000000 0.75842852356685 0.93063656663510 15.999 > 74 75 O 0.00000000000000 0.24157147643315 0.43063656663510 15.999 > 75 76 O 0.25000000000000 0.33959565810605 0.75000000000000 15.999 > 76 77 O 0.20405785016445 0.21989916853513 0.34829953633683 15.999 > 77 78 O 0.70405785016445 0.78010083146487 0.84829953633683 15.999 > 78 79 O 0.26673083872487 0.69286931635967 0.43571822759320 15.999 > 79 80 O 0.90388815737447 0.33438109527899 0.07468672433334 15.999 > 80 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.6715631 0.0000000 0.0000000 0.0000000 3.6581666 0.0000000 0.0000000 0.0000000 3.4791827 -------------------------- Born effective charges -------------------------- 1 Tm 3.9754949 -0.0294977 0.2287474 -0.0083454 3.8740412 -0.1369866 0.1354346 -0.1268572 3.1815253 2 Tm 3.7734164 0.0000000 0.0000000 -0.0000000 3.5759062 0.0548702 0.0000000 0.1308467 3.7565425 3 Tm 3.9754949 -0.0294977 0.2287474 -0.0083454 3.8740412 -0.1369866 0.1354346 -0.1268572 3.1815253 4 Tm 3.9754949 0.0294977 -0.2287474 0.0083454 3.8740412 -0.1369866 -0.1354346 -0.1268572 3.1815253 5 Tm 3.7734164 0.0000000 0.0000000 -0.0000000 3.5759062 -0.0548702 0.0000000 -0.1308467 3.7565425 6 Tm 3.9754949 -0.0294977 -0.2287474 -0.0083454 3.8740412 0.1369866 -0.1354346 0.1268572 3.1815253 7 Tm 3.9754949 0.0294977 0.2287474 0.0083454 3.8740412 0.1369866 0.1354346 0.1268572 3.1815253 8 Tm 3.9754949 0.0294977 -0.2287474 0.0083454 3.8740412 -0.1369866 -0.1354346 -0.1268572 3.1815253 9 Tm 3.7734164 0.0000000 0.0000000 -0.0000000 3.5759062 0.0548702 0.0000000 0.1308467 3.7565425 10 Tm 3.7734164 0.0000000 0.0000000 -0.0000000 3.5759062 -0.0548702 0.0000000 -0.1308467 3.7565425 11 Tm 3.9754949 -0.0294977 -0.2287474 -0.0083454 3.8740412 0.1369866 -0.1354346 0.1268572 3.1815253 12 Tm 3.9754949 0.0294977 0.2287474 0.0083454 3.8740412 0.1369866 0.1354346 0.1268572 3.1815253 13 B 2.6823983 0.0000000 0.0000000 -0.0000000 2.1578760 0.0267574 0.0000000 -0.1143542 3.0680834 14 B 2.3292242 -0.0672076 -0.0584436 -0.1210870 2.6885425 0.0753527 -0.0500945 -0.0540490 2.1827415 15 B 2.3292242 0.0672076 -0.0584436 0.1210870 2.6885425 -0.0753527 -0.0500945 0.0540490 2.1827415 16 B 2.3292242 -0.0672076 -0.0584436 -0.1210870 2.6885425 0.0753527 -0.0500945 -0.0540490 2.1827415 17 B 2.6496855 0.0000000 0.0000000 -0.0000000 2.6895255 0.0271434 0.0000000 -0.1703266 2.2036940 18 B 2.6823983 0.0000000 0.0000000 -0.0000000 2.1578760 -0.0267574 0.0000000 0.1143542 3.0680834 19 B 2.6496855 0.0000000 0.0000000 -0.0000000 2.6895255 0.0271434 0.0000000 -0.1703266 2.2036940 20 B 2.6496855 0.0000000 0.0000000 -0.0000000 2.6895255 -0.0271434 0.0000000 0.1703266 2.2036940 21 B 2.6123114 0.0000000 0.0000000 -0.0000000 2.7225266 0.1728446 0.0000000 0.1327173 2.6601231 22 B 2.3292242 0.0672076 -0.0584436 0.1210870 2.6885425 -0.0753527 -0.0500945 0.0540490 2.1827415 23 B 2.6823983 0.0000000 0.0000000 -0.0000000 2.1578760 -0.0267574 0.0000000 0.1143542 3.0680834 24 B 2.6823983 0.0000000 0.0000000 -0.0000000 2.1578760 0.0267574 0.0000000 -0.1143542 3.0680834 25 B 2.6123114 0.0000000 0.0000000 -0.0000000 2.7225266 -0.1728446 0.0000000 -0.1327173 2.6601231 26 B 2.6123114 0.0000000 0.0000000 -0.0000000 2.7225266 -0.1728446 0.0000000 -0.1327173 2.6601231 27 B 2.3292242 -0.0672076 0.0584436 -0.1210870 2.6885425 -0.0753527 0.0500945 0.0540490 2.1827415 28 B 2.3292242 -0.0672076 0.0584436 -0.1210870 2.6885425 -0.0753527 0.0500945 0.0540490 2.1827415 29 B 2.6123114 0.0000000 0.0000000 -0.0000000 2.7225266 0.1728446 0.0000000 0.1327173 2.6601231 30 B 2.3292242 0.0672076 0.0584436 0.1210870 2.6885425 0.0753527 0.0500945 -0.0540490 2.1827415 31 B 2.3292242 0.0672076 0.0584436 0.1210870 2.6885425 0.0753527 0.0500945 -0.0540490 2.1827415 32 B 2.6496855 0.0000000 0.0000000 -0.0000000 2.6895255 -0.0271434 0.0000000 0.1703266 2.2036940 33 O -1.9608989 -0.1829731 -0.2536853 -0.1880894 -1.7841080 -0.1145246 -0.3112119 -0.0304055 -1.9915288 34 O -1.9608989 0.1829731 0.2536853 0.1880894 -1.7841080 -0.1145246 0.3112119 -0.0304055 -1.9915288 35 O -2.0746556 -0.1257515 0.5567131 -0.1130508 -1.7199358 -0.5450862 0.5717778 -0.5068543 -2.0385124 36 O -2.3484676 0.0000000 0.0000000 -0.0000000 -2.6579763 0.4456282 0.0000000 0.3777036 -1.1826609 37 O -2.3484676 0.0000000 0.0000000 -0.0000000 -2.6579763 0.4456282 0.0000000 0.3777036 -1.1826609 38 O -2.3344730 0.1935696 -0.0108837 0.3063152 -1.8623306 0.0585052 0.0440243 0.1062651 -1.5004621 39 O -2.3344730 -0.1935696 0.0108837 -0.3063152 -1.8623306 0.0585052 -0.0440243 0.1062651 -1.5004621 40 O -1.7967438 0.0000000 0.0000000 -0.0000000 -1.8264288 -0.0691842 0.0000000 -0.2406972 -2.3445211 41 O -1.7392078 -0.0126995 -0.1518091 -0.0125714 -2.5187988 -0.0595721 -0.1270557 -0.0585253 -1.8065922 42 O -2.3344730 -0.1935696 -0.0108837 -0.3063152 -1.8623306 -0.0585052 0.0440243 -0.1062651 -1.5004621 43 O -1.7967438 0.0000000 0.0000000 -0.0000000 -1.8264288 -0.0691842 0.0000000 -0.2406972 -2.3445211 44 O -1.9608989 -0.1829731 0.2536853 -0.1880894 -1.7841080 0.1145246 0.3112119 0.0304055 -1.9915288 45 O -1.9608989 -0.1829731 0.2536853 -0.1880894 -1.7841080 0.1145246 0.3112119 0.0304055 -1.9915288 46 O -2.3344730 -0.1935696 0.0108837 -0.3063152 -1.8623306 0.0585052 -0.0440243 0.1062651 -1.5004621 47 O -1.7392078 -0.0126995 -0.1518091 -0.0125714 -2.5187988 -0.0595721 -0.1270557 -0.0585253 -1.8065922 48 O -1.8103503 0.0000000 -0.3787583 -0.0000000 -1.9161658 -0.0000000 -0.3537318 0.0000000 -2.2720448 49 O -2.0746556 0.1257515 -0.5567131 0.1130508 -1.7199358 -0.5450862 -0.5717778 -0.5068543 -2.0385124 50 O -1.9608989 0.1829731 -0.2536853 0.1880894 -1.7841080 0.1145246 -0.3112119 0.0304055 -1.9915288 51 O -2.3344730 0.1935696 0.0108837 0.3063152 -1.8623306 -0.0585052 -0.0440243 -0.1062651 -1.5004621 52 O -1.7392078 0.0126995 -0.1518091 0.0125714 -2.5187988 0.0595721 -0.1270557 0.0585253 -1.8065922 53 O -2.3344730 0.1935696 0.0108837 0.3063152 -1.8623306 -0.0585052 -0.0440243 -0.1062651 -1.5004621 54 O -1.8103503 0.0000000 0.3787583 -0.0000000 -1.9161658 -0.0000000 0.3537318 0.0000000 -2.2720448 55 O -1.7392078 -0.0126995 0.1518091 -0.0125714 -2.5187988 0.0595721 0.1270557 0.0585253 -1.8065922 56 O -2.0746556 -0.1257515 -0.5567131 -0.1130508 -1.7199358 0.5450862 -0.5717778 0.5068543 -2.0385124 57 O -2.3344730 0.1935696 -0.0108837 0.3063152 -1.8623306 0.0585052 0.0440243 0.1062651 -1.5004621 58 O -1.8103503 0.0000000 0.3787583 -0.0000000 -1.9161658 -0.0000000 0.3537318 0.0000000 -2.2720448 59 O -2.0746556 0.1257515 -0.5567131 0.1130508 -1.7199358 -0.5450862 -0.5717778 -0.5068543 -2.0385124 60 O -2.3484676 0.0000000 0.0000000 -0.0000000 -2.6579763 -0.4456282 0.0000000 -0.3777036 -1.1826609 61 O -1.9608989 -0.1829731 -0.2536853 -0.1880894 -1.7841080 -0.1145246 -0.3112119 -0.0304055 -1.9915288 62 O -1.7967438 0.0000000 0.0000000 -0.0000000 -1.8264288 0.0691842 0.0000000 0.2406972 -2.3445211 63 O -2.3344730 -0.1935696 -0.0108837 -0.3063152 -1.8623306 -0.0585052 0.0440243 -0.1062651 -1.5004621 64 O -2.1532178 0.0000000 0.0000000 -0.0000000 -2.1000846 -0.8272746 0.0000000 -0.8705378 -1.9435589 65 O -2.0746556 -0.1257515 0.5567131 -0.1130508 -1.7199358 -0.5450862 0.5717778 -0.5068543 -2.0385124 66 O -2.3484676 0.0000000 0.0000000 -0.0000000 -2.6579763 -0.4456282 0.0000000 -0.3777036 -1.1826609 67 O -1.7392078 0.0126995 -0.1518091 0.0125714 -2.5187988 0.0595721 -0.1270557 0.0585253 -1.8065922 68 O -2.0746556 0.1257515 0.5567131 0.1130508 -1.7199358 0.5450862 0.5717778 0.5068543 -2.0385124 69 O -1.7392078 0.0126995 0.1518091 0.0125714 -2.5187988 -0.0595721 0.1270557 -0.0585253 -1.8065922 70 O -1.7967438 0.0000000 0.0000000 -0.0000000 -1.8264288 0.0691842 0.0000000 0.2406972 -2.3445211 71 O -2.1532178 0.0000000 0.0000000 -0.0000000 -2.1000846 0.8272746 0.0000000 0.8705378 -1.9435589 72 O -1.9608989 0.1829731 0.2536853 0.1880894 -1.7841080 -0.1145246 0.3112119 -0.0304055 -1.9915288 73 O -2.0746556 0.1257515 0.5567131 0.1130508 -1.7199358 0.5450862 0.5717778 0.5068543 -2.0385124 74 O -2.1532178 0.0000000 0.0000000 -0.0000000 -2.1000846 -0.8272746 0.0000000 -0.8705378 -1.9435589 75 O -2.1532178 0.0000000 0.0000000 -0.0000000 -2.1000846 0.8272746 0.0000000 0.8705378 -1.9435589 76 O -1.8103503 0.0000000 -0.3787583 -0.0000000 -1.9161658 -0.0000000 -0.3537318 0.0000000 -2.2720448 77 O -1.7392078 0.0126995 0.1518091 0.0125714 -2.5187988 -0.0595721 0.1270557 -0.0585253 -1.8065922 78 O -1.7392078 -0.0126995 0.1518091 -0.0125714 -2.5187988 0.0595721 0.1270557 0.0585253 -1.8065922 79 O -1.9608989 0.1829731 -0.2536853 0.1880894 -1.7841080 0.1145246 -0.3112119 0.0304055 -1.9915288 80 O -2.0746556 -0.1257515 -0.5567131 -0.1130508 -1.7199358 0.5450862 -0.5717778 0.5068543 -2.0385124 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000000 (yyy) 0.00000000 (yyy) 0.00000000 (yyy) Max drift of fc2: 0.00000000 (yy) 0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 4 11 4 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.46, Number of G-points: 293, Lambda: 0.09 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/54) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 1.905 ( 0.000 0.000 0.000) 0.000 2.098 ( 0.000 0.000 0.000) 0.000 2.615 ( 0.000 0.000 0.000) 0.000 2.684 ( 0.000 0.000 0.000) 0.000 2.777 ( 0.000 0.000 0.000) 0.000 2.810 ( 0.000 0.000 0.000) 0.000 2.811 ( 0.000 0.000 0.000) 0.000 2.841 ( 0.000 0.000 0.000) 0.000 2.897 ( 0.000 0.000 0.000) 0.000 3.028 ( 0.000 0.000 0.000) 0.000 3.043 ( 0.000 0.000 0.000) 0.000 3.260 ( 0.000 0.000 0.000) 0.000 3.391 ( 0.000 0.000 0.000) 0.000 3.445 ( 0.000 0.000 0.000) 0.000 3.463 ( 0.000 0.000 0.000) 0.000 3.503 ( 0.000 0.000 0.000) 0.000 3.649 ( 0.000 0.000 0.000) 0.000 3.770 ( 0.000 0.000 0.000) 0.000 3.812 ( 0.000 0.000 0.000) 0.000 3.912 ( 0.000 0.000 0.000) 0.000 3.977 ( 0.000 0.000 0.000) 0.000 4.104 ( 0.000 0.000 0.000) 0.000 4.223 ( 0.000 0.000 0.000) 0.000 4.431 ( 0.000 0.000 0.000) 0.000 4.567 ( 0.000 0.000 0.000) 0.000 4.858 ( 0.000 0.000 0.000) 0.000 4.869 ( 0.000 0.000 0.000) 0.000 4.933 ( 0.000 0.000 0.000) 0.000 5.091 ( 0.000 0.000 0.000) 0.000 5.099 ( 0.000 0.000 0.000) 0.000 5.100 ( 0.000 0.000 0.000) 0.000 5.754 ( 0.000 0.000 0.000) 0.000 6.034 ( 0.000 0.000 0.000) 0.000 6.200 ( 0.000 0.000 0.000) 0.000 6.223 ( 0.000 0.000 0.000) 0.000 6.339 ( 0.000 0.000 0.000) 0.000 6.499 ( 0.000 0.000 0.000) 0.000 6.701 ( 0.000 0.000 0.000) 0.000 6.802 ( 0.000 0.000 0.000) 0.000 6.896 ( 0.000 0.000 0.000) 0.000 7.057 ( 0.000 0.000 0.000) 0.000 7.179 ( 0.000 0.000 0.000) 0.000 7.358 ( 0.000 0.000 0.000) 0.000 7.382 ( 0.000 0.000 0.000) 0.000 7.399 ( 0.000 0.000 0.000) 0.000 7.682 ( 0.000 0.000 0.000) 0.000 7.730 ( 0.000 0.000 0.000) 0.000 7.781 ( 0.000 0.000 0.000) 0.000 7.862 ( 0.000 0.000 0.000) 0.000 7.996 ( 0.000 0.000 0.000) 0.000 8.002 ( 0.000 0.000 0.000) 0.000 8.076 ( 0.000 0.000 0.000) 0.000 8.258 ( 0.000 0.000 0.000) 0.000 8.261 ( 0.000 0.000 0.000) 0.000 8.533 ( 0.000 0.000 0.000) 0.000 8.564 ( 0.000 0.000 0.000) 0.000 8.785 ( 0.000 0.000 0.000) 0.000 9.005 ( 0.000 0.000 0.000) 0.000 9.101 ( 0.000 0.000 0.000) 0.000 9.394 ( 0.000 0.000 0.000) 0.000 9.747 ( 0.000 0.000 0.000) 0.000 9.768 ( 0.000 0.000 0.000) 0.000 9.799 ( 0.000 0.000 0.000) 0.000 9.809 ( 0.000 0.000 0.000) 0.000 9.911 ( 0.000 0.000 0.000) 0.000 10.082 ( 0.000 0.000 0.000) 0.000 10.125 ( 0.000 0.000 0.000) 0.000 10.334 ( 0.000 0.000 0.000) 0.000 10.387 ( 0.000 0.000 0.000) 0.000 10.672 ( 0.000 0.000 0.000) 0.000 10.863 ( 0.000 0.000 0.000) 0.000 10.994 ( 0.000 0.000 0.000) 0.000 11.149 ( 0.000 0.000 0.000) 0.000 11.156 ( 0.000 0.000 0.000) 0.000 11.174 ( 0.000 0.000 0.000) 0.000 11.176 ( 0.000 0.000 0.000) 0.000 11.254 ( 0.000 0.000 0.000) 0.000 11.256 ( 0.000 0.000 0.000) 0.000 11.345 ( 0.000 0.000 0.000) 0.000 11.413 ( 0.000 0.000 0.000) 0.000 11.418 ( 0.000 0.000 0.000) 0.000 11.578 ( 0.000 0.000 0.000) 0.000 12.034 ( 0.000 0.000 0.000) 0.000 12.054 ( 0.000 0.000 0.000) 0.000 12.085 ( 0.000 0.000 0.000) 0.000 12.131 ( 0.000 0.000 0.000) 0.000 12.152 ( 0.000 0.000 0.000) 0.000 12.275 ( 0.000 0.000 0.000) 0.000 12.405 ( 0.000 0.000 0.000) 0.000 12.413 ( 0.000 0.000 0.000) 0.000 12.584 ( 0.000 0.000 0.000) 0.000 12.630 ( 0.000 0.000 0.000) 0.000 12.643 ( 0.000 0.000 0.000) 0.000 12.848 ( 0.000 0.000 0.000) 0.000 12.933 ( 0.000 0.000 0.000) 0.000 13.013 ( 0.000 0.000 0.000) 0.000 13.038 ( 0.000 0.000 0.000) 0.000 13.182 ( 0.000 0.000 0.000) 0.000 13.320 ( 0.000 0.000 0.000) 0.000 13.356 ( 0.000 0.000 0.000) 0.000 13.444 ( 0.000 0.000 0.000) 0.000 13.505 ( 0.000 0.000 0.000) 0.000 13.625 ( 0.000 0.000 0.000) 0.000 13.764 ( 0.000 0.000 0.000) 0.000 13.852 ( 0.000 0.000 0.000) 0.000 13.988 ( 0.000 0.000 0.000) 0.000 14.115 ( 0.000 0.000 0.000) 0.000 14.191 ( 0.000 0.000 0.000) 0.000 14.483 ( 0.000 0.000 0.000) 0.000 14.795 ( 0.000 0.000 0.000) 0.000 14.855 ( 0.000 0.000 0.000) 0.000 15.021 ( 0.000 0.000 0.000) 0.000 15.375 ( 0.000 0.000 0.000) 0.000 15.407 ( 0.000 0.000 0.000) 0.000 15.606 ( 0.000 0.000 0.000) 0.000 15.638 ( 0.000 0.000 0.000) 0.000 15.763 ( 0.000 0.000 0.000) 0.000 15.807 ( 0.000 0.000 0.000) 0.000 16.037 ( 0.000 0.000 0.000) 0.000 16.434 ( 0.000 0.000 0.000) 0.000 16.491 ( 0.000 0.000 0.000) 0.000 16.711 ( 0.000 0.000 0.000) 0.000 16.850 ( 0.000 0.000 0.000) 0.000 16.880 ( 0.000 0.000 0.000) 0.000 17.040 ( 0.000 0.000 0.000) 0.000 17.251 ( 0.000 0.000 0.000) 0.000 17.279 ( 0.000 0.000 0.000) 0.000 17.449 ( 0.000 0.000 0.000) 0.000 17.701 ( 0.000 0.000 0.000) 0.000 17.894 ( 0.000 0.000 0.000) 0.000 17.995 ( 0.000 0.000 0.000) 0.000 18.027 ( 0.000 0.000 0.000) 0.000 18.187 ( 0.000 0.000 0.000) 0.000 18.191 ( 0.000 0.000 0.000) 0.000 18.295 ( 0.000 0.000 0.000) 0.000 18.354 ( 0.000 0.000 0.000) 0.000 18.448 ( 0.000 0.000 0.000) 0.000 18.675 ( 0.000 0.000 0.000) 0.000 18.742 ( 0.000 0.000 0.000) 0.000 18.789 ( 0.000 0.000 0.000) 0.000 18.806 ( 0.000 0.000 0.000) 0.000 18.942 ( 0.000 0.000 0.000) 0.000 19.174 ( 0.000 0.000 0.000) 0.000 19.265 ( 0.000 0.000 0.000) 0.000 19.386 ( 0.000 0.000 0.000) 0.000 19.425 ( 0.000 0.000 0.000) 0.000 19.445 ( 0.000 0.000 0.000) 0.000 19.712 ( 0.000 0.000 0.000) 0.000 19.843 ( 0.000 0.000 0.000) 0.000 20.157 ( 0.000 0.000 0.000) 0.000 20.504 ( 0.000 0.000 0.000) 0.000 20.723 ( 0.000 0.000 0.000) 0.000 20.777 ( 0.000 0.000 0.000) 0.000 20.843 ( 0.000 0.000 0.000) 0.000 20.847 ( 0.000 0.000 0.000) 0.000 20.903 ( 0.000 0.000 0.000) 0.000 21.023 ( 0.000 0.000 0.000) 0.000 21.073 ( 0.000 0.000 0.000) 0.000 21.142 ( 0.000 0.000 0.000) 0.000 21.255 ( 0.000 0.000 0.000) 0.000 21.337 ( 0.000 0.000 0.000) 0.000 21.992 ( 0.000 0.000 0.000) 0.000 22.241 ( 0.000 0.000 0.000) 0.000 22.310 ( 0.000 0.000 0.000) 0.000 22.453 ( 0.000 0.000 0.000) 0.000 22.523 ( 0.000 0.000 0.000) 0.000 22.599 ( 0.000 0.000 0.000) 0.000 22.895 ( 0.000 0.000 0.000) 0.000 22.986 ( 0.000 0.000 0.000) 0.000 23.071 ( 0.000 0.000 0.000) 0.000 23.157 ( 0.000 0.000 0.000) 0.000 23.387 ( 0.000 0.000 0.000) 0.000 23.647 ( 0.000 0.000 0.000) 0.000 23.833 ( 0.000 0.000 0.000) 0.000 23.836 ( 0.000 0.000 0.000) 0.000 23.872 ( 0.000 0.000 0.000) 0.000 23.878 ( 0.000 0.000 0.000) 0.000 24.102 ( 0.000 0.000 0.000) 0.000 24.246 ( 0.000 0.000 0.000) 0.000 24.320 ( 0.000 0.000 0.000) 0.000 24.422 ( 0.000 0.000 0.000) 0.000 24.500 ( 0.000 0.000 0.000) 0.000 24.575 ( 0.000 0.000 0.000) 0.000 24.776 ( 0.000 0.000 0.000) 0.000 25.306 ( 0.000 0.000 0.000) 0.000 25.318 ( 0.000 0.000 0.000) 0.000 25.573 ( 0.000 0.000 0.000) 0.000 25.658 ( 0.000 0.000 0.000) 0.000 25.984 ( 0.000 0.000 0.000) 0.000 26.073 ( 0.000 0.000 0.000) 0.000 26.102 ( 0.000 0.000 0.000) 0.000 26.302 ( 0.000 0.000 0.000) 0.000 26.322 ( 0.000 0.000 0.000) 0.000 26.502 ( 0.000 0.000 0.000) 0.000 27.442 ( 0.000 0.000 0.000) 0.000 27.545 ( 0.000 0.000 0.000) 0.000 27.821 ( 0.000 0.000 0.000) 0.000 28.025 ( 0.000 0.000 0.000) 0.000 28.238 ( 0.000 0.000 0.000) 0.000 28.430 ( 0.000 0.000 0.000) 0.000 28.668 ( 0.000 0.000 0.000) 0.000 28.803 ( 0.000 0.000 0.000) 0.000 28.932 ( 0.000 0.000 0.000) 0.000 28.955 ( 0.000 0.000 0.000) 0.000 29.027 ( 0.000 0.000 0.000) 0.000 29.040 ( 0.000 0.000 0.000) 0.000 29.183 ( 0.000 0.000 0.000) 0.000 29.721 ( 0.000 0.000 0.000) 0.000 29.934 ( 0.000 0.000 0.000) 0.000 30.122 ( 0.000 0.000 0.000) 0.000 30.205 ( 0.000 0.000 0.000) 0.000 30.249 ( 0.000 0.000 0.000) 0.000 30.708 ( 0.000 0.000 0.000) 0.000 30.848 ( 0.000 0.000 0.000) 0.000 30.849 ( 0.000 0.000 0.000) 0.000 30.901 ( 0.000 0.000 0.000) 0.000 30.954 ( 0.000 0.000 0.000) 0.000 31.137 ( 0.000 0.000 0.000) 0.000 31.142 ( 0.000 0.000 0.000) 0.000 31.832 ( 0.000 0.000 0.000) 0.000 31.895 ( 0.000 0.000 0.000) 0.000 31.902 ( 0.000 0.000 0.000) 0.000 31.906 ( 0.000 0.000 0.000) 0.000 32.040 ( 0.000 0.000 0.000) 0.000 32.102 ( 0.000 0.000 0.000) 0.000 32.123 ( 0.000 0.000 0.000) 0.000 32.601 ( 0.000 0.000 0.000) 0.000 32.680 ( 0.000 0.000 0.000) 0.000 32.929 ( 0.000 0.000 0.000) 0.000 32.955 ( 0.000 0.000 0.000) 0.000 33.041 ( 0.000 0.000 0.000) 0.000 33.289 ( 0.000 0.000 0.000) 0.000 33.698 ( 0.000 0.000 0.000) 0.000 33.704 ( 0.000 0.000 0.000) 0.000 33.731 ( 0.000 0.000 0.000) 0.000 34.497 ( 0.000 0.000 0.000) 0.000 34.692 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/54) ======================= q-point: ( 0.25 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 36 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.791 ( 39.328 0.000 0.000) 39.328 0.795 ( 36.802 0.000 0.000) 36.802 1.559 ( 74.876 0.000 0.000) 74.876 1.796 ( -11.181 0.000 0.000) 11.181 2.083 ( -10.465 0.000 0.000) 10.465 2.518 ( -4.518 0.000 0.000) 4.518 2.627 ( -6.071 0.000 0.000) 6.071 2.651 ( -2.690 0.000 0.000) 2.690 2.693 ( 6.703 0.000 0.000) 6.703 2.957 ( 0.236 0.000 0.000) 0.236 2.971 ( 6.620 0.000 0.000) 6.620 3.025 ( 9.129 0.000 0.000) 9.129 3.059 ( -0.237 0.000 0.000) 0.237 3.125 ( 7.988 0.000 0.000) 7.988 3.188 ( -10.554 0.000 0.000) 10.554 3.266 ( -0.640 0.000 0.000) 0.640 3.420 ( -5.372 0.000 0.000) 5.372 3.445 ( -4.835 0.000 0.000) 4.835 3.542 ( 3.962 0.000 0.000) 3.962 3.557 ( -7.481 0.000 0.000) 7.481 3.610 ( -17.128 0.000 0.000) 17.128 3.748 ( -11.292 0.000 0.000) 11.292 3.839 ( 0.798 0.000 0.000) 0.798 4.067 ( 1.536 0.000 0.000) 1.536 4.189 ( 6.087 0.000 0.000) 6.087 4.262 ( 2.337 0.000 0.000) 2.337 4.313 ( -22.776 0.000 0.000) 22.776 4.371 ( -3.969 0.000 0.000) 3.969 4.640 ( 5.222 0.000 0.000) 5.222 4.817 ( -3.658 0.000 0.000) 3.658 4.997 ( -8.121 0.000 0.000) 8.121 5.001 ( -8.046 0.000 0.000) 8.046 5.238 ( 11.092 0.000 0.000) 11.092 5.398 ( 21.680 0.000 0.000) 21.680 5.646 ( -9.240 0.000 0.000) 9.240 5.961 ( -7.364 0.000 0.000) 7.364 6.279 ( 5.769 0.000 0.000) 5.769 6.381 ( 3.218 0.000 0.000) 3.218 6.543 ( 4.209 0.000 0.000) 4.209 6.667 ( -1.332 0.000 0.000) 1.332 6.716 ( 1.315 0.000 0.000) 1.315 6.827 ( -6.320 0.000 0.000) 6.320 6.904 ( 7.941 0.000 0.000) 7.941 7.232 ( 0.273 0.000 0.000) 0.273 7.277 ( 18.342 0.000 0.000) 18.342 7.369 ( 1.990 0.000 0.000) 1.990 7.414 ( 6.012 0.000 0.000) 6.012 7.484 ( -11.669 0.000 0.000) 11.669 7.661 ( -3.378 0.000 0.000) 3.378 7.748 ( -1.459 0.000 0.000) 1.459 7.805 ( -14.931 0.000 0.000) 14.931 7.890 ( 3.694 0.000 0.000) 3.694 7.957 ( -5.212 0.000 0.000) 5.212 8.024 ( 10.639 0.000 0.000) 10.639 8.029 ( -1.815 0.000 0.000) 1.815 8.249 ( -0.773 0.000 0.000) 0.773 8.525 ( 13.080 0.000 0.000) 13.080 8.553 ( 2.219 0.000 0.000) 2.219 8.553 ( 2.595 0.000 0.000) 2.595 8.843 ( -12.403 0.000 0.000) 12.403 9.048 ( 21.125 0.000 0.000) 21.125 9.459 ( -26.396 0.000 0.000) 26.396 9.575 ( -8.373 0.000 0.000) 8.373 9.597 ( -26.059 0.000 0.000) 26.059 9.649 ( -8.234 0.000 0.000) 8.234 9.677 ( 22.288 0.000 0.000) 22.288 9.707 ( 1.458 0.000 0.000) 1.458 9.771 ( -5.666 0.000 0.000) 5.666 10.154 ( 12.476 0.000 0.000) 12.476 10.182 ( 9.191 0.000 0.000) 9.191 10.206 ( -9.704 0.000 0.000) 9.704 10.423 ( 7.893 0.000 0.000) 7.893 10.638 ( -3.008 0.000 0.000) 3.008 10.661 ( -16.494 0.000 0.000) 16.494 10.913 ( -15.278 0.000 0.000) 15.278 10.936 ( -7.428 0.000 0.000) 7.428 11.199 ( 3.883 0.000 0.000) 3.883 11.242 ( 4.256 0.000 0.000) 4.256 11.256 ( 7.549 0.000 0.000) 7.549 11.355 ( -1.560 0.000 0.000) 1.560 11.372 ( 5.708 0.000 0.000) 5.708 11.375 ( -2.980 0.000 0.000) 2.980 11.445 ( 13.248 0.000 0.000) 13.248 11.674 ( 17.383 0.000 0.000) 17.383 11.750 ( 14.889 0.000 0.000) 14.889 12.026 ( -3.952 0.000 0.000) 3.952 12.095 ( -10.450 0.000 0.000) 10.450 12.127 ( 2.650 0.000 0.000) 2.650 12.133 ( 7.561 0.000 0.000) 7.561 12.210 ( 10.423 0.000 0.000) 10.423 12.230 ( -6.637 0.000 0.000) 6.637 12.270 ( 0.091 0.000 0.000) 0.091 12.284 ( -16.320 0.000 0.000) 16.320 12.538 ( -3.161 0.000 0.000) 3.161 12.674 ( -26.681 0.000 0.000) 26.681 12.717 ( 12.751 0.000 0.000) 12.751 12.815 ( 3.768 0.000 0.000) 3.768 12.878 ( 4.436 0.000 0.000) 4.436 13.001 ( 1.914 0.000 0.000) 1.914 13.038 ( 4.026 0.000 0.000) 4.026 13.303 ( -10.866 0.000 0.000) 10.866 13.316 ( 10.257 0.000 0.000) 10.257 13.402 ( 3.717 0.000 0.000) 3.717 13.478 ( -1.979 0.000 0.000) 1.979 13.511 ( 0.263 0.000 0.000) 0.263 13.540 ( -7.839 0.000 0.000) 7.839 13.807 ( -0.628 0.000 0.000) 0.628 14.010 ( 14.109 0.000 0.000) 14.109 14.035 ( 6.505 0.000 0.000) 6.505 14.189 ( -0.603 0.000 0.000) 0.603 14.227 ( 10.284 0.000 0.000) 10.284 14.467 ( -3.382 0.000 0.000) 3.382 14.773 ( -2.242 0.000 0.000) 2.242 14.912 ( -8.706 0.000 0.000) 8.706 14.999 ( 12.729 0.000 0.000) 12.729 15.338 ( -0.694 0.000 0.000) 0.694 15.425 ( -12.479 0.000 0.000) 12.479 15.446 ( 1.853 0.000 0.000) 1.853 15.640 ( -11.061 0.000 0.000) 11.061 15.710 ( 6.362 0.000 0.000) 6.362 15.848 ( 3.655 0.000 0.000) 3.655 15.918 ( -2.462 0.000 0.000) 2.462 16.153 ( -27.452 0.000 0.000) 27.452 16.362 ( -27.404 0.000 0.000) 27.404 16.860 ( 22.048 0.000 0.000) 22.048 16.869 ( 9.011 0.000 0.000) 9.011 16.980 ( 12.984 0.000 0.000) 12.984 17.144 ( 2.175 0.000 0.000) 2.175 17.366 ( 6.017 0.000 0.000) 6.017 17.517 ( 5.212 0.000 0.000) 5.212 17.595 ( 15.472 0.000 0.000) 15.472 17.656 ( -4.528 0.000 0.000) 4.528 17.719 ( -14.058 0.000 0.000) 14.058 17.916 ( -18.198 0.000 0.000) 18.198 18.088 ( 9.530 0.000 0.000) 9.530 18.151 ( -1.027 0.000 0.000) 1.027 18.252 ( -3.918 0.000 0.000) 3.918 18.320 ( -1.794 0.000 0.000) 1.794 18.556 ( 5.850 0.000 0.000) 5.850 18.649 ( -2.741 0.000 0.000) 2.741 18.691 ( -3.394 0.000 0.000) 3.394 18.721 ( -3.679 0.000 0.000) 3.679 18.743 ( -3.960 0.000 0.000) 3.960 18.822 ( -9.413 0.000 0.000) 9.413 18.975 ( 7.564 0.000 0.000) 7.564 19.190 ( 0.284 0.000 0.000) 0.284 19.376 ( -0.617 0.000 0.000) 0.617 19.437 ( -1.360 0.000 0.000) 1.360 19.461 ( 15.754 0.000 0.000) 15.754 19.636 ( 13.509 0.000 0.000) 13.509 19.876 ( 14.830 0.000 0.000) 14.830 19.934 ( 8.136 0.000 0.000) 8.136 20.140 ( -1.654 0.000 0.000) 1.654 20.397 ( -10.308 0.000 0.000) 10.308 20.558 ( -7.877 0.000 0.000) 7.877 20.777 ( 8.132 0.000 0.000) 8.132 20.780 ( -2.403 0.000 0.000) 2.403 20.913 ( 3.821 0.000 0.000) 3.821 20.985 ( -0.350 0.000 0.000) 0.350 21.061 ( -13.248 0.000 0.000) 13.248 21.125 ( -11.228 0.000 0.000) 11.228 21.201 ( 4.844 0.000 0.000) 4.844 21.263 ( -7.615 0.000 0.000) 7.615 21.290 ( 12.832 0.000 0.000) 12.832 21.974 ( -16.055 0.000 0.000) 16.055 22.016 ( -21.164 0.000 0.000) 21.164 22.248 ( 18.464 0.000 0.000) 18.464 22.355 ( -2.998 0.000 0.000) 2.998 22.736 ( 18.053 0.000 0.000) 18.053 22.797 ( 7.162 0.000 0.000) 7.162 22.955 ( -10.507 0.000 0.000) 10.507 22.994 ( 5.220 0.000 0.000) 5.220 23.012 ( 2.504 0.000 0.000) 2.504 23.301 ( 8.173 0.000 0.000) 8.173 23.314 ( -7.444 0.000 0.000) 7.444 23.634 ( -2.207 0.000 0.000) 2.207 23.683 ( -11.557 0.000 0.000) 11.557 23.765 ( -5.932 0.000 0.000) 5.932 23.812 ( -0.606 0.000 0.000) 0.606 24.073 ( -13.515 0.000 0.000) 13.515 24.102 ( 3.095 0.000 0.000) 3.095 24.175 ( 5.586 0.000 0.000) 5.586 24.347 ( -4.230 0.000 0.000) 4.230 24.352 ( -5.207 0.000 0.000) 5.207 24.649 ( 11.721 0.000 0.000) 11.721 25.031 ( 20.844 0.000 0.000) 20.844 25.267 ( -19.462 0.000 0.000) 19.462 25.416 ( 10.385 0.000 0.000) 10.385 25.573 ( 18.410 0.000 0.000) 18.410 25.629 ( -3.918 0.000 0.000) 3.918 25.908 ( -6.582 0.000 0.000) 6.582 25.966 ( -12.027 0.000 0.000) 12.027 26.107 ( 5.706 0.000 0.000) 5.706 26.335 ( 0.894 0.000 0.000) 0.894 26.523 ( 2.636 0.000 0.000) 2.636 26.690 ( 37.077 0.000 0.000) 37.077 27.356 ( -32.554 0.000 0.000) 32.554 27.462 ( 0.704 0.000 0.000) 0.704 27.531 ( -1.391 0.000 0.000) 1.391 28.073 ( 4.498 0.000 0.000) 4.498 28.281 ( -39.141 0.000 0.000) 39.141 28.309 ( -4.806 0.000 0.000) 4.806 28.578 ( -3.861 0.000 0.000) 3.861 28.586 ( 16.752 0.000 0.000) 16.752 28.675 ( -7.968 0.000 0.000) 7.968 29.090 ( 16.056 0.000 0.000) 16.056 29.100 ( -7.999 0.000 0.000) 7.999 29.178 ( 14.315 0.000 0.000) 14.315 29.500 ( 17.926 0.000 0.000) 17.926 29.597 ( -3.114 0.000 0.000) 3.114 29.773 ( -11.459 0.000 0.000) 11.459 29.850 ( 11.286 0.000 0.000) 11.286 30.083 ( -14.349 0.000 0.000) 14.349 30.192 ( -2.192 0.000 0.000) 2.192 30.292 ( 12.343 0.000 0.000) 12.343 30.694 ( -1.034 0.000 0.000) 1.034 30.743 ( -8.651 0.000 0.000) 8.651 30.818 ( -8.792 0.000 0.000) 8.792 30.978 ( 7.092 0.000 0.000) 7.092 31.118 ( 6.033 0.000 0.000) 6.033 31.266 ( 8.532 0.000 0.000) 8.532 31.327 ( 4.907 0.000 0.000) 4.907 31.642 ( -10.889 0.000 0.000) 10.889 31.772 ( -11.965 0.000 0.000) 11.965 31.933 ( 2.898 0.000 0.000) 2.898 32.009 ( 2.903 0.000 0.000) 2.903 32.095 ( -0.434 0.000 0.000) 0.434 32.109 ( -0.886 0.000 0.000) 0.886 32.683 ( 8.157 0.000 0.000) 8.157 32.777 ( 7.806 0.000 0.000) 7.806 32.930 ( -0.687 0.000 0.000) 0.687 32.958 ( 0.358 0.000 0.000) 0.358 32.976 ( -1.798 0.000 0.000) 1.798 33.024 ( -1.878 0.000 0.000) 1.878 33.341 ( 4.919 0.000 0.000) 4.919 33.647 ( -7.898 0.000 0.000) 7.898 33.697 ( -0.053 0.000 0.000) 0.053 33.701 ( -0.237 0.000 0.000) 0.237 34.508 ( 1.373 0.000 0.000) 1.373 34.646 ( -4.169 0.000 0.000) 4.169 ======================= Grid point 2 (3/54) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 36 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.352 ( -9.604 0.000 0.000) 9.604 1.352 ( 9.604 0.000 0.000) 9.604 1.625 ( -19.831 0.000 0.000) 19.831 1.625 ( 19.831 0.000 0.000) 19.831 2.570 ( -2.419 0.000 0.000) 2.419 2.570 ( 2.419 0.000 0.000) 2.419 2.699 ( -12.353 0.000 0.000) 12.353 2.699 ( 12.353 0.000 0.000) 12.353 2.888 ( -49.961 0.000 0.000) 49.961 2.888 ( 49.961 0.000 0.000) 49.961 2.935 ( -0.307 0.000 0.000) 0.307 2.935 ( 0.307 0.000 0.000) 0.307 3.104 ( -5.549 0.000 0.000) 5.549 3.104 ( 5.549 0.000 0.000) 5.549 3.226 ( -2.487 0.000 0.000) 2.487 3.226 ( 2.487 0.000 0.000) 2.487 3.250 ( -4.548 0.000 0.000) 4.548 3.250 ( 4.548 0.000 0.000) 4.548 3.422 ( -4.305 0.000 0.000) 4.305 3.422 ( 4.305 0.000 0.000) 4.305 3.607 ( -3.680 0.000 0.000) 3.680 3.607 ( 3.680 0.000 0.000) 3.680 3.893 ( -6.133 0.000 0.000) 6.133 3.893 ( 6.133 0.000 0.000) 6.133 4.257 ( -0.858 0.000 0.000) 0.858 4.257 ( 0.858 0.000 0.000) 0.858 4.306 ( -2.549 0.000 0.000) 2.549 4.306 ( 2.549 0.000 0.000) 2.549 4.737 ( -4.523 0.000 0.000) 4.523 4.737 ( 4.523 0.000 0.000) 4.523 4.895 ( -0.122 0.000 0.000) 0.122 4.895 ( 0.122 0.000 0.000) 0.122 5.449 ( -10.295 0.000 0.000) 10.295 5.449 ( 10.295 0.000 0.000) 10.295 5.749 ( -14.227 0.000 0.000) 14.227 5.749 ( 14.227 0.000 0.000) 14.227 6.399 ( -3.384 0.000 0.000) 3.384 6.399 ( 3.384 0.000 0.000) 3.384 6.652 ( -6.145 0.000 0.000) 6.145 6.652 ( 6.145 0.000 0.000) 6.145 6.690 ( -5.045 0.000 0.000) 5.045 6.690 ( 5.045 0.000 0.000) 5.045 7.076 ( -9.663 0.000 0.000) 9.663 7.076 ( 9.663 0.000 0.000) 9.663 7.458 ( -3.324 0.000 0.000) 3.324 7.458 ( 3.324 0.000 0.000) 3.324 7.542 ( -2.756 0.000 0.000) 2.756 7.542 ( 2.756 0.000 0.000) 2.756 7.583 ( -0.861 0.000 0.000) 0.861 7.583 ( 0.861 0.000 0.000) 0.861 7.786 ( -8.931 0.000 0.000) 8.931 7.786 ( 8.931 0.000 0.000) 8.931 7.978 ( -3.904 0.000 0.000) 3.904 7.978 ( 3.904 0.000 0.000) 3.904 8.202 ( -5.488 0.000 0.000) 5.488 8.202 ( 5.488 0.000 0.000) 5.488 8.612 ( -2.304 0.000 0.000) 2.304 8.612 ( 2.304 0.000 0.000) 2.304 8.772 ( -11.001 0.000 0.000) 11.001 8.772 ( 11.001 0.000 0.000) 11.001 9.002 ( -1.997 0.000 0.000) 1.997 9.002 ( 1.997 0.000 0.000) 1.997 9.433 ( -15.096 0.000 0.000) 15.096 9.433 ( 15.096 0.000 0.000) 15.096 9.594 ( -9.188 0.000 0.000) 9.188 9.594 ( 9.188 0.000 0.000) 9.188 9.965 ( -10.835 0.000 0.000) 10.835 9.965 ( 10.835 0.000 0.000) 10.835 10.184 ( -22.547 0.000 0.000) 22.547 10.184 ( 22.547 0.000 0.000) 22.547 10.316 ( -1.145 0.000 0.000) 1.145 10.316 ( 1.145 0.000 0.000) 1.145 10.646 ( -8.306 0.000 0.000) 8.306 10.646 ( 8.306 0.000 0.000) 8.306 10.731 ( -13.080 0.000 0.000) 13.080 10.731 ( 13.080 0.000 0.000) 13.080 11.274 ( -3.448 0.000 0.000) 3.448 11.274 ( 3.448 0.000 0.000) 3.448 11.317 ( -3.078 0.000 0.000) 3.078 11.317 ( 3.078 0.000 0.000) 3.078 11.391 ( -2.806 0.000 0.000) 2.806 11.391 ( 2.806 0.000 0.000) 2.806 11.759 ( -18.269 0.000 0.000) 18.269 11.759 ( 18.269 0.000 0.000) 18.269 11.997 ( -3.363 0.000 0.000) 3.363 11.997 ( 3.363 0.000 0.000) 3.363 12.003 ( -15.003 0.000 0.000) 15.003 12.003 ( 15.003 0.000 0.000) 15.003 12.119 ( -3.991 0.000 0.000) 3.991 12.119 ( 3.991 0.000 0.000) 3.991 12.308 ( -6.131 0.000 0.000) 6.131 12.308 ( 6.131 0.000 0.000) 6.131 12.342 ( -12.651 0.000 0.000) 12.651 12.342 ( 12.651 0.000 0.000) 12.651 12.552 ( -18.141 0.000 0.000) 18.141 12.552 ( 18.141 0.000 0.000) 18.141 12.955 ( -6.735 0.000 0.000) 6.735 12.955 ( 6.735 0.000 0.000) 6.735 13.140 ( -5.538 0.000 0.000) 5.538 13.140 ( 5.538 0.000 0.000) 5.538 13.234 ( -19.420 0.000 0.000) 19.420 13.234 ( 19.420 0.000 0.000) 19.420 13.414 ( -2.872 0.000 0.000) 2.872 13.414 ( 2.872 0.000 0.000) 2.872 13.469 ( -2.968 0.000 0.000) 2.968 13.469 ( 2.968 0.000 0.000) 2.968 13.979 ( -13.093 0.000 0.000) 13.093 13.979 ( 13.093 0.000 0.000) 13.093 14.275 ( -14.993 0.000 0.000) 14.993 14.275 ( 14.993 0.000 0.000) 14.993 14.310 ( -4.081 0.000 0.000) 4.081 14.310 ( 4.081 0.000 0.000) 4.081 14.771 ( -3.918 0.000 0.000) 3.918 14.771 ( 3.918 0.000 0.000) 3.918 15.268 ( -11.152 0.000 0.000) 11.152 15.268 ( 11.152 0.000 0.000) 11.152 15.411 ( -5.527 0.000 0.000) 5.527 15.411 ( 5.527 0.000 0.000) 5.527 15.607 ( -17.299 0.000 0.000) 17.299 15.607 ( 17.299 0.000 0.000) 17.299 15.858 ( -4.425 0.000 0.000) 4.425 15.858 ( 4.425 0.000 0.000) 4.425 15.972 ( -11.320 0.000 0.000) 11.320 15.972 ( 11.320 0.000 0.000) 11.320 17.042 ( -5.475 0.000 0.000) 5.475 17.042 ( 5.475 0.000 0.000) 5.475 17.269 ( -10.666 0.000 0.000) 10.666 17.269 ( 10.666 0.000 0.000) 10.666 17.349 ( -20.426 0.000 0.000) 20.426 17.349 ( 20.426 0.000 0.000) 20.426 17.564 ( -0.206 0.000 0.000) 0.206 17.564 ( 0.206 0.000 0.000) 0.206 17.773 ( -3.199 0.000 0.000) 3.199 17.773 ( 3.199 0.000 0.000) 3.199 18.165 ( -2.909 0.000 0.000) 2.909 18.165 ( 2.909 0.000 0.000) 2.909 18.282 ( -5.575 0.000 0.000) 5.575 18.282 ( 5.575 0.000 0.000) 5.575 18.614 ( -0.786 0.000 0.000) 0.786 18.614 ( 0.786 0.000 0.000) 0.786 18.672 ( -2.485 0.000 0.000) 2.485 18.672 ( 2.485 0.000 0.000) 2.485 18.678 ( -1.508 0.000 0.000) 1.508 18.678 ( 1.508 0.000 0.000) 1.508 19.120 ( -6.801 0.000 0.000) 6.801 19.120 ( 6.801 0.000 0.000) 6.801 19.398 ( -2.398 0.000 0.000) 2.398 19.398 ( 2.398 0.000 0.000) 2.398 19.726 ( -6.894 0.000 0.000) 6.894 19.726 ( 6.894 0.000 0.000) 6.894 20.085 ( -4.812 0.000 0.000) 4.812 20.085 ( 4.812 0.000 0.000) 4.812 20.172 ( -12.502 0.000 0.000) 12.502 20.172 ( 12.502 0.000 0.000) 12.502 20.600 ( -10.365 0.000 0.000) 10.365 20.600 ( 10.365 0.000 0.000) 10.365 20.943 ( -4.906 0.000 0.000) 4.906 20.943 ( 4.906 0.000 0.000) 4.906 20.970 ( -0.614 0.000 0.000) 0.614 20.970 ( 0.614 0.000 0.000) 0.614 21.042 ( -13.506 0.000 0.000) 13.506 21.042 ( 13.506 0.000 0.000) 13.506 21.328 ( -6.013 0.000 0.000) 6.013 21.328 ( 6.013 0.000 0.000) 6.013 21.774 ( -0.428 0.000 0.000) 0.428 21.774 ( 0.428 0.000 0.000) 0.428 22.448 ( -4.363 0.000 0.000) 4.363 22.448 ( 4.363 0.000 0.000) 4.363 22.808 ( -1.334 0.000 0.000) 1.334 22.808 ( 1.334 0.000 0.000) 1.334 23.020 ( -4.642 0.000 0.000) 4.642 23.020 ( 4.642 0.000 0.000) 4.642 23.105 ( -11.261 0.000 0.000) 11.261 23.105 ( 11.261 0.000 0.000) 11.261 23.472 ( -8.436 0.000 0.000) 8.436 23.472 ( 8.436 0.000 0.000) 8.436 23.659 ( -3.468 0.000 0.000) 3.468 23.659 ( 3.468 0.000 0.000) 3.468 23.861 ( -6.546 0.000 0.000) 6.546 23.861 ( 6.546 0.000 0.000) 6.546 24.200 ( -7.271 0.000 0.000) 7.271 24.200 ( 7.271 0.000 0.000) 7.271 24.272 ( -4.067 0.000 0.000) 4.067 24.272 ( 4.067 0.000 0.000) 4.067 24.930 ( -15.408 0.000 0.000) 15.408 24.930 ( 15.408 0.000 0.000) 15.408 25.430 ( -16.982 0.000 0.000) 16.982 25.430 ( 16.982 0.000 0.000) 16.982 25.680 ( -15.465 0.000 0.000) 15.465 25.680 ( 15.465 0.000 0.000) 15.465 25.794 ( -5.182 0.000 0.000) 5.182 25.794 ( 5.182 0.000 0.000) 5.182 26.305 ( -6.885 0.000 0.000) 6.885 26.305 ( 6.885 0.000 0.000) 6.885 26.733 ( -24.433 0.000 0.000) 24.433 26.733 ( 24.433 0.000 0.000) 24.433 27.477 ( -41.619 0.000 0.000) 41.619 27.477 ( 41.619 0.000 0.000) 41.619 27.496 ( -1.981 0.000 0.000) 1.981 27.496 ( 1.981 0.000 0.000) 1.981 28.185 ( -6.577 0.000 0.000) 6.577 28.185 ( 6.577 0.000 0.000) 6.577 28.568 ( -2.699 0.000 0.000) 2.699 28.568 ( 2.699 0.000 0.000) 2.699 28.888 ( -13.297 0.000 0.000) 13.297 28.888 ( 13.297 0.000 0.000) 13.297 29.362 ( -4.951 0.000 0.000) 4.951 29.362 ( 4.951 0.000 0.000) 4.951 29.549 ( -6.143 0.000 0.000) 6.143 29.549 ( 6.143 0.000 0.000) 6.143 29.792 ( -13.599 0.000 0.000) 13.599 29.792 ( 13.599 0.000 0.000) 13.599 30.077 ( -9.858 0.000 0.000) 9.858 30.077 ( 9.858 0.000 0.000) 9.858 30.538 ( -11.918 0.000 0.000) 11.918 30.538 ( 11.918 0.000 0.000) 11.918 30.699 ( -2.628 0.000 0.000) 2.628 30.699 ( 2.628 0.000 0.000) 2.628 31.120 ( -5.415 0.000 0.000) 5.415 31.120 ( 5.415 0.000 0.000) 5.415 31.442 ( -9.459 0.000 0.000) 9.459 31.442 ( 9.459 0.000 0.000) 9.459 31.512 ( -12.947 0.000 0.000) 12.947 31.512 ( 12.947 0.000 0.000) 12.947 31.997 ( -2.916 0.000 0.000) 2.916 31.997 ( 2.916 0.000 0.000) 2.916 32.095 ( -0.466 0.000 0.000) 0.466 32.095 ( 0.466 0.000 0.000) 0.466 32.858 ( -7.316 0.000 0.000) 7.316 32.858 ( 7.316 0.000 0.000) 7.316 32.915 ( -5.171 0.000 0.000) 5.171 32.915 ( 5.171 0.000 0.000) 5.171 32.977 ( -1.921 0.000 0.000) 1.921 32.977 ( 1.921 0.000 0.000) 1.921 33.473 ( -8.437 0.000 0.000) 8.437 33.473 ( 8.437 0.000 0.000) 8.437 33.697 ( -0.117 0.000 0.000) 0.117 33.697 ( 0.117 0.000 0.000) 0.117 34.560 ( -3.880 0.000 0.000) 3.880 34.560 ( 3.880 0.000 0.000) 3.880 ======================= Grid point 5 (4/54) ======================= q-point: ( 0.00 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.615 ( 0.000 30.306 0.000) 30.306 0.645 ( 0.000 31.785 0.000) 31.785 0.835 ( 0.000 41.657 0.000) 41.657 1.998 ( 0.000 9.018 0.000) 9.018 2.178 ( 0.000 7.179 0.000) 7.179 2.668 ( 0.000 4.951 0.000) 4.951 2.679 ( 0.000 -5.428 0.000) 5.428 2.723 ( 0.000 -5.137 0.000) 5.137 2.749 ( 0.000 6.283 0.000) 6.283 2.894 ( 0.000 2.702 0.000) 2.702 2.902 ( 0.000 0.660 0.000) 0.660 2.924 ( 0.000 7.070 0.000) 7.070 3.067 ( 0.000 1.533 0.000) 1.533 3.075 ( 0.000 4.319 0.000) 4.319 3.282 ( 0.000 2.144 0.000) 2.144 3.393 ( 0.000 0.157 0.000) 0.157 3.434 ( 0.000 -2.336 0.000) 2.336 3.441 ( 0.000 -0.635 0.000) 0.635 3.510 ( 0.000 0.089 0.000) 0.089 3.618 ( 0.000 -2.708 0.000) 2.708 3.693 ( 0.000 -5.853 0.000) 5.853 3.756 ( 0.000 -5.252 0.000) 5.252 3.958 ( 0.000 3.101 0.000) 3.101 3.961 ( 0.000 -1.552 0.000) 1.552 4.085 ( 0.000 -1.877 0.000) 1.877 4.272 ( 0.000 4.478 0.000) 4.478 4.442 ( 0.000 -1.137 0.000) 1.137 4.548 ( 0.000 -2.032 0.000) 2.032 4.742 ( 0.000 -7.420 0.000) 7.420 4.884 ( 0.000 -3.504 0.000) 3.504 4.903 ( 0.000 -1.627 0.000) 1.627 5.062 ( 0.000 -3.703 0.000) 3.703 5.098 ( 0.000 0.825 0.000) 0.825 5.138 ( 0.000 3.395 0.000) 3.395 5.765 ( 0.000 -0.059 0.000) 0.059 6.022 ( 0.000 -1.245 0.000) 1.245 6.145 ( 0.000 -4.464 0.000) 4.464 6.230 ( 0.000 0.523 0.000) 0.523 6.365 ( 0.000 1.608 0.000) 1.608 6.505 ( 0.000 0.609 0.000) 0.609 6.716 ( 0.000 1.354 0.000) 1.354 6.761 ( 0.000 -4.553 0.000) 4.553 6.908 ( 0.000 -9.463 0.000) 9.463 7.062 ( 0.000 -8.231 0.000) 8.231 7.171 ( 0.000 -0.712 0.000) 0.712 7.324 ( 0.000 -3.843 0.000) 3.843 7.406 ( 0.000 0.671 0.000) 0.671 7.534 ( 0.000 11.891 0.000) 11.891 7.707 ( 0.000 2.060 0.000) 2.060 7.760 ( 0.000 -2.093 0.000) 2.093 7.863 ( 0.000 0.393 0.000) 0.393 7.978 ( 0.000 -1.342 0.000) 1.342 8.044 ( 0.000 3.762 0.000) 3.762 8.091 ( 0.000 11.294 0.000) 11.294 8.248 ( 0.000 -0.803 0.000) 0.803 8.266 ( 0.000 0.444 0.000) 0.444 8.573 ( 0.000 3.583 0.000) 3.583 8.588 ( 0.000 2.021 0.000) 2.021 8.784 ( 0.000 -0.104 0.000) 0.104 8.999 ( 0.000 -0.560 0.000) 0.560 9.091 ( 0.000 -0.730 0.000) 0.730 9.385 ( 0.000 -0.881 0.000) 0.881 9.531 ( 0.000 -5.376 0.000) 5.376 9.731 ( 0.000 -3.260 0.000) 3.260 9.743 ( 0.000 -0.309 0.000) 0.309 9.801 ( 0.000 -0.792 0.000) 0.792 9.908 ( 0.000 -0.266 0.000) 0.266 9.954 ( 0.000 -2.190 0.000) 2.190 10.089 ( 0.000 0.579 0.000) 0.579 10.116 ( 0.000 -0.752 0.000) 0.752 10.336 ( 0.000 0.043 0.000) 0.043 10.384 ( 0.000 -0.306 0.000) 0.306 10.678 ( 0.000 0.267 0.000) 0.267 10.775 ( 0.000 -8.051 0.000) 8.051 10.964 ( 0.000 -2.722 0.000) 2.722 11.129 ( 0.000 -1.312 0.000) 1.312 11.137 ( 0.000 -3.623 0.000) 3.623 11.188 ( 0.000 -0.047 0.000) 0.047 11.215 ( 0.000 3.089 0.000) 3.089 11.241 ( 0.000 -1.177 0.000) 1.177 11.287 ( 0.000 -5.172 0.000) 5.172 11.314 ( 0.000 -6.780 0.000) 6.780 11.422 ( 0.000 -2.119 0.000) 2.119 11.592 ( 0.000 1.015 0.000) 1.015 11.646 ( 0.000 -5.071 0.000) 5.071 12.034 ( 0.000 0.476 0.000) 0.476 12.067 ( 0.000 -1.871 0.000) 1.871 12.136 ( 0.000 0.575 0.000) 0.575 12.151 ( 0.000 -0.426 0.000) 0.426 12.186 ( 0.000 2.789 0.000) 2.789 12.244 ( 0.000 -0.438 0.000) 0.438 12.377 ( 0.000 -3.474 0.000) 3.474 12.528 ( 0.000 8.248 0.000) 8.248 12.549 ( 0.000 -0.978 0.000) 0.978 12.619 ( 0.000 1.075 0.000) 1.075 12.711 ( 0.000 -10.371 0.000) 10.371 12.748 ( 0.000 4.369 0.000) 4.369 12.945 ( 0.000 1.171 0.000) 1.171 12.962 ( 0.000 -3.724 0.000) 3.724 13.101 ( 0.000 2.433 0.000) 2.433 13.332 ( 0.000 -5.208 0.000) 5.208 13.347 ( 0.000 -0.940 0.000) 0.940 13.374 ( 0.000 4.906 0.000) 4.906 13.472 ( 0.000 2.580 0.000) 2.580 13.503 ( 0.000 -0.729 0.000) 0.729 13.593 ( 0.000 -2.253 0.000) 2.253 13.737 ( 0.000 -2.669 0.000) 2.669 13.913 ( 0.000 5.210 0.000) 5.210 13.990 ( 0.000 0.083 0.000) 0.083 14.045 ( 0.000 -6.301 0.000) 6.301 14.199 ( 0.000 0.763 0.000) 0.763 14.514 ( 0.000 2.895 0.000) 2.895 14.734 ( 0.000 -6.867 0.000) 6.867 14.806 ( 0.000 1.065 0.000) 1.065 15.185 ( 0.000 11.177 0.000) 11.177 15.384 ( 0.000 0.803 0.000) 0.803 15.531 ( 0.000 5.414 0.000) 5.414 15.574 ( 0.000 -3.001 0.000) 3.001 15.675 ( 0.000 3.383 0.000) 3.383 15.712 ( 0.000 -3.674 0.000) 3.674 15.819 ( 0.000 -0.131 0.000) 0.131 16.025 ( 0.000 -1.092 0.000) 1.092 16.448 ( 0.000 1.348 0.000) 1.348 16.487 ( 0.000 -0.430 0.000) 0.430 16.699 ( 0.000 -1.202 0.000) 1.202 16.884 ( 0.000 0.377 0.000) 0.377 16.922 ( 0.000 6.634 0.000) 6.634 17.064 ( 0.000 1.391 0.000) 1.391 17.285 ( 0.000 0.590 0.000) 0.590 17.286 ( 0.000 3.231 0.000) 3.231 17.455 ( 0.000 0.567 0.000) 0.567 17.692 ( 0.000 -0.835 0.000) 0.835 17.881 ( 0.000 -1.271 0.000) 1.271 18.008 ( 0.000 -0.543 0.000) 0.543 18.026 ( 0.000 -0.080 0.000) 0.080 18.157 ( 0.000 -2.236 0.000) 2.236 18.215 ( 0.000 1.727 0.000) 1.727 18.291 ( 0.000 -0.381 0.000) 0.381 18.415 ( 0.000 4.801 0.000) 4.801 18.449 ( 0.000 0.068 0.000) 0.068 18.673 ( 0.000 -0.176 0.000) 0.176 18.740 ( 0.000 -0.186 0.000) 0.186 18.775 ( 0.000 -1.245 0.000) 1.245 18.806 ( 0.000 -0.071 0.000) 0.071 18.957 ( 0.000 1.298 0.000) 1.298 19.166 ( 0.000 -0.781 0.000) 0.781 19.265 ( 0.000 -0.002 0.000) 0.002 19.377 ( 0.000 -0.821 0.000) 0.821 19.387 ( 0.000 -1.861 0.000) 1.861 19.501 ( 0.000 3.601 0.000) 3.601 19.717 ( 0.000 0.430 0.000) 0.430 19.853 ( 0.000 0.041 0.000) 0.041 20.159 ( 0.000 0.198 0.000) 0.198 20.534 ( 0.000 1.681 0.000) 1.681 20.716 ( 0.000 -1.206 0.000) 1.206 20.778 ( 0.000 -0.055 0.000) 0.055 20.849 ( 0.000 0.626 0.000) 0.626 20.854 ( 0.000 0.684 0.000) 0.684 20.889 ( 0.000 -1.471 0.000) 1.471 20.987 ( 0.000 -3.194 0.000) 3.194 21.075 ( 0.000 0.161 0.000) 0.161 21.138 ( 0.000 -0.418 0.000) 0.418 21.273 ( 0.000 1.565 0.000) 1.565 21.334 ( 0.000 -0.280 0.000) 0.280 21.990 ( 0.000 -0.199 0.000) 0.199 22.249 ( 0.000 0.763 0.000) 0.763 22.313 ( 0.000 0.322 0.000) 0.322 22.460 ( 0.000 0.675 0.000) 0.675 22.532 ( 0.000 0.946 0.000) 0.946 22.538 ( 0.000 -5.740 0.000) 5.740 22.897 ( 0.000 -0.491 0.000) 0.491 22.974 ( 0.000 -1.125 0.000) 1.125 23.089 ( 0.000 1.711 0.000) 1.711 23.135 ( 0.000 -2.128 0.000) 2.128 23.401 ( 0.000 0.547 0.000) 0.547 23.654 ( 0.000 0.669 0.000) 0.669 23.830 ( 0.000 -0.297 0.000) 0.297 23.856 ( 0.000 -1.395 0.000) 1.395 23.856 ( 0.000 2.003 0.000) 2.003 23.879 ( 0.000 0.123 0.000) 0.123 24.107 ( 0.000 0.489 0.000) 0.489 24.248 ( 0.000 0.149 0.000) 0.149 24.323 ( 0.000 0.298 0.000) 0.298 24.455 ( 0.000 2.760 0.000) 2.760 24.498 ( 0.000 -0.153 0.000) 0.153 24.573 ( 0.000 -0.207 0.000) 0.207 24.781 ( 0.000 0.506 0.000) 0.506 25.250 ( 0.000 -5.232 0.000) 5.232 25.283 ( 0.000 -4.116 0.000) 4.116 25.579 ( 0.000 0.591 0.000) 0.591 25.665 ( 0.000 0.625 0.000) 0.625 25.995 ( 0.000 1.087 0.000) 1.087 26.079 ( 0.000 -4.149 0.000) 4.149 26.100 ( 0.000 -0.897 0.000) 0.897 26.296 ( 0.000 -0.600 0.000) 0.600 26.322 ( 0.000 0.038 0.000) 0.038 26.503 ( 0.000 0.069 0.000) 0.069 27.442 ( 0.000 0.007 0.000) 0.007 27.613 ( 0.000 -1.536 0.000) 1.536 27.805 ( 0.000 -1.491 0.000) 1.491 28.028 ( 0.000 0.205 0.000) 0.205 28.200 ( 0.000 -3.736 0.000) 3.736 28.420 ( 0.000 -1.019 0.000) 1.019 28.611 ( 0.000 -16.961 0.000) 16.961 28.656 ( 0.000 -1.294 0.000) 1.294 28.921 ( 0.000 -11.273 0.000) 11.273 28.926 ( 0.000 -2.800 0.000) 2.800 28.927 ( 0.000 -0.428 0.000) 0.428 28.990 ( 0.000 -3.766 0.000) 3.766 29.216 ( 0.000 -0.906 0.000) 0.906 29.740 ( 0.000 1.138 0.000) 1.138 29.851 ( 0.000 -7.513 0.000) 7.513 30.110 ( 0.000 -1.110 0.000) 1.110 30.195 ( 0.000 -5.159 0.000) 5.159 30.198 ( 0.000 -0.669 0.000) 0.669 30.713 ( 0.000 0.305 0.000) 0.305 30.822 ( 0.000 -2.363 0.000) 2.363 30.845 ( 0.000 -0.455 0.000) 0.455 30.855 ( 0.000 -4.127 0.000) 4.127 30.936 ( 0.000 -1.869 0.000) 1.869 31.113 ( 0.000 -2.170 0.000) 2.170 31.228 ( 0.000 2.159 0.000) 2.159 31.411 ( 0.000 -28.889 0.000) 28.889 31.759 ( 0.000 -15.124 0.000) 15.124 31.786 ( 0.000 -8.560 0.000) 8.560 31.801 ( 0.000 -2.877 0.000) 2.877 32.052 ( 0.000 -4.460 0.000) 4.460 32.102 ( 0.000 3.317 0.000) 3.317 32.234 ( 0.000 9.943 0.000) 9.943 32.442 ( 0.000 -17.751 0.000) 17.751 32.805 ( 0.000 -8.252 0.000) 8.252 32.848 ( 0.000 -14.286 0.000) 14.286 33.034 ( 0.000 25.712 0.000) 25.712 33.172 ( 0.000 2.729 0.000) 2.729 33.551 ( 0.000 14.151 0.000) 14.151 33.667 ( 0.000 -1.208 0.000) 1.208 33.742 ( 0.000 4.834 0.000) 4.834 34.338 ( 0.000 9.845 0.000) 9.845 34.690 ( 0.000 16.116 0.000) 16.116 38.893 ( 0.000 -20.333 0.000) 20.333 ======================= Grid point 6 (5/54) ======================= q-point: ( 0.25 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.012 ( 27.748 19.062 0.000) 33.664 1.055 ( 26.153 22.764 0.000) 34.673 1.627 ( 49.369 7.425 0.000) 49.924 1.956 ( 6.306 14.499 0.000) 15.811 2.117 ( -13.035 2.941 0.000) 13.363 2.559 ( -0.996 4.103 0.000) 4.223 2.630 ( -1.752 0.419 0.000) 1.801 2.694 ( -3.373 4.511 0.000) 5.632 2.756 ( 6.724 5.435 0.000) 8.646 2.950 ( 3.567 -0.321 0.000) 3.582 2.960 ( 3.515 -0.124 0.000) 3.517 3.057 ( -0.585 3.140 0.000) 3.194 3.104 ( 3.637 2.955 0.000) 4.686 3.148 ( 10.818 2.206 0.000) 11.040 3.207 ( -11.147 1.812 0.000) 11.293 3.288 ( 0.121 2.121 0.000) 2.124 3.394 ( -3.814 -2.284 0.000) 4.445 3.460 ( -5.297 0.391 0.000) 5.312 3.514 ( -0.702 -2.735 0.000) 2.824 3.562 ( -1.400 0.568 0.000) 1.511 3.571 ( -12.722 -2.707 0.000) 13.007 3.763 ( 0.825 -6.075 0.000) 6.131 3.805 ( -11.062 4.734 0.000) 12.032 4.046 ( 0.442 -1.771 0.000) 1.826 4.162 ( 5.735 -2.624 0.000) 6.307 4.243 ( -10.155 -2.123 0.000) 10.374 4.336 ( -12.915 2.937 0.000) 13.244 4.374 ( -3.632 -0.053 0.000) 3.632 4.619 ( 4.197 -2.466 0.000) 4.868 4.746 ( -2.586 -6.470 0.000) 6.968 4.956 ( -6.867 -4.069 0.000) 7.982 4.967 ( -7.435 -3.164 0.000) 8.080 5.269 ( 9.632 2.418 0.000) 9.931 5.403 ( 20.684 0.353 0.000) 20.687 5.649 ( -9.810 -0.151 0.000) 9.812 5.948 ( -7.283 -1.328 0.000) 7.403 6.287 ( 6.242 0.643 0.000) 6.275 6.358 ( 7.242 -2.341 0.000) 7.611 6.478 ( 0.389 -4.743 0.000) 4.759 6.570 ( 16.011 -5.455 0.000) 16.915 6.699 ( -0.956 1.216 0.000) 1.546 6.861 ( -11.585 -2.491 0.000) 11.850 6.907 ( 10.175 0.205 0.000) 10.177 7.113 ( 17.083 -8.638 0.000) 19.143 7.175 ( -5.890 -5.657 0.000) 8.167 7.235 ( 5.651 -1.607 0.000) 5.875 7.535 ( -0.209 7.549 0.000) 7.552 7.599 ( 5.353 -7.115 0.000) 8.904 7.686 ( -1.400 2.868 0.000) 3.192 7.724 ( -17.930 -0.216 0.000) 17.932 7.817 ( 8.366 1.430 0.000) 8.488 7.920 ( 4.690 3.771 0.000) 6.018 7.960 ( -3.801 11.060 0.000) 11.695 8.027 ( -1.650 5.658 0.000) 5.894 8.231 ( -1.548 -1.533 0.000) 2.179 8.413 ( -14.460 6.215 0.000) 15.739 8.510 ( 10.636 0.239 0.000) 10.639 8.583 ( 1.420 2.766 0.000) 3.109 8.765 ( -14.765 13.848 0.000) 20.243 8.835 ( -12.596 -0.681 0.000) 12.614 9.045 ( 20.863 -0.339 0.000) 20.866 9.452 ( -24.807 -0.860 0.000) 24.822 9.549 ( -35.609 -4.667 0.000) 35.914 9.557 ( 5.835 -2.196 0.000) 6.234 9.646 ( -7.960 -0.224 0.000) 7.963 9.661 ( 3.635 -1.306 0.000) 3.863 9.692 ( 10.203 -1.091 0.000) 10.261 9.771 ( -6.484 -0.373 0.000) 6.495 10.167 ( 6.781 -0.292 0.000) 6.787 10.190 ( 9.349 0.722 0.000) 9.376 10.222 ( -4.758 1.565 0.000) 5.009 10.388 ( 4.360 -3.624 0.000) 5.670 10.584 ( -8.014 -4.875 0.000) 9.380 10.669 ( -8.547 1.207 0.000) 8.631 10.886 ( -8.866 -2.376 0.000) 9.179 10.948 ( -15.577 0.421 0.000) 15.583 11.162 ( 2.443 -2.680 0.000) 3.627 11.212 ( 7.124 -4.059 0.000) 8.199 11.256 ( 5.118 0.344 0.000) 5.129 11.274 ( -2.134 -5.750 0.000) 6.133 11.338 ( 3.709 -1.899 0.000) 4.167 11.383 ( -0.363 -1.237 0.000) 1.290 11.563 ( 7.989 5.755 0.000) 9.846 11.628 ( 16.987 -4.235 0.000) 17.507 11.759 ( 9.817 -0.923 0.000) 9.861 12.023 ( -3.241 -0.653 0.000) 3.306 12.073 ( -2.639 -3.303 0.000) 4.228 12.099 ( -7.465 -0.401 0.000) 7.476 12.182 ( 5.814 3.662 0.000) 6.871 12.214 ( -5.740 0.938 0.000) 5.816 12.241 ( 9.363 3.785 0.000) 10.099 12.335 ( -1.381 3.961 0.000) 4.195 12.368 ( -6.367 5.524 0.000) 8.429 12.519 ( -3.908 -2.274 0.000) 4.522 12.637 ( -22.393 -2.681 0.000) 22.553 12.651 ( 13.996 -3.056 0.000) 14.325 12.863 ( -3.813 3.621 0.000) 5.259 12.960 ( 10.569 5.790 0.000) 12.051 12.993 ( 5.606 -1.860 0.000) 5.907 13.051 ( -0.509 1.285 0.000) 1.382 13.235 ( 1.279 -6.226 0.000) 6.356 13.308 ( -9.871 -0.486 0.000) 9.883 13.367 ( -0.933 -1.078 0.000) 1.426 13.497 ( -0.931 -0.603 0.000) 1.109 13.540 ( 5.651 2.754 0.000) 6.287 13.595 ( -2.725 3.992 0.000) 4.834 13.759 ( -0.125 -3.145 0.000) 3.148 13.988 ( 5.618 -4.915 0.000) 7.465 14.017 ( 10.995 0.802 0.000) 11.024 14.168 ( -3.229 -1.513 0.000) 3.566 14.257 ( 13.786 2.742 0.000) 14.056 14.539 ( 0.191 6.183 0.000) 6.186 14.784 ( -1.728 1.087 0.000) 2.041 14.870 ( 9.579 -3.538 0.000) 10.211 15.101 ( -6.410 8.248 0.000) 10.446 15.323 ( -2.548 -1.365 0.000) 2.891 15.399 ( -11.905 -2.440 0.000) 12.152 15.504 ( -0.521 5.100 0.000) 5.126 15.614 ( -9.241 -2.522 0.000) 9.579 15.728 ( 4.594 1.616 0.000) 4.870 15.827 ( 1.205 -0.961 0.000) 1.541 15.953 ( 0.725 2.247 0.000) 2.361 16.150 ( -26.801 -0.301 0.000) 26.803 16.372 ( -26.967 0.954 0.000) 26.984 16.835 ( 21.134 -1.979 0.000) 21.226 16.849 ( 10.027 -1.411 0.000) 10.126 17.051 ( 12.666 6.149 0.000) 14.079 17.157 ( 1.445 1.249 0.000) 1.910 17.373 ( 5.370 0.661 0.000) 5.411 17.518 ( 4.884 0.176 0.000) 4.887 17.605 ( 14.135 0.750 0.000) 14.155 17.661 ( -3.092 0.439 0.000) 3.123 17.712 ( -12.372 -0.430 0.000) 12.379 17.945 ( -17.927 2.695 0.000) 18.128 18.087 ( 10.102 -0.112 0.000) 10.103 18.131 ( -0.879 -1.444 0.000) 1.691 18.247 ( -4.228 -0.491 0.000) 4.256 18.365 ( -1.987 3.756 0.000) 4.249 18.466 ( 9.711 -15.172 0.000) 18.014 18.556 ( 4.969 0.001 0.000) 4.969 18.666 ( -0.437 -0.180 0.000) 0.472 18.721 ( -4.579 -1.829 0.000) 4.931 18.722 ( -3.297 -0.001 0.000) 3.297 18.829 ( -9.756 0.526 0.000) 9.770 18.931 ( 10.722 -1.818 0.000) 10.875 19.184 ( 0.404 -0.607 0.000) 0.729 19.363 ( 0.161 -1.237 0.000) 1.248 19.417 ( 0.036 -1.377 0.000) 1.377 19.472 ( 15.245 0.971 0.000) 15.276 19.652 ( 12.152 1.467 0.000) 12.240 19.885 ( 15.200 0.880 0.000) 15.225 19.943 ( 8.111 0.656 0.000) 8.137 20.143 ( -1.579 0.243 0.000) 1.597 20.414 ( -10.644 1.609 0.000) 10.765 20.561 ( -8.060 0.276 0.000) 8.065 20.758 ( 2.907 -1.096 0.000) 3.107 20.793 ( 3.960 0.470 0.000) 3.987 20.909 ( 1.547 -0.826 0.000) 1.753 20.936 ( -0.940 -4.333 0.000) 4.433 20.984 ( -8.154 -4.323 0.000) 9.229 21.129 ( -11.640 0.156 0.000) 11.642 21.192 ( 4.254 -0.863 0.000) 4.340 21.252 ( 0.358 -0.871 0.000) 0.942 21.298 ( 4.638 0.604 0.000) 4.677 21.984 ( -15.900 0.968 0.000) 15.930 22.023 ( -20.678 0.622 0.000) 20.688 22.225 ( 18.660 -1.624 0.000) 18.731 22.340 ( -2.356 -1.459 0.000) 2.772 22.743 ( 17.650 0.565 0.000) 17.659 22.771 ( 8.085 -2.055 0.000) 8.342 22.947 ( -7.122 -0.219 0.000) 7.126 23.003 ( 2.759 -0.873 0.000) 2.894 23.009 ( 1.211 1.095 0.000) 1.633 23.264 ( 8.956 -3.268 0.000) 9.534 23.321 ( -7.565 0.673 0.000) 7.595 23.631 ( -5.536 -0.615 0.000) 5.570 23.673 ( -8.613 -0.550 0.000) 8.631 23.774 ( -6.227 0.965 0.000) 6.301 23.808 ( -0.794 -0.332 0.000) 0.861 24.057 ( -2.755 -2.331 0.000) 3.609 24.075 ( -5.608 -1.326 0.000) 5.762 24.183 ( 5.822 0.826 0.000) 5.881 24.352 ( -5.692 0.020 0.000) 5.692 24.370 ( -4.393 2.230 0.000) 4.927 24.644 ( 12.046 -0.433 0.000) 12.054 25.037 ( 20.784 0.594 0.000) 20.792 25.268 ( -18.320 0.078 0.000) 18.320 25.366 ( 10.691 -4.564 0.000) 11.624 25.557 ( 21.262 -2.421 0.000) 21.399 25.638 ( -3.726 0.710 0.000) 3.794 25.792 ( 16.409 -25.917 0.000) 30.675 25.915 ( -6.989 0.680 0.000) 7.022 26.041 ( 2.800 -4.220 0.000) 5.065 26.334 ( 0.699 -0.102 0.000) 0.706 26.490 ( 32.487 -18.908 0.000) 37.588 26.542 ( 29.427 -14.928 0.000) 32.997 26.921 ( 61.714 -40.570 0.000) 73.855 27.317 ( -32.955 -3.721 0.000) 33.164 27.461 ( -0.440 -0.062 0.000) 0.444 27.657 ( 9.182 -11.411 0.000) 14.646 28.076 ( 4.842 -0.066 0.000) 4.843 28.206 ( -30.861 -6.846 0.000) 31.611 28.307 ( -9.796 -1.242 0.000) 9.874 28.518 ( -1.425 -4.704 0.000) 4.915 28.579 ( 12.254 -2.039 0.000) 12.422 28.711 ( -8.234 -3.424 0.000) 8.918 28.878 ( 2.802 -22.563 0.000) 22.736 29.127 ( -7.029 -1.137 0.000) 7.120 29.221 ( 14.374 -1.731 0.000) 14.478 29.304 ( 13.554 -13.168 0.000) 18.897 29.730 ( -8.905 -3.295 0.000) 9.495 29.858 ( 9.825 0.443 0.000) 9.835 30.009 ( -16.488 -5.358 0.000) 17.337 30.186 ( -2.436 -0.742 0.000) 2.547 30.274 ( 13.114 -1.663 0.000) 13.219 30.696 ( -1.238 -0.047 0.000) 1.239 30.705 ( -7.304 -1.711 0.000) 7.502 30.808 ( -7.898 -1.106 0.000) 7.975 30.924 ( 6.453 -5.019 0.000) 8.175 31.001 ( 9.366 -3.357 0.000) 9.950 31.128 ( 0.092 -3.102 0.000) 3.103 31.332 ( 7.321 0.973 0.000) 7.385 31.367 ( -5.004 -24.632 0.000) 25.136 31.619 ( -8.344 -2.536 0.000) 8.721 31.805 ( 1.326 -14.893 0.000) 14.952 31.852 ( 0.239 -14.973 0.000) 14.975 32.059 ( 1.808 2.843 0.000) 3.369 32.160 ( 5.493 -4.197 0.000) 6.913 32.207 ( -2.371 8.135 0.000) 8.474 32.419 ( -3.591 -17.154 0.000) 17.526 32.816 ( -2.289 -1.343 0.000) 2.654 32.834 ( -1.573 -14.125 0.000) 14.212 32.952 ( 1.894 5.847 0.000) 6.146 33.159 ( -1.933 2.469 0.000) 3.136 33.700 ( 2.985 1.746 0.000) 3.458 33.730 ( 3.703 7.140 0.000) 8.043 33.839 ( 15.079 22.039 0.000) 26.704 34.250 ( -7.910 10.500 0.000) 13.146 34.811 ( 15.923 25.718 0.000) 30.248 37.135 (-111.444 75.978 0.000) 134.880 ======================= Grid point 7 (6/54) ======================= q-point: (-0.50 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 51 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.465 ( -2.976 10.746 0.000) 11.151 1.465 ( 2.976 10.746 0.000) 11.151 1.707 ( -10.893 8.202 0.000) 13.636 1.707 ( 10.893 8.202 0.000) 13.636 2.614 ( -0.290 3.274 0.000) 3.287 2.614 ( 0.290 3.274 0.000) 3.287 2.749 ( -2.789 5.310 0.000) 5.998 2.749 ( 2.789 5.310 0.000) 5.998 2.868 ( -21.361 0.562 0.000) 21.368 2.868 ( 21.361 0.562 0.000) 21.368 3.009 ( -0.159 2.702 0.000) 2.706 3.009 ( 0.159 2.702 0.000) 2.706 3.078 ( -15.103 1.667 0.000) 15.195 3.078 ( 15.103 1.667 0.000) 15.195 3.262 ( -3.553 1.134 0.000) 3.730 3.262 ( 3.553 1.134 0.000) 3.730 3.321 ( -5.843 6.379 0.000) 8.651 3.321 ( 5.843 6.379 0.000) 8.651 3.404 ( -4.922 -1.304 0.000) 5.091 3.404 ( 4.922 -1.304 0.000) 5.091 3.625 ( -3.101 2.071 0.000) 3.729 3.625 ( 3.101 2.071 0.000) 3.729 3.823 ( -1.821 -6.016 0.000) 6.286 3.823 ( 1.821 -6.016 0.000) 6.286 4.224 ( -0.115 -3.102 0.000) 3.104 4.224 ( 0.115 -3.102 0.000) 3.104 4.320 ( -0.570 1.119 0.000) 1.255 4.320 ( 0.570 1.119 0.000) 1.255 4.690 ( -2.006 -4.451 0.000) 4.882 4.690 ( 2.006 -4.451 0.000) 4.882 4.870 ( -0.027 -2.527 0.000) 2.527 4.870 ( 0.027 -2.527 0.000) 2.527 5.453 ( -6.451 0.152 0.000) 6.453 5.453 ( 6.451 0.152 0.000) 6.453 5.742 ( -12.977 -0.877 0.000) 13.006 5.742 ( 12.977 -0.877 0.000) 13.006 6.413 ( -0.876 1.192 0.000) 1.479 6.413 ( 0.876 1.192 0.000) 1.479 6.573 ( -8.424 -5.517 0.000) 10.069 6.573 ( 8.424 -5.517 0.000) 10.069 6.698 ( -1.958 -1.261 0.000) 2.329 6.698 ( 1.958 -1.261 0.000) 2.329 7.120 ( -8.629 3.286 0.000) 9.234 7.120 ( 8.629 3.286 0.000) 9.234 7.382 ( -1.202 -6.653 0.000) 6.761 7.382 ( 1.202 -6.653 0.000) 6.761 7.443 ( -2.897 -1.725 0.000) 3.371 7.443 ( 2.897 -1.725 0.000) 3.371 7.696 ( -0.658 -1.155 0.000) 1.329 7.696 ( 0.658 -1.155 0.000) 1.329 7.893 ( -0.220 14.343 0.000) 14.344 7.893 ( 0.220 14.343 0.000) 14.344 8.042 ( -2.160 2.494 0.000) 3.300 8.042 ( 2.160 2.494 0.000) 3.300 8.204 ( -1.476 1.560 0.000) 2.148 8.204 ( 1.476 1.560 0.000) 2.148 8.621 ( -0.009 0.701 0.000) 0.701 8.621 ( 0.009 0.701 0.000) 0.701 8.729 ( -2.898 -3.760 0.000) 4.747 8.729 ( 2.898 -3.760 0.000) 4.747 9.006 ( -5.309 0.275 0.000) 5.316 9.006 ( 5.309 0.275 0.000) 5.316 9.429 ( -14.592 -0.472 0.000) 14.599 9.429 ( 14.592 -0.472 0.000) 14.599 9.604 ( -2.725 0.801 0.000) 2.841 9.604 ( 2.725 0.801 0.000) 2.841 9.957 ( -2.898 -1.102 0.000) 3.101 9.957 ( 2.898 -1.102 0.000) 3.101 10.118 ( -17.993 -5.031 0.000) 18.683 10.118 ( 17.993 -5.031 0.000) 18.683 10.333 ( -0.034 1.275 0.000) 1.275 10.333 ( 0.034 1.275 0.000) 1.275 10.634 ( -8.277 -1.221 0.000) 8.367 10.634 ( 8.277 -1.221 0.000) 8.367 10.716 ( -12.276 -1.489 0.000) 12.366 10.716 ( 12.276 -1.489 0.000) 12.366 11.218 ( -0.322 -4.246 0.000) 4.259 11.218 ( 0.322 -4.246 0.000) 4.259 11.325 ( -1.554 -2.252 0.000) 2.736 11.325 ( 1.554 -2.252 0.000) 2.736 11.350 ( -0.249 -1.629 0.000) 1.648 11.350 ( 0.249 -1.629 0.000) 1.648 11.816 ( -12.529 3.752 0.000) 13.079 11.816 ( 12.529 3.752 0.000) 13.079 11.877 ( -1.153 -7.202 0.000) 7.294 11.877 ( 1.153 -7.202 0.000) 7.294 11.992 ( -0.518 -1.259 0.000) 1.361 11.992 ( 0.518 -1.259 0.000) 1.361 12.200 ( -1.708 3.377 0.000) 3.785 12.200 ( 1.708 3.377 0.000) 3.785 12.332 ( -0.060 2.343 0.000) 2.343 12.332 ( 0.060 2.343 0.000) 2.343 12.376 ( -7.917 3.635 0.000) 8.712 12.376 ( 7.917 3.635 0.000) 8.712 12.589 ( -14.702 3.136 0.000) 15.032 12.589 ( 14.702 3.136 0.000) 15.032 12.945 ( -3.328 -0.984 0.000) 3.471 12.945 ( 3.328 -0.984 0.000) 3.471 13.128 ( -0.458 -1.683 0.000) 1.744 13.128 ( 0.458 -1.683 0.000) 1.744 13.232 ( -0.510 0.044 0.000) 0.511 13.232 ( 0.510 0.044 0.000) 0.511 13.334 ( -1.602 -3.210 0.000) 3.588 13.334 ( 1.602 -3.210 0.000) 3.588 13.576 ( -0.091 6.056 0.000) 6.057 13.576 ( 0.091 6.056 0.000) 6.057 13.942 ( -8.238 -2.557 0.000) 8.625 13.942 ( 8.238 -2.557 0.000) 8.625 14.184 ( -5.728 -5.115 0.000) 7.679 14.184 ( 5.728 -5.115 0.000) 7.679 14.439 ( -6.325 7.756 0.000) 10.008 14.439 ( 6.325 7.756 0.000) 10.008 14.828 ( -3.029 5.094 0.000) 5.927 14.828 ( 3.029 5.094 0.000) 5.927 15.233 ( -8.105 -3.032 0.000) 8.653 15.233 ( 8.105 -3.032 0.000) 8.653 15.408 ( -7.941 -0.511 0.000) 7.957 15.408 ( 7.941 -0.511 0.000) 7.957 15.602 ( -13.388 -0.840 0.000) 13.414 15.602 ( 13.388 -0.840 0.000) 13.414 15.843 ( -0.196 -0.441 0.000) 0.483 15.843 ( 0.196 -0.441 0.000) 0.483 16.017 ( -6.816 3.426 0.000) 7.629 16.017 ( 6.816 3.426 0.000) 7.629 17.021 ( -2.201 -1.790 0.000) 2.837 17.021 ( 2.201 -1.790 0.000) 2.837 17.277 ( -9.069 0.621 0.000) 9.090 17.277 ( 9.069 0.621 0.000) 9.090 17.385 ( -13.710 3.485 0.000) 14.146 17.385 ( 13.710 3.485 0.000) 14.146 17.566 ( -0.013 0.206 0.000) 0.207 17.566 ( 0.013 0.206 0.000) 0.207 17.788 ( -3.197 1.440 0.000) 3.506 17.788 ( 3.197 1.440 0.000) 3.506 18.147 ( -1.801 -1.478 0.000) 2.329 18.147 ( 1.801 -1.478 0.000) 2.329 18.311 ( -7.113 2.489 0.000) 7.536 18.311 ( 7.113 2.489 0.000) 7.536 18.563 ( -0.678 -4.986 0.000) 5.032 18.563 ( 0.678 -4.986 0.000) 5.032 18.662 ( -0.038 -0.179 0.000) 0.183 18.662 ( 0.038 -0.179 0.000) 0.183 18.680 ( -0.279 -0.223 0.000) 0.357 18.680 ( 0.279 -0.223 0.000) 0.357 19.112 ( -4.854 -0.769 0.000) 4.915 19.112 ( 4.854 -0.769 0.000) 4.915 19.389 ( -2.042 -0.779 0.000) 2.186 19.389 ( 2.042 -0.779 0.000) 2.186 19.733 ( -6.721 0.617 0.000) 6.750 19.733 ( 6.721 0.617 0.000) 6.750 20.090 ( -3.986 0.471 0.000) 4.013 20.090 ( 3.986 0.471 0.000) 4.013 20.187 ( -12.270 1.471 0.000) 12.358 20.187 ( 12.270 1.471 0.000) 12.358 20.598 ( -9.985 -0.175 0.000) 9.987 20.598 ( 9.985 -0.175 0.000) 9.987 20.909 ( -0.128 -4.934 0.000) 4.936 20.909 ( 0.128 -4.934 0.000) 4.936 20.943 ( -3.640 -0.438 0.000) 3.667 20.943 ( 3.640 -0.438 0.000) 3.667 21.052 ( -12.209 0.831 0.000) 12.237 21.052 ( 12.209 0.831 0.000) 12.237 21.313 ( -6.015 -1.498 0.000) 6.199 21.313 ( 6.015 -1.498 0.000) 6.199 21.787 ( -0.021 1.212 0.000) 1.213 21.787 ( 0.021 1.212 0.000) 1.213 22.438 ( -2.325 -0.948 0.000) 2.510 22.438 ( 2.325 -0.948 0.000) 2.510 22.795 ( -0.044 -0.963 0.000) 0.964 22.795 ( 0.044 -0.963 0.000) 0.964 23.023 ( -3.765 0.243 0.000) 3.773 23.023 ( 3.765 0.243 0.000) 3.773 23.108 ( -11.329 0.327 0.000) 11.334 23.108 ( 11.329 0.327 0.000) 11.334 23.442 ( -8.565 -2.755 0.000) 8.997 23.442 ( 8.565 -2.755 0.000) 8.997 23.665 ( -3.087 0.715 0.000) 3.169 23.665 ( 3.087 0.715 0.000) 3.169 23.853 ( -6.348 -0.740 0.000) 6.390 23.853 ( 6.348 -0.740 0.000) 6.390 24.186 ( -5.333 -1.208 0.000) 5.468 24.186 ( 5.333 -1.208 0.000) 5.468 24.292 ( -1.760 1.811 0.000) 2.525 24.292 ( 1.760 1.811 0.000) 2.525 24.933 ( -15.725 0.313 0.000) 15.728 24.933 ( 15.725 0.313 0.000) 15.728 25.434 ( -14.592 0.347 0.000) 14.596 25.434 ( 14.592 0.347 0.000) 14.596 25.633 ( -11.843 -4.613 0.000) 12.710 25.633 ( 11.843 -4.613 0.000) 12.710 25.796 ( -4.384 0.162 0.000) 4.387 25.796 ( 4.384 0.162 0.000) 4.387 26.284 ( -9.218 -2.239 0.000) 9.486 26.284 ( 9.218 -2.239 0.000) 9.486 26.693 ( -22.917 -3.704 0.000) 23.215 26.693 ( 22.917 -3.704 0.000) 23.215 27.418 ( -18.044 -7.037 0.000) 19.368 27.418 ( 18.044 -7.037 0.000) 19.368 27.484 ( -3.098 -1.713 0.000) 3.540 27.484 ( 3.098 -1.713 0.000) 3.540 28.158 ( -6.213 -7.910 0.000) 10.058 28.158 ( 6.213 -7.910 0.000) 10.058 28.364 ( -13.179 -37.364 0.000) 39.621 28.364 ( 13.179 -37.364 0.000) 39.621 28.656 ( -6.563 -21.468 0.000) 22.449 28.656 ( 6.563 -21.468 0.000) 22.449 28.925 ( -5.049 -5.610 0.000) 7.547 28.925 ( 5.049 -5.610 0.000) 7.547 29.499 ( -11.343 -2.484 0.000) 11.612 29.499 ( 11.343 -2.484 0.000) 11.612 29.640 ( -17.829 -6.515 0.000) 18.982 29.640 ( 17.829 -6.515 0.000) 18.982 30.069 ( -9.238 -0.719 0.000) 9.266 30.069 ( 9.238 -0.719 0.000) 9.266 30.525 ( -11.087 -0.996 0.000) 11.132 30.525 ( 11.087 -0.996 0.000) 11.132 30.698 ( -1.110 -0.309 0.000) 1.153 30.698 ( 1.110 -0.309 0.000) 1.153 31.065 ( -2.708 -5.592 0.000) 6.213 31.065 ( 2.708 -5.592 0.000) 6.213 31.208 ( -10.150 -12.341 0.000) 15.979 31.208 ( 10.150 -12.341 0.000) 15.979 31.471 ( -2.539 -0.015 0.000) 2.539 31.471 ( 2.539 -0.015 0.000) 2.539 31.830 ( -1.059 -17.983 0.000) 18.014 31.830 ( 1.059 -17.983 0.000) 18.014 32.132 ( -1.062 6.319 0.000) 6.408 32.132 ( 1.062 6.319 0.000) 6.408 32.299 ( -5.181 -12.435 0.000) 13.471 32.299 ( 5.181 -12.435 0.000) 13.471 32.796 ( -0.116 -10.433 0.000) 10.434 32.796 ( 0.116 -10.433 0.000) 10.434 33.075 ( -1.879 2.247 0.000) 2.929 33.075 ( 1.879 2.247 0.000) 2.929 33.750 ( -0.044 6.205 0.000) 6.206 33.750 ( 0.044 6.205 0.000) 6.206 34.078 ( -1.469 15.056 0.000) 15.128 34.078 ( 1.469 15.056 0.000) 15.128 35.498 ( -51.691 62.717 0.000) 81.274 35.498 ( 51.691 62.717 0.000) 81.274 ======================= Grid point 10 (7/54) ======================= q-point: ( 0.00 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.196 ( 0.000 27.747 0.000) 27.747 1.252 ( 0.000 28.762 0.000) 28.762 1.651 ( 0.000 39.889 0.000) 39.889 2.245 ( 0.000 15.157 0.000) 15.157 2.314 ( 0.000 4.190 0.000) 4.190 2.573 ( 0.000 -5.232 0.000) 5.232 2.691 ( 0.000 4.483 0.000) 4.483 2.787 ( 0.000 6.148 0.000) 6.148 2.920 ( 0.000 10.242 0.000) 10.242 2.930 ( 0.000 2.227 0.000) 2.227 2.951 ( 0.000 3.278 0.000) 3.278 3.074 ( 0.000 7.447 0.000) 7.447 3.098 ( 0.000 1.458 0.000) 1.458 3.175 ( 0.000 5.114 0.000) 5.114 3.340 ( 0.000 3.304 0.000) 3.304 3.368 ( 0.000 -4.671 0.000) 4.671 3.390 ( 0.000 -0.998 0.000) 0.998 3.402 ( 0.000 -3.786 0.000) 3.786 3.503 ( 0.000 -0.134 0.000) 0.134 3.571 ( 0.000 -0.761 0.000) 0.761 3.593 ( 0.000 -3.372 0.000) 3.372 3.633 ( 0.000 -6.015 0.000) 6.015 3.916 ( 0.000 -3.098 0.000) 3.098 4.013 ( 0.000 2.447 0.000) 2.447 4.035 ( 0.000 -2.927 0.000) 2.927 4.370 ( 0.000 4.387 0.000) 4.387 4.410 ( 0.000 -2.009 0.000) 2.009 4.478 ( 0.000 -5.165 0.000) 5.165 4.570 ( 0.000 -9.742 0.000) 9.742 4.755 ( 0.000 -7.476 0.000) 7.476 4.900 ( 0.000 1.449 0.000) 1.449 4.955 ( 0.000 -6.836 0.000) 6.836 5.122 ( 0.000 0.549 0.000) 0.549 5.193 ( 0.000 1.686 0.000) 1.686 5.763 ( 0.000 -0.142 0.000) 0.142 5.983 ( 0.000 -2.633 0.000) 2.633 6.050 ( 0.000 -4.603 0.000) 4.603 6.233 ( 0.000 -0.353 0.000) 0.353 6.377 ( 0.000 -0.664 0.000) 0.664 6.524 ( 0.000 1.306 0.000) 1.306 6.609 ( 0.000 -9.492 0.000) 9.492 6.744 ( 0.000 1.146 0.000) 1.146 6.772 ( 0.000 -4.799 0.000) 4.799 6.861 ( 0.000 -11.078 0.000) 11.078 7.150 ( 0.000 -1.456 0.000) 1.456 7.248 ( 0.000 -4.067 0.000) 4.067 7.429 ( 0.000 1.801 0.000) 1.801 7.699 ( 0.000 2.716 0.000) 2.716 7.703 ( 0.000 -3.330 0.000) 3.330 7.740 ( 0.000 0.596 0.000) 0.596 7.882 ( 0.000 1.372 0.000) 1.372 7.966 ( 0.000 0.436 0.000) 0.436 8.149 ( 0.000 6.876 0.000) 6.876 8.236 ( 0.000 -0.046 0.000) 0.046 8.277 ( 0.000 0.636 0.000) 0.636 8.316 ( 0.000 9.937 0.000) 9.937 8.631 ( 0.000 2.271 0.000) 2.271 8.650 ( 0.000 3.537 0.000) 3.537 8.782 ( 0.000 -0.066 0.000) 0.066 8.984 ( 0.000 -0.857 0.000) 0.857 9.086 ( 0.000 0.487 0.000) 0.487 9.333 ( 0.000 -15.322 0.000) 15.322 9.358 ( 0.000 -1.809 0.000) 1.809 9.656 ( 0.000 -3.988 0.000) 3.988 9.745 ( 0.000 0.940 0.000) 0.940 9.774 ( 0.000 -1.992 0.000) 1.992 9.898 ( 0.000 -2.965 0.000) 2.965 9.901 ( 0.000 -0.446 0.000) 0.446 10.085 ( 0.000 -1.223 0.000) 1.223 10.117 ( 0.000 1.068 0.000) 1.068 10.325 ( 0.000 -1.501 0.000) 1.501 10.378 ( 0.000 -0.302 0.000) 0.302 10.587 ( 0.000 -9.755 0.000) 9.755 10.665 ( 0.000 -1.965 0.000) 1.965 10.897 ( 0.000 -3.721 0.000) 3.721 11.037 ( 0.000 -6.102 0.000) 6.102 11.104 ( 0.000 -1.189 0.000) 1.189 11.169 ( 0.000 -7.252 0.000) 7.252 11.178 ( 0.000 -4.783 0.000) 4.783 11.189 ( 0.000 0.175 0.000) 0.175 11.214 ( 0.000 -1.327 0.000) 1.327 11.286 ( 0.000 3.836 0.000) 3.836 11.343 ( 0.000 -5.396 0.000) 5.396 11.517 ( 0.000 -6.878 0.000) 6.878 11.594 ( 0.000 -1.403 0.000) 1.403 12.027 ( 0.000 -1.749 0.000) 1.749 12.054 ( 0.000 1.236 0.000) 1.236 12.107 ( 0.000 -4.243 0.000) 4.243 12.157 ( 0.000 1.651 0.000) 1.651 12.255 ( 0.000 3.817 0.000) 3.817 12.258 ( 0.000 1.088 0.000) 1.088 12.315 ( 0.000 -1.310 0.000) 1.310 12.504 ( 0.000 -9.464 0.000) 9.464 12.580 ( 0.000 2.946 0.000) 2.946 12.653 ( 0.000 2.414 0.000) 2.414 12.688 ( 0.000 7.394 0.000) 7.394 12.803 ( 0.000 1.165 0.000) 1.165 12.883 ( 0.000 -3.807 0.000) 3.807 12.975 ( 0.000 1.640 0.000) 1.640 13.102 ( 0.000 -2.235 0.000) 2.235 13.209 ( 0.000 -6.655 0.000) 6.655 13.319 ( 0.000 -1.699 0.000) 1.699 13.457 ( 0.000 -4.154 0.000) 4.154 13.485 ( 0.000 5.386 0.000) 5.386 13.537 ( 0.000 3.692 0.000) 3.692 13.554 ( 0.000 -1.791 0.000) 1.791 13.664 ( 0.000 -4.082 0.000) 4.082 13.909 ( 0.000 -6.305 0.000) 6.305 13.987 ( 0.000 -0.333 0.000) 0.333 14.032 ( 0.000 6.333 0.000) 6.333 14.220 ( 0.000 1.259 0.000) 1.259 14.580 ( 0.000 3.264 0.000) 3.264 14.637 ( 0.000 -2.798 0.000) 2.798 14.838 ( 0.000 2.210 0.000) 2.210 15.404 ( 0.000 1.059 0.000) 1.059 15.406 ( 0.000 10.645 0.000) 10.645 15.497 ( 0.000 -4.434 0.000) 4.434 15.635 ( 0.000 -3.952 0.000) 3.952 15.659 ( 0.000 6.744 0.000) 6.744 15.753 ( 0.000 4.047 0.000) 4.047 15.790 ( 0.000 -2.591 0.000) 2.591 15.999 ( 0.000 -1.484 0.000) 1.484 16.476 ( 0.000 -0.621 0.000) 0.621 16.485 ( 0.000 2.248 0.000) 2.248 16.665 ( 0.000 -2.160 0.000) 2.160 16.894 ( 0.000 0.614 0.000) 0.614 17.082 ( 0.000 8.516 0.000) 8.516 17.103 ( 0.000 2.360 0.000) 2.360 17.303 ( 0.000 1.223 0.000) 1.223 17.363 ( 0.000 4.057 0.000) 4.057 17.470 ( 0.000 0.851 0.000) 0.851 17.669 ( 0.000 -1.345 0.000) 1.345 17.849 ( 0.000 -1.612 0.000) 1.612 17.994 ( 0.000 -0.840 0.000) 0.840 18.024 ( 0.000 -0.146 0.000) 0.146 18.124 ( 0.000 -1.155 0.000) 1.155 18.257 ( 0.000 2.342 0.000) 2.342 18.281 ( 0.000 -0.569 0.000) 0.569 18.451 ( 0.000 0.147 0.000) 0.147 18.513 ( 0.000 4.730 0.000) 4.730 18.668 ( 0.000 -0.268 0.000) 0.268 18.735 ( 0.000 -0.311 0.000) 0.311 18.746 ( 0.000 -1.412 0.000) 1.412 18.804 ( 0.000 -0.089 0.000) 0.089 18.986 ( 0.000 1.489 0.000) 1.489 19.146 ( 0.000 -1.135 0.000) 1.135 19.264 ( 0.000 -0.159 0.000) 0.159 19.357 ( 0.000 -1.160 0.000) 1.160 19.357 ( 0.000 -1.196 0.000) 1.196 19.575 ( 0.000 3.695 0.000) 3.695 19.728 ( 0.000 0.705 0.000) 0.705 19.854 ( 0.000 0.046 0.000) 0.046 20.164 ( 0.000 0.343 0.000) 0.343 20.582 ( 0.000 3.024 0.000) 3.024 20.689 ( 0.000 -1.351 0.000) 1.351 20.771 ( 0.000 -0.736 0.000) 0.736 20.838 ( 0.000 -3.786 0.000) 3.786 20.867 ( 0.000 1.147 0.000) 1.147 20.873 ( 0.000 1.156 0.000) 1.156 20.921 ( 0.000 -2.916 0.000) 2.916 21.081 ( 0.000 0.444 0.000) 0.444 21.125 ( 0.000 -0.979 0.000) 0.979 21.310 ( 0.000 2.070 0.000) 2.070 21.324 ( 0.000 -0.842 0.000) 0.842 21.985 ( 0.000 -0.343 0.000) 0.343 22.267 ( 0.000 0.772 0.000) 0.772 22.322 ( 0.000 0.530 0.000) 0.530 22.398 ( 0.000 -7.254 0.000) 7.254 22.481 ( 0.000 1.418 0.000) 1.418 22.560 ( 0.000 1.866 0.000) 1.866 22.891 ( 0.000 0.009 0.000) 0.009 22.944 ( 0.000 -1.765 0.000) 1.765 23.080 ( 0.000 -3.242 0.000) 3.242 23.133 ( 0.000 2.496 0.000) 2.496 23.419 ( 0.000 1.283 0.000) 1.283 23.675 ( 0.000 1.527 0.000) 1.527 23.817 ( 0.000 -1.145 0.000) 1.145 23.833 ( 0.000 -0.407 0.000) 0.407 23.883 ( 0.000 0.244 0.000) 0.244 23.915 ( 0.000 3.926 0.000) 3.926 24.122 ( 0.000 1.089 0.000) 1.089 24.252 ( 0.000 0.228 0.000) 0.228 24.330 ( 0.000 0.414 0.000) 0.414 24.495 ( 0.000 -0.175 0.000) 0.175 24.526 ( 0.000 4.075 0.000) 4.075 24.568 ( 0.000 -0.264 0.000) 0.264 24.795 ( 0.000 0.870 0.000) 0.870 25.123 ( 0.000 -6.842 0.000) 6.842 25.173 ( 0.000 -6.512 0.000) 6.512 25.596 ( 0.000 1.179 0.000) 1.179 25.678 ( 0.000 0.638 0.000) 0.638 25.974 ( 0.000 -5.454 0.000) 5.454 26.024 ( 0.000 1.677 0.000) 1.677 26.084 ( 0.000 -0.993 0.000) 0.993 26.279 ( 0.000 -1.038 0.000) 1.038 26.323 ( 0.000 0.067 0.000) 0.067 26.505 ( 0.000 0.106 0.000) 0.106 27.441 ( 0.000 -0.169 0.000) 0.169 27.582 ( 0.000 -1.411 0.000) 1.411 27.764 ( 0.000 -2.547 0.000) 2.547 28.032 ( 0.000 0.243 0.000) 0.243 28.098 ( 0.000 -6.157 0.000) 6.157 28.239 ( 0.000 -18.294 0.000) 18.294 28.373 ( 0.000 -5.415 0.000) 5.415 28.575 ( 0.000 -8.896 0.000) 8.896 28.694 ( 0.000 -6.250 0.000) 6.250 28.848 ( 0.000 -4.806 0.000) 4.806 28.867 ( 0.000 -8.756 0.000) 8.756 28.915 ( 0.000 -0.721 0.000) 0.721 29.195 ( 0.000 -1.130 0.000) 1.130 29.663 ( 0.000 -8.379 0.000) 8.379 29.771 ( 0.000 0.286 0.000) 0.286 30.061 ( 0.000 -7.713 0.000) 7.713 30.081 ( 0.000 -1.660 0.000) 1.660 30.180 ( 0.000 -1.088 0.000) 1.088 30.716 ( 0.000 -0.035 0.000) 0.035 30.759 ( 0.000 -4.993 0.000) 4.993 30.771 ( 0.000 -2.445 0.000) 2.445 30.818 ( 0.000 -2.989 0.000) 2.989 30.889 ( 0.000 -2.114 0.000) 2.114 30.918 ( 0.000 -19.523 0.000) 19.523 31.064 ( 0.000 -2.477 0.000) 2.477 31.271 ( 0.000 1.816 0.000) 1.816 31.489 ( 0.000 -11.842 0.000) 11.842 31.608 ( 0.000 -8.828 0.000) 8.828 31.730 ( 0.000 -3.887 0.000) 3.887 31.951 ( 0.000 -5.074 0.000) 5.074 32.124 ( 0.000 -13.440 0.000) 13.440 32.137 ( 0.000 0.131 0.000) 0.131 32.385 ( 0.000 5.068 0.000) 5.068 32.550 ( 0.000 -14.428 0.000) 14.428 32.665 ( 0.000 -5.808 0.000) 5.808 33.207 ( 0.000 0.852 0.000) 0.852 33.415 ( 0.000 11.734 0.000) 11.734 33.673 ( 0.000 0.992 0.000) 0.992 33.704 ( 0.000 2.992 0.000) 2.992 33.873 ( 0.000 5.520 0.000) 5.520 34.467 ( 0.000 2.108 0.000) 2.108 34.998 ( 0.000 12.426 0.000) 12.426 38.332 ( 0.000 -34.609 0.000) 34.609 ======================= Grid point 11 (8/54) ======================= q-point: ( 0.25 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.449 ( 16.722 22.940 0.000) 28.387 1.560 ( 18.059 25.172 0.000) 30.980 1.863 ( 15.844 16.495 0.000) 22.872 2.190 ( -11.901 4.638 0.000) 12.773 2.317 ( 16.689 20.705 0.000) 26.593 2.589 ( 1.456 -2.114 0.000) 2.566 2.726 ( 6.883 9.681 0.000) 11.879 2.807 ( -6.460 5.173 0.000) 8.275 2.875 ( 8.234 6.135 0.000) 10.268 2.966 ( 1.529 2.080 0.000) 2.582 2.999 ( 0.753 4.677 0.000) 4.737 3.135 ( -3.942 4.418 0.000) 5.921 3.148 ( 6.199 1.419 0.000) 6.359 3.210 ( 8.616 3.806 0.000) 9.419 3.255 ( -9.744 2.863 0.000) 10.156 3.324 ( -3.635 -5.065 0.000) 6.234 3.333 ( -0.328 1.584 0.000) 1.618 3.438 ( 2.053 -4.575 0.000) 5.014 3.452 ( -5.257 0.107 0.000) 5.258 3.534 ( -5.238 -1.229 0.000) 5.380 3.566 ( -0.988 -1.705 0.000) 1.971 3.670 ( 3.483 -0.031 0.000) 3.483 3.894 ( -5.431 2.576 0.000) 6.011 4.016 ( -0.732 -0.383 0.000) 0.826 4.093 ( 4.602 -4.066 0.000) 6.141 4.215 ( -18.450 0.162 0.000) 18.450 4.357 ( -2.522 -1.908 0.000) 3.162 4.408 ( -10.204 3.380 0.000) 10.749 4.542 ( 3.063 -5.100 0.000) 5.949 4.585 ( -1.133 -9.043 0.000) 9.114 4.854 ( -5.069 -5.341 0.000) 7.363 4.880 ( -5.791 -5.371 0.000) 7.898 5.304 ( 7.373 0.521 0.000) 7.391 5.400 ( 17.973 -1.052 0.000) 18.004 5.638 ( -10.429 -0.828 0.000) 10.462 5.903 ( -7.530 -3.231 0.000) 8.194 6.294 ( 7.258 -0.269 0.000) 7.263 6.297 ( 15.962 -3.392 0.000) 16.318 6.385 ( -2.659 -4.381 0.000) 5.124 6.495 ( 8.501 -3.175 0.000) 9.074 6.681 ( -3.315 -2.850 0.000) 4.372 6.753 ( -5.301 -7.036 0.000) 8.809 6.903 ( 14.975 -1.038 0.000) 15.011 6.991 ( 18.066 -3.147 0.000) 18.338 7.086 ( -7.797 -4.248 0.000) 8.879 7.208 ( 5.090 -1.500 0.000) 5.306 7.477 ( 0.820 -5.132 0.000) 5.197 7.603 ( -8.453 0.734 0.000) 8.485 7.707 ( -14.704 -0.054 0.000) 14.704 7.746 ( 2.046 1.062 0.000) 2.305 7.832 ( 6.618 0.424 0.000) 6.632 7.997 ( 8.187 1.876 0.000) 8.399 8.174 ( 1.027 9.284 0.000) 9.340 8.183 ( -0.444 9.002 0.000) 9.013 8.203 ( -2.438 -1.105 0.000) 2.676 8.461 ( -6.933 0.605 0.000) 6.959 8.532 ( 3.514 1.783 0.000) 3.940 8.643 ( -0.242 2.701 0.000) 2.712 8.818 ( -14.557 -1.156 0.000) 14.603 8.878 ( -16.443 -1.644 0.000) 16.525 9.037 ( 20.044 -0.325 0.000) 20.047 9.423 ( -21.526 -2.109 0.000) 21.629 9.431 ( -43.421 -6.436 0.000) 43.896 9.467 ( 20.356 -6.627 0.000) 21.408 9.647 ( -8.780 0.175 0.000) 8.782 9.649 ( -7.608 0.840 0.000) 7.654 9.672 ( 15.419 -0.911 0.000) 15.446 9.750 ( -5.806 -1.703 0.000) 6.050 10.139 ( 5.497 -2.106 0.000) 5.887 10.208 ( 9.719 0.903 0.000) 9.761 10.241 ( -1.904 0.056 0.000) 1.905 10.281 ( -3.282 -6.523 0.000) 7.302 10.501 ( -1.325 -2.988 0.000) 3.269 10.690 ( -9.977 0.545 0.000) 9.992 10.829 ( -6.960 -2.977 0.000) 7.570 10.948 ( -18.416 -0.396 0.000) 18.420 11.104 ( 0.941 -3.162 0.000) 3.299 11.108 ( 6.594 -6.097 0.000) 8.981 11.155 ( -1.194 -5.641 0.000) 5.766 11.242 ( 0.588 -2.090 0.000) 2.172 11.300 ( 3.759 -1.532 0.000) 4.059 11.328 ( 4.670 -3.764 0.000) 5.998 11.528 ( 16.771 -5.208 0.000) 17.561 11.619 ( 8.595 0.120 0.000) 8.596 11.700 ( 6.560 -3.408 0.000) 7.393 11.990 ( -2.615 -2.371 0.000) 3.530 12.026 ( -5.014 -1.600 0.000) 5.263 12.087 ( -4.855 -0.532 0.000) 4.884 12.248 ( -3.667 1.293 0.000) 3.888 12.252 ( 7.006 3.423 0.000) 7.797 12.343 ( 11.053 5.820 0.000) 12.491 12.394 ( 1.877 1.440 0.000) 2.366 12.426 ( -1.492 -0.458 0.000) 1.561 12.465 ( -2.501 -1.743 0.000) 3.048 12.617 ( -14.696 1.396 0.000) 14.762 12.635 ( 3.877 0.820 0.000) 3.963 12.937 ( -2.256 3.130 0.000) 3.858 12.950 ( 9.243 -1.931 0.000) 9.443 13.044 ( -1.234 -2.355 0.000) 2.659 13.055 ( 8.845 3.295 0.000) 9.439 13.109 ( -4.721 -5.933 0.000) 7.582 13.284 ( -4.435 -0.358 0.000) 4.450 13.390 ( -4.855 2.172 0.000) 5.319 13.423 ( -2.271 -6.074 0.000) 6.485 13.593 ( 7.259 1.683 0.000) 7.452 13.664 ( 1.697 2.460 0.000) 2.989 13.721 ( 4.530 -0.926 0.000) 4.624 13.871 ( 6.151 -5.398 0.000) 8.184 14.049 ( 3.616 2.503 0.000) 4.398 14.146 ( -6.421 -0.499 0.000) 6.440 14.317 ( 18.108 2.979 0.000) 18.351 14.670 ( 6.118 6.097 0.000) 8.638 14.796 ( 14.507 -3.451 0.000) 14.912 14.814 ( -1.746 1.919 0.000) 2.594 15.272 ( -12.552 8.396 0.000) 15.101 15.286 ( -6.160 -2.264 0.000) 6.563 15.336 ( -10.845 -3.643 0.000) 11.440 15.548 ( -7.339 -3.820 0.000) 8.274 15.618 ( -5.610 5.869 0.000) 8.118 15.762 ( 0.750 1.514 0.000) 1.690 15.821 ( 1.815 0.262 0.000) 1.834 15.984 ( 3.639 0.648 0.000) 3.696 16.141 ( -25.835 -0.690 0.000) 25.844 16.396 ( -25.779 1.383 0.000) 25.816 16.792 ( 20.098 -2.245 0.000) 20.223 16.833 ( 9.590 -0.123 0.000) 9.590 17.181 ( 5.418 3.230 0.000) 6.307 17.205 ( 5.458 6.529 0.000) 8.510 17.389 ( 3.601 0.872 0.000) 3.705 17.526 ( 4.796 0.636 0.000) 4.838 17.603 ( 5.785 -1.387 0.000) 5.949 17.672 ( -0.245 0.638 0.000) 0.683 17.723 ( -3.326 1.899 0.000) 3.830 18.010 ( -16.792 3.494 0.000) 17.151 18.084 ( 11.412 -0.152 0.000) 11.413 18.106 ( -1.144 -1.050 0.000) 1.553 18.209 ( 1.241 -5.674 0.000) 5.808 18.255 ( 6.474 -3.105 0.000) 7.180 18.444 ( -0.930 3.696 0.000) 3.812 18.558 ( 1.220 0.337 0.000) 1.266 18.665 ( -0.290 -0.044 0.000) 0.293 18.683 ( -4.262 -1.670 0.000) 4.577 18.723 ( -2.764 0.111 0.000) 2.766 18.837 ( -11.174 0.190 0.000) 11.176 18.910 ( 9.382 -0.685 0.000) 9.407 19.168 ( 0.552 -0.927 0.000) 1.079 19.333 ( 1.021 -1.653 0.000) 1.943 19.390 ( 0.875 -1.281 0.000) 1.552 19.494 ( 15.114 1.151 0.000) 15.158 19.687 ( 9.171 1.781 0.000) 9.342 19.908 ( 16.055 1.330 0.000) 16.110 19.958 ( 8.917 0.852 0.000) 8.958 20.150 ( -1.325 0.464 0.000) 1.404 20.457 ( -11.053 2.568 0.000) 11.347 20.567 ( -8.646 0.218 0.000) 8.648 20.734 ( 2.683 -1.306 0.000) 2.984 20.794 ( 5.153 -0.385 0.000) 5.168 20.835 ( -1.427 -5.315 0.000) 5.503 20.878 ( -9.283 -1.383 0.000) 9.385 20.954 ( -0.100 0.288 0.000) 0.304 21.124 ( -11.867 -0.696 0.000) 11.887 21.168 ( 3.025 -1.446 0.000) 3.353 21.230 ( 5.143 -1.384 0.000) 5.326 21.312 ( -1.956 0.853 0.000) 2.134 22.011 ( -15.522 1.654 0.000) 15.610 22.039 ( -19.194 0.993 0.000) 19.219 22.200 ( 16.705 -0.788 0.000) 16.724 22.297 ( 0.282 -2.751 0.000) 2.765 22.728 ( 8.264 -1.204 0.000) 8.351 22.769 ( 17.999 1.476 0.000) 18.059 22.954 ( -3.979 0.818 0.000) 4.062 22.979 ( 3.373 -1.389 0.000) 3.648 23.033 ( -2.881 1.264 0.000) 3.146 23.189 ( 8.970 -3.831 0.000) 9.754 23.342 ( -7.589 1.418 0.000) 7.720 23.601 ( -12.714 -1.969 0.000) 12.866 23.680 ( -2.508 1.207 0.000) 2.783 23.802 ( -1.216 -0.232 0.000) 1.238 23.808 ( -7.455 2.531 0.000) 7.873 24.006 ( 6.143 -1.908 0.000) 6.433 24.056 ( -13.244 -0.890 0.000) 13.274 24.207 ( 6.288 1.585 0.000) 6.484 24.355 ( -6.711 0.260 0.000) 6.716 24.429 ( -4.697 3.481 0.000) 5.846 24.635 ( 13.185 -0.426 0.000) 13.192 25.049 ( 21.784 -0.157 0.000) 21.784 25.172 ( 45.703 -16.865 0.000) 48.715 25.256 ( 11.277 -5.987 0.000) 12.768 25.286 ( -12.062 -0.744 0.000) 12.085 25.541 ( 21.138 -2.748 0.000) 21.316 25.653 ( -3.457 0.735 0.000) 3.535 25.933 ( -8.024 1.047 0.000) 8.092 25.954 ( -0.925 -5.519 0.000) 5.596 26.121 ( 14.673 -6.931 0.000) 16.228 26.332 ( 0.143 -0.173 0.000) 0.224 26.511 ( 1.004 -0.357 0.000) 1.066 26.736 ( 34.733 -2.470 0.000) 34.820 27.219 ( -34.429 -5.781 0.000) 34.911 27.457 ( -3.395 -0.553 0.000) 3.439 27.579 ( -0.015 -1.709 0.000) 1.709 28.019 ( -24.122 -11.549 0.000) 26.745 28.077 ( 4.314 0.063 0.000) 4.314 28.121 ( -24.266 -23.945 0.000) 34.091 28.360 ( -9.222 -5.745 0.000) 10.865 28.469 ( -2.550 -5.468 0.000) 6.033 28.567 ( 12.855 -3.988 0.000) 13.459 28.635 ( -10.354 -4.466 0.000) 11.276 29.103 ( -7.396 -1.213 0.000) 7.495 29.105 ( 16.560 -7.786 0.000) 18.299 29.185 ( 14.187 -1.971 0.000) 14.323 29.653 ( -4.457 -4.257 0.000) 6.163 29.863 ( 8.613 0.064 0.000) 8.613 29.876 ( -16.550 -7.508 0.000) 18.173 30.164 ( -2.686 -1.346 0.000) 3.005 30.235 ( 14.133 -2.045 0.000) 14.280 30.670 ( -6.694 -1.756 0.000) 6.920 30.683 ( -2.017 -1.537 0.000) 2.536 30.768 ( -5.366 -2.981 0.000) 6.138 30.802 ( 4.587 -6.506 0.000) 7.961 30.952 ( 2.735 -2.257 0.000) 3.546 30.982 ( 4.779 -13.951 0.000) 14.746 31.076 ( 0.816 -1.978 0.000) 2.140 31.339 ( 5.505 -0.583 0.000) 5.535 31.512 ( 1.212 -8.028 0.000) 8.119 31.558 ( -2.871 -10.062 0.000) 10.463 31.656 ( -6.635 -4.917 0.000) 8.258 32.012 ( 4.829 -5.053 0.000) 6.989 32.113 ( -0.908 -13.136 0.000) 13.167 32.134 ( 0.212 -1.507 0.000) 1.522 32.282 ( -6.611 -0.326 0.000) 6.619 32.553 ( 0.936 -12.563 0.000) 12.598 32.785 ( 3.272 -0.609 0.000) 3.328 33.055 ( -13.625 2.800 0.000) 13.910 33.187 ( -2.496 0.482 0.000) 2.542 33.756 ( 7.455 2.939 0.000) 8.013 33.834 ( 4.194 4.140 0.000) 5.894 34.136 ( 12.812 7.319 0.000) 14.755 34.383 ( -7.590 2.300 0.000) 7.931 35.266 ( 32.243 15.812 0.000) 35.912 37.605 ( -63.820 -9.107 0.000) 64.467 ======================= Grid point 12 (9/54) ======================= q-point: (-0.50 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 51 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.743 ( -1.800 16.265 0.000) 16.364 1.743 ( 1.800 16.265 0.000) 16.364 1.938 ( -3.246 14.256 0.000) 14.621 1.938 ( 3.246 14.256 0.000) 14.621 2.667 ( -1.757 1.688 0.000) 2.436 2.667 ( 1.757 1.688 0.000) 2.436 2.883 ( -11.227 5.422 0.000) 12.468 2.883 ( 11.227 5.422 0.000) 12.468 2.917 ( -0.614 5.199 0.000) 5.235 2.917 ( 0.614 5.199 0.000) 5.235 3.046 ( -0.282 3.890 0.000) 3.900 3.046 ( 0.282 3.890 0.000) 3.900 3.169 ( -10.320 4.001 0.000) 11.068 3.169 ( 10.320 4.001 0.000) 11.068 3.296 ( -6.604 2.377 0.000) 7.019 3.296 ( 6.604 2.377 0.000) 7.019 3.346 ( -0.005 -2.124 0.000) 2.124 3.346 ( 0.005 -2.124 0.000) 2.124 3.454 ( -0.019 4.293 0.000) 4.293 3.454 ( 0.019 4.293 0.000) 4.293 3.658 ( -11.917 -2.310 0.000) 12.139 3.658 ( 11.917 -2.310 0.000) 12.139 3.762 ( -6.126 5.411 0.000) 8.174 3.762 ( 6.126 5.411 0.000) 8.174 4.145 ( -0.028 -4.512 0.000) 4.512 4.145 ( 0.028 -4.512 0.000) 4.512 4.335 ( -0.222 -0.097 0.000) 0.243 4.335 ( 0.222 -0.097 0.000) 0.243 4.572 ( -0.050 -7.113 0.000) 7.113 4.572 ( 0.050 -7.113 0.000) 7.113 4.802 ( -0.175 -3.853 0.000) 3.857 4.802 ( 0.175 -3.853 0.000) 3.857 5.445 ( -3.973 -1.148 0.000) 4.135 5.445 ( 3.973 -1.148 0.000) 4.135 5.704 ( -10.564 -3.220 0.000) 11.044 5.704 ( 10.564 -3.220 0.000) 11.044 6.420 ( -1.616 -2.231 0.000) 2.755 6.420 ( 1.616 -2.231 0.000) 2.755 6.484 ( -5.692 -1.442 0.000) 5.872 6.484 ( 5.692 -1.442 0.000) 5.872 6.632 ( -2.721 -4.906 0.000) 5.611 6.632 ( 2.721 -4.906 0.000) 5.611 7.174 ( -5.075 1.589 0.000) 5.318 7.174 ( 5.075 1.589 0.000) 5.318 7.264 ( -2.117 -5.425 0.000) 5.824 7.264 ( 2.117 -5.425 0.000) 5.824 7.414 ( -5.688 -1.038 0.000) 5.782 7.414 ( 5.688 -1.038 0.000) 5.782 7.656 ( -10.882 -2.450 0.000) 11.154 7.656 ( 10.882 -2.450 0.000) 11.154 8.007 ( -3.381 -3.264 0.000) 4.700 8.007 ( 3.381 -3.264 0.000) 4.700 8.182 ( -0.028 11.076 0.000) 11.076 8.182 ( 0.028 11.076 0.000) 11.076 8.264 ( -8.713 3.078 0.000) 9.241 8.264 ( 8.713 3.078 0.000) 9.241 8.589 ( -4.736 -5.232 0.000) 7.057 8.589 ( 4.736 -5.232 0.000) 7.057 8.685 ( -1.830 0.835 0.000) 2.012 8.685 ( 1.830 0.835 0.000) 2.012 9.004 ( -9.034 -0.600 0.000) 9.054 9.004 ( 9.034 -0.600 0.000) 9.054 9.419 ( -14.880 -0.276 0.000) 14.882 9.419 ( 14.880 -0.276 0.000) 14.882 9.617 ( -1.171 0.371 0.000) 1.228 9.617 ( 1.171 0.371 0.000) 1.228 9.900 ( -4.236 -4.685 0.000) 6.316 9.900 ( 4.236 -4.685 0.000) 6.316 10.040 ( -0.326 -2.249 0.000) 2.273 10.040 ( 0.326 -2.249 0.000) 2.273 10.357 ( -0.265 0.986 0.000) 1.021 10.357 ( 0.265 0.986 0.000) 1.021 10.598 ( -8.709 -2.301 0.000) 9.007 10.598 ( 8.709 -2.301 0.000) 9.007 10.672 ( -10.750 -2.876 0.000) 11.128 10.672 ( 10.750 -2.876 0.000) 11.128 11.129 ( -0.051 -4.405 0.000) 4.406 11.129 ( 0.051 -4.405 0.000) 4.406 11.220 ( -2.051 -6.546 0.000) 6.860 11.220 ( 2.051 -6.546 0.000) 6.860 11.345 ( -0.147 -0.086 0.000) 0.170 11.345 ( 0.147 -0.086 0.000) 0.170 11.743 ( -0.332 -5.495 0.000) 5.505 11.743 ( 0.332 -5.495 0.000) 5.505 11.866 ( -9.139 0.393 0.000) 9.148 11.866 ( 9.139 0.393 0.000) 9.148 11.972 ( -0.107 -0.494 0.000) 0.505 11.972 ( 0.107 -0.494 0.000) 0.505 12.236 ( -5.061 1.025 0.000) 5.164 12.236 ( 5.061 1.025 0.000) 5.164 12.383 ( -3.531 2.471 0.000) 4.310 12.383 ( 3.531 2.471 0.000) 4.310 12.458 ( -0.069 3.530 0.000) 3.530 12.458 ( 0.069 3.530 0.000) 3.530 12.647 ( -8.945 2.044 0.000) 9.175 12.647 ( 8.945 2.044 0.000) 9.175 12.923 ( -1.355 -0.860 0.000) 1.604 12.923 ( 1.355 -0.860 0.000) 1.604 13.065 ( -0.072 -4.329 0.000) 4.329 13.065 ( 0.072 -4.329 0.000) 4.329 13.236 ( -5.254 0.737 0.000) 5.305 13.236 ( 5.254 0.737 0.000) 5.305 13.323 ( -2.664 1.513 0.000) 3.064 13.323 ( 2.664 1.513 0.000) 3.064 13.666 ( -0.014 2.357 0.000) 2.358 13.666 ( 0.014 2.357 0.000) 2.358 13.906 ( -6.493 -0.898 0.000) 6.555 13.906 ( 6.493 -0.898 0.000) 6.555 14.088 ( -7.216 -3.921 0.000) 8.213 14.088 ( 7.216 -3.921 0.000) 8.213 14.580 ( -10.042 6.158 0.000) 11.780 14.580 ( 10.042 6.158 0.000) 11.780 14.942 ( -4.107 5.626 0.000) 6.966 14.942 ( 4.107 5.626 0.000) 6.966 15.166 ( -5.218 -3.397 0.000) 6.226 15.166 ( 5.218 -3.397 0.000) 6.226 15.389 ( -12.799 -1.313 0.000) 12.866 15.389 ( 12.799 -1.313 0.000) 12.866 15.565 ( -8.868 -2.762 0.000) 9.288 15.565 ( 8.868 -2.762 0.000) 9.288 15.856 ( -0.464 1.386 0.000) 1.461 15.856 ( 0.464 1.386 0.000) 1.461 16.082 ( -6.994 2.916 0.000) 7.578 16.082 ( 6.994 2.916 0.000) 7.578 16.981 ( -1.296 -2.048 0.000) 2.424 16.981 ( 1.296 -2.048 0.000) 2.424 17.289 ( -5.916 0.621 0.000) 5.949 17.289 ( 5.916 0.621 0.000) 5.949 17.473 ( -7.534 4.936 0.000) 9.007 17.473 ( 7.534 4.936 0.000) 9.007 17.570 ( -0.296 0.163 0.000) 0.338 17.570 ( 0.296 0.163 0.000) 0.338 17.827 ( -4.230 2.305 0.000) 4.817 17.827 ( 4.230 2.305 0.000) 4.817 18.114 ( -0.953 -1.831 0.000) 2.064 18.114 ( 0.953 -1.831 0.000) 2.064 18.368 ( -10.376 3.005 0.000) 10.802 18.368 ( 10.376 3.005 0.000) 10.802 18.451 ( -5.139 -5.361 0.000) 7.426 18.451 ( 5.139 -5.361 0.000) 7.426 18.663 ( -0.027 -0.044 0.000) 0.052 18.663 ( 0.027 -0.044 0.000) 0.052 18.675 ( -0.053 0.038 0.000) 0.065 18.675 ( 0.053 0.038 0.000) 0.065 19.093 ( -3.775 -1.101 0.000) 3.933 19.093 ( 3.775 -1.101 0.000) 3.933 19.371 ( -1.442 -0.985 0.000) 1.747 19.371 ( 1.442 -0.985 0.000) 1.747 19.746 ( -6.309 0.681 0.000) 6.346 19.746 ( 6.309 0.681 0.000) 6.346 20.102 ( -2.543 0.701 0.000) 2.637 20.102 ( 2.543 0.701 0.000) 2.637 20.227 ( -11.802 2.398 0.000) 12.044 20.227 ( 11.802 2.398 0.000) 12.044 20.591 ( -9.008 -0.621 0.000) 9.030 20.591 ( 9.008 -0.621 0.000) 9.030 20.801 ( -0.309 -5.146 0.000) 5.156 20.801 ( 0.309 -5.146 0.000) 5.156 20.935 ( -4.471 -0.478 0.000) 4.496 20.935 ( 4.471 -0.478 0.000) 4.496 21.072 ( -10.493 1.187 0.000) 10.560 21.072 ( 10.493 1.187 0.000) 10.560 21.271 ( -5.980 -2.524 0.000) 6.491 21.271 ( 5.980 -2.524 0.000) 6.491 21.819 ( -0.026 1.899 0.000) 1.899 21.819 ( 0.026 1.899 0.000) 1.899 22.414 ( -0.832 -1.347 0.000) 1.583 22.414 ( 0.832 -1.347 0.000) 1.583 22.786 ( -2.297 0.287 0.000) 2.315 22.786 ( 2.297 0.287 0.000) 2.315 23.028 ( -2.300 0.135 0.000) 2.304 23.028 ( 2.300 0.135 0.000) 2.304 23.121 ( -12.654 1.132 0.000) 12.704 23.121 ( 12.654 1.132 0.000) 12.704 23.375 ( -8.863 -3.679 0.000) 9.596 23.375 ( 8.863 -3.679 0.000) 9.596 23.689 ( -2.764 1.685 0.000) 3.237 23.689 ( 2.764 1.685 0.000) 3.237 23.836 ( -5.813 -0.864 0.000) 5.877 23.836 ( 5.813 -0.864 0.000) 5.877 24.163 ( -6.116 -0.913 0.000) 6.183 24.163 ( 6.116 -0.913 0.000) 6.183 24.339 ( -2.060 2.848 0.000) 3.515 24.339 ( 2.060 2.848 0.000) 3.515 24.945 ( -16.588 0.944 0.000) 16.615 24.945 ( 16.588 0.944 0.000) 16.615 25.431 ( -2.589 -1.907 0.000) 3.216 25.431 ( 2.589 -1.907 0.000) 3.216 25.516 ( -0.107 -5.410 0.000) 5.411 25.516 ( 0.107 -5.410 0.000) 5.411 25.800 ( -3.069 0.188 0.000) 3.074 25.800 ( 3.069 0.188 0.000) 3.074 26.215 ( -17.262 -4.481 0.000) 17.834 26.215 ( 17.262 -4.481 0.000) 17.834 26.611 ( -17.274 -3.919 0.000) 17.713 26.611 ( 17.274 -3.919 0.000) 17.713 27.011 ( -48.944 -30.243 0.000) 57.533 27.011 ( 48.944 -30.243 0.000) 57.533 27.424 ( -14.408 -3.982 0.000) 14.948 27.424 ( 14.408 -3.982 0.000) 14.948 27.637 ( -2.269 -9.836 0.000) 10.094 27.637 ( 2.269 -9.836 0.000) 10.094 28.188 ( -6.765 -0.885 0.000) 6.822 28.188 ( 6.765 -0.885 0.000) 6.822 28.485 ( -4.265 -6.090 0.000) 7.436 28.485 ( 4.265 -6.090 0.000) 7.436 28.877 ( -13.383 -1.709 0.000) 13.491 28.877 ( 13.383 -1.709 0.000) 13.491 29.429 ( -0.376 -4.953 0.000) 4.967 29.429 ( 0.376 -4.953 0.000) 4.967 29.527 ( -6.783 -4.541 0.000) 8.163 29.527 ( 6.783 -4.541 0.000) 8.163 30.051 ( -8.483 -1.086 0.000) 8.552 30.051 ( 8.483 -1.086 0.000) 8.552 30.504 ( -11.050 -1.062 0.000) 11.101 30.504 ( 11.050 -1.062 0.000) 11.101 30.681 ( -0.883 -1.657 0.000) 1.877 30.681 ( 0.883 -1.657 0.000) 1.877 30.919 ( -3.617 -7.447 0.000) 8.279 30.919 ( 3.617 -7.447 0.000) 8.279 31.059 ( -1.707 -5.371 0.000) 5.636 31.059 ( 1.707 -5.371 0.000) 5.636 31.462 ( -3.887 -1.179 0.000) 4.062 31.462 ( 3.887 -1.179 0.000) 4.062 31.555 ( -0.532 -9.621 0.000) 9.636 31.555 ( 0.532 -9.621 0.000) 9.636 32.089 ( -0.397 -9.913 0.000) 9.921 32.089 ( 0.397 -9.913 0.000) 9.921 32.172 ( -2.891 -2.475 0.000) 3.806 32.172 ( 2.891 -2.475 0.000) 3.806 32.633 ( -6.632 -5.127 0.000) 8.383 32.633 ( 6.632 -5.127 0.000) 8.383 33.094 ( -2.829 -0.050 0.000) 2.829 33.094 ( 2.829 -0.050 0.000) 2.829 33.878 ( -0.094 5.561 0.000) 5.562 33.878 ( 0.094 5.561 0.000) 5.562 34.245 ( -0.254 3.184 0.000) 3.194 34.245 ( 0.254 3.184 0.000) 3.194 36.264 ( -61.868 14.822 0.000) 63.619 36.264 ( 61.868 14.822 0.000) 63.619 ======================= Grid point 15 (10/54) ======================= q-point: ( 0.00 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.710 ( 0.000 23.720 0.000) 23.720 1.762 ( 0.000 21.461 0.000) 21.461 2.375 ( 0.000 5.263 0.000) 5.263 2.395 ( 0.000 33.477 0.000) 33.477 2.470 ( 0.000 -5.063 0.000) 5.063 2.579 ( 0.000 17.803 0.000) 17.803 2.880 ( 0.000 2.772 0.000) 2.772 2.881 ( 0.000 10.931 0.000) 10.931 2.988 ( 0.000 3.244 0.000) 3.244 3.030 ( 0.000 5.025 0.000) 5.025 3.065 ( 0.000 1.676 0.000) 1.676 3.192 ( 0.000 10.569 0.000) 10.569 3.192 ( 0.000 2.640 0.000) 2.640 3.202 ( 0.000 -3.492 0.000) 3.492 3.269 ( 0.000 -8.000 0.000) 8.000 3.326 ( 0.000 3.769 0.000) 3.769 3.348 ( 0.000 -2.617 0.000) 2.617 3.421 ( 0.000 3.617 0.000) 3.617 3.525 ( 0.000 0.675 0.000) 0.675 3.547 ( 0.000 -2.672 0.000) 2.672 3.564 ( 0.000 1.246 0.000) 1.246 3.633 ( 0.000 7.509 0.000) 7.509 3.827 ( 0.000 -6.179 0.000) 6.179 3.979 ( 0.000 -2.356 0.000) 2.356 4.071 ( 0.000 3.987 0.000) 3.987 4.338 ( 0.000 -8.913 0.000) 8.913 4.351 ( 0.000 -9.903 0.000) 9.903 4.359 ( 0.000 -3.243 0.000) 3.243 4.421 ( 0.000 -1.307 0.000) 1.307 4.654 ( 0.000 -1.894 0.000) 1.894 4.800 ( 0.000 -8.503 0.000) 8.503 4.948 ( 0.000 2.925 0.000) 2.925 5.095 ( 0.000 -3.437 0.000) 3.437 5.199 ( 0.000 -1.060 0.000) 1.060 5.760 ( 0.000 -0.108 0.000) 0.108 5.922 ( 0.000 -3.270 0.000) 3.270 5.973 ( 0.000 -2.928 0.000) 2.928 6.215 ( 0.000 -1.303 0.000) 1.303 6.337 ( 0.000 -3.245 0.000) 3.245 6.432 ( 0.000 -7.689 0.000) 7.689 6.554 ( 0.000 1.651 0.000) 1.651 6.637 ( 0.000 -11.274 0.000) 11.274 6.686 ( 0.000 -4.091 0.000) 4.091 6.753 ( 0.000 -0.316 0.000) 0.316 7.111 ( 0.000 -2.448 0.000) 2.448 7.159 ( 0.000 -4.759 0.000) 4.759 7.482 ( 0.000 3.568 0.000) 3.568 7.640 ( 0.000 -2.803 0.000) 2.803 7.656 ( 0.000 -5.244 0.000) 5.244 7.717 ( 0.000 -2.887 0.000) 2.887 7.904 ( 0.000 0.674 0.000) 0.674 7.995 ( 0.000 2.341 0.000) 2.341 8.194 ( 0.000 -1.943 0.000) 1.943 8.289 ( 0.000 0.482 0.000) 0.482 8.337 ( 0.000 8.142 0.000) 8.142 8.443 ( 0.000 2.337 0.000) 2.337 8.693 ( 0.000 3.886 0.000) 3.886 8.699 ( 0.000 1.451 0.000) 1.451 8.781 ( 0.000 -0.130 0.000) 0.130 8.915 ( 0.000 -25.640 0.000) 25.640 8.968 ( 0.000 -0.678 0.000) 0.678 9.112 ( 0.000 1.906 0.000) 1.906 9.317 ( 0.000 -2.231 0.000) 2.231 9.580 ( 0.000 -3.497 0.000) 3.497 9.724 ( 0.000 -2.920 0.000) 2.920 9.792 ( 0.000 3.825 0.000) 3.825 9.849 ( 0.000 -1.867 0.000) 1.867 9.893 ( 0.000 -0.318 0.000) 0.318 10.056 ( 0.000 -1.593 0.000) 1.593 10.142 ( 0.000 1.247 0.000) 1.247 10.270 ( 0.000 -3.917 0.000) 3.917 10.367 ( 0.000 -0.913 0.000) 0.913 10.415 ( 0.000 -7.120 0.000) 7.120 10.606 ( 0.000 -3.314 0.000) 3.314 10.819 ( 0.000 -4.064 0.000) 4.064 10.904 ( 0.000 -7.044 0.000) 7.044 11.042 ( 0.000 -5.273 0.000) 5.273 11.079 ( 0.000 -1.413 0.000) 1.413 11.117 ( 0.000 -1.471 0.000) 1.471 11.186 ( 0.000 -0.661 0.000) 0.661 11.200 ( 0.000 0.179 0.000) 0.179 11.224 ( 0.000 -6.262 0.000) 6.262 11.360 ( 0.000 3.320 0.000) 3.320 11.408 ( 0.000 -3.606 0.000) 3.606 11.534 ( 0.000 -4.027 0.000) 4.027 12.000 ( 0.000 -1.039 0.000) 1.039 12.016 ( 0.000 -4.025 0.000) 4.025 12.077 ( 0.000 1.047 0.000) 1.047 12.199 ( 0.000 2.199 0.000) 2.199 12.273 ( 0.000 0.356 0.000) 0.356 12.317 ( 0.000 0.917 0.000) 0.917 12.321 ( 0.000 2.461 0.000) 2.461 12.356 ( 0.000 -4.987 0.000) 4.987 12.638 ( 0.000 2.337 0.000) 2.337 12.712 ( 0.000 3.235 0.000) 3.235 12.804 ( 0.000 -0.618 0.000) 0.618 12.816 ( 0.000 5.472 0.000) 5.472 12.819 ( 0.000 -2.529 0.000) 2.529 13.004 ( 0.000 1.157 0.000) 1.157 13.022 ( 0.000 -5.505 0.000) 5.505 13.089 ( 0.000 -4.825 0.000) 4.825 13.286 ( 0.000 -1.600 0.000) 1.600 13.343 ( 0.000 -6.719 0.000) 6.719 13.514 ( 0.000 -2.344 0.000) 2.344 13.516 ( 0.000 -3.125 0.000) 3.125 13.613 ( 0.000 3.806 0.000) 3.806 13.647 ( 0.000 3.345 0.000) 3.345 13.816 ( 0.000 -3.024 0.000) 3.024 13.982 ( 0.000 -0.076 0.000) 0.076 14.156 ( 0.000 5.898 0.000) 5.898 14.245 ( 0.000 1.213 0.000) 1.213 14.610 ( 0.000 -0.304 0.000) 0.304 14.632 ( 0.000 1.847 0.000) 1.847 14.896 ( 0.000 3.709 0.000) 3.709 15.405 ( 0.000 -3.819 0.000) 3.819 15.426 ( 0.000 0.343 0.000) 0.343 15.551 ( 0.000 -4.723 0.000) 4.723 15.599 ( 0.000 8.528 0.000) 8.528 15.730 ( 0.000 -3.023 0.000) 3.023 15.767 ( 0.000 3.313 0.000) 3.313 15.838 ( 0.000 4.996 0.000) 4.996 15.967 ( 0.000 -1.598 0.000) 1.598 16.463 ( 0.000 -0.641 0.000) 0.641 16.533 ( 0.000 2.424 0.000) 2.424 16.617 ( 0.000 -2.599 0.000) 2.599 16.907 ( 0.000 0.622 0.000) 0.622 17.153 ( 0.000 2.554 0.000) 2.554 17.224 ( 0.000 4.897 0.000) 4.897 17.344 ( 0.000 3.440 0.000) 3.440 17.433 ( 0.000 2.800 0.000) 2.800 17.484 ( 0.000 0.484 0.000) 0.484 17.642 ( 0.000 -1.362 0.000) 1.362 17.826 ( 0.000 -0.607 0.000) 0.607 17.977 ( 0.000 -0.721 0.000) 0.721 18.021 ( 0.000 -0.200 0.000) 0.200 18.103 ( 0.000 -1.077 0.000) 1.077 18.270 ( 0.000 -0.510 0.000) 0.510 18.301 ( 0.000 1.892 0.000) 1.892 18.454 ( 0.000 0.158 0.000) 0.158 18.595 ( 0.000 3.391 0.000) 3.391 18.663 ( 0.000 -0.260 0.000) 0.260 18.723 ( 0.000 -0.869 0.000) 0.869 18.728 ( 0.000 -0.334 0.000) 0.334 18.802 ( 0.000 -0.039 0.000) 0.039 19.013 ( 0.000 1.138 0.000) 1.138 19.122 ( 0.000 -1.216 0.000) 1.216 19.258 ( 0.000 -0.401 0.000) 0.401 19.336 ( 0.000 -0.838 0.000) 0.838 19.338 ( 0.000 -0.718 0.000) 0.718 19.642 ( 0.000 2.851 0.000) 2.851 19.743 ( 0.000 0.752 0.000) 0.752 19.854 ( 0.000 0.004 0.000) 0.004 20.172 ( 0.000 0.371 0.000) 0.371 20.645 ( 0.000 2.222 0.000) 2.222 20.671 ( 0.000 0.542 0.000) 0.542 20.751 ( 0.000 -1.149 0.000) 1.149 20.753 ( 0.000 -4.224 0.000) 4.224 20.872 ( 0.000 -2.125 0.000) 2.125 20.894 ( 0.000 1.484 0.000) 1.484 20.897 ( 0.000 1.233 0.000) 1.233 21.093 ( 0.000 0.738 0.000) 0.738 21.098 ( 0.000 -1.725 0.000) 1.725 21.300 ( 0.000 -1.482 0.000) 1.482 21.352 ( 0.000 2.018 0.000) 2.018 21.977 ( 0.000 -0.397 0.000) 0.397 22.226 ( 0.000 -4.994 0.000) 4.994 22.327 ( 0.000 0.664 0.000) 0.664 22.333 ( 0.000 0.558 0.000) 0.558 22.514 ( 0.000 1.884 0.000) 1.884 22.603 ( 0.000 2.265 0.000) 2.265 22.901 ( 0.000 0.973 0.000) 0.973 22.909 ( 0.000 -1.721 0.000) 1.721 23.015 ( 0.000 -3.073 0.000) 3.073 23.183 ( 0.000 2.388 0.000) 2.388 23.452 ( 0.000 1.999 0.000) 1.999 23.713 ( 0.000 2.092 0.000) 2.092 23.802 ( 0.000 -0.149 0.000) 0.149 23.833 ( 0.000 0.299 0.000) 0.299 23.889 ( 0.000 0.319 0.000) 0.319 24.007 ( 0.000 5.110 0.000) 5.110 24.150 ( 0.000 1.657 0.000) 1.657 24.256 ( 0.000 0.215 0.000) 0.215 24.337 ( 0.000 0.174 0.000) 0.174 24.492 ( 0.000 -0.098 0.000) 0.098 24.563 ( 0.000 -0.190 0.000) 0.190 24.604 ( 0.000 3.448 0.000) 3.448 24.814 ( 0.000 0.972 0.000) 0.972 24.998 ( 0.000 -5.439 0.000) 5.439 25.045 ( 0.000 -5.770 0.000) 5.770 25.626 ( 0.000 1.754 0.000) 1.754 25.689 ( 0.000 0.381 0.000) 0.381 25.879 ( 0.000 -3.956 0.000) 3.956 26.059 ( 0.000 1.771 0.000) 1.771 26.060 ( 0.000 -1.337 0.000) 1.337 26.257 ( 0.000 -1.167 0.000) 1.167 26.325 ( 0.000 0.077 0.000) 0.077 26.507 ( 0.000 0.104 0.000) 0.104 27.434 ( 0.000 -0.533 0.000) 0.533 27.561 ( 0.000 -0.630 0.000) 0.630 27.705 ( 0.000 -3.433 0.000) 3.433 27.930 ( 0.000 -12.221 0.000) 12.221 27.970 ( 0.000 -6.411 0.000) 6.411 28.036 ( 0.000 0.133 0.000) 0.133 28.142 ( 0.000 -14.492 0.000) 14.492 28.467 ( 0.000 -1.775 0.000) 1.775 28.636 ( 0.000 -1.756 0.000) 1.756 28.658 ( 0.000 -11.346 0.000) 11.346 28.745 ( 0.000 -5.277 0.000) 5.277 28.900 ( 0.000 -0.795 0.000) 0.795 29.174 ( 0.000 -0.900 0.000) 0.900 29.528 ( 0.000 -4.882 0.000) 4.882 29.774 ( 0.000 -0.043 0.000) 0.043 29.909 ( 0.000 -7.107 0.000) 7.107 30.048 ( 0.000 -1.589 0.000) 1.589 30.157 ( 0.000 -1.130 0.000) 1.130 30.624 ( 0.000 -10.679 0.000) 10.679 30.669 ( 0.000 -3.886 0.000) 3.886 30.714 ( 0.000 -0.146 0.000) 0.146 30.721 ( 0.000 -5.895 0.000) 5.895 30.729 ( 0.000 -1.732 0.000) 1.732 30.869 ( 0.000 -0.200 0.000) 0.200 31.018 ( 0.000 -2.157 0.000) 2.157 31.289 ( 0.000 -8.230 0.000) 8.230 31.296 ( 0.000 0.653 0.000) 0.653 31.447 ( 0.000 -7.197 0.000) 7.197 31.658 ( 0.000 -3.198 0.000) 3.198 31.859 ( 0.000 -4.171 0.000) 4.171 31.906 ( 0.000 -8.648 0.000) 8.648 32.115 ( 0.000 -2.099 0.000) 2.099 32.303 ( 0.000 -10.064 0.000) 10.064 32.440 ( 0.000 0.787 0.000) 0.787 32.569 ( 0.000 -4.004 0.000) 4.004 33.210 ( 0.000 -0.411 0.000) 0.411 33.517 ( 0.000 -0.387 0.000) 0.387 33.681 ( 0.000 -0.408 0.000) 0.408 33.720 ( 0.000 -1.181 0.000) 1.181 33.916 ( 0.000 -0.614 0.000) 0.614 34.425 ( 0.000 -5.560 0.000) 5.560 35.150 ( 0.000 3.083 0.000) 3.083 37.586 ( 0.000 -38.250 0.000) 38.250 ======================= Grid point 16 (11/54) ======================= q-point: ( 0.25 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.869 ( 9.568 18.183 0.000) 20.546 1.982 ( 19.246 17.324 0.000) 25.895 2.278 ( -8.934 23.219 0.000) 24.879 2.331 ( -3.286 10.304 0.000) 10.815 2.521 ( 4.880 -4.202 0.000) 6.440 2.738 ( 13.442 20.244 0.000) 24.300 2.850 ( -7.476 -0.176 0.000) 7.478 2.934 ( 5.031 9.201 0.000) 10.486 2.984 ( 5.576 3.687 0.000) 6.685 3.022 ( -0.727 3.585 0.000) 3.658 3.132 ( -1.506 5.880 0.000) 6.070 3.169 ( 5.287 1.263 0.000) 5.436 3.206 ( -0.617 -5.633 0.000) 5.667 3.230 ( 0.519 4.848 0.000) 4.875 3.288 ( -0.434 3.746 0.000) 3.771 3.294 ( -1.025 -0.125 0.000) 1.033 3.315 ( -0.119 -1.160 0.000) 1.166 3.416 ( 1.821 4.328 0.000) 4.696 3.498 ( -3.971 3.994 0.000) 5.632 3.505 ( -3.693 -1.638 0.000) 4.040 3.520 ( -0.131 -1.316 0.000) 1.322 3.776 ( 9.654 8.645 0.000) 12.958 3.866 ( 1.046 -4.328 0.000) 4.452 4.014 ( 2.942 -3.224 0.000) 4.365 4.051 ( -1.859 3.057 0.000) 3.578 4.260 ( -15.386 4.012 0.000) 15.900 4.285 ( -1.598 -5.653 0.000) 5.875 4.370 ( 0.178 -8.629 0.000) 8.631 4.424 ( 2.004 -6.477 0.000) 6.780 4.483 ( -11.026 0.541 0.000) 11.039 4.764 ( -2.451 -6.140 0.000) 6.611 4.778 ( -6.098 -1.763 0.000) 6.348 5.283 ( 5.931 -2.515 0.000) 6.442 5.348 ( 14.515 -4.214 0.000) 15.114 5.621 ( -11.508 -0.741 0.000) 11.532 5.823 ( -8.730 -4.531 0.000) 9.835 6.235 ( 20.159 -2.665 0.000) 20.335 6.272 ( 5.745 -1.781 0.000) 6.015 6.306 ( -0.901 -3.707 0.000) 3.815 6.424 ( 2.384 -4.038 0.000) 4.689 6.609 ( 3.430 -7.114 0.000) 7.898 6.612 ( -3.106 -3.472 0.000) 4.658 6.872 ( 17.561 -1.657 0.000) 17.639 6.960 ( 14.991 -1.140 0.000) 15.034 6.988 ( -9.856 -5.588 0.000) 11.329 7.169 ( 4.750 -2.545 0.000) 5.389 7.388 ( -4.754 -3.765 0.000) 6.065 7.595 ( -8.557 -1.545 0.000) 8.696 7.715 ( 4.865 -3.260 0.000) 5.856 7.733 ( -13.867 2.385 0.000) 14.070 7.844 ( 6.972 0.948 0.000) 7.036 7.991 ( 5.260 -1.769 0.000) 5.550 8.170 ( -3.476 -2.552 0.000) 4.312 8.287 ( -0.202 1.393 0.000) 1.408 8.350 ( 1.350 6.858 0.000) 6.990 8.461 ( -1.836 -0.537 0.000) 1.913 8.528 ( -11.543 -6.369 0.000) 13.183 8.685 ( -1.351 1.859 0.000) 2.298 8.769 ( -3.330 -4.989 0.000) 5.998 8.783 ( -20.152 -2.399 0.000) 20.294 9.035 ( 18.637 0.291 0.000) 18.639 9.323 ( -42.857 -3.994 0.000) 43.043 9.323 ( 15.043 -5.814 0.000) 16.128 9.389 ( -9.827 -1.897 0.000) 10.009 9.654 ( 16.533 -0.872 0.000) 16.556 9.664 ( -7.188 1.302 0.000) 7.305 9.692 ( -8.885 3.433 0.000) 9.525 9.706 ( -4.063 -2.483 0.000) 4.762 10.093 ( 6.345 -2.310 0.000) 6.753 10.150 ( -4.364 -5.805 0.000) 7.263 10.218 ( -0.663 -2.419 0.000) 2.509 10.230 ( 8.666 0.928 0.000) 8.715 10.462 ( 0.333 -1.138 0.000) 1.186 10.683 ( -13.649 -1.276 0.000) 13.708 10.779 ( -6.322 -1.946 0.000) 6.614 10.926 ( -17.889 -2.261 0.000) 18.032 10.977 ( 5.899 -6.962 0.000) 9.125 11.033 ( -2.563 -3.672 0.000) 4.478 11.059 ( -0.658 -4.093 0.000) 4.146 11.174 ( -5.818 -3.641 0.000) 6.863 11.254 ( 14.403 -3.185 0.000) 14.751 11.293 ( 5.187 0.582 0.000) 5.219 11.435 ( 14.979 -3.898 0.000) 15.478 11.591 ( 7.014 -1.751 0.000) 7.229 11.659 ( 9.022 -1.271 0.000) 9.111 11.949 ( -2.468 -1.354 0.000) 2.815 12.004 ( -5.089 -0.503 0.000) 5.114 12.073 ( -2.224 -0.982 0.000) 2.431 12.250 ( 0.306 -0.811 0.000) 0.867 12.319 ( 7.099 2.731 0.000) 7.606 12.380 ( 1.095 -2.566 0.000) 2.790 12.399 ( 4.036 -0.177 0.000) 4.039 12.456 ( 11.290 4.878 0.000) 12.299 12.465 ( -8.013 0.859 0.000) 8.059 12.662 ( -1.785 1.574 0.000) 2.380 12.670 ( -8.539 3.128 0.000) 9.093 12.927 ( 12.542 -0.545 0.000) 12.554 12.957 ( -3.873 -5.780 0.000) 6.957 12.962 ( -0.494 -0.906 0.000) 1.032 13.014 ( -6.769 -3.505 0.000) 7.623 13.104 ( 2.186 2.368 0.000) 3.223 13.298 ( 3.340 -5.778 0.000) 6.674 13.306 ( 2.054 1.809 0.000) 2.736 13.429 ( -1.545 1.563 0.000) 2.198 13.555 ( 4.157 -4.950 0.000) 6.464 13.691 ( 0.923 0.559 0.000) 1.079 13.717 ( 6.884 -0.181 0.000) 6.886 13.822 ( 8.448 0.822 0.000) 8.488 14.103 ( -5.563 2.049 0.000) 5.928 14.160 ( -5.587 2.388 0.000) 6.076 14.371 ( 21.590 2.389 0.000) 21.722 14.738 ( 13.140 -2.409 0.000) 13.359 14.758 ( 12.564 2.524 0.000) 12.815 14.869 ( -3.993 3.775 0.000) 5.495 15.236 ( -8.224 -2.778 0.000) 8.681 15.265 ( -10.763 -3.149 0.000) 11.214 15.428 ( -15.463 7.117 0.000) 17.022 15.468 ( -6.908 -4.175 0.000) 8.071 15.725 ( -11.703 4.644 0.000) 12.591 15.780 ( -2.569 0.337 0.000) 2.591 15.832 ( 4.024 0.741 0.000) 4.092 15.979 ( 6.024 -1.015 0.000) 6.108 16.120 ( -24.756 -1.471 0.000) 24.800 16.425 ( -24.345 1.480 0.000) 24.390 16.748 ( 18.885 -2.059 0.000) 18.997 16.842 ( 8.549 0.922 0.000) 8.599 17.220 ( 0.539 1.735 0.000) 1.817 17.352 ( 7.362 6.904 0.000) 10.093 17.405 ( 1.145 0.605 0.000) 1.295 17.540 ( 5.331 0.728 0.000) 5.380 17.560 ( 0.923 -2.507 0.000) 2.672 17.686 ( 2.941 0.734 0.000) 3.031 17.777 ( 2.086 3.069 0.000) 3.711 18.070 ( -5.746 1.581 0.000) 5.960 18.086 ( -1.480 -1.100 0.000) 1.844 18.087 ( 3.327 1.206 0.000) 3.539 18.112 ( 4.660 -3.238 0.000) 5.674 18.229 ( -1.401 -0.960 0.000) 1.698 18.495 ( 1.325 1.250 0.000) 1.821 18.577 ( -4.941 1.557 0.000) 5.180 18.663 ( -1.295 -0.303 0.000) 1.330 18.664 ( -0.072 -0.005 0.000) 0.072 18.728 ( -1.784 0.438 0.000) 1.837 18.838 ( -12.938 -0.032 0.000) 12.938 18.897 ( 8.402 -0.647 0.000) 8.427 19.148 ( 0.444 -1.094 0.000) 1.181 19.300 ( 1.606 -1.563 0.000) 2.241 19.365 ( 1.049 -1.194 0.000) 1.589 19.516 ( 15.315 0.937 0.000) 15.344 19.718 ( 6.392 1.239 0.000) 6.511 19.934 ( 16.874 1.241 0.000) 16.919 19.976 ( 9.853 0.950 0.000) 9.899 20.160 ( -0.868 0.576 0.000) 1.042 20.511 ( -11.415 2.788 0.000) 11.751 20.566 ( -9.458 -0.364 0.000) 9.465 20.705 ( 1.335 -1.629 0.000) 2.107 20.742 ( -1.102 -3.778 0.000) 3.935 20.786 ( 3.029 -0.247 0.000) 3.039 20.862 ( -9.959 -0.455 0.000) 9.969 20.969 ( 1.877 1.092 0.000) 2.172 21.105 ( -10.917 -1.141 0.000) 10.977 21.137 ( 1.639 -1.577 0.000) 2.274 21.197 ( 4.474 -1.862 0.000) 4.846 21.332 ( -4.621 1.086 0.000) 4.747 22.048 ( -14.932 1.995 0.000) 15.064 22.062 ( -17.552 1.274 0.000) 17.598 22.190 ( 15.250 -0.323 0.000) 15.254 22.242 ( 4.201 -2.463 0.000) 4.870 22.724 ( 7.462 0.677 0.000) 7.493 22.805 ( 18.660 2.055 0.000) 18.772 22.951 ( 4.036 -1.359 0.000) 4.259 22.976 ( -0.735 1.251 0.000) 1.450 23.056 ( -5.227 0.694 0.000) 5.273 23.123 ( 6.919 -2.367 0.000) 7.313 23.377 ( -7.445 2.091 0.000) 7.733 23.568 ( -15.495 -1.214 0.000) 15.543 23.713 ( -1.257 1.949 0.000) 2.319 23.801 ( -1.665 0.151 0.000) 1.672 23.868 ( -9.031 3.071 0.000) 9.538 23.989 ( 6.530 0.222 0.000) 6.534 24.039 ( -14.279 -0.759 0.000) 14.299 24.245 ( 6.618 2.142 0.000) 6.956 24.362 ( -7.479 0.437 0.000) 7.492 24.501 ( -4.712 3.529 0.000) 5.887 24.629 ( 15.102 -0.153 0.000) 15.103 24.926 ( 34.080 -6.322 0.000) 34.661 25.089 ( 21.208 1.026 0.000) 21.232 25.146 ( 11.477 -4.761 0.000) 12.425 25.296 ( -7.427 0.719 0.000) 7.461 25.478 ( 18.843 -3.542 0.000) 19.173 25.665 ( -3.113 0.493 0.000) 3.152 25.846 ( -1.133 -4.302 0.000) 4.449 25.955 ( -9.349 1.105 0.000) 9.414 26.044 ( 2.899 -2.336 0.000) 3.723 26.328 ( -0.659 -0.189 0.000) 0.685 26.506 ( 0.222 -0.128 0.000) 0.256 26.694 ( 32.543 -1.952 0.000) 32.601 27.103 ( -35.821 -5.541 0.000) 36.247 27.413 ( -18.544 -5.594 0.000) 19.369 27.558 ( -0.331 -0.614 0.000) 0.697 27.662 ( -27.589 -15.165 0.000) 31.482 27.809 ( -10.864 -10.116 0.000) 14.845 28.078 ( 3.999 0.045 0.000) 3.999 28.302 ( -6.419 -2.122 0.000) 6.761 28.381 ( -4.032 -3.868 0.000) 5.587 28.508 ( 14.969 -2.387 0.000) 15.158 28.538 ( -11.743 -5.042 0.000) 12.780 28.972 ( 17.487 -5.670 0.000) 18.384 29.081 ( -7.505 -0.925 0.000) 7.561 29.145 ( 13.738 -1.965 0.000) 13.878 29.570 ( -1.179 -3.865 0.000) 4.041 29.730 ( -15.987 -6.787 0.000) 17.368 29.861 ( 7.888 -0.198 0.000) 7.891 30.136 ( -2.842 -1.354 0.000) 3.148 30.196 ( 14.479 -1.797 0.000) 14.590 30.606 ( -0.548 -5.896 0.000) 5.921 30.637 ( -5.722 -1.565 0.000) 5.932 30.693 ( -3.303 -4.266 0.000) 5.395 30.710 ( 2.795 -2.534 0.000) 3.773 30.787 ( 7.417 -6.358 0.000) 9.769 30.911 ( -2.267 -1.805 0.000) 2.898 31.047 ( 2.498 -1.002 0.000) 2.691 31.290 ( -0.970 -4.488 0.000) 4.592 31.362 ( 6.019 -6.324 0.000) 8.730 31.418 ( 1.334 -3.817 0.000) 4.043 31.589 ( -6.902 -2.563 0.000) 7.362 31.890 ( -1.214 -9.176 0.000) 9.256 31.913 ( 2.833 -4.475 0.000) 5.296 32.054 ( -3.416 -6.176 0.000) 7.058 32.242 ( -10.116 -2.894 0.000) 10.522 32.368 ( 6.338 -6.063 0.000) 8.771 32.778 ( 7.264 -0.532 0.000) 7.283 33.059 ( -19.836 -2.055 0.000) 19.942 33.183 ( -3.123 -0.797 0.000) 3.223 33.790 ( 9.668 0.299 0.000) 9.673 33.886 ( 5.131 1.092 0.000) 5.246 34.167 ( 10.906 -3.189 0.000) 11.363 34.349 ( -6.911 -4.963 0.000) 8.509 35.415 ( 30.039 0.407 0.000) 30.042 37.180 ( -38.445 -28.283 0.000) 47.728 ======================= Grid point 17 (12/54) ======================= q-point: (-0.50 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 51 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.080 ( -4.107 16.681 0.000) 17.179 2.080 ( 4.107 16.681 0.000) 17.179 2.240 ( -2.641 15.083 0.000) 15.313 2.240 ( 2.641 15.083 0.000) 15.313 2.667 ( -7.385 -1.459 0.000) 7.528 2.667 ( 7.385 -1.459 0.000) 7.528 2.971 ( -1.547 5.307 0.000) 5.528 2.971 ( 1.547 5.307 0.000) 5.528 3.035 ( -2.159 4.493 0.000) 4.985 3.035 ( 2.159 4.493 0.000) 4.985 3.134 ( -1.122 1.724 0.000) 2.057 3.134 ( 1.122 1.724 0.000) 2.057 3.232 ( -0.111 4.868 0.000) 4.869 3.232 ( 0.111 4.868 0.000) 4.869 3.312 ( -0.117 -0.732 0.000) 0.741 3.312 ( 0.117 -0.732 0.000) 0.741 3.346 ( -8.299 2.262 0.000) 8.602 3.346 ( 8.299 2.262 0.000) 8.602 3.501 ( -0.713 0.794 0.000) 1.067 3.501 ( 0.713 0.794 0.000) 1.067 3.661 ( -14.531 4.335 0.000) 15.164 3.661 ( 14.531 4.335 0.000) 15.164 3.960 ( -3.518 11.310 0.000) 11.844 3.960 ( 3.518 11.310 0.000) 11.844 4.058 ( -0.139 -3.186 0.000) 3.189 4.058 ( 0.139 -3.186 0.000) 3.189 4.303 ( -1.880 -3.254 0.000) 3.758 4.303 ( 1.880 -3.254 0.000) 3.758 4.419 ( -0.410 -7.901 0.000) 7.912 4.419 ( 0.410 -7.901 0.000) 7.912 4.734 ( -0.049 -2.684 0.000) 2.685 4.734 ( 0.049 -2.684 0.000) 2.685 5.409 ( -4.220 -2.177 0.000) 4.748 5.409 ( 4.220 -2.177 0.000) 4.748 5.611 ( -9.332 -5.914 0.000) 11.048 5.611 ( 9.332 -5.914 0.000) 11.048 6.340 ( -5.459 -4.403 0.000) 7.013 6.340 ( 5.459 -4.403 0.000) 7.013 6.502 ( -1.228 1.606 0.000) 2.021 6.502 ( 1.228 1.606 0.000) 2.021 6.523 ( -1.065 -5.515 0.000) 5.617 6.523 ( 1.065 -5.515 0.000) 5.617 7.125 ( -0.111 -6.193 0.000) 6.194 7.125 ( 0.111 -6.193 0.000) 6.194 7.203 ( -9.929 -1.187 0.000) 9.999 7.203 ( 9.929 -1.187 0.000) 9.999 7.401 ( -4.371 -0.515 0.000) 4.401 7.401 ( 4.371 -0.515 0.000) 4.401 7.599 ( -13.499 -3.102 0.000) 13.850 7.599 ( 13.499 -3.102 0.000) 13.850 7.948 ( -1.197 -2.186 0.000) 2.492 7.948 ( 1.197 -2.186 0.000) 2.492 8.216 ( -3.904 -5.276 0.000) 6.563 8.216 ( 3.904 -5.276 0.000) 6.563 8.371 ( -0.011 4.140 0.000) 4.140 8.371 ( 0.011 4.140 0.000) 4.140 8.467 ( -0.413 -5.680 0.000) 5.695 8.467 ( 0.413 -5.680 0.000) 5.695 8.726 ( -0.394 2.829 0.000) 2.857 8.726 ( 0.394 2.829 0.000) 2.857 8.988 ( -8.865 -0.759 0.000) 8.897 8.988 ( 8.865 -0.759 0.000) 8.897 9.424 ( -15.202 0.809 0.000) 15.224 9.424 ( 15.202 0.809 0.000) 15.224 9.617 ( -3.504 -0.302 0.000) 3.517 9.617 ( 3.504 -0.302 0.000) 3.517 9.804 ( -15.637 -4.172 0.000) 16.184 9.804 ( 15.637 -4.172 0.000) 16.184 10.012 ( -1.600 -1.005 0.000) 1.889 10.012 ( 1.600 -1.005 0.000) 1.889 10.365 ( -2.964 -0.432 0.000) 2.996 10.365 ( 2.964 -0.432 0.000) 2.996 10.554 ( -10.213 -1.726 0.000) 10.358 10.554 ( 10.213 -1.726 0.000) 10.358 10.607 ( -9.722 -3.426 0.000) 10.308 10.607 ( 9.722 -3.426 0.000) 10.308 11.042 ( -0.027 -5.052 0.000) 5.052 11.042 ( 0.027 -5.052 0.000) 5.052 11.087 ( -4.349 -5.781 0.000) 7.234 11.087 ( 4.349 -5.781 0.000) 7.234 11.350 ( -0.005 0.675 0.000) 0.675 11.350 ( 0.005 0.675 0.000) 0.675 11.657 ( -0.709 -3.281 0.000) 3.357 11.657 ( 0.709 -3.281 0.000) 3.357 11.857 ( -8.606 -0.561 0.000) 8.624 11.857 ( 8.606 -0.561 0.000) 8.624 11.967 ( -0.826 -0.182 0.000) 0.846 11.967 ( 0.826 -0.182 0.000) 0.846 12.249 ( -5.517 0.022 0.000) 5.517 12.249 ( 5.517 0.022 0.000) 5.517 12.422 ( -0.794 1.285 0.000) 1.511 12.422 ( 0.794 1.285 0.000) 1.511 12.508 ( -1.320 1.785 0.000) 2.221 12.508 ( 1.320 1.785 0.000) 2.221 12.664 ( -1.931 -0.031 0.000) 1.931 12.664 ( 1.931 -0.031 0.000) 1.931 12.919 ( -0.657 0.342 0.000) 0.741 12.919 ( 0.657 0.342 0.000) 0.741 12.973 ( -0.508 -4.509 0.000) 4.538 12.973 ( 0.508 -4.509 0.000) 4.538 13.272 ( -11.225 2.664 0.000) 11.537 13.272 ( 11.225 2.664 0.000) 11.537 13.360 ( -0.082 1.784 0.000) 1.786 13.360 ( 0.082 1.784 0.000) 1.786 13.653 ( -0.972 -3.416 0.000) 3.552 13.653 ( 0.972 -3.416 0.000) 3.552 13.901 ( -6.052 0.216 0.000) 6.056 13.901 ( 6.052 0.216 0.000) 6.056 14.050 ( -8.628 0.121 0.000) 8.629 14.050 ( 8.628 0.121 0.000) 8.629 14.686 ( -12.068 4.696 0.000) 12.950 14.686 ( 12.068 4.696 0.000) 12.950 15.021 ( -1.862 1.120 0.000) 2.173 15.021 ( 1.862 1.120 0.000) 2.173 15.119 ( -4.611 -0.098 0.000) 4.612 15.119 ( 4.611 -0.098 0.000) 4.612 15.361 ( -17.137 -1.316 0.000) 17.188 15.361 ( 17.137 -1.316 0.000) 17.188 15.502 ( -9.745 -3.403 0.000) 10.323 15.502 ( 9.745 -3.403 0.000) 10.323 15.882 ( -0.538 0.976 0.000) 1.114 15.882 ( 0.538 0.976 0.000) 1.114 16.130 ( -8.411 1.868 0.000) 8.616 16.130 ( 8.411 1.868 0.000) 8.616 16.945 ( -0.128 -1.537 0.000) 1.543 16.945 ( 0.128 -1.537 0.000) 1.543 17.302 ( -4.768 0.577 0.000) 4.803 17.302 ( 4.768 0.577 0.000) 4.803 17.558 ( -3.628 1.854 0.000) 4.074 17.558 ( 3.628 1.854 0.000) 4.074 17.582 ( -3.321 2.474 0.000) 4.141 17.582 ( 3.321 2.474 0.000) 4.141 17.875 ( -3.756 2.402 0.000) 4.459 17.875 ( 3.756 2.402 0.000) 4.459 18.078 ( -0.255 -1.675 0.000) 1.695 18.078 ( 0.255 -1.675 0.000) 1.695 18.367 ( -8.624 -3.055 0.000) 9.149 18.367 ( 8.624 -3.055 0.000) 9.149 18.423 ( -14.751 2.405 0.000) 14.946 18.423 ( 14.751 2.405 0.000) 14.946 18.657 ( -0.007 -0.265 0.000) 0.265 18.657 ( 0.007 -0.265 0.000) 0.265 18.687 ( -0.028 1.026 0.000) 1.026 18.687 ( 0.028 1.026 0.000) 1.026 19.069 ( -3.541 -1.283 0.000) 3.766 19.069 ( 3.541 -1.283 0.000) 3.766 19.350 ( -1.235 -1.155 0.000) 1.691 19.350 ( 1.235 -1.155 0.000) 1.691 19.758 ( -5.652 0.474 0.000) 5.672 19.758 ( 5.652 0.474 0.000) 5.672 20.117 ( -1.676 0.756 0.000) 1.838 20.117 ( 1.676 0.756 0.000) 1.838 20.276 ( -12.044 2.416 0.000) 12.284 20.276 ( 12.044 2.416 0.000) 12.284 20.572 ( -7.842 -1.326 0.000) 7.953 20.572 ( 7.842 -1.326 0.000) 7.953 20.720 ( -0.144 -2.865 0.000) 2.869 20.720 ( 0.144 -2.865 0.000) 2.869 20.925 ( -3.587 -0.502 0.000) 3.622 20.925 ( 3.587 -0.502 0.000) 3.622 21.097 ( -8.545 1.201 0.000) 8.629 21.097 ( 8.545 1.201 0.000) 8.629 21.219 ( -5.693 -2.520 0.000) 6.226 21.219 ( 5.693 -2.520 0.000) 6.226 21.859 ( -0.064 2.077 0.000) 2.078 21.859 ( 0.064 2.077 0.000) 2.078 22.391 ( -0.645 -0.839 0.000) 1.058 22.391 ( 0.645 -0.839 0.000) 1.058 22.806 ( -4.633 1.610 0.000) 4.905 22.806 ( 4.633 1.610 0.000) 4.905 23.027 ( -2.563 -0.196 0.000) 2.570 23.027 ( 2.563 -0.196 0.000) 2.570 23.154 ( -13.798 2.092 0.000) 13.956 23.154 ( 13.798 2.092 0.000) 13.956 23.308 ( -9.119 -2.878 0.000) 9.562 23.308 ( 9.119 -2.878 0.000) 9.562 23.730 ( -2.991 2.294 0.000) 3.769 23.730 ( 2.991 2.294 0.000) 3.769 23.822 ( -5.043 -0.498 0.000) 5.067 23.822 ( 5.043 -0.498 0.000) 5.067 24.155 ( -7.316 0.128 0.000) 7.317 24.155 ( 7.316 0.128 0.000) 7.317 24.400 ( -3.040 3.063 0.000) 4.315 24.400 ( 3.040 3.063 0.000) 4.315 24.969 ( -17.639 1.455 0.000) 17.699 24.969 ( 17.639 1.455 0.000) 17.699 25.320 ( -0.029 -6.663 0.000) 6.663 25.320 ( 0.029 -6.663 0.000) 6.663 25.486 ( -9.804 0.499 0.000) 9.817 25.486 ( 9.804 0.499 0.000) 9.817 25.803 ( -2.065 0.040 0.000) 2.065 25.803 ( 2.065 0.040 0.000) 2.065 26.119 ( -26.664 -4.758 0.000) 27.085 26.119 ( 26.664 -4.758 0.000) 27.085 26.524 ( -31.776 -9.620 0.000) 33.200 26.524 ( 31.776 -9.620 0.000) 33.200 26.579 ( -19.973 -8.122 0.000) 21.562 26.579 ( 19.973 -8.122 0.000) 21.562 27.341 ( -22.883 -4.144 0.000) 23.255 27.341 ( 22.883 -4.144 0.000) 23.255 27.559 ( -0.075 -1.357 0.000) 1.359 27.559 ( 0.075 -1.357 0.000) 1.359 28.173 ( -4.960 -0.682 0.000) 5.007 28.173 ( 4.960 -0.682 0.000) 5.007 28.367 ( -4.067 -5.614 0.000) 6.932 28.367 ( 4.067 -5.614 0.000) 6.932 28.845 ( -15.014 -1.411 0.000) 15.080 28.845 ( 15.014 -1.411 0.000) 15.080 29.316 ( -12.068 -5.687 0.000) 13.341 29.316 ( 12.068 -5.687 0.000) 13.341 29.459 ( -2.490 -2.678 0.000) 3.656 29.459 ( 2.490 -2.678 0.000) 3.656 30.029 ( -7.649 -0.988 0.000) 7.712 30.029 ( 7.649 -0.988 0.000) 7.712 30.484 ( -11.576 -0.901 0.000) 11.611 30.484 ( 11.576 -0.901 0.000) 11.611 30.623 ( -2.345 -4.041 0.000) 4.673 30.623 ( 2.345 -4.041 0.000) 4.673 30.807 ( -4.969 -3.599 0.000) 6.136 30.807 ( 4.969 -3.599 0.000) 6.136 30.951 ( -8.327 -5.401 0.000) 9.925 30.951 ( 8.327 -5.401 0.000) 9.925 31.405 ( -6.282 -3.764 0.000) 7.324 31.405 ( 6.282 -3.764 0.000) 7.324 31.452 ( -0.001 -1.938 0.000) 1.938 31.452 ( 0.001 -1.938 0.000) 1.938 31.891 ( -0.355 -9.440 0.000) 9.447 31.891 ( 0.355 -9.440 0.000) 9.447 32.090 ( -2.819 -4.747 0.000) 5.522 32.090 ( 2.819 -4.747 0.000) 5.522 32.569 ( -12.569 -2.187 0.000) 12.758 32.569 ( 12.569 -2.187 0.000) 12.758 33.077 ( -4.826 -1.615 0.000) 5.089 33.077 ( 4.826 -1.615 0.000) 5.089 33.949 ( -0.100 1.454 0.000) 1.457 33.949 ( 0.100 1.454 0.000) 1.457 34.229 ( -0.077 -4.094 0.000) 4.095 34.229 ( 0.077 -4.094 0.000) 4.095 36.258 ( -48.655 -10.912 0.000) 49.864 36.258 ( 48.655 -10.912 0.000) 49.864 ======================= Grid point 20 (13/54) ======================= q-point: ( 0.00 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.095 ( 0.000 13.341 0.000) 13.341 2.131 ( 0.000 18.145 0.000) 18.145 2.381 ( 0.000 -3.528 0.000) 3.528 2.588 ( 0.000 14.873 0.000) 14.873 2.842 ( 0.000 7.229 0.000) 7.229 2.856 ( 0.000 1.508 0.000) 1.508 2.970 ( 0.000 14.732 0.000) 14.732 2.984 ( 0.000 -0.663 0.000) 0.663 3.046 ( 0.000 2.430 0.000) 2.430 3.082 ( 0.000 -5.257 0.000) 5.257 3.112 ( 0.000 -7.521 0.000) 7.521 3.166 ( 0.000 5.098 0.000) 5.098 3.174 ( 0.000 13.723 0.000) 13.723 3.266 ( 0.000 3.101 0.000) 3.101 3.306 ( 0.000 -1.414 0.000) 1.414 3.404 ( 0.000 8.983 0.000) 8.983 3.413 ( 0.000 3.788 0.000) 3.788 3.465 ( 0.000 0.215 0.000) 0.215 3.514 ( 0.000 -0.569 0.000) 0.569 3.527 ( 0.000 1.003 0.000) 1.003 3.604 ( 0.000 0.854 0.000) 0.854 3.692 ( 0.000 -4.676 0.000) 4.676 3.885 ( 0.000 17.219 0.000) 17.219 3.942 ( 0.000 -2.202 0.000) 2.202 4.136 ( 0.000 -10.384 0.000) 10.384 4.156 ( 0.000 -9.065 0.000) 9.065 4.190 ( 0.000 7.824 0.000) 7.824 4.283 ( 0.000 -4.027 0.000) 4.027 4.413 ( 0.000 1.321 0.000) 1.321 4.625 ( 0.000 -8.687 0.000) 8.687 4.640 ( 0.000 -0.920 0.000) 0.920 4.995 ( 0.000 -5.991 0.000) 5.991 4.997 ( 0.000 1.625 0.000) 1.625 5.156 ( 0.000 -2.854 0.000) 2.854 5.761 ( 0.000 0.257 0.000) 0.257 5.862 ( 0.000 -2.668 0.000) 2.668 5.940 ( 0.000 -0.381 0.000) 0.381 6.188 ( 0.000 -1.234 0.000) 1.234 6.257 ( 0.000 -4.436 0.000) 4.436 6.312 ( 0.000 -4.372 0.000) 4.372 6.424 ( 0.000 -9.445 0.000) 9.445 6.588 ( 0.000 1.646 0.000) 1.646 6.608 ( 0.000 -3.557 0.000) 3.557 6.731 ( 0.000 -1.769 0.000) 1.769 7.059 ( 0.000 -2.542 0.000) 2.542 7.067 ( 0.000 -4.419 0.000) 4.419 7.545 ( 0.000 -5.087 0.000) 5.087 7.562 ( 0.000 4.064 0.000) 4.064 7.596 ( 0.000 -1.425 0.000) 1.425 7.637 ( 0.000 -4.524 0.000) 4.524 7.902 ( 0.000 -0.995 0.000) 0.995 8.036 ( 0.000 -0.529 0.000) 0.529 8.143 ( 0.000 -2.395 0.000) 2.395 8.295 ( 0.000 0.172 0.000) 0.172 8.328 ( 0.000 -22.369 0.000) 22.369 8.454 ( 0.000 3.010 0.000) 3.010 8.461 ( 0.000 -4.703 0.000) 4.703 8.730 ( 0.000 2.220 0.000) 2.220 8.776 ( 0.000 -0.312 0.000) 0.312 8.795 ( 0.000 4.045 0.000) 4.045 8.958 ( 0.000 -0.283 0.000) 0.283 9.152 ( 0.000 1.848 0.000) 1.848 9.276 ( 0.000 -1.727 0.000) 1.727 9.523 ( 0.000 -2.162 0.000) 2.162 9.666 ( 0.000 -2.594 0.000) 2.594 9.824 ( 0.000 -0.681 0.000) 0.681 9.886 ( 0.000 5.049 0.000) 5.049 9.890 ( 0.000 0.078 0.000) 0.078 10.025 ( 0.000 -1.423 0.000) 1.423 10.163 ( 0.000 0.844 0.000) 0.844 10.179 ( 0.000 -4.784 0.000) 4.784 10.307 ( 0.000 -3.850 0.000) 3.850 10.339 ( 0.000 -1.746 0.000) 1.746 10.558 ( 0.000 -1.246 0.000) 1.246 10.738 ( 0.000 -3.942 0.000) 3.942 10.768 ( 0.000 -6.233 0.000) 6.233 10.966 ( 0.000 -2.252 0.000) 2.252 11.046 ( 0.000 -1.713 0.000) 1.713 11.105 ( 0.000 -5.452 0.000) 5.452 11.105 ( 0.000 -0.065 0.000) 0.065 11.177 ( 0.000 -0.208 0.000) 0.208 11.207 ( 0.000 0.370 0.000) 0.370 11.371 ( 0.000 -0.547 0.000) 0.547 11.402 ( 0.000 0.220 0.000) 0.220 11.471 ( 0.000 -1.183 0.000) 1.183 11.962 ( 0.000 -1.452 0.000) 1.452 11.984 ( 0.000 -0.585 0.000) 0.585 12.095 ( 0.000 0.735 0.000) 0.735 12.212 ( 0.000 -1.132 0.000) 1.132 12.274 ( 0.000 -0.189 0.000) 0.189 12.328 ( 0.000 1.954 0.000) 1.954 12.341 ( 0.000 1.374 0.000) 1.374 12.352 ( 0.000 0.765 0.000) 0.765 12.652 ( 0.000 -1.206 0.000) 1.206 12.762 ( 0.000 1.438 0.000) 1.438 12.782 ( 0.000 -1.221 0.000) 1.221 12.802 ( 0.000 0.854 0.000) 0.854 12.898 ( 0.000 -6.467 0.000) 6.467 12.908 ( 0.000 3.801 0.000) 3.801 13.017 ( 0.000 0.077 0.000) 0.077 13.032 ( 0.000 -0.860 0.000) 0.860 13.215 ( 0.000 -5.604 0.000) 5.604 13.256 ( 0.000 -1.330 0.000) 1.330 13.446 ( 0.000 -2.989 0.000) 2.989 13.464 ( 0.000 -2.405 0.000) 2.405 13.682 ( 0.000 3.024 0.000) 3.024 13.718 ( 0.000 2.970 0.000) 2.970 13.777 ( 0.000 -1.113 0.000) 1.113 13.987 ( 0.000 0.532 0.000) 0.532 14.257 ( 0.000 4.098 0.000) 4.098 14.266 ( 0.000 0.790 0.000) 0.790 14.612 ( 0.000 0.237 0.000) 0.237 14.655 ( 0.000 0.518 0.000) 0.518 14.986 ( 0.000 5.236 0.000) 5.236 15.331 ( 0.000 -3.103 0.000) 3.103 15.438 ( 0.000 0.475 0.000) 0.475 15.443 ( 0.000 -6.013 0.000) 6.013 15.682 ( 0.000 -1.696 0.000) 1.696 15.740 ( 0.000 5.527 0.000) 5.527 15.798 ( 0.000 0.410 0.000) 0.410 15.938 ( 0.000 -1.294 0.000) 1.294 15.939 ( 0.000 4.542 0.000) 4.542 16.452 ( 0.000 -0.474 0.000) 0.474 16.566 ( 0.000 -2.291 0.000) 2.291 16.576 ( 0.000 1.854 0.000) 1.854 16.917 ( 0.000 0.411 0.000) 0.411 17.199 ( 0.000 1.915 0.000) 1.915 17.276 ( 0.000 1.078 0.000) 1.078 17.430 ( 0.000 4.225 0.000) 4.225 17.474 ( 0.000 1.392 0.000) 1.392 17.488 ( 0.000 -0.060 0.000) 0.060 17.618 ( 0.000 -0.950 0.000) 0.950 17.823 ( 0.000 0.150 0.000) 0.150 17.966 ( 0.000 -0.381 0.000) 0.381 18.017 ( 0.000 -0.199 0.000) 0.199 18.079 ( 0.000 -1.226 0.000) 1.226 18.261 ( 0.000 -0.312 0.000) 0.312 18.330 ( 0.000 1.083 0.000) 1.083 18.457 ( 0.000 0.074 0.000) 0.074 18.647 ( 0.000 1.818 0.000) 1.818 18.658 ( 0.000 -0.177 0.000) 0.177 18.713 ( 0.000 -0.190 0.000) 0.190 18.722 ( 0.000 -0.252 0.000) 0.252 18.802 ( 0.000 0.018 0.000) 0.018 19.031 ( 0.000 0.696 0.000) 0.696 19.098 ( 0.000 -1.161 0.000) 1.161 19.251 ( 0.000 -0.220 0.000) 0.220 19.323 ( 0.000 -0.449 0.000) 0.449 19.328 ( 0.000 -0.364 0.000) 0.364 19.686 ( 0.000 1.603 0.000) 1.603 19.757 ( 0.000 0.568 0.000) 0.568 19.854 ( 0.000 -0.036 0.000) 0.036 20.178 ( 0.000 0.273 0.000) 0.273 20.643 ( 0.000 -0.573 0.000) 0.573 20.682 ( 0.000 -2.795 0.000) 2.795 20.721 ( 0.000 0.407 0.000) 0.407 20.741 ( 0.000 2.268 0.000) 2.268 20.835 ( 0.000 -1.563 0.000) 1.563 20.919 ( 0.000 0.902 0.000) 0.902 20.923 ( 0.000 1.406 0.000) 1.406 21.057 ( 0.000 -2.220 0.000) 2.220 21.108 ( 0.000 0.738 0.000) 0.738 21.268 ( 0.000 -1.601 0.000) 1.601 21.387 ( 0.000 1.473 0.000) 1.473 21.970 ( 0.000 -0.330 0.000) 0.330 22.143 ( 0.000 -2.946 0.000) 2.946 22.343 ( 0.000 0.412 0.000) 0.412 22.354 ( 0.000 1.434 0.000) 1.434 22.551 ( 0.000 1.620 0.000) 1.620 22.644 ( 0.000 1.762 0.000) 1.762 22.879 ( 0.000 -1.176 0.000) 1.176 22.926 ( 0.000 1.350 0.000) 1.350 22.963 ( 0.000 -2.047 0.000) 2.047 23.223 ( 0.000 1.603 0.000) 1.603 23.494 ( 0.000 2.012 0.000) 2.012 23.753 ( 0.000 1.819 0.000) 1.819 23.811 ( 0.000 0.850 0.000) 0.850 23.843 ( 0.000 0.540 0.000) 0.540 23.895 ( 0.000 0.283 0.000) 0.283 24.108 ( 0.000 4.595 0.000) 4.595 24.185 ( 0.000 1.801 0.000) 1.801 24.260 ( 0.000 0.142 0.000) 0.142 24.336 ( 0.000 -0.285 0.000) 0.285 24.491 ( 0.000 -0.025 0.000) 0.025 24.561 ( 0.000 -0.079 0.000) 0.079 24.654 ( 0.000 1.515 0.000) 1.515 24.832 ( 0.000 0.758 0.000) 0.758 24.912 ( 0.000 -3.112 0.000) 3.112 24.957 ( 0.000 -2.956 0.000) 2.956 25.664 ( 0.000 1.963 0.000) 1.963 25.694 ( 0.000 0.125 0.000) 0.125 25.817 ( 0.000 -2.336 0.000) 2.336 26.034 ( 0.000 -1.252 0.000) 1.252 26.091 ( 0.000 1.380 0.000) 1.380 26.235 ( 0.000 -0.916 0.000) 0.916 26.326 ( 0.000 0.063 0.000) 0.063 26.509 ( 0.000 0.073 0.000) 0.073 27.421 ( 0.000 -0.706 0.000) 0.706 27.555 ( 0.000 -0.114 0.000) 0.114 27.623 ( 0.000 -4.572 0.000) 4.572 27.762 ( 0.000 -4.815 0.000) 4.815 27.834 ( 0.000 -7.631 0.000) 7.631 27.918 ( 0.000 -6.572 0.000) 6.572 28.038 ( 0.000 0.017 0.000) 0.017 28.450 ( 0.000 -0.341 0.000) 0.341 28.452 ( 0.000 -8.623 0.000) 8.623 28.607 ( 0.000 -1.168 0.000) 1.168 28.650 ( 0.000 -3.990 0.000) 3.990 28.885 ( 0.000 -0.621 0.000) 0.621 29.159 ( 0.000 -0.570 0.000) 0.570 29.460 ( 0.000 -2.200 0.000) 2.200 29.771 ( 0.000 -0.235 0.000) 0.235 29.790 ( 0.000 -4.702 0.000) 4.702 30.021 ( 0.000 -1.100 0.000) 1.100 30.137 ( 0.000 -0.821 0.000) 0.821 30.468 ( 0.000 -5.389 0.000) 5.389 30.607 ( 0.000 -2.290 0.000) 2.290 30.610 ( 0.000 -4.811 0.000) 4.811 30.703 ( 0.000 -0.890 0.000) 0.890 30.711 ( 0.000 -0.137 0.000) 0.137 30.873 ( 0.000 0.632 0.000) 0.632 30.975 ( 0.000 -2.196 0.000) 2.196 31.160 ( 0.000 -4.771 0.000) 4.771 31.300 ( 0.000 -0.086 0.000) 0.086 31.329 ( 0.000 -4.548 0.000) 4.548 31.606 ( 0.000 -1.992 0.000) 1.992 31.772 ( 0.000 -4.912 0.000) 4.912 31.783 ( 0.000 -3.401 0.000) 3.401 32.067 ( 0.000 -2.354 0.000) 2.354 32.154 ( 0.000 -4.974 0.000) 4.974 32.433 ( 0.000 -1.066 0.000) 1.066 32.502 ( 0.000 -2.679 0.000) 2.679 33.195 ( 0.000 -1.020 0.000) 1.020 33.451 ( 0.000 -4.849 0.000) 4.849 33.658 ( 0.000 -1.739 0.000) 1.739 33.667 ( 0.000 -3.617 0.000) 3.617 33.885 ( 0.000 -1.804 0.000) 1.804 34.289 ( 0.000 -6.937 0.000) 6.937 35.152 ( 0.000 -1.916 0.000) 1.916 36.891 ( 0.000 -29.592 0.000) 29.592 ======================= Grid point 21 (14/54) ======================= q-point: ( 0.25 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.169 ( 7.631 12.996 0.000) 15.071 2.277 ( 10.973 12.276 0.000) 16.466 2.437 ( 4.695 -3.339 0.000) 5.761 2.598 ( 1.036 14.597 0.000) 14.634 2.676 ( -11.933 13.954 0.000) 18.360 2.815 ( -6.502 -1.375 0.000) 6.645 2.990 ( 1.001 -3.172 0.000) 3.326 3.027 ( 2.897 2.637 0.000) 3.917 3.079 ( 2.462 6.250 0.000) 6.717 3.091 ( 0.613 -1.423 0.000) 1.549 3.142 ( 6.308 1.348 0.000) 6.450 3.153 ( -0.446 3.144 0.000) 3.175 3.199 ( -2.271 4.529 0.000) 5.066 3.291 ( 0.238 -0.300 0.000) 0.383 3.305 ( 1.656 1.100 0.000) 1.988 3.367 ( -2.681 4.188 0.000) 4.972 3.411 ( 2.049 8.174 0.000) 8.427 3.491 ( -1.910 1.534 0.000) 2.450 3.520 ( 1.753 1.333 0.000) 2.203 3.560 ( 7.218 7.905 0.000) 10.705 3.575 ( -2.246 2.842 0.000) 3.623 3.775 ( 5.438 -3.289 0.000) 6.355 3.906 ( 2.796 0.834 0.000) 2.917 4.036 ( 7.125 4.507 0.000) 8.431 4.124 ( -7.088 4.169 0.000) 8.224 4.149 ( 1.778 -3.501 0.000) 3.927 4.192 ( 3.158 -7.895 0.000) 8.503 4.299 ( 0.345 -5.693 0.000) 5.703 4.370 ( -5.334 6.059 0.000) 8.072 4.481 ( -13.396 -1.212 0.000) 13.450 4.640 ( 2.167 -6.083 0.000) 6.457 4.774 ( -7.655 0.676 0.000) 7.685 5.208 ( 7.871 -4.908 0.000) 9.275 5.252 ( 9.373 -4.486 0.000) 10.391 5.613 ( -12.410 0.078 0.000) 12.410 5.736 ( -10.811 -3.978 0.000) 11.520 6.195 ( 18.347 -1.284 0.000) 18.392 6.233 ( 0.361 -1.979 0.000) 2.011 6.239 ( 4.289 -2.741 0.000) 5.090 6.342 ( 2.769 -3.745 0.000) 4.657 6.477 ( 12.364 -6.012 0.000) 13.749 6.551 ( -1.776 -2.723 0.000) 3.251 6.842 ( 15.026 -1.302 0.000) 15.082 6.875 ( -13.068 -5.338 0.000) 14.116 6.929 ( 14.050 -1.931 0.000) 14.182 7.105 ( 3.528 -3.804 0.000) 5.188 7.332 ( -9.212 -1.777 0.000) 9.382 7.544 ( -5.860 -3.206 0.000) 6.680 7.651 ( 9.186 -2.829 0.000) 9.612 7.784 ( -15.245 2.118 0.000) 15.392 7.871 ( 8.307 1.561 0.000) 8.453 7.947 ( 2.425 -2.173 0.000) 3.256 8.104 ( -6.398 -3.658 0.000) 7.370 8.149 ( -9.297 -18.108 0.000) 20.355 8.340 ( -1.900 -2.981 0.000) 3.535 8.420 ( -2.573 0.569 0.000) 2.635 8.450 ( 0.271 -0.938 0.000) 0.977 8.722 ( -22.310 -0.587 0.000) 22.318 8.747 ( -5.150 1.524 0.000) 5.371 8.763 ( 3.027 1.440 0.000) 3.352 9.054 ( 17.402 1.615 0.000) 17.477 9.240 ( 13.397 -2.889 0.000) 13.705 9.269 ( -38.133 -1.705 0.000) 38.171 9.358 ( -7.531 -1.171 0.000) 7.622 9.639 ( 10.763 -0.899 0.000) 10.800 9.655 ( 0.369 -1.910 0.000) 1.945 9.693 ( -5.542 1.527 0.000) 5.748 9.783 ( -8.298 4.952 0.000) 9.663 10.054 ( -4.316 -3.874 0.000) 5.800 10.056 ( 6.728 -1.274 0.000) 6.848 10.152 ( 0.653 -3.867 0.000) 3.922 10.249 ( 9.214 1.002 0.000) 9.269 10.450 ( -0.750 -0.103 0.000) 0.757 10.648 ( -17.158 -1.968 0.000) 17.271 10.752 ( -3.864 -0.874 0.000) 3.962 10.839 ( 5.432 -6.463 0.000) 8.443 10.842 ( -11.068 -5.295 0.000) 12.269 10.986 ( -15.929 -1.079 0.000) 15.966 10.990 ( -0.315 -2.762 0.000) 2.780 11.124 ( -5.713 -1.375 0.000) 5.877 11.209 ( 25.096 -1.429 0.000) 25.136 11.311 ( 3.996 1.010 0.000) 4.122 11.378 ( 10.955 -1.896 0.000) 11.118 11.564 ( 6.656 -1.045 0.000) 6.737 11.636 ( 10.092 -1.008 0.000) 10.142 11.940 ( -1.736 0.390 0.000) 1.779 12.017 ( -4.264 1.999 0.000) 4.709 12.050 ( 0.730 -1.211 0.000) 1.414 12.230 ( -1.107 -0.961 0.000) 1.466 12.289 ( 1.353 -4.227 0.000) 4.438 12.392 ( 5.102 2.080 0.000) 5.510 12.400 ( 3.285 0.423 0.000) 3.312 12.477 ( -8.883 0.056 0.000) 8.884 12.540 ( 13.196 3.679 0.000) 13.699 12.691 ( -3.998 1.311 0.000) 4.208 12.723 ( -3.773 1.888 0.000) 4.219 12.827 ( -1.271 -6.015 0.000) 6.148 12.921 ( -1.934 -2.536 0.000) 3.189 12.929 ( 3.052 -0.163 0.000) 3.057 12.977 ( -2.719 -0.246 0.000) 2.730 13.155 ( -1.415 2.639 0.000) 2.994 13.203 ( 8.735 -3.734 0.000) 9.499 13.325 ( 7.884 -0.310 0.000) 7.890 13.450 ( 2.693 0.666 0.000) 2.774 13.457 ( 3.444 -4.150 0.000) 5.393 13.697 ( 8.672 -1.442 0.000) 8.791 13.702 ( -3.977 0.775 0.000) 4.052 13.869 ( 7.811 2.766 0.000) 8.286 14.126 ( -9.960 0.697 0.000) 9.984 14.227 ( -5.173 3.459 0.000) 6.223 14.411 ( 24.974 1.644 0.000) 25.028 14.699 ( 9.715 -1.498 0.000) 9.829 14.781 ( 14.026 0.239 0.000) 14.028 14.955 ( -3.004 4.442 0.000) 5.363 15.179 ( -8.560 -2.697 0.000) 8.975 15.221 ( -11.029 -1.147 0.000) 11.088 15.382 ( -7.133 -4.439 0.000) 8.401 15.551 ( -17.240 5.090 0.000) 17.975 15.768 ( -8.804 -0.454 0.000) 8.816 15.812 ( -13.090 3.122 0.000) 13.457 15.850 ( 5.366 1.050 0.000) 5.468 15.949 ( 8.000 -1.845 0.000) 8.210 16.083 ( -23.701 -2.098 0.000) 23.794 16.453 ( -23.120 1.236 0.000) 23.153 16.713 ( 17.815 -1.413 0.000) 17.871 16.863 ( 7.820 1.040 0.000) 7.889 17.252 ( -0.038 1.355 0.000) 1.355 17.413 ( -0.856 0.241 0.000) 0.889 17.467 ( 5.667 4.417 0.000) 7.186 17.513 ( 0.590 -2.025 0.000) 2.110 17.552 ( 5.670 0.390 0.000) 5.683 17.700 ( 6.044 0.650 0.000) 6.079 17.834 ( 3.116 2.561 0.000) 4.033 18.062 ( -1.317 -1.233 0.000) 1.804 18.068 ( 3.231 -1.069 0.000) 3.404 18.077 ( 11.500 -0.228 0.000) 11.502 18.128 ( -11.489 1.948 0.000) 11.653 18.209 ( -3.078 -1.025 0.000) 3.244 18.505 ( -0.818 0.115 0.000) 0.826 18.604 ( -4.822 0.846 0.000) 4.895 18.665 ( 0.128 0.035 0.000) 0.132 18.672 ( 1.328 1.015 0.000) 1.671 18.740 ( -0.327 0.726 0.000) 0.796 18.837 ( -14.486 -0.002 0.000) 14.486 18.883 ( 7.449 -0.717 0.000) 7.483 19.126 ( 0.155 -1.085 0.000) 1.096 19.274 ( 1.746 -1.027 0.000) 2.026 19.344 ( 0.693 -0.899 0.000) 1.135 19.531 ( 15.519 0.554 0.000) 15.529 19.735 ( 4.643 0.578 0.000) 4.679 19.955 ( 17.347 0.816 0.000) 17.366 19.993 ( 10.505 0.718 0.000) 10.529 20.171 ( -0.308 0.491 0.000) 0.579 20.551 ( -9.493 -0.998 0.000) 9.545 20.563 ( -11.443 2.312 0.000) 11.674 20.672 ( -0.871 -1.607 0.000) 1.828 20.689 ( -1.000 -1.553 0.000) 1.847 20.788 ( 1.808 0.529 0.000) 1.884 20.851 ( -8.817 -0.751 0.000) 8.849 20.993 ( 2.783 1.181 0.000) 3.023 21.084 ( -10.689 -0.792 0.000) 10.719 21.108 ( 0.484 -1.242 0.000) 1.333 21.160 ( 3.503 -1.708 0.000) 3.897 21.353 ( -5.643 0.919 0.000) 5.718 22.087 ( -16.040 1.351 0.000) 16.097 22.087 ( -15.160 1.604 0.000) 15.245 22.185 ( 15.336 -0.186 0.000) 15.337 22.205 ( 7.101 -1.274 0.000) 7.214 22.745 ( 6.964 1.152 0.000) 7.059 22.845 ( 19.135 1.772 0.000) 19.217 22.928 ( 4.553 -0.902 0.000) 4.642 22.999 ( 0.999 0.898 0.000) 1.343 23.044 ( 3.345 -1.302 0.000) 3.590 23.113 ( -4.300 0.740 0.000) 4.363 23.420 ( -7.257 2.068 0.000) 7.546 23.554 ( -17.400 -0.209 0.000) 17.401 23.752 ( -0.941 1.775 0.000) 2.009 23.806 ( -2.068 0.335 0.000) 2.095 23.913 ( -6.773 1.292 0.000) 6.895 24.016 ( 0.169 2.018 0.000) 2.026 24.028 ( -11.944 -0.189 0.000) 11.945 24.289 ( 6.978 2.115 0.000) 7.291 24.370 ( -7.935 0.308 0.000) 7.941 24.564 ( -4.439 2.649 0.000) 5.169 24.628 ( 17.146 0.036 0.000) 17.146 24.845 ( 27.363 -2.479 0.000) 27.475 25.071 ( 11.386 -2.714 0.000) 11.705 25.110 ( 19.753 0.883 0.000) 19.773 25.301 ( 14.211 -0.460 0.000) 14.218 25.420 ( -1.011 -1.755 0.000) 2.025 25.672 ( -2.760 0.214 0.000) 2.768 25.790 ( -1.111 -1.540 0.000) 1.899 25.975 ( -10.585 0.868 0.000) 10.620 26.007 ( 0.278 -1.524 0.000) 1.550 26.324 ( -1.477 -0.144 0.000) 1.484 26.505 ( -0.196 -0.028 0.000) 0.198 26.660 ( 31.208 -1.418 0.000) 31.240 27.009 ( -36.156 -3.683 0.000) 36.344 27.224 ( -43.268 -9.792 0.000) 44.362 27.534 ( -3.844 -1.541 0.000) 4.141 27.551 ( -0.330 -0.099 0.000) 0.345 27.643 ( -6.812 -6.448 0.000) 9.379 28.079 ( 3.966 0.072 0.000) 3.967 28.261 ( -7.679 -1.976 0.000) 7.929 28.314 ( 1.661 -2.695 0.000) 3.166 28.445 ( -12.790 -4.014 0.000) 13.405 28.470 ( 13.140 -1.357 0.000) 13.209 28.879 ( 17.809 -3.611 0.000) 18.172 29.067 ( -7.754 -0.497 0.000) 7.770 29.110 ( 13.263 -1.440 0.000) 13.341 29.506 ( 0.255 -2.479 0.000) 2.492 29.616 ( -15.236 -4.466 0.000) 15.877 29.857 ( 7.601 -0.218 0.000) 7.604 30.113 ( -2.881 -0.924 0.000) 3.026 30.165 ( 14.111 -1.266 0.000) 14.167 30.500 ( 2.328 -4.257 0.000) 4.852 30.593 ( -1.991 -3.205 0.000) 3.773 30.631 ( -5.296 -1.284 0.000) 5.450 30.659 ( 5.042 -2.629 0.000) 5.686 30.713 ( 1.972 -1.622 0.000) 2.553 30.880 ( -4.369 -1.247 0.000) 4.544 31.032 ( 2.088 -0.581 0.000) 2.167 31.197 ( -3.444 -4.035 0.000) 5.305 31.264 ( 8.853 -3.574 0.000) 9.547 31.373 ( 4.354 -1.446 0.000) 4.588 31.547 ( -6.198 -1.656 0.000) 6.416 31.746 ( -2.367 -5.399 0.000) 5.895 31.841 ( 0.551 -2.671 0.000) 2.728 31.926 ( -4.946 -5.859 0.000) 7.667 32.185 ( -11.822 -2.560 0.000) 12.096 32.288 ( 9.224 -2.525 0.000) 9.563 32.763 ( 10.380 -0.830 0.000) 10.413 32.993 ( -22.060 -3.936 0.000) 22.408 33.159 ( -3.796 -1.378 0.000) 4.039 33.773 ( 10.263 -1.679 0.000) 10.399 33.889 ( 5.152 -0.400 0.000) 5.167 34.057 ( 10.665 -6.685 0.000) 12.587 34.226 ( -5.869 -6.334 0.000) 8.636 35.352 ( 22.369 -5.039 0.000) 22.929 36.624 ( -25.840 -24.883 0.000) 35.873 ======================= Grid point 22 (15/54) ======================= q-point: (-0.50 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 51 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.367 ( -3.289 10.763 0.000) 11.254 2.367 ( 3.289 10.763 0.000) 11.254 2.484 ( -0.134 7.855 0.000) 7.857 2.484 ( 0.134 7.855 0.000) 7.857 2.668 ( -5.906 4.229 0.000) 7.264 2.668 ( 5.906 4.229 0.000) 7.264 3.038 ( -0.515 -1.206 0.000) 1.311 3.038 ( 0.515 -1.206 0.000) 1.311 3.097 ( -0.003 -0.090 0.000) 0.090 3.097 ( 0.003 -0.090 0.000) 0.090 3.139 ( -0.840 3.168 0.000) 3.277 3.139 ( 0.840 3.168 0.000) 3.277 3.298 ( -1.097 -0.895 0.000) 1.416 3.298 ( 1.097 -0.895 0.000) 1.416 3.314 ( -3.191 2.932 0.000) 4.333 3.314 ( 3.191 2.932 0.000) 4.333 3.448 ( -1.583 7.692 0.000) 7.854 3.448 ( 1.583 7.692 0.000) 7.854 3.544 ( -0.178 4.114 0.000) 4.118 3.544 ( 0.178 4.114 0.000) 4.118 3.774 ( -5.848 5.776 0.000) 8.219 3.774 ( 5.848 5.776 0.000) 8.219 3.963 ( -2.132 -3.401 0.000) 4.014 3.963 ( 2.132 -3.401 0.000) 4.014 4.202 ( -5.732 -5.648 0.000) 8.048 4.202 ( 5.732 -5.648 0.000) 8.048 4.234 ( -3.521 10.912 0.000) 11.466 4.234 ( 3.521 10.912 0.000) 11.466 4.276 ( -0.213 -5.501 0.000) 5.505 4.276 ( 0.213 -5.501 0.000) 5.505 4.695 ( -2.009 -1.425 0.000) 2.463 4.695 ( 2.009 -1.425 0.000) 2.463 5.369 ( -6.493 -1.640 0.000) 6.697 5.369 ( 6.493 -1.640 0.000) 6.697 5.485 ( -10.027 -6.170 0.000) 11.774 5.485 ( 10.027 -6.170 0.000) 11.774 6.261 ( -2.883 -3.213 0.000) 4.317 6.261 ( 2.883 -3.213 0.000) 4.317 6.421 ( -4.383 -4.370 0.000) 6.189 6.421 ( 4.383 -4.370 0.000) 6.189 6.529 ( -0.584 0.605 0.000) 0.841 6.529 ( 0.584 0.605 0.000) 0.841 6.997 ( -1.111 -6.035 0.000) 6.136 6.997 ( 1.111 -6.035 0.000) 6.136 7.158 ( -2.417 -3.217 0.000) 4.024 7.158 ( 2.417 -3.217 0.000) 4.024 7.389 ( -7.766 -0.516 0.000) 7.783 7.389 ( 7.766 -0.515 0.000) 7.783 7.540 ( -4.933 -2.842 0.000) 5.693 7.540 ( 4.933 -2.842 0.000) 5.693 7.919 ( -8.070 -1.123 0.000) 8.148 7.919 ( 8.070 -1.123 0.000) 8.148 8.054 ( -0.016 -8.728 0.000) 8.728 8.054 ( 0.016 -8.728 0.000) 8.728 8.355 ( -5.581 -3.396 0.000) 6.533 8.355 ( 5.581 -3.396 0.000) 6.533 8.418 ( -0.674 -0.794 0.000) 1.041 8.418 ( 0.674 -0.794 0.000) 1.041 8.788 ( -0.195 2.957 0.000) 2.963 8.788 ( 0.195 2.957 0.000) 2.963 8.979 ( -6.158 -0.192 0.000) 6.161 8.979 ( 6.158 -0.192 0.000) 6.161 9.441 ( -13.237 0.543 0.000) 13.248 9.441 ( 13.237 0.543 0.000) 13.248 9.617 ( -1.337 0.599 0.000) 1.465 9.617 ( 1.337 0.599 0.000) 1.465 9.744 ( -6.709 -2.018 0.000) 7.006 9.744 ( 6.709 -2.018 0.000) 7.006 9.999 ( -2.237 -0.193 0.000) 2.246 9.999 ( 2.237 -0.193 0.000) 2.246 10.335 ( -9.163 -2.375 0.000) 9.466 10.335 ( 9.163 -2.375 0.000) 9.466 10.537 ( -10.805 -0.285 0.000) 10.808 10.537 ( 10.805 -0.285 0.000) 10.808 10.549 ( -10.732 -1.888 0.000) 10.897 10.549 ( 10.732 -1.888 0.000) 10.897 10.912 ( -0.008 -6.772 0.000) 6.772 10.912 ( 0.008 -6.772 0.000) 6.772 11.020 ( -1.131 -1.783 0.000) 2.111 11.020 ( 1.131 -1.783 0.000) 2.111 11.370 ( -0.056 1.221 0.000) 1.222 11.370 ( 0.056 1.221 0.000) 1.222 11.604 ( -3.063 -2.077 0.000) 3.701 11.604 ( 3.063 -2.077 0.000) 3.701 11.856 ( -9.228 0.361 0.000) 9.236 11.856 ( 9.228 0.361 0.000) 9.236 11.970 ( -0.009 0.779 0.000) 0.779 11.970 ( 0.009 0.779 0.000) 0.779 12.225 ( -2.532 -2.480 0.000) 3.544 12.225 ( 2.532 -2.480 0.000) 3.544 12.433 ( -0.274 -0.052 0.000) 0.279 12.433 ( 0.274 -0.052 0.000) 0.279 12.545 ( -5.381 2.136 0.000) 5.789 12.545 ( 5.381 2.136 0.000) 5.789 12.660 ( -0.002 -0.127 0.000) 0.127 12.660 ( 0.002 -0.127 0.000) 0.127 12.891 ( -0.168 -3.485 0.000) 3.489 12.891 ( 0.168 -3.485 0.000) 3.489 12.933 ( -12.680 0.644 0.000) 12.697 12.933 ( 12.680 0.644 0.000) 12.697 13.328 ( -16.425 2.582 0.000) 16.627 13.328 ( 16.425 2.582 0.000) 16.627 13.388 ( -2.108 1.009 0.000) 2.337 13.388 ( 2.108 1.009 0.000) 2.337 13.566 ( -1.392 -4.393 0.000) 4.609 13.566 ( 1.392 -4.393 0.000) 4.609 13.907 ( -8.131 0.237 0.000) 8.134 13.907 ( 8.131 0.237 0.000) 8.134 14.073 ( -9.921 1.609 0.000) 10.051 14.073 ( 9.921 1.609 0.000) 10.051 14.772 ( -11.327 3.966 0.000) 12.001 14.772 ( 11.327 3.966 0.000) 12.001 14.988 ( -7.591 -2.947 0.000) 8.144 14.988 ( 7.591 -2.947 0.000) 8.144 15.163 ( -12.285 3.140 0.000) 12.680 15.163 ( 12.285 3.140 0.000) 12.680 15.339 ( -19.988 -0.940 0.000) 20.010 15.339 ( 19.988 -0.940 0.000) 20.010 15.434 ( -13.168 -3.301 0.000) 13.576 15.434 ( 13.168 -3.301 0.000) 13.576 15.892 ( -0.412 0.111 0.000) 0.427 15.892 ( 0.412 0.111 0.000) 0.427 16.159 ( -10.402 1.059 0.000) 10.455 16.159 ( 10.402 1.059 0.000) 10.455 16.921 ( -1.913 -0.859 0.000) 2.097 16.921 ( 1.913 -0.859 0.000) 2.097 17.311 ( -4.525 0.391 0.000) 4.542 17.311 ( 4.525 0.391 0.000) 4.542 17.563 ( -4.251 -0.156 0.000) 4.253 17.563 ( 4.251 -0.156 0.000) 4.253 17.649 ( -4.282 2.951 0.000) 5.200 17.649 ( 4.282 2.951 0.000) 5.200 17.918 ( -2.917 1.864 0.000) 3.462 17.918 ( 2.917 1.864 0.000) 3.462 18.050 ( -0.056 -1.106 0.000) 1.107 18.050 ( 0.056 -1.106 0.000) 1.107 18.322 ( -10.103 -1.608 0.000) 10.230 18.322 ( 10.103 -1.608 0.000) 10.230 18.460 ( -18.671 1.226 0.000) 18.712 18.460 ( 18.671 1.226 0.000) 18.712 18.655 ( -0.914 0.036 0.000) 0.915 18.655 ( 0.914 0.036 0.000) 0.915 18.713 ( -0.133 1.545 0.000) 1.551 18.713 ( 0.133 1.545 0.000) 1.551 19.042 ( -4.093 -1.356 0.000) 4.311 19.042 ( 4.093 -1.356 0.000) 4.311 19.327 ( -1.344 -1.026 0.000) 1.691 19.327 ( 1.344 -1.026 0.000) 1.691 19.765 ( -5.018 0.231 0.000) 5.023 19.765 ( 5.018 0.231 0.000) 5.023 20.131 ( -1.417 0.607 0.000) 1.541 20.131 ( 1.417 0.607 0.000) 1.541 20.318 ( -13.064 1.692 0.000) 13.173 20.318 ( 13.064 1.692 0.000) 13.173 20.543 ( -7.157 -1.434 0.000) 7.300 20.543 ( 7.157 -1.434 0.000) 7.300 20.683 ( -0.104 -1.059 0.000) 1.064 20.683 ( 0.104 -1.059 0.000) 1.064 20.916 ( -2.670 -0.393 0.000) 2.699 20.916 ( 2.670 -0.393 0.000) 2.699 21.116 ( -5.548 0.636 0.000) 5.585 21.116 ( 5.548 0.636 0.000) 5.585 21.178 ( -7.042 -1.397 0.000) 7.179 21.178 ( 7.042 -1.397 0.000) 7.179 21.897 ( -0.181 1.618 0.000) 1.628 21.897 ( 0.181 1.618 0.000) 1.628 22.381 ( -0.956 -0.197 0.000) 0.976 22.381 ( 0.956 -0.197 0.000) 0.976 22.840 ( -5.694 1.553 0.000) 5.902 22.840 ( 5.694 1.553 0.000) 5.902 23.022 ( -3.631 -0.253 0.000) 3.640 23.022 ( 3.631 -0.253 0.000) 3.640 23.198 ( -13.565 2.102 0.000) 13.727 23.198 ( 13.565 2.102 0.000) 13.727 23.264 ( -8.885 -1.530 0.000) 9.016 23.264 ( 8.885 -1.530 0.000) 9.016 23.773 ( -3.188 1.904 0.000) 3.714 23.773 ( 3.188 1.904 0.000) 3.714 23.816 ( -4.027 -0.128 0.000) 4.030 23.816 ( 4.027 -0.128 0.000) 4.030 24.165 ( -8.119 0.830 0.000) 8.161 24.165 ( 8.119 0.830 0.000) 8.161 24.455 ( -4.609 2.373 0.000) 5.184 24.455 ( 4.609 2.373 0.000) 5.184 24.998 ( -18.571 1.234 0.000) 18.612 24.998 ( 18.571 1.234 0.000) 18.612 25.214 ( -0.585 -3.810 0.000) 3.855 25.214 ( 0.585 -3.810 0.000) 3.855 25.499 ( -14.769 0.613 0.000) 14.782 25.499 ( 14.769 0.613 0.000) 14.782 25.801 ( -1.828 -0.223 0.000) 1.842 25.801 ( 1.828 -0.223 0.000) 1.842 26.037 ( -32.511 -3.277 0.000) 32.676 26.037 ( 32.511 -3.277 0.000) 32.676 26.329 ( -36.101 -6.843 0.000) 36.744 26.329 ( 36.101 -6.843 0.000) 36.744 26.530 ( -5.453 -0.996 0.000) 5.543 26.530 ( 5.453 -0.996 0.000) 5.543 27.268 ( -25.015 -2.966 0.000) 25.190 27.268 ( 25.015 -2.966 0.000) 25.190 27.544 ( -0.000 -0.344 0.000) 0.344 27.544 ( 0.000 -0.344 0.000) 0.344 28.163 ( -2.088 -0.286 0.000) 2.108 28.163 ( 2.088 -0.286 0.000) 2.108 28.268 ( -1.770 -4.172 0.000) 4.532 28.268 ( 1.770 -4.172 0.000) 4.532 28.822 ( -16.022 -0.906 0.000) 16.047 28.822 ( 16.022 -0.906 0.000) 16.047 29.219 ( -14.205 -3.904 0.000) 14.732 29.219 ( 14.205 -3.904 0.000) 14.732 29.415 ( -5.259 -1.711 0.000) 5.530 29.415 ( 5.259 -1.711 0.000) 5.530 30.013 ( -7.063 -0.598 0.000) 7.088 30.013 ( 7.063 -0.598 0.000) 7.088 30.464 ( -12.460 -1.283 0.000) 12.526 30.464 ( 12.460 -1.283 0.000) 12.526 30.546 ( -1.407 -2.938 0.000) 3.258 30.546 ( 1.407 -2.938 0.000) 3.258 30.762 ( -4.205 -1.300 0.000) 4.401 30.762 ( 4.205 -1.300 0.000) 4.401 30.854 ( -10.640 -4.100 0.000) 11.402 30.854 ( 10.640 -4.100 0.000) 11.402 31.355 ( -6.506 -1.377 0.000) 6.651 31.355 ( 6.506 -1.377 0.000) 6.651 31.422 ( -0.284 -1.229 0.000) 1.262 31.422 ( 0.284 -1.229 0.000) 1.262 31.729 ( -0.983 -6.631 0.000) 6.703 31.729 ( 0.983 -6.631 0.000) 6.703 32.005 ( -3.993 -3.511 0.000) 5.317 32.005 ( 3.993 -3.511 0.000) 5.317 32.531 ( -14.043 -1.636 0.000) 14.138 32.531 ( 14.043 -1.636 0.000) 14.138 33.037 ( -7.688 -2.197 0.000) 7.995 33.037 ( 7.688 -2.197 0.000) 7.995 33.950 ( -0.184 -0.804 0.000) 0.825 33.950 ( 0.184 -0.804 0.000) 0.825 34.117 ( -0.079 -6.269 0.000) 6.270 34.117 ( 0.079 -6.269 0.000) 6.270 35.976 ( -36.078 -14.590 0.000) 38.916 35.976 ( 36.078 -14.590 0.000) 38.916 ======================= Grid point 25 (16/54) ======================= q-point: ( 0.00 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.335 ( 0.000 -1.106 0.000) 1.106 2.338 ( 0.000 9.766 0.000) 9.766 2.405 ( 0.000 8.127 0.000) 8.127 2.850 ( 0.000 1.379 0.000) 1.379 2.865 ( 0.000 -0.615 0.000) 0.615 2.867 ( 0.000 4.989 0.000) 4.989 2.909 ( 0.000 1.902 0.000) 1.902 2.960 ( 0.000 -7.188 0.000) 7.188 3.008 ( 0.000 -1.960 0.000) 1.960 3.082 ( 0.000 0.978 0.000) 0.978 3.112 ( 0.000 -8.624 0.000) 8.624 3.278 ( 0.000 12.639 0.000) 12.639 3.286 ( 0.000 -0.411 0.000) 0.411 3.313 ( 0.000 1.333 0.000) 1.333 3.436 ( 0.000 -3.244 0.000) 3.244 3.449 ( 0.000 9.753 0.000) 9.753 3.465 ( 0.000 1.380 0.000) 1.380 3.515 ( 0.000 0.502 0.000) 0.502 3.521 ( 0.000 2.102 0.000) 2.102 3.587 ( 0.000 5.687 0.000) 5.687 3.593 ( 0.000 -1.205 0.000) 1.205 3.734 ( 0.000 6.377 0.000) 6.377 3.798 ( 0.000 -11.530 0.000) 11.530 3.991 ( 0.000 -7.059 0.000) 7.059 4.024 ( 0.000 -0.946 0.000) 0.946 4.173 ( 0.000 6.285 0.000) 6.285 4.231 ( 0.000 -0.329 0.000) 0.329 4.336 ( 0.000 4.980 0.000) 4.980 4.466 ( 0.000 2.803 0.000) 2.803 4.502 ( 0.000 -1.647 0.000) 1.647 4.604 ( 0.000 -2.079 0.000) 2.079 4.893 ( 0.000 -3.227 0.000) 3.227 5.006 ( 0.000 -0.483 0.000) 0.483 5.109 ( 0.000 -1.335 0.000) 1.335 5.774 ( 0.000 1.071 0.000) 1.071 5.813 ( 0.000 -2.265 0.000) 2.265 5.949 ( 0.000 0.796 0.000) 0.796 6.172 ( 0.000 -0.345 0.000) 0.345 6.180 ( 0.000 -2.576 0.000) 2.576 6.255 ( 0.000 -1.424 0.000) 1.424 6.292 ( 0.000 -3.325 0.000) 3.325 6.554 ( 0.000 -1.554 0.000) 1.554 6.619 ( 0.000 1.295 0.000) 1.295 6.693 ( 0.000 -1.676 0.000) 1.676 6.985 ( 0.000 -3.163 0.000) 3.163 7.021 ( 0.000 -1.088 0.000) 1.088 7.473 ( 0.000 -1.888 0.000) 1.888 7.564 ( 0.000 -2.172 0.000) 2.172 7.602 ( 0.000 2.990 0.000) 2.990 7.626 ( 0.000 1.848 0.000) 1.848 7.780 ( 0.000 -15.644 0.000) 15.644 7.874 ( 0.000 -1.242 0.000) 1.242 8.116 ( 0.000 -0.468 0.000) 0.468 8.176 ( 0.000 1.169 0.000) 1.169 8.297 ( 0.000 0.008 0.000) 0.008 8.407 ( 0.000 -1.796 0.000) 1.796 8.475 ( 0.000 -0.005 0.000) 0.005 8.770 ( 0.000 -0.203 0.000) 0.203 8.775 ( 0.000 1.550 0.000) 1.550 8.852 ( 0.000 1.487 0.000) 1.487 8.956 ( 0.000 -0.049 0.000) 0.049 9.178 ( 0.000 0.703 0.000) 0.703 9.252 ( 0.000 -0.620 0.000) 0.620 9.495 ( 0.000 -0.688 0.000) 0.688 9.629 ( 0.000 -1.022 0.000) 1.022 9.818 ( 0.000 -0.003 0.000) 0.003 9.894 ( 0.000 0.164 0.000) 0.164 9.968 ( 0.000 2.516 0.000) 2.516 10.003 ( 0.000 -0.589 0.000) 0.589 10.102 ( 0.000 -2.327 0.000) 2.327 10.175 ( 0.000 0.301 0.000) 0.301 10.256 ( 0.000 -1.275 0.000) 1.275 10.311 ( 0.000 -0.837 0.000) 0.837 10.548 ( 0.000 -0.094 0.000) 0.094 10.674 ( 0.000 -2.708 0.000) 2.708 10.676 ( 0.000 -1.857 0.000) 1.857 10.951 ( 0.000 0.496 0.000) 0.496 11.015 ( 0.000 -3.172 0.000) 3.172 11.019 ( 0.000 -0.799 0.000) 0.799 11.106 ( 0.000 0.057 0.000) 0.057 11.176 ( 0.000 0.011 0.000) 0.011 11.213 ( 0.000 0.214 0.000) 0.214 11.370 ( 0.000 0.114 0.000) 0.114 11.387 ( 0.000 -0.663 0.000) 0.663 11.475 ( 0.000 0.450 0.000) 0.450 11.949 ( 0.000 -0.137 0.000) 0.137 11.977 ( 0.000 -0.194 0.000) 0.194 12.106 ( 0.000 0.290 0.000) 0.290 12.190 ( 0.000 -0.654 0.000) 0.654 12.270 ( 0.000 -0.148 0.000) 0.148 12.358 ( 0.000 0.069 0.000) 0.069 12.367 ( 0.000 1.000 0.000) 1.000 12.379 ( 0.000 1.957 0.000) 1.957 12.613 ( 0.000 -1.662 0.000) 1.662 12.768 ( 0.000 -0.233 0.000) 0.233 12.774 ( 0.000 0.092 0.000) 0.092 12.791 ( 0.000 -3.464 0.000) 3.464 12.825 ( 0.000 0.863 0.000) 0.863 12.969 ( 0.000 2.395 0.000) 2.395 13.007 ( 0.000 -1.129 0.000) 1.129 13.036 ( 0.000 0.500 0.000) 0.500 13.135 ( 0.000 -2.146 0.000) 2.146 13.236 ( 0.000 -0.607 0.000) 0.607 13.406 ( 0.000 -0.998 0.000) 0.998 13.428 ( 0.000 -1.024 0.000) 1.024 13.726 ( 0.000 1.179 0.000) 1.179 13.757 ( 0.000 0.942 0.000) 0.942 13.764 ( 0.000 -0.284 0.000) 0.284 13.998 ( 0.000 0.390 0.000) 0.390 14.276 ( 0.000 0.264 0.000) 0.264 14.313 ( 0.000 1.434 0.000) 1.434 14.615 ( 0.000 0.107 0.000) 0.107 14.659 ( 0.000 0.030 0.000) 0.030 15.091 ( 0.000 4.384 0.000) 4.384 15.288 ( 0.000 -1.132 0.000) 1.132 15.327 ( 0.000 -4.676 0.000) 4.676 15.444 ( 0.000 0.147 0.000) 0.147 15.662 ( 0.000 -0.471 0.000) 0.471 15.799 ( 0.000 -0.090 0.000) 0.090 15.815 ( 0.000 1.920 0.000) 1.920 15.919 ( 0.000 -0.501 0.000) 0.501 16.004 ( 0.000 1.776 0.000) 1.776 16.445 ( 0.000 -0.174 0.000) 0.174 16.532 ( 0.000 -0.979 0.000) 0.979 16.603 ( 0.000 0.699 0.000) 0.699 16.923 ( 0.000 0.129 0.000) 0.129 17.226 ( 0.000 0.704 0.000) 0.704 17.287 ( 0.000 0.220 0.000) 0.220 17.485 ( 0.000 -0.125 0.000) 0.125 17.490 ( 0.000 1.590 0.000) 1.590 17.492 ( 0.000 0.434 0.000) 0.434 17.605 ( 0.000 -0.330 0.000) 0.330 17.827 ( 0.000 0.128 0.000) 0.128 17.962 ( 0.000 -0.105 0.000) 0.105 18.013 ( 0.000 -0.087 0.000) 0.087 18.060 ( 0.000 -0.570 0.000) 0.570 18.257 ( 0.000 -0.100 0.000) 0.100 18.344 ( 0.000 0.339 0.000) 0.339 18.457 ( 0.000 0.008 0.000) 0.008 18.656 ( 0.000 -0.061 0.000) 0.061 18.669 ( 0.000 0.524 0.000) 0.524 18.712 ( 0.000 0.049 0.000) 0.049 18.719 ( 0.000 -0.093 0.000) 0.093 18.803 ( 0.000 0.018 0.000) 0.018 19.040 ( 0.000 0.238 0.000) 0.238 19.080 ( 0.000 -0.525 0.000) 0.525 19.249 ( 0.000 0.009 0.000) 0.009 19.317 ( 0.000 -0.175 0.000) 0.175 19.323 ( 0.000 -0.106 0.000) 0.106 19.707 ( 0.000 0.486 0.000) 0.486 19.765 ( 0.000 0.211 0.000) 0.211 19.853 ( 0.000 -0.023 0.000) 0.023 20.182 ( 0.000 0.098 0.000) 0.098 20.635 ( 0.000 -0.209 0.000) 0.209 20.644 ( 0.000 -0.941 0.000) 0.941 20.711 ( 0.000 -0.359 0.000) 0.359 20.796 ( 0.000 1.857 0.000) 1.857 20.813 ( 0.000 -0.588 0.000) 0.588 20.932 ( 0.000 0.326 0.000) 0.326 20.945 ( 0.000 0.623 0.000) 0.623 21.018 ( 0.000 -1.338 0.000) 1.338 21.119 ( 0.000 0.311 0.000) 0.311 21.243 ( 0.000 -0.734 0.000) 0.734 21.408 ( 0.000 0.534 0.000) 0.534 21.965 ( 0.000 -0.131 0.000) 0.131 22.108 ( 0.000 -0.793 0.000) 0.793 22.349 ( 0.000 0.150 0.000) 0.150 22.375 ( 0.000 0.598 0.000) 0.598 22.574 ( 0.000 0.635 0.000) 0.635 22.669 ( 0.000 0.642 0.000) 0.642 22.863 ( 0.000 -0.409 0.000) 0.409 22.935 ( 0.000 -0.699 0.000) 0.699 22.947 ( 0.000 0.631 0.000) 0.631 23.245 ( 0.000 0.539 0.000) 0.539 23.524 ( 0.000 0.868 0.000) 0.868 23.779 ( 0.000 0.716 0.000) 0.716 23.827 ( 0.000 0.528 0.000) 0.528 23.851 ( 0.000 0.271 0.000) 0.271 23.899 ( 0.000 0.115 0.000) 0.115 24.176 ( 0.000 1.896 0.000) 1.896 24.215 ( 0.000 0.919 0.000) 0.919 24.262 ( 0.000 0.048 0.000) 0.048 24.328 ( 0.000 -0.329 0.000) 0.329 24.491 ( 0.000 0.000 0.000) 0.000 24.560 ( 0.000 -0.013 0.000) 0.013 24.669 ( 0.000 0.194 0.000) 0.194 24.843 ( 0.000 0.286 0.000) 0.286 24.872 ( 0.000 -0.970 0.000) 0.970 24.923 ( 0.000 -0.675 0.000) 0.675 25.695 ( 0.000 0.012 0.000) 0.012 25.697 ( 0.000 1.129 0.000) 1.129 25.784 ( 0.000 -1.003 0.000) 1.003 26.015 ( 0.000 -0.529 0.000) 0.529 26.110 ( 0.000 0.528 0.000) 0.528 26.223 ( 0.000 -0.347 0.000) 0.347 26.327 ( 0.000 0.024 0.000) 0.024 26.510 ( 0.000 0.026 0.000) 0.026 27.410 ( 0.000 -0.313 0.000) 0.313 27.552 ( 0.000 -2.036 0.000) 2.036 27.554 ( 0.000 0.017 0.000) 0.017 27.709 ( 0.000 -1.102 0.000) 1.102 27.714 ( 0.000 -3.347 0.000) 3.347 27.847 ( 0.000 -1.481 0.000) 1.481 28.037 ( 0.000 -0.012 0.000) 0.012 28.333 ( 0.000 -3.110 0.000) 3.110 28.447 ( 0.000 -0.060 0.000) 0.060 28.590 ( 0.000 -0.431 0.000) 0.431 28.594 ( 0.000 -1.468 0.000) 1.468 28.877 ( 0.000 -0.236 0.000) 0.236 29.152 ( 0.000 -0.201 0.000) 0.201 29.433 ( 0.000 -0.642 0.000) 0.642 29.726 ( 0.000 -1.622 0.000) 1.622 29.767 ( 0.000 -0.120 0.000) 0.120 30.006 ( 0.000 -0.390 0.000) 0.390 30.126 ( 0.000 -0.296 0.000) 0.296 30.400 ( 0.000 -1.670 0.000) 1.670 30.542 ( 0.000 -1.804 0.000) 1.804 30.577 ( 0.000 -0.732 0.000) 0.732 30.692 ( 0.000 -0.238 0.000) 0.238 30.709 ( 0.000 -0.064 0.000) 0.064 30.894 ( 0.000 1.409 0.000) 1.409 30.932 ( 0.000 -2.031 0.000) 2.031 31.097 ( 0.000 -1.561 0.000) 1.561 31.268 ( 0.000 -1.511 0.000) 1.511 31.297 ( 0.000 -0.137 0.000) 0.137 31.579 ( 0.000 -0.671 0.000) 0.671 31.708 ( 0.000 -1.602 0.000) 1.602 31.732 ( 0.000 -1.467 0.000) 1.467 32.032 ( 0.000 -0.984 0.000) 0.984 32.094 ( 0.000 -1.301 0.000) 1.301 32.413 ( 0.000 -0.646 0.000) 0.646 32.465 ( 0.000 -0.990 0.000) 0.990 33.177 ( 0.000 -0.571 0.000) 0.571 33.370 ( 0.000 -2.503 0.000) 2.503 33.605 ( 0.000 -1.927 0.000) 1.927 33.626 ( 0.000 -1.015 0.000) 1.015 33.858 ( 0.000 -0.709 0.000) 0.709 34.185 ( 0.000 -2.903 0.000) 2.903 35.111 ( 0.000 -1.394 0.000) 1.394 36.474 ( 0.000 -11.097 0.000) 11.097 ======================= Grid point 26 (17/54) ======================= q-point: ( 0.25 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.375 ( 4.114 1.416 0.000) 4.351 2.425 ( 7.895 7.280 0.000) 10.739 2.445 ( 2.718 4.088 0.000) 4.909 2.788 ( -6.495 1.128 0.000) 6.592 2.825 ( -1.943 -1.154 0.000) 2.260 2.858 ( -1.128 4.863 0.000) 4.992 2.897 ( 0.710 4.641 0.000) 4.695 2.985 ( 1.564 -6.960 0.000) 7.134 3.045 ( 0.237 -3.764 0.000) 3.772 3.076 ( -1.659 1.177 0.000) 2.034 3.145 ( 3.032 -3.246 0.000) 4.442 3.237 ( -3.401 -0.064 0.000) 3.401 3.306 ( 2.311 7.323 0.000) 7.679 3.329 ( 0.973 1.656 0.000) 1.920 3.360 ( -3.504 2.851 0.000) 4.518 3.421 ( -3.887 1.519 0.000) 4.173 3.538 ( 3.330 3.219 0.000) 4.632 3.547 ( 3.137 1.798 0.000) 3.616 3.598 ( 3.503 8.006 0.000) 8.739 3.600 ( 1.309 0.256 0.000) 1.333 3.662 ( 12.442 2.223 0.000) 12.639 3.775 ( 3.322 2.325 0.000) 4.054 3.826 ( 3.340 -10.100 0.000) 10.638 3.972 ( -3.042 -0.792 0.000) 3.144 4.059 ( 5.726 -4.508 0.000) 7.288 4.208 ( -11.856 3.193 0.000) 12.279 4.216 ( -1.381 -1.929 0.000) 2.372 4.289 ( 8.020 5.122 0.000) 9.516 4.433 ( -14.299 -1.834 0.000) 14.416 4.486 ( -1.015 3.380 0.000) 3.529 4.557 ( 5.514 -0.915 0.000) 5.589 4.783 ( -6.383 0.090 0.000) 6.384 5.120 ( 9.294 -2.813 0.000) 9.710 5.188 ( 6.752 -1.772 0.000) 6.980 5.626 ( -12.713 1.294 0.000) 12.779 5.668 ( -12.383 -2.850 0.000) 12.707 6.180 ( 11.773 -0.292 0.000) 11.776 6.201 ( 1.082 -0.780 0.000) 1.334 6.204 ( 2.703 -1.021 0.000) 2.890 6.297 ( 8.207 -0.669 0.000) 8.235 6.381 ( 18.374 -3.085 0.000) 18.631 6.506 ( -1.385 -1.411 0.000) 1.977 6.787 ( -15.610 -2.958 0.000) 15.888 6.823 ( 11.425 -0.521 0.000) 11.437 6.895 ( 14.709 -1.116 0.000) 14.751 7.034 ( 1.981 -2.525 0.000) 3.210 7.317 ( -12.486 -0.005 0.000) 12.486 7.491 ( -5.617 -1.626 0.000) 5.847 7.609 ( 14.645 -1.203 0.000) 14.694 7.750 ( -2.408 -6.506 0.000) 6.937 7.868 ( -14.155 -1.281 0.000) 14.213 7.919 ( 1.878 -0.588 0.000) 1.968 7.923 ( 8.436 -0.484 0.000) 8.450 8.045 ( -10.436 -1.750 0.000) 10.581 8.317 ( -4.034 -0.365 0.000) 4.051 8.410 ( -4.454 -0.682 0.000) 4.505 8.431 ( 2.211 -0.679 0.000) 2.313 8.696 ( -32.961 -0.797 0.000) 32.970 8.781 ( 3.718 0.356 0.000) 3.735 8.796 ( 1.995 1.651 0.000) 2.590 9.090 ( 17.462 1.410 0.000) 17.519 9.198 ( 10.129 -1.297 0.000) 10.212 9.246 ( -35.111 -0.596 0.000) 35.116 9.342 ( -5.524 -0.407 0.000) 5.539 9.612 ( -2.631 -0.964 0.000) 2.802 9.643 ( 12.871 -0.035 0.000) 12.871 9.718 ( -4.698 0.805 0.000) 4.766 9.868 ( -8.807 2.928 0.000) 9.280 9.995 ( -3.373 -1.905 0.000) 3.874 10.045 ( 8.450 0.187 0.000) 8.452 10.084 ( 0.080 -2.444 0.000) 2.445 10.266 ( 9.582 0.552 0.000) 9.598 10.453 ( -1.567 0.181 0.000) 1.578 10.615 ( -19.893 -0.987 0.000) 19.917 10.726 ( 4.186 -1.676 0.000) 4.509 10.740 ( 5.455 -2.889 0.000) 6.173 10.773 ( -16.351 -1.033 0.000) 16.384 10.952 ( 0.723 -1.009 0.000) 1.241 10.975 ( -21.279 -0.249 0.000) 21.281 11.111 ( -4.868 -0.209 0.000) 4.872 11.192 ( 30.864 -0.396 0.000) 30.867 11.327 ( 3.303 0.442 0.000) 3.333 11.356 ( 7.942 -0.466 0.000) 7.956 11.549 ( 7.209 -0.425 0.000) 7.222 11.621 ( 9.566 -0.416 0.000) 9.575 11.955 ( -0.949 0.727 0.000) 1.196 12.028 ( 2.138 -0.783 0.000) 2.277 12.080 ( -2.500 3.927 0.000) 4.655 12.196 ( -0.582 -4.645 0.000) 4.682 12.216 ( -3.318 -0.402 0.000) 3.342 12.418 ( 3.666 1.269 0.000) 3.880 12.419 ( 3.192 0.604 0.000) 3.248 12.464 ( -8.385 -1.121 0.000) 8.459 12.603 ( 15.531 2.321 0.000) 15.703 12.711 ( -4.875 0.525 0.000) 4.903 12.718 ( -3.726 -2.535 0.000) 4.507 12.759 ( 4.857 -0.132 0.000) 4.858 12.880 ( -3.840 -1.197 0.000) 4.022 12.935 ( -11.818 0.780 0.000) 11.843 12.971 ( 7.108 -0.771 0.000) 7.149 13.156 ( 11.077 -0.951 0.000) 11.118 13.203 ( -7.619 1.787 0.000) 7.826 13.301 ( 16.017 -1.432 0.000) 16.081 13.401 ( 3.209 -1.422 0.000) 3.510 13.459 ( 4.044 0.229 0.000) 4.050 13.674 ( 10.036 -0.681 0.000) 10.059 13.718 ( -6.799 0.569 0.000) 6.823 13.910 ( 6.997 1.138 0.000) 7.089 14.135 ( -10.655 0.251 0.000) 10.657 14.277 ( -5.939 1.381 0.000) 6.097 14.435 ( 27.612 0.624 0.000) 27.619 14.679 ( 6.799 -0.545 0.000) 6.821 14.780 ( 14.293 -0.116 0.000) 14.293 15.027 ( -2.562 2.190 0.000) 3.371 15.139 ( -8.787 -1.101 0.000) 8.856 15.224 ( -9.031 1.539 0.000) 9.161 15.296 ( -8.619 -3.945 0.000) 9.479 15.623 ( -17.621 1.974 0.000) 17.732 15.756 ( -9.335 -0.459 0.000) 9.346 15.861 ( -17.352 1.467 0.000) 17.414 15.874 ( 3.943 1.328 0.000) 4.160 15.912 ( 10.985 -1.729 0.000) 11.120 16.045 ( -22.904 -1.287 0.000) 22.940 16.471 ( -22.462 0.496 0.000) 22.467 16.694 ( 17.216 -0.495 0.000) 17.223 16.879 ( 7.476 0.434 0.000) 7.488 17.272 ( -0.316 0.568 0.000) 0.650 17.415 ( -1.818 0.048 0.000) 1.819 17.481 ( 0.062 -0.819 0.000) 0.822 17.528 ( 5.579 1.528 0.000) 5.785 17.556 ( 5.694 0.084 0.000) 5.694 17.709 ( 8.080 0.272 0.000) 8.085 17.872 ( 3.274 1.073 0.000) 3.445 18.041 ( -0.933 -0.645 0.000) 1.135 18.054 ( 1.835 -0.315 0.000) 1.862 18.076 ( 13.425 -0.017 0.000) 13.425 18.158 ( -11.743 1.032 0.000) 11.788 18.190 ( -3.714 -0.801 0.000) 3.799 18.506 ( -2.694 -0.001 0.000) 2.694 18.613 ( -2.862 0.160 0.000) 2.867 18.665 ( 0.237 0.022 0.000) 0.238 18.690 ( 2.081 0.566 0.000) 2.157 18.753 ( 1.075 0.435 0.000) 1.160 18.838 ( -15.351 0.040 0.000) 15.352 18.871 ( 6.529 -0.391 0.000) 6.541 19.109 ( -0.114 -0.498 0.000) 0.511 19.260 ( 1.593 -0.334 0.000) 1.628 19.331 ( 0.308 -0.340 0.000) 0.458 19.538 ( 15.641 0.173 0.000) 15.642 19.742 ( 3.890 0.150 0.000) 3.892 19.966 ( 17.516 0.278 0.000) 17.519 20.003 ( 10.817 0.257 0.000) 10.820 20.178 ( 0.098 0.196 0.000) 0.219 20.534 ( -8.888 -0.520 0.000) 8.903 20.601 ( -11.681 1.366 0.000) 11.760 20.643 ( -1.659 -1.145 0.000) 2.016 20.672 ( -1.424 -0.344 0.000) 1.465 20.805 ( 2.226 1.041 0.000) 2.457 20.832 ( -9.350 -1.100 0.000) 9.415 21.012 ( 3.630 0.590 0.000) 3.678 21.075 ( -12.167 -0.179 0.000) 12.169 21.090 ( -0.482 -0.534 0.000) 0.720 21.134 ( 4.525 -0.754 0.000) 4.587 21.366 ( -6.042 0.354 0.000) 6.052 22.104 ( -17.109 0.473 0.000) 17.116 22.115 ( -15.064 0.823 0.000) 15.086 22.183 ( 16.394 -0.085 0.000) 16.394 22.189 ( 9.252 -0.415 0.000) 9.261 22.762 ( 6.776 0.490 0.000) 6.793 22.870 ( 19.206 0.662 0.000) 19.218 22.916 ( 5.075 -0.271 0.000) 5.083 23.005 ( 2.942 -0.139 0.000) 2.945 23.030 ( 3.960 -0.062 0.000) 3.961 23.127 ( -7.419 0.439 0.000) 7.432 23.452 ( -7.136 0.889 0.000) 7.191 23.554 ( -18.535 0.073 0.000) 18.536 23.778 ( -0.774 0.757 0.000) 1.083 23.811 ( -2.405 0.126 0.000) 2.408 23.926 ( -3.812 0.253 0.000) 3.820 24.020 ( -15.597 -0.139 0.000) 15.598 24.058 ( 0.024 1.260 0.000) 1.260 24.322 ( 8.234 1.012 0.000) 8.295 24.373 ( -9.124 0.011 0.000) 9.124 24.601 ( -4.357 1.026 0.000) 4.477 24.629 ( 18.466 0.039 0.000) 18.467 24.814 ( 24.701 -0.696 0.000) 24.711 25.036 ( 11.294 -0.845 0.000) 11.326 25.121 ( 19.080 0.252 0.000) 19.082 25.285 ( 31.221 -0.660 0.000) 31.228 25.407 ( -18.104 -0.031 0.000) 18.104 25.675 ( -2.542 0.045 0.000) 2.542 25.774 ( -0.342 -0.284 0.000) 0.445 25.985 ( -0.493 -0.607 0.000) 0.782 25.987 ( -11.332 0.335 0.000) 11.337 26.322 ( -2.005 -0.053 0.000) 2.006 26.505 ( -0.422 0.001 0.000) 0.422 26.640 ( 30.542 -0.517 0.000) 30.547 26.960 ( -35.888 -1.216 0.000) 35.909 27.090 ( -45.010 -3.450 0.000) 45.142 27.525 ( -1.721 0.280 0.000) 1.743 27.551 ( -0.336 0.019 0.000) 0.336 27.553 ( -4.926 -2.650 0.000) 5.593 28.080 ( 4.196 0.058 0.000) 4.196 28.230 ( -9.558 -0.899 0.000) 9.600 28.278 ( 7.183 -0.914 0.000) 7.241 28.387 ( -13.527 -1.550 0.000) 13.615 28.453 ( 11.515 -0.423 0.000) 11.522 28.831 ( 17.729 -1.236 0.000) 17.772 29.061 ( -8.614 -0.116 0.000) 8.615 29.090 ( 13.632 -0.559 0.000) 13.643 29.473 ( 0.612 -0.831 0.000) 1.032 29.556 ( -14.753 -1.544 0.000) 14.833 29.853 ( 7.570 -0.087 0.000) 7.570 30.100 ( -2.848 -0.317 0.000) 2.865 30.148 ( 13.566 -0.465 0.000) 13.574 30.443 ( 3.740 -1.428 0.000) 4.003 30.542 ( -0.905 -1.433 0.000) 1.695 30.619 ( -5.549 -0.188 0.000) 5.553 30.622 ( 5.032 -0.953 0.000) 5.122 30.695 ( 0.143 -0.397 0.000) 0.422 30.862 ( -5.206 -0.501 0.000) 5.230 31.024 ( 0.391 -0.229 0.000) 0.453 31.142 ( -1.873 -1.368 0.000) 2.319 31.218 ( 10.342 -1.145 0.000) 10.405 31.353 ( 4.765 -0.552 0.000) 4.797 31.525 ( -5.916 -0.583 0.000) 5.944 31.674 ( -3.159 -1.786 0.000) 3.629 31.811 ( 0.615 -0.283 0.000) 0.677 31.838 ( -6.463 -2.806 0.000) 7.046 32.148 ( -12.449 -0.999 0.000) 12.489 32.256 ( 9.958 -0.750 0.000) 9.986 32.751 ( 14.014 -0.242 0.000) 14.016 32.927 ( -24.414 -2.058 0.000) 24.501 33.136 ( -4.278 -0.724 0.000) 4.338 33.741 ( 10.231 -1.071 0.000) 10.287 33.887 ( 5.042 0.542 0.000) 5.071 33.942 ( 10.429 -4.053 0.000) 11.188 34.131 ( -5.142 -2.651 0.000) 5.785 35.267 ( 17.322 -2.583 0.000) 17.513 36.267 ( -20.120 -9.614 0.000) 22.299 ======================= Grid point 27 (18/54) ======================= q-point: (-0.50 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 51 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.454 ( -2.223 0.297 0.000) 2.243 2.454 ( 2.223 0.297 0.000) 2.243 2.618 ( -6.589 5.565 0.000) 8.625 2.618 ( 6.589 5.565 0.000) 8.625 2.818 ( -0.518 7.855 0.000) 7.872 2.818 ( 0.518 7.855 0.000) 7.872 2.955 ( -4.154 -5.467 0.000) 6.866 2.955 ( 4.154 -5.467 0.000) 6.866 3.042 ( -0.003 -3.552 0.000) 3.552 3.042 ( 0.003 -3.552 0.000) 3.552 3.188 ( -0.533 0.242 0.000) 0.585 3.188 ( 0.533 0.242 0.000) 0.585 3.326 ( -0.097 3.274 0.000) 3.275 3.326 ( 0.097 3.274 0.000) 3.275 3.359 ( -0.625 0.678 0.000) 0.923 3.359 ( 0.625 0.678 0.000) 0.923 3.587 ( -0.014 5.189 0.000) 5.189 3.587 ( 0.014 5.189 0.000) 5.189 3.633 ( -0.359 3.223 0.000) 3.243 3.633 ( 0.359 3.223 0.000) 3.243 3.853 ( -2.199 0.351 0.000) 2.227 3.853 ( 2.199 0.350 0.000) 2.227 3.929 ( -12.897 1.643 0.000) 13.001 3.929 ( 12.897 1.643 0.000) 13.002 4.075 ( -13.345 -5.305 0.000) 14.361 4.075 ( 13.345 -5.305 0.000) 14.361 4.176 ( -0.777 -3.066 0.000) 3.162 4.176 ( 0.777 -3.066 0.000) 3.162 4.427 ( -4.405 5.370 0.000) 6.946 4.427 ( 4.405 5.370 0.000) 6.946 4.677 ( -4.901 -0.307 0.000) 4.911 4.677 ( 4.901 -0.307 0.000) 4.911 5.351 ( -10.045 -0.006 0.000) 10.045 5.351 ( 10.045 -0.006 0.000) 10.045 5.388 ( -10.487 -3.115 0.000) 10.940 5.388 ( 10.487 -3.115 0.000) 10.940 6.220 ( -1.325 -0.920 0.000) 1.613 6.220 ( 1.325 -0.920 0.000) 1.613 6.356 ( -6.081 -1.858 0.000) 6.358 6.356 ( 6.081 -1.858 0.000) 6.358 6.522 ( -4.208 -0.912 0.000) 4.306 6.522 ( 4.208 -0.912 0.000) 4.306 6.908 ( -6.052 -2.450 0.000) 6.529 6.908 ( 6.052 -2.450 0.000) 6.529 7.099 ( -0.021 -1.901 0.000) 1.901 7.099 ( 0.021 -1.901 0.000) 1.901 7.391 ( -23.096 0.704 0.000) 23.107 7.391 ( 23.096 0.704 0.000) 23.107 7.480 ( -0.487 -2.698 0.000) 2.742 7.480 ( 0.487 -2.698 0.000) 2.742 7.880 ( -0.586 -2.099 0.000) 2.179 7.880 ( 0.586 -2.099 0.000) 2.179 7.955 ( -4.291 -1.276 0.000) 4.477 7.955 ( 4.291 -1.276 0.000) 4.477 8.304 ( -4.238 -1.404 0.000) 4.464 8.304 ( 4.238 -1.404 0.000) 4.464 8.399 ( -2.356 -0.721 0.000) 2.464 8.399 ( 2.356 -0.721 0.000) 2.464 8.830 ( -0.010 1.110 0.000) 1.110 8.830 ( 0.010 1.110 0.000) 1.110 8.977 ( -5.342 -0.066 0.000) 5.342 8.977 ( 5.342 -0.066 0.000) 5.342 9.444 ( -13.751 -0.034 0.000) 13.751 9.444 ( 13.751 -0.034 0.000) 13.751 9.637 ( -6.488 0.909 0.000) 6.551 9.637 ( 6.488 0.909 0.000) 6.551 9.717 ( -2.250 -0.743 0.000) 2.369 9.717 ( 2.250 -0.743 0.000) 2.369 10.002 ( -3.194 0.263 0.000) 3.205 10.002 ( 3.194 0.263 0.000) 3.205 10.291 ( -12.700 -1.476 0.000) 12.786 10.291 ( 12.700 -1.476 0.000) 12.786 10.517 ( -8.270 -0.735 0.000) 8.303 10.517 ( 8.270 -0.735 0.000) 8.303 10.551 ( -17.115 0.670 0.000) 17.128 10.551 ( 17.115 0.670 0.000) 17.128 10.806 ( -0.076 -3.240 0.000) 3.241 10.806 ( 0.076 -3.240 0.000) 3.241 11.000 ( -2.879 -0.421 0.000) 2.910 11.000 ( 2.879 -0.421 0.000) 2.910 11.390 ( -0.768 0.632 0.000) 0.995 11.390 ( 0.768 0.632 0.000) 0.995 11.574 ( -6.442 -0.841 0.000) 6.497 11.574 ( 6.442 -0.841 0.000) 6.497 11.863 ( -13.344 0.214 0.000) 13.346 11.863 ( 13.344 0.214 0.000) 13.346 11.998 ( -2.345 1.541 0.000) 2.806 11.998 ( 2.345 1.541 0.000) 2.806 12.167 ( -0.002 -2.462 0.000) 2.462 12.167 ( 0.002 -2.462 0.000) 2.462 12.428 ( -1.417 -0.248 0.000) 1.439 12.428 ( 1.417 -0.248 0.000) 1.439 12.586 ( -11.267 1.507 0.000) 11.367 12.586 ( 11.267 1.507 0.000) 11.367 12.660 ( -0.073 0.063 0.000) 0.096 12.660 ( 0.073 0.063 0.000) 0.096 12.835 ( -0.591 -1.752 0.000) 1.849 12.835 ( 0.591 -1.752 0.000) 1.849 12.944 ( -14.481 0.309 0.000) 14.484 12.944 ( 14.481 0.309 0.000) 14.484 13.365 ( -19.974 1.012 0.000) 19.999 13.365 ( 19.974 1.012 0.000) 19.999 13.401 ( -9.013 0.311 0.000) 9.019 13.401 ( 9.013 0.311 0.000) 9.019 13.502 ( -0.435 -1.750 0.000) 1.803 13.502 ( 0.435 -1.750 0.000) 1.803 13.910 ( -11.505 0.048 0.000) 11.505 13.910 ( 11.505 0.048 0.000) 11.505 14.098 ( -10.914 0.742 0.000) 10.939 14.098 ( 10.914 0.742 0.000) 10.939 14.844 ( -8.833 3.063 0.000) 9.349 14.844 ( 8.833 3.063 0.000) 9.349 14.928 ( -10.638 -2.777 0.000) 10.994 14.928 ( 10.638 -2.777 0.000) 10.994 15.219 ( -17.021 2.030 0.000) 17.142 15.219 ( 17.021 2.031 0.000) 17.142 15.322 ( -20.225 -0.727 0.000) 20.238 15.322 ( 20.225 -0.727 0.000) 20.238 15.380 ( -21.135 -1.687 0.000) 21.203 15.380 ( 21.136 -1.687 0.000) 21.203 15.891 ( -0.460 -0.094 0.000) 0.469 15.891 ( 0.460 -0.094 0.000) 0.469 16.173 ( -11.982 0.351 0.000) 11.987 16.173 ( 11.982 0.351 0.000) 11.987 16.910 ( -3.739 -0.265 0.000) 3.749 16.910 ( 3.739 -0.265 0.000) 3.749 17.317 ( -4.794 0.134 0.000) 4.795 17.317 ( 4.794 0.134 0.000) 4.795 17.560 ( -5.960 -0.086 0.000) 5.960 17.560 ( 5.960 -0.086 0.000) 5.960 17.689 ( -6.546 1.075 0.000) 6.633 17.689 ( 6.546 1.075 0.000) 6.633 17.945 ( -4.011 0.765 0.000) 4.083 17.945 ( 4.011 0.765 0.000) 4.083 18.034 ( -0.030 -0.439 0.000) 0.440 18.034 ( 0.030 -0.439 0.000) 0.440 18.300 ( -11.240 -0.579 0.000) 11.255 18.300 ( 11.240 -0.579 0.000) 11.255 18.474 ( -20.603 0.313 0.000) 20.605 18.474 ( 20.603 0.313 0.000) 20.605 18.657 ( -1.452 0.058 0.000) 1.453 18.657 ( 1.452 0.058 0.000) 1.453 18.741 ( -0.530 0.897 0.000) 1.042 18.741 ( 0.530 0.897 0.000) 1.042 19.020 ( -6.380 -0.713 0.000) 6.419 19.020 ( 6.380 -0.713 0.000) 6.419 19.312 ( -2.059 -0.409 0.000) 2.099 19.312 ( 2.059 -0.409 0.000) 2.099 19.768 ( -4.723 0.061 0.000) 4.723 19.768 ( 4.723 0.061 0.000) 4.723 20.140 ( -1.568 0.235 0.000) 1.585 20.140 ( 1.568 0.235 0.000) 1.585 20.341 ( -14.072 0.601 0.000) 14.084 20.341 ( 14.072 0.601 0.000) 14.084 20.521 ( -7.387 -0.591 0.000) 7.410 20.521 ( 7.387 -0.591 0.000) 7.410 20.671 ( -1.046 -0.251 0.000) 1.076 20.671 ( 1.046 -0.251 0.000) 1.076 20.910 ( -2.142 -0.155 0.000) 2.147 20.910 ( 2.142 -0.155 0.000) 2.147 21.121 ( -2.721 -0.025 0.000) 2.722 21.121 ( 2.721 -0.025 0.000) 2.722 21.164 ( -12.067 -0.187 0.000) 12.069 21.164 ( 12.067 -0.187 0.000) 12.069 21.920 ( -0.655 0.608 0.000) 0.894 21.920 ( 0.655 0.608 0.000) 0.894 22.380 ( -1.893 0.018 0.000) 1.893 22.380 ( 1.893 0.018 0.000) 1.893 22.862 ( -6.009 0.586 0.000) 6.038 22.862 ( 6.009 0.586 0.000) 6.038 23.018 ( -4.229 -0.100 0.000) 4.230 23.018 ( 4.229 -0.100 0.000) 4.230 23.230 ( -11.721 0.936 0.000) 11.758 23.230 ( 11.721 0.936 0.000) 11.758 23.244 ( -7.448 -0.484 0.000) 7.464 23.244 ( 7.448 -0.484 0.000) 7.464 23.801 ( -3.309 0.741 0.000) 3.391 23.801 ( 3.309 0.741 0.000) 3.391 23.815 ( -3.477 -0.029 0.000) 3.477 23.815 ( 3.477 -0.029 0.000) 3.477 24.180 ( -8.537 0.487 0.000) 8.550 24.180 ( 8.537 0.487 0.000) 8.550 24.489 ( -6.815 0.901 0.000) 6.875 24.489 ( 6.815 0.901 0.000) 6.875 25.014 ( -18.829 0.389 0.000) 18.833 25.014 ( 18.829 0.389 0.000) 18.833 25.167 ( -1.833 -1.053 0.000) 2.114 25.167 ( 1.833 -1.053 0.000) 2.114 25.508 ( -16.607 0.230 0.000) 16.609 25.508 ( 16.607 0.230 0.000) 16.609 25.796 ( -3.694 -0.207 0.000) 3.700 25.796 ( 3.694 -0.207 0.000) 3.700 25.993 ( -34.417 -1.080 0.000) 34.434 25.993 ( 34.417 -1.080 0.000) 34.434 26.244 ( -32.678 -1.994 0.000) 32.739 26.244 ( 32.678 -1.994 0.000) 32.739 26.519 ( -4.398 -0.265 0.000) 4.406 26.519 ( 4.398 -0.265 0.000) 4.406 27.227 ( -25.875 -1.060 0.000) 25.897 27.227 ( 25.875 -1.060 0.000) 25.897 27.541 ( -0.064 -0.074 0.000) 0.098 27.541 ( 0.064 -0.074 0.000) 0.098 28.165 ( -1.764 0.465 0.000) 1.824 28.165 ( 1.764 0.465 0.000) 1.824 28.205 ( -2.900 -2.078 0.000) 3.568 28.205 ( 2.900 -2.078 0.000) 3.568 28.810 ( -16.626 -0.304 0.000) 16.629 28.810 ( 16.626 -0.304 0.000) 16.629 29.166 ( -14.518 -1.379 0.000) 14.583 29.166 ( 14.518 -1.379 0.000) 14.583 29.392 ( -6.351 -0.601 0.000) 6.380 29.392 ( 6.351 -0.601 0.000) 6.380 30.006 ( -6.791 -0.181 0.000) 6.794 30.006 ( 6.791 -0.181 0.000) 6.794 30.437 ( -12.259 -0.983 0.000) 12.298 30.437 ( 12.259 -0.983 0.000) 12.298 30.515 ( -2.994 -0.522 0.000) 3.040 30.515 ( 2.994 -0.522 0.000) 3.040 30.747 ( -4.440 -0.315 0.000) 4.451 30.747 ( 4.440 -0.315 0.000) 4.451 30.796 ( -12.045 -1.597 0.000) 12.151 30.796 ( 12.045 -1.597 0.000) 12.151 31.341 ( -10.534 -0.168 0.000) 10.535 31.341 ( 10.534 -0.168 0.000) 10.535 31.404 ( -3.057 -0.512 0.000) 3.100 31.404 ( 3.057 -0.512 0.000) 3.100 31.636 ( -2.056 -2.447 0.000) 3.196 31.636 ( 2.056 -2.447 0.000) 3.196 31.957 ( -6.731 -1.274 0.000) 6.851 31.957 ( 6.731 -1.274 0.000) 6.851 32.507 ( -16.129 -0.642 0.000) 16.142 32.507 ( 16.129 -0.642 0.000) 16.142 33.001 ( -9.556 -1.068 0.000) 9.616 33.001 ( 9.556 -1.068 0.000) 9.616 33.936 ( -1.060 -0.269 0.000) 1.094 33.936 ( 1.060 -0.269 0.000) 1.094 34.014 ( -0.650 -3.220 0.000) 3.285 34.014 ( 0.650 -3.220 0.000) 3.285 35.757 ( -29.001 -6.113 0.000) 29.638 35.757 ( 29.001 -6.113 0.000) 29.638 ======================= Grid point 55 (19/54) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 36 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.751 ( 0.000 0.000 36.542) 36.542 0.842 ( 0.000 0.000 40.341) 40.341 1.434 ( 0.000 0.000 66.198) 66.198 1.992 ( 0.000 0.000 -17.076) 17.076 2.083 ( 0.000 0.000 4.238) 4.238 2.306 ( 0.000 0.000 -10.172) 10.172 2.529 ( 0.000 0.000 -0.285) 0.285 2.730 ( 0.000 0.000 -9.061) 9.061 2.792 ( 0.000 0.000 -4.013) 4.013 2.908 ( 0.000 0.000 2.402) 2.402 2.922 ( 0.000 0.000 4.883) 4.883 3.060 ( 0.000 0.000 11.164) 11.164 3.079 ( 0.000 0.000 4.078) 4.078 3.132 ( 0.000 0.000 6.138) 6.138 3.276 ( 0.000 0.000 -2.204) 2.204 3.363 ( 0.000 0.000 -2.987) 2.987 3.385 ( 0.000 0.000 0.443) 0.443 3.466 ( 0.000 0.000 0.030) 0.030 3.556 ( 0.000 0.000 -7.937) 7.937 3.572 ( 0.000 0.000 2.694) 2.694 3.650 ( 0.000 0.000 -28.615) 28.615 3.651 ( 0.000 0.000 -9.675) 9.675 3.729 ( 0.000 0.000 -2.215) 2.215 3.894 ( 0.000 0.000 -3.978) 3.978 4.203 ( 0.000 0.000 7.513) 7.513 4.311 ( 0.000 0.000 5.150) 5.150 4.466 ( 0.000 0.000 0.699) 0.699 4.495 ( 0.000 0.000 -6.041) 6.041 4.835 ( 0.000 0.000 -1.458) 1.458 4.901 ( 0.000 0.000 -3.842) 3.842 4.985 ( 0.000 0.000 3.900) 3.900 5.084 ( 0.000 0.000 -0.794) 0.794 5.130 ( 0.000 0.000 2.364) 2.364 5.139 ( 0.000 0.000 2.480) 2.480 5.788 ( 0.000 0.000 3.202) 3.202 5.983 ( 0.000 0.000 -4.577) 4.577 6.181 ( 0.000 0.000 -0.387) 0.387 6.305 ( 0.000 0.000 -3.988) 3.988 6.609 ( 0.000 0.000 13.501) 13.501 6.685 ( 0.000 0.000 17.154) 17.154 6.831 ( 0.000 0.000 9.856) 9.856 6.917 ( 0.000 0.000 2.003) 2.003 7.114 ( 0.000 0.000 5.003) 5.003 7.135 ( 0.000 0.000 -5.058) 5.058 7.215 ( 0.000 0.000 3.725) 3.725 7.324 ( 0.000 0.000 -3.162) 3.162 7.457 ( 0.000 0.000 5.063) 5.063 7.519 ( 0.000 0.000 -25.564) 25.564 7.529 ( 0.000 0.000 7.188) 7.188 7.666 ( 0.000 0.000 -1.363) 1.363 7.699 ( 0.000 0.000 -2.892) 2.892 7.834 ( 0.000 0.000 4.615) 4.615 8.021 ( 0.000 0.000 -3.306) 3.306 8.147 ( 0.000 0.000 -12.098) 12.098 8.168 ( 0.000 0.000 6.725) 6.725 8.315 ( 0.000 0.000 3.180) 3.180 8.495 ( 0.000 0.000 -2.032) 2.032 8.536 ( 0.000 0.000 11.298) 11.298 8.631 ( 0.000 0.000 -9.695) 9.695 8.660 ( 0.000 0.000 9.354) 9.354 8.878 ( 0.000 0.000 -12.761) 12.761 9.036 ( 0.000 0.000 -3.432) 3.432 9.327 ( 0.000 0.000 -6.542) 6.542 9.526 ( 0.000 0.000 -12.421) 12.421 9.585 ( 0.000 0.000 -26.916) 26.916 9.702 ( 0.000 0.000 -14.406) 14.406 9.826 ( 0.000 0.000 1.887) 1.887 9.870 ( 0.000 0.000 1.183) 1.183 10.050 ( 0.000 0.000 5.171) 5.171 10.335 ( 0.000 0.000 -25.125) 25.125 10.347 ( 0.000 0.000 5.587) 5.587 10.485 ( 0.000 0.000 12.837) 12.837 10.503 ( 0.000 0.000 15.752) 15.752 10.565 ( 0.000 0.000 -6.102) 6.102 10.951 ( 0.000 0.000 -8.891) 8.891 11.076 ( 0.000 0.000 -7.232) 7.232 11.102 ( 0.000 0.000 0.433) 0.433 11.228 ( 0.000 0.000 -2.436) 2.436 11.268 ( 0.000 0.000 11.650) 11.650 11.284 ( 0.000 0.000 4.233) 4.233 11.415 ( 0.000 0.000 -0.911) 0.911 11.550 ( 0.000 0.000 23.441) 23.441 11.601 ( 0.000 0.000 20.112) 20.112 11.698 ( 0.000 0.000 11.890) 11.890 12.001 ( 0.000 0.000 -1.857) 1.857 12.031 ( 0.000 0.000 3.863) 3.863 12.056 ( 0.000 0.000 -5.806) 5.806 12.082 ( 0.000 0.000 23.353) 23.353 12.204 ( 0.000 0.000 -0.242) 0.242 12.208 ( 0.000 0.000 0.887) 0.887 12.250 ( 0.000 0.000 -0.917) 0.917 12.404 ( 0.000 0.000 0.886) 0.886 12.444 ( 0.000 0.000 -1.134) 1.134 12.564 ( 0.000 0.000 -6.244) 6.244 12.588 ( 0.000 0.000 -3.855) 3.855 12.697 ( 0.000 0.000 13.276) 13.276 12.725 ( 0.000 0.000 -11.155) 11.155 12.935 ( 0.000 0.000 2.016) 2.016 12.965 ( 0.000 0.000 -3.849) 3.849 12.971 ( 0.000 0.000 -6.354) 6.354 13.278 ( 0.000 0.000 -10.404) 10.404 13.287 ( 0.000 0.000 -12.298) 12.298 13.321 ( 0.000 0.000 11.525) 11.525 13.353 ( 0.000 0.000 -1.256) 1.256 13.419 ( 0.000 0.000 9.362) 9.362 13.461 ( 0.000 0.000 -9.873) 9.873 13.803 ( 0.000 0.000 -5.170) 5.170 13.879 ( 0.000 0.000 -14.504) 14.504 14.067 ( 0.000 0.000 6.920) 6.920 14.149 ( 0.000 0.000 14.404) 14.404 14.310 ( 0.000 0.000 11.932) 11.932 14.737 ( 0.000 0.000 -0.389) 0.389 14.779 ( 0.000 0.000 16.391) 16.391 14.956 ( 0.000 0.000 7.463) 7.463 14.969 ( 0.000 0.000 -4.893) 4.893 15.110 ( 0.000 0.000 -19.135) 19.135 15.324 ( 0.000 0.000 -7.374) 7.374 15.552 ( 0.000 0.000 -18.222) 18.222 15.696 ( 0.000 0.000 7.737) 7.737 15.718 ( 0.000 0.000 -2.272) 2.272 15.768 ( 0.000 0.000 6.765) 6.765 15.971 ( 0.000 0.000 -5.147) 5.147 16.196 ( 0.000 0.000 -19.171) 19.171 16.273 ( 0.000 0.000 -21.304) 21.304 16.726 ( 0.000 0.000 22.297) 22.297 17.025 ( 0.000 0.000 -1.344) 1.344 17.128 ( 0.000 0.000 -9.077) 9.077 17.171 ( 0.000 0.000 16.813) 16.813 17.349 ( 0.000 0.000 9.041) 9.041 17.394 ( 0.000 0.000 25.082) 25.082 17.540 ( 0.000 0.000 -10.007) 10.007 17.849 ( 0.000 0.000 17.848) 17.848 17.935 ( 0.000 0.000 -8.580) 8.580 17.969 ( 0.000 0.000 -4.842) 4.842 18.034 ( 0.000 0.000 2.046) 2.046 18.122 ( 0.000 0.000 0.902) 0.902 18.160 ( 0.000 0.000 -3.425) 3.425 18.284 ( 0.000 0.000 -1.292) 1.292 18.371 ( 0.000 0.000 1.937) 1.937 18.417 ( 0.000 0.000 -2.775) 2.775 18.533 ( 0.000 0.000 -12.137) 12.137 18.599 ( 0.000 0.000 -9.300) 9.300 18.773 ( 0.000 0.000 0.452) 0.452 18.823 ( 0.000 0.000 2.319) 2.319 18.926 ( 0.000 0.000 -1.671) 1.671 19.030 ( 0.000 0.000 -12.032) 12.032 19.377 ( 0.000 0.000 0.327) 0.327 19.398 ( 0.000 0.000 5.173) 5.173 19.467 ( 0.000 0.000 3.985) 3.985 19.548 ( 0.000 0.000 5.488) 5.488 19.947 ( 0.000 0.000 8.875) 8.875 19.970 ( 0.000 0.000 10.548) 10.548 20.495 ( 0.000 0.000 -1.764) 1.764 20.627 ( 0.000 0.000 -4.215) 4.215 20.672 ( 0.000 0.000 -8.702) 8.702 20.754 ( 0.000 0.000 2.664) 2.664 20.820 ( 0.000 0.000 -1.013) 1.013 20.895 ( 0.000 0.000 -1.671) 1.671 20.943 ( 0.000 0.000 -10.995) 10.995 21.034 ( 0.000 0.000 -8.091) 8.091 21.115 ( 0.000 0.000 10.547) 10.547 21.135 ( 0.000 0.000 12.119) 12.119 21.352 ( 0.000 0.000 0.086) 0.086 21.680 ( 0.000 0.000 -10.970) 10.970 22.013 ( 0.000 0.000 5.893) 5.893 22.399 ( 0.000 0.000 5.755) 5.755 22.444 ( 0.000 0.000 -11.868) 11.868 22.457 ( 0.000 0.000 0.220) 0.220 22.582 ( 0.000 0.000 8.202) 8.202 22.613 ( 0.000 0.000 18.835) 18.835 22.947 ( 0.000 0.000 2.582) 2.582 23.041 ( 0.000 0.000 -2.299) 2.299 23.114 ( 0.000 0.000 -6.015) 6.015 23.302 ( 0.000 0.000 -9.137) 9.137 23.665 ( 0.000 0.000 -6.980) 6.980 23.678 ( 0.000 0.000 2.436) 2.436 23.772 ( 0.000 0.000 -2.888) 2.888 23.781 ( 0.000 0.000 -7.459) 7.459 24.020 ( 0.000 0.000 6.385) 6.385 24.040 ( 0.000 0.000 9.913) 9.913 24.200 ( 0.000 0.000 -3.437) 3.437 24.395 ( 0.000 0.000 -2.383) 2.383 24.424 ( 0.000 0.000 9.858) 9.858 24.508 ( 0.000 0.000 0.711) 0.711 24.545 ( 0.000 0.000 -1.268) 1.268 25.018 ( 0.000 0.000 19.501) 19.501 25.174 ( 0.000 0.000 -18.351) 18.351 25.235 ( 0.000 0.000 0.475) 0.475 25.448 ( 0.000 0.000 6.242) 6.242 25.514 ( 0.000 0.000 -5.564) 5.564 25.718 ( 0.000 0.000 -7.936) 7.936 25.858 ( 0.000 0.000 3.214) 3.214 25.952 ( 0.000 0.000 -22.345) 22.345 26.053 ( 0.000 0.000 -2.160) 2.160 26.452 ( 0.000 0.000 3.300) 3.300 26.497 ( 0.000 0.000 20.633) 20.633 26.500 ( 0.000 0.000 -0.225) 0.225 27.338 ( 0.000 0.000 -17.826) 17.826 27.592 ( 0.000 0.000 12.150) 12.150 27.980 ( 0.000 0.000 -4.661) 4.661 28.336 ( 0.000 0.000 9.402) 9.402 28.450 ( 0.000 0.000 2.245) 2.245 28.559 ( 0.000 0.000 4.565) 4.565 28.622 ( 0.000 0.000 -4.250) 4.250 28.831 ( 0.000 0.000 -3.396) 3.396 28.896 ( 0.000 0.000 -12.932) 12.932 28.976 ( 0.000 0.000 1.760) 1.760 28.996 ( 0.000 0.000 0.678) 0.678 29.034 ( 0.000 0.000 9.907) 9.907 29.290 ( 0.000 0.000 11.437) 11.437 29.723 ( 0.000 0.000 -21.849) 21.849 30.000 ( 0.000 0.000 -17.258) 17.258 30.028 ( 0.000 0.000 8.127) 8.127 30.335 ( 0.000 0.000 -2.969) 2.969 30.513 ( 0.000 0.000 13.650) 13.650 30.825 ( 0.000 0.000 -2.675) 2.675 30.891 ( 0.000 0.000 0.360) 0.360 30.896 ( 0.000 0.000 -0.370) 0.370 30.929 ( 0.000 0.000 5.225) 5.225 31.054 ( 0.000 0.000 7.746) 7.746 31.117 ( 0.000 0.000 -2.491) 2.491 31.141 ( 0.000 0.000 0.550) 0.550 31.653 ( 0.000 0.000 -8.474) 8.474 31.794 ( 0.000 0.000 -8.160) 8.160 32.074 ( 0.000 0.000 1.991) 1.991 32.097 ( 0.000 0.000 1.471) 1.471 32.181 ( 0.000 0.000 7.513) 7.513 32.229 ( 0.000 0.000 12.292) 12.292 32.567 ( 0.000 0.000 -3.583) 3.583 32.594 ( 0.000 0.000 -8.766) 8.766 32.845 ( 0.000 0.000 -0.881) 0.881 32.957 ( 0.000 0.000 -4.634) 4.634 33.086 ( 0.000 0.000 5.767) 5.767 33.143 ( 0.000 0.000 2.786) 2.786 33.647 ( 0.000 0.000 0.278) 0.278 33.681 ( 0.000 0.000 -1.254) 1.254 33.713 ( 0.000 0.000 0.788) 0.788 33.737 ( 0.000 0.000 0.129) 0.129 34.697 ( 0.000 0.000 0.504) 0.504 34.735 ( 0.000 0.000 -0.931) 0.931 ======================= Grid point 56 (20/54) ======================= q-point: ( 0.25 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 48 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.091 ( 28.801 0.000 24.817) 38.018 1.239 ( 28.200 0.000 28.796) 40.304 1.930 ( 32.965 0.000 24.197) 40.892 2.015 ( -8.548 0.000 14.825) 17.113 2.145 ( 19.116 0.000 7.018) 20.364 2.316 ( -13.866 0.000 -5.896) 15.068 2.332 ( 4.290 0.000 -15.999) 16.564 2.740 ( 2.094 0.000 -3.784) 4.325 2.768 ( -7.391 0.000 5.938) 9.482 2.875 ( 0.753 0.000 -5.898) 5.946 2.929 ( -9.199 0.000 -5.001) 10.470 3.040 ( 4.117 0.000 4.003) 5.742 3.128 ( 3.333 0.000 1.701) 3.742 3.207 ( 5.791 0.000 6.185) 8.473 3.218 ( -0.131 0.000 0.766) 0.777 3.293 ( -2.809 0.000 3.250) 4.295 3.422 ( -4.387 0.000 -0.448) 4.410 3.425 ( -2.354 0.000 -2.652) 3.546 3.502 ( -4.899 0.000 -4.640) 6.748 3.509 ( -8.081 0.000 -3.906) 8.976 3.620 ( 0.857 0.000 -0.473) 0.979 3.652 ( -0.302 0.000 -6.951) 6.958 3.829 ( -5.910 0.000 -1.267) 6.045 3.836 ( 4.809 0.000 -15.766) 16.483 4.152 ( -2.696 0.000 -2.057) 3.392 4.229 ( -22.930 0.000 -5.720) 23.633 4.333 ( 1.905 0.000 4.792) 5.157 4.414 ( -3.223 0.000 1.704) 3.645 4.696 ( 2.741 0.000 3.702) 4.606 4.802 ( -2.810 0.000 -1.982) 3.439 5.024 ( -8.575 0.000 2.125) 8.835 5.031 ( -9.051 0.000 2.165) 9.306 5.282 ( 11.551 0.000 2.318) 11.782 5.362 ( 18.334 0.000 -2.650) 18.525 5.699 ( -6.557 0.000 4.388) 7.890 5.907 ( -6.303 0.000 -4.524) 7.758 6.363 ( 11.306 0.000 2.229) 11.523 6.426 ( 10.247 0.000 -0.528) 10.261 6.549 ( 3.478 0.000 7.344) 8.126 6.673 ( -2.050 0.000 14.799) 14.941 6.890 ( -2.300 0.000 7.338) 7.690 6.955 ( 4.688 0.000 2.507) 5.316 6.997 ( -13.462 0.000 9.766) 16.631 7.189 ( -3.766 0.000 -6.804) 7.776 7.245 ( 3.449 0.000 -3.417) 4.855 7.365 ( -1.028 0.000 1.666) 1.958 7.402 ( -9.582 0.000 -6.767) 11.731 7.461 ( -2.168 0.000 0.224) 2.179 7.507 ( 9.596 0.000 -5.247) 10.936 7.606 ( 10.199 0.000 -6.775) 12.244 7.773 ( 10.638 0.000 -0.735) 10.664 7.921 ( 4.142 0.000 8.211) 9.196 7.993 ( -2.866 0.000 -2.286) 3.666 8.093 ( -6.109 0.000 6.452) 8.885 8.175 ( -4.339 0.000 6.935) 8.181 8.362 ( -4.665 0.000 -1.218) 4.821 8.456 ( 4.846 0.000 -4.427) 6.564 8.503 ( 1.091 0.000 -4.990) 5.108 8.528 ( -1.295 0.000 2.011) 2.392 8.764 ( 7.494 0.000 0.370) 7.503 9.018 ( 0.651 0.000 -5.936) 5.972 9.158 ( -13.287 0.000 -19.428) 23.537 9.204 ( -17.874 0.000 -18.248) 25.544 9.304 ( 17.671 0.000 -17.629) 24.961 9.634 ( 6.574 0.000 -5.020) 8.271 9.811 ( 2.633 0.000 -14.180) 14.423 9.851 ( -14.162 0.000 4.879) 14.979 9.889 ( -13.164 0.000 9.726) 16.367 9.932 ( 13.377 0.000 3.056) 13.722 10.287 ( 9.565 0.000 7.267) 12.012 10.366 ( -10.798 0.000 10.509) 15.067 10.407 ( -3.128 0.000 -19.385) 19.636 10.540 ( 0.952 0.000 2.103) 2.308 10.626 ( 3.639 0.000 2.812) 4.599 10.714 ( -12.784 0.000 6.347) 14.273 10.922 ( -6.572 0.000 -6.350) 9.139 11.099 ( 3.634 0.000 -6.870) 7.772 11.255 ( 3.077 0.000 -6.385) 7.088 11.299 ( 1.845 0.000 1.272) 2.241 11.352 ( -4.536 0.000 -0.917) 4.628 11.423 ( 2.345 0.000 11.588) 11.823 11.561 ( -1.237 0.000 17.705) 17.748 11.675 ( 4.805 0.000 3.010) 5.670 11.873 ( 14.113 0.000 11.179) 18.004 11.904 ( -8.352 0.000 -8.200) 11.705 12.076 ( 2.403 0.000 23.241) 23.365 12.096 ( -2.104 0.000 -1.018) 2.337 12.136 ( 7.919 0.000 1.005) 7.982 12.194 ( -9.851 0.000 -1.509) 9.966 12.214 ( -5.406 0.000 -2.332) 5.888 12.233 ( 5.393 0.000 2.723) 6.042 12.252 ( 5.852 0.000 2.650) 6.425 12.403 ( -8.355 0.000 12.626) 15.140 12.548 ( -4.757 0.000 -4.136) 6.303 12.598 ( 7.920 0.000 -0.441) 7.933 12.692 ( -12.560 0.000 1.524) 12.652 12.708 ( 5.840 0.000 -6.585) 8.802 12.851 ( -5.524 0.000 -3.387) 6.480 12.939 ( 2.110 0.000 -6.436) 6.773 13.094 ( 14.376 0.000 4.236) 14.987 13.237 ( 2.327 0.000 -5.763) 6.215 13.298 ( -9.922 0.000 -8.872) 13.310 13.353 ( 3.369 0.000 5.580) 6.518 13.447 ( 5.650 0.000 2.252) 6.082 13.470 ( 1.801 0.000 -1.083) 2.102 13.679 ( 4.563 0.000 0.554) 4.597 13.778 ( -1.214 0.000 -4.303) 4.471 13.944 ( 7.420 0.000 -3.644) 8.266 14.145 ( 12.464 0.000 7.040) 14.315 14.246 ( 9.525 0.000 7.645) 12.213 14.299 ( -1.251 0.000 10.810) 10.882 14.595 ( -11.636 0.000 3.411) 12.126 14.859 ( 2.861 0.000 10.899) 11.268 14.911 ( -4.571 0.000 -0.878) 4.654 14.980 ( 4.101 0.000 -3.273) 5.247 15.121 ( 3.869 0.000 -12.993) 13.557 15.292 ( -3.787 0.000 -9.585) 10.306 15.463 ( -8.314 0.000 -13.221) 15.618 15.511 ( -11.864 0.000 1.374) 11.943 15.767 ( 6.035 0.000 -0.025) 6.035 15.845 ( 2.589 0.000 1.135) 2.827 15.861 ( 0.496 0.000 -2.402) 2.453 16.117 ( -16.019 0.000 -7.513) 17.693 16.340 ( -9.565 0.000 -5.974) 11.277 16.669 ( -1.008 0.000 4.014) 4.138 16.729 ( -0.782 0.000 -7.210) 7.252 16.941 ( -3.431 0.000 -9.639) 10.231 17.389 ( -14.375 0.000 -10.468) 17.783 17.395 ( 7.055 0.000 21.608) 22.731 17.522 ( 11.860 0.000 6.362) 13.458 17.636 ( 10.098 0.000 9.509) 13.871 17.819 ( 4.828 0.000 11.176) 12.174 17.898 ( -6.527 0.000 2.871) 7.131 17.914 ( -7.481 0.000 0.397) 7.491 18.113 ( -0.286 0.000 1.618) 1.643 18.154 ( 3.748 0.000 2.199) 4.346 18.211 ( -3.026 0.000 -7.793) 8.360 18.280 ( 5.926 0.000 -4.748) 7.593 18.351 ( 2.286 0.000 -3.794) 4.430 18.476 ( -0.224 0.000 -6.037) 6.041 18.571 ( 2.129 0.000 -7.473) 7.770 18.591 ( 1.196 0.000 -5.931) 6.050 18.792 ( 1.389 0.000 0.122) 1.394 18.819 ( -0.677 0.000 2.593) 2.680 18.986 ( 4.784 0.000 -2.387) 5.346 19.056 ( 1.807 0.000 -11.044) 11.191 19.430 ( 4.809 0.000 4.664) 6.700 19.502 ( 5.774 0.000 5.070) 7.684 19.558 ( 11.225 0.000 6.842) 13.146 19.740 ( 14.449 0.000 6.603) 15.886 19.977 ( 4.219 0.000 4.378) 6.080 20.032 ( 6.082 0.000 5.811) 8.412 20.375 ( -9.632 0.000 -1.685) 9.778 20.483 ( -9.882 0.000 -1.277) 9.964 20.505 ( -18.256 0.000 12.436) 22.089 20.710 ( 3.610 0.000 -7.996) 8.773 20.805 ( 7.280 0.000 2.257) 7.621 20.861 ( -15.206 0.000 -6.671) 16.605 20.911 ( 0.087 0.000 -2.133) 2.135 21.032 ( -1.661 0.000 4.581) 4.873 21.077 ( 3.067 0.000 -8.838) 9.355 21.179 ( -7.672 0.000 -2.363) 8.028 21.357 ( 6.165 0.000 6.025) 8.620 21.381 ( -19.748 0.000 7.288) 21.050 22.077 ( -13.881 0.000 1.600) 13.973 22.105 ( 6.025 0.000 -0.130) 6.026 22.378 ( -5.578 0.000 15.966) 16.913 22.424 ( -4.410 0.000 9.824) 10.768 22.741 ( 8.885 0.000 -3.991) 9.740 22.756 ( 10.534 0.000 1.984) 10.719 22.939 ( -3.690 0.000 -1.732) 4.076 23.018 ( 3.404 0.000 1.137) 3.589 23.225 ( -6.502 0.000 -7.730) 10.101 23.249 ( -0.014 0.000 -1.296) 1.296 23.285 ( -5.039 0.000 16.416) 17.172 23.640 ( -3.183 0.000 -0.371) 3.204 23.700 ( -3.155 0.000 -3.402) 4.640 23.714 ( -5.771 0.000 1.316) 5.919 23.854 ( -1.894 0.000 3.515) 3.993 24.072 ( -11.762 0.000 0.286) 11.766 24.086 ( -5.891 0.000 0.264) 5.897 24.184 ( -10.929 0.000 -8.599) 13.906 24.279 ( 7.635 0.000 7.408) 10.638 24.464 ( 1.023 0.000 2.529) 2.728 24.679 ( 7.529 0.000 4.615) 8.831 25.026 ( 7.607 0.000 0.893) 7.659 25.161 ( -16.716 0.000 -10.114) 19.538 25.465 ( -6.588 0.000 -19.956) 21.016 25.521 ( 18.909 0.000 10.341) 21.552 25.643 ( 14.517 0.000 5.644) 15.576 25.680 ( -1.053 0.000 0.104) 1.058 26.146 ( 11.132 0.000 4.560) 12.030 26.195 ( 13.346 0.000 -13.028) 18.651 26.373 ( -8.989 0.000 19.956) 21.887 26.519 ( 2.890 0.000 -0.276) 2.903 26.583 ( 19.252 0.000 -4.545) 19.782 26.908 ( 25.316 0.000 -37.643) 45.365 27.282 ( -6.081 0.000 -20.164) 21.061 27.613 ( -2.933 0.000 14.079) 14.381 28.021 ( 2.493 0.000 -4.111) 4.808 28.202 ( 3.626 0.000 -9.959) 10.599 28.345 ( -4.609 0.000 3.165) 5.591 28.398 ( -30.651 0.000 4.402) 30.965 28.511 ( -6.991 0.000 -8.142) 10.732 28.832 ( -2.094 0.000 9.114) 9.351 28.953 ( 21.357 0.000 -6.453) 22.311 28.984 ( -4.148 0.000 -4.231) 5.925 29.064 ( 16.944 0.000 -2.835) 17.180 29.223 ( 10.230 0.000 0.122) 10.231 29.417 ( 1.591 0.000 -9.169) 9.306 29.754 ( -1.772 0.000 -0.593) 1.868 29.915 ( -10.219 0.000 -6.482) 12.102 30.069 ( 7.771 0.000 -0.593) 7.793 30.278 ( -2.793 0.000 -2.276) 3.603 30.560 ( 3.375 0.000 13.542) 13.957 30.662 ( -6.321 0.000 1.393) 6.473 30.774 ( -9.155 0.000 -2.794) 9.572 30.809 ( -6.966 0.000 1.926) 7.227 31.011 ( 2.496 0.000 1.116) 2.734 31.109 ( 4.856 0.000 -7.108) 8.608 31.211 ( 8.911 0.000 7.626) 11.729 31.338 ( 12.852 0.000 6.683) 14.486 31.631 ( -2.803 0.000 -6.900) 7.448 31.875 ( -0.828 0.000 -7.698) 7.742 32.017 ( -1.966 0.000 8.928) 9.141 32.086 ( -1.813 0.000 4.570) 4.916 32.146 ( -3.981 0.000 6.544) 7.660 32.159 ( -1.902 0.000 6.037) 6.330 32.524 ( 1.023 0.000 -5.954) 6.041 32.664 ( 2.920 0.000 -10.095) 10.509 32.867 ( 2.848 0.000 0.847) 2.971 32.979 ( 0.426 0.000 -3.096) 3.125 33.102 ( 1.384 0.000 6.199) 6.351 33.151 ( 0.011 0.000 4.488) 4.488 33.496 ( -7.230 0.000 8.014) 10.793 33.629 ( -6.470 0.000 -1.503) 6.642 33.706 ( -0.290 0.000 0.405) 0.498 33.708 ( -0.915 0.000 0.624) 1.107 34.603 ( -5.262 0.000 4.851) 7.156 34.650 ( -4.008 0.000 0.341) 4.023 ======================= Grid point 57 (21/54) ======================= q-point: (-0.50 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 36 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.678 ( -11.233 0.000 23.883) 26.393 1.678 ( 11.233 0.000 23.883) 26.393 1.756 ( -0.434 0.000 13.334) 13.341 1.756 ( 0.434 0.000 13.334) 13.341 2.425 ( -1.459 0.000 -12.643) 12.727 2.425 ( 1.459 0.000 -12.643) 12.727 2.606 ( -10.818 0.000 -8.614) 13.828 2.606 ( 10.818 0.000 -8.614) 13.828 2.804 ( -0.553 0.000 -3.635) 3.677 2.804 ( 0.553 0.000 -3.635) 3.677 3.015 ( -31.529 0.000 6.075) 32.109 3.015 ( 31.529 0.000 6.075) 32.109 3.195 ( -8.494 0.000 5.601) 10.174 3.195 ( 8.494 0.000 5.601) 10.174 3.261 ( -0.037 0.000 1.046) 1.047 3.261 ( 0.037 0.000 1.046) 1.047 3.314 ( -5.627 0.000 5.129) 7.613 3.314 ( 5.627 0.000 5.129) 7.613 3.400 ( -1.933 0.000 -1.107) 2.228 3.400 ( 1.933 0.000 -1.107) 2.228 3.642 ( -0.086 0.000 3.807) 3.808 3.642 ( 0.086 0.000 3.807) 3.808 3.772 ( -0.493 0.000 -9.326) 9.339 3.772 ( 0.493 0.000 -9.326) 9.339 4.096 ( -3.216 0.000 -12.095) 12.515 4.096 ( 3.216 0.000 -12.095) 12.515 4.367 ( -0.783 0.000 2.737) 2.847 4.367 ( 0.783 0.000 2.737) 2.847 4.781 ( -2.406 0.000 3.014) 3.857 4.781 ( 2.406 0.000 3.014) 3.857 4.899 ( -0.117 0.000 0.398) 0.415 4.899 ( 0.117 0.000 0.398) 0.415 5.466 ( -5.389 0.000 0.863) 5.457 5.466 ( 5.389 0.000 0.863) 5.457 5.742 ( -9.994 0.000 -0.357) 10.000 5.742 ( 9.994 0.000 -0.357) 10.000 6.538 ( -5.240 0.000 10.199) 11.466 6.538 ( 5.240 0.000 10.199) 11.466 6.666 ( -3.947 0.000 2.104) 4.472 6.666 ( 3.947 0.000 2.104) 4.472 6.789 ( -2.762 0.000 6.919) 7.450 6.789 ( 2.762 0.000 6.919) 7.450 7.061 ( -7.332 0.000 -2.019) 7.605 7.061 ( 7.332 0.000 -2.019) 7.605 7.198 ( -2.663 0.000 -7.245) 7.719 7.198 ( 2.663 0.000 -7.245) 7.719 7.515 ( -4.889 0.000 -3.746) 6.159 7.515 ( 4.889 0.000 -3.746) 6.159 7.762 ( -12.629 0.000 6.699) 14.295 7.762 ( 12.629 0.000 6.699) 14.295 7.873 ( -1.562 0.000 1.605) 2.239 7.873 ( 1.562 0.000 1.605) 2.239 7.981 ( -2.299 0.000 3.341) 4.056 7.981 ( 2.299 0.000 3.341) 4.056 8.207 ( -5.323 0.000 -0.589) 5.355 8.207 ( 5.323 0.000 -0.589) 5.355 8.517 ( -0.028 0.000 -7.055) 7.055 8.517 ( 0.028 0.000 -7.055) 7.055 8.669 ( -16.160 0.000 -16.186) 22.873 8.669 ( 16.160 0.000 -16.186) 22.873 8.899 ( -7.734 0.000 4.957) 9.186 8.899 ( 7.734 0.000 4.957) 9.186 9.362 ( -12.063 0.000 -10.146) 15.763 9.362 ( 12.063 0.000 -10.146) 15.763 9.660 ( -0.978 0.000 4.256) 4.367 9.660 ( 0.978 0.000 4.256) 4.367 9.853 ( -0.000 0.000 -9.584) 9.584 9.853 ( 0.000 0.000 -9.584) 9.584 10.179 ( -0.018 0.000 -2.740) 2.740 10.179 ( 0.018 0.000 -2.740) 2.740 10.270 ( -14.889 0.000 -0.876) 14.915 10.270 ( 14.889 0.000 -0.876) 14.915 10.661 ( -3.740 0.000 7.578) 8.450 10.661 ( 3.740 0.000 7.578) 8.450 10.727 ( -9.026 0.000 0.011) 9.026 10.727 ( 9.026 0.000 0.011) 9.026 11.237 ( -7.238 0.000 -6.369) 9.641 11.237 ( 7.238 0.000 -6.369) 9.641 11.315 ( -0.703 0.000 -0.761) 1.036 11.315 ( 0.703 0.000 -0.761) 1.036 11.455 ( -5.487 0.000 6.084) 8.193 11.455 ( 5.487 0.000 6.084) 8.193 11.779 ( -3.092 0.000 -7.430) 8.048 11.779 ( 3.092 0.000 -7.430) 8.048 12.016 ( -2.376 0.000 10.120) 10.395 12.016 ( 2.376 0.000 10.120) 10.395 12.089 ( -0.006 0.000 0.926) 0.926 12.089 ( 0.006 0.000 0.926) 0.926 12.244 ( -1.497 0.000 14.351) 14.429 12.244 ( 1.497 0.000 14.351) 14.429 12.334 ( -8.339 0.000 0.774) 8.375 12.334 ( 8.339 0.000 0.774) 8.375 12.405 ( -7.604 0.000 4.986) 9.093 12.405 ( 7.604 0.000 4.986) 9.093 12.587 ( -8.720 0.000 2.815) 9.163 12.587 ( 8.720 0.000 2.815) 9.163 12.790 ( -5.047 0.000 -8.122) 9.562 12.790 ( 5.047 0.000 -8.122) 9.562 13.053 ( -10.497 0.000 -7.780) 13.066 13.053 ( 10.497 0.000 -7.780) 13.066 13.327 ( -0.965 0.000 1.619) 1.885 13.327 ( 0.965 0.000 1.619) 1.885 13.372 ( -1.830 0.000 1.106) 2.139 13.372 ( 1.830 0.000 1.106) 2.139 13.565 ( -5.063 0.000 3.389) 6.092 13.565 ( 5.063 0.000 3.389) 6.092 13.937 ( -5.493 0.000 -1.958) 5.831 13.937 ( 5.493 0.000 -1.958) 5.831 14.341 ( -5.043 0.000 5.524) 7.480 14.341 ( 5.043 0.000 5.524) 7.480 14.376 ( -1.221 0.000 7.306) 7.407 14.376 ( 1.221 0.000 7.306) 7.407 14.854 ( -0.001 0.000 5.576) 5.576 14.854 ( 0.001 0.000 5.576) 5.576 15.157 ( -8.299 0.000 -10.963) 13.751 15.157 ( 8.299 0.000 -10.963) 13.751 15.268 ( -9.925 0.000 -10.139) 14.189 15.268 ( 9.925 0.000 -10.139) 14.189 15.583 ( -18.555 0.000 0.223) 18.556 15.583 ( 18.555 0.000 0.223) 18.556 15.894 ( -0.389 0.000 0.351) 0.524 15.894 ( 0.389 0.000 0.351) 0.524 16.038 ( -12.542 0.000 5.398) 13.654 16.038 ( 12.542 0.000 5.398) 13.654 16.726 ( -4.166 0.000 -17.456) 17.946 16.726 ( 4.166 0.000 -17.456) 17.946 17.069 ( -14.246 0.000 -12.564) 18.995 17.069 ( 14.246 0.000 -12.564) 18.995 17.601 ( -7.303 0.000 16.252) 17.818 17.601 ( 7.303 0.000 16.252) 17.818 17.711 ( -1.951 0.000 7.414) 7.667 17.711 ( 1.951 0.000 7.414) 7.667 17.890 ( -0.009 0.000 6.754) 6.754 17.890 ( 0.009 0.000 6.754) 6.754 18.104 ( -2.106 0.000 -6.227) 6.573 18.104 ( 2.106 0.000 -6.227) 6.573 18.299 ( -3.861 0.000 1.568) 4.167 18.299 ( 3.861 0.000 1.568) 4.167 18.415 ( -3.154 0.000 -7.059) 7.732 18.415 ( 3.154 0.000 -7.059) 7.732 18.603 ( -0.578 0.000 -4.222) 4.261 18.603 ( 0.578 0.000 -4.222) 4.261 18.807 ( -0.335 0.000 3.437) 3.454 18.807 ( 0.335 0.000 3.437) 3.454 19.059 ( -1.191 0.000 -6.534) 6.642 19.059 ( 1.191 0.000 -6.534) 6.642 19.524 ( -3.313 0.000 11.914) 12.366 19.524 ( 3.313 0.000 11.914) 12.366 19.803 ( -8.979 0.000 5.377) 10.465 19.803 ( 8.979 0.000 5.377) 10.465 20.123 ( -6.521 0.000 -2.540) 6.999 20.123 ( 6.521 0.000 -2.540) 6.999 20.281 ( -4.143 0.000 12.438) 13.110 20.281 ( 4.143 0.000 12.438) 13.110 20.486 ( -16.393 0.000 -10.526) 19.481 20.486 ( 16.393 0.000 -10.526) 19.481 20.832 ( -7.177 0.000 -5.985) 9.345 20.832 ( 7.177 0.000 -5.985) 9.345 21.013 ( -4.048 0.000 3.181) 5.149 21.013 ( 4.048 0.000 3.181) 5.149 21.053 ( -12.953 0.000 1.422) 13.031 21.053 ( 12.953 0.000 1.422) 13.031 21.274 ( -9.444 0.000 -4.786) 10.588 21.274 ( 9.444 0.000 -4.786) 10.588 22.006 ( -5.002 0.000 16.236) 16.989 22.006 ( 5.002 0.000 16.236) 16.989 22.445 ( -0.001 0.000 -0.241) 0.241 22.445 ( 0.001 0.000 -0.241) 0.241 22.773 ( -0.811 0.000 -2.804) 2.919 22.773 ( 0.811 0.000 -2.804) 2.919 23.076 ( -6.822 0.000 -2.049) 7.123 23.076 ( 6.822 0.000 -2.049) 7.123 23.087 ( -2.071 0.000 6.736) 7.047 23.087 ( 2.071 0.000 6.736) 7.047 23.511 ( -11.332 0.000 -0.575) 11.346 23.511 ( 11.332 0.000 -0.575) 11.346 23.648 ( -1.035 0.000 1.081) 1.497 23.648 ( 1.035 0.000 1.081) 1.497 23.872 ( -5.300 0.000 1.210) 5.436 23.872 ( 5.300 0.000 1.210) 5.436 24.061 ( -2.564 0.000 -7.288) 7.726 24.061 ( 2.564 0.000 -7.288) 7.726 24.409 ( -5.082 0.000 7.143) 8.766 24.409 ( 5.082 0.000 7.143) 8.766 24.873 ( -12.302 0.000 -4.697) 13.168 24.873 ( 12.302 0.000 -4.697) 13.168 25.260 ( -12.901 0.000 -10.482) 16.622 25.260 ( 12.901 0.000 -10.482) 16.622 25.674 ( -0.525 0.000 -0.122) 0.539 25.674 ( 0.525 0.000 -0.122) 0.539 26.024 ( -19.748 0.000 15.184) 24.911 26.024 ( 19.748 0.000 15.184) 24.911 26.337 ( -1.255 0.000 4.058) 4.247 26.337 ( 1.255 0.000 4.058) 4.247 26.757 ( -21.704 0.000 2.152) 21.810 26.757 ( 21.704 0.000 2.152) 21.810 27.050 ( -19.076 0.000 -22.788) 29.719 27.050 ( 19.076 0.000 -22.788) 29.719 27.758 ( -19.439 0.000 5.550) 20.216 27.758 ( 19.439 0.000 5.550) 20.216 28.188 ( -4.896 0.000 -0.618) 4.935 28.188 ( 4.896 0.000 -0.618) 4.935 28.401 ( -2.246 0.000 -14.356) 14.530 28.401 ( 2.246 0.000 -14.356) 14.530 28.875 ( -4.692 0.000 3.684) 5.965 28.875 ( 4.692 0.000 3.684) 5.965 29.274 ( -3.540 0.000 -6.114) 7.065 29.274 ( 3.540 0.000 -6.114) 7.065 29.380 ( -2.485 0.000 -9.938) 10.244 29.380 ( 2.485 0.000 -9.938) 10.244 29.693 ( -4.315 0.000 0.208) 4.320 29.693 ( 4.315 0.000 0.208) 4.320 30.229 ( -3.607 0.000 0.826) 3.701 30.229 ( 3.607 0.000 0.826) 3.701 30.603 ( -0.516 0.000 4.664) 4.692 30.603 ( 0.516 0.000 4.664) 4.692 30.690 ( -1.963 0.000 0.443) 2.012 30.690 ( 1.963 0.000 0.443) 2.012 31.092 ( -2.254 0.000 -2.245) 3.181 31.092 ( 2.254 0.000 -2.245) 3.181 31.417 ( -7.499 0.000 5.388) 9.234 31.417 ( 7.499 0.000 5.388) 9.234 31.682 ( -5.005 0.000 3.099) 5.887 31.682 ( 5.005 0.000 3.099) 5.887 32.044 ( -0.092 0.000 5.151) 5.152 32.044 ( 0.092 0.000 5.151) 5.152 32.128 ( -0.781 0.000 3.456) 3.543 32.128 ( 0.781 0.000 3.456) 3.543 32.628 ( -0.828 0.000 -11.944) 11.972 32.628 ( 0.828 0.000 -11.944) 11.972 32.945 ( -2.055 0.000 0.242) 2.069 32.945 ( 2.055 0.000 0.242) 2.069 33.130 ( -0.032 0.000 7.070) 7.070 33.130 ( 0.032 0.000 7.070) 7.070 33.491 ( -0.503 0.000 1.361) 1.451 33.491 ( 0.503 0.000 1.361) 1.451 33.702 ( -0.001 0.000 0.389) 0.389 33.702 ( 0.001 0.000 0.389) 0.389 34.581 ( -0.282 0.000 1.577) 1.602 34.581 ( 0.282 0.000 1.577) 1.602 ======================= Grid point 60 (22/54) ======================= q-point: ( 0.00 0.09 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.043 ( 0.000 17.797 32.434) 36.996 1.075 ( 0.000 26.671 24.598) 36.282 1.560 ( 0.000 12.483 56.613) 57.972 2.089 ( 0.000 9.658 -13.432) 16.544 2.136 ( 0.000 5.088 2.354) 5.606 2.375 ( 0.000 6.462 -8.778) 10.900 2.545 ( 0.000 1.278 -2.009) 2.381 2.696 ( 0.000 -2.456 -7.727) 8.108 2.778 ( 0.000 -1.238 -1.954) 2.313 2.898 ( 0.000 0.182 2.395) 2.402 2.967 ( 0.000 3.560 1.670) 3.933 3.068 ( 0.000 1.828 10.656) 10.811 3.110 ( 0.000 2.591 3.321) 4.213 3.154 ( 0.000 1.648 5.399) 5.645 3.294 ( 0.000 1.448 -3.224) 3.534 3.362 ( 0.000 -0.670 -4.557) 4.606 3.380 ( 0.000 -0.282 0.715) 0.769 3.454 ( 0.000 -1.919 -0.957) 2.145 3.499 ( 0.000 -2.949 -11.385) 11.760 3.537 ( 0.000 -2.259 0.189) 2.267 3.596 ( 0.000 -5.199 -7.080) 8.784 3.706 ( 0.000 3.690 -19.922) 20.261 3.734 ( 0.000 1.400 1.569) 2.103 3.928 ( 0.000 1.854 -3.226) 3.721 4.189 ( 0.000 -1.517 7.686) 7.834 4.336 ( 0.000 2.797 4.788) 5.546 4.457 ( 0.000 -1.092 0.451) 1.182 4.483 ( 0.000 -1.458 -5.715) 5.898 4.785 ( 0.000 -5.219 1.205) 5.356 4.869 ( 0.000 -3.017 -2.131) 3.693 4.953 ( 0.000 -1.930 4.176) 4.600 5.080 ( 0.000 -4.482 2.639) 5.201 5.112 ( 0.000 1.967 -2.521) 3.197 5.122 ( 0.000 -1.455 1.419) 2.033 5.784 ( 0.000 -0.441 2.303) 2.345 5.963 ( 0.000 -1.507 -4.523) 4.767 6.165 ( 0.000 -1.418 1.884) 2.358 6.331 ( 0.000 2.241 -4.180) 4.743 6.475 ( 0.000 -5.755 17.969) 18.868 6.668 ( 0.000 -1.402 16.285) 16.345 6.826 ( 0.000 -0.575 8.481) 8.500 6.828 ( 0.000 -7.441 3.723) 8.320 7.000 ( 0.000 -4.964 2.306) 5.474 7.089 ( 0.000 -8.942 5.759) 10.636 7.209 ( 0.000 -0.734 3.687) 3.759 7.326 ( 0.000 -1.421 0.163) 1.431 7.465 ( 0.000 0.771 5.105) 5.163 7.479 ( 0.000 -3.415 -21.315) 21.587 7.617 ( 0.000 10.848 3.463) 11.388 7.686 ( 0.000 1.636 -1.860) 2.477 7.731 ( 0.000 0.647 -0.299) 0.713 7.978 ( 0.000 7.524 -5.737) 9.461 8.022 ( 0.000 3.519 6.266) 7.186 8.152 ( 0.000 0.498 -12.012) 12.023 8.175 ( 0.000 3.035 2.595) 3.993 8.473 ( 0.000 -2.059 4.628) 5.066 8.537 ( 0.000 2.706 1.479) 3.083 8.629 ( 0.000 -0.169 -9.718) 9.720 8.630 ( 0.000 5.011 -0.037) 5.011 8.834 ( 0.000 11.625 -21.059) 24.055 8.868 ( 0.000 -0.983 -13.029) 13.066 9.079 ( 0.000 4.294 -7.462) 8.610 9.331 ( 0.000 0.322 -5.888) 5.897 9.509 ( 0.000 -1.866 -10.686) 10.848 9.589 ( 0.000 0.382 -26.024) 26.026 9.691 ( 0.000 -0.971 -14.196) 14.229 9.816 ( 0.000 -0.904 1.748) 1.968 9.869 ( 0.000 -0.151 0.872) 0.885 10.042 ( 0.000 -0.769 6.930) 6.973 10.341 ( 0.000 -0.486 5.121) 5.144 10.416 ( 0.000 3.241 -19.923) 20.185 10.483 ( 0.000 -0.121 13.666) 13.667 10.487 ( 0.000 -1.989 6.741) 7.029 10.571 ( 0.000 0.455 -6.524) 6.540 10.957 ( 0.000 0.466 -7.015) 7.030 11.020 ( 0.000 -6.162 -3.596) 7.134 11.067 ( 0.000 -3.009 -3.807) 4.852 11.213 ( 0.000 -1.387 -2.715) 3.049 11.262 ( 0.000 -0.911 10.002) 10.044 11.280 ( 0.000 -0.306 1.846) 1.871 11.373 ( 0.000 -3.834 -1.445) 4.097 11.467 ( 0.000 -6.746 18.766) 19.942 11.539 ( 0.000 -4.889 17.220) 17.900 11.758 ( 0.000 4.264 16.251) 16.801 12.003 ( 0.000 0.640 3.291) 3.352 12.055 ( 0.000 1.954 9.646) 9.842 12.085 ( 0.000 2.702 -4.765) 5.478 12.166 ( 0.000 3.631 5.965) 6.984 12.175 ( 0.000 -1.577 6.052) 6.254 12.199 ( 0.000 -0.792 -0.076) 0.796 12.245 ( 0.000 -0.014 0.110) 0.111 12.363 ( 0.000 -4.862 -0.182) 4.865 12.502 ( 0.000 5.429 -2.394) 5.933 12.518 ( 0.000 -2.830 -5.525) 6.207 12.559 ( 0.000 -2.407 -3.606) 4.335 12.720 ( 0.000 1.879 13.154) 13.287 12.735 ( 0.000 0.395 -8.188) 8.198 12.896 ( 0.000 -3.395 -4.998) 6.042 12.947 ( 0.000 1.052 2.302) 2.530 13.017 ( 0.000 1.207 -6.464) 6.576 13.263 ( 0.000 -1.005 -6.101) 6.183 13.296 ( 0.000 1.119 -11.087) 11.143 13.337 ( 0.000 -0.224 6.715) 6.718 13.351 ( 0.000 0.728 -3.241) 3.322 13.477 ( 0.000 1.431 -9.332) 9.441 13.494 ( 0.000 5.507 7.788) 9.538 13.825 ( 0.000 -4.845 -13.782) 14.609 13.830 ( 0.000 2.485 -4.418) 5.069 14.040 ( 0.000 -2.463 8.826) 9.164 14.158 ( 0.000 0.665 11.724) 11.743 14.326 ( 0.000 1.405 11.937) 12.019 14.679 ( 0.000 -5.044 0.315) 5.054 14.778 ( 0.000 0.139 16.861) 16.862 14.875 ( 0.000 -1.121 3.094) 3.291 15.112 ( 0.000 0.361 -19.681) 19.684 15.138 ( 0.000 9.259 -3.171) 9.787 15.361 ( 0.000 2.143 -10.467) 10.684 15.514 ( 0.000 -3.039 -16.519) 16.797 15.713 ( 0.000 2.239 9.437) 9.699 15.741 ( 0.000 1.558 -2.326) 2.800 15.801 ( 0.000 3.037 7.192) 7.807 15.993 ( 0.000 1.286 -3.842) 4.052 16.195 ( 0.000 0.038 -18.657) 18.657 16.317 ( 0.000 4.027 -20.551) 20.942 16.725 ( 0.000 -0.081 21.104) 21.105 17.036 ( 0.000 1.018 -1.910) 2.164 17.115 ( 0.000 -1.068 -8.078) 8.148 17.173 ( 0.000 0.141 16.798) 16.799 17.368 ( 0.000 1.518 6.783) 6.950 17.392 ( 0.000 -0.058 24.238) 24.238 17.529 ( 0.000 -0.693 -8.539) 8.567 17.829 ( 0.000 -1.096 20.820) 20.849 17.929 ( 0.000 -0.451 -9.018) 9.029 17.978 ( 0.000 0.667 -2.866) 2.942 18.034 ( 0.000 -0.187 1.556) 1.567 18.112 ( 0.000 -0.793 1.563) 1.752 18.165 ( 0.000 0.465 -4.504) 4.528 18.280 ( 0.000 -0.405 -1.250) 1.314 18.407 ( 0.000 3.227 0.461) 3.259 18.419 ( 0.000 0.219 -2.797) 2.806 18.532 ( 0.000 -0.070 -11.857) 11.858 18.602 ( 0.000 0.312 -8.524) 8.529 18.760 ( 0.000 -0.905 0.610) 1.091 18.820 ( 0.000 -0.336 2.585) 2.607 18.934 ( 0.000 0.669 -2.079) 2.184 19.030 ( 0.000 -0.027 -11.447) 11.447 19.364 ( 0.000 -0.738 2.347) 2.461 19.420 ( 0.000 1.524 4.109) 4.382 19.460 ( 0.000 -0.509 5.334) 5.358 19.573 ( 0.000 2.191 4.228) 4.762 19.939 ( 0.000 -0.685 10.614) 10.636 19.972 ( 0.000 0.157 10.295) 10.296 20.496 ( 0.000 -0.480 -0.964) 1.077 20.633 ( 0.000 0.563 -4.468) 4.503 20.635 ( 0.000 -5.214 0.107) 5.216 20.712 ( 0.000 -6.336 1.749) 6.573 20.760 ( 0.000 -0.779 2.117) 2.255 20.884 ( 0.000 -0.996 -1.960) 2.199 20.942 ( 0.000 -0.143 -11.068) 11.068 21.033 ( 0.000 -0.178 -7.751) 7.753 21.084 ( 0.000 -3.185 11.107) 11.554 21.139 ( 0.000 0.422 11.986) 11.993 21.352 ( 0.000 0.025 0.252) 0.253 21.555 ( 0.000 -10.837 5.841) 12.311 21.911 ( 0.000 -6.048 2.304) 6.472 22.387 ( 0.000 -5.424 -12.074) 13.236 22.404 ( 0.000 0.424 6.051) 6.066 22.464 ( 0.000 0.758 0.293) 0.812 22.538 ( 0.000 -4.691 22.061) 22.554 22.586 ( 0.000 0.438 7.491) 7.504 22.943 ( 0.000 -0.333 2.981) 3.000 23.052 ( 0.000 1.082 -2.928) 3.121 23.092 ( 0.000 -2.062 -5.810) 6.165 23.295 ( 0.000 -0.523 -9.856) 9.870 23.665 ( 0.000 0.040 -7.066) 7.066 23.673 ( 0.000 -7.247 10.619) 12.856 23.706 ( 0.000 -12.258 16.050) 20.196 23.768 ( 0.000 -1.213 -7.189) 7.290 23.851 ( 0.000 -7.874 10.812) 13.375 24.019 ( 0.000 -0.045 6.391) 6.391 24.201 ( 0.000 0.108 -3.497) 3.499 24.364 ( 0.000 -9.065 6.782) 11.321 24.418 ( 0.000 -1.180 10.615) 10.681 24.489 ( 0.000 -13.959 17.115) 22.086 24.506 ( 0.000 -0.170 0.701) 0.721 24.543 ( 0.000 -0.140 -1.275) 1.283 25.021 ( 0.000 0.282 19.404) 19.406 25.212 ( 0.000 -2.149 1.535) 2.641 25.350 ( 0.000 -8.999 1.217) 9.081 25.442 ( 0.000 -0.551 -7.762) 7.781 25.636 ( 0.000 -1.230 -16.171) 16.218 25.740 ( 0.000 -0.248 3.042) 3.052 25.951 ( 0.000 -0.140 -22.195) 22.195 26.009 ( 0.000 -5.565 -6.903) 8.867 26.451 ( 0.000 -0.088 3.380) 3.382 26.483 ( 0.000 -0.382 21.825) 21.828 26.501 ( 0.000 0.055 -0.239) 0.245 27.361 ( 0.000 0.206 -19.441) 19.442 27.589 ( 0.000 -0.342 11.931) 11.936 27.978 ( 0.000 -0.174 -4.898) 4.901 28.128 ( 0.000 -16.844 22.339) 27.978 28.288 ( 0.000 -4.645 8.220) 9.442 28.440 ( 0.000 -1.101 2.223) 2.480 28.609 ( 0.000 -1.500 -4.301) 4.555 28.668 ( 0.000 -15.232 0.012) 15.232 28.797 ( 0.000 -9.066 -10.991) 14.248 28.939 ( 0.000 -3.514 1.032) 3.662 28.979 ( 0.000 -3.916 -2.482) 4.637 29.030 ( 0.000 -0.362 9.954) 9.960 29.254 ( 0.000 -2.407 7.981) 8.336 29.698 ( 0.000 -9.053 -6.287) 11.022 29.718 ( 0.000 -0.434 -21.633) 21.638 29.944 ( 0.000 -7.748 8.253) 11.320 30.243 ( 0.000 -6.688 0.056) 6.688 30.502 ( 0.000 -1.074 13.607) 13.649 30.745 ( 0.000 -3.024 5.045) 5.881 30.817 ( 0.000 -0.818 -2.963) 3.074 30.840 ( 0.000 -4.443 0.071) 4.443 30.902 ( 0.000 -1.242 5.487) 5.626 31.014 ( 0.000 -3.918 5.689) 6.908 31.115 ( 0.000 -3.145 0.080) 3.146 31.186 ( 0.000 2.873 -4.281) 5.156 31.433 ( 0.000 -19.796 3.379) 20.083 31.735 ( 0.000 -11.561 -2.932) 11.927 31.780 ( 0.000 -12.605 -0.325) 12.609 31.867 ( 0.000 -15.362 7.568) 17.125 31.896 ( 0.000 -3.477 -10.585) 11.142 32.192 ( 0.000 -7.494 11.869) 14.037 32.329 ( 0.000 -19.526 -9.895) 21.891 32.485 ( 0.000 13.030 15.133) 19.970 32.666 ( 0.000 -14.221 -8.756) 16.701 32.965 ( 0.000 23.520 -6.752) 24.470 33.001 ( 0.000 -5.903 9.561) 11.237 33.248 ( 0.000 -1.076 5.619) 5.721 33.449 ( 0.000 8.426 -7.343) 11.176 33.584 ( 0.000 -0.259 -6.789) 6.793 33.858 ( 0.000 6.710 8.888) 11.136 34.241 ( 0.000 11.284 -7.762) 13.696 34.959 ( 0.000 27.785 24.728) 37.196 37.228 ( 0.000 70.026 -101.453) 123.274 ======================= Grid point 61 (23/54) ======================= q-point: ( 0.25 0.09 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 88 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.270 ( 21.372 16.468 19.193) 33.111 1.370 ( 22.027 12.217 26.314) 36.426 1.983 ( 19.297 5.311 20.711) 28.802 2.113 ( 0.127 9.089 9.784) 13.355 2.188 ( 12.426 3.909 10.003) 16.424 2.366 ( -7.428 5.428 -7.496) 11.867 2.418 ( 6.719 8.027 -13.003) 16.693 2.691 ( 0.672 -1.505 -5.499) 5.741 2.818 ( 1.375 -0.096 2.594) 2.937 2.861 ( -4.438 1.680 -2.447) 5.339 2.983 ( -8.027 4.049 -3.134) 9.521 3.061 ( 4.687 2.471 3.476) 6.336 3.146 ( 2.735 1.387 -0.076) 3.068 3.211 ( 6.466 0.852 4.917) 8.168 3.232 ( -0.045 0.787 0.969) 1.249 3.315 ( -3.640 1.995 2.312) 4.751 3.395 ( -2.843 -2.136 -1.342) 3.801 3.437 ( -3.069 -4.154 -7.807) 9.361 3.457 ( -2.610 1.838 -0.756) 3.280 3.490 ( -4.657 -1.994 -1.332) 5.238 3.568 ( -1.613 -2.925 -4.226) 5.387 3.712 ( -0.520 3.122 1.502) 3.504 3.814 ( 5.410 -0.073 -13.901) 14.917 3.877 ( -6.009 3.250 -2.128) 7.156 4.148 ( -3.158 -0.312 -0.664) 3.242 4.245 ( -20.756 0.475 -2.115) 20.869 4.340 ( -1.397 1.206 2.428) 3.050 4.408 ( -2.318 -0.686 1.434) 2.810 4.657 ( 1.886 -3.996 2.750) 5.204 4.751 ( -2.300 -4.774 -0.965) 5.387 4.973 ( -7.817 -4.772 2.775) 9.570 5.001 ( -8.439 -3.239 1.879) 9.233 5.276 ( 10.658 -0.040 0.519) 10.671 5.361 ( 17.601 -0.163 -3.269) 17.903 5.696 ( -6.463 -0.490 3.993) 7.613 5.897 ( -5.917 -1.124 -4.429) 7.476 6.345 ( 11.522 -1.314 2.802) 11.930 6.431 ( 7.391 -0.113 0.450) 7.406 6.527 ( 6.798 -2.122 6.232) 9.463 6.624 ( -0.785 -3.840 15.267) 15.762 6.868 ( 0.263 -2.340 5.484) 5.968 6.941 ( 1.118 -2.058 7.556) 7.911 6.980 ( -4.056 -0.463 6.914) 8.029 7.117 ( 1.933 -7.756 -1.044) 8.061 7.169 ( -4.518 -2.847 -2.859) 6.057 7.248 ( 3.135 -4.376 4.599) 7.080 7.439 ( -3.358 0.068 -4.533) 5.642 7.500 ( 0.122 -0.413 -10.957) 10.966 7.548 ( 7.725 5.411 -3.252) 9.976 7.768 ( 4.000 3.861 -2.415) 6.062 7.850 ( 7.263 7.664 1.740) 10.701 7.946 ( -0.231 4.604 4.208) 6.241 7.971 ( 1.745 0.927 3.372) 3.908 8.103 ( -5.798 3.989 3.323) 7.783 8.328 ( -10.357 -2.256 1.683) 10.733 8.341 ( -3.536 4.231 -11.187) 12.472 8.468 ( -4.118 2.390 -1.789) 5.087 8.544 ( 1.441 3.200 -3.394) 4.883 8.575 ( -2.089 4.184 -3.928) 6.107 8.800 ( 8.162 3.321 -1.804) 8.994 9.016 ( -0.401 -0.134 -5.813) 5.828 9.151 ( -15.305 -0.643 -19.241) 24.594 9.195 ( -17.142 -0.867 -16.869) 24.066 9.293 ( 14.373 -1.114 -15.784) 21.376 9.621 ( 5.471 -1.168 -4.784) 7.360 9.799 ( 0.362 -0.469 -9.537) 9.555 9.854 ( -10.387 0.177 2.988) 10.810 9.912 ( -4.033 0.476 8.440) 9.367 9.924 ( 3.436 -0.731 3.639) 5.058 10.248 ( 6.579 -3.462 5.106) 9.019 10.348 ( -8.501 -1.447 9.166) 12.585 10.432 ( -6.773 0.695 -18.339) 19.562 10.517 ( -1.777 -2.398 1.706) 3.438 10.616 ( 2.111 -1.375 2.060) 3.254 10.673 ( -8.419 -2.844 6.495) 11.007 10.903 ( -6.870 -1.808 -6.265) 9.473 11.077 ( 3.326 -2.169 -7.147) 8.176 11.244 ( 1.775 -1.276 -6.881) 7.220 11.284 ( -1.055 -2.839 2.322) 3.816 11.317 ( -1.820 -2.515 0.043) 3.105 11.418 ( 2.672 -0.188 8.862) 9.258 11.515 ( 2.202 -3.596 14.138) 14.753 11.649 ( 5.209 -3.230 3.313) 6.967 11.851 ( 3.764 -0.673 7.281) 8.224 11.951 ( -0.844 3.211 -1.380) 3.595 12.053 ( -1.050 -3.390 11.030) 11.587 12.093 ( -1.582 -0.041 10.855) 10.969 12.135 ( -0.283 -1.920 -1.282) 2.326 12.210 ( 0.881 4.874 0.714) 5.005 12.233 ( -3.620 3.194 0.059) 4.828 12.262 ( 6.239 2.397 3.273) 7.442 12.318 ( 3.632 1.999 3.323) 5.313 12.414 ( -5.095 0.508 4.106) 6.563 12.512 ( 0.607 -1.729 -2.079) 2.771 12.587 ( 3.278 -1.285 -0.118) 3.523 12.670 ( -10.929 -0.722 3.262) 11.428 12.740 ( 3.559 1.784 -7.635) 8.611 12.891 ( -5.553 3.166 -3.622) 7.347 12.922 ( 4.521 -1.154 -6.058) 7.647 13.085 ( 9.625 -1.084 2.556) 10.017 13.217 ( 2.688 -0.863 -2.263) 3.618 13.309 ( -10.651 1.361 -4.293) 11.564 13.383 ( 2.363 -1.150 -0.716) 2.724 13.442 ( 8.960 1.999 1.618) 9.322 13.467 ( 0.019 -0.869 -1.811) 2.009 13.714 ( 9.346 2.285 5.216) 10.944 13.747 ( -4.223 -1.121 -6.672) 7.976 13.949 ( 5.608 0.266 -1.176) 5.736 14.110 ( 11.575 -2.683 7.995) 14.321 14.274 ( 9.966 1.631 5.671) 11.582 14.291 ( -1.330 -0.619 9.885) 9.994 14.626 ( -8.349 2.692 1.225) 8.858 14.811 ( 4.197 -2.444 5.180) 7.100 14.914 ( 2.319 -0.643 3.808) 4.505 15.044 ( -2.067 3.644 -8.072) 9.095 15.143 ( 0.976 3.325 -7.787) 8.523 15.308 ( -4.617 0.674 -9.425) 10.516 15.438 ( -7.271 -2.261 -14.643) 16.504 15.525 ( -11.854 1.928 3.759) 12.584 15.780 ( 4.630 1.072 1.328) 4.935 15.863 ( 0.404 1.692 1.428) 2.251 15.894 ( 2.570 2.933 -2.223) 4.489 16.140 ( -16.885 2.080 -5.526) 17.887 16.348 ( -9.667 0.723 -5.682) 11.236 16.674 ( -0.448 0.464 1.541) 1.671 16.730 ( -1.156 0.101 -6.501) 6.604 16.954 ( -3.280 1.307 -9.425) 10.065 17.355 ( -7.732 -2.203 -4.058) 9.006 17.412 ( 1.031 0.549 13.944) 13.993 17.528 ( 11.883 0.566 5.906) 13.282 17.646 ( 8.914 0.990 8.540) 12.385 17.822 ( 4.201 0.260 9.852) 10.713 17.900 ( -6.543 0.090 6.166) 8.991 17.928 ( -6.196 1.325 -2.244) 6.722 18.102 ( -0.732 -0.994 0.448) 1.313 18.156 ( 4.927 0.170 2.502) 5.529 18.203 ( 0.576 -1.282 -7.205) 7.341 18.265 ( 6.721 -1.500 -3.010) 7.515 18.361 ( -1.283 1.717 -1.159) 2.436 18.479 ( -0.315 0.306 -5.338) 5.356 18.566 ( 1.989 -0.310 -7.434) 7.702 18.601 ( 1.206 0.821 -5.215) 5.415 18.775 ( 0.986 -1.264 0.093) 1.606 18.811 ( -1.169 -0.834 2.969) 3.298 18.982 ( 4.199 -0.319 -1.812) 4.584 19.064 ( 2.549 0.679 -9.955) 10.299 19.424 ( 4.880 -0.539 5.224) 7.169 19.500 ( 4.021 -0.317 6.464) 7.619 19.563 ( 12.010 0.550 6.404) 13.622 19.750 ( 13.643 1.015 6.418) 15.111 19.979 ( 4.969 0.224 4.562) 6.750 20.037 ( 6.447 0.419 5.779) 8.668 20.365 ( -10.341 -1.345 -0.755) 10.455 20.461 ( -13.576 -3.478 12.081) 18.503 20.489 ( -10.107 0.638 -0.985) 10.175 20.696 ( 3.431 -1.249 -7.652) 8.478 20.807 ( 6.678 0.111 1.807) 6.919 20.850 ( -13.305 -0.829 -4.411) 14.042 20.903 ( -2.009 -1.045 -2.848) 3.639 21.014 ( -0.059 -1.714 4.571) 4.883 21.065 ( 1.462 -1.205 -7.845) 8.070 21.163 ( -7.338 -1.508 -1.585) 7.657 21.320 ( -4.638 -3.336 5.963) 8.258 21.364 ( -4.422 -0.856 5.414) 7.042 22.062 ( -9.689 -1.289 0.729) 9.801 22.104 ( 2.571 -0.272 -0.407) 2.617 22.320 ( -2.213 -4.362 15.416) 16.174 22.413 ( -3.834 -1.081 9.950) 10.717 22.721 ( 8.482 -1.782 -3.739) 9.439 22.761 ( 10.607 0.547 1.730) 10.761 22.940 ( -4.101 0.245 -2.044) 4.589 23.016 ( 3.193 -0.259 0.619) 3.263 23.212 ( -4.201 -3.024 1.369) 5.354 23.218 ( -2.808 -0.839 -6.861) 7.461 23.273 ( -0.994 -1.017 13.691) 13.765 23.647 ( -3.434 0.679 0.027) 3.501 23.697 ( -5.736 -1.441 0.770) 5.964 23.700 ( -2.877 -0.095 -4.023) 4.947 23.839 ( -0.865 -1.100 2.501) 2.866 24.048 ( -5.936 -2.485 0.534) 6.458 24.067 ( -10.586 -1.072 -0.115) 10.641 24.178 ( -10.449 -0.520 -10.090) 14.535 24.284 ( 7.635 0.547 7.430) 10.667 24.476 ( 1.312 1.173 2.327) 2.917 24.687 ( 7.484 0.773 5.317) 9.213 25.015 ( 7.361 -1.106 0.168) 7.445 25.165 ( -16.018 0.491 -9.896) 18.835 25.414 ( 1.155 -6.761 -18.535) 19.764 25.500 ( 18.177 -2.131 11.512) 21.621 25.624 ( 18.726 -2.015 5.276) 19.559 25.680 ( -1.018 -0.096 1.006) 1.434 25.947 ( 26.623 -19.604 -0.913) 33.075 26.182 ( 16.933 -4.464 -11.686) 21.053 26.325 ( 10.633 -15.395 7.718) 20.240 26.428 ( 19.771 -11.144 1.474) 22.743 26.513 ( 1.813 -0.468 -0.018) 1.873 26.617 ( 20.497 -3.286 -11.804) 23.880 27.298 ( -7.435 0.007 -20.279) 21.599 27.556 ( -13.866 -6.822 13.891) 20.779 27.829 ( 1.689 -18.491 16.927) 25.126 28.016 ( 1.347 -0.825 -4.898) 5.147 28.291 ( -21.741 -8.671 -0.051) 23.407 28.340 ( -11.010 -2.953 2.334) 11.636 28.484 ( -6.797 -2.492 -5.090) 8.850 28.671 ( 11.584 -10.296 7.370) 17.161 28.811 ( -2.186 -2.183 9.147) 9.654 28.840 ( 0.849 -18.004 1.546) 18.090 29.013 ( 6.683 -2.402 -6.651) 9.730 29.207 ( 9.650 -1.240 -1.365) 9.824 29.344 ( 1.897 -5.783 -2.932) 6.756 29.676 ( -5.679 -5.482 -2.832) 8.385 29.769 ( 1.890 -7.083 -5.285) 9.037 30.042 ( 8.945 -2.643 -1.995) 9.538 30.136 ( -5.560 -7.353 3.803) 9.972 30.540 ( 3.110 -1.820 13.303) 13.783 30.652 ( -4.872 -0.473 0.357) 4.908 30.751 ( -7.327 -2.305 -1.363) 7.801 30.787 ( -4.598 -0.903 0.915) 4.775 30.952 ( 1.559 -5.050 1.395) 5.466 31.041 ( 6.038 -4.906 0.722) 7.813 31.146 ( 3.908 -3.226 3.962) 6.433 31.345 ( 10.415 -0.176 2.321) 10.671 31.414 ( -2.898 -17.549 4.664) 18.388 31.727 ( -2.181 -11.996 7.549) 14.340 31.791 ( 2.166 -15.007 -1.750) 15.263 31.844 ( -1.657 -19.545 -0.484) 19.621 31.932 ( 2.141 1.599 -8.331) 8.749 32.201 ( 1.751 -6.916 8.753) 11.293 32.256 ( -5.316 -10.717 -7.012) 13.866 32.435 ( -4.888 -4.422 5.811) 8.787 32.687 ( 0.548 -9.258 -5.961) 11.025 32.843 ( -5.878 6.456 -5.042) 10.082 33.049 ( 3.371 -0.935 10.201) 10.784 33.257 ( 0.503 -0.863 7.120) 7.190 33.574 ( 3.645 1.808 -6.663) 7.807 33.643 ( 7.250 11.796 -13.355) 19.237 33.911 ( 5.049 11.416 11.332) 16.859 34.327 ( 8.820 23.329 -0.634) 24.948 34.910 ( -0.739 26.952 14.074) 30.415 36.398 ( -63.357 76.725 -54.418) 113.412 ======================= Grid point 62 (24/54) ======================= q-point: (-0.50 0.09 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.675 ( -0.000 3.387 22.018) 22.277 1.731 ( -0.000 3.832 7.888) 8.769 1.799 ( 0.000 8.364 19.477) 21.197 1.944 ( 0.000 11.981 16.973) 20.775 2.383 ( 0.000 2.235 -12.232) 12.435 2.564 ( 0.000 5.892 -14.438) 15.595 2.653 ( -0.000 2.969 -10.419) 10.834 2.655 ( 0.000 7.690 -5.769) 9.613 2.777 ( -0.000 -0.621 -7.155) 7.182 2.838 ( 0.000 0.329 1.462) 1.499 3.020 ( -0.000 1.787 6.392) 6.637 3.069 ( 0.000 5.024 5.037) 7.114 3.203 ( -0.000 0.570 5.200) 5.231 3.207 ( 0.000 1.931 6.402) 6.687 3.272 ( 0.000 1.437 1.200) 1.872 3.285 ( 0.000 0.048 0.600) 0.601 3.328 ( 0.000 3.329 2.060) 3.915 3.353 ( -0.000 1.496 0.727) 1.664 3.386 ( -0.000 -0.391 -0.097) 0.403 3.418 ( 0.000 1.632 0.544) 1.720 3.614 ( -0.000 -7.321 -8.108) 10.924 3.617 ( 0.000 0.078 2.792) 2.793 3.731 ( 0.000 5.643 6.924) 8.932 3.868 ( 0.000 2.862 -7.170) 7.720 4.068 ( 0.000 -2.062 -7.265) 7.552 4.105 ( 0.000 0.302 -11.529) 11.533 4.335 ( 0.000 -1.315 2.094) 2.473 4.390 ( 0.000 0.371 1.999) 2.033 4.714 ( 0.000 -5.509 2.706) 6.138 4.747 ( 0.000 -4.098 2.918) 5.031 4.863 ( 0.000 -3.388 0.247) 3.397 4.878 ( 0.000 -2.451 0.110) 2.454 5.411 ( 0.000 -2.681 -0.282) 2.696 5.499 ( 0.000 0.782 -0.235) 0.816 5.715 ( 0.000 -1.794 -0.071) 1.796 5.757 ( -0.000 0.148 -0.269) 0.307 6.501 ( 0.000 -1.711 9.094) 9.253 6.563 ( -0.000 -3.331 3.008) 4.489 6.590 ( 0.000 -5.618 1.495) 5.814 6.618 ( -0.000 0.122 9.047) 9.048 6.797 ( 0.000 -0.292 11.313) 11.317 6.830 ( 0.000 1.191 9.606) 9.680 7.037 ( 0.000 -0.864 -8.075) 8.122 7.063 ( 0.000 -2.009 -10.341) 10.534 7.121 ( 0.000 0.713 -0.948) 1.186 7.301 ( 0.000 1.626 -1.141) 1.986 7.506 ( -0.000 -1.542 0.387) 1.590 7.535 ( 0.000 1.527 -0.911) 1.778 7.746 ( 0.000 1.948 5.796) 6.114 7.782 ( -0.000 -1.179 0.899) 1.483 7.903 ( 0.000 -0.914 4.825) 4.911 7.930 ( 0.000 5.545 -2.555) 6.105 8.031 ( 0.000 7.473 -5.630) 9.356 8.042 ( -0.000 4.056 2.708) 4.877 8.208 ( 0.000 0.364 0.904) 0.974 8.215 ( -0.000 1.934 -0.877) 2.123 8.481 ( 0.000 -1.456 -7.653) 7.791 8.568 ( 0.000 2.704 -5.584) 6.204 8.657 ( -0.000 -1.978 -8.020) 8.261 8.682 ( 0.000 1.551 -15.544) 15.621 8.879 ( 0.000 0.078 -0.627) 0.631 8.914 ( -0.000 -0.164 5.948) 5.950 9.295 ( -0.000 -3.182 -12.045) 12.458 9.411 ( 0.000 1.275 -8.375) 8.471 9.614 ( 0.000 -1.999 7.087) 7.363 9.652 ( 0.000 -1.875 -2.883) 3.439 9.866 ( 0.000 2.067 -0.476) 2.121 9.911 ( 0.000 3.004 -12.589) 12.942 10.082 ( 0.000 -6.086 -6.390) 8.824 10.180 ( -0.000 -3.284 -0.031) 3.284 10.212 ( -0.000 -1.885 -0.856) 2.070 10.277 ( 0.000 -1.779 -2.455) 3.032 10.634 ( -0.000 -2.191 6.481) 6.841 10.656 ( 0.000 -1.052 8.511) 8.576 10.694 ( 0.000 -2.348 -0.284) 2.365 10.730 ( -0.000 -0.427 -0.066) 0.432 11.175 ( 0.000 -4.759 -4.852) 6.797 11.200 ( -0.000 -3.917 -7.677) 8.619 11.269 ( 0.000 -3.465 -0.221) 3.472 11.316 ( 0.000 -0.364 -0.911) 0.981 11.465 ( 0.000 0.270 2.636) 2.649 11.474 ( -0.000 0.806 9.924) 9.957 11.715 ( 0.000 -3.517 -7.114) 7.936 11.793 ( -0.000 -0.954 -5.446) 5.529 12.011 ( -0.000 2.006 6.141) 6.460 12.012 ( 0.000 -4.139 2.916) 5.063 12.092 ( -0.000 3.386 11.706) 12.186 12.120 ( 0.000 0.575 -1.095) 1.237 12.143 ( 0.000 -3.569 19.682) 20.003 12.334 ( -0.000 0.248 3.059) 3.069 12.343 ( 0.000 1.664 -0.977) 1.929 12.377 ( 0.000 4.458 8.600) 9.687 12.430 ( -0.000 3.375 3.675) 4.990 12.435 ( 0.000 1.682 6.181) 6.406 12.566 ( 0.000 1.277 0.057) 1.278 12.666 ( 0.000 4.057 3.549) 5.390 12.743 ( 0.000 -2.228 -9.125) 9.393 12.811 ( 0.000 0.111 -8.807) 8.808 13.046 ( 0.000 0.430 -8.599) 8.610 13.081 ( -0.000 1.447 -5.859) 6.034 13.195 ( 0.000 -6.547 3.277) 7.321 13.340 ( 0.000 -1.407 3.040) 3.350 13.362 ( -0.000 -0.336 -0.627) 0.711 13.410 ( 0.000 -0.155 0.285) 0.324 13.581 ( 0.000 4.337 2.910) 5.223 13.647 ( 0.000 4.907 1.715) 5.198 13.869 ( -0.000 -2.365 1.995) 3.094 13.980 ( 0.000 0.177 -1.351) 1.363 14.240 ( 0.000 -4.672 8.084) 9.337 14.289 ( 0.000 -4.518 8.744) 9.842 14.454 ( 0.000 5.667 2.209) 6.082 14.476 ( -0.000 5.444 3.143) 6.286 14.825 ( 0.000 0.855 2.197) 2.358 14.955 ( 0.000 4.689 2.011) 5.102 15.087 ( 0.000 -2.126 -6.075) 6.437 15.200 ( -0.000 0.033 -8.323) 8.323 15.252 ( 0.000 -1.075 -11.567) 11.617 15.288 ( 0.000 1.810 -9.355) 9.529 15.527 ( 0.000 -2.287 0.806) 2.425 15.640 ( -0.000 2.434 3.140) 3.973 15.902 ( 0.000 1.741 1.863) 2.550 15.942 ( -0.000 2.774 1.434) 3.123 15.999 ( 0.000 -0.794 3.180) 3.278 16.086 ( -0.000 2.157 4.448) 4.943 16.727 ( 0.000 0.302 -17.781) 17.783 16.735 ( -0.000 0.614 -17.238) 17.249 17.070 ( -0.000 0.194 -10.987) 10.988 17.073 ( 0.000 0.311 -14.103) 14.107 17.537 ( -0.000 -2.632 15.770) 15.988 17.662 ( 0.000 2.361 12.550) 12.770 17.708 ( 0.000 -0.016 7.150) 7.150 17.726 ( 0.000 1.197 8.907) 8.987 17.888 ( 0.000 0.180 5.689) 5.692 17.902 ( 0.000 0.870 6.008) 6.070 18.064 ( 0.000 -2.074 -6.641) 6.957 18.136 ( 0.000 1.145 -3.945) 4.108 18.315 ( 0.000 1.016 0.950) 1.391 18.316 ( -0.000 1.977 0.209) 1.988 18.398 ( -0.000 -1.232 -7.134) 7.239 18.417 ( 0.000 0.169 -2.672) 2.677 18.593 ( -0.000 -0.426 -4.759) 4.778 18.613 ( 0.000 0.458 -3.516) 3.545 18.785 ( 0.000 -2.323 6.129) 6.555 18.791 ( 0.000 -1.131 1.735) 2.071 19.039 ( 0.000 -0.727 -5.400) 5.449 19.092 ( 0.000 1.699 -6.245) 6.472 19.512 ( -0.000 -1.186 12.566) 12.622 19.513 ( 0.000 -0.779 11.821) 11.847 19.806 ( 0.000 0.453 5.398) 5.417 19.810 ( -0.000 0.494 5.228) 5.252 20.116 ( -0.000 0.443 -3.161) 3.192 20.157 ( 0.000 2.153 -2.499) 3.299 20.248 ( -0.000 -2.067 10.420) 10.623 20.289 ( 0.000 -0.198 12.409) 12.411 20.472 ( 0.000 -0.726 -9.586) 9.613 20.497 ( -0.000 0.345 -10.409) 10.415 20.786 ( -0.000 -2.913 -4.707) 5.535 20.836 ( 0.000 -1.089 -6.134) 6.230 20.996 ( 0.000 -1.198 3.499) 3.698 21.009 ( 0.000 -0.778 3.885) 3.962 21.027 ( 0.000 -1.237 1.098) 1.654 21.080 ( 0.000 1.445 0.829) 1.666 21.252 ( -0.000 -1.627 -5.089) 5.342 21.265 ( 0.000 -1.378 -4.618) 4.820 21.966 ( 0.000 -2.240 15.400) 15.562 22.022 ( -0.000 0.102 14.979) 14.979 22.421 ( 0.000 -1.314 -0.142) 1.322 22.458 ( 0.000 0.334 0.111) 0.352 22.750 ( 0.000 -1.747 -3.295) 3.730 22.759 ( 0.000 -1.339 -3.169) 3.440 23.063 ( -0.000 -0.627 -1.807) 1.913 23.071 ( 0.000 -0.912 3.967) 4.071 23.089 ( 0.000 0.630 -0.774) 0.998 23.096 ( -0.000 0.385 6.891) 6.902 23.484 ( -0.000 -1.975 -0.546) 2.049 23.501 ( 0.000 -1.608 2.328) 2.829 23.645 ( 0.000 -0.075 0.152) 0.169 23.651 ( -0.000 0.430 -0.786) 0.896 23.853 ( -0.000 -1.382 0.483) 1.463 23.867 ( 0.000 -0.773 1.399) 1.599 24.045 ( -0.000 -1.096 -6.903) 6.989 24.055 ( 0.000 -0.689 -8.280) 8.308 24.407 ( -0.000 0.554 7.531) 7.551 24.432 ( 0.000 1.694 6.735) 6.944 24.880 ( -0.000 0.864 -4.126) 4.216 24.881 ( 0.000 0.731 -4.389) 4.450 25.233 ( 0.000 -1.935 -10.369) 10.549 25.261 ( -0.000 -0.693 -11.276) 11.297 25.658 ( 0.000 -1.041 1.160) 1.558 25.680 ( -0.000 -0.087 0.295) 0.308 25.998 ( 0.000 -2.412 16.507) 16.683 26.025 ( -0.000 -0.293 14.898) 14.901 26.270 ( -0.000 -5.156 0.519) 5.182 26.338 ( 0.000 -1.656 5.477) 5.722 26.672 ( 0.000 -7.184 -2.718) 7.681 26.701 ( -0.000 -4.928 0.919) 5.013 27.020 ( -0.000 -2.673 -22.399) 22.558 27.059 ( 0.000 -0.261 -21.438) 21.440 27.540 ( -0.000 -20.242 0.141) 20.243 27.711 ( 0.000 -12.853 -5.395) 13.940 28.013 ( 0.000 -20.802 -0.883) 20.821 28.178 ( 0.000 -0.782 -2.360) 2.486 28.233 ( -0.000 -2.293 1.785) 2.906 28.375 ( 0.000 -10.783 -5.572) 12.138 28.742 ( -0.000 -11.670 8.546) 14.464 28.754 ( 0.000 -20.490 9.030) 22.391 28.961 ( -0.000 -6.964 8.152) 10.721 29.071 ( 0.000 -11.910 4.109) 12.599 29.345 ( 0.000 -2.579 -12.401) 12.666 29.363 ( -0.000 -1.774 -11.963) 12.094 29.628 ( 0.000 -5.171 0.408) 5.187 29.642 ( -0.000 -4.781 0.899) 4.865 30.122 ( 0.000 -5.121 2.012) 5.502 30.167 ( 0.000 -4.786 3.109) 5.707 30.585 ( 0.000 -0.940 4.428) 4.527 30.605 ( -0.000 -0.545 5.350) 5.377 30.663 ( 0.000 -1.408 -0.279) 1.435 30.709 ( 0.000 0.389 0.213) 0.443 30.986 ( 0.000 -6.675 -2.028) 6.976 31.076 ( 0.000 -6.157 -3.536) 7.100 31.292 ( -0.000 -8.135 6.898) 10.666 31.298 ( 0.000 -10.662 10.056) 14.656 31.485 ( 0.000 -3.402 5.031) 6.073 31.682 ( 0.000 -8.577 12.416) 15.091 31.813 ( -0.000 -22.596 -1.552) 22.649 31.826 ( 0.000 -17.450 -0.909) 17.473 31.955 ( 0.000 3.873 -9.565) 10.319 32.187 ( 0.000 -9.741 -7.400) 12.233 32.271 ( 0.000 -3.634 5.825) 6.866 32.336 ( -0.000 -13.257 1.464) 13.337 32.679 ( 0.000 -8.679 -4.107) 9.601 32.800 ( 0.000 -3.642 -5.959) 6.984 33.091 ( 0.000 1.487 9.222) 9.341 33.260 ( 0.000 -1.004 8.945) 9.001 33.603 ( 0.000 1.119 -6.189) 6.290 33.716 ( 0.000 9.546 -16.786) 19.311 33.989 ( 0.000 18.866 15.367) 24.333 34.426 ( 0.000 28.688 13.269) 31.608 35.157 ( 0.000 50.393 -19.226) 53.936 35.433 ( -0.000 53.879 -13.122) 55.454 ======================= Grid point 65 (25/54) ======================= q-point: ( 0.00 0.18 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.456 ( 0.000 21.965 22.296) 31.299 1.616 ( 0.000 24.203 20.814) 31.922 1.930 ( 0.000 24.752 30.399) 39.202 2.269 ( 0.000 7.338 -3.945) 8.331 2.310 ( 0.000 9.124 -3.653) 9.829 2.528 ( 0.000 7.801 -0.442) 7.814 2.588 ( 0.000 5.729 -5.849) 8.187 2.697 ( 0.000 3.212 -8.901) 9.463 2.776 ( 0.000 2.399 -1.736) 2.961 2.919 ( 0.000 1.757 0.470) 1.819 3.051 ( 0.000 4.647 -3.021) 5.543 3.116 ( 0.000 1.466 6.439) 6.604 3.160 ( 0.000 1.547 1.176) 1.943 3.202 ( 0.000 4.063 4.854) 6.330 3.313 ( 0.000 -0.756 -4.643) 4.704 3.313 ( 0.000 -3.382 -9.299) 9.895 3.346 ( 0.000 -4.019 -1.011) 4.144 3.411 ( 0.000 0.633 0.342) 0.720 3.506 ( 0.000 -0.386 0.126) 0.406 3.509 ( 0.000 4.016 -2.232) 4.595 3.535 ( 0.000 -1.144 -1.674) 2.028 3.737 ( 0.000 -1.554 6.562) 6.743 3.775 ( 0.000 3.124 -12.355) 12.744 3.954 ( 0.000 0.860 -3.298) 3.408 4.137 ( 0.000 -3.431 6.859) 7.670 4.399 ( 0.000 2.295 1.981) 3.032 4.421 ( 0.000 -2.437 0.866) 2.586 4.423 ( 0.000 -4.827 -5.206) 7.099 4.653 ( 0.000 -7.877 5.752) 9.753 4.757 ( 0.000 -7.112 0.056) 7.112 4.942 ( 0.000 1.105 3.931) 4.084 4.968 ( 0.000 -6.895 1.572) 7.072 5.091 ( 0.000 -1.571 -2.830) 3.237 5.147 ( 0.000 1.380 -4.207) 4.428 5.770 ( 0.000 -0.925 1.202) 1.516 5.924 ( 0.000 -2.465 -4.691) 5.299 6.130 ( 0.000 -2.038 6.157) 6.485 6.377 ( 0.000 2.045 -3.376) 3.947 6.399 ( 0.000 -2.828 14.662) 14.932 6.638 ( 0.000 -1.544 14.144) 14.228 6.659 ( 0.000 -9.161 4.751) 10.320 6.808 ( 0.000 -1.187 5.600) 5.725 6.837 ( 0.000 -10.783 -2.800) 11.141 6.951 ( 0.000 -4.720 14.637) 15.379 7.181 ( 0.000 -2.173 2.980) 3.688 7.268 ( 0.000 -5.421 -0.240) 5.426 7.389 ( 0.000 -3.922 -21.337) 21.694 7.489 ( 0.000 1.626 4.499) 4.784 7.713 ( 0.000 0.702 -2.047) 2.164 7.724 ( 0.000 0.502 0.343) 0.608 7.857 ( 0.000 9.032 3.622) 9.731 8.017 ( 0.000 0.270 6.618) 6.623 8.160 ( 0.000 5.882 -4.364) 7.324 8.166 ( 0.000 0.883 -11.636) 11.669 8.293 ( 0.000 7.399 -4.175) 8.496 8.411 ( 0.000 -2.234 7.839) 8.151 8.600 ( 0.000 2.508 0.891) 2.661 8.625 ( 0.000 -0.218 -9.802) 9.805 8.708 ( 0.000 3.617 4.126) 5.487 8.843 ( 0.000 -1.413 -13.511) 13.584 8.908 ( 0.000 -1.842 -19.245) 19.333 9.116 ( 0.000 -1.200 -8.541) 8.625 9.332 ( 0.000 -0.445 -4.389) 4.411 9.461 ( 0.000 -2.353 -8.456) 8.777 9.597 ( 0.000 0.303 -23.949) 23.951 9.668 ( 0.000 -1.159 -15.929) 15.971 9.795 ( 0.000 -0.978 1.185) 1.536 9.859 ( 0.000 -0.969 0.053) 0.970 10.016 ( 0.000 -1.823 9.397) 9.572 10.330 ( 0.000 -0.594 4.548) 4.587 10.399 ( 0.000 -5.666 -17.517) 18.411 10.420 ( 0.000 -2.689 9.907) 10.266 10.481 ( 0.000 -0.089 15.497) 15.497 10.577 ( 0.000 0.072 -7.000) 7.000 10.857 ( 0.000 -9.104 -2.913) 9.558 10.960 ( 0.000 -0.406 -1.873) 1.916 10.986 ( 0.000 -5.049 -4.063) 6.481 11.173 ( 0.000 -2.740 -4.336) 5.129 11.203 ( 0.000 -5.628 6.805) 8.831 11.270 ( 0.000 -1.144 0.227) 1.166 11.286 ( 0.000 -3.584 -1.366) 3.836 11.320 ( 0.000 -7.117 11.575) 13.588 11.463 ( 0.000 -1.878 12.178) 12.322 11.831 ( 0.000 2.579 20.417) 20.579 11.996 ( 0.000 -2.501 14.998) 15.205 12.084 ( 0.000 0.380 5.992) 6.004 12.126 ( 0.000 -0.056 6.351) 6.351 12.146 ( 0.000 0.622 -10.816) 10.833 12.162 ( 0.000 -1.052 4.087) 4.221 12.245 ( 0.000 0.526 0.714) 0.887 12.245 ( 0.000 -5.084 1.659) 5.348 12.249 ( 0.000 2.497 1.319) 2.824 12.439 ( 0.000 -3.200 -2.099) 3.827 12.548 ( 0.000 -0.940 -4.456) 4.554 12.626 ( 0.000 6.094 -5.917) 8.494 12.726 ( 0.000 -0.428 -6.563) 6.577 12.768 ( 0.000 3.113 14.240) 14.576 12.845 ( 0.000 -1.741 -3.630) 4.026 12.968 ( 0.000 0.792 2.610) 2.728 13.014 ( 0.000 -1.399 -6.196) 6.352 13.252 ( 0.000 -0.152 -3.335) 3.339 13.283 ( 0.000 -3.700 2.689) 4.574 13.314 ( 0.000 -1.160 -6.454) 6.558 13.367 ( 0.000 0.307 -4.555) 4.566 13.515 ( 0.000 2.458 -7.665) 8.050 13.602 ( 0.000 4.983 7.137) 8.704 13.715 ( 0.000 -5.399 -13.052) 14.125 13.893 ( 0.000 3.578 -1.193) 3.771 13.979 ( 0.000 -3.413 10.269) 10.821 14.172 ( 0.000 0.708 8.061) 8.092 14.357 ( 0.000 1.541 12.405) 12.500 14.587 ( 0.000 -3.539 -0.186) 3.544 14.789 ( 0.000 0.826 15.627) 15.649 14.882 ( 0.000 1.221 1.725) 2.113 15.126 ( 0.000 1.009 -20.311) 20.336 15.309 ( 0.000 7.222 -8.346) 11.037 15.366 ( 0.000 -1.623 -10.820) 10.942 15.455 ( 0.000 -2.327 -13.936) 14.129 15.758 ( 0.000 -0.059 0.146) 0.158 15.793 ( 0.000 5.361 9.798) 11.169 15.870 ( 0.000 3.295 7.799) 8.466 16.003 ( 0.000 -0.217 -0.641) 0.677 16.203 ( 0.000 0.834 -17.366) 17.386 16.407 ( 0.000 4.327 -18.042) 18.554 16.724 ( 0.000 0.055 18.314) 18.314 17.063 ( 0.000 1.500 -3.562) 3.865 17.097 ( 0.000 -0.527 -7.506) 7.524 17.176 ( 0.000 0.182 16.655) 16.656 17.377 ( 0.000 -1.312 -2.759) 3.055 17.395 ( 0.000 0.377 20.553) 20.556 17.542 ( 0.000 2.596 -0.290) 2.613 17.827 ( 0.000 0.954 21.200) 21.221 17.920 ( 0.000 -0.356 -9.243) 9.250 17.990 ( 0.000 0.420 1.331) 1.395 18.024 ( 0.000 -0.699 1.585) 1.733 18.098 ( 0.000 -0.620 1.144) 1.302 18.173 ( 0.000 0.146 -7.238) 7.240 18.269 ( 0.000 -0.707 -1.295) 1.475 18.426 ( 0.000 0.411 -2.710) 2.741 18.481 ( 0.000 3.859 -1.636) 4.192 18.532 ( 0.000 0.020 -11.194) 11.194 18.611 ( 0.000 0.570 -6.565) 6.590 18.748 ( 0.000 -0.273 0.267) 0.382 18.812 ( 0.000 -0.387 3.162) 3.186 18.950 ( 0.000 0.942 -2.886) 3.036 19.028 ( 0.000 -0.159 -10.218) 10.219 19.354 ( 0.000 -0.263 4.321) 4.329 19.449 ( 0.000 1.374 4.990) 5.175 19.451 ( 0.000 -0.411 7.161) 7.173 19.624 ( 0.000 2.667 2.507) 3.661 19.923 ( 0.000 -0.870 13.338) 13.367 19.975 ( 0.000 0.169 10.350) 10.351 20.404 ( 0.000 -7.234 15.124) 16.765 20.555 ( 0.000 -0.010 -1.467) 1.467 20.645 ( 0.000 -1.963 -6.293) 6.592 20.648 ( 0.000 1.002 -5.126) 5.223 20.745 ( 0.000 -1.128 -0.275) 1.161 20.859 ( 0.000 -1.539 -2.563) 2.989 20.938 ( 0.000 -0.186 -11.314) 11.315 20.997 ( 0.000 -4.327 11.017) 11.836 21.030 ( 0.000 -0.764 -6.249) 6.295 21.151 ( 0.000 0.718 11.593) 11.615 21.351 ( 0.000 -0.161 0.771) 0.788 21.409 ( 0.000 -3.276 6.672) 7.433 21.832 ( 0.000 -2.750 -7.228) 7.734 22.250 ( 0.000 -7.552 -12.324) 14.454 22.414 ( 0.000 0.509 6.723) 6.742 22.487 ( 0.000 1.494 0.426) 1.553 22.490 ( 0.000 -0.333 18.446) 18.449 22.602 ( 0.000 1.298 5.790) 5.933 22.938 ( 0.000 -0.095 3.492) 3.493 23.039 ( 0.000 -3.007 -5.219) 6.024 23.082 ( 0.000 1.896 -3.883) 4.321 23.286 ( 0.000 -0.530 -11.712) 11.724 23.340 ( 0.000 -9.250 31.540) 32.868 23.667 ( 0.000 0.192 -7.226) 7.228 23.707 ( 0.000 1.539 2.405) 2.855 23.741 ( 0.000 -1.241 -6.649) 6.764 23.861 ( 0.000 2.825 -3.103) 4.196 24.020 ( 0.000 0.123 6.433) 6.434 24.205 ( 0.000 0.286 -3.559) 3.570 24.258 ( 0.000 -1.152 9.075) 9.148 24.406 ( 0.000 -0.926 -3.158) 3.292 24.463 ( 0.000 0.916 3.665) 3.778 24.502 ( 0.000 -0.212 0.665) 0.698 24.540 ( 0.000 -0.187 -1.298) 1.312 25.029 ( 0.000 0.520 19.134) 19.141 25.145 ( 0.000 -8.819 -2.826) 9.261 25.164 ( 0.000 -3.648 4.941) 6.142 25.448 ( 0.000 0.808 -12.135) 12.162 25.634 ( 0.000 0.363 -17.134) 17.138 25.740 ( 0.000 0.143 2.460) 2.464 25.912 ( 0.000 -3.601 -6.665) 7.575 25.947 ( 0.000 -0.257 -21.774) 21.776 26.449 ( 0.000 -0.153 3.590) 3.593 26.475 ( 0.000 -0.514 21.460) 21.466 26.503 ( 0.000 0.084 -0.275) 0.287 27.340 ( 0.000 -1.948 -19.281) 19.379 27.578 ( 0.000 -0.818 11.274) 11.304 27.936 ( 0.000 -5.686 14.994) 16.036 27.970 ( 0.000 -0.850 -5.548) 5.613 28.166 ( 0.000 -6.949 5.629) 8.943 28.341 ( 0.000 -15.354 4.133) 15.900 28.373 ( 0.000 -8.257 -0.741) 8.290 28.527 ( 0.000 -5.743 -3.159) 6.554 28.643 ( 0.000 -3.589 -4.538) 5.786 28.832 ( 0.000 -7.520 -1.363) 7.642 28.868 ( 0.000 -6.504 -0.960) 6.575 29.020 ( 0.000 -0.582 10.128) 10.144 29.214 ( 0.000 -1.634 4.464) 4.754 29.612 ( 0.000 -2.313 -11.627) 11.855 29.707 ( 0.000 -0.689 -21.108) 21.119 29.765 ( 0.000 -9.010 8.559) 12.428 30.085 ( 0.000 -8.520 -1.815) 8.711 30.473 ( 0.000 -1.704 13.492) 13.599 30.719 ( 0.000 -0.795 0.892) 1.194 30.746 ( 0.000 -4.400 -0.114) 4.401 30.784 ( 0.000 -3.127 -3.114) 4.413 30.873 ( 0.000 -1.425 8.420) 8.540 30.896 ( 0.000 -9.265 0.961) 9.315 30.945 ( 0.000 -11.213 0.085) 11.213 31.149 ( 0.000 -6.061 9.525) 11.290 31.233 ( 0.000 1.783 -4.396) 4.743 31.517 ( 0.000 -10.030 2.199) 10.269 31.555 ( 0.000 -8.763 -4.503) 9.853 31.683 ( 0.000 -6.264 -1.298) 6.397 31.888 ( 0.000 -0.345 -14.984) 14.988 31.964 ( 0.000 -13.556 -8.508) 16.005 32.090 ( 0.000 -5.712 5.737) 8.096 32.413 ( 0.000 -10.936 -7.708) 13.379 32.676 ( 0.000 5.962 18.829) 19.750 32.870 ( 0.000 -6.665 13.430) 14.993 33.236 ( 0.000 -0.711 1.658) 1.804 33.314 ( 0.000 10.808 -9.723) 14.538 33.510 ( 0.000 0.628 -7.946) 7.971 33.632 ( 0.000 1.586 -12.142) 12.246 33.976 ( 0.000 4.679 12.170) 13.038 34.426 ( 0.000 5.946 -6.154) 8.557 35.392 ( 0.000 13.219 36.871) 39.169 37.641 ( 0.000 -10.324 -58.782) 59.681 ======================= Grid point 66 (26/54) ======================= q-point: ( 0.25 0.18 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 88 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.633 ( 14.642 16.754 16.449) 27.670 1.708 ( 7.874 21.803 14.219) 27.194 2.127 ( 3.526 8.653 11.961) 15.178 2.258 ( -4.371 5.835 8.921) 11.521 2.376 ( 16.838 13.289 2.253) 21.568 2.512 ( -1.374 7.881 -4.298) 9.081 2.628 ( 9.404 12.500 -7.094) 17.176 2.696 ( 0.596 2.613 -7.775) 8.224 2.841 ( 5.533 4.371 -3.187) 7.738 2.894 ( -3.364 0.703 2.517) 4.260 3.057 ( -7.878 3.292 -2.483) 8.891 3.129 ( 7.184 2.092 0.410) 7.493 3.185 ( -0.340 2.374 -1.816) 3.008 3.220 ( 0.059 -0.890 -1.293) 1.570 3.240 ( 6.712 1.661 2.810) 7.464 3.325 ( -3.797 -0.979 0.724) 3.987 3.365 ( -1.634 -0.574 0.136) 1.737 3.389 ( 0.750 0.623 -1.211) 1.555 3.463 ( -3.441 -0.091 0.681) 3.509 3.507 ( -2.404 2.271 -0.407) 3.332 3.529 ( -0.642 -0.167 -2.079) 2.182 3.754 ( 0.488 1.390 6.120) 6.294 3.822 ( 5.104 0.761 -12.126) 13.178 3.953 ( -1.674 3.353 -0.925) 3.860 4.138 ( -0.352 -1.314 2.749) 3.067 4.232 ( -19.316 -0.175 2.546) 19.484 4.375 ( -1.588 -3.112 0.182) 3.499 4.395 ( -6.856 3.442 -1.443) 7.806 4.548 ( -1.023 -6.350 1.378) 6.578 4.626 ( -0.917 -7.447 1.314) 7.617 4.856 ( -6.258 -6.210 2.203) 9.087 4.906 ( -7.051 -6.003 1.462) 9.375 5.278 ( 7.961 -0.205 -1.961) 8.201 5.349 ( 15.711 -1.216 -4.231) 16.316 5.677 ( -6.706 -1.407 3.432) 7.663 5.858 ( -5.898 -2.810 -4.005) 7.663 6.320 ( 11.956 -1.159 4.169) 12.715 6.397 ( 0.553 -3.694 0.279) 3.745 6.460 ( 6.147 -4.262 7.064) 10.289 6.564 ( 2.981 -2.005 12.113) 12.634 6.789 ( 3.551 -4.964 3.953) 7.272 6.897 ( -1.880 -3.499 15.295) 15.803 6.932 ( 8.870 -5.310 2.343) 10.600 6.995 ( 3.399 -2.609 2.795) 5.116 7.100 ( -1.540 -3.957 -2.098) 4.736 7.200 ( 0.915 -1.711 1.206) 2.285 7.417 ( -0.379 -2.015 -3.135) 3.746 7.463 ( 0.976 -1.411 -9.726) 9.876 7.619 ( 2.237 0.350 -3.894) 4.504 7.835 ( -4.231 3.352 2.756) 6.060 7.904 ( 6.624 0.792 7.396) 9.960 8.020 ( 5.332 2.110 2.053) 6.090 8.100 ( -4.675 5.448 -7.935) 10.700 8.203 ( 0.407 4.656 -0.657) 4.720 8.277 ( -8.635 -0.308 2.032) 8.876 8.376 ( 0.526 1.211 -13.089) 13.155 8.511 ( -7.599 1.433 2.999) 8.294 8.604 ( -3.502 1.768 -3.051) 4.970 8.639 ( -2.631 1.811 -6.792) 7.505 8.859 ( 7.682 1.708 -5.062) 9.357 9.016 ( -1.555 0.189 -4.945) 5.187 9.131 ( -15.136 -1.567 -15.366) 21.626 9.174 ( -16.562 -0.865 -16.715) 23.547 9.259 ( 8.392 -2.116 -12.020) 14.811 9.593 ( 3.815 -1.502 -3.729) 5.542 9.798 ( 0.408 -0.265 -6.418) 6.436 9.820 ( -7.232 -3.452 5.001) 9.446 9.900 ( 4.786 -0.561 2.038) 5.233 9.913 ( -7.888 -0.943 7.655) 11.032 10.165 ( 5.289 -4.659 1.303) 7.168 10.305 ( -9.812 -2.824 7.523) 12.682 10.406 ( -7.715 -3.019 -21.644) 23.175 10.449 ( -4.422 -3.988 6.158) 8.566 10.567 ( 0.733 -2.619 3.141) 4.155 10.641 ( -2.556 -0.872 3.614) 4.512 10.857 ( -7.196 -2.686 -6.081) 9.796 11.014 ( 2.664 -4.065 -7.019) 8.537 11.171 ( -1.947 -5.866 -2.839) 6.801 11.228 ( -2.196 -1.633 1.625) 3.182 11.270 ( 1.320 -2.609 0.421) 2.954 11.400 ( 2.942 -2.057 3.787) 5.218 11.452 ( 6.142 -2.147 11.456) 13.175 11.554 ( 8.052 -5.636 2.804) 10.221 11.845 ( -1.975 -0.444 8.289) 8.533 11.961 ( -2.924 -4.539 10.315) 11.642 12.014 ( 0.281 2.865 1.539) 3.264 12.088 ( -2.245 -0.713 12.239) 12.464 12.116 ( -1.656 -0.998 2.421) 3.098 12.262 ( -1.964 0.795 1.865) 2.823 12.301 ( 7.655 1.758 6.016) 9.894 12.337 ( 1.873 4.375 -1.444) 4.973 12.350 ( 5.767 2.628 -0.291) 6.344 12.374 ( 5.851 -2.473 -3.390) 7.201 12.496 ( -3.537 -2.317 0.499) 4.257 12.583 ( -1.246 1.947 -1.626) 2.826 12.675 ( -5.245 0.686 2.297) 5.767 12.757 ( 1.597 0.193 -6.467) 6.664 12.912 ( 2.895 0.606 -2.497) 3.871 12.956 ( -1.742 2.451 -3.995) 5.000 13.052 ( 2.236 -1.896 2.712) 3.994 13.213 ( 4.597 -0.194 -0.839) 4.677 13.287 ( -2.373 -3.383 0.920) 4.233 13.379 ( -5.314 1.229 -4.722) 7.214 13.415 ( -0.058 -3.322 -1.859) 3.807 13.494 ( 11.064 1.794 -1.793) 11.351 13.712 ( 5.798 -0.265 1.827) 6.085 13.802 ( 3.333 3.827 0.011) 5.075 13.943 ( 1.002 -1.124 7.390) 7.542 14.068 ( 10.320 -0.738 3.750) 11.005 14.263 ( -7.506 -1.465 10.587) 13.061 14.307 ( 15.781 0.969 0.322) 15.814 14.666 ( 1.259 0.461 -2.936) 3.228 14.801 ( 2.925 1.857 4.417) 5.614 14.904 ( 1.259 -0.187 3.934) 4.135 15.071 ( -0.136 0.021 -11.846) 11.846 15.247 ( -5.265 5.008 -4.398) 8.493 15.295 ( -5.546 -1.760 -7.433) 9.439 15.390 ( -6.014 -1.988 -12.333) 13.864 15.589 ( -11.694 3.986 3.127) 12.744 15.801 ( 2.408 0.882 2.657) 3.693 15.904 ( -0.498 2.169 2.819) 3.592 15.958 ( 3.547 3.015 -0.870) 4.736 16.183 ( -18.406 1.883 -0.613) 18.512 16.365 ( -9.091 0.887 -5.228) 10.524 16.688 ( 0.516 0.936 -3.590) 3.745 16.731 ( -2.424 -0.000 -4.790) 5.368 16.987 ( -2.880 1.846 -9.207) 9.822 17.305 ( -8.307 -2.774 -9.058) 12.600 17.422 ( 3.290 0.650 14.828) 15.202 17.542 ( 11.819 0.756 4.839) 12.793 17.674 ( 5.794 1.749 6.831) 9.126 17.828 ( 2.261 0.266 7.362) 7.706 17.904 ( -4.965 0.439 7.037) 8.624 17.957 ( -4.798 1.311 -2.901) 5.758 18.072 ( 0.041 -2.011 -2.687) 3.356 18.143 ( 6.956 -1.962 1.097) 7.311 18.176 ( 4.972 -0.154 0.987) 5.071 18.245 ( 1.807 -0.407 0.265) 1.872 18.413 ( -1.837 3.002 -2.729) 4.454 18.490 ( -0.367 0.833 -3.723) 3.832 18.564 ( 1.853 0.211 -6.481) 6.744 18.620 ( 0.863 1.041 -3.873) 4.102 18.752 ( -0.698 -1.025 0.303) 1.277 18.792 ( -1.908 -0.917 2.690) 3.424 18.979 ( 3.292 0.056 -1.125) 3.480 19.077 ( 3.674 0.539 -8.148) 8.954 19.412 ( 4.498 -0.617 6.704) 8.097 19.489 ( 2.189 -0.798 8.976) 9.273 19.580 ( 12.391 1.099 5.707) 13.687 19.776 ( 11.695 1.454 6.173) 13.304 19.988 ( 6.885 0.636 4.632) 8.323 20.047 ( 7.288 0.526 5.721) 9.280 20.310 ( -7.829 -3.381 7.322) 11.240 20.416 ( -9.584 -1.015 0.762) 9.667 20.507 ( -10.214 1.153 -1.056) 10.333 20.666 ( 2.612 -1.648 -7.241) 7.872 20.805 ( 3.660 -0.342 1.275) 3.891 20.835 ( -7.933 -1.044 -1.052) 8.070 20.862 ( -6.073 -2.413 -1.884) 6.801 20.981 ( 2.848 -1.114 2.172) 3.751 21.032 ( -1.053 -1.937 -6.006) 6.398 21.131 ( -6.840 -1.393 -1.821) 7.214 21.262 ( -1.442 -2.468 2.338) 3.692 21.346 ( -4.335 -0.901 2.327) 5.002 22.034 ( -3.803 -1.371 -1.296) 4.245 22.093 ( 0.424 -0.697 -1.358) 1.584 22.258 ( -1.233 -1.440 12.182) 12.329 22.383 ( -2.327 -1.802 10.400) 10.808 22.689 ( 6.945 -1.008 -3.405) 7.800 22.780 ( 10.657 1.341 1.195) 10.807 22.950 ( -4.232 0.610 -3.358) 5.437 23.009 ( 2.626 -0.367 -0.545) 2.707 23.146 ( -0.901 -2.828 3.816) 4.835 23.207 ( -1.626 -0.392 -2.813) 3.273 23.252 ( 0.030 -0.826 8.510) 8.550 23.648 ( -7.245 -1.176 1.401) 7.473 23.683 ( -2.901 0.681 -1.129) 3.187 23.697 ( -1.047 0.012 -5.237) 5.340 23.836 ( -1.514 1.170 0.760) 2.059 24.004 ( -3.771 -1.616 0.831) 4.186 24.041 ( -12.907 -1.500 -1.290) 13.058 24.169 ( -9.384 -0.346 -12.374) 15.534 24.302 ( 8.036 1.164 7.180) 10.839 24.508 ( 2.256 1.933 1.742) 3.444 24.710 ( 7.561 1.542 6.807) 10.290 24.984 ( 6.952 -1.945 -1.436) 7.360 25.150 ( 31.026 -12.950 -4.759) 33.955 25.185 ( -11.377 -0.149 -6.732) 13.221 25.445 ( 16.630 -3.177 12.562) 21.082 25.559 ( 27.647 -4.321 2.358) 28.081 25.647 ( 5.930 -3.280 -3.317) 7.545 25.705 ( 4.921 -1.357 -4.527) 6.822 25.958 ( 11.469 -8.904 -7.337) 16.268 26.218 ( 7.067 -0.690 -7.736) 10.500 26.392 ( -4.296 -0.540 16.719) 17.271 26.505 ( 0.598 -0.287 0.017) 0.663 26.592 ( 17.547 -0.862 -7.672) 19.171 27.270 ( -9.195 -2.786 -19.755) 21.968 27.372 ( -30.285 -9.540 10.307) 33.383 27.665 ( -0.045 -3.892 14.233) 14.756 27.927 ( -21.312 -12.079 -8.328) 25.874 28.084 ( -5.261 -5.755 -2.464) 8.178 28.251 ( -5.037 -7.841 7.796) 12.151 28.423 ( -14.081 -3.741 1.309) 14.628 28.484 ( 1.781 -11.015 5.473) 12.428 28.538 ( 3.654 -5.761 0.388) 6.833 28.756 ( 0.207 -3.416 9.174) 9.791 28.955 ( 7.742 -3.355 -6.036) 10.374 29.174 ( 8.700 -1.968 -1.402) 9.030 29.240 ( 0.631 -4.298 2.773) 5.154 29.576 ( -6.880 -4.559 -5.940) 10.168 29.669 ( 0.819 -4.179 -8.436) 9.449 29.969 ( 5.611 -4.505 -2.734) 7.698 30.015 ( 3.417 -4.645 0.090) 5.768 30.496 ( 2.464 -2.478 12.636) 13.111 30.637 ( -4.577 -1.232 -0.565) 4.774 30.702 ( -4.530 -2.504 -1.082) 5.288 30.759 ( -3.132 -2.052 0.605) 3.793 30.837 ( 0.060 -5.853 2.042) 6.199 30.916 ( 0.307 -8.327 -1.631) 8.491 31.070 ( 7.396 -4.627 5.830) 10.493 31.136 ( 0.183 -7.659 6.430) 10.002 31.333 ( 6.708 -1.396 -0.768) 6.894 31.480 ( -3.933 -12.741 -6.344) 14.767 31.555 ( 2.169 -7.117 3.882) 8.392 31.644 ( -3.507 -5.192 -0.723) 6.307 31.937 ( 2.867 -2.965 -11.833) 12.531 31.976 ( 1.188 -11.340 -10.833) 15.727 32.093 ( 0.992 -4.116 5.365) 6.834 32.321 ( -8.441 -7.997 -1.569) 11.733 32.607 ( -1.615 -2.551 6.909) 7.540 32.887 ( -11.830 -0.314 2.130) 12.024 33.059 ( -0.301 0.725 5.319) 5.377 33.245 ( -0.441 -0.769 4.523) 4.609 33.597 ( 3.627 1.337 -7.262) 8.226 33.787 ( 4.771 2.733 -19.169) 19.942 34.106 ( 12.431 7.238 17.821) 22.902 34.674 ( 18.440 9.056 5.654) 21.307 35.360 ( 4.604 15.155 18.321) 24.219 37.088 ( -49.595 2.997 -45.029) 67.054 ======================= Grid point 67 (27/54) ======================= q-point: (-0.50 0.18 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.806 ( -0.000 9.251 14.474) 17.178 1.902 ( -0.000 12.730 3.612) 13.232 2.004 ( 0.000 12.000 12.821) 17.560 2.195 ( 0.000 12.197 14.087) 18.634 2.507 ( 0.000 9.409 -6.460) 11.413 2.662 ( 0.000 -2.102 -17.208) 17.336 2.686 ( -0.000 7.047 -11.455) 13.449 2.811 ( -0.000 -0.463 2.630) 2.670 2.823 ( -0.000 5.648 -2.451) 6.156 2.865 ( 0.000 9.322 -6.016) 11.095 3.098 ( 0.000 5.082 5.241) 7.301 3.153 ( -0.000 1.799 0.097) 1.802 3.229 ( 0.000 2.345 4.813) 5.354 3.247 ( 0.000 1.228 2.658) 2.927 3.280 ( -0.000 0.496 -0.171) 0.525 3.300 ( 0.000 0.386 0.296) 0.486 3.360 ( -0.000 -0.059 0.601) 0.604 3.361 ( 0.000 0.118 0.449) 0.464 3.439 ( -0.000 4.626 0.779) 4.691 3.471 ( 0.000 3.477 0.359) 3.495 3.534 ( -0.000 0.864 0.854) 1.215 3.664 ( 0.000 5.353 2.721) 6.005 3.880 ( 0.000 8.875 5.654) 10.523 3.885 ( -0.000 -0.858 -0.846) 1.205 4.013 ( 0.000 -3.213 -1.626) 3.601 4.115 ( 0.000 0.754 -6.253) 6.298 4.330 ( 0.000 0.881 -0.611) 1.072 4.364 ( 0.000 -3.458 0.542) 3.501 4.579 ( 0.000 -7.561 2.428) 7.942 4.630 ( 0.000 -7.364 2.825) 7.887 4.772 ( 0.000 -5.245 -0.865) 5.316 4.808 ( 0.000 -4.330 -0.569) 4.368 5.365 ( 0.000 -1.991 -1.995) 2.818 5.496 ( 0.000 -1.069 -1.935) 2.211 5.662 ( 0.000 -3.697 0.699) 3.762 5.737 ( -0.000 -2.371 0.157) 2.376 6.437 ( 0.000 -5.643 3.790) 6.797 6.441 ( -0.000 -6.930 0.476) 6.946 6.502 ( 0.000 -2.037 2.076) 2.908 6.652 ( -0.000 1.326 8.170) 8.277 6.768 ( 0.000 -2.032 15.234) 15.369 6.799 ( -0.000 -3.808 15.014) 15.489 7.003 ( 0.000 -3.587 -9.967) 10.592 7.046 ( 0.000 1.241 -10.384) 10.458 7.161 ( 0.000 1.746 -0.001) 1.746 7.290 ( 0.000 -2.033 0.662) 2.138 7.463 ( -0.000 -2.593 2.442) 3.561 7.513 ( 0.000 -2.968 4.441) 5.341 7.747 ( -0.000 -2.880 11.578) 11.931 7.769 ( 0.000 -0.431 1.875) 1.924 7.914 ( -0.000 0.453 -11.074) 11.083 7.927 ( 0.000 -2.676 -6.333) 6.875 8.156 ( 0.000 3.877 -4.398) 5.863 8.178 ( -0.000 5.814 -3.815) 6.954 8.266 ( 0.000 1.805 -1.754) 2.517 8.276 ( -0.000 6.931 1.536) 7.099 8.458 ( 0.000 -0.850 -7.817) 7.863 8.573 ( 0.000 -2.614 5.480) 6.071 8.643 ( 0.000 2.070 -7.748) 8.020 8.711 ( 0.000 0.494 -7.468) 7.484 8.901 ( 0.000 1.531 -4.421) 4.679 8.901 ( -0.000 -0.591 1.550) 1.659 9.240 ( -0.000 -2.299 -11.626) 11.851 9.405 ( 0.000 -1.758 -9.420) 9.582 9.597 ( 0.000 0.308 5.014) 5.024 9.599 ( -0.000 -3.588 -1.245) 3.798 9.900 ( 0.000 0.913 2.595) 2.751 9.925 ( 0.000 -2.136 -10.032) 10.257 9.972 ( -0.000 -4.009 -8.548) 9.442 10.131 ( -0.000 -1.239 -1.449) 1.906 10.160 ( 0.000 -2.952 -1.913) 3.517 10.220 ( 0.000 -3.333 -7.108) 7.851 10.568 ( -0.000 -4.360 4.563) 6.311 10.622 ( -0.000 -2.246 9.007) 9.283 10.644 ( 0.000 -2.419 1.143) 2.675 10.709 ( -0.000 -1.755 0.809) 1.932 11.071 ( 0.000 -5.261 -6.247) 8.168 11.108 ( -0.000 -4.940 -7.386) 8.885 11.196 ( 0.000 -3.542 1.682) 3.921 11.300 ( 0.000 -1.138 -1.712) 2.056 11.439 ( 0.000 -2.478 2.430) 3.470 11.477 ( -0.000 -0.418 13.339) 13.345 11.646 ( 0.000 -3.308 -6.537) 7.326 11.762 ( -0.000 -2.101 -3.929) 4.456 11.930 ( -0.000 -3.467 3.849) 5.181 12.048 ( 0.000 0.690 6.188) 6.226 12.086 ( 0.000 -1.947 21.156) 21.246 12.135 ( -0.000 0.574 11.323) 11.337 12.148 ( 0.000 2.665 -3.934) 4.752 12.331 ( 0.000 -0.393 5.343) 5.358 12.389 ( -0.000 2.287 -2.405) 3.318 12.421 ( 0.000 1.674 6.142) 6.366 12.450 ( -0.000 -0.264 5.617) 5.623 12.528 ( 0.000 4.600 1.708) 4.907 12.606 ( -0.000 1.686 -4.018) 4.357 12.664 ( 0.000 -2.424 -1.956) 3.114 12.783 ( 0.000 4.435 -3.460) 5.625 12.791 ( -0.000 -1.980 -8.183) 8.419 13.073 ( -0.000 1.290 -5.888) 6.028 13.098 ( -0.000 -1.902 3.038) 3.584 13.099 ( 0.000 0.083 -1.810) 1.812 13.311 ( 0.000 -1.428 2.176) 2.603 13.320 ( 0.000 -2.281 -3.124) 3.868 13.422 ( 0.000 0.804 -0.667) 1.045 13.672 ( 0.000 3.833 1.125) 3.994 13.737 ( -0.000 3.567 1.786) 3.989 13.841 ( -0.000 -0.876 6.255) 6.316 13.964 ( 0.000 -0.993 0.084) 0.997 14.155 ( 0.000 -3.860 9.581) 10.329 14.201 ( 0.000 -3.928 9.093) 9.905 14.561 ( 0.000 4.934 -1.203) 5.079 14.569 ( -0.000 3.514 -1.506) 3.824 14.875 ( -0.000 3.689 -1.812) 4.110 14.944 ( 0.000 -4.023 -11.739) 12.409 15.143 ( -0.000 5.534 6.285) 8.374 15.169 ( 0.000 -2.620 -5.246) 5.864 15.232 ( 0.000 -0.805 -10.203) 10.234 15.325 ( 0.000 1.345 -7.748) 7.864 15.496 ( 0.000 -0.868 4.961) 5.036 15.675 ( -0.000 0.939 6.797) 6.862 15.949 ( 0.000 2.515 2.516) 3.558 15.955 ( -0.000 -0.350 9.782) 9.788 16.045 ( 0.000 3.950 -5.006) 6.376 16.120 ( -0.000 1.337 3.331) 3.589 16.737 ( 0.000 0.642 -17.615) 17.627 16.746 ( -0.000 0.318 -16.655) 16.658 17.074 ( 0.000 0.189 -10.384) 10.386 17.079 ( -0.000 0.261 -14.714) 14.717 17.503 ( -0.000 -0.657 12.067) 12.085 17.690 ( -0.000 0.649 7.540) 7.568 17.709 ( 0.000 0.115 6.773) 6.774 17.754 ( 0.000 1.348 10.271) 10.359 17.894 ( 0.000 0.352 3.724) 3.740 17.919 ( 0.000 0.582 2.805) 2.865 18.022 ( 0.000 -1.966 -5.990) 6.304 18.143 ( 0.000 -0.548 -2.136) 2.205 18.329 ( 0.000 0.492 0.755) 0.901 18.372 ( -0.000 1.969 -4.567) 4.973 18.376 ( -0.000 0.878 -0.333) 0.939 18.437 ( 0.000 1.901 3.242) 3.759 18.587 ( -0.000 -0.212 -4.613) 4.618 18.621 ( 0.000 0.351 -2.981) 3.001 18.726 ( 0.000 -3.272 7.852) 8.507 18.771 ( 0.000 -0.817 0.662) 1.052 19.031 ( 0.000 -0.014 -3.694) 3.694 19.120 ( 0.000 1.063 -4.856) 4.971 19.481 ( -0.000 -1.799 13.195) 13.317 19.497 ( 0.000 -0.818 12.043) 12.070 19.819 ( 0.000 0.786 5.346) 5.404 19.820 ( -0.000 0.506 5.227) 5.252 20.140 ( -0.000 1.838 -3.715) 4.145 20.205 ( 0.000 2.518 -2.994) 3.912 20.210 ( 0.000 -1.502 7.439) 7.589 20.278 ( 0.000 -0.785 10.798) 10.827 20.457 ( 0.000 -0.796 -8.002) 8.042 20.498 ( -0.000 -0.254 -9.931) 9.934 20.725 ( -0.000 -2.983 -3.509) 4.606 20.788 ( 0.000 -3.536 -4.466) 5.696 20.973 ( -0.000 -1.040 3.260) 3.422 20.987 ( 0.000 -1.091 4.850) 4.971 21.012 ( 0.000 -0.297 -1.149) 1.187 21.108 ( 0.000 1.357 0.160) 1.366 21.215 ( -0.000 -1.991 -4.959) 5.344 21.221 ( 0.000 -2.823 -4.580) 5.380 21.930 ( 0.000 -1.078 12.332) 12.379 22.017 ( 0.000 -0.360 12.318) 12.324 22.396 ( -0.000 -1.025 0.302) 1.069 22.457 ( 0.000 -0.419 0.824) 0.925 22.723 ( 0.000 -0.657 -4.430) 4.478 22.738 ( -0.000 -0.446 -4.181) 4.205 23.049 ( -0.000 -0.892 -1.255) 1.539 23.050 ( 0.000 -1.234 1.357) 1.835 23.106 ( 0.000 1.181 0.294) 1.217 23.109 ( -0.000 1.087 5.510) 5.616 23.441 ( -0.000 -2.001 1.501) 2.501 23.456 ( 0.000 -2.526 5.007) 5.608 23.651 ( 0.000 0.695 -2.091) 2.204 23.667 ( 0.000 1.083 -3.269) 3.443 23.828 ( 0.000 -0.826 0.319) 0.886 23.849 ( 0.000 -0.893 1.364) 1.630 24.026 ( -0.000 -0.593 -6.943) 6.969 24.042 ( 0.000 -0.485 -9.123) 9.136 24.431 ( 0.000 1.763 7.621) 7.822 24.474 ( 0.000 2.367 6.257) 6.690 24.902 ( 0.000 1.367 -3.349) 3.617 24.908 ( -0.000 1.978 -3.028) 3.617 25.184 ( -0.000 -2.888 -10.116) 10.520 25.231 ( 0.000 -2.301 -11.785) 12.008 25.633 ( 0.000 -1.412 4.452) 4.671 25.670 ( -0.000 -0.850 2.054) 2.223 25.913 ( -0.000 -5.873 12.859) 14.137 26.013 ( 0.000 -0.884 15.655) 15.680 26.163 ( -0.000 -4.378 -1.449) 4.612 26.249 ( 0.000 -7.670 1.031) 7.739 26.531 ( 0.000 -5.485 -7.998) 9.698 26.610 ( -0.000 -3.663 0.942) 3.782 26.852 ( -0.000 -17.319 -5.434) 18.152 27.032 ( -0.000 -3.889 -16.762) 17.207 27.122 ( -0.000 -11.130 -10.273) 15.146 27.170 ( 0.000 -27.210 -8.343) 28.460 27.822 ( -0.000 -3.348 16.696) 17.029 28.098 ( 0.000 -9.257 13.907) 16.706 28.176 ( 0.000 -1.363 1.958) 2.386 28.208 ( -0.000 -1.158 2.713) 2.950 28.500 ( 0.000 -7.764 1.768) 7.963 28.517 ( 0.000 -9.481 4.262) 10.395 28.913 ( -0.000 -1.391 5.309) 5.488 28.946 ( 0.000 -3.221 3.257) 4.581 29.281 ( -0.000 -3.642 -11.949) 12.492 29.310 ( 0.000 -3.454 -10.405) 10.963 29.513 ( 0.000 -5.756 -0.423) 5.771 29.539 ( -0.000 -5.056 -0.310) 5.066 30.053 ( 0.000 -2.403 0.983) 2.596 30.092 ( 0.000 -2.928 2.272) 3.706 30.569 ( 0.000 -0.599 4.714) 4.752 30.577 ( -0.000 -2.173 4.946) 5.403 30.640 ( 0.000 -0.952 -1.231) 1.556 30.696 ( 0.000 -2.117 -0.279) 2.136 30.859 ( 0.000 -5.598 -1.897) 5.910 30.907 ( 0.000 -7.983 -2.307) 8.309 31.137 ( 0.000 -7.768 7.288) 10.652 31.142 ( -0.000 -7.576 6.343) 9.881 31.424 ( -0.000 -3.147 -1.647) 3.552 31.449 ( 0.000 -11.573 -5.363) 12.755 31.575 ( 0.000 -4.204 5.549) 6.962 31.594 ( 0.000 -6.746 1.598) 6.933 31.947 ( -0.000 -11.394 -10.135) 15.249 32.007 ( 0.000 -1.373 -12.077) 12.155 32.159 ( 0.000 -5.501 2.573) 6.072 32.166 ( -0.000 -6.137 0.766) 6.185 32.630 ( 0.000 -0.226 0.743) 0.776 32.682 ( -0.000 -7.017 0.183) 7.019 33.106 ( 0.000 0.217 7.022) 7.025 33.234 ( 0.000 -1.899 7.088) 7.338 33.642 ( 0.000 2.021 -8.389) 8.629 33.807 ( 0.000 1.290 -18.790) 18.835 34.308 ( 0.000 11.286 26.775) 29.057 34.757 ( 0.000 6.872 24.831) 25.764 35.880 ( 0.000 18.548 -26.835) 32.621 36.121 ( -0.000 14.425 -19.216) 24.028 ======================= Grid point 70 (28/54) ======================= q-point: ( 0.00 0.27 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.873 ( 0.000 19.167 14.120) 23.806 1.996 ( 0.000 14.217 18.193) 23.089 2.369 ( 0.000 1.796 -6.802) 7.035 2.420 ( 0.000 5.939 4.247) 7.301 2.460 ( 0.000 24.223 4.305) 24.603 2.699 ( 0.000 10.826 7.034) 12.910 2.791 ( 0.000 7.215 -8.227) 10.943 2.846 ( 0.000 15.743 -7.089) 17.265 2.874 ( 0.000 5.329 -1.647) 5.578 2.960 ( 0.000 2.121 -1.196) 2.435 3.112 ( 0.000 0.020 1.539) 1.540 3.126 ( 0.000 -3.445 -4.743) 5.862 3.160 ( 0.000 5.378 -4.391) 6.943 3.248 ( 0.000 -2.343 -2.014) 3.089 3.268 ( 0.000 -0.686 -4.815) 4.864 3.323 ( 0.000 -0.996 3.135) 3.289 3.324 ( 0.000 6.974 4.985) 8.572 3.438 ( 0.000 0.908 -0.589) 1.083 3.521 ( 0.000 -0.341 0.083) 0.351 3.530 ( 0.000 2.362 0.086) 2.364 3.646 ( 0.000 9.886 2.504) 10.198 3.693 ( 0.000 -1.805 8.296) 8.490 3.824 ( 0.000 1.422 -2.724) 3.073 3.945 ( 0.000 -2.241 -3.369) 4.046 4.098 ( 0.000 0.792 2.934) 3.039 4.294 ( 0.000 -7.788 -4.184) 8.840 4.338 ( 0.000 -6.053 0.670) 6.090 4.398 ( 0.000 -2.602 -1.625) 3.067 4.478 ( 0.000 -8.708 8.063) 11.868 4.660 ( 0.000 -2.355 -0.077) 2.356 4.814 ( 0.000 -7.969 2.172) 8.260 4.985 ( 0.000 2.562 3.392) 4.251 5.045 ( 0.000 -3.311 -4.928) 5.936 5.160 ( 0.000 -0.298 -3.573) 3.585 5.750 ( 0.000 -1.007 -0.185) 1.024 5.867 ( 0.000 -3.083 -4.407) 5.378 6.089 ( 0.000 -1.927 9.333) 9.529 6.347 ( 0.000 -2.473 12.196) 12.444 6.404 ( 0.000 0.462 -0.303) 0.553 6.473 ( 0.000 -9.126 3.823) 9.894 6.609 ( 0.000 -1.265 11.100) 11.172 6.624 ( 0.000 -10.538 -1.306) 10.619 6.782 ( 0.000 -1.455 3.198) 3.513 6.860 ( 0.000 -4.567 14.897) 15.581 7.116 ( 0.000 -8.294 -9.175) 12.368 7.124 ( 0.000 -3.387 1.663) 3.773 7.340 ( 0.000 -1.926 -14.639) 14.765 7.522 ( 0.000 1.310 0.597) 1.439 7.710 ( 0.000 -0.645 1.215) 1.376 7.725 ( 0.000 -0.331 2.365) 2.388 7.947 ( 0.000 -0.394 7.078) 7.089 8.030 ( 0.000 1.568 0.454) 1.633 8.184 ( 0.000 0.883 -10.801) 10.837 8.211 ( 0.000 -1.107 -3.232) 3.417 8.378 ( 0.000 1.891 3.151) 3.675 8.463 ( 0.000 4.644 -5.099) 6.897 8.619 ( 0.000 -0.360 -10.053) 10.059 8.627 ( 0.000 1.208 3.679) 3.872 8.736 ( 0.000 -13.085 -11.744) 17.583 8.773 ( 0.000 1.175 3.496) 3.688 8.816 ( 0.000 -1.169 -13.967) 14.016 9.106 ( 0.000 1.110 -1.733) 2.058 9.312 ( 0.000 -1.520 -3.062) 3.419 9.433 ( 0.000 -0.410 -7.840) 7.850 9.600 ( 0.000 0.024 -21.869) 21.869 9.654 ( 0.000 -0.124 -18.334) 18.335 9.780 ( 0.000 -0.553 0.555) 0.784 9.828 ( 0.000 -2.057 -1.126) 2.345 9.983 ( 0.000 -1.044 9.071) 9.131 10.279 ( 0.000 -5.264 -11.243) 12.414 10.318 ( 0.000 -0.617 4.213) 4.258 10.351 ( 0.000 -4.268 7.637) 8.749 10.474 ( 0.000 -0.802 18.081) 18.099 10.579 ( 0.000 0.413 -6.428) 6.441 10.689 ( 0.000 -7.313 -4.037) 8.353 10.874 ( 0.000 -5.926 -2.377) 6.385 10.921 ( 0.000 -4.023 3.953) 5.640 11.085 ( 0.000 -4.553 4.862) 6.661 11.098 ( 0.000 -4.578 -6.287) 7.777 11.183 ( 0.000 -6.767 0.954) 6.834 11.215 ( 0.000 -2.036 1.258) 2.393 11.277 ( 0.000 0.467 -2.030) 2.083 11.463 ( 0.000 1.275 7.850) 7.953 11.853 ( 0.000 -0.330 22.632) 22.634 11.916 ( 0.000 -4.412 20.786) 21.249 12.073 ( 0.000 -3.892 -7.734) 8.658 12.098 ( 0.000 1.037 4.725) 4.837 12.133 ( 0.000 -2.214 1.005) 2.431 12.135 ( 0.000 0.309 10.595) 10.600 12.238 ( 0.000 -0.680 -2.966) 3.043 12.266 ( 0.000 4.192 4.747) 6.332 12.304 ( 0.000 2.508 -1.134) 2.752 12.402 ( 0.000 -1.294 0.203) 1.310 12.492 ( 0.000 -3.642 -9.954) 10.599 12.726 ( 0.000 3.914 -8.245) 9.127 12.747 ( 0.000 2.168 -3.623) 4.222 12.820 ( 0.000 -0.774 -0.243) 0.811 12.843 ( 0.000 4.046 14.203) 14.768 12.968 ( 0.000 -2.916 -4.660) 5.497 12.970 ( 0.000 -0.678 2.622) 2.708 13.206 ( 0.000 -3.234 6.123) 6.925 13.245 ( 0.000 -0.831 -2.839) 2.958 13.251 ( 0.000 -4.971 -6.985) 8.574 13.349 ( 0.000 -2.184 -3.740) 4.331 13.574 ( 0.000 3.289 -6.395) 7.191 13.636 ( 0.000 -2.335 -13.273) 13.477 13.682 ( 0.000 2.823 5.712) 6.372 13.909 ( 0.000 -2.041 17.027) 17.149 13.977 ( 0.000 3.757 -2.234) 4.371 14.188 ( 0.000 0.850 4.717) 4.794 14.386 ( 0.000 1.392 12.882) 12.957 14.542 ( 0.000 -1.203 -3.201) 3.420 14.803 ( 0.000 0.440 13.570) 13.578 14.917 ( 0.000 2.319 -1.005) 2.527 15.148 ( 0.000 1.071 -20.331) 20.359 15.315 ( 0.000 -3.053 -8.726) 9.245 15.358 ( 0.000 -2.215 -13.381) 13.563 15.482 ( 0.000 4.824 -10.895) 11.915 15.742 ( 0.000 -1.376 3.554) 3.811 15.896 ( 0.000 3.943 6.616) 7.702 15.918 ( 0.000 1.413 8.241) 8.361 16.000 ( 0.000 0.605 2.487) 2.559 16.228 ( 0.000 1.646 -15.630) 15.716 16.474 ( 0.000 2.365 -13.855) 14.055 16.729 ( 0.000 0.395 15.329) 15.334 17.076 ( 0.000 -0.245 -8.787) 8.790 17.108 ( 0.000 1.574 -4.948) 5.192 17.179 ( 0.000 0.091 16.000) 16.000 17.328 ( 0.000 -2.967 -7.712) 8.263 17.405 ( 0.000 0.528 15.903) 15.912 17.620 ( 0.000 4.679 4.454) 6.460 17.858 ( 0.000 1.889 19.714) 19.804 17.915 ( 0.000 -0.232 -8.851) 8.854 17.995 ( 0.000 0.030 5.594) 5.595 18.010 ( 0.000 -0.651 1.883) 1.992 18.081 ( 0.000 -1.185 -0.713) 1.383 18.168 ( 0.000 -0.628 -10.409) 10.428 18.253 ( 0.000 -0.778 -1.614) 1.792 18.435 ( 0.000 0.515 -2.406) 2.460 18.532 ( 0.000 0.046 -10.632) 10.632 18.552 ( 0.000 3.061 -2.917) 4.228 18.624 ( 0.000 0.679 -4.430) 4.481 18.748 ( 0.000 0.233 0.119) 0.262 18.806 ( 0.000 -0.197 3.791) 3.797 18.969 ( 0.000 0.908 -3.501) 3.617 19.025 ( 0.000 -0.076 -9.088) 9.088 19.353 ( 0.000 0.139 6.755) 6.757 19.443 ( 0.000 -0.440 8.382) 8.394 19.473 ( 0.000 0.918 6.492) 6.556 19.672 ( 0.000 2.049 1.070) 2.311 19.908 ( 0.000 -0.618 14.306) 14.319 19.978 ( 0.000 0.131 10.683) 10.684 20.303 ( 0.000 -3.008 11.924) 12.297 20.565 ( 0.000 0.329 -5.732) 5.741 20.614 ( 0.000 -1.197 -6.671) 6.777 20.671 ( 0.000 1.169 -5.950) 6.064 20.717 ( 0.000 -1.528 -2.185) 2.666 20.825 ( 0.000 -1.739 -2.463) 3.015 20.924 ( 0.000 -2.618 12.185) 12.463 20.935 ( 0.000 -0.142 -11.724) 11.725 21.011 ( 0.000 -1.159 -6.921) 7.017 21.166 ( 0.000 0.832 11.016) 11.048 21.346 ( 0.000 -0.417 1.624) 1.676 21.382 ( 0.000 -0.286 0.825) 0.873 21.786 ( 0.000 -1.967 -9.698) 9.895 22.117 ( 0.000 -5.395 -11.385) 12.599 22.422 ( 0.000 0.308 7.092) 7.099 22.507 ( 0.000 1.591 15.452) 15.533 22.521 ( 0.000 1.845 0.417) 1.892 22.637 ( 0.000 2.038 4.309) 4.767 22.940 ( 0.000 0.312 3.104) 3.120 22.982 ( 0.000 -2.590 -4.235) 4.964 23.121 ( 0.000 1.654 -1.526) 2.250 23.225 ( 0.000 -2.298 18.407) 18.550 23.301 ( 0.000 0.785 -8.279) 8.316 23.673 ( 0.000 0.375 -7.382) 7.392 23.725 ( 0.000 -0.268 -6.385) 6.391 23.745 ( 0.000 2.229 2.431) 3.298 23.927 ( 0.000 3.620 -5.009) 6.180 24.025 ( 0.000 0.421 6.550) 6.564 24.213 ( 0.000 0.450 -3.433) 3.462 24.262 ( 0.000 1.138 5.464) 5.581 24.372 ( 0.000 -2.288 -10.850) 11.088 24.481 ( 0.000 0.721 2.725) 2.818 24.498 ( 0.000 -0.149 0.598) 0.616 24.536 ( 0.000 -0.141 -1.340) 1.347 25.006 ( 0.000 -4.362 -0.818) 4.439 25.041 ( 0.000 0.614 18.766) 18.776 25.115 ( 0.000 -1.780 9.146) 9.317 25.469 ( 0.000 1.298 -12.699) 12.766 25.645 ( 0.000 0.707 -16.921) 16.935 25.745 ( 0.000 0.382 2.365) 2.395 25.859 ( 0.000 -2.047 -4.432) 4.882 25.941 ( 0.000 -0.310 -21.184) 21.186 26.446 ( 0.000 -0.170 3.847) 3.851 26.463 ( 0.000 -0.618 20.640) 20.649 26.504 ( 0.000 0.082 -0.318) 0.329 27.292 ( 0.000 -2.641 -19.076) 19.258 27.556 ( 0.000 -1.416 10.138) 10.236 27.850 ( 0.000 -3.295 11.634) 12.092 27.927 ( 0.000 -4.225 -5.251) 6.739 28.044 ( 0.000 -4.622 1.685) 4.919 28.089 ( 0.000 -10.020 7.996) 12.820 28.130 ( 0.000 -12.247 -1.252) 12.311 28.474 ( 0.000 -0.937 1.170) 1.499 28.601 ( 0.000 -1.473 -3.181) 3.506 28.648 ( 0.000 -10.068 -0.687) 10.091 28.741 ( 0.000 -6.128 -1.142) 6.234 29.008 ( 0.000 -0.609 10.403) 10.420 29.186 ( 0.000 -1.188 2.993) 3.221 29.566 ( 0.000 -2.584 -11.641) 11.924 29.622 ( 0.000 -4.973 5.566) 7.464 29.693 ( 0.000 -0.694 -20.495) 20.506 29.929 ( 0.000 -6.779 -3.077) 7.444 30.438 ( 0.000 -1.729 13.368) 13.479 30.632 ( 0.000 -9.772 1.071) 9.830 30.666 ( 0.000 -3.122 0.483) 3.159 30.710 ( 0.000 -0.559 -0.552) 0.786 30.717 ( 0.000 -6.992 -0.933) 7.054 30.832 ( 0.000 -2.714 -4.466) 5.226 30.848 ( 0.000 -1.062 10.372) 10.427 31.064 ( 0.000 -3.489 6.231) 7.141 31.255 ( 0.000 0.468 -4.747) 4.770 31.368 ( 0.000 -5.162 2.940) 5.941 31.399 ( 0.000 -6.958 -0.745) 6.998 31.584 ( 0.000 -3.847 -3.834) 5.431 31.749 ( 0.000 -8.352 -8.885) 12.194 31.868 ( 0.000 -1.503 -15.633) 15.705 31.997 ( 0.000 -3.891 6.511) 7.585 32.229 ( 0.000 -7.496 -4.844) 8.924 32.731 ( 0.000 0.047 19.674) 19.675 32.748 ( 0.000 -5.475 13.873) 14.914 33.212 ( 0.000 -1.744 -1.372) 2.219 33.409 ( 0.000 -0.312 -10.426) 10.431 33.509 ( 0.000 -0.746 -8.501) 8.533 33.619 ( 0.000 -2.358 -12.150) 12.377 34.031 ( 0.000 0.936 12.686) 12.720 34.457 ( 0.000 -2.486 -2.901) 3.820 35.492 ( 0.000 -1.598 32.907) 32.946 37.201 ( 0.000 -28.707 -35.385) 45.566 ======================= Grid point 71 (29/54) ======================= q-point: ( 0.25 0.27 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 88 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.936 ( 5.830 13.666 9.732) 17.761 2.121 ( 7.739 16.518 8.706) 20.212 2.320 ( -4.078 11.276 1.002) 12.032 2.410 ( -1.005 7.654 4.186) 8.782 2.518 ( 5.780 4.844 0.894) 7.594 2.733 ( 1.245 10.397 -2.722) 10.819 2.797 ( 0.134 6.706 -8.418) 10.763 2.851 ( -2.206 6.529 -0.921) 6.953 2.938 ( 5.375 7.056 0.469) 8.882 2.984 ( 6.556 9.165 -3.459) 11.788 3.108 ( 0.810 -0.280 -1.192) 1.468 3.134 ( -0.589 2.941 -4.225) 5.181 3.163 ( 1.235 -0.594 -0.563) 1.482 3.263 ( 5.080 1.273 1.011) 5.333 3.312 ( 0.489 -0.517 1.336) 1.514 3.330 ( 0.652 5.581 4.056) 6.930 3.339 ( 1.318 0.162 1.284) 1.847 3.431 ( -1.128 1.351 -0.664) 1.881 3.497 ( -2.935 2.934 0.678) 4.205 3.524 ( 0.841 0.982 0.469) 1.375 3.577 ( -2.106 3.723 5.648) 7.084 3.799 ( 5.228 2.719 1.152) 6.005 3.849 ( 3.180 3.709 -1.833) 5.218 3.981 ( 1.084 -1.007 -1.995) 2.484 4.098 ( 0.420 -1.448 2.210) 2.675 4.259 ( -7.897 -2.186 -2.533) 8.576 4.281 ( -6.247 -1.920 2.452) 6.980 4.377 ( 2.363 -6.532 1.114) 7.036 4.473 ( 0.305 -6.396 2.284) 6.798 4.492 ( -11.426 1.010 1.484) 11.566 4.753 ( -5.388 -4.778 -0.005) 7.201 4.783 ( -7.187 -4.935 0.240) 8.722 5.258 ( 6.215 -1.959 -2.007) 6.818 5.307 ( 13.306 -3.088 -3.619) 14.131 5.644 ( -8.132 -1.681 2.406) 8.646 5.789 ( -6.903 -3.921 -3.142) 8.538 6.287 ( 9.427 -3.201 3.874) 10.683 6.314 ( 0.779 -2.976 2.093) 3.721 6.357 ( -0.206 -6.129 3.214) 6.923 6.535 ( 7.839 -1.200 11.781) 14.202 6.690 ( 9.867 -4.785 7.898) 13.514 6.788 ( 5.862 -5.763 7.802) 11.333 6.822 ( -1.766 -6.462 4.311) 7.966 6.962 ( 3.904 -1.538 2.663) 4.970 7.025 ( 8.284 -3.079 -1.406) 8.949 7.152 ( -0.857 -3.377 -0.113) 3.486 7.373 ( 1.488 -1.874 -3.259) 4.043 7.454 ( -1.994 -0.102 -7.016) 7.295 7.588 ( -1.267 -2.977 -4.322) 5.399 7.881 ( -1.858 1.368 2.372) 3.309 7.922 ( -0.327 0.822 7.703) 7.754 8.019 ( 5.234 -1.770 2.768) 6.180 8.096 ( -9.103 -3.494 -9.546) 13.646 8.234 ( -1.721 -2.833 -2.456) 4.125 8.320 ( -3.104 2.163 -4.687) 6.023 8.439 ( -0.866 4.378 -6.942) 8.253 8.525 ( -7.833 -1.676 -1.851) 8.221 8.581 ( -4.248 -1.977 2.950) 5.537 8.658 ( -0.205 -0.026 -6.970) 6.973 8.871 ( 8.480 0.518 -3.455) 9.172 9.017 ( -0.176 -0.486 0.310) 0.602 9.091 ( -10.234 -1.713 -12.001) 15.865 9.177 ( -15.344 1.073 -16.893) 22.847 9.220 ( -0.214 -1.590 -8.457) 8.607 9.563 ( 0.603 -1.420 -2.478) 2.919 9.738 ( -5.322 -2.572 7.183) 9.302 9.805 ( 2.544 -0.140 -13.252) 13.495 9.879 ( -6.772 -2.437 7.686) 10.530 9.889 ( 2.333 -0.476 3.239) 4.020 10.078 ( 5.197 -3.633 -0.195) 6.344 10.243 ( -9.306 -3.239 2.586) 10.187 10.335 ( -5.826 -3.531 -21.348) 22.409 10.375 ( -3.421 -3.215 8.703) 9.889 10.523 ( -1.058 -1.872 0.723) 2.268 10.620 ( -3.262 -1.322 4.288) 5.548 10.804 ( -7.129 -2.465 -5.383) 9.267 10.917 ( 1.958 -5.498 -5.893) 8.294 11.057 ( -1.447 -5.323 0.832) 5.579 11.181 ( -0.544 -3.232 1.328) 3.537 11.234 ( 0.309 -0.439 1.149) 1.268 11.349 ( 8.023 -3.043 1.934) 8.796 11.411 ( 9.251 -2.704 1.552) 9.763 11.460 ( 3.242 -2.752 7.771) 8.859 11.824 ( -5.163 -1.522 9.447) 10.873 11.896 ( -1.096 -1.801 10.317) 10.530 12.054 ( -1.187 -2.495 5.890) 6.506 12.066 ( 0.853 2.416 4.421) 5.110 12.098 ( -2.116 -0.424 12.394) 12.581 12.246 ( 4.401 -1.865 0.858) 4.856 12.317 ( 6.338 -0.440 -0.049) 6.354 12.340 ( 3.055 -0.124 -0.162) 3.062 12.404 ( 1.223 3.401 -1.989) 4.126 12.417 ( 0.989 -1.881 1.000) 2.348 12.461 ( 6.606 2.895 -3.733) 8.122 12.628 ( -3.689 2.195 -2.002) 4.737 12.683 ( -2.802 0.014 -3.671) 4.618 12.772 ( -4.714 1.352 0.220) 4.909 12.906 ( 4.812 -2.172 -2.810) 5.980 12.983 ( 3.034 0.832 1.790) 3.620 13.024 ( -5.487 -1.030 3.084) 6.378 13.187 ( 4.920 -1.371 2.283) 5.594 13.254 ( 1.512 -1.199 -3.241) 3.772 13.297 ( 2.207 -4.527 -2.497) 5.622 13.445 ( -2.007 2.189 -1.329) 3.253 13.502 ( 10.176 -0.691 -4.600) 11.189 13.708 ( 6.923 -0.330 1.751) 7.149 13.865 ( 3.237 2.218 4.087) 5.666 13.919 ( 1.749 -0.444 14.678) 14.788 14.088 ( 4.823 2.214 -2.999) 6.095 14.235 ( -10.661 -1.149 8.357) 13.595 14.319 ( 18.197 0.366 -3.043) 18.454 14.657 ( 6.886 -0.687 -2.298) 7.292 14.862 ( 0.255 3.664 0.588) 3.719 14.904 ( 1.162 0.136 3.826) 4.001 15.065 ( -1.025 -0.517 -10.737) 10.799 15.243 ( -4.913 -2.733 -3.736) 6.750 15.284 ( -5.926 -1.717 -9.340) 11.194 15.400 ( -7.630 2.873 -9.064) 12.191 15.667 ( -10.402 3.633 3.148) 11.459 15.812 ( -0.124 0.253 3.479) 3.490 15.943 ( -0.670 1.760 4.136) 4.544 16.003 ( 3.592 1.444 1.411) 4.120 16.209 ( -19.440 0.721 4.412) 19.948 16.383 ( -7.293 0.969 -5.328) 9.084 16.707 ( 0.081 0.786 -6.550) 6.598 16.732 ( -3.843 0.179 -4.410) 5.852 17.022 ( -2.253 1.544 -9.329) 9.721 17.249 ( -7.433 -2.781 -10.585) 13.230 17.441 ( 4.886 1.177 11.276) 12.346 17.554 ( 11.226 0.399 3.268) 11.699 17.711 ( 1.780 1.896 5.582) 6.158 17.832 ( 0.218 0.218 6.012) 6.020 17.917 ( -3.136 0.775 4.915) 5.881 17.973 ( -4.107 0.300 -2.777) 4.967 18.030 ( 1.841 -1.923 -3.419) 4.333 18.105 ( 0.747 -1.755 0.199) 1.918 18.180 ( 8.519 0.304 4.149) 9.481 18.243 ( 3.046 0.146 2.183) 3.750 18.468 ( 0.434 2.348 -3.866) 4.544 18.513 ( -0.699 1.506 -3.066) 3.487 18.573 ( 1.437 0.558 -4.637) 4.886 18.641 ( 0.457 0.948 -2.662) 2.862 18.736 ( -3.226 -0.457 0.509) 3.298 18.776 ( -2.173 -0.699 1.874) 2.953 18.984 ( 2.940 0.466 -0.376) 3.000 19.084 ( 4.237 0.192 -6.871) 8.075 19.399 ( 3.450 -0.664 8.877) 9.547 19.472 ( 1.459 -0.863 10.576) 10.711 19.603 ( 12.261 1.064 5.765) 13.590 19.804 ( 9.679 1.218 6.198) 11.558 20.003 ( 9.188 0.835 4.394) 10.219 20.056 ( 8.083 0.396 5.453) 9.759 20.259 ( -4.181 -1.622 7.801) 8.998 20.402 ( -10.188 -0.524 -5.723) 11.697 20.532 ( -9.767 1.197 -1.954) 10.032 20.633 ( 1.460 -1.554 -6.959) 7.278 20.776 ( -2.575 -2.810 2.643) 4.638 20.806 ( -5.323 -0.376 0.948) 5.420 20.847 ( -2.695 -0.035 -1.912) 3.305 20.967 ( 2.242 -0.548 -3.552) 4.236 20.994 ( -0.484 -1.640 -3.042) 3.490 21.108 ( -7.267 -0.923 -2.654) 7.791 21.215 ( -0.937 -2.275 0.806) 2.589 21.333 ( -5.971 -0.353 -1.111) 6.083 22.013 ( 2.656 -0.662 -2.973) 4.041 22.080 ( -0.144 -0.572 -2.218) 2.295 22.257 ( -3.295 0.984 9.986) 10.561 22.349 ( -1.119 -1.440 10.809) 10.962 22.688 ( 4.948 0.836 -3.137) 5.918 22.813 ( 10.742 1.862 0.686) 10.923 22.952 ( -2.446 -0.612 -5.640) 6.178 23.003 ( 1.829 -0.238 -1.488) 2.370 23.117 ( -2.467 0.084 5.399) 5.936 23.200 ( 3.895 -0.332 8.699) 9.537 23.250 ( -2.633 0.647 -1.759) 3.232 23.627 ( -8.577 -0.506 1.094) 8.662 23.686 ( -0.432 -0.080 -6.575) 6.589 23.724 ( -2.246 2.080 -0.508) 3.103 23.882 ( -3.718 3.127 -0.472) 4.881 23.984 ( -5.108 -0.556 0.401) 5.154 24.013 ( -11.840 -1.253 -2.602) 12.187 24.167 ( -8.421 0.154 -13.236) 15.688 24.329 ( 8.764 1.534 6.509) 11.024 24.548 ( 3.779 2.041 1.196) 4.458 24.745 ( 8.521 1.809 7.631) 11.581 24.940 ( 14.316 -2.996 -3.305) 14.995 24.962 ( 21.681 -4.855 3.088) 22.432 25.209 ( -8.813 1.427 -7.110) 11.413 25.374 ( 16.604 -3.737 5.962) 18.033 25.481 ( 27.078 -2.878 6.400) 27.972 25.616 ( 0.331 -0.342 -10.755) 10.766 25.703 ( 0.506 0.210 -1.405) 1.508 25.847 ( 2.558 -3.262 -4.040) 5.788 26.207 ( 7.147 -0.436 -8.270) 10.939 26.379 ( -5.298 -0.699 16.613) 17.452 26.501 ( -0.073 -0.137 -0.198) 0.252 26.574 ( 16.113 -0.914 -6.614) 17.441 27.180 ( -28.007 -6.444 -3.298) 28.927 27.210 ( -20.584 -6.241 -8.953) 23.298 27.525 ( -30.118 -11.253 -1.698) 32.197 27.712 ( -4.076 -4.325 8.335) 10.237 28.035 ( 0.503 -2.569 3.221) 4.151 28.080 ( 1.982 -6.192 8.384) 10.610 28.346 ( -4.399 -3.713 3.808) 6.902 28.366 ( -5.298 -3.845 -1.995) 6.844 28.444 ( -2.671 -3.692 -1.212) 4.715 28.684 ( 4.014 -3.629 9.198) 10.672 28.884 ( 11.784 -3.648 -5.063) 13.334 29.135 ( 6.290 -1.839 -0.310) 6.561 29.173 ( -0.487 -2.584 3.399) 4.297 29.494 ( -5.815 -3.561 -6.530) 9.441 29.584 ( -4.137 -4.296 -8.781) 10.615 29.886 ( 3.836 -3.397 -1.587) 5.364 29.945 ( 12.576 -2.672 -5.468) 13.972 30.446 ( 1.317 -2.475 11.559) 11.894 30.595 ( -2.301 -3.038 0.700) 3.875 30.649 ( -2.248 -3.014 -1.390) 4.009 30.704 ( -3.380 -3.504 0.529) 4.897 30.736 ( 0.885 -3.980 2.043) 4.560 30.765 ( 3.357 -5.212 -0.231) 6.204 30.979 ( -2.514 -3.721 5.428) 7.045 31.061 ( 6.041 -1.976 2.397) 6.793 31.238 ( -5.799 -7.335 -4.946) 10.578 31.344 ( 4.017 -2.037 -5.561) 7.156 31.441 ( 4.336 -4.557 5.833) 8.578 31.562 ( -3.079 -3.358 -1.449) 4.781 31.773 ( 0.565 -7.712 -8.200) 11.271 31.872 ( 0.692 -4.512 -8.776) 9.892 32.028 ( 2.589 -3.082 2.597) 4.790 32.184 ( -4.554 -5.039 -2.766) 7.334 32.529 ( -5.705 -4.818 10.911) 13.222 32.872 ( -10.618 -1.219 2.534) 10.984 33.038 ( -3.161 -2.884 2.869) 5.152 33.223 ( -2.194 -1.459 3.023) 4.010 33.613 ( 4.296 0.081 -8.019) 9.098 33.785 ( 3.887 -2.322 -19.034) 19.565 34.183 ( 14.339 0.685 18.801) 23.655 34.694 ( 15.427 -5.448 9.248) 18.794 35.498 ( 7.587 -0.022 15.169) 16.960 36.850 ( -33.183 -21.281 -30.325) 49.736 ======================= Grid point 72 (30/54) ======================= q-point: (-0.50 0.27 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.018 ( 0.000 11.401 4.661) 12.317 2.204 ( 0.000 16.498 1.989) 16.618 2.258 ( 0.000 12.388 7.036) 14.247 2.397 ( 0.000 7.532 4.141) 8.595 2.612 ( 0.000 0.993 -6.236) 6.314 2.721 ( 0.000 -3.288 1.713) 3.707 2.754 ( -0.000 11.834 -5.006) 12.850 2.897 ( 0.000 9.363 -11.024) 14.463 2.944 ( -0.000 5.495 -2.955) 6.239 3.035 ( 0.000 6.443 -1.559) 6.628 3.156 ( 0.000 0.116 0.547) 0.559 3.162 ( 0.000 0.846 2.871) 2.993 3.263 ( 0.000 0.740 -2.786) 2.882 3.288 ( -0.000 1.168 -2.936) 3.160 3.313 ( -0.000 2.850 6.393) 6.999 3.330 ( 0.000 3.721 3.360) 5.013 3.363 ( -0.000 1.216 1.309) 1.786 3.373 ( 0.000 1.846 1.808) 2.584 3.501 ( 0.000 1.479 1.112) 1.850 3.534 ( 0.000 2.853 1.328) 3.147 3.624 ( -0.000 6.020 3.952) 7.201 3.802 ( 0.000 4.020 5.594) 6.889 3.900 ( -0.000 7.078 0.469) 7.094 3.961 ( -0.000 -1.452 -3.383) 3.681 4.048 ( 0.000 5.393 -2.294) 5.861 4.146 ( 0.000 3.215 4.163) 5.260 4.251 ( 0.000 -6.519 -0.545) 6.542 4.353 ( 0.000 0.541 1.488) 1.583 4.434 ( 0.000 -6.743 3.545) 7.618 4.471 ( 0.000 -8.009 2.947) 8.533 4.682 ( 0.000 -3.180 -3.609) 4.810 4.714 ( 0.000 -4.846 -2.611) 5.504 5.328 ( 0.000 -1.760 -2.304) 2.899 5.459 ( 0.000 -2.700 -3.291) 4.257 5.570 ( 0.000 -5.228 2.555) 5.819 5.662 ( -0.000 -4.945 1.160) 5.079 6.308 ( 0.000 -6.271 -1.444) 6.435 6.310 ( -0.000 -6.614 -1.601) 6.805 6.477 ( 0.000 -1.027 2.045) 2.288 6.634 ( -0.000 -3.713 4.082) 5.518 6.715 ( 0.000 -3.845 16.923) 17.354 6.743 ( -0.000 -0.130 18.865) 18.865 6.927 ( 0.000 -3.647 -8.333) 9.097 7.061 ( 0.000 -0.028 -8.594) 8.594 7.171 ( 0.000 -0.770 -0.271) 0.816 7.219 ( -0.000 -5.250 1.626) 5.496 7.400 ( 0.000 -3.777 2.466) 4.510 7.452 ( 0.000 -2.616 2.393) 3.545 7.670 ( 0.000 -4.028 9.387) 10.214 7.747 ( 0.000 -2.010 0.330) 2.037 7.892 ( 0.000 -0.363 -3.306) 3.326 7.895 ( -0.000 -2.021 -8.406) 8.645 8.171 ( 0.000 -2.133 -2.507) 3.291 8.214 ( 0.000 -5.012 -3.256) 5.977 8.239 ( -0.000 -1.194 -5.665) 5.790 8.405 ( 0.000 2.221 3.770) 4.375 8.460 ( 0.000 2.729 -9.385) 9.774 8.558 ( 0.000 0.813 12.044) 12.072 8.683 ( 0.000 -2.506 1.811) 3.092 8.684 ( -0.000 1.665 -9.029) 9.181 8.909 ( -0.000 1.251 -5.872) 6.004 8.925 ( 0.000 0.781 -4.338) 4.408 9.203 ( -0.000 -1.472 -11.317) 11.412 9.358 ( 0.000 -2.624 -12.248) 12.526 9.526 ( 0.000 -2.808 0.617) 2.875 9.618 ( -0.000 1.445 1.346) 1.975 9.861 ( 0.000 -2.941 -6.411) 7.054 9.895 ( 0.000 -1.007 -2.550) 2.741 9.935 ( -0.000 -0.454 -2.475) 2.516 10.069 ( -0.000 -4.184 0.389) 4.202 10.143 ( 0.000 -0.096 -8.088) 8.089 10.160 ( -0.000 -2.475 -11.047) 11.320 10.472 ( -0.000 -4.785 3.231) 5.774 10.567 ( -0.000 -3.408 8.624) 9.273 10.604 ( 0.000 -1.454 3.994) 4.251 10.663 ( -0.000 -2.485 1.801) 3.069 10.969 ( 0.000 -5.135 -6.988) 8.672 11.005 ( 0.000 -5.514 -6.261) 8.343 11.137 ( -0.000 -2.061 4.711) 5.142 11.276 ( -0.000 -1.174 -1.974) 2.297 11.395 ( 0.000 -1.438 1.376) 1.990 11.460 ( -0.000 -1.275 14.049) 14.106 11.586 ( 0.000 -2.597 -6.422) 6.927 11.704 ( -0.000 -3.707 -2.281) 4.353 11.891 ( 0.000 -0.293 4.267) 4.277 12.051 ( -0.000 0.046 4.839) 4.839 12.062 ( 0.000 -0.274 19.283) 19.285 12.124 ( 0.000 -1.208 11.684) 11.747 12.212 ( 0.000 2.888 -1.707) 3.355 12.319 ( 0.000 -0.954 6.564) 6.633 12.401 ( 0.000 -1.571 -1.648) 2.277 12.448 ( 0.000 0.788 1.306) 1.525 12.453 ( -0.000 1.234 3.614) 3.819 12.585 ( 0.000 0.800 -0.207) 0.826 12.620 ( -0.000 0.032 -7.569) 7.569 12.632 ( 0.000 -0.595 -1.286) 1.417 12.750 ( 0.000 -1.528 -3.962) 4.246 12.852 ( 0.000 2.092 -3.073) 3.718 13.042 ( 0.000 -1.478 4.394) 4.636 13.078 ( -0.000 -1.817 3.019) 3.523 13.162 ( 0.000 4.790 -4.836) 6.807 13.287 ( -0.000 -0.945 -0.111) 0.952 13.309 ( 0.000 0.978 -3.783) 3.907 13.419 ( 0.000 -1.267 -4.664) 4.833 13.718 ( 0.000 0.669 5.011) 5.056 13.772 ( -0.000 -0.110 4.091) 4.093 13.832 ( -0.000 0.307 6.298) 6.305 13.963 ( 0.000 0.898 0.649) 1.108 14.088 ( 0.000 -2.745 8.400) 8.837 14.144 ( 0.000 -1.744 7.399) 7.602 14.620 ( 0.000 1.855 -4.943) 5.279 14.651 ( -0.000 4.237 -3.462) 5.472 14.858 ( 0.000 -4.268 -12.516) 13.224 14.951 ( -0.000 3.531 -5.339) 6.401 15.109 ( -0.000 -3.118 -3.387) 4.604 15.215 ( 0.000 0.009 -9.453) 9.453 15.241 ( 0.000 2.907 4.673) 5.503 15.336 ( 0.000 -0.110 -4.892) 4.893 15.493 ( 0.000 0.628 11.300) 11.317 15.677 ( -0.000 -0.634 10.711) 10.729 15.954 ( 0.000 0.236 9.011) 9.014 15.987 ( -0.000 1.070 3.568) 3.725 16.118 ( -0.000 3.220 -3.660) 4.875 16.144 ( 0.000 1.206 2.034) 2.365 16.746 ( 0.000 -0.268 -15.607) 15.609 16.749 ( -0.000 0.445 -16.788) 16.794 17.076 ( 0.000 0.038 -10.823) 10.823 17.083 ( -0.000 0.126 -14.516) 14.516 17.510 ( -0.000 1.182 6.684) 6.788 17.694 ( -0.000 -0.284 5.429) 5.437 17.713 ( 0.000 0.279 6.126) 6.132 17.772 ( 0.000 0.439 8.462) 8.473 17.900 ( -0.000 0.172 1.982) 1.989 17.916 ( 0.000 -0.884 -1.194) 1.486 17.995 ( 0.000 -0.640 -5.369) 5.407 18.114 ( 0.000 -2.163 -2.675) 3.440 18.344 ( 0.000 1.107 3.615) 3.780 18.376 ( -0.000 0.805 2.108) 2.257 18.450 ( 0.000 3.843 -2.153) 4.405 18.484 ( 0.000 2.581 5.935) 6.472 18.583 ( -0.000 -0.157 -4.167) 4.170 18.627 ( 0.000 0.252 -2.696) 2.707 18.667 ( 0.000 -2.428 6.963) 7.374 18.756 ( 0.000 -0.814 -0.714) 1.083 19.039 ( 0.000 0.847 -2.092) 2.257 19.132 ( 0.000 0.138 -3.123) 3.126 19.446 ( -0.000 -1.576 13.554) 13.645 19.479 ( 0.000 -1.068 12.588) 12.633 19.830 ( 0.000 0.486 5.454) 5.475 19.834 ( -0.000 0.722 5.466) 5.513 20.182 ( -0.000 2.122 -2.719) 3.449 20.192 ( 0.000 -0.252 5.383) 5.389 20.253 ( -0.000 2.216 -3.541) 4.177 20.265 ( 0.000 -0.381 7.478) 7.488 20.440 ( 0.000 -0.859 -6.826) 6.880 20.486 ( -0.000 -0.923 -9.315) 9.360 20.673 ( -0.000 -2.261 -3.452) 4.127 20.713 ( 0.000 -3.526 -3.333) 4.852 20.957 ( 0.000 -0.534 3.019) 3.065 20.970 ( -0.000 -0.732 4.394) 4.454 21.014 ( 0.000 0.489 -2.817) 2.859 21.130 ( 0.000 0.651 -1.498) 1.633 21.162 ( -0.000 -2.766 -3.720) 4.635 21.178 ( 0.000 -1.612 -4.330) 4.620 21.924 ( 0.000 0.408 8.957) 8.967 22.011 ( 0.000 -0.292 9.107) 9.111 22.386 ( -0.000 0.030 1.125) 1.125 22.447 ( 0.000 -0.494 1.510) 1.588 22.728 ( 0.000 1.101 -5.365) 5.477 22.744 ( -0.000 0.978 -5.184) 5.276 23.024 ( -0.000 -1.334 -0.718) 1.514 23.026 ( 0.000 -1.317 -1.318) 1.863 23.135 ( 0.000 1.646 1.644) 2.326 23.140 ( -0.000 1.841 4.449) 4.815 23.414 ( -0.000 -0.608 3.827) 3.875 23.416 ( 0.000 -1.146 6.341) 6.443 23.670 ( -0.000 1.104 -4.139) 4.283 23.688 ( 0.000 0.830 -5.282) 5.347 23.827 ( -0.000 0.728 1.549) 1.712 23.838 ( 0.000 -0.052 1.556) 1.557 24.024 ( -0.000 0.328 -7.443) 7.450 24.041 ( 0.000 0.374 -9.199) 9.206 24.474 ( 0.000 2.495 7.348) 7.761 24.522 ( -0.000 2.306 5.741) 6.187 24.936 ( 0.000 1.995 -1.964) 2.799 24.954 ( -0.000 2.503 -1.981) 3.192 25.125 ( -0.000 -2.871 -8.863) 9.317 25.174 ( 0.000 -3.118 -10.296) 10.757 25.604 ( 0.000 -1.366 7.656) 7.776 25.648 ( -0.000 -1.240 4.076) 4.260 25.809 ( 0.000 -3.780 2.957) 4.800 25.978 ( 0.000 -3.559 13.437) 13.900 26.086 ( -0.000 -6.175 -5.588) 8.327 26.104 ( 0.000 -1.945 2.744) 3.363 26.444 ( 0.000 -5.215 -1.301) 5.375 26.550 ( -0.000 -3.228 1.915) 3.754 26.559 ( 0.000 -8.023 2.588) 8.430 26.692 ( 0.000 -16.161 2.160) 16.305 27.014 ( -0.000 -2.135 -22.406) 22.507 27.016 ( 0.000 -3.057 -17.134) 17.404 27.780 ( -0.000 -1.206 16.666) 16.710 27.964 ( 0.000 -4.823 18.478) 19.097 28.161 ( 0.000 -0.531 -1.508) 1.599 28.183 ( -0.000 -1.293 1.815) 2.228 28.360 ( 0.000 -6.369 -1.320) 6.505 28.362 ( -0.000 -6.334 0.177) 6.337 28.887 ( -0.000 -1.188 4.886) 5.029 28.900 ( 0.000 -1.671 3.321) 3.718 29.207 ( -0.000 -3.628 -9.289) 9.972 29.232 ( 0.000 -4.131 -7.533) 8.591 29.414 ( 0.000 -3.957 -2.099) 4.479 29.450 ( -0.000 -3.846 -2.414) 4.541 30.015 ( 0.000 -1.493 0.265) 1.516 30.043 ( -0.000 -2.054 1.033) 2.299 30.525 ( 0.000 -2.970 1.911) 3.532 30.561 ( -0.000 -0.263 5.341) 5.347 30.614 ( -0.000 -5.335 -1.531) 5.550 30.622 ( 0.000 -0.795 0.436) 0.907 30.769 ( 0.000 -3.427 -0.049) 3.427 30.801 ( 0.000 -3.116 -1.377) 3.407 30.979 ( 0.000 -7.427 2.621) 7.876 30.987 ( -0.000 -7.407 2.113) 7.702 31.308 ( -0.000 -3.836 -4.936) 6.251 31.367 ( 0.000 -2.504 -4.989) 5.582 31.506 ( -0.000 -2.873 3.601) 4.606 31.506 ( 0.000 -2.954 4.745) 5.589 31.758 ( 0.000 -7.695 -7.084) 10.459 31.888 ( 0.000 -8.201 -5.684) 9.978 32.061 ( -0.000 -4.128 1.185) 4.295 32.116 ( 0.000 -0.849 -0.254) 0.886 32.550 ( 0.000 -5.832 1.126) 5.940 32.607 ( 0.000 -2.288 0.069) 2.289 33.098 ( 0.000 -1.022 5.397) 5.493 33.184 ( -0.000 -3.086 5.964) 6.715 33.668 ( 0.000 0.479 -9.845) 9.857 33.794 ( 0.000 -2.227 -17.920) 18.058 34.422 ( 0.000 0.739 27.518) 27.528 34.747 ( -0.000 -6.486 24.612) 25.452 35.977 ( 0.000 -5.277 -20.328) 21.002 36.130 ( -0.000 -9.606 -15.793) 18.485 ======================= Grid point 75 (31/54) ======================= q-point: ( 0.00 0.36 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.200 ( 0.000 13.197 5.734) 14.389 2.210 ( 0.000 9.009 10.189) 13.601 2.373 ( 0.000 -0.092 -1.199) 1.203 2.603 ( 0.000 10.130 1.526) 10.245 2.733 ( 0.000 4.090 -10.134) 10.928 2.897 ( 0.000 3.208 4.023) 5.146 2.910 ( 0.000 3.465 -7.182) 7.974 2.946 ( 0.000 3.187 -1.195) 3.403 3.008 ( 0.000 3.518 -2.544) 4.341 3.064 ( 0.000 -0.347 -0.698) 0.779 3.176 ( 0.000 -2.134 3.175) 3.826 3.183 ( 0.000 15.967 2.907) 16.230 3.196 ( 0.000 6.735 4.835) 8.291 3.289 ( 0.000 4.156 -1.826) 4.540 3.306 ( 0.000 1.394 2.087) 2.510 3.319 ( 0.000 5.530 -5.487) 7.790 3.427 ( 0.000 -1.236 -2.507) 2.795 3.452 ( 0.000 5.393 1.416) 5.576 3.520 ( 0.000 0.529 1.364) 1.463 3.571 ( 0.000 0.932 0.880) 1.282 3.676 ( 0.000 -0.630 5.934) 5.968 3.793 ( 0.000 -2.289 7.419) 7.764 3.898 ( 0.000 -1.787 -4.104) 4.476 3.923 ( 0.000 14.875 2.701) 15.118 4.119 ( 0.000 -6.207 -0.592) 6.236 4.178 ( 0.000 3.673 -1.524) 3.977 4.184 ( 0.000 -8.124 2.267) 8.435 4.341 ( 0.000 -4.520 4.476) 6.361 4.371 ( 0.000 0.759 -2.811) 2.912 4.585 ( 0.000 -6.506 -3.350) 7.318 4.698 ( 0.000 -3.051 5.143) 5.980 4.958 ( 0.000 -5.186 -3.939) 6.512 5.024 ( 0.000 1.031 2.381) 2.595 5.133 ( 0.000 -2.177 -2.093) 3.020 5.736 ( 0.000 -0.237 -1.500) 1.518 5.811 ( 0.000 -2.350 -3.968) 4.611 6.060 ( 0.000 -0.950 10.054) 10.098 6.280 ( 0.000 -5.115 5.798) 7.732 6.328 ( 0.000 -4.709 3.421) 5.821 6.395 ( 0.000 -1.196 5.741) 5.864 6.424 ( 0.000 -8.509 1.494) 8.639 6.591 ( 0.000 -0.535 6.231) 6.254 6.751 ( 0.000 -1.605 2.476) 2.950 6.776 ( 0.000 -3.425 14.029) 14.441 6.976 ( 0.000 -5.411 -11.198) 12.437 7.057 ( 0.000 -3.000 0.592) 3.058 7.286 ( 0.000 -3.807 -13.841) 14.355 7.519 ( 0.000 -1.757 -6.211) 6.455 7.713 ( 0.000 1.289 7.737) 7.844 7.715 ( 0.000 -0.452 5.390) 5.408 7.885 ( 0.000 -4.786 3.046) 5.673 8.045 ( 0.000 -1.477 -5.493) 5.688 8.181 ( 0.000 -0.219 6.559) 6.563 8.198 ( 0.000 0.479 -9.709) 9.721 8.243 ( 0.000 -15.818 -7.443) 17.481 8.455 ( 0.000 -4.221 5.676) 7.074 8.594 ( 0.000 2.695 -6.562) 7.094 8.610 ( 0.000 -0.527 -10.484) 10.497 8.688 ( 0.000 3.846 8.116) 8.981 8.798 ( 0.000 0.529 -0.602) 0.801 8.799 ( 0.000 -0.620 -14.550) 14.563 9.140 ( 0.000 1.830 -2.281) 2.925 9.279 ( 0.000 -1.582 -2.457) 2.922 9.437 ( 0.000 0.528 -5.706) 5.731 9.599 ( 0.000 -0.079 -20.843) 20.843 9.662 ( 0.000 0.803 -17.759) 17.777 9.772 ( 0.000 -0.267 0.914) 0.952 9.784 ( 0.000 -2.174 -2.586) 3.378 9.984 ( 0.000 1.085 5.865) 5.964 10.204 ( 0.000 -2.409 -8.881) 9.202 10.262 ( 0.000 -4.261 7.975) 9.042 10.306 ( 0.000 -0.583 3.662) 3.708 10.450 ( 0.000 -1.345 20.448) 20.492 10.574 ( 0.000 -4.275 -6.065) 7.421 10.601 ( 0.000 1.776 -4.332) 4.682 10.760 ( 0.000 -5.199 -0.391) 5.214 10.818 ( 0.000 -5.500 2.658) 6.109 11.009 ( 0.000 -3.999 -6.050) 7.252 11.010 ( 0.000 -4.116 6.698) 7.861 11.080 ( 0.000 -2.700 -5.449) 6.081 11.191 ( 0.000 -0.628 1.184) 1.341 11.290 ( 0.000 0.747 -3.232) 3.317 11.494 ( 0.000 1.496 5.047) 5.264 11.832 ( 0.000 -1.260 20.584) 20.622 11.842 ( 0.000 -2.860 21.931) 22.117 12.024 ( 0.000 -0.843 -6.700) 6.753 12.114 ( 0.000 0.369 11.120) 11.126 12.119 ( 0.000 0.434 4.831) 4.851 12.140 ( 0.000 0.304 6.186) 6.193 12.223 ( 0.000 -0.670 -4.419) 4.469 12.330 ( 0.000 1.125 2.920) 3.130 12.337 ( 0.000 -4.501 -8.711) 9.805 12.344 ( 0.000 1.478 -1.649) 2.215 12.474 ( 0.000 2.073 0.985) 2.295 12.783 ( 0.000 0.932 -6.790) 6.854 12.787 ( 0.000 2.376 -8.844) 9.158 12.816 ( 0.000 0.086 2.990) 2.992 12.896 ( 0.000 0.074 8.873) 8.873 12.915 ( 0.000 -1.761 -0.452) 1.818 12.961 ( 0.000 0.952 5.215) 5.301 13.145 ( 0.000 -4.855 -5.947) 7.677 13.169 ( 0.000 -0.629 7.276) 7.303 13.215 ( 0.000 -2.112 -2.998) 3.667 13.289 ( 0.000 -3.435 -2.657) 4.343 13.607 ( 0.000 -0.543 -11.906) 11.918 13.640 ( 0.000 2.586 -7.509) 7.942 13.711 ( 0.000 0.351 5.077) 5.089 13.895 ( 0.000 0.507 16.961) 16.969 14.052 ( 0.000 3.558 3.423) 4.938 14.198 ( 0.000 0.025 0.269) 0.270 14.410 ( 0.000 0.968 13.281) 13.316 14.530 ( 0.000 -0.197 -6.462) 6.465 14.806 ( 0.000 -0.103 12.162) 12.162 14.978 ( 0.000 3.780 -5.532) 6.700 15.166 ( 0.000 0.735 -19.987) 20.001 15.258 ( 0.000 -2.456 -7.193) 7.600 15.292 ( 0.000 -4.110 -9.345) 10.209 15.570 ( 0.000 3.489 -14.107) 14.532 15.714 ( 0.000 -1.218 5.839) 5.964 15.926 ( 0.000 -0.337 5.751) 5.761 15.928 ( 0.000 0.041 3.805) 3.805 16.047 ( 0.000 3.244 6.822) 7.554 16.262 ( 0.000 1.546 -14.034) 14.119 16.503 ( 0.000 0.719 -9.446) 9.473 16.739 ( 0.000 0.563 13.014) 13.026 17.069 ( 0.000 -0.394 -10.788) 10.796 17.139 ( 0.000 1.352 -5.603) 5.764 17.179 ( 0.000 -0.102 13.824) 13.824 17.274 ( 0.000 -2.276 -6.755) 7.128 17.414 ( 0.000 0.356 12.393) 12.398 17.717 ( 0.000 4.919 5.222) 7.174 17.895 ( 0.000 1.697 18.549) 18.626 17.910 ( 0.000 -0.243 -7.268) 7.272 17.984 ( 0.000 -1.442 8.822) 8.939 18.000 ( 0.000 -0.343 2.200) 2.227 18.055 ( 0.000 -1.116 -3.138) 3.331 18.150 ( 0.000 -1.041 -13.191) 13.232 18.240 ( 0.000 -0.559 -2.174) 2.245 18.445 ( 0.000 0.434 -1.992) 2.038 18.533 ( 0.000 -0.022 -10.516) 10.516 18.601 ( 0.000 1.867 -3.393) 3.873 18.636 ( 0.000 0.471 -3.099) 3.135 18.755 ( 0.000 0.333 0.211) 0.394 18.804 ( 0.000 0.033 4.349) 4.349 18.985 ( 0.000 0.677 -3.751) 3.811 19.025 ( 0.000 0.030 -8.262) 8.262 19.357 ( 0.000 0.286 9.013) 9.017 19.434 ( 0.000 -0.414 8.890) 8.900 19.486 ( 0.000 0.415 7.943) 7.954 19.703 ( 0.000 1.070 -0.017) 1.070 19.899 ( 0.000 -0.303 13.827) 13.830 19.980 ( 0.000 0.063 11.036) 11.036 20.267 ( 0.000 -0.955 8.611) 8.664 20.562 ( 0.000 -0.470 -6.518) 6.535 20.595 ( 0.000 -0.844 -6.694) 6.747 20.690 ( 0.000 -1.105 -4.997) 5.117 20.692 ( 0.000 0.941 -6.685) 6.751 20.799 ( 0.000 -0.656 -0.876) 1.094 20.893 ( 0.000 -0.609 10.699) 10.717 20.933 ( 0.000 -0.086 -12.164) 12.165 20.984 ( 0.000 -1.518 -6.071) 6.257 21.182 ( 0.000 0.675 10.474) 10.496 21.336 ( 0.000 -0.438 2.567) 2.604 21.382 ( 0.000 0.079 -3.527) 3.527 21.756 ( 0.000 -1.001 -9.431) 9.484 22.040 ( 0.000 -2.443 -9.861) 10.159 22.426 ( 0.000 0.136 6.935) 6.937 22.541 ( 0.000 1.675 13.949) 14.049 22.555 ( 0.000 1.440 0.123) 1.446 22.677 ( 0.000 1.807 3.731) 4.146 22.941 ( 0.000 -1.459 -2.974) 3.313 22.948 ( 0.000 0.419 1.787) 1.836 23.133 ( 0.000 -0.294 11.457) 11.461 23.224 ( 0.000 1.583 7.546) 7.710 23.321 ( 0.000 1.013 -11.513) 11.557 23.681 ( 0.000 0.388 -7.555) 7.565 23.729 ( 0.000 0.510 -6.624) 6.644 23.789 ( 0.000 1.972 2.629) 3.286 23.995 ( 0.000 2.888 -6.371) 6.995 24.035 ( 0.000 0.537 6.725) 6.746 24.222 ( 0.000 0.456 -3.105) 3.138 24.293 ( 0.000 1.674 -1.131) 2.020 24.330 ( 0.000 -1.510 -10.654) 10.760 24.488 ( 0.000 0.018 2.402) 2.402 24.496 ( 0.000 -0.070 0.522) 0.527 24.534 ( 0.000 -0.060 -1.395) 1.396 24.954 ( 0.000 -1.323 3.093) 3.364 25.052 ( 0.000 0.495 18.417) 18.424 25.094 ( 0.000 -0.415 11.948) 11.955 25.496 ( 0.000 1.273 -12.458) 12.522 25.660 ( 0.000 0.822 -16.563) 16.583 25.755 ( 0.000 0.571 1.941) 2.023 25.823 ( 0.000 -1.672 -2.661) 3.143 25.935 ( 0.000 -0.260 -20.602) 20.604 26.443 ( 0.000 -0.129 4.063) 4.065 26.452 ( 0.000 -0.454 19.691) 19.696 26.506 ( 0.000 0.057 -0.356) 0.360 27.241 ( 0.000 -2.291 -18.501) 18.642 27.524 ( 0.000 -1.600 8.552) 8.701 27.801 ( 0.000 -1.653 9.451) 9.594 27.803 ( 0.000 -7.036 -3.312) 7.776 27.927 ( 0.000 -5.596 1.125) 5.708 27.935 ( 0.000 -5.679 9.944) 11.452 28.014 ( 0.000 -1.253 -2.130) 2.471 28.463 ( 0.000 -0.289 1.484) 1.512 28.464 ( 0.000 -7.710 1.383) 7.833 28.577 ( 0.000 -0.994 -2.737) 2.912 28.633 ( 0.000 -4.473 -2.252) 5.008 28.997 ( 0.000 -0.456 10.694) 10.704 29.167 ( 0.000 -0.732 2.243) 2.359 29.517 ( 0.000 -1.894 -3.782) 4.230 29.554 ( 0.000 -2.503 -3.770) 4.525 29.681 ( 0.000 -0.488 -19.980) 19.986 29.824 ( 0.000 -3.699 -3.708) 5.238 30.407 ( 0.000 -1.303 13.302) 13.365 30.480 ( 0.000 -5.435 1.371) 5.606 30.590 ( 0.000 -5.354 -2.015) 5.721 30.618 ( 0.000 -1.740 1.393) 2.229 30.701 ( 0.000 -0.358 -1.127) 1.182 30.796 ( 0.000 -1.200 -6.966) 7.068 30.832 ( 0.000 -0.612 11.050) 11.067 31.006 ( 0.000 -2.278 5.237) 5.711 31.254 ( 0.000 -0.412 -5.057) 5.074 31.276 ( 0.000 -4.673 -4.261) 6.324 31.301 ( 0.000 -2.414 9.928) 10.217 31.527 ( 0.000 -1.866 -4.876) 5.220 31.618 ( 0.000 -4.984 -7.739) 9.205 31.835 ( 0.000 -1.549 -15.317) 15.395 31.932 ( 0.000 -2.640 6.836) 7.328 32.116 ( 0.000 -3.876 -2.816) 4.791 32.655 ( 0.000 -3.781 12.828) 13.374 32.702 ( 0.000 -2.253 18.726) 18.861 33.169 ( 0.000 -2.365 -4.562) 5.139 33.349 ( 0.000 -4.457 -9.891) 10.849 33.481 ( 0.000 -1.825 -8.717) 8.906 33.564 ( 0.000 -2.609 -8.727) 9.109 34.025 ( 0.000 -1.161 11.651) 11.708 34.363 ( 0.000 -5.749 0.486) 5.769 35.400 ( 0.000 -6.060 24.480) 25.219 36.639 ( 0.000 -25.069 -23.672) 34.479 ======================= Grid point 76 (32/54) ======================= q-point: ( 0.25 0.36 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 88 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.180 ( 2.813 11.137 3.071) 11.890 2.346 ( 6.087 7.602 3.499) 10.348 2.424 ( 4.602 0.673 -0.753) 4.711 2.597 ( -0.996 9.418 0.638) 9.492 2.693 ( -2.728 6.340 -4.043) 7.999 2.793 ( -8.250 4.172 1.258) 9.330 2.915 ( 0.751 4.008 -4.842) 6.330 2.997 ( 3.395 1.462 0.620) 3.748 3.061 ( 2.804 4.965 -0.414) 5.717 3.073 ( 1.691 -1.829 -3.965) 4.683 3.152 ( 0.171 5.778 -0.301) 5.789 3.194 ( 1.719 4.084 5.014) 6.691 3.244 ( 0.080 6.532 -0.713) 6.572 3.291 ( 1.088 1.747 1.791) 2.728 3.324 ( -0.120 2.640 -0.223) 2.652 3.352 ( 2.554 1.513 2.258) 3.730 3.440 ( 3.376 3.841 -0.394) 5.129 3.463 ( -0.121 4.843 1.307) 5.018 3.524 ( 0.597 0.824 0.829) 1.313 3.582 ( 0.441 3.512 -0.126) 3.542 3.658 ( 1.579 2.765 5.796) 6.613 3.821 ( 2.144 0.778 3.131) 3.873 3.900 ( 1.925 -5.139 -0.607) 5.521 4.023 ( 5.069 7.978 -1.349) 9.548 4.091 ( -2.918 -1.207 -0.857) 3.272 4.145 ( -1.046 -0.728 -1.564) 2.017 4.223 ( 3.662 -6.515 2.703) 7.948 4.344 ( -0.783 0.426 3.746) 3.850 4.372 ( -1.009 0.043 0.634) 1.193 4.513 ( -9.898 0.016 1.889) 10.077 4.624 ( -1.519 -6.976 -0.722) 7.176 4.749 ( -9.827 -0.277 -2.523) 10.150 5.198 ( 7.286 -3.845 -0.644) 8.264 5.235 ( 9.243 -3.633 -1.687) 10.074 5.620 ( -9.629 -0.569 1.014) 9.699 5.714 ( -8.718 -3.360 -2.139) 9.585 6.205 ( -2.811 -4.322 -1.168) 5.287 6.223 ( 0.199 -5.736 -0.545) 5.765 6.286 ( 9.181 -1.316 5.458) 10.761 6.509 ( 12.173 -1.404 14.958) 19.337 6.598 ( 14.250 -4.347 11.147) 18.606 6.679 ( -0.146 -5.120 -8.959) 10.320 6.704 ( -0.323 -4.267 13.017) 13.702 6.931 ( 5.087 -1.361 3.227) 6.176 6.978 ( 11.260 -1.840 -0.477) 11.419 7.065 ( -2.603 -5.291 -1.298) 6.038 7.352 ( 1.652 -0.170 -3.201) 3.606 7.444 ( -2.031 -1.045 -5.327) 5.796 7.515 ( -2.837 -3.798 -5.281) 7.096 7.886 ( -2.817 -2.324 -3.999) 5.415 7.907 ( 1.119 -2.835 2.878) 4.192 7.995 ( 2.326 0.184 5.146) 5.650 8.010 ( -10.846 -3.930 0.616) 11.552 8.104 ( -5.608 -8.110 -2.481) 10.167 8.343 ( -0.461 0.384 -5.903) 5.934 8.380 ( -4.474 -6.493 4.022) 8.851 8.520 ( -2.640 1.272 -2.622) 3.932 8.606 ( -2.851 1.029 -1.673) 3.463 8.659 ( 1.336 1.660 -9.185) 9.429 8.901 ( 6.615 2.086 -3.084) 7.591 8.988 ( -2.422 -2.039 2.570) 4.078 9.082 ( -3.449 0.538 -10.658) 11.215 9.185 ( -5.375 -1.043 -9.167) 10.678 9.210 ( -17.922 0.732 -9.517) 20.306 9.544 ( -1.738 -0.350 -2.413) 2.994 9.716 ( -2.192 -0.234 5.169) 5.619 9.795 ( 4.467 -1.095 -16.840) 17.456 9.829 ( -1.158 -2.000 2.097) 3.121 9.890 ( -4.031 0.818 6.627) 7.800 10.028 ( 6.553 -1.500 0.534) 6.744 10.179 ( -7.939 -3.009 1.267) 8.584 10.278 ( -5.060 -2.130 -13.996) 15.035 10.328 ( -2.679 -1.464 1.598) 3.446 10.492 ( -5.688 -1.314 -3.426) 6.769 10.591 ( -2.510 -1.443 7.451) 7.993 10.760 ( -5.705 -2.116 -4.343) 7.476 10.810 ( 0.421 -4.703 -4.235) 6.342 10.957 ( -2.654 -4.649 4.040) 6.707 11.133 ( 4.952 -1.028 0.564) 5.089 11.237 ( -0.478 0.359 2.208) 2.288 11.271 ( 13.520 -4.204 -0.725) 14.177 11.368 ( 7.486 -1.477 -1.548) 7.786 11.431 ( -1.520 -0.778 8.083) 8.262 11.795 ( -6.563 -1.197 7.982) 10.402 11.883 ( 2.046 -0.002 12.020) 12.193 12.012 ( 0.760 -0.905 3.500) 3.694 12.099 ( -1.452 0.432 13.788) 13.871 12.113 ( 0.507 2.252 6.887) 7.263 12.208 ( 4.131 -1.750 0.264) 4.495 12.287 ( 5.149 -2.791 0.928) 5.930 12.325 ( -0.232 -1.435 -1.713) 2.247 12.365 ( 2.949 -1.558 -4.378) 5.504 12.470 ( 2.768 2.797 0.990) 4.058 12.541 ( 9.034 3.995 -0.727) 9.904 12.663 ( -4.137 1.157 -2.125) 4.792 12.683 ( -6.078 0.246 -7.903) 9.973 12.786 ( -6.070 -1.311 -0.505) 6.230 12.855 ( 1.927 -0.791 2.451) 3.217 12.983 ( -3.990 -1.898 0.766) 4.485 13.012 ( 3.482 0.459 6.972) 7.807 13.169 ( 10.152 -2.048 0.487) 10.368 13.193 ( -0.062 -1.155 -1.515) 1.906 13.273 ( 3.107 -0.133 -5.026) 5.910 13.437 ( 15.511 -2.347 6.404) 16.944 13.508 ( -3.050 1.002 -9.973) 10.477 13.702 ( 6.850 -0.151 3.193) 7.559 13.882 ( -0.617 0.017 11.545) 11.561 13.941 ( 5.466 2.011 10.267) 11.804 14.136 ( 0.543 2.255 -6.111) 6.536 14.219 ( -12.925 -0.510 5.207) 13.944 14.324 ( 19.682 0.155 -5.125) 20.339 14.647 ( 6.610 -0.355 -1.278) 6.742 14.903 ( 6.407 -0.043 7.622) 9.957 14.940 ( -4.088 3.785 -7.238) 9.134 15.054 ( -2.210 -0.469 -9.742) 10.001 15.192 ( -4.840 -2.262 -3.475) 6.373 15.232 ( -3.814 -2.987 -5.148) 7.069 15.455 ( -10.593 2.196 -11.681) 15.921 15.727 ( -5.685 2.203 3.548) 7.054 15.813 ( -4.029 0.019 4.118) 5.761 15.973 ( -1.669 1.197 4.655) 5.088 16.016 ( 3.271 0.021 3.808) 5.020 16.215 ( -19.943 -0.050 7.943) 21.467 16.403 ( -5.193 0.960 -5.673) 7.751 16.716 ( -4.057 0.217 -3.489) 5.355 16.740 ( -2.300 0.497 -8.989) 9.292 17.047 ( -1.487 0.901 -9.544) 9.701 17.200 ( -6.324 -1.983 -10.549) 12.458 17.465 ( 6.546 1.241 7.540) 10.062 17.556 ( 9.971 -0.248 1.820) 10.139 17.747 ( -2.105 1.654 4.737) 5.442 17.837 ( -0.690 0.249 5.967) 6.012 17.933 ( -2.397 0.799 1.451) 2.913 17.972 ( -4.172 -0.365 -2.985) 5.143 18.001 ( 1.987 -0.990 -1.686) 2.788 18.070 ( -3.078 -1.779 -3.389) 4.911 18.186 ( 11.699 0.268 5.952) 13.129 18.248 ( 4.936 0.298 4.724) 6.838 18.502 ( 3.851 1.160 -3.540) 5.359 18.546 ( -0.237 1.582 -5.191) 5.432 18.586 ( -0.261 0.760 -1.989) 2.145 18.653 ( 0.310 0.257 -2.174) 2.211 18.735 ( -4.691 0.225 -0.074) 4.697 18.763 ( -3.001 -0.616 1.802) 3.554 18.995 ( 3.066 0.557 0.623) 3.178 19.086 ( 4.283 0.002 -6.266) 7.590 19.387 ( 2.240 -0.500 10.958) 11.196 19.456 ( 1.011 -0.719 11.622) 11.688 19.620 ( 12.243 0.683 6.203) 13.741 19.823 ( 8.378 0.684 6.368) 10.546 20.018 ( 11.102 0.654 4.238) 11.902 20.062 ( 8.506 0.184 4.873) 9.805 20.241 ( -2.483 -0.387 6.627) 7.087 20.392 ( -10.647 -0.504 -8.279) 13.496 20.551 ( -8.065 0.710 -3.496) 8.819 20.605 ( 0.320 -1.269 -6.375) 6.508 20.734 ( -7.453 -1.224 3.702) 8.411 20.804 ( -5.853 0.135 0.467) 5.873 20.845 ( 1.549 -0.207 -1.132) 1.930 20.949 ( -2.545 -1.117 -8.834) 9.261 20.976 ( 5.326 -0.384 -0.063) 5.340 21.093 ( -8.052 -0.644 -2.791) 8.546 21.178 ( -2.645 -1.329 0.758) 3.055 21.330 ( -6.038 -0.035 -3.572) 7.016 22.006 ( 7.598 -0.097 -3.652) 8.430 22.073 ( -0.719 -0.129 -2.611) 2.712 22.283 ( -4.619 1.379 9.151) 10.344 22.328 ( -0.841 -0.691 10.785) 10.840 22.712 ( 3.810 1.339 -2.798) 4.913 22.848 ( 11.391 1.456 0.321) 11.488 22.933 ( -1.190 -0.987 -6.010) 6.205 22.999 ( 0.812 -0.105 -2.972) 3.082 23.136 ( -5.769 1.292 7.936) 9.896 23.198 ( 7.403 0.141 12.982) 14.945 23.271 ( -3.326 1.197 -5.831) 6.819 23.629 ( -8.955 0.493 0.768) 9.002 23.687 ( -0.214 0.142 -7.234) 7.238 23.764 ( -2.846 1.786 -0.138) 3.363 23.946 ( -6.065 2.969 -0.520) 6.772 23.977 ( -9.519 -0.159 -2.046) 9.738 23.996 ( -5.746 -0.361 -2.086) 6.123 24.173 ( -7.686 0.396 -13.322) 15.386 24.359 ( 9.340 1.365 5.714) 11.034 24.586 ( 5.365 1.641 1.109) 5.719 24.777 ( 10.986 1.285 6.407) 12.782 24.873 ( 25.151 -2.470 0.440) 25.275 24.922 ( 3.185 -0.865 1.711) 3.718 25.229 ( 8.217 0.258 -3.104) 8.787 25.317 ( 2.582 -1.494 -2.719) 4.036 25.444 ( 22.892 -1.042 12.473) 26.091 25.618 ( -2.016 0.329 -12.395) 12.562 25.707 ( 0.131 0.197 -1.816) 1.831 25.802 ( 0.970 -1.516 -1.255) 2.194 26.199 ( 7.028 -0.355 -8.173) 10.785 26.366 ( -5.909 -0.588 15.622) 16.712 26.499 ( -0.470 -0.045 -0.365) 0.597 26.558 ( 14.759 -0.687 -5.696) 15.834 27.060 ( -35.458 -4.872 1.082) 35.807 27.090 ( -26.624 -5.862 -10.286) 29.137 27.341 ( -26.548 -6.218 -8.102) 28.445 27.678 ( 3.161 -0.505 11.960) 12.381 27.940 ( 0.198 -4.302 15.377) 15.968 28.043 ( 4.840 -0.358 -3.769) 6.145 28.271 ( 5.056 -3.483 -2.484) 6.623 28.303 ( -11.850 -2.564 2.255) 12.332 28.390 ( -7.396 -1.912 -0.951) 7.698 28.620 ( 7.762 -2.607 8.963) 12.140 28.818 ( 14.678 -2.773 -4.231) 15.525 29.106 ( 4.560 -1.023 0.416) 4.692 29.132 ( -1.570 -1.587 2.940) 3.691 29.438 ( -5.212 -2.034 -6.095) 8.274 29.506 ( -6.810 -3.345 -7.784) 10.870 29.837 ( 6.064 -1.598 -2.394) 6.712 29.904 ( 14.103 -1.534 -7.853) 16.215 30.401 ( -0.421 -1.907 10.227) 10.411 30.527 ( 3.737 -3.279 3.280) 5.957 30.580 ( -1.212 -3.552 -1.538) 4.056 30.641 ( 0.879 -2.122 -0.609) 2.377 30.681 ( -0.189 -1.793 -0.440) 1.856 30.710 ( -1.683 -1.232 2.911) 3.581 30.921 ( -6.210 -2.181 3.314) 7.370 31.031 ( 7.993 -1.116 1.638) 8.235 31.118 ( -8.644 -4.428 -5.851) 11.338 31.315 ( 4.415 -1.089 -4.755) 6.579 31.369 ( 5.891 -2.681 6.916) 9.472 31.508 ( -2.860 -2.117 -2.216) 4.192 31.651 ( 1.094 -4.606 -5.945) 7.600 31.789 ( -3.880 -3.470 -7.862) 9.429 31.964 ( 2.407 -2.974 4.567) 5.958 32.122 ( -0.246 -1.608 -3.086) 3.488 32.436 ( -7.249 -4.076 10.822) 13.649 32.841 ( -12.851 -1.584 -0.816) 12.974 32.961 ( 0.041 -4.314 4.073) 5.933 33.188 ( -3.401 -1.929 1.741) 4.280 33.603 ( 4.713 -0.837 -8.056) 9.371 33.719 ( 4.830 -3.704 -16.352) 17.448 34.159 ( 12.831 -2.307 16.645) 21.143 34.532 ( 10.909 -8.984 10.107) 17.375 35.425 ( 7.219 -5.582 11.303) 14.527 36.400 ( -23.078 -21.096 -21.017) 37.674 ======================= Grid point 77 (33/54) ======================= q-point: (-0.50 0.36 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.240 ( 0.000 10.545 -2.537) 10.845 2.407 ( 0.000 2.557 -3.663) 4.468 2.485 ( 0.000 8.483 1.347) 8.589 2.554 ( -0.000 8.915 3.356) 9.525 2.678 ( 0.000 4.337 -1.006) 4.452 2.691 ( -0.000 2.888 2.962) 4.137 2.938 ( 0.000 4.424 -4.909) 6.608 3.024 ( 0.000 2.392 2.524) 3.477 3.036 ( -0.000 2.338 -6.047) 6.484 3.108 ( 0.000 0.847 -2.109) 2.272 3.186 ( -0.000 2.925 4.517) 5.381 3.215 ( 0.000 6.071 1.965) 6.381 3.285 ( 0.000 1.714 -1.392) 2.208 3.304 ( 0.000 -0.926 2.646) 2.803 3.316 ( -0.000 1.673 1.171) 2.042 3.335 ( 0.000 -0.405 0.835) 0.928 3.467 ( 0.000 6.766 1.896) 7.027 3.488 ( 0.000 6.997 2.042) 7.289 3.537 ( 0.000 3.244 1.034) 3.404 3.594 ( 0.000 3.055 2.538) 3.972 3.725 ( 0.000 3.800 -0.425) 3.824 3.847 ( 0.000 1.972 1.424) 2.432 3.907 ( 0.000 -2.468 -1.654) 2.971 4.014 ( 0.000 -5.940 -0.160) 5.942 4.121 ( 0.000 -3.059 -1.691) 3.495 4.156 ( -0.000 12.757 -2.916) 13.086 4.293 ( 0.000 -5.760 5.396) 7.892 4.294 ( -0.000 1.133 4.724) 4.858 4.334 ( 0.000 1.951 3.931) 4.388 4.363 ( -0.000 -3.003 5.665) 6.412 4.627 ( 0.000 -3.388 -5.934) 6.833 4.652 ( 0.000 -0.349 -4.999) 5.011 5.294 ( 0.000 -1.603 -2.266) 2.776 5.385 ( 0.000 -4.626 -4.621) 6.539 5.481 ( -0.000 -3.007 5.073) 5.898 5.557 ( -0.000 -4.982 2.781) 5.706 6.185 ( 0.000 -5.517 -5.088) 7.505 6.195 ( -0.000 -5.033 -4.504) 6.754 6.449 ( -0.000 -1.737 2.962) 3.434 6.533 ( 0.000 -5.280 4.239) 6.771 6.664 ( 0.000 -1.408 15.074) 15.140 6.727 ( 0.000 -2.503 15.386) 15.588 6.882 ( -0.000 -0.412 -4.613) 4.631 7.043 ( 0.000 -1.632 -5.863) 6.086 7.092 ( 0.000 -6.680 2.016) 6.977 7.133 ( -0.000 -2.955 -0.895) 3.088 7.327 ( 0.000 -2.799 2.874) 4.012 7.410 ( 0.000 -1.901 -0.558) 1.981 7.608 ( 0.000 -1.891 6.804) 7.062 7.691 ( 0.000 -3.327 -0.963) 3.464 7.838 ( -0.000 -3.533 -4.760) 5.928 7.902 ( 0.000 0.504 -1.435) 1.521 8.054 ( -0.000 -8.307 -0.698) 8.337 8.095 ( 0.000 -4.498 -0.949) 4.597 8.229 ( -0.000 -0.211 -2.250) 2.260 8.373 ( 0.000 -3.550 5.056) 6.177 8.507 ( 0.000 0.683 0.603) 0.912 8.562 ( -0.000 -0.651 11.342) 11.361 8.673 ( 0.000 1.696 -3.949) 4.298 8.709 ( -0.000 0.845 -8.987) 9.027 8.934 ( -0.000 0.263 -5.124) 5.131 8.934 ( 0.000 1.010 -7.106) 7.177 9.183 ( -0.000 -0.406 -13.459) 13.465 9.302 ( 0.000 -3.068 -15.226) 15.532 9.513 ( 0.000 1.591 0.833) 1.796 9.638 ( -0.000 0.187 -2.827) 2.833 9.838 ( 0.000 0.669 -0.497) 0.833 9.880 ( 0.000 -0.321 -3.837) 3.851 9.927 ( -0.000 -0.515 0.631) 0.814 9.988 ( -0.000 -3.681 -2.157) 4.266 10.126 ( 0.000 -0.975 -13.209) 13.245 10.132 ( -0.000 -0.851 -9.800) 9.836 10.395 ( -0.000 -2.707 3.376) 4.328 10.486 ( -0.000 -4.426 6.433) 7.808 10.588 ( 0.000 -0.182 5.974) 5.977 10.624 ( -0.000 -1.307 3.203) 3.459 10.866 ( 0.000 -4.955 -3.436) 6.030 10.892 ( -0.000 -5.549 -4.522) 7.158 11.123 ( -0.000 0.636 4.599) 4.642 11.251 ( -0.000 -1.509 -0.962) 1.789 11.386 ( -0.000 0.305 0.251) 0.395 11.430 ( 0.000 -1.445 10.624) 10.722 11.546 ( 0.000 -1.442 -6.272) 6.436 11.624 ( -0.000 -3.939 -2.307) 4.565 11.919 ( 0.000 2.888 4.166) 5.069 12.052 ( -0.000 0.169 10.800) 10.801 12.074 ( -0.000 0.998 11.383) 11.426 12.101 ( 0.000 -0.884 13.915) 13.943 12.238 ( 0.000 -0.538 2.742) 2.794 12.290 ( -0.000 -1.963 5.982) 6.295 12.365 ( 0.000 -1.128 -2.951) 3.159 12.453 ( 0.000 -1.565 0.817) 1.765 12.475 ( -0.000 1.957 -2.411) 3.106 12.572 ( -0.000 -1.067 -3.276) 3.445 12.623 ( -0.000 0.313 -5.826) 5.834 12.634 ( 0.000 0.446 -0.370) 0.579 12.741 ( 0.000 0.456 -1.542) 1.608 12.856 ( 0.000 -1.659 -4.186) 4.503 13.026 ( -0.000 -0.172 5.254) 5.257 13.051 ( 0.000 -0.666 6.191) 6.226 13.255 ( -0.000 3.832 -3.595) 5.254 13.276 ( -0.000 0.249 -2.095) 2.110 13.329 ( 0.000 0.089 -4.575) 4.576 13.380 ( 0.000 -1.783 -4.650) 4.980 13.715 ( 0.000 -0.345 10.514) 10.520 13.751 ( -0.000 -1.447 7.738) 7.872 13.854 ( -0.000 1.645 3.281) 3.670 13.971 ( 0.000 -0.888 2.813) 2.950 14.060 ( 0.000 0.360 3.357) 3.376 14.123 ( 0.000 -0.658 4.218) 4.269 14.651 ( 0.000 1.392 -7.294) 7.425 14.729 ( -0.000 2.924 -3.350) 4.446 14.787 ( -0.000 -2.041 -13.864) 14.013 14.985 ( -0.000 -1.485 -10.134) 10.242 15.075 ( 0.000 0.979 -0.384) 1.051 15.205 ( 0.000 -0.930 -7.748) 7.804 15.280 ( -0.000 1.071 1.029) 1.485 15.326 ( -0.000 -0.745 -2.585) 2.691 15.521 ( 0.000 2.089 16.878) 17.007 15.653 ( 0.000 -1.636 14.354) 14.447 15.961 ( 0.000 0.363 7.784) 7.793 15.992 ( -0.000 -0.422 4.767) 4.786 16.169 ( -0.000 1.831 -1.783) 2.556 16.170 ( 0.000 1.266 1.100) 1.677 16.740 ( 0.000 -0.224 -15.051) 15.052 16.752 ( -0.000 -0.079 -15.941) 15.941 17.077 ( 0.000 0.045 -11.702) 11.702 17.084 ( -0.000 -0.030 -13.993) 13.993 17.545 ( -0.000 2.260 2.052) 3.053 17.679 ( -0.000 -1.179 3.525) 3.717 17.720 ( -0.000 0.462 5.445) 5.464 17.769 ( 0.000 -0.738 5.348) 5.399 17.897 ( -0.000 -0.650 -1.344) 1.493 17.901 ( 0.000 -0.066 0.991) 0.993 17.993 ( 0.000 0.297 -5.796) 5.804 18.068 ( 0.000 -2.223 -3.642) 4.266 18.371 ( 0.000 1.506 6.191) 6.372 18.397 ( -0.000 0.988 5.945) 6.027 18.518 ( -0.000 2.729 -1.218) 2.989 18.530 ( 0.000 1.818 8.128) 8.329 18.582 ( -0.000 0.130 -4.978) 4.979 18.627 ( 0.000 -0.805 1.817) 1.988 18.638 ( 0.000 0.162 -0.421) 0.451 18.736 ( 0.000 -1.280 -2.547) 2.851 19.062 ( 0.000 1.312 -0.794) 1.534 19.127 ( 0.000 -0.570 -1.519) 1.623 19.422 ( -0.000 -0.809 14.044) 14.068 19.455 ( 0.000 -1.304 13.407) 13.470 19.839 ( -0.000 0.440 5.804) 5.821 19.846 ( 0.000 0.392 5.774) 5.787 20.196 ( -0.000 0.480 4.734) 4.758 20.212 ( 0.000 0.676 2.417) 2.510 20.271 ( -0.000 1.011 0.667) 1.211 20.289 ( 0.000 1.363 -3.779) 4.018 20.425 ( 0.000 -0.603 -6.528) 6.556 20.462 ( -0.000 -1.385 -8.490) 8.602 20.637 ( -0.000 -1.285 -3.990) 4.192 20.656 ( -0.000 -2.151 -3.671) 4.254 20.950 ( 0.000 -0.153 3.164) 3.168 20.957 ( -0.000 -0.477 4.207) 4.234 21.029 ( 0.000 0.920 -3.869) 3.977 21.105 ( -0.000 -2.119 -4.672) 5.130 21.146 ( 0.000 0.191 -1.405) 1.418 21.153 ( 0.000 -0.828 -3.725) 3.816 21.941 ( 0.000 1.173 6.562) 6.666 22.004 ( 0.000 -0.525 6.510) 6.531 22.396 ( -0.000 0.893 2.067) 2.252 22.439 ( 0.000 -0.317 2.127) 2.150 22.757 ( 0.000 1.531 -5.847) 6.044 22.768 ( -0.000 1.202 -5.787) 5.910 23.000 ( -0.000 -0.975 -1.984) 2.210 23.002 ( 0.000 -1.046 -2.062) 2.312 23.165 ( 0.000 1.259 3.162) 3.403 23.173 ( -0.000 1.240 4.573) 4.738 23.412 ( -0.000 0.525 6.827) 6.847 23.416 ( 0.000 0.614 5.537) 5.571 23.689 ( -0.000 0.748 -5.425) 5.476 23.699 ( 0.000 0.348 -6.115) 6.125 23.846 ( 0.000 0.737 1.622) 1.781 23.849 ( -0.000 1.173 2.376) 2.650 24.038 ( -0.000 0.989 -8.119) 8.179 24.054 ( 0.000 0.786 -8.773) 8.808 24.525 ( 0.000 2.410 6.903) 7.312 24.561 ( -0.000 1.492 5.513) 5.712 24.978 ( 0.000 2.139 -0.700) 2.251 25.001 ( -0.000 1.948 -1.317) 2.351 25.078 ( -0.000 -1.738 -7.287) 7.492 25.116 ( 0.000 -2.606 -8.220) 8.623 25.586 ( -0.000 -0.417 7.278) 7.290 25.624 ( 0.000 -1.168 5.047) 5.181 25.764 ( 0.000 -0.997 -1.647) 1.925 25.875 ( 0.000 -5.198 -0.090) 5.199 26.031 ( -0.000 -0.749 4.776) 4.834 26.072 ( 0.000 -1.453 5.545) 5.732 26.327 ( 0.000 -4.798 3.655) 6.032 26.404 ( 0.000 -8.517 2.192) 8.794 26.500 ( -0.000 -0.490 -1.273) 1.364 26.546 ( 0.000 -1.937 0.927) 2.148 26.968 ( -0.000 -1.819 -17.265) 17.360 26.975 ( 0.000 -1.731 -20.363) 20.436 27.771 ( -0.000 0.281 16.399) 16.402 27.886 ( 0.000 -3.268 17.726) 18.025 28.154 ( -0.000 -0.160 -2.039) 2.045 28.161 ( 0.000 -0.809 0.913) 1.219 28.251 ( 0.000 -4.492 -1.537) 4.748 28.258 ( -0.000 -4.197 -1.348) 4.409 28.868 ( -0.000 -0.714 4.715) 4.769 28.875 ( 0.000 -0.912 3.790) 3.899 29.143 ( -0.000 -2.740 -6.634) 7.178 29.155 ( 0.000 -3.313 -5.598) 6.505 29.356 ( 0.000 -1.905 -3.686) 4.149 29.386 ( 0.000 -2.573 -3.857) 4.636 29.992 ( 0.000 -0.747 -0.258) 0.790 30.010 ( -0.000 -1.326 0.097) 1.329 30.467 ( 0.000 -2.584 -0.202) 2.592 30.504 ( -0.000 -4.334 -0.627) 4.379 30.574 ( 0.000 0.575 4.962) 4.995 30.612 ( 0.000 -0.191 3.552) 3.557 30.716 ( 0.000 -2.071 -0.058) 2.072 30.752 ( 0.000 -2.273 -1.496) 2.721 30.857 ( 0.000 -4.589 0.374) 4.604 30.865 ( -0.000 -4.688 -0.340) 4.700 31.264 ( -0.000 -0.950 -4.444) 4.544 31.322 ( 0.000 -2.059 -5.564) 5.933 31.460 ( -0.000 -1.756 2.671) 3.196 31.462 ( 0.000 -1.615 4.708) 4.978 31.638 ( 0.000 -4.268 -4.392) 6.124 31.733 ( 0.000 -6.828 -3.198) 7.540 32.006 ( -0.000 -1.423 3.024) 3.342 32.088 ( 0.000 -2.061 2.794) 3.472 32.462 ( -0.000 -2.776 -1.894) 3.360 32.546 ( 0.000 -3.520 -1.806) 3.956 33.070 ( 0.000 -1.600 4.576) 4.847 33.116 ( -0.000 -3.416 4.994) 6.050 33.665 ( 0.000 -0.501 -10.283) 10.295 33.736 ( 0.000 -3.160 -15.032) 15.360 34.383 ( 0.000 -3.265 23.268) 23.496 34.565 ( -0.000 -10.139 20.816) 23.154 35.795 ( 0.000 -10.416 -13.450) 17.012 35.872 ( -0.000 -13.689 -11.547) 17.908 ======================= Grid point 80 (34/54) ======================= q-point: ( 0.00 0.45 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.345 ( 0.000 1.210 1.466) 1.901 2.385 ( 0.000 7.349 4.390) 8.560 2.419 ( 0.000 4.225 0.236) 4.232 2.664 ( 0.000 -2.887 -9.450) 9.881 2.833 ( 0.000 6.138 -1.951) 6.441 2.903 ( 0.000 0.671 4.567) 4.616 2.930 ( 0.000 -1.235 -4.775) 4.932 2.957 ( 0.000 -1.091 -0.395) 1.161 2.999 ( 0.000 -2.704 -0.448) 2.741 3.057 ( 0.000 -0.642 -2.207) 2.298 3.255 ( 0.000 1.700 11.641) 11.765 3.275 ( 0.000 5.047 -0.255) 5.054 3.310 ( 0.000 1.342 -0.542) 1.447 3.357 ( 0.000 0.405 3.394) 3.418 3.397 ( 0.000 1.173 -1.989) 2.309 3.447 ( 0.000 2.822 -3.010) 4.126 3.457 ( 0.000 8.679 0.639) 8.702 3.527 ( 0.000 1.623 -0.077) 1.625 3.533 ( 0.000 0.188 1.018) 1.035 3.567 ( 0.000 -0.743 2.313) 2.430 3.662 ( 0.000 -0.360 3.660) 3.678 3.774 ( 0.000 1.634 4.940) 5.203 3.850 ( 0.000 -3.186 1.574) 3.553 4.014 ( 0.000 -4.979 0.397) 4.995 4.015 ( 0.000 -2.255 1.560) 2.742 4.193 ( 0.000 4.946 2.525) 5.553 4.277 ( 0.000 3.697 -5.480) 6.610 4.287 ( 0.000 -0.477 4.116) 4.144 4.431 ( 0.000 3.248 -3.029) 4.441 4.478 ( 0.000 -1.765 -1.962) 2.639 4.650 ( 0.000 -1.834 4.507) 4.866 4.864 ( 0.000 -3.279 -3.035) 4.468 5.024 ( 0.000 -0.637 1.583) 1.706 5.093 ( 0.000 -1.197 -1.344) 1.800 5.744 ( 0.000 1.023 -2.177) 2.405 5.773 ( 0.000 -1.666 -2.991) 3.423 6.050 ( 0.000 -0.147 9.166) 9.167 6.190 ( 0.000 -2.890 -0.485) 2.930 6.232 ( 0.000 -3.579 -2.012) 4.105 6.339 ( 0.000 -1.117 8.508) 8.581 6.370 ( 0.000 -0.867 10.877) 10.911 6.586 ( 0.000 -0.068 2.186) 2.187 6.724 ( 0.000 -0.837 3.063) 3.175 6.734 ( 0.000 -0.867 13.703) 13.730 6.901 ( 0.000 -2.147 -9.741) 9.975 7.014 ( 0.000 -1.153 0.175) 1.166 7.196 ( 0.000 -3.926 -14.775) 15.288 7.479 ( 0.000 -1.415 -7.517) 7.649 7.716 ( 0.000 0.546 7.158) 7.179 7.744 ( 0.000 1.118 9.112) 9.181 7.796 ( 0.000 -2.890 -3.046) 4.199 7.906 ( 0.000 -8.153 2.728) 8.598 8.067 ( 0.000 -1.781 -3.951) 4.334 8.203 ( 0.000 0.100 -8.969) 8.969 8.207 ( 0.000 1.631 6.368) 6.573 8.391 ( 0.000 -2.110 1.934) 2.862 8.601 ( 0.000 -0.290 -10.818) 10.822 8.644 ( 0.000 1.408 0.690) 1.568 8.749 ( 0.000 1.790 6.769) 7.001 8.791 ( 0.000 -0.167 -15.097) 15.098 8.801 ( 0.000 -0.012 -6.149) 6.149 9.167 ( 0.000 0.741 -2.784) 2.881 9.255 ( 0.000 -0.639 -2.324) 2.411 9.445 ( 0.000 0.227 -3.533) 3.540 9.598 ( 0.000 -0.027 -20.897) 20.897 9.676 ( 0.000 0.448 -16.109) 16.115 9.751 ( 0.000 -0.923 -2.855) 3.001 9.769 ( 0.000 -0.085 1.119) 1.122 10.010 ( 0.000 1.014 2.924) 3.095 10.176 ( 0.000 -0.503 -7.111) 7.129 10.198 ( 0.000 -1.886 8.316) 8.527 10.297 ( 0.000 -0.260 3.141) 3.152 10.430 ( 0.000 -0.556 22.265) 22.272 10.517 ( 0.000 -1.427 -8.162) 8.286 10.648 ( 0.000 2.914 -2.549) 3.871 10.683 ( 0.000 -2.187 1.106) 2.450 10.719 ( 0.000 -4.284 -0.205) 4.289 10.941 ( 0.000 -2.025 2.819) 3.471 10.951 ( 0.000 -1.575 -5.646) 5.862 11.055 ( 0.000 -0.402 -2.344) 2.379 11.184 ( 0.000 -0.122 0.998) 1.005 11.302 ( 0.000 0.340 -3.952) 3.966 11.515 ( 0.000 0.563 4.101) 4.139 11.804 ( 0.000 -0.933 22.043) 22.063 11.813 ( 0.000 -0.538 17.682) 17.691 12.031 ( 0.000 0.932 -1.038) 1.395 12.115 ( 0.000 -0.062 13.930) 13.930 12.137 ( 0.000 1.122 -0.215) 1.142 12.146 ( 0.000 0.198 3.570) 3.575 12.214 ( 0.000 -0.192 -4.753) 4.757 12.239 ( 0.000 -3.731 -9.104) 9.839 12.345 ( 0.000 0.144 1.826) 1.832 12.363 ( 0.000 0.448 -1.119) 1.205 12.525 ( 0.000 1.947 7.589) 7.835 12.789 ( 0.000 -0.150 -10.785) 10.786 12.802 ( 0.000 -0.846 0.944) 1.268 12.828 ( 0.000 1.846 -7.943) 8.154 12.867 ( 0.000 -1.956 0.886) 2.147 12.912 ( 0.000 0.670 6.533) 6.567 12.989 ( 0.000 0.915 9.514) 9.558 13.075 ( 0.000 -1.857 -5.312) 5.627 13.169 ( 0.000 0.255 8.114) 8.118 13.176 ( 0.000 -1.335 -2.479) 2.816 13.233 ( 0.000 -1.717 -3.252) 3.677 13.600 ( 0.000 -0.169 -12.494) 12.495 13.678 ( 0.000 1.024 -7.063) 7.137 13.711 ( 0.000 -0.107 5.483) 5.484 13.910 ( 0.000 0.598 16.455) 16.466 14.112 ( 0.000 2.094 12.402) 12.577 14.188 ( 0.000 -0.841 -8.519) 8.560 14.423 ( 0.000 0.346 13.541) 13.545 14.529 ( 0.000 0.006 -8.298) 8.298 14.802 ( 0.000 -0.128 11.554) 11.554 15.060 ( 0.000 3.909 -14.189) 14.718 15.176 ( 0.000 0.267 -19.722) 19.724 15.205 ( 0.000 -3.987 -0.685) 4.046 15.223 ( 0.000 -0.927 -6.393) 6.460 15.617 ( 0.000 1.210 -15.831) 15.877 15.697 ( 0.000 -0.437 6.634) 6.648 15.917 ( 0.000 -0.279 2.338) 2.354 15.924 ( 0.000 -0.248 6.298) 6.303 16.096 ( 0.000 1.383 6.829) 6.968 16.284 ( 0.000 0.616 -13.155) 13.169 16.510 ( 0.000 0.071 -6.617) 6.617 16.748 ( 0.000 0.274 11.759) 11.762 17.063 ( 0.000 -0.168 -11.685) 11.687 17.158 ( 0.000 0.497 -6.208) 6.228 17.176 ( 0.000 -0.148 9.843) 9.844 17.243 ( 0.000 -0.762 -2.990) 3.086 17.419 ( 0.000 0.117 10.633) 10.634 17.810 ( 0.000 4.026 2.749) 4.875 17.899 ( 0.000 -1.363 4.121) 4.341 17.921 ( 0.000 0.726 18.421) 18.435 17.941 ( 0.000 -1.835 0.424) 1.883 17.996 ( 0.000 -0.094 2.412) 2.414 18.044 ( 0.000 -0.151 -2.084) 2.089 18.133 ( 0.000 -0.558 -15.249) 15.259 18.232 ( 0.000 -0.194 -2.625) 2.632 18.451 ( 0.000 0.173 -1.654) 1.663 18.532 ( 0.000 -0.030 -10.665) 10.665 18.626 ( 0.000 0.700 -3.456) 3.526 18.642 ( 0.000 0.069 -2.627) 2.628 18.760 ( 0.000 0.145 0.311) 0.343 18.806 ( 0.000 0.062 4.687) 4.687 18.995 ( 0.000 0.256 -3.789) 3.798 19.026 ( 0.000 0.029 -7.802) 7.802 19.362 ( 0.000 0.142 10.381) 10.382 19.428 ( 0.000 -0.172 8.978) 8.979 19.490 ( 0.000 0.091 8.807) 8.807 19.716 ( 0.000 0.298 -0.616) 0.684 19.895 ( 0.000 -0.083 13.229) 13.229 19.981 ( 0.000 0.014 11.252) 11.252 20.257 ( 0.000 -0.209 7.330) 7.333 20.554 ( 0.000 -0.235 -6.562) 6.566 20.581 ( 0.000 -0.433 -5.758) 5.774 20.674 ( 0.000 -0.448 -6.957) 6.971 20.706 ( 0.000 0.360 -7.123) 7.132 20.795 ( 0.000 0.032 0.048) 0.058 20.893 ( 0.000 0.352 9.033) 9.040 20.931 ( 0.000 -0.032 -12.446) 12.446 20.956 ( 0.000 -1.042 -5.346) 5.447 21.192 ( 0.000 0.257 10.183) 10.186 21.330 ( 0.000 -0.179 3.180) 3.185 21.383 ( 0.000 0.022 -6.141) 6.141 21.744 ( 0.000 -0.252 -8.511) 8.515 22.011 ( 0.000 -0.619 -8.984) 9.005 22.428 ( 0.000 0.038 6.700) 6.700 22.566 ( 0.000 0.676 13.265) 13.282 22.575 ( 0.000 0.515 -0.249) 0.572 22.703 ( 0.000 0.699 3.675) 3.741 22.923 ( 0.000 -0.417 -1.997) 2.040 22.955 ( 0.000 0.183 0.646) 0.671 23.126 ( 0.000 -0.201 16.527) 16.528 23.255 ( 0.000 0.982 5.577) 5.663 23.336 ( 0.000 0.415 -14.082) 14.088 23.687 ( 0.000 0.164 -7.674) 7.676 23.739 ( 0.000 0.341 -7.012) 7.020 23.818 ( 0.000 0.783 2.821) 2.928 24.035 ( 0.000 1.046 -6.955) 7.033 24.044 ( 0.000 0.251 6.862) 6.867 24.229 ( 0.000 0.201 -2.806) 2.813 24.297 ( 0.000 -0.500 -20.234) 20.241 24.337 ( 0.000 1.104 6.002) 6.102 24.484 ( 0.000 -0.283 2.151) 2.169 24.495 ( 0.000 -0.018 0.472) 0.472 24.534 ( 0.000 -0.010 -1.438) 1.438 24.939 ( 0.000 -0.321 5.488) 5.497 25.059 ( 0.000 0.189 18.206) 18.207 25.092 ( 0.000 0.063 12.942) 12.943 25.515 ( 0.000 0.540 -12.154) 12.166 25.674 ( 0.000 0.414 -16.644) 16.649 25.769 ( 0.000 0.903 0.942) 1.305 25.792 ( 0.000 -1.379 -0.828) 1.608 25.931 ( 0.000 -0.102 -20.240) 20.240 26.441 ( 0.000 -0.048 4.182) 4.182 26.446 ( 0.000 -0.157 19.037) 19.038 26.506 ( 0.000 0.020 -0.377) 0.377 27.208 ( 0.000 -0.918 -17.889) 17.913 27.499 ( 0.000 -0.703 7.258) 7.292 27.697 ( 0.000 -2.949 -1.824) 3.467 27.783 ( 0.000 -0.262 7.439) 7.444 27.857 ( 0.000 -2.080 11.132) 11.325 27.861 ( 0.000 -1.482 1.573) 2.161 28.002 ( 0.000 -0.251 -3.368) 3.378 28.357 ( 0.000 -2.791 2.588) 3.807 28.460 ( 0.000 -0.075 1.424) 1.426 28.563 ( 0.000 -0.365 -2.495) 2.522 28.571 ( 0.000 -1.625 -2.859) 3.289 28.991 ( 0.000 -0.169 10.884) 10.885 29.157 ( 0.000 -0.250 1.925) 1.941 29.496 ( 0.000 -0.211 1.731) 1.744 29.515 ( 0.000 -1.294 -9.519) 9.606 29.674 ( 0.000 -0.172 -19.692) 19.692 29.778 ( 0.000 -1.101 -4.140) 4.284 30.387 ( 0.000 -0.726 11.750) 11.772 30.413 ( 0.000 -1.452 2.717) 3.081 30.516 ( 0.000 -1.946 -2.511) 3.177 30.595 ( 0.000 -0.544 1.895) 1.972 30.696 ( 0.000 -0.114 -1.272) 1.277 30.780 ( 0.000 -0.411 -7.966) 7.977 30.824 ( 0.000 -0.193 11.146) 11.148 30.975 ( 0.000 -0.760 5.042) 5.099 31.210 ( 0.000 -1.745 -2.282) 2.872 31.245 ( 0.000 -0.327 -5.274) 5.284 31.273 ( 0.000 -0.659 9.480) 9.503 31.509 ( 0.000 -0.074 -5.212) 5.213 31.546 ( 0.000 -2.181 -7.108) 7.435 31.813 ( 0.000 -0.632 -14.885) 14.898 31.894 ( 0.000 -1.015 7.370) 7.440 32.069 ( 0.000 -1.040 -2.046) 2.295 32.603 ( 0.000 -1.396 11.915) 11.997 32.664 ( 0.000 -1.188 17.674) 17.713 33.130 ( 0.000 -1.194 -6.769) 6.873 33.274 ( 0.000 -2.308 -9.278) 9.561 33.449 ( 0.000 -1.002 -7.710) 7.775 33.527 ( 0.000 -1.001 -6.600) 6.676 34.002 ( 0.000 -0.736 10.555) 10.580 34.270 ( 0.000 -2.764 2.277) 3.581 35.302 ( 0.000 -2.877 19.037) 19.253 36.280 ( 0.000 -9.671 -18.341) 20.734 ======================= Grid point 81 (35/54) ======================= q-point: ( 0.25 0.45 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 88 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.369 ( 3.186 5.539 -0.160) 6.392 2.433 ( 1.889 3.445 -0.359) 3.945 2.463 ( 4.864 2.437 2.192) 5.866 2.632 ( -1.866 -3.599 -7.625) 8.635 2.809 ( -1.654 6.153 -0.492) 6.390 2.899 ( -2.595 4.009 1.267) 4.941 2.915 ( -0.127 -2.769 -0.811) 2.888 3.001 ( 0.203 -4.807 0.729) 4.866 3.023 ( 3.032 1.326 -0.639) 3.371 3.069 ( 1.558 -0.794 -1.964) 2.630 3.241 ( 0.020 1.932 8.153) 8.379 3.287 ( 0.063 2.394 0.211) 2.405 3.318 ( -0.601 1.864 0.912) 2.160 3.350 ( 0.159 2.593 3.300) 4.200 3.370 ( -1.294 0.736 0.781) 1.681 3.420 ( -2.140 4.934 0.703) 5.423 3.536 ( 4.514 3.743 -0.877) 5.929 3.546 ( 3.421 1.976 0.376) 3.968 3.564 ( 3.177 2.824 -0.135) 4.252 3.635 ( 2.450 2.378 -0.368) 3.435 3.669 ( 3.907 -0.514 0.740) 4.009 3.794 ( 1.127 -2.809 1.825) 3.535 3.847 ( 3.514 -1.510 2.687) 4.674 3.967 ( -2.554 -3.326 0.763) 4.262 4.091 ( 5.655 -2.967 1.282) 6.514 4.139 ( -8.703 1.057 -3.408) 9.406 4.294 ( 6.683 5.065 1.424) 8.505 4.324 ( -0.981 0.561 6.095) 6.199 4.447 ( 0.144 3.203 -2.950) 4.357 4.490 ( -13.306 -2.863 4.619) 14.373 4.524 ( 4.172 -0.583 -2.926) 5.130 4.739 ( -7.825 -0.731 -4.336) 8.976 5.129 ( 8.327 -2.271 0.826) 8.670 5.178 ( 6.671 -1.745 -0.986) 6.966 5.624 ( -10.279 0.991 0.012) 10.327 5.659 ( -10.195 -2.164 -0.912) 10.462 6.122 ( -2.522 -2.765 -3.491) 5.118 6.151 ( -3.124 -1.863 -3.861) 5.305 6.267 ( 11.782 -0.517 5.430) 12.983 6.490 ( 15.693 -0.032 13.870) 20.944 6.526 ( 10.729 -2.761 15.589) 19.124 6.613 ( -0.404 -1.532 -10.160) 10.283 6.648 ( 0.998 -1.377 12.058) 12.177 6.916 ( 2.144 0.003 3.441) 4.054 6.947 ( 8.323 -1.680 2.939) 8.985 6.963 ( 1.923 -3.360 -5.050) 6.363 7.366 ( 4.310 1.536 -5.083) 6.839 7.410 ( -1.999 -2.191 -1.658) 3.398 7.457 ( -3.363 -1.698 -5.293) 6.497 7.771 ( -4.443 -4.842 -5.567) 8.612 7.849 ( 3.183 -2.552 -2.768) 4.930 7.968 ( -9.867 -1.112 7.099) 12.206 8.002 ( 6.820 0.132 6.728) 9.581 8.023 ( -11.383 -0.337 1.658) 11.508 8.295 ( -5.042 -2.009 2.370) 5.923 8.345 ( 1.062 -0.142 -5.576) 5.678 8.532 ( -4.195 0.223 2.234) 4.758 8.599 ( -0.849 -0.604 -7.681) 7.751 8.709 ( -0.265 1.803 -8.443) 8.637 8.934 ( 1.139 0.882 -1.874) 2.363 8.955 ( -1.620 -0.956 -1.915) 2.685 9.099 ( 11.225 0.839 -7.459) 13.503 9.161 ( -20.368 -0.988 -6.590) 21.430 9.219 ( -17.801 0.137 -7.916) 19.483 9.546 ( -0.549 0.268 -3.616) 3.667 9.711 ( -3.617 -0.300 3.049) 4.740 9.774 ( -1.783 -0.564 0.818) 2.041 9.805 ( 11.764 -0.620 -16.301) 20.113 9.917 ( -7.734 1.244 4.666) 9.117 10.009 ( 7.581 -0.500 1.874) 7.825 10.134 ( -6.463 -1.306 0.496) 6.613 10.250 ( -5.722 -0.747 -4.065) 7.058 10.314 ( -2.256 -0.160 -7.703) 8.028 10.472 ( -9.675 -0.559 -6.494) 11.666 10.569 ( -0.642 -0.621 10.213) 10.252 10.716 ( 2.893 -1.733 -2.610) 4.264 10.754 ( -7.955 -1.065 -3.948) 8.944 10.886 ( -4.036 -2.030 5.931) 7.456 11.140 ( 8.201 1.478 -0.396) 8.343 11.191 ( 17.238 -3.198 -0.579) 17.542 11.250 ( -4.154 0.325 1.993) 4.619 11.346 ( 7.277 -0.663 -1.332) 7.428 11.422 ( -2.650 -0.175 5.842) 6.417 11.779 ( -7.200 -0.355 5.975) 9.363 11.880 ( 5.037 -0.257 14.744) 15.583 12.027 ( 0.361 1.709 0.713) 1.886 12.107 ( -0.941 -0.013 12.379) 12.415 12.150 ( 0.453 0.965 9.449) 9.509 12.182 ( 2.556 -0.176 -0.704) 2.658 12.219 ( 3.511 -3.154 3.594) 5.932 12.307 ( 1.755 -0.408 -3.596) 4.022 12.344 ( 4.114 -0.650 -4.132) 5.867 12.509 ( 4.328 1.025 2.319) 5.017 12.607 ( 3.278 2.382 0.640) 4.102 12.672 ( -4.226 -0.287 -5.885) 7.251 12.691 ( -0.798 0.319 -4.662) 4.740 12.738 ( -4.157 -1.780 -3.911) 5.979 12.882 ( -5.673 2.336 4.306) 7.495 12.933 ( -7.143 -2.698 2.561) 8.054 13.011 ( 9.647 -0.457 5.892) 11.313 13.140 ( 10.086 -0.286 0.668) 10.113 13.192 ( -1.385 0.044 -3.083) 3.381 13.269 ( 4.308 -0.172 -4.822) 6.468 13.397 ( 19.148 -1.156 8.294) 20.899 13.518 ( -1.483 0.136 -8.764) 8.889 13.703 ( 5.179 0.116 3.469) 6.234 13.881 ( -1.226 -0.043 13.215) 13.272 13.975 ( 5.874 0.997 9.237) 10.992 14.167 ( -2.597 0.760 -6.446) 6.991 14.214 ( -13.353 -0.058 1.902) 13.488 14.326 ( 20.599 0.050 -6.032) 21.464 14.643 ( 5.619 -0.093 -0.735) 5.667 14.901 ( 7.231 -0.103 7.993) 10.779 15.010 ( -4.669 2.870 -13.792) 14.841 15.046 ( -2.726 -0.479 -8.780) 9.206 15.153 ( -5.619 -1.562 -3.416) 6.759 15.182 ( -1.195 -1.505 1.385) 2.369 15.484 ( -12.223 0.723 -13.391) 18.146 15.753 ( 0.749 0.500 3.800) 3.905 15.816 ( -8.917 0.196 4.098) 9.816 15.992 ( -3.799 0.706 4.085) 5.623 16.010 ( 3.814 -0.445 5.971) 7.099 16.212 ( -20.082 -0.153 9.842) 22.365 16.418 ( -3.996 0.427 -5.789) 7.047 16.719 ( -6.771 0.076 -1.378) 6.911 16.747 ( -1.354 0.194 -11.938) 12.016 17.058 ( -0.912 0.281 -9.643) 9.690 17.173 ( -5.646 -0.707 -10.281) 11.750 17.486 ( 8.231 0.669 5.486) 9.914 17.548 ( 8.391 -0.376 1.115) 8.473 17.773 ( -4.766 0.754 4.135) 6.354 17.841 ( -0.846 0.118 6.508) 6.563 17.948 ( -3.727 0.661 -2.317) 4.438 17.962 ( -2.391 -0.534 -2.626) 3.591 17.989 ( 1.492 -0.252 0.795) 1.709 18.041 ( -4.230 -0.915 -6.050) 7.438 18.190 ( 13.818 0.125 6.916) 15.452 18.253 ( 5.514 0.117 6.224) 8.316 18.517 ( 5.180 0.351 -3.361) 6.185 18.567 ( 2.728 0.442 -7.360) 7.862 18.603 ( -3.164 0.739 0.656) 3.314 18.652 ( 0.481 -0.213 -2.954) 3.001 18.740 ( -4.906 0.228 -0.802) 4.977 18.753 ( -4.044 -0.279 2.494) 4.760 19.003 ( 3.235 0.243 1.451) 3.554 19.085 ( 4.172 -0.021 -6.144) 7.427 19.381 ( 1.539 -0.166 12.154) 12.252 19.445 ( 0.642 -0.304 12.296) 12.317 19.629 ( 12.295 0.224 6.544) 13.930 19.831 ( 7.859 0.205 6.470) 10.182 20.027 ( 12.165 0.243 4.296) 12.903 20.064 ( 8.596 0.039 4.308) 9.616 20.238 ( -1.663 -0.019 6.078) 6.302 20.384 ( -10.837 -0.233 -9.121) 14.166 20.561 ( -6.478 0.283 -4.695) 8.005 20.585 ( -0.148 -0.627 -5.524) 5.562 20.723 ( -10.280 -0.119 3.871) 10.986 20.809 ( -11.175 0.223 -0.727) 11.201 20.839 ( 8.018 -0.316 0.198) 8.027 20.933 ( -3.002 -0.427 -9.053) 9.547 20.971 ( 6.866 -0.110 -1.356) 7.000 21.084 ( -8.642 -0.243 -2.675) 9.050 21.162 ( -3.726 -0.345 1.101) 3.901 21.330 ( -5.931 0.007 -4.865) 7.671 22.006 ( 10.063 0.020 -3.825) 10.766 22.073 ( -1.282 0.037 -2.723) 3.010 22.305 ( -4.938 0.700 8.692) 10.021 22.319 ( -0.932 -0.297 10.754) 10.798 22.733 ( 3.419 0.582 -2.499) 4.275 22.866 ( 12.334 0.406 -0.058) 12.341 22.920 ( -1.589 -0.238 -5.570) 5.797 22.998 ( 0.169 -0.026 -3.985) 3.989 23.154 ( -7.263 0.438 11.765) 13.833 23.204 ( 8.712 0.334 11.395) 14.348 23.289 ( -3.340 0.540 -6.414) 7.252 23.639 ( -8.970 0.373 0.503) 8.992 23.689 ( -0.258 0.090 -7.440) 7.445 23.790 ( -3.366 0.681 -0.170) 3.438 23.974 ( -12.885 0.012 -2.863) 13.199 23.982 ( -8.789 0.333 1.658) 8.951 24.003 ( 0.533 0.860 -4.153) 4.274 24.180 ( -7.201 0.200 -13.288) 15.115 24.379 ( 9.565 0.558 5.185) 10.894 24.610 ( 6.348 0.684 1.293) 6.514 24.795 ( 12.970 0.489 3.699) 13.496 24.841 ( 23.382 -0.859 1.542) 23.449 24.914 ( 0.692 -0.106 3.617) 3.685 25.222 ( 24.555 -0.492 1.109) 24.585 25.311 ( -13.917 0.217 -7.876) 15.992 25.432 ( 21.480 -0.261 14.749) 26.057 25.624 ( -3.015 0.206 -12.852) 13.203 25.710 ( 0.019 0.091 -3.151) 3.153 25.782 ( 1.020 -0.539 0.820) 1.416 26.194 ( 6.837 -0.143 -7.966) 10.499 26.357 ( -6.326 -0.224 14.714) 16.018 26.499 ( -0.730 -0.006 -0.434) 0.849 26.548 ( 14.093 -0.245 -5.143) 15.004 26.992 ( -33.327 -1.954 -7.559) 34.229 27.005 ( -36.087 -2.120 1.372) 36.175 27.266 ( -19.130 -1.697 -10.795) 22.031 27.675 ( 3.931 -0.013 11.698) 12.341 27.884 ( 0.952 -1.422 15.317) 15.412 28.040 ( 4.809 -0.038 -4.144) 6.348 28.220 ( 5.193 -1.382 -4.157) 6.794 28.266 ( -10.916 -1.011 3.202) 11.421 28.365 ( -8.840 -0.636 -0.586) 8.882 28.584 ( 9.779 -0.914 8.671) 13.102 28.779 ( 15.730 -1.011 -3.813) 16.217 29.094 ( 5.843 -0.225 0.293) 5.855 29.109 ( -4.307 -0.640 3.024) 5.301 29.413 ( -4.974 -0.542 -5.524) 7.453 29.458 ( -7.662 -1.325 -7.186) 10.588 29.817 ( 7.115 -0.456 -2.963) 7.721 29.884 ( 14.194 -0.499 -8.771) 16.693 30.374 ( -1.641 -0.747 9.123) 9.300 30.480 ( 6.979 -1.206 4.301) 8.287 30.527 ( -0.374 -1.464 -1.734) 2.300 30.618 ( 2.260 -0.452 0.670) 2.400 30.657 ( -1.943 -0.667 -1.837) 2.756 30.698 ( -3.066 -0.207 3.501) 4.658 30.891 ( -7.126 -0.824 2.325) 7.541 31.016 ( 7.561 -0.391 1.341) 7.689 31.061 ( -8.389 -1.414 -5.740) 10.262 31.301 ( 4.348 -0.322 -5.012) 6.643 31.332 ( 6.689 -1.018 7.836) 10.353 31.479 ( -3.214 -0.711 -2.715) 4.267 31.589 ( 1.369 -1.597 -4.892) 5.325 31.741 ( -6.533 -1.268 -7.742) 10.209 31.922 ( 3.095 -1.055 6.453) 7.234 32.105 ( 1.082 -0.359 -2.813) 3.035 32.378 ( -7.572 -1.572 9.936) 12.591 32.820 ( -19.469 -0.422 -6.792) 20.624 32.889 ( 7.629 -2.322 8.736) 11.829 33.156 ( -3.805 -0.974 0.842) 4.017 33.589 ( 4.912 -0.460 -7.803) 9.231 33.660 ( 5.808 -1.773 -13.935) 15.201 34.118 ( 11.230 -1.255 14.522) 18.401 34.393 ( 8.053 -3.994 9.992) 13.440 35.332 ( 6.242 -2.851 9.010) 11.326 36.093 ( -18.133 -8.367 -16.424) 25.856 ======================= Grid point 82 (36/54) ======================= q-point: (-0.50 0.45 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.424 ( 0.000 6.788 -2.659) 7.291 2.447 ( -0.000 1.847 -1.526) 2.396 2.533 ( 0.000 0.783 -1.733) 1.902 2.613 ( 0.000 -3.745 -4.983) 6.233 2.802 ( 0.000 8.468 3.699) 9.241 2.827 ( -0.000 7.187 1.771) 7.402 2.935 ( 0.000 -3.221 -2.434) 4.037 2.972 ( -0.000 -7.279 0.442) 7.293 3.059 ( -0.000 1.792 1.964) 2.659 3.096 ( 0.000 -1.648 -0.800) 1.832 3.245 ( -0.000 2.448 5.246) 5.790 3.278 ( 0.000 0.460 -1.466) 1.536 3.317 ( 0.000 0.098 7.152) 7.153 3.320 ( 0.000 0.607 -0.068) 0.611 3.379 ( -0.000 3.949 2.750) 4.812 3.389 ( 0.000 4.000 1.595) 4.306 3.595 ( 0.000 5.572 1.101) 5.680 3.598 ( -0.000 3.534 0.682) 3.599 3.629 ( 0.000 4.374 -0.217) 4.379 3.635 ( -0.000 0.896 0.241) 0.928 3.763 ( 0.000 -0.277 -5.303) 5.310 3.802 ( -0.000 -5.082 -5.454) 7.455 3.913 ( -0.000 1.727 0.099) 1.730 3.938 ( 0.000 -1.227 -1.020) 1.596 4.083 ( -0.000 0.469 4.356) 4.381 4.155 ( 0.000 -5.399 4.723) 7.173 4.248 ( -0.000 -0.955 5.757) 5.836 4.278 ( 0.000 -3.526 6.356) 7.269 4.397 ( -0.000 6.442 -0.670) 6.476 4.433 ( 0.000 2.567 -0.553) 2.626 4.602 ( -0.000 1.062 -6.031) 6.124 4.638 ( 0.000 -1.486 -4.749) 4.976 5.273 ( 0.000 -0.184 -2.840) 2.845 5.301 ( 0.000 -3.108 -3.628) 4.777 5.454 ( -0.000 0.065 4.819) 4.820 5.480 ( -0.000 -2.609 4.160) 4.910 6.107 ( -0.000 -1.960 -7.318) 7.576 6.115 ( 0.000 -2.610 -7.255) 7.710 6.426 ( -0.000 -0.075 4.185) 4.186 6.452 ( 0.000 -2.654 4.485) 5.212 6.641 ( -0.000 -0.896 11.813) 11.847 6.657 ( 0.000 -3.022 10.767) 11.183 6.904 ( 0.000 2.270 1.684) 2.827 6.968 ( -0.000 -4.328 3.716) 5.704 7.032 ( 0.000 0.137 -4.280) 4.283 7.068 ( -0.000 -3.042 -1.897) 3.585 7.314 ( 0.000 1.443 2.837) 3.183 7.364 ( -0.000 -2.849 0.524) 2.897 7.596 ( 0.000 0.571 3.304) 3.353 7.628 ( -0.000 -2.631 0.529) 2.684 7.789 ( -0.000 -0.146 -1.672) 1.678 7.848 ( 0.000 -5.228 -1.179) 5.359 7.980 ( 0.000 0.897 -1.146) 1.456 8.021 ( 0.000 -2.853 -1.292) 3.132 8.242 ( -0.000 1.705 2.696) 3.190 8.296 ( -0.000 -3.574 5.760) 6.778 8.518 ( -0.000 0.813 5.575) 5.634 8.540 ( -0.000 -1.291 8.965) 9.057 8.708 ( 0.000 1.213 -6.995) 7.099 8.718 ( -0.000 0.084 -7.820) 7.820 8.939 ( -0.000 0.318 -6.624) 6.632 8.944 ( 0.000 0.003 -7.097) 7.097 9.192 ( -0.000 1.476 -15.839) 15.908 9.239 ( 0.000 -2.996 -16.309) 16.582 9.568 ( 0.000 3.225 -0.743) 3.309 9.621 ( -0.000 -1.832 -2.914) 3.442 9.868 ( 0.000 1.684 6.113) 6.340 9.882 ( 0.000 0.317 2.253) 2.275 9.914 ( -0.000 -0.550 -4.233) 4.269 9.929 ( -0.000 -2.080 -7.785) 8.058 10.116 ( 0.001 -0.190 -13.283) 13.284 10.118 ( -0.001 -0.456 -11.321) 11.330 10.371 ( -0.000 0.380 3.956) 3.974 10.407 ( 0.000 -3.103 4.833) 5.743 10.594 ( 0.000 0.642 6.511) 6.543 10.607 ( -0.000 -0.621 4.923) 4.962 10.791 ( 0.000 -1.986 -1.563) 2.527 10.802 ( -0.000 -2.962 -2.860) 4.118 11.156 ( -0.000 2.463 3.505) 4.284 11.210 ( -0.000 -2.594 1.654) 3.076 11.398 ( -0.000 0.658 1.133) 1.310 11.410 ( -0.000 -0.663 5.139) 5.181 11.532 ( 0.000 0.210 -5.734) 5.738 11.558 ( -0.000 -2.457 -3.872) 4.586 11.991 ( 0.000 3.930 3.648) 5.362 12.049 ( -0.000 -1.166 5.648) 5.767 12.085 ( -0.000 0.023 15.652) 15.652 12.089 ( 0.000 -0.408 16.641) 16.646 12.219 ( 0.000 -0.094 5.625) 5.626 12.246 ( -0.000 -2.231 5.731) 6.151 12.366 ( 0.000 1.095 -3.699) 3.858 12.405 ( -0.000 -2.622 -2.096) 3.357 12.519 ( -0.000 2.185 -3.850) 4.427 12.553 ( 0.000 -1.140 -3.586) 3.763 12.633 ( 0.000 0.587 -4.254) 4.294 12.640 ( -0.000 -0.005 -1.648) 1.648 12.762 ( 0.000 1.621 -1.661) 2.321 12.806 ( -0.000 -2.733 -3.227) 4.229 13.031 ( 0.000 0.555 6.252) 6.276 13.042 ( -0.000 -0.467 6.822) 6.838 13.275 ( 0.000 0.655 -4.491) 4.538 13.300 ( 0.000 -1.894 -5.776) 6.079 13.331 ( -0.000 2.658 -1.956) 3.300 13.364 ( 0.000 -0.776 -1.942) 2.092 13.714 ( 0.000 0.266 11.462) 11.465 13.726 ( -0.000 -0.963 10.373) 10.418 13.892 ( -0.000 2.080 2.564) 3.301 13.935 ( 0.000 -2.237 3.147) 3.861 14.085 ( -0.000 1.483 0.865) 1.717 14.109 ( 0.000 -0.920 1.665) 1.902 14.679 ( 0.000 1.549 -8.607) 8.745 14.715 ( -0.000 -2.054 -8.573) 8.816 14.831 ( -0.000 4.244 -8.937) 9.894 14.918 ( -0.000 -4.222 -8.821) 9.779 15.123 ( -0.000 2.855 -3.699) 4.673 15.174 ( 0.000 -2.151 -6.007) 6.381 15.296 ( -0.000 0.681 -0.343) 0.763 15.310 ( 0.000 -0.776 -1.141) 1.380 15.568 ( 0.000 2.450 18.380) 18.542 15.615 ( 0.000 -2.184 17.121) 17.260 15.968 ( 0.000 0.431 6.710) 6.724 15.979 ( -0.000 -0.660 5.738) 5.776 16.189 ( -0.000 0.622 0.551) 0.831 16.192 ( 0.000 0.466 -0.296) 0.552 16.740 ( 0.000 0.232 -15.114) 15.115 16.747 ( 0.000 -0.401 -15.415) 15.420 17.079 ( 0.000 0.149 -12.568) 12.569 17.082 ( -0.000 -0.155 -13.329) 13.330 17.595 ( 0.000 2.657 -0.202) 2.665 17.645 ( -0.000 -2.216 0.755) 2.341 17.731 ( -0.000 0.713 4.773) 4.826 17.749 ( 0.000 -1.065 4.130) 4.265 17.893 ( -0.000 0.128 0.085) 0.153 17.898 ( 0.000 -0.237 0.592) 0.638 18.005 ( -0.000 0.924 -5.603) 5.679 18.030 ( 0.000 -1.595 -4.703) 4.966 18.398 ( 0.000 1.028 7.656) 7.725 18.408 ( -0.000 0.055 7.727) 7.727 18.549 ( -0.000 0.502 2.746) 2.792 18.550 ( 0.000 0.317 6.817) 6.825 18.594 ( 0.000 0.937 -3.517) 3.639 18.611 ( -0.000 -0.742 -0.020) 0.743 18.662 ( 0.000 1.965 -3.663) 4.157 18.703 ( 0.000 -1.962 -3.873) 4.342 19.088 ( 0.000 1.285 -0.146) 1.293 19.111 ( 0.000 -1.015 -0.422) 1.100 19.416 ( -0.000 0.244 14.393) 14.395 19.430 ( 0.000 -1.067 14.152) 14.192 19.847 ( -0.000 0.288 6.064) 6.071 19.850 ( 0.000 0.004 6.049) 6.049 20.207 ( -0.000 0.529 4.876) 4.905 20.215 ( 0.000 -0.212 4.925) 4.929 20.294 ( -0.000 1.034 -2.813) 2.997 20.304 ( 0.000 0.109 -3.509) 3.510 20.420 ( 0.000 0.254 -7.055) 7.059 20.435 ( -0.000 -1.186 -7.739) 7.829 20.622 ( -0.000 -0.258 -4.362) 4.369 20.627 ( -0.000 -0.823 -4.248) 4.327 20.949 ( 0.000 0.004 3.572) 3.572 20.951 ( -0.000 -0.185 3.955) 3.959 21.049 ( 0.000 0.994 -4.213) 4.329 21.071 ( -0.000 -1.340 -4.325) 4.528 21.145 ( -0.000 -0.091 -3.286) 3.287 21.146 ( 0.000 -0.117 -2.612) 2.615 21.967 ( -0.000 1.258 5.305) 5.452 21.989 ( 0.000 -0.944 5.233) 5.318 22.416 ( -0.000 0.952 2.579) 2.749 22.431 ( 0.000 -0.555 2.550) 2.609 22.781 ( 0.001 0.778 -6.011) 6.061 22.785 ( -0.001 0.389 -5.999) 6.012 22.987 ( 0.000 -0.333 -2.589) 2.610 22.987 ( -0.000 -0.388 -2.590) 2.619 23.184 ( 0.001 0.553 4.381) 4.416 23.187 ( -0.001 0.234 4.802) 4.807 23.426 ( -0.001 0.601 6.758) 6.785 23.428 ( 0.001 0.386 6.411) 6.423 23.700 ( -0.000 0.313 -5.878) 5.886 23.703 ( 0.000 0.015 -6.066) 6.066 23.861 ( 0.000 0.585 1.641) 1.742 23.865 ( 0.000 0.311 2.082) 2.105 24.057 ( -0.000 0.830 -8.342) 8.383 24.065 ( 0.000 0.164 -8.408) 8.410 24.564 ( 0.000 1.411 6.360) 6.514 24.577 ( -0.000 0.119 5.791) 5.792 25.014 ( 0.000 1.330 0.036) 1.330 25.025 ( -0.000 0.372 -0.480) 0.607 25.059 ( -0.000 -0.063 -6.825) 6.825 25.074 ( 0.000 -1.493 -7.293) 7.444 25.587 ( -0.000 0.511 5.910) 5.932 25.603 ( 0.000 -0.967 5.316) 5.403 25.762 ( 0.000 0.717 -2.815) 2.904 25.795 ( 0.000 -2.766 -2.788) 3.928 26.029 ( -0.000 0.406 6.751) 6.763 26.045 ( 0.000 -1.166 6.758) 6.858 26.269 ( -0.000 -1.023 2.633) 2.825 26.289 ( 0.000 -3.151 1.832) 3.645 26.503 ( -0.000 0.586 -0.533) 0.792 26.520 ( 0.000 -1.041 0.377) 1.107 26.945 ( -0.000 -0.476 -17.561) 17.567 26.949 ( 0.000 -0.842 -18.634) 18.653 27.790 ( -0.000 1.519 16.330) 16.400 27.829 ( 0.000 -2.439 16.819) 16.994 28.155 ( 0.000 0.270 0.052) 0.275 28.158 ( 0.000 0.518 -1.973) 2.040 28.185 ( -0.000 -1.955 -1.063) 2.225 28.194 ( 0.000 -2.253 -1.980) 2.999 28.860 ( -0.000 -0.134 4.586) 4.588 28.862 ( 0.000 -0.366 4.291) 4.307 29.104 ( -0.000 -0.971 -5.310) 5.398 29.108 ( 0.000 -1.337 -5.008) 5.184 29.336 ( -0.000 -0.172 -4.379) 4.382 29.348 ( 0.000 -1.278 -4.404) 4.586 29.985 ( 0.000 -0.042 -0.542) 0.543 29.990 ( -0.000 -0.621 -0.443) 0.763 30.431 ( 0.000 -0.771 -0.745) 1.072 30.441 ( -0.000 -1.830 -0.859) 2.022 30.592 ( 0.000 1.117 6.622) 6.715 30.609 ( -0.000 -0.373 6.869) 6.880 30.689 ( 0.000 -0.352 -2.505) 2.530 30.707 ( 0.000 -1.949 -2.474) 3.149 30.800 ( 0.000 -1.278 -0.564) 1.397 30.803 ( -0.000 -1.573 -0.946) 1.835 31.262 ( -0.000 0.664 -4.800) 4.846 31.286 ( 0.000 -1.584 -5.362) 5.591 31.437 ( 0.000 -0.476 2.690) 2.732 31.440 ( -0.000 -0.650 3.629) 3.687 31.592 ( 0.000 -0.292 -2.865) 2.880 31.627 ( 0.000 -3.694 -2.422) 4.417 32.003 ( -0.000 1.038 4.854) 4.963 32.040 ( 0.000 -2.439 5.229) 5.770 32.442 ( -0.000 0.623 -4.055) 4.103 32.479 ( 0.000 -2.886 -3.584) 4.602 33.046 ( 0.000 -0.446 4.236) 4.260 33.060 ( -0.000 -1.912 4.371) 4.771 33.660 ( -0.000 0.215 -10.690) 10.692 33.682 ( 0.000 -2.039 -12.193) 12.362 34.339 ( 0.000 -0.263 19.327) 19.328 34.395 ( -0.000 -6.043 18.407) 19.373 35.638 ( 0.000 -4.073 -9.610) 10.438 35.660 ( -0.000 -6.369 -9.146) 11.145 ======================= Grid point 110 (37/54) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 36 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.452 ( 0.000 0.000 -32.271) 32.271 1.452 ( 0.000 0.000 32.271) 32.271 1.599 ( 0.000 0.000 -34.074) 34.074 1.599 ( 0.000 0.000 34.074) 34.074 2.461 ( 0.000 0.000 -24.039) 24.039 2.461 ( 0.000 0.000 24.039) 24.039 2.588 ( 0.000 0.000 -16.706) 16.706 2.588 ( 0.000 0.000 16.706) 16.706 2.839 ( 0.000 0.000 -36.080) 36.080 2.839 ( 0.000 0.000 36.080) 36.080 2.956 ( 0.000 0.000 -0.919) 0.919 2.956 ( 0.000 0.000 0.919) 0.919 3.173 ( 0.000 0.000 -5.472) 5.472 3.173 ( 0.000 0.000 5.472) 5.472 3.230 ( 0.000 0.000 -5.023) 5.023 3.230 ( 0.000 0.000 5.023) 5.023 3.391 ( 0.000 0.000 -6.095) 6.095 3.391 ( 0.000 0.000 6.095) 6.095 3.441 ( 0.000 0.000 -2.552) 2.552 3.441 ( 0.000 0.000 2.552) 2.552 3.560 ( 0.000 0.000 -0.999) 0.999 3.560 ( 0.000 0.000 0.999) 0.999 3.780 ( 0.000 0.000 -6.084) 6.084 3.780 ( 0.000 0.000 6.084) 6.084 4.356 ( 0.000 0.000 -7.407) 7.407 4.356 ( 0.000 0.000 7.407) 7.407 4.420 ( 0.000 0.000 -4.743) 4.743 4.420 ( 0.000 0.000 4.743) 4.743 4.837 ( 0.000 0.000 -1.920) 1.920 4.837 ( 0.000 0.000 1.920) 1.920 5.053 ( 0.000 0.000 -2.474) 2.474 5.053 ( 0.000 0.000 2.474) 2.474 5.164 ( 0.000 0.000 -0.383) 0.383 5.164 ( 0.000 0.000 0.383) 0.383 5.876 ( 0.000 0.000 -5.361) 5.361 5.876 ( 0.000 0.000 5.361) 5.361 6.216 ( 0.000 0.000 -3.731) 3.731 6.216 ( 0.000 0.000 3.731) 3.731 6.911 ( 0.000 0.000 -9.340) 9.340 6.911 ( 0.000 0.000 9.340) 9.340 6.946 ( 0.000 0.000 -2.372) 2.372 6.946 ( 0.000 0.000 2.372) 2.372 7.102 ( 0.000 0.000 -8.039) 8.039 7.102 ( 0.000 0.000 8.039) 8.039 7.232 ( 0.000 0.000 -5.575) 5.575 7.232 ( 0.000 0.000 5.575) 5.575 7.386 ( 0.000 0.000 -12.808) 12.808 7.386 ( 0.000 0.000 12.808) 12.808 7.636 ( 0.000 0.000 -3.647) 3.647 7.636 ( 0.000 0.000 3.647) 3.647 7.812 ( 0.000 0.000 -16.994) 16.994 7.812 ( 0.000 0.000 16.994) 16.994 7.936 ( 0.000 0.000 -5.027) 5.027 7.936 ( 0.000 0.000 5.027) 5.027 8.299 ( 0.000 0.000 -5.390) 5.390 8.299 ( 0.000 0.000 5.390) 5.390 8.548 ( 0.000 0.000 -6.000) 6.000 8.548 ( 0.000 0.000 6.000) 6.000 8.599 ( 0.000 0.000 -8.529) 8.529 8.599 ( 0.000 0.000 8.529) 8.529 8.949 ( 0.000 0.000 -13.831) 13.831 8.949 ( 0.000 0.000 13.831) 13.831 9.273 ( 0.000 0.000 -4.061) 4.061 9.273 ( 0.000 0.000 4.061) 4.061 9.372 ( 0.000 0.000 -2.708) 2.708 9.372 ( 0.000 0.000 2.708) 2.708 9.886 ( 0.000 0.000 -1.315) 1.315 9.886 ( 0.000 0.000 1.315) 1.315 10.115 ( 0.000 0.000 -3.325) 3.325 10.115 ( 0.000 0.000 3.325) 3.325 10.439 ( 0.000 0.000 -5.675) 5.675 10.439 ( 0.000 0.000 5.675) 5.675 10.739 ( 0.000 0.000 -11.418) 11.418 10.739 ( 0.000 0.000 11.418) 11.418 10.842 ( 0.000 0.000 -15.357) 15.357 10.842 ( 0.000 0.000 15.357) 15.357 11.161 ( 0.000 0.000 -3.868) 3.868 11.161 ( 0.000 0.000 3.868) 3.868 11.366 ( 0.000 0.000 -3.683) 3.683 11.366 ( 0.000 0.000 3.683) 3.683 11.586 ( 0.000 0.000 -15.357) 15.357 11.586 ( 0.000 0.000 15.357) 15.357 11.957 ( 0.000 0.000 -13.101) 13.101 11.957 ( 0.000 0.000 13.101) 13.101 11.999 ( 0.000 0.000 -1.671) 1.671 11.999 ( 0.000 0.000 1.671) 1.671 12.024 ( 0.000 0.000 -14.189) 14.189 12.024 ( 0.000 0.000 14.189) 14.189 12.217 ( 0.000 0.000 -0.212) 0.212 12.217 ( 0.000 0.000 0.212) 0.212 12.391 ( 0.000 0.000 -5.220) 5.220 12.391 ( 0.000 0.000 5.220) 5.220 12.470 ( 0.000 0.000 -7.958) 7.958 12.470 ( 0.000 0.000 7.958) 7.958 12.516 ( 0.000 0.000 -4.043) 4.043 12.516 ( 0.000 0.000 4.043) 4.043 12.903 ( 0.000 0.000 -0.835) 0.835 12.903 ( 0.000 0.000 0.835) 0.835 13.051 ( 0.000 0.000 -9.774) 9.774 13.051 ( 0.000 0.000 9.774) 9.774 13.119 ( 0.000 0.000 -22.342) 22.342 13.119 ( 0.000 0.000 22.342) 22.342 13.278 ( 0.000 0.000 -5.583) 5.583 13.278 ( 0.000 0.000 5.583) 5.583 13.592 ( 0.000 0.000 -14.509) 14.509 13.592 ( 0.000 0.000 14.509) 14.509 13.636 ( 0.000 0.000 -10.785) 10.785 13.636 ( 0.000 0.000 10.785) 10.785 14.210 ( 0.000 0.000 -5.287) 5.287 14.210 ( 0.000 0.000 5.287) 5.287 14.653 ( 0.000 0.000 -20.642) 20.642 14.653 ( 0.000 0.000 20.642) 20.642 14.838 ( 0.000 0.000 -7.625) 7.625 14.838 ( 0.000 0.000 7.625) 7.625 15.119 ( 0.000 0.000 -12.854) 12.854 15.119 ( 0.000 0.000 12.854) 12.854 15.180 ( 0.000 0.000 -15.648) 15.648 15.180 ( 0.000 0.000 15.648) 15.648 15.842 ( 0.000 0.000 -13.973) 13.973 15.842 ( 0.000 0.000 13.973) 13.973 15.849 ( 0.000 0.000 -0.255) 0.255 15.849 ( 0.000 0.000 0.255) 0.255 15.938 ( 0.000 0.000 -9.585) 9.585 15.938 ( 0.000 0.000 9.585) 9.585 17.013 ( 0.000 0.000 -1.382) 1.382 17.013 ( 0.000 0.000 1.382) 1.382 17.156 ( 0.000 0.000 -17.366) 17.366 17.156 ( 0.000 0.000 17.366) 17.366 17.522 ( 0.000 0.000 -0.634) 0.634 17.522 ( 0.000 0.000 0.634) 0.634 17.778 ( 0.000 0.000 -1.010) 1.010 17.778 ( 0.000 0.000 1.010) 1.010 17.864 ( 0.000 0.000 -18.283) 18.283 17.864 ( 0.000 0.000 18.283) 18.283 18.138 ( 0.000 0.000 -6.018) 6.018 18.138 ( 0.000 0.000 6.018) 6.018 18.226 ( 0.000 0.000 -4.760) 4.760 18.226 ( 0.000 0.000 4.760) 4.760 18.347 ( 0.000 0.000 -1.532) 1.532 18.347 ( 0.000 0.000 1.532) 1.532 18.445 ( 0.000 0.000 -5.651) 5.651 18.445 ( 0.000 0.000 5.651) 5.651 18.830 ( 0.000 0.000 -5.832) 5.832 18.830 ( 0.000 0.000 5.832) 5.832 18.878 ( 0.000 0.000 -2.862) 2.862 18.878 ( 0.000 0.000 2.862) 2.862 19.412 ( 0.000 0.000 -2.235) 2.235 19.412 ( 0.000 0.000 2.235) 2.235 19.558 ( 0.000 0.000 -3.730) 3.730 19.558 ( 0.000 0.000 3.730) 3.730 20.108 ( 0.000 0.000 -1.995) 1.995 20.108 ( 0.000 0.000 1.995) 1.995 20.494 ( 0.000 0.000 -5.515) 5.515 20.494 ( 0.000 0.000 5.515) 5.515 20.707 ( 0.000 0.000 -10.361) 10.361 20.707 ( 0.000 0.000 10.361) 10.361 20.798 ( 0.000 0.000 -0.998) 0.998 20.798 ( 0.000 0.000 0.998) 0.998 20.900 ( 0.000 0.000 -4.043) 4.043 20.900 ( 0.000 0.000 4.043) 4.043 21.306 ( 0.000 0.000 -5.040) 5.040 21.306 ( 0.000 0.000 5.040) 5.040 21.398 ( 0.000 0.000 -15.521) 15.521 21.398 ( 0.000 0.000 15.521) 15.521 22.199 ( 0.000 0.000 -11.505) 11.505 22.199 ( 0.000 0.000 11.505) 11.505 22.454 ( 0.000 0.000 -0.747) 0.747 22.454 ( 0.000 0.000 0.747) 0.747 22.869 ( 0.000 0.000 -16.604) 16.604 22.869 ( 0.000 0.000 16.604) 16.604 22.960 ( 0.000 0.000 -5.926) 5.926 22.960 ( 0.000 0.000 5.926) 5.926 23.042 ( 0.000 0.000 -10.503) 10.503 23.042 ( 0.000 0.000 10.503) 10.503 23.644 ( 0.000 0.000 -4.454) 4.454 23.644 ( 0.000 0.000 4.454) 4.454 23.724 ( 0.000 0.000 -2.097) 2.097 23.724 ( 0.000 0.000 2.097) 2.097 24.124 ( 0.000 0.000 -4.234) 4.234 24.124 ( 0.000 0.000 4.234) 4.234 24.249 ( 0.000 0.000 -9.949) 9.949 24.249 ( 0.000 0.000 9.949) 9.949 24.525 ( 0.000 0.000 -0.908) 0.908 24.525 ( 0.000 0.000 0.908) 0.908 24.764 ( 0.000 0.000 -20.684) 20.684 24.764 ( 0.000 0.000 20.684) 20.684 25.344 ( 0.000 0.000 -9.106) 9.106 25.344 ( 0.000 0.000 9.106) 9.106 25.471 ( 0.000 0.000 -24.224) 24.224 25.471 ( 0.000 0.000 24.224) 24.224 25.564 ( 0.000 0.000 -5.708) 5.708 25.564 ( 0.000 0.000 5.708) 5.708 25.978 ( 0.000 0.000 -5.305) 5.305 25.978 ( 0.000 0.000 5.305) 5.305 26.490 ( 0.000 0.000 -0.952) 0.952 26.490 ( 0.000 0.000 0.952) 0.952 26.926 ( 0.000 0.000 -21.633) 21.633 26.926 ( 0.000 0.000 21.633) 21.633 27.831 ( 0.000 0.000 -10.127) 10.127 27.831 ( 0.000 0.000 10.127) 10.127 28.520 ( 0.000 0.000 -5.113) 5.113 28.520 ( 0.000 0.000 5.113) 5.113 28.596 ( 0.000 0.000 -14.913) 14.913 28.596 ( 0.000 0.000 14.913) 14.913 28.689 ( 0.000 0.000 -7.882) 7.882 28.689 ( 0.000 0.000 7.882) 7.882 29.007 ( 0.000 0.000 -0.801) 0.801 29.007 ( 0.000 0.000 0.801) 0.801 29.317 ( 0.000 0.000 -17.690) 17.690 29.317 ( 0.000 0.000 17.690) 17.690 29.621 ( 0.000 0.000 -19.234) 19.234 29.621 ( 0.000 0.000 19.234) 19.234 30.208 ( 0.000 0.000 -8.617) 8.617 30.208 ( 0.000 0.000 8.617) 8.617 30.725 ( 0.000 0.000 -7.547) 7.547 30.725 ( 0.000 0.000 7.547) 7.547 30.891 ( 0.000 0.000 -0.077) 0.077 30.891 ( 0.000 0.000 0.077) 0.077 31.042 ( 0.000 0.000 -4.954) 4.954 31.042 ( 0.000 0.000 4.954) 4.954 31.151 ( 0.000 0.000 -0.753) 0.753 31.151 ( 0.000 0.000 0.753) 0.753 31.629 ( 0.000 0.000 -5.953) 5.953 31.629 ( 0.000 0.000 5.953) 5.953 32.100 ( 0.000 0.000 -0.581) 0.581 32.100 ( 0.000 0.000 0.581) 0.581 32.379 ( 0.000 0.000 -11.265) 11.265 32.379 ( 0.000 0.000 11.265) 11.265 32.448 ( 0.000 0.000 -8.450) 8.450 32.448 ( 0.000 0.000 8.450) 8.450 32.876 ( 0.000 0.000 -3.176) 3.176 32.876 ( 0.000 0.000 3.176) 3.176 33.159 ( 0.000 0.000 -1.377) 1.377 33.159 ( 0.000 0.000 1.377) 1.377 33.658 ( 0.000 0.000 -0.884) 0.884 33.658 ( 0.000 0.000 0.884) 0.884 33.730 ( 0.000 0.000 -0.745) 0.745 33.730 ( 0.000 0.000 0.745) 0.745 34.713 ( 0.000 0.000 -1.050) 1.050 34.713 ( 0.000 0.000 1.050) 1.050 ======================= Grid point 112 (38/54) ======================= q-point: ( 0.25 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 36 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.637 ( 18.117 0.000 -26.915) 32.445 1.637 ( 18.117 0.000 26.915) 32.445 1.782 ( 16.236 0.000 -24.877) 29.706 1.782 ( 16.236 0.000 24.877) 29.706 2.395 ( -12.119 0.000 -0.027) 12.119 2.395 ( -12.119 0.000 0.027) 12.119 2.649 ( 3.957 0.000 -0.224) 3.963 2.649 ( 3.957 0.000 0.224) 3.963 2.845 ( -6.576 0.000 -12.690) 14.293 2.845 ( -6.576 0.000 12.690) 14.293 2.908 ( 3.075 0.000 -19.924) 20.160 2.908 ( 3.075 0.000 19.924) 20.160 3.132 ( 6.349 0.000 -5.911) 8.675 3.132 ( 6.349 0.000 5.911) 8.675 3.308 ( -1.280 0.000 -1.617) 2.062 3.308 ( -1.280 0.000 1.617) 2.062 3.365 ( 0.583 0.000 -1.810) 1.902 3.365 ( 0.583 0.000 1.810) 1.902 3.452 ( -0.209 0.000 -0.249) 0.325 3.452 ( -0.209 0.000 0.249) 0.325 3.570 ( 1.261 0.000 -0.242) 1.284 3.570 ( 1.261 0.000 0.242) 1.284 3.770 ( -0.451 0.000 -3.824) 3.851 3.770 ( -0.451 0.000 3.824) 3.851 4.146 ( -17.781 0.000 -1.949) 17.888 4.146 ( -17.781 0.000 1.949) 17.888 4.409 ( -1.064 0.000 -2.218) 2.460 4.409 ( -1.064 0.000 2.218) 2.460 4.756 ( 0.482 0.000 -2.371) 2.420 4.756 ( 0.482 0.000 2.371) 2.420 5.054 ( -9.202 0.000 -0.278) 9.206 5.054 ( -9.202 0.000 0.278) 9.206 5.317 ( 14.588 0.000 -1.647) 14.681 5.317 ( 14.588 0.000 1.647) 14.681 5.801 ( -5.448 0.000 -5.519) 7.755 5.801 ( -5.448 0.000 5.519) 7.755 6.385 ( 14.187 0.000 -1.977) 14.324 6.385 ( 14.187 0.000 1.977) 14.324 6.846 ( -4.007 0.000 -15.307) 15.823 6.846 ( -4.007 0.000 15.307) 15.823 6.906 ( -2.571 0.000 -4.192) 4.918 6.906 ( -2.571 0.000 4.192) 4.918 7.149 ( -19.287 0.000 -3.427) 19.589 7.149 ( -19.287 0.000 3.427) 19.589 7.265 ( 11.242 0.000 -15.077) 18.807 7.265 ( 11.242 0.000 15.077) 18.807 7.353 ( 9.152 0.000 -2.153) 9.401 7.353 ( 9.152 0.000 2.153) 9.401 7.532 ( 2.160 0.000 -2.448) 3.264 7.532 ( 2.160 0.000 2.448) 3.264 7.889 ( -1.381 0.000 -9.199) 9.302 7.889 ( -1.381 0.000 9.199) 9.302 8.093 ( 9.803 0.000 -9.446) 13.613 8.093 ( 9.803 0.000 9.446) 13.613 8.258 ( -4.749 0.000 -0.330) 4.761 8.258 ( -4.749 0.000 0.330) 4.761 8.398 ( -6.484 0.000 -1.290) 6.611 8.398 ( -6.484 0.000 1.290) 6.611 8.718 ( -12.418 0.000 -15.187) 19.618 8.718 ( -12.418 0.000 15.187) 19.618 8.896 ( 11.218 0.000 -7.347) 13.410 8.896 ( 11.218 0.000 7.347) 13.410 9.063 ( -0.822 0.000 -7.787) 7.830 9.063 ( -0.822 0.000 7.787) 7.830 9.599 ( 6.621 0.000 -3.531) 7.504 9.599 ( 6.621 0.000 3.531) 7.504 9.958 ( -13.034 0.000 -4.541) 13.802 9.958 ( -13.034 0.000 4.541) 13.802 10.053 ( 12.467 0.000 -7.861) 14.738 10.053 ( 12.467 0.000 7.861) 14.738 10.397 ( -7.803 0.000 -3.947) 8.744 10.397 ( -7.803 0.000 3.947) 8.744 10.738 ( -3.350 0.000 -9.279) 9.865 10.738 ( -3.350 0.000 9.279) 9.865 10.832 ( 0.428 0.000 -8.173) 8.184 10.832 ( 0.428 0.000 8.173) 8.184 11.028 ( -2.577 0.000 -11.397) 11.684 11.028 ( -2.577 0.000 11.397) 11.684 11.325 ( -1.080 0.000 -1.396) 1.765 11.325 ( -1.080 0.000 1.396) 1.765 11.667 ( 2.845 0.000 -9.201) 9.631 11.667 ( 2.845 0.000 9.201) 9.631 11.761 ( -14.908 0.000 -4.024) 15.442 11.761 ( -14.908 0.000 4.024) 15.442 12.046 ( 5.001 0.000 -4.670) 6.842 12.046 ( 5.001 0.000 4.670) 6.842 12.145 ( 0.485 0.000 -2.155) 2.209 12.145 ( 0.485 0.000 2.155) 2.209 12.202 ( 3.887 0.000 -2.372) 4.554 12.202 ( 3.887 0.000 2.372) 4.554 12.294 ( 3.280 0.000 -2.478) 4.111 12.294 ( 3.280 0.000 2.478) 4.111 12.519 ( 4.101 0.000 -5.705) 7.026 12.519 ( 4.101 0.000 5.705) 7.026 12.664 ( 0.734 0.000 -2.497) 2.602 12.664 ( 0.734 0.000 2.497) 2.602 12.803 ( -7.260 0.000 -6.721) 9.893 12.803 ( -7.260 0.000 6.721) 9.893 12.969 ( -3.727 0.000 -18.157) 18.535 12.969 ( -3.727 0.000 18.157) 18.535 13.174 ( 9.475 0.000 -4.269) 10.392 13.174 ( 9.475 0.000 4.269) 10.392 13.463 ( 3.067 0.000 -0.133) 3.070 13.463 ( 3.067 0.000 0.133) 3.070 13.522 ( -0.461 0.000 -9.872) 9.883 13.522 ( -0.461 0.000 9.872) 9.883 13.844 ( 11.448 0.000 -6.221) 13.029 13.844 ( 11.448 0.000 6.221) 13.029 14.288 ( 10.878 0.000 -5.063) 11.998 14.288 ( 10.878 0.000 5.063) 11.998 14.565 ( -7.894 0.000 -11.568) 14.005 14.565 ( -7.894 0.000 11.568) 14.005 14.852 ( 0.881 0.000 -2.236) 2.404 14.852 ( 0.881 0.000 2.236) 2.404 15.097 ( -1.672 0.000 -9.702) 9.845 15.097 ( -1.672 0.000 9.702) 9.845 15.143 ( -3.891 0.000 -12.041) 12.654 15.143 ( -3.891 0.000 12.041) 12.654 15.648 ( -5.195 0.000 -9.747) 11.045 15.648 ( -5.195 0.000 9.747) 11.045 15.841 ( -0.048 0.000 -0.158) 0.165 15.841 ( -0.048 0.000 0.158) 0.165 16.127 ( 3.981 0.000 -9.944) 10.712 16.127 ( 3.981 0.000 9.944) 10.712 16.689 ( -15.266 0.000 -2.050) 15.403 16.689 ( -15.266 0.000 2.050) 15.403 17.077 ( -11.933 0.000 -17.359) 21.065 17.077 ( -11.933 0.000 17.359) 21.065 17.697 ( 10.280 0.000 -1.435) 10.380 17.697 ( 10.280 0.000 1.435) 10.380 17.771 ( 1.129 0.000 -0.930) 1.463 17.771 ( 1.129 0.000 0.930) 1.463 17.889 ( 1.289 0.000 -7.488) 7.598 17.889 ( 1.289 0.000 7.488) 7.598 18.152 ( -6.396 0.000 -1.062) 6.484 18.152 ( -6.396 0.000 1.062) 6.484 18.233 ( 7.329 0.000 -3.903) 8.303 18.233 ( 7.329 0.000 3.903) 8.303 18.363 ( -0.403 0.000 -4.615) 4.632 18.363 ( -0.403 0.000 4.615) 4.632 18.498 ( 4.380 0.000 -1.985) 4.809 18.498 ( 4.380 0.000 1.985) 4.809 18.849 ( 2.254 0.000 -5.292) 5.752 18.849 ( 2.254 0.000 5.292) 5.752 18.906 ( 1.926 0.000 -3.794) 4.255 18.906 ( 1.926 0.000 3.794) 4.255 19.521 ( 10.197 0.000 -3.154) 10.673 19.521 ( 10.197 0.000 3.154) 10.673 19.732 ( 16.643 0.000 -8.205) 18.555 19.732 ( 16.643 0.000 8.205) 18.555 20.045 ( -6.880 0.000 -1.659) 7.077 20.045 ( -6.880 0.000 1.659) 7.077 20.499 ( -4.346 0.000 -10.455) 11.322 20.499 ( -4.346 0.000 10.455) 11.322 20.534 ( -7.442 0.000 -5.059) 8.999 20.534 ( -7.442 0.000 5.059) 8.999 20.818 ( -4.395 0.000 -0.649) 4.442 20.818 ( -4.395 0.000 0.649) 4.442 20.927 ( 3.286 0.000 -4.920) 5.916 20.927 ( 3.286 0.000 4.920) 5.916 21.115 ( -4.808 0.000 -3.602) 6.007 21.115 ( -4.808 0.000 3.602) 6.007 21.452 ( -10.665 0.000 -1.102) 10.722 21.452 ( -10.665 0.000 1.102) 10.722 22.070 ( 3.242 0.000 -0.455) 3.274 22.070 ( 3.242 0.000 0.455) 3.274 22.613 ( -2.455 0.000 -3.912) 4.619 22.613 ( -2.455 0.000 3.912) 4.619 22.721 ( -3.997 0.000 -8.116) 9.047 22.721 ( -3.997 0.000 8.116) 9.047 22.961 ( 2.797 0.000 -6.786) 7.339 22.961 ( 2.797 0.000 6.786) 7.339 23.144 ( 6.693 0.000 -3.165) 7.404 23.144 ( 6.693 0.000 3.165) 7.404 23.576 ( -9.114 0.000 -7.818) 12.008 23.576 ( -9.114 0.000 7.818) 12.008 23.691 ( -0.518 0.000 -1.985) 2.052 23.691 ( -0.518 0.000 1.985) 2.052 23.983 ( -7.773 0.000 -8.924) 11.834 23.983 ( -7.773 0.000 8.924) 11.834 24.098 ( -14.132 0.000 -0.314) 14.135 24.098 ( -14.132 0.000 0.314) 14.135 24.423 ( 5.903 0.000 -5.877) 8.330 24.423 ( 5.903 0.000 5.877) 8.330 24.883 ( -3.153 0.000 -14.941) 15.270 24.883 ( -3.153 0.000 14.941) 15.270 25.140 ( -3.942 0.000 -10.818) 11.514 25.140 ( -3.942 0.000 10.818) 11.514 25.674 ( 1.556 0.000 -2.283) 2.763 25.674 ( 1.556 0.000 2.283) 2.763 25.862 ( 25.957 0.000 -16.663) 30.845 25.862 ( 25.957 0.000 16.663) 30.845 26.345 ( 26.370 0.000 -16.951) 31.348 26.345 ( 26.370 0.000 16.951) 31.348 26.518 ( 5.530 0.000 -0.432) 5.547 26.518 ( 5.530 0.000 0.432) 5.547 26.838 ( -8.560 0.000 -22.473) 24.048 26.838 ( -8.560 0.000 22.473) 24.048 27.884 ( 1.360 0.000 -10.601) 10.688 27.884 ( 1.360 0.000 10.601) 10.688 28.245 ( -18.066 0.000 -10.469) 20.880 28.245 ( -18.066 0.000 10.469) 20.880 28.421 ( -10.649 0.000 -3.284) 11.144 28.421 ( -10.649 0.000 3.284) 11.144 28.947 ( 13.856 0.000 -2.418) 14.066 28.947 ( 13.856 0.000 2.418) 14.066 29.016 ( 3.319 0.000 -5.570) 6.483 29.016 ( 3.319 0.000 5.570) 6.483 29.235 ( -2.131 0.000 -3.775) 4.335 29.235 ( -2.131 0.000 3.775) 4.335 29.785 ( 3.296 0.000 -4.463) 5.548 29.785 ( 3.296 0.000 4.463) 5.548 30.155 ( -0.288 0.000 -6.976) 6.982 30.155 ( -0.288 0.000 6.976) 6.982 30.693 ( -4.592 0.000 -0.950) 4.689 30.693 ( -4.592 0.000 0.950) 4.689 30.788 ( -5.776 0.000 -4.338) 7.224 30.788 ( -5.776 0.000 4.338) 7.224 31.025 ( 2.480 0.000 -1.592) 2.947 31.025 ( 2.480 0.000 1.592) 2.947 31.365 ( 13.039 0.000 -6.076) 14.386 31.365 ( 13.039 0.000 6.076) 14.386 31.661 ( 1.496 0.000 -10.269) 10.377 31.661 ( 1.496 0.000 10.269) 10.377 32.104 ( 0.283 0.000 -1.005) 1.044 32.104 ( 0.283 0.000 1.005) 1.044 32.260 ( -6.153 0.000 -0.133) 6.154 32.260 ( -6.153 0.000 0.133) 6.154 32.488 ( 0.134 0.000 -4.257) 4.259 32.488 ( 0.134 0.000 4.257) 4.259 32.913 ( 2.863 0.000 -3.113) 4.229 32.913 ( 2.863 0.000 3.113) 4.229 33.178 ( 1.592 0.000 -1.298) 2.054 33.178 ( 1.592 0.000 1.298) 2.054 33.590 ( -6.259 0.000 -2.575) 6.768 33.590 ( -6.259 0.000 2.575) 6.768 33.713 ( -0.679 0.000 -0.119) 0.689 33.713 ( -0.679 0.000 0.119) 0.689 34.651 ( -4.476 0.000 -0.570) 4.512 34.651 ( -4.476 0.000 0.570) 4.512 ======================= Grid point 114 (39/54) ======================= q-point: (-0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 30 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.953 ( 0.000 0.000 -0.000) 0.000 1.953 ( 0.000 0.000 0.000) 0.000 2.038 ( 0.000 0.000 0.000) 0.000 2.038 ( 0.000 0.000 0.000) 0.000 2.312 ( -0.000 0.000 -0.000) 0.000 2.312 ( 0.000 0.000 -0.000) 0.000 2.324 ( -0.000 0.000 0.000) 0.000 2.324 ( 0.000 0.000 0.000) 0.000 2.855 ( 0.000 0.000 0.000) 0.000 2.855 ( 0.000 0.000 0.000) 0.000 3.041 ( -0.000 0.000 0.000) 0.000 3.041 ( 0.000 0.000 0.000) 0.000 3.240 ( 0.000 0.000 0.000) 0.000 3.240 ( 0.000 0.000 0.000) 0.000 3.293 ( -0.000 0.000 0.000) 0.000 3.293 ( 0.000 0.000 0.000) 0.000 3.357 ( 0.000 0.000 0.000) 0.000 3.357 ( 0.000 0.000 0.000) 0.000 3.411 ( 0.000 0.000 0.000) 0.000 3.411 ( -0.000 0.000 0.000) 0.000 3.633 ( -0.000 0.000 0.000) 0.000 3.633 ( -0.000 0.000 0.000) 0.000 3.770 ( 0.000 0.000 -0.000) 0.000 3.770 ( 0.000 0.000 0.000) 0.000 3.880 ( 0.000 0.000 -0.000) 0.000 3.880 ( 0.000 0.000 0.000) 0.000 4.395 ( 0.000 0.000 0.000) 0.000 4.395 ( 0.000 0.000 0.000) 0.000 4.816 ( 0.000 0.000 0.000) 0.000 4.816 ( 0.000 0.000 0.000) 0.000 4.905 ( 0.000 0.000 0.000) 0.000 4.905 ( -0.000 0.000 0.000) 0.000 5.472 ( 0.000 0.000 0.000) 0.000 5.472 ( 0.000 0.000 0.000) 0.000 5.740 ( 0.000 0.000 0.000) 0.000 5.740 ( 0.000 0.000 0.000) 0.000 6.635 ( 0.000 0.000 0.000) 0.000 6.635 ( 0.000 0.000 0.000) 0.000 6.798 ( -0.000 0.000 -0.000) 0.000 6.798 ( 0.000 0.000 -0.000) 0.000 6.805 ( 0.000 0.000 0.000) 0.000 6.805 ( 0.000 0.000 0.000) 0.000 6.909 ( -0.000 0.000 -0.000) 0.000 6.909 ( 0.000 0.000 0.000) 0.000 7.413 ( -0.000 0.000 -0.000) 0.000 7.413 ( 0.000 0.000 -0.000) 0.000 7.455 ( 0.000 0.000 0.000) 0.000 7.455 ( -0.000 0.000 0.000) 0.000 7.644 ( -0.000 0.000 0.000) 0.000 7.644 ( 0.000 0.000 0.000) 0.000 7.872 ( 0.000 0.000 0.000) 0.000 7.872 ( 0.000 0.000 0.000) 0.000 8.087 ( -0.000 0.000 -0.000) 0.000 8.087 ( 0.000 0.000 0.000) 0.000 8.179 ( 0.000 0.000 0.000) 0.000 8.179 ( 0.000 0.000 0.000) 0.000 8.422 ( -0.000 0.000 -0.000) 0.000 8.422 ( -0.000 0.000 0.000) 0.000 8.472 ( 0.000 0.000 -0.000) 0.000 8.472 ( 0.000 0.000 0.000) 0.000 9.065 ( -0.000 0.000 -0.000) 0.000 9.065 ( -0.000 0.000 0.000) 0.000 9.163 ( -0.000 0.000 0.000) 0.000 9.163 ( 0.000 0.000 0.000) 0.000 9.643 ( 0.000 0.000 0.000) 0.000 9.643 ( 0.000 0.000 0.000) 0.000 9.766 ( 0.000 0.000 0.000) 0.000 9.766 ( 0.000 0.000 0.000) 0.000 10.168 ( -0.000 0.000 0.000) 0.000 10.168 ( -0.000 0.000 0.000) 0.000 10.246 ( 0.000 0.000 -0.000) 0.000 10.246 ( 0.000 0.000 0.000) 0.000 10.716 ( -0.000 0.000 0.000) 0.000 10.716 ( 0.000 0.000 0.000) 0.000 10.849 ( 0.000 0.000 0.000) 0.000 10.849 ( 0.000 0.000 0.000) 0.000 11.096 ( -0.000 0.000 0.000) 0.000 11.096 ( 0.000 0.000 0.000) 0.000 11.311 ( 0.000 0.000 0.000) 0.000 11.311 ( 0.000 0.000 0.000) 0.000 11.520 ( 0.000 0.000 -0.000) 0.000 11.520 ( -0.000 0.000 0.000) 0.000 11.707 ( 0.000 0.000 0.000) 0.000 11.707 ( 0.000 0.000 0.000) 0.000 12.086 ( -0.000 0.000 0.000) 0.000 12.086 ( 0.000 0.000 0.000) 0.000 12.096 ( 0.000 0.000 0.000) 0.000 12.096 ( 0.000 0.000 0.000) 0.000 12.358 ( -0.000 0.000 -0.000) 0.000 12.358 ( 0.000 0.000 -0.000) 0.000 12.381 ( -0.000 0.000 0.000) 0.000 12.381 ( -0.000 0.000 0.000) 0.000 12.538 ( 0.000 0.000 0.000) 0.000 12.538 ( 0.000 0.000 0.000) 0.000 12.623 ( 0.000 0.000 0.000) 0.000 12.623 ( 0.000 0.000 0.000) 0.000 12.732 ( 0.000 0.000 0.000) 0.000 12.732 ( 0.000 0.000 0.000) 0.000 12.922 ( -0.000 0.000 0.000) 0.000 12.922 ( 0.000 0.000 0.000) 0.000 13.322 ( 0.000 0.000 0.000) 0.000 13.322 ( 0.000 0.000 0.000) 0.000 13.394 ( 0.000 0.000 0.000) 0.000 13.394 ( -0.000 0.000 0.000) 0.000 13.582 ( 0.000 0.000 0.000) 0.000 13.582 ( 0.000 0.000 0.000) 0.000 13.923 ( 0.000 0.000 0.000) 0.000 13.923 ( 0.000 0.000 0.000) 0.000 14.454 ( 0.000 0.000 0.000) 0.000 14.454 ( 0.000 0.000 0.000) 0.000 14.496 ( 0.000 0.000 0.000) 0.000 14.496 ( 0.000 0.000 0.000) 0.000 14.850 ( 0.000 0.000 0.000) 0.000 14.850 ( 0.000 0.000 0.000) 0.000 15.080 ( 0.000 0.000 -0.000) 0.000 15.080 ( -0.000 0.000 0.000) 0.000 15.086 ( 0.000 0.000 -0.000) 0.000 15.086 ( 0.000 0.000 0.000) 0.000 15.621 ( 0.000 0.000 -0.000) 0.000 15.621 ( 0.000 0.000 0.000) 0.000 15.886 ( 0.000 0.000 0.000) 0.000 15.886 ( 0.000 0.000 0.000) 0.000 16.073 ( 0.000 0.000 0.000) 0.000 16.073 ( -0.000 0.000 0.000) 0.000 16.551 ( -0.000 0.000 0.000) 0.000 16.551 ( 0.000 0.000 0.000) 0.000 16.928 ( 0.000 0.000 0.000) 0.000 16.928 ( 0.000 0.000 0.000) 0.000 17.787 ( 0.000 0.000 0.000) 0.000 17.787 ( 0.000 0.000 0.000) 0.000 17.877 ( -0.000 0.000 -0.000) 0.000 17.877 ( 0.000 0.000 -0.000) 0.000 17.884 ( -0.000 0.000 0.000) 0.000 17.884 ( 0.000 0.000 0.000) 0.000 17.997 ( -0.000 0.000 -0.000) 0.000 17.997 ( 0.000 0.000 0.000) 0.000 18.341 ( -0.000 0.000 -0.000) 0.000 18.341 ( -0.000 0.000 0.000) 0.000 18.346 ( 0.000 0.000 -0.000) 0.000 18.346 ( 0.000 0.000 0.000) 0.000 18.552 ( 0.000 0.000 0.000) 0.000 18.552 ( 0.000 0.000 0.000) 0.000 18.887 ( -0.000 0.000 -0.000) 0.000 18.887 ( 0.000 0.000 0.000) 0.000 18.921 ( 0.000 0.000 0.000) 0.000 18.921 ( 0.000 0.000 0.000) 0.000 19.724 ( 0.000 0.000 0.000) 0.000 19.724 ( -0.000 0.000 0.000) 0.000 19.851 ( 0.000 0.000 0.000) 0.000 19.851 ( 0.000 0.000 0.000) 0.000 20.075 ( 0.000 0.000 0.000) 0.000 20.075 ( 0.000 0.000 0.000) 0.000 20.295 ( -0.000 0.000 0.000) 0.000 20.295 ( 0.000 0.000 0.000) 0.000 20.483 ( 0.000 0.000 0.000) 0.000 20.483 ( -0.000 0.000 0.000) 0.000 20.748 ( -0.000 0.000 -0.000) 0.000 20.748 ( 0.000 0.000 0.000) 0.000 21.046 ( 0.000 0.000 0.000) 0.000 21.046 ( 0.000 0.000 0.000) 0.000 21.128 ( 0.000 0.000 0.000) 0.000 21.128 ( 0.000 0.000 0.000) 0.000 21.167 ( -0.000 0.000 -0.000) 0.000 21.167 ( -0.000 0.000 0.000) 0.000 22.213 ( 0.000 0.000 0.000) 0.000 22.213 ( -0.000 0.000 0.000) 0.000 22.428 ( -0.000 0.000 0.000) 0.000 22.428 ( 0.000 0.000 -0.000) 0.000 22.737 ( 0.000 0.000 0.000) 0.000 22.737 ( 0.000 0.000 0.000) 0.000 23.049 ( 0.000 0.000 0.000) 0.000 23.049 ( 0.000 0.000 0.000) 0.000 23.236 ( -0.000 0.000 -0.000) 0.000 23.236 ( -0.000 0.000 0.000) 0.000 23.411 ( 0.000 0.000 -0.000) 0.000 23.411 ( 0.000 0.000 0.000) 0.000 23.693 ( 0.000 0.000 0.000) 0.000 23.693 ( 0.000 0.000 0.000) 0.000 23.902 ( 0.000 0.000 0.000) 0.000 23.902 ( 0.000 0.000 0.000) 0.000 23.969 ( 0.000 0.000 0.000) 0.000 23.969 ( 0.000 0.000 0.000) 0.000 24.495 ( 0.000 0.000 0.000) 0.000 24.495 ( -0.000 0.000 0.000) 0.000 24.808 ( 0.000 0.000 0.000) 0.000 24.808 ( 0.000 0.000 0.000) 0.000 25.138 ( 0.000 0.000 0.000) 0.000 25.138 ( 0.000 0.000 0.000) 0.000 25.673 ( 0.000 0.000 0.000) 0.000 25.673 ( 0.000 0.000 0.000) 0.000 26.193 ( -0.000 0.000 0.000) 0.000 26.193 ( 0.000 0.000 0.000) 0.000 26.521 ( 0.000 0.000 0.000) 0.000 26.521 ( 0.000 0.000 0.000) 0.000 26.660 ( -0.000 0.000 0.000) 0.000 26.660 ( 0.000 0.000 0.000) 0.000 26.794 ( 0.000 0.000 0.000) 0.000 26.794 ( 0.000 0.000 0.000) 0.000 27.754 ( 0.000 0.000 0.000) 0.000 27.754 ( 0.000 0.000 0.000) 0.000 28.138 ( 0.000 0.000 0.000) 0.000 28.138 ( 0.000 0.000 0.000) 0.000 28.290 ( -0.000 0.000 0.000) 0.000 28.290 ( -0.000 0.000 0.000) 0.000 29.000 ( 0.000 0.000 0.000) 0.000 29.000 ( 0.000 0.000 0.000) 0.000 29.154 ( -0.000 0.000 -0.000) 0.000 29.154 ( 0.000 0.000 0.000) 0.000 29.276 ( 0.000 0.000 0.000) 0.000 29.276 ( 0.000 0.000 0.000) 0.000 29.708 ( 0.000 0.000 0.000) 0.000 29.708 ( -0.000 0.000 0.000) 0.000 30.209 ( 0.000 0.000 -0.000) 0.000 30.209 ( 0.000 0.000 0.000) 0.000 30.628 ( 0.000 0.000 0.000) 0.000 30.628 ( 0.000 0.000 0.000) 0.000 30.722 ( -0.000 0.000 0.000) 0.000 30.722 ( 0.000 0.000 0.000) 0.000 31.067 ( 0.000 0.000 0.000) 0.000 31.067 ( 0.000 0.000 0.000) 0.000 31.536 ( -0.000 0.000 -0.000) 0.000 31.536 ( -0.000 0.000 0.000) 0.000 31.647 ( 0.000 0.000 0.000) 0.000 31.647 ( 0.000 0.000 0.000) 0.000 32.107 ( 0.000 0.000 0.000) 0.000 32.107 ( 0.000 0.000 0.000) 0.000 32.205 ( 0.000 0.000 0.000) 0.000 32.205 ( 0.000 0.000 0.000) 0.000 32.475 ( 0.000 0.000 0.000) 0.000 32.475 ( 0.000 0.000 0.000) 0.000 32.947 ( 0.000 0.000 0.000) 0.000 32.947 ( 0.000 0.000 0.000) 0.000 33.200 ( 0.000 0.000 0.000) 0.000 33.200 ( 0.000 0.000 0.000) 0.000 33.507 ( 0.000 0.000 0.000) 0.000 33.507 ( 0.000 0.000 0.000) 0.000 33.707 ( 0.000 0.000 0.000) 0.000 33.707 ( 0.000 0.000 0.000) 0.000 34.600 ( 0.000 0.000 0.000) 0.000 34.600 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 120 (40/54) ======================= q-point: ( 0.00 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 51 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.620 ( 0.000 15.591 -27.343) 31.476 1.620 ( 0.000 15.591 27.343) 31.476 1.704 ( 0.000 9.873 -30.978) 32.513 1.704 ( 0.000 9.873 30.978) 32.513 2.467 ( 0.000 0.863 -20.014) 20.032 2.467 ( 0.000 0.863 20.014) 20.032 2.601 ( 0.000 1.456 -14.661) 14.734 2.601 ( 0.000 1.456 14.661) 14.734 2.826 ( 0.000 -0.954 -33.965) 33.978 2.826 ( 0.000 -0.954 33.965) 33.978 2.961 ( 0.000 0.579 -2.147) 2.224 2.961 ( 0.000 0.579 2.147) 2.224 3.197 ( 0.000 1.970 -4.844) 5.230 3.197 ( 0.000 1.970 4.844) 5.230 3.235 ( 0.000 0.750 -4.436) 4.499 3.235 ( 0.000 0.750 4.436) 4.499 3.407 ( 0.000 -3.168 -1.788) 3.638 3.407 ( 0.000 -3.168 1.788) 3.638 3.434 ( 0.000 4.172 -6.644) 7.845 3.434 ( 0.000 4.172 6.644) 7.845 3.528 ( 0.000 -1.488 -0.471) 1.560 3.528 ( 0.000 -1.488 0.471) 1.560 3.829 ( 0.000 3.137 -6.107) 6.866 3.829 ( 0.000 3.137 6.107) 6.866 4.345 ( 0.000 -1.353 -7.522) 7.642 4.345 ( 0.000 -1.353 7.522) 7.642 4.426 ( 0.000 0.513 -3.500) 3.538 4.426 ( 0.000 0.513 3.500) 3.538 4.814 ( 0.000 -2.430 -2.373) 3.396 4.814 ( 0.000 -2.430 2.373) 3.396 5.042 ( 0.000 -0.700 -4.236) 4.293 5.042 ( 0.000 -0.700 4.236) 4.293 5.128 ( 0.000 -3.751 -1.186) 3.934 5.128 ( 0.000 -3.751 1.186) 3.934 5.861 ( 0.000 -1.362 -4.989) 5.171 5.861 ( 0.000 -1.362 4.989) 5.171 6.232 ( 0.000 1.390 -4.693) 4.894 6.232 ( 0.000 1.390 4.693) 4.894 6.835 ( 0.000 -5.785 -11.135) 12.548 6.835 ( 0.000 -5.785 11.135) 12.548 6.925 ( 0.000 -1.915 -2.545) 3.185 6.925 ( 0.000 -1.915 2.545) 3.185 7.001 ( 0.000 -6.706 -8.016) 10.451 7.001 ( 0.000 -6.706 8.016) 10.451 7.300 ( 0.000 1.267 -3.784) 3.990 7.300 ( 0.000 1.267 3.784) 3.990 7.383 ( 0.000 -0.440 -13.560) 13.568 7.383 ( 0.000 -0.440 13.560) 13.568 7.731 ( 0.000 7.708 -4.840) 9.102 7.731 ( 0.000 7.708 4.840) 9.102 7.823 ( 0.000 1.048 -16.570) 16.603 7.823 ( 0.000 1.048 16.570) 16.603 7.961 ( 0.000 2.827 -8.048) 8.530 7.961 ( 0.000 2.827 8.048) 8.530 8.319 ( 0.000 1.511 -10.857) 10.961 8.319 ( 0.000 1.511 10.857) 10.961 8.567 ( 0.000 2.177 -0.845) 2.336 8.567 ( 0.000 2.177 0.845) 2.336 8.592 ( 0.000 -0.568 -8.057) 8.077 8.592 ( 0.000 -0.568 8.057) 8.077 8.952 ( 0.000 0.239 -13.008) 13.010 8.952 ( 0.000 0.239 13.008) 13.010 9.285 ( 0.000 0.973 -4.154) 4.267 9.285 ( 0.000 0.973 4.154) 4.267 9.390 ( 0.000 0.832 -3.766) 3.857 9.390 ( 0.000 0.832 3.766) 3.857 9.880 ( 0.000 -0.528 -1.642) 1.725 9.880 ( 0.000 -0.528 1.642) 1.725 10.142 ( 0.000 1.866 -5.479) 5.788 10.142 ( 0.000 1.866 5.479) 5.788 10.430 ( 0.000 -0.779 -6.030) 6.080 10.430 ( 0.000 -0.779 6.030) 6.080 10.758 ( 0.000 1.713 -11.856) 11.979 10.758 ( 0.000 1.713 11.856) 11.979 10.804 ( 0.000 -3.776 -15.305) 15.764 10.804 ( 0.000 -3.776 15.305) 15.764 11.130 ( 0.000 -3.168 -5.236) 6.120 11.130 ( 0.000 -3.168 5.236) 6.120 11.329 ( 0.000 -3.060 -2.664) 4.057 11.329 ( 0.000 -3.060 2.664) 4.057 11.540 ( 0.000 -4.855 -11.318) 12.315 11.540 ( 0.000 -4.855 11.318) 12.315 11.880 ( 0.000 -5.671 -10.610) 12.030 11.880 ( 0.000 -5.671 10.610) 12.030 12.033 ( 0.000 2.956 -2.739) 4.030 12.033 ( 0.000 2.956 2.739) 4.030 12.068 ( 0.000 3.065 -7.615) 8.209 12.068 ( 0.000 3.065 7.615) 8.209 12.214 ( 0.000 -0.424 -1.994) 2.038 12.214 ( 0.000 -0.424 1.994) 2.038 12.420 ( 0.000 2.434 -6.478) 6.920 12.420 ( 0.000 2.434 6.478) 6.920 12.462 ( 0.000 -1.070 -9.179) 9.241 12.462 ( 0.000 -1.070 9.179) 9.241 12.518 ( 0.000 0.040 -4.509) 4.509 12.518 ( 0.000 0.040 4.509) 4.509 12.883 ( 0.000 -1.371 -4.335) 4.547 12.883 ( 0.000 -1.371 4.335) 4.547 13.066 ( 0.000 1.353 -8.789) 8.892 13.066 ( 0.000 1.353 8.789) 8.892 13.144 ( 0.000 2.341 -21.159) 21.288 13.144 ( 0.000 2.341 21.159) 21.288 13.284 ( 0.000 0.439 -4.738) 4.759 13.284 ( 0.000 0.439 4.738) 4.759 13.557 ( 0.000 -3.361 -13.134) 13.558 13.557 ( 0.000 -3.361 13.134) 13.558 13.678 ( 0.000 3.717 -9.638) 10.330 13.678 ( 0.000 3.717 9.638) 10.330 14.197 ( 0.000 -1.098 -5.635) 5.741 14.197 ( 0.000 -1.098 5.635) 5.741 14.666 ( 0.000 1.203 -20.488) 20.524 14.666 ( 0.000 1.203 20.488) 20.524 14.817 ( 0.000 -1.964 -9.099) 9.309 14.817 ( 0.000 -1.964 9.099) 9.309 15.117 ( 0.000 -0.216 -13.942) 13.944 15.117 ( 0.000 -0.216 13.942) 13.944 15.197 ( 0.000 1.595 -11.113) 11.227 15.197 ( 0.000 1.595 11.113) 11.227 15.856 ( 0.000 1.304 -13.203) 13.267 15.856 ( 0.000 1.304 13.203) 13.267 15.887 ( 0.000 3.441 -2.480) 4.241 15.887 ( 0.000 3.441 2.480) 4.241 15.979 ( 0.000 3.719 -10.820) 11.441 15.979 ( 0.000 3.719 10.820) 11.441 17.013 ( 0.000 0.080 -0.985) 0.989 17.013 ( 0.000 0.080 0.985) 0.989 17.134 ( 0.000 -1.982 -17.007) 17.122 17.134 ( 0.000 -1.982 17.007) 17.122 17.536 ( 0.000 1.187 -5.503) 5.629 17.536 ( 0.000 1.187 5.503) 5.629 17.787 ( 0.000 1.016 -4.459) 4.574 17.787 ( 0.000 1.016 4.459) 4.574 17.849 ( 0.000 -1.393 -18.528) 18.580 17.849 ( 0.000 -1.393 18.528) 18.580 18.134 ( 0.000 -0.355 -6.062) 6.072 18.134 ( 0.000 -0.355 6.062) 6.072 18.223 ( 0.000 -0.314 -4.821) 4.831 18.223 ( 0.000 -0.314 4.821) 4.831 18.356 ( 0.000 0.795 -2.695) 2.810 18.356 ( 0.000 0.795 2.695) 2.810 18.462 ( 0.000 1.630 -5.039) 5.296 18.462 ( 0.000 1.630 5.039) 5.296 18.829 ( 0.000 -0.073 -6.619) 6.619 18.829 ( 0.000 -0.073 6.619) 6.619 18.879 ( 0.000 0.094 -3.102) 3.103 18.879 ( 0.000 0.094 3.102) 3.103 19.422 ( 0.000 0.941 -2.957) 3.104 19.422 ( 0.000 0.941 2.957) 3.104 19.568 ( 0.000 0.944 -4.300) 4.402 19.568 ( 0.000 0.944 4.300) 4.402 20.112 ( 0.000 0.404 -2.021) 2.061 20.112 ( 0.000 0.404 2.021) 2.061 20.490 ( 0.000 -0.478 -5.147) 5.169 20.490 ( 0.000 -0.478 5.147) 5.169 20.706 ( 0.000 -0.029 -10.140) 10.140 20.706 ( 0.000 -0.029 10.140) 10.140 20.767 ( 0.000 -3.048 -1.943) 3.615 20.767 ( 0.000 -3.048 1.943) 3.615 20.897 ( 0.000 -0.317 -4.626) 4.637 20.897 ( 0.000 -0.317 4.626) 4.637 21.309 ( 0.000 0.256 -4.972) 4.978 21.309 ( 0.000 0.256 4.972) 4.978 21.373 ( 0.000 -2.556 -15.143) 15.357 21.373 ( 0.000 -2.556 15.143) 15.357 22.123 ( 0.000 -7.219 -13.325) 15.155 22.123 ( 0.000 -7.219 13.325) 15.155 22.462 ( 0.000 0.829 -0.766) 1.129 22.462 ( 0.000 0.829 0.766) 1.129 22.858 ( 0.000 -1.054 -15.923) 15.958 22.858 ( 0.000 -1.054 15.923) 15.958 22.938 ( 0.000 -2.223 -11.199) 11.417 22.938 ( 0.000 -2.223 11.199) 11.417 23.038 ( 0.000 -0.064 -8.066) 8.067 23.038 ( 0.000 -0.064 8.066) 8.067 23.638 ( 0.000 -0.577 -4.040) 4.081 23.638 ( 0.000 -0.577 4.040) 4.081 23.730 ( 0.000 0.578 -2.201) 2.275 23.730 ( 0.000 0.578 2.201) 2.275 24.124 ( 0.000 0.012 -4.276) 4.276 24.124 ( 0.000 0.012 4.276) 4.276 24.201 ( 0.000 -5.552 -13.369) 14.477 24.201 ( 0.000 -5.552 13.369) 14.477 24.523 ( 0.000 -0.171 -0.921) 0.937 24.523 ( 0.000 -0.171 0.921) 0.937 24.681 ( 0.000 -8.442 -9.059) 12.382 24.681 ( 0.000 -8.442 9.059) 12.382 25.309 ( 0.000 -6.739 -6.494) 9.359 25.309 ( 0.000 -6.739 6.494) 9.359 25.407 ( 0.000 -9.245 -5.541) 10.779 25.407 ( 0.000 -9.245 5.541) 10.779 25.472 ( 0.000 0.112 -24.130) 24.131 25.472 ( 0.000 0.112 24.130) 24.131 25.849 ( 0.000 -5.539 -7.670) 9.461 25.849 ( 0.000 -5.539 7.670) 9.461 26.490 ( 0.000 0.014 -0.983) 0.983 26.490 ( 0.000 0.014 0.983) 0.983 26.929 ( 0.000 -0.133 -22.282) 22.282 26.929 ( 0.000 -0.133 22.282) 22.282 27.826 ( 0.000 -0.517 -10.201) 10.214 27.826 ( 0.000 -0.517 10.201) 10.214 28.472 ( 0.000 -5.948 -5.902) 8.379 28.472 ( 0.000 -5.948 5.902) 8.379 28.508 ( 0.000 -14.543 -14.393) 20.461 28.508 ( 0.000 -14.543 14.393) 20.461 28.565 ( 0.000 -1.765 -7.944) 8.138 28.565 ( 0.000 -1.765 7.944) 8.138 28.954 ( 0.000 -4.696 -0.339) 4.708 28.954 ( 0.000 -4.696 0.339) 4.708 29.314 ( 0.000 -0.265 -17.710) 17.712 29.314 ( 0.000 -0.265 17.710) 17.712 29.490 ( 0.000 -7.896 -12.844) 15.077 29.490 ( 0.000 -7.896 12.844) 15.077 30.133 ( 0.000 -7.103 -9.051) 11.506 30.133 ( 0.000 -7.103 9.051) 11.506 30.713 ( 0.000 -1.109 -7.595) 7.676 30.713 ( 0.000 -1.109 7.595) 7.676 30.825 ( 0.000 -4.955 -1.851) 5.289 30.825 ( 0.000 -4.955 1.851) 5.289 31.058 ( 0.000 1.279 -8.183) 8.282 31.058 ( 0.000 1.279 8.183) 8.282 31.096 ( 0.000 -5.739 -2.349) 6.201 31.096 ( 0.000 -5.739 2.349) 6.201 31.584 ( 0.000 -6.120 -10.379) 12.050 31.584 ( 0.000 -6.120 10.379) 12.050 31.786 ( 0.000 -15.663 -1.370) 15.723 31.786 ( 0.000 -15.663 1.370) 15.723 32.089 ( 0.000 -23.094 -12.805) 26.406 32.089 ( 0.000 -23.094 12.805) 26.406 32.453 ( 0.000 -14.077 -12.410) 18.766 32.453 ( 0.000 -14.077 12.410) 18.766 32.769 ( 0.000 18.406 -12.378) 22.181 32.769 ( 0.000 18.406 12.378) 22.181 33.206 ( 0.000 -1.271 -9.815) 9.897 33.206 ( 0.000 -1.271 9.815) 9.897 33.440 ( 0.000 -0.742 -6.634) 6.676 33.440 ( 0.000 -0.742 6.634) 6.676 34.056 ( 0.000 10.791 -10.104) 14.783 34.056 ( 0.000 10.791 10.104) 14.783 35.707 ( 0.000 57.310 -52.194) 77.515 35.707 ( 0.000 57.310 52.194) 77.515 ======================= Grid point 122 (41/54) ======================= q-point: ( 0.25 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( 12.170 9.097 -23.771) 28.212 1.727 ( 12.170 9.097 23.771) 28.212 1.894 ( 15.645 9.868 -23.975) 30.281 1.894 ( 15.645 9.868 23.975) 30.281 2.412 ( -10.365 1.803 -3.654) 11.137 2.412 ( -10.365 1.803 3.654) 11.137 2.619 ( 1.586 -1.049 -3.706) 4.165 2.619 ( 1.586 -1.049 3.706) 4.165 2.873 ( -0.630 0.400 -20.227) 20.241 2.873 ( -0.630 0.400 20.227) 20.241 2.950 ( 1.860 4.879 -8.335) 9.835 2.950 ( 1.860 4.879 8.335) 9.835 3.141 ( 5.216 0.868 -3.904) 6.573 3.141 ( 5.216 0.868 3.904) 6.573 3.318 ( 0.172 0.932 -3.937) 4.049 3.318 ( 0.172 0.932 3.937) 4.049 3.362 ( -0.935 -0.628 -1.782) 2.108 3.362 ( -0.935 -0.628 1.782) 2.108 3.472 ( -0.436 2.072 -2.790) 3.502 3.472 ( -0.436 2.072 2.790) 3.502 3.527 ( 2.556 -2.115 -3.627) 4.916 3.527 ( 2.556 -2.115 3.627) 4.916 3.823 ( -0.803 3.618 -4.903) 6.146 3.823 ( -0.803 3.618 4.903) 6.146 4.174 ( -16.302 2.689 -3.318) 16.852 4.174 ( -16.302 2.689 3.318) 16.852 4.401 ( -1.391 -0.989 -2.196) 2.781 4.401 ( -1.391 -0.989 2.196) 2.781 4.710 ( -0.300 -4.387 -2.502) 5.059 4.710 ( -0.300 -4.387 2.502) 5.059 5.019 ( -9.081 -3.583 -0.677) 9.786 5.019 ( -9.081 -3.583 0.677) 9.786 5.301 ( 13.974 -1.426 -2.246) 14.225 5.301 ( 13.974 -1.426 2.246) 14.225 5.793 ( -4.936 -0.905 -5.386) 7.362 5.793 ( -4.936 -0.905 5.386) 7.362 6.388 ( 12.622 0.097 -2.483) 12.864 6.388 ( 12.622 0.097 2.483) 12.864 6.783 ( -5.505 -5.953 -9.445) 12.448 6.783 ( -5.505 -5.953 9.445) 12.448 6.897 ( 3.344 -0.580 -4.620) 5.732 6.897 ( 3.344 -0.580 4.620) 5.732 7.104 ( -11.663 -2.528 -5.047) 12.957 7.104 ( -11.663 -2.528 5.047) 12.957 7.261 ( 10.116 -1.216 -15.978) 18.950 7.261 ( 10.116 -1.216 15.978) 18.950 7.398 ( 4.242 1.997 -4.917) 6.794 7.398 ( 4.242 1.997 4.917) 6.794 7.593 ( -1.040 4.435 -11.322) 12.204 7.593 ( -1.040 4.435 11.322) 12.204 7.918 ( -1.933 3.145 -5.627) 6.730 7.918 ( -1.933 3.145 5.627) 6.730 8.094 ( 10.199 0.214 -9.646) 14.040 8.094 ( 10.199 0.214 9.646) 14.040 8.249 ( -7.467 -0.437 -8.002) 10.954 8.249 ( -7.467 -0.437 8.002) 10.954 8.432 ( -4.726 3.042 -3.530) 6.637 8.432 ( -4.726 3.042 3.530) 6.637 8.742 ( -8.802 1.827 -13.718) 16.401 8.742 ( -8.802 1.827 13.718) 16.401 8.878 ( 6.270 -1.143 -5.825) 8.634 8.878 ( 6.270 -1.143 5.825) 8.634 9.079 ( -0.459 1.187 -5.898) 6.034 9.079 ( -0.459 1.187 5.898) 6.034 9.595 ( 6.757 -0.351 -3.911) 7.815 9.595 ( 6.757 -0.351 3.911) 7.815 9.984 ( -11.656 1.720 -4.268) 12.531 9.984 ( -11.656 1.720 4.268) 12.531 10.049 ( 9.141 -0.616 -9.316) 13.066 10.049 ( 9.141 -0.616 9.316) 13.066 10.361 ( -9.711 -3.492 -5.518) 11.703 10.361 ( -9.711 -3.492 5.518) 11.703 10.711 ( -3.695 -2.832 -7.663) 8.966 10.711 ( -3.695 -2.832 7.663) 8.966 10.808 ( 1.011 -1.952 -5.976) 6.367 10.808 ( 1.011 -1.952 5.976) 6.367 11.006 ( -2.566 -1.940 -11.294) 11.744 11.006 ( -2.566 -1.940 11.294) 11.744 11.306 ( -0.660 -1.829 -0.718) 2.072 11.306 ( -0.660 -1.829 0.718) 2.072 11.628 ( 2.582 -4.192 -4.228) 6.490 11.628 ( 2.582 -4.192 4.228) 6.490 11.738 ( -11.400 -1.423 -7.290) 13.606 11.738 ( -11.400 -1.423 7.290) 13.606 12.055 ( 4.174 0.885 -2.151) 4.778 12.055 ( 4.174 0.885 2.151) 4.778 12.133 ( 0.648 0.305 -5.165) 5.214 12.133 ( 0.648 0.305 5.165) 5.214 12.275 ( 2.253 4.516 -4.793) 6.960 12.275 ( 2.253 4.516 4.793) 6.960 12.300 ( 4.072 0.424 -4.800) 6.309 12.300 ( 4.072 0.424 4.800) 6.309 12.505 ( 4.051 -0.690 -6.950) 8.074 12.505 ( 4.051 -0.690 6.950) 8.074 12.653 ( 1.390 -2.204 -3.208) 4.133 12.653 ( 1.390 -2.204 3.208) 4.133 12.802 ( -6.462 1.013 -6.780) 9.421 12.802 ( -6.462 1.013 6.780) 9.421 12.991 ( -3.513 1.921 -17.080) 17.543 12.991 ( -3.513 1.921 17.080) 17.543 13.177 ( 6.483 0.398 -5.597) 8.574 13.177 ( 6.483 0.398 5.597) 8.574 13.430 ( -0.038 -3.208 -2.216) 3.899 13.430 ( -0.038 -3.208 2.216) 3.899 13.553 ( 5.161 2.702 -8.698) 10.469 13.553 ( 5.161 2.702 8.698) 10.469 13.860 ( 10.495 1.478 -6.878) 12.635 13.860 ( 10.495 1.478 6.878) 12.635 14.274 ( 10.756 -1.469 -6.241) 12.522 14.274 ( 10.756 -1.469 6.241) 12.522 14.566 ( -8.215 0.183 -12.855) 15.257 14.566 ( -8.215 0.183 12.855) 15.257 14.840 ( 0.642 -1.155 -4.713) 4.895 14.840 ( 0.642 -1.155 4.713) 4.895 15.100 ( -2.069 0.329 -7.196) 7.494 15.100 ( -2.069 0.329 7.196) 7.494 15.168 ( -1.876 2.183 -6.944) 7.517 15.168 ( -1.876 2.183 6.944) 7.517 15.685 ( -4.894 3.345 -10.358) 11.934 15.685 ( -4.894 3.345 10.358) 11.934 15.863 ( -1.486 2.088 -0.218) 2.573 15.863 ( -1.486 2.088 0.218) 2.573 16.149 ( 3.627 2.054 -8.954) 9.876 16.149 ( 3.627 2.054 8.954) 9.876 16.690 ( -15.358 0.050 -1.694) 15.451 16.690 ( -15.358 0.050 1.694) 15.451 17.066 ( -11.240 -0.994 -16.167) 19.715 17.066 ( -11.240 -0.994 16.167) 19.715 17.695 ( 9.543 -0.142 -4.010) 10.352 17.695 ( 9.543 -0.142 4.010) 10.352 17.769 ( 0.613 -0.323 -8.229) 8.258 17.769 ( 0.613 -0.323 8.229) 8.258 17.890 ( 1.688 0.189 -7.443) 7.634 17.890 ( 1.688 0.189 7.443) 7.634 18.141 ( -6.135 -1.029 -2.373) 6.658 18.141 ( -6.135 -1.029 2.373) 6.658 18.235 ( 7.540 0.273 -3.459) 8.300 18.235 ( 7.540 0.273 3.459) 8.300 18.375 ( -0.194 1.139 -4.161) 4.318 18.375 ( -0.194 1.139 4.161) 4.318 18.513 ( 4.132 1.400 -2.711) 5.137 18.513 ( 4.132 1.400 2.711) 5.137 18.843 ( 1.919 -0.588 -5.388) 5.750 18.843 ( 1.919 -0.588 5.388) 5.750 18.913 ( 2.250 0.623 -3.395) 4.120 18.913 ( 2.250 0.623 3.395) 4.120 19.526 ( 9.774 0.440 -3.547) 10.407 19.526 ( 9.774 0.440 3.547) 10.407 19.740 ( 16.408 0.809 -8.513) 18.502 19.740 ( 16.408 0.809 8.513) 18.502 20.048 ( -6.943 0.338 -1.817) 7.185 20.048 ( -6.943 0.338 1.817) 7.185 20.479 ( -5.868 -1.792 -8.998) 10.891 20.479 ( -5.868 -1.792 8.998) 10.891 20.534 ( -5.649 -0.137 -3.299) 6.543 20.534 ( -5.649 -0.137 3.299) 6.543 20.816 ( -4.030 -0.175 -0.779) 4.109 20.816 ( -4.030 -0.175 0.779) 4.109 20.916 ( 2.366 -1.109 -4.685) 5.364 20.916 ( 2.366 -1.109 4.685) 5.364 21.106 ( -4.329 -0.841 -3.547) 5.659 21.106 ( -4.329 -0.841 3.547) 5.659 21.419 ( -10.353 -3.201 -1.623) 10.957 21.419 ( -10.353 -3.201 1.623) 10.957 22.056 ( 4.695 -1.276 -1.327) 5.043 22.056 ( 4.695 -1.276 1.327) 5.043 22.581 ( -2.026 -3.046 -5.726) 6.795 22.581 ( -2.026 -3.046 5.726) 6.795 22.717 ( -5.072 -0.355 -9.104) 10.428 22.717 ( -5.072 -0.355 9.104) 10.428 22.949 ( 3.787 -1.030 -6.762) 7.819 22.949 ( 3.787 -1.030 6.762) 7.819 23.138 ( 6.523 -0.413 -2.482) 6.992 23.138 ( 6.523 -0.413 2.482) 6.992 23.581 ( -9.242 0.438 -8.792) 12.764 23.581 ( -9.242 0.438 8.792) 12.764 23.676 ( -1.204 -1.423 -1.434) 2.351 23.676 ( -1.204 -1.423 1.434) 2.351 23.959 ( -7.736 -2.404 -9.975) 12.850 23.959 ( -7.736 -2.404 9.975) 12.850 24.068 ( -11.669 -2.320 -0.493) 11.907 24.068 ( -11.669 -2.320 0.493) 11.907 24.430 ( 6.177 0.673 -6.085) 8.697 24.430 ( 6.177 0.673 6.085) 8.697 24.892 ( -1.982 0.849 -14.478) 14.638 24.892 ( -1.982 0.849 14.478) 14.638 25.121 ( -3.594 -1.917 -10.005) 10.803 25.121 ( -3.594 -1.917 10.005) 10.803 25.669 ( 2.683 -0.636 -2.947) 4.036 25.669 ( 2.683 -0.636 2.947) 4.036 25.823 ( 30.890 -5.515 -12.526) 33.786 25.823 ( 30.890 -5.515 12.526) 33.786 26.115 ( 28.147 -16.543 -8.395) 33.710 26.115 ( 28.147 -16.543 8.395) 33.710 26.512 ( 3.046 -0.267 -1.159) 3.270 26.512 ( 3.046 -0.267 1.159) 3.270 26.841 ( -8.404 -0.280 -22.984) 24.474 26.841 ( -8.404 -0.280 22.984) 24.474 27.843 ( -6.274 -5.128 -12.123) 14.582 27.843 ( -6.274 -5.128 12.123) 14.582 28.110 ( -15.114 -10.385 -12.025) 21.929 28.110 ( -15.114 -10.385 12.025) 21.929 28.410 ( -8.285 -1.278 -3.516) 9.091 28.410 ( -8.285 -1.278 3.516) 9.091 28.821 ( 13.470 -12.367 -7.191) 19.650 28.821 ( 13.470 -12.367 7.191) 19.650 28.966 ( 1.987 -3.053 -1.423) 3.911 28.966 ( 1.987 -3.053 1.423) 3.911 29.200 ( -4.166 -2.038 -4.843) 6.705 29.200 ( -4.166 -2.038 4.843) 6.705 29.682 ( 5.022 -7.266 -2.800) 9.265 29.682 ( 5.022 -7.266 2.800) 9.265 30.096 ( 0.534 -5.176 -5.040) 7.244 30.096 ( 0.534 -5.176 5.040) 7.244 30.677 ( -4.081 -1.547 -0.895) 4.455 30.677 ( -4.081 -1.547 0.895) 4.455 30.766 ( -3.799 -1.762 -3.794) 5.651 30.766 ( -3.799 -1.762 3.794) 5.651 30.990 ( -0.196 -3.996 -3.038) 5.024 30.990 ( -0.196 -3.996 3.038) 5.024 31.292 ( 10.650 -5.215 -6.805) 13.672 31.292 ( 10.650 -5.215 6.805) 13.672 31.620 ( 2.642 -7.119 -12.671) 14.772 31.620 ( 2.642 -7.119 12.671) 14.772 31.799 ( 1.154 -15.314 -0.553) 15.367 31.799 ( 1.154 -15.314 0.553) 15.367 32.040 ( -4.127 -20.222 -11.924) 23.835 32.040 ( -4.127 -20.222 11.924) 23.835 32.408 ( -3.986 -11.887 -9.373) 15.654 32.408 ( -3.986 -11.887 9.373) 15.654 32.707 ( -3.429 5.476 -7.203) 9.676 32.707 ( -3.429 5.476 7.203) 9.676 33.279 ( 3.896 1.222 -10.105) 10.898 33.279 ( 3.896 1.222 10.105) 10.898 33.471 ( 2.671 1.910 -3.505) 4.803 33.471 ( 2.671 1.910 3.505) 4.803 34.164 ( 11.002 20.604 -12.537) 26.509 34.164 ( 11.002 20.604 12.537) 26.509 35.438 ( -22.918 50.512 -37.591) 67.006 35.438 ( -22.918 50.512 37.591) 67.006 ======================= Grid point 124 (42/54) ======================= q-point: (-0.50 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 50 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.944 ( 0.000 1.704 -12.419) 12.535 1.944 ( 0.000 1.704 12.419) 12.535 2.115 ( 0.000 5.144 -2.125) 5.566 2.115 ( 0.000 5.144 2.125) 5.566 2.315 ( 0.000 2.094 -5.623) 6.000 2.315 ( 0.000 2.094 5.623) 6.000 2.444 ( 0.000 9.927 -13.184) 16.504 2.444 ( -0.000 9.927 13.184) 16.504 2.844 ( 0.000 -1.092 -5.793) 5.895 2.844 ( 0.000 -1.092 5.793) 5.895 3.077 ( -0.000 3.124 -1.002) 3.281 3.077 ( -0.000 3.124 1.002) 3.281 3.251 ( 0.000 0.817 -1.888) 2.057 3.251 ( 0.000 0.817 1.888) 2.057 3.312 ( -0.000 1.010 -3.387) 3.534 3.312 ( 0.000 1.010 3.387) 3.534 3.341 ( 0.000 -0.597 -2.213) 2.292 3.341 ( 0.000 -0.597 2.213) 2.292 3.417 ( -0.000 1.064 -1.599) 1.920 3.417 ( 0.000 1.064 1.599) 1.920 3.641 ( 0.000 1.285 -10.314) 10.394 3.641 ( -0.000 1.285 10.314) 10.394 3.768 ( -0.000 0.695 -9.623) 9.648 3.768 ( 0.000 0.695 9.623) 9.648 3.946 ( 0.000 5.436 -3.757) 6.608 3.946 ( 0.000 5.436 3.757) 6.608 4.386 ( 0.000 -1.297 -1.997) 2.381 4.386 ( 0.000 -1.297 1.997) 2.381 4.762 ( 0.000 -5.061 -1.371) 5.243 4.762 ( -0.000 -5.061 1.371) 5.243 4.875 ( 0.000 -3.054 -0.508) 3.096 4.875 ( -0.000 -3.054 0.508) 3.096 5.447 ( 0.000 -2.207 -3.402) 4.055 5.447 ( 0.000 -2.207 3.402) 4.055 5.737 ( 0.000 -0.446 -1.459) 1.526 5.737 ( 0.000 -0.446 1.459) 1.526 6.587 ( 0.000 -4.402 -0.376) 4.418 6.587 ( 0.000 -4.402 0.376) 4.418 6.728 ( 0.000 -5.492 -8.620) 10.221 6.728 ( 0.000 -5.492 8.620) 10.221 6.823 ( -0.000 1.894 -5.380) 5.704 6.823 ( 0.000 1.894 5.380) 5.704 6.981 ( -0.000 4.769 -0.265) 4.777 6.981 ( 0.000 4.769 0.265) 4.777 7.438 ( -0.000 1.829 -16.898) 16.996 7.438 ( -0.000 1.829 16.898) 16.996 7.464 ( 0.000 0.038 -5.982) 5.982 7.464 ( -0.000 0.038 5.982) 5.982 7.641 ( -0.000 -0.577 -1.762) 1.854 7.641 ( 0.000 -0.577 1.762) 1.854 7.893 ( 0.000 0.816 -0.522) 0.968 7.893 ( 0.000 0.816 0.522) 0.968 8.075 ( 0.000 0.628 -3.253) 3.313 8.075 ( -0.000 0.628 3.253) 3.313 8.186 ( 0.000 0.876 -1.256) 1.531 8.186 ( 0.000 0.876 1.256) 1.531 8.436 ( 0.000 1.287 -4.950) 5.115 8.436 ( -0.000 1.287 4.950) 5.115 8.525 ( 0.000 4.248 -0.806) 4.324 8.525 ( 0.000 4.248 0.806) 4.324 9.046 ( -0.000 -1.802 -11.652) 11.791 9.046 ( 0.000 -1.802 11.652) 11.791 9.145 ( 0.000 -1.384 -14.299) 14.366 9.145 ( 0.000 -1.384 14.299) 14.366 9.673 ( 0.000 2.175 -6.923) 7.256 9.673 ( -0.000 2.175 6.923) 7.256 9.759 ( -0.000 -0.808 -7.320) 7.364 9.759 ( 0.000 -0.808 7.320) 7.364 10.088 ( -0.000 -5.507 -5.996) 8.142 10.088 ( 0.000 -5.507 5.996) 8.142 10.254 ( 0.000 -1.072 -2.318) 2.554 10.254 ( 0.000 -1.072 2.318) 2.554 10.708 ( 0.000 -0.614 -1.519) 1.639 10.708 ( 0.000 -0.614 1.519) 1.639 10.823 ( -0.000 -2.440 -2.432) 3.445 10.823 ( 0.000 -2.440 2.432) 3.445 11.042 ( 0.000 -4.729 -1.677) 5.018 11.042 ( -0.000 -4.729 1.677) 5.018 11.295 ( 0.000 -1.595 -1.175) 1.981 11.295 ( -0.000 -1.595 1.175) 1.981 11.524 ( 0.000 0.035 -2.980) 2.980 11.524 ( -0.000 0.035 2.980) 2.980 11.694 ( 0.000 -1.217 -3.918) 4.103 11.694 ( 0.000 -1.217 3.918) 4.103 12.065 ( 0.000 -1.340 -2.156) 2.539 12.065 ( 0.000 -1.340 2.156) 2.539 12.131 ( 0.000 2.550 -3.889) 4.651 12.131 ( 0.000 2.550 3.889) 4.651 12.344 ( 0.000 0.140 -1.174) 1.182 12.344 ( -0.000 0.140 1.174) 1.182 12.423 ( 0.000 1.734 -2.820) 3.311 12.423 ( 0.000 1.734 2.820) 3.311 12.561 ( 0.000 1.975 -2.508) 3.192 12.561 ( 0.000 1.975 2.508) 3.192 12.604 ( 0.000 -1.488 -3.423) 3.733 12.604 ( 0.000 -1.488 3.423) 3.733 12.731 ( 0.000 0.065 -1.900) 1.901 12.731 ( 0.000 0.065 1.900) 1.901 12.949 ( 0.000 2.710 -3.848) 4.706 12.949 ( 0.000 2.710 3.848) 4.706 13.269 ( 0.000 -4.123 -4.998) 6.479 13.269 ( 0.000 -4.123 4.998) 6.479 13.389 ( 0.000 -0.890 -1.835) 2.040 13.389 ( -0.000 -0.890 1.835) 2.040 13.630 ( 0.000 4.093 -2.429) 4.759 13.630 ( 0.000 4.093 2.429) 4.759 13.942 ( 0.000 1.362 -2.623) 2.955 13.942 ( 0.000 1.362 2.623) 2.955 14.429 ( -0.000 -2.349 -3.418) 4.148 14.429 ( 0.000 -2.349 3.418) 4.148 14.500 ( 0.000 0.438 -1.560) 1.620 14.500 ( -0.000 0.438 1.560) 1.620 14.833 ( 0.000 -1.505 -0.804) 1.706 14.833 ( 0.000 -1.505 0.804) 1.706 15.057 ( 0.000 0.329 -1.567) 1.601 15.057 ( 0.000 0.329 1.567) 1.601 15.162 ( -0.000 4.300 -4.332) 6.104 15.162 ( 0.000 4.300 4.332) 6.104 15.647 ( 0.000 2.585 -6.534) 7.026 15.647 ( 0.000 2.585 6.534) 7.026 15.900 ( 0.000 1.336 -0.929) 1.627 15.900 ( 0.000 1.336 0.929) 1.627 16.085 ( -0.000 1.084 -3.527) 3.690 16.085 ( -0.000 1.084 3.527) 3.690 16.552 ( 0.000 0.108 -1.713) 1.716 16.552 ( 0.000 0.108 1.713) 1.716 16.927 ( 0.000 -0.065 -1.470) 1.471 16.927 ( 0.000 -0.065 1.470) 1.471 17.780 ( 0.000 -0.721 -2.605) 2.703 17.780 ( 0.000 -0.721 2.605) 2.703 17.847 ( -0.000 -1.861 -8.887) 9.080 17.847 ( 0.000 -1.861 8.887) 9.080 17.897 ( 0.000 0.293 -4.989) 4.998 17.897 ( -0.000 0.293 4.989) 4.998 18.003 ( -0.000 0.472 -4.416) 4.441 18.003 ( -0.000 0.472 4.416) 4.441 18.344 ( -0.000 0.573 -1.351) 1.467 18.344 ( -0.000 0.573 1.351) 1.467 18.363 ( 0.000 1.491 -4.266) 4.519 18.363 ( 0.000 1.491 4.266) 4.519 18.563 ( 0.000 0.949 -1.335) 1.638 18.563 ( 0.000 0.949 1.335) 1.638 18.874 ( 0.000 -1.199 -2.127) 2.442 18.874 ( 0.000 -1.199 2.127) 2.442 18.935 ( 0.000 1.226 -1.270) 1.765 18.935 ( 0.000 1.226 1.270) 1.765 19.718 ( -0.000 -0.522 -0.319) 0.612 19.718 ( 0.000 -0.522 0.319) 0.612 19.856 ( 0.000 0.481 -0.247) 0.541 19.856 ( 0.000 0.481 0.247) 0.541 20.079 ( -0.000 0.462 -1.860) 1.916 20.079 ( 0.000 0.462 1.860) 1.916 20.295 ( 0.000 -0.107 -3.233) 3.234 20.295 ( -0.000 -0.107 3.233) 3.234 20.477 ( 0.000 -0.649 -0.099) 0.657 20.477 ( -0.000 -0.649 0.099) 0.657 20.727 ( 0.000 -1.965 -1.520) 2.484 20.727 ( -0.000 -1.965 1.520) 2.484 21.043 ( 0.000 -0.312 -0.673) 0.742 21.043 ( 0.000 -0.312 0.673) 0.742 21.121 ( 0.000 -0.725 -1.099) 1.316 21.121 ( -0.000 -0.725 1.099) 1.316 21.151 ( -0.000 -1.525 -2.299) 2.759 21.151 ( 0.000 -1.525 2.299) 2.759 22.192 ( -0.000 -1.984 -2.639) 3.301 22.192 ( -0.000 -1.984 2.639) 3.301 22.425 ( 0.000 -0.270 -2.150) 2.166 22.425 ( 0.000 -0.270 2.150) 2.166 22.714 ( 0.000 -2.001 -0.431) 2.047 22.714 ( 0.000 -2.001 0.431) 2.047 23.047 ( 0.000 -0.258 -0.432) 0.503 23.047 ( 0.000 -0.258 0.432) 0.503 23.224 ( -0.000 -1.048 -2.367) 2.589 23.224 ( -0.000 -1.048 2.367) 2.589 23.414 ( 0.000 0.217 -2.782) 2.790 23.414 ( 0.000 0.217 2.782) 2.790 23.675 ( 0.000 -1.631 -0.149) 1.638 23.675 ( 0.000 -1.631 0.149) 1.638 23.886 ( 0.000 -1.291 -1.656) 2.100 23.886 ( -0.000 -1.291 1.656) 2.100 23.956 ( 0.000 -1.159 -0.712) 1.360 23.956 ( 0.000 -1.159 0.712) 1.360 24.505 ( -0.000 1.083 -0.744) 1.314 24.505 ( -0.000 1.083 0.744) 1.314 24.822 ( 0.000 1.421 -0.101) 1.424 24.822 ( 0.000 1.421 0.101) 1.424 25.123 ( 0.000 -1.452 -0.835) 1.675 25.123 ( 0.000 -1.452 0.835) 1.675 25.674 ( 0.000 0.096 -0.615) 0.623 25.674 ( 0.000 0.096 0.615) 0.623 26.188 ( 0.000 -0.496 -0.969) 1.089 26.188 ( 0.000 -0.496 0.969) 1.089 26.448 ( 0.000 -9.120 -17.017) 19.307 26.448 ( 0.000 -9.120 17.017) 19.307 26.616 ( -0.000 -3.227 -19.351) 19.618 26.616 ( 0.000 -3.227 19.351) 19.618 26.748 ( 0.000 -2.523 -4.021) 4.747 26.748 ( 0.000 -2.523 4.021) 4.747 27.548 ( 0.000 -19.844 -4.033) 20.250 27.548 ( 0.000 -19.844 4.033) 20.250 28.090 ( 0.000 -2.571 -4.694) 5.352 28.090 ( 0.000 -2.571 4.694) 5.352 28.300 ( -0.000 -0.252 -3.258) 3.267 28.300 ( 0.000 -0.252 3.258) 3.267 28.930 ( 0.000 -11.482 -2.025) 11.660 28.930 ( -0.000 -11.482 2.025) 11.660 29.074 ( 0.000 -10.572 -3.751) 11.218 29.074 ( 0.000 -10.572 3.751) 11.218 29.149 ( -0.000 -1.153 -1.283) 1.725 29.149 ( -0.000 -1.153 1.283) 1.725 29.646 ( -0.000 -5.630 -0.775) 5.683 29.646 ( -0.000 -5.630 0.775) 5.683 30.157 ( 0.000 -3.717 -2.119) 4.279 30.157 ( 0.000 -3.717 2.119) 4.279 30.623 ( 0.000 -0.429 -0.421) 0.601 30.623 ( 0.000 -0.429 0.421) 0.601 30.718 ( 0.000 -0.717 -1.078) 1.294 30.718 ( -0.000 -0.717 1.078) 1.294 31.000 ( 0.000 -6.609 -3.002) 7.259 31.000 ( 0.000 -6.609 3.002) 7.259 31.417 ( -0.000 -7.097 -2.530) 7.535 31.417 ( 0.000 -7.097 2.530) 7.535 31.648 ( 0.000 -6.556 -11.948) 13.628 31.648 ( -0.000 -6.556 11.948) 13.628 31.814 ( 0.000 -15.881 -0.048) 15.881 31.814 ( 0.000 -15.881 0.048) 15.881 31.986 ( 0.000 -17.551 -11.281) 20.864 31.986 ( 0.000 -17.551 11.281) 20.864 32.354 ( 0.000 -10.968 -0.883) 11.003 32.354 ( 0.000 -10.968 0.883) 11.003 32.675 ( 0.000 -2.257 -4.350) 4.901 32.675 ( 0.000 -2.257 4.350) 4.901 33.313 ( 0.000 0.563 -9.046) 9.063 33.313 ( 0.000 0.563 9.046) 9.063 33.504 ( 0.000 3.109 -1.285) 3.364 33.504 ( 0.000 3.109 1.285) 3.364 34.356 ( -0.000 37.917 -18.381) 42.137 34.356 ( 0.000 37.917 18.381) 42.137 35.109 ( 0.000 36.694 -14.450) 39.437 35.109 ( -0.000 36.694 14.450) 39.437 ======================= Grid point 130 (43/54) ======================= q-point: ( 0.00 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 51 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.946 ( 0.000 13.014 -23.449) 26.819 1.946 ( 0.000 13.014 23.450) 26.819 1.998 ( 0.000 20.108 -18.532) 27.345 1.998 ( 0.000 20.108 18.532) 27.345 2.504 ( 0.000 3.065 -12.326) 12.701 2.504 ( 0.000 3.065 12.326) 12.701 2.659 ( 0.000 4.872 -8.981) 10.218 2.659 ( 0.000 4.872 8.981) 10.218 2.827 ( 0.000 2.027 -28.011) 28.084 2.827 ( 0.000 2.027 28.011) 28.084 2.978 ( 0.000 1.041 -4.107) 4.237 2.978 ( 0.000 1.041 4.107) 4.237 3.213 ( 0.000 -1.114 -4.325) 4.466 3.213 ( 0.000 -1.114 4.325) 4.466 3.265 ( 0.000 2.198 -2.866) 3.612 3.265 ( 0.000 2.198 2.866) 3.612 3.371 ( 0.000 0.636 -3.154) 3.218 3.371 ( 0.000 0.636 3.154) 3.218 3.515 ( 0.000 -0.010 -0.707) 0.707 3.515 ( 0.000 -0.010 0.707) 0.707 3.550 ( 0.000 7.391 -6.958) 10.150 3.550 ( 0.000 7.391 6.958) 10.150 3.867 ( 0.000 0.413 -5.623) 5.638 3.867 ( 0.000 0.413 5.623) 5.638 4.288 ( 0.000 -4.508 -7.619) 8.853 4.288 ( 0.000 -4.508 7.619) 8.853 4.426 ( 0.000 -1.071 -0.578) 1.217 4.426 ( 0.000 -1.071 0.578) 1.217 4.738 ( 0.000 -5.143 -2.446) 5.695 4.738 ( 0.000 -5.143 2.446) 5.695 5.023 ( 0.000 -6.087 -3.501) 7.022 5.023 ( 0.000 -6.087 3.501) 7.022 5.043 ( 0.000 0.977 -5.585) 5.670 5.043 ( 0.000 0.977 5.585) 5.670 5.827 ( 0.000 -2.035 -4.318) 4.773 5.827 ( 0.000 -2.035 4.318) 4.773 6.262 ( 0.000 1.406 -6.731) 6.877 6.262 ( 0.000 1.406 6.731) 6.877 6.713 ( 0.000 -6.660 -9.750) 11.808 6.713 ( 0.000 -6.660 9.750) 11.808 6.853 ( 0.000 -7.787 -17.274) 18.948 6.853 ( 0.000 -7.787 17.274) 18.948 6.878 ( 0.000 -2.603 -2.689) 3.743 6.878 ( 0.000 -2.603 2.689) 3.743 7.266 ( 0.000 -3.862 -6.259) 7.355 7.266 ( 0.000 -3.862 6.259) 7.355 7.361 ( 0.000 -1.864 -15.599) 15.710 7.361 ( 0.000 -1.864 15.599) 15.710 7.833 ( 0.000 1.918 -9.769) 9.955 7.833 ( 0.000 1.918 9.769) 9.955 7.852 ( 0.000 1.811 -15.729) 15.832 7.852 ( 0.000 1.811 15.729) 15.832 8.071 ( 0.000 7.327 -4.320) 8.505 8.071 ( 0.000 7.327 4.320) 8.505 8.341 ( 0.000 0.513 -11.724) 11.735 8.341 ( 0.000 0.513 11.724) 11.735 8.579 ( 0.000 -0.754 -7.020) 7.060 8.579 ( 0.000 -0.754 7.020) 7.060 8.626 ( 0.000 2.950 -2.831) 4.089 8.626 ( 0.000 2.950 2.831) 4.089 8.957 ( 0.000 0.260 -13.224) 13.226 8.957 ( 0.000 0.260 13.224) 13.226 9.302 ( 0.000 0.573 -4.535) 4.571 9.302 ( 0.000 0.573 4.535) 4.571 9.381 ( 0.000 -1.542 -4.045) 4.329 9.381 ( 0.000 -1.542 4.045) 4.329 9.865 ( 0.000 -1.023 -2.053) 2.294 9.865 ( 0.000 -1.023 2.053) 2.294 10.155 ( 0.000 -0.948 -6.771) 6.837 10.155 ( 0.000 -0.948 6.771) 6.837 10.414 ( 0.000 -0.695 -6.558) 6.595 10.414 ( 0.000 -0.695 6.558) 6.595 10.702 ( 0.000 -6.007 -13.798) 15.049 10.702 ( 0.000 -6.007 13.798) 15.049 10.799 ( 0.000 2.180 -12.867) 13.051 10.799 ( 0.000 2.180 12.867) 13.051 11.042 ( 0.000 -5.283 -7.676) 9.318 11.042 ( 0.000 -5.283 7.676) 9.318 11.273 ( 0.000 -2.272 -0.331) 2.296 11.273 ( 0.000 -2.272 0.331) 2.296 11.389 ( 0.000 -9.857 -6.357) 11.729 11.389 ( 0.000 -9.857 6.357) 11.729 11.776 ( 0.000 -4.198 -18.955) 19.414 11.776 ( 0.000 -4.198 18.955) 19.414 12.096 ( 0.000 2.942 -3.825) 4.825 12.096 ( 0.000 2.942 3.825) 4.825 12.129 ( 0.000 2.585 -9.407) 9.756 12.129 ( 0.000 2.585 9.407) 9.756 12.196 ( 0.000 -1.229 -3.637) 3.839 12.196 ( 0.000 -1.229 3.637) 3.839 12.418 ( 0.000 -2.929 -7.243) 7.813 12.418 ( 0.000 -2.929 7.243) 7.813 12.468 ( 0.000 2.033 -9.888) 10.095 12.468 ( 0.000 2.033 9.888) 10.095 12.524 ( 0.000 0.699 -9.847) 9.872 12.524 ( 0.000 0.699 9.847) 9.872 12.869 ( 0.000 0.067 -6.340) 6.340 12.869 ( 0.000 0.067 6.340) 6.340 13.092 ( 0.000 0.839 -7.752) 7.797 13.092 ( 0.000 0.839 7.752) 7.797 13.201 ( 0.000 2.970 -20.196) 20.413 13.201 ( 0.000 2.970 20.196) 20.413 13.287 ( 0.000 -0.435 -4.348) 4.370 13.287 ( 0.000 -0.435 4.348) 4.370 13.472 ( 0.000 -4.495 -11.000) 11.883 13.472 ( 0.000 -4.495 11.000) 11.883 13.761 ( 0.000 4.112 -8.553) 9.490 13.761 ( 0.000 4.112 8.553) 9.490 14.177 ( 0.000 -0.558 -6.758) 6.781 14.177 ( 0.000 -0.558 6.758) 6.781 14.695 ( 0.000 1.578 -20.210) 20.272 14.695 ( 0.000 1.578 20.210) 20.272 14.765 ( 0.000 -3.078 -13.517) 13.863 14.765 ( 0.000 -3.078 13.517) 13.863 15.107 ( 0.000 -0.786 -14.467) 14.489 15.107 ( 0.000 -0.786 14.467) 14.489 15.236 ( 0.000 2.143 -5.009) 5.448 15.236 ( 0.000 2.143 5.009) 5.448 15.888 ( 0.000 1.822 -12.474) 12.606 15.888 ( 0.000 1.822 12.474) 12.606 15.960 ( 0.000 3.129 -3.562) 4.741 15.960 ( 0.000 3.129 3.562) 4.741 16.066 ( 0.000 4.708 -14.172) 14.933 16.066 ( 0.000 4.708 14.172) 14.933 17.016 ( 0.000 0.197 -0.930) 0.951 17.016 ( 0.000 0.197 0.930) 0.951 17.086 ( 0.000 -2.617 -15.928) 16.141 17.086 ( 0.000 -2.617 15.928) 16.141 17.561 ( 0.000 1.210 -11.136) 11.202 17.561 ( 0.000 1.210 11.136) 11.202 17.815 ( 0.000 -1.921 -18.853) 18.951 17.815 ( 0.000 -1.921 18.853) 18.951 17.818 ( 0.000 2.024 -8.203) 8.449 17.818 ( 0.000 2.024 8.203) 8.449 18.126 ( 0.000 -0.356 -5.435) 5.447 18.126 ( 0.000 -0.356 5.435) 5.447 18.212 ( 0.000 -0.791 -4.846) 4.910 18.212 ( 0.000 -0.791 4.846) 4.910 18.374 ( 0.000 0.915 -3.290) 3.415 18.374 ( 0.000 0.915 3.290) 3.415 18.504 ( 0.000 2.369 -3.797) 4.476 18.504 ( 0.000 2.369 3.797) 4.476 18.828 ( 0.000 0.043 -7.690) 7.690 18.828 ( 0.000 0.043 7.690) 7.690 18.882 ( 0.000 0.228 -3.664) 3.671 18.882 ( 0.000 0.228 3.664) 3.671 19.448 ( 0.000 1.600 -4.008) 4.315 19.448 ( 0.000 1.600 4.008) 4.315 19.591 ( 0.000 1.218 -5.591) 5.722 19.591 ( 0.000 1.218 5.591) 5.722 20.122 ( 0.000 0.623 -2.161) 2.249 20.122 ( 0.000 0.623 2.161) 2.249 20.476 ( 0.000 -0.854 -4.579) 4.658 20.476 ( 0.000 -0.854 4.579) 4.658 20.683 ( 0.000 -5.090 -6.316) 8.112 20.683 ( 0.000 -5.090 6.316) 8.112 20.706 ( 0.000 0.009 -9.527) 9.527 20.706 ( 0.000 0.009 9.527) 9.527 20.886 ( 0.000 -0.745 -5.459) 5.509 20.886 ( 0.000 -0.745 5.459) 5.509 21.301 ( 0.000 -4.273 -14.714) 15.322 21.301 ( 0.000 -4.273 14.714) 15.322 21.315 ( 0.000 0.337 -4.733) 4.745 21.315 ( 0.000 0.337 4.733) 4.745 21.958 ( 0.000 -7.826 -15.011) 16.928 21.958 ( 0.000 -7.826 15.011) 16.928 22.486 ( 0.000 1.428 -0.956) 1.718 22.486 ( 0.000 1.428 0.956) 1.718 22.833 ( 0.000 -1.285 -14.039) 14.098 22.833 ( 0.000 -1.285 14.039) 14.098 22.887 ( 0.000 -2.295 -16.193) 16.355 22.887 ( 0.000 -2.295 16.193) 16.355 23.049 ( 0.000 1.196 -5.755) 5.878 23.049 ( 0.000 1.196 5.755) 5.878 23.625 ( 0.000 -0.529 -3.131) 3.175 23.625 ( 0.000 -0.529 3.131) 3.175 23.744 ( 0.000 0.570 -1.705) 1.798 23.744 ( 0.000 0.570 1.705) 1.798 24.032 ( 0.000 -9.126 -23.169) 24.902 24.032 ( 0.000 -9.126 23.169) 24.902 24.126 ( 0.000 0.229 -4.373) 4.379 24.126 ( 0.000 0.229 4.373) 4.379 24.519 ( 0.000 -0.233 -0.946) 0.974 24.519 ( 0.000 -0.233 0.946) 0.974 24.520 ( 0.000 -5.239 -6.488) 8.339 24.520 ( 0.000 -5.239 6.488) 8.339 25.162 ( 0.000 -3.236 -8.862) 9.435 25.162 ( 0.000 -3.236 8.862) 9.435 25.354 ( 0.000 -0.549 -10.972) 10.986 25.354 ( 0.000 -0.549 10.972) 10.986 25.475 ( 0.000 0.203 -23.857) 23.858 25.475 ( 0.000 0.203 23.857) 23.858 25.799 ( 0.000 -0.863 -3.882) 3.977 25.799 ( 0.000 -0.863 3.882) 3.977 26.490 ( 0.000 0.018 -1.064) 1.064 26.490 ( 0.000 0.018 1.064) 1.064 26.914 ( 0.000 -1.264 -21.937) 21.974 26.914 ( 0.000 -1.264 21.937) 21.974 27.808 ( 0.000 -1.316 -10.329) 10.413 27.808 ( 0.000 -1.316 10.329) 10.413 28.250 ( 0.000 -10.448 -12.859) 16.568 28.250 ( 0.000 -10.448 12.859) 16.568 28.295 ( 0.000 -10.648 -6.312) 12.378 28.295 ( 0.000 -10.648 6.312) 12.378 28.541 ( 0.000 -0.885 -4.388) 4.476 28.541 ( 0.000 -0.885 4.388) 4.476 28.834 ( 0.000 -7.135 -1.837) 7.368 28.834 ( 0.000 -7.135 1.837) 7.368 29.307 ( 0.000 -0.407 -17.738) 17.743 29.307 ( 0.000 -0.407 17.738) 17.743 29.380 ( 0.000 -3.722 -10.642) 11.274 29.380 ( 0.000 -3.722 10.642) 11.274 29.958 ( 0.000 -9.424 -9.414) 13.320 29.958 ( 0.000 -9.424 9.414) 13.320 30.682 ( 0.000 -1.980 -7.423) 7.682 30.682 ( 0.000 -1.980 7.423) 7.682 30.739 ( 0.000 -3.377 -0.737) 3.457 30.739 ( 0.000 -3.377 0.737) 3.457 30.923 ( 0.000 -10.826 -1.555) 10.937 30.923 ( 0.000 -10.826 1.555) 10.937 31.079 ( 0.000 0.715 -10.297) 10.322 31.079 ( 0.000 0.715 10.297) 10.322 31.383 ( 0.000 -9.791 -11.190) 14.869 31.383 ( 0.000 -9.791 11.190) 14.869 31.636 ( 0.000 -3.338 -8.925) 9.529 31.636 ( 0.000 -3.338 8.925) 9.529 31.755 ( 0.000 -11.176 -8.539) 14.065 31.755 ( 0.000 -11.176 8.539) 14.065 32.252 ( 0.000 -7.854 -8.386) 11.490 32.252 ( 0.000 -7.854 8.386) 11.490 33.042 ( 0.000 8.519 -16.599) 18.658 33.042 ( 0.000 8.519 16.599) 18.658 33.142 ( 0.000 -4.335 -12.029) 12.787 33.142 ( 0.000 -4.335 12.029) 12.787 33.453 ( 0.000 0.661 -4.249) 4.300 33.453 ( 0.000 0.661 4.249) 4.300 34.232 ( 0.000 6.282 -12.131) 13.661 34.232 ( 0.000 6.282 12.131) 13.661 36.382 ( 0.000 11.633 -59.310) 60.440 36.382 ( 0.000 11.633 59.310) 60.440 ======================= Grid point 132 (44/54) ======================= q-point: ( 0.25 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.975 ( 4.552 14.397 -16.666) 22.489 1.975 ( 4.552 14.397 16.666) 22.489 2.106 ( 7.783 10.013 -21.079) 24.600 2.106 ( 7.783 10.013 21.079) 24.600 2.474 ( -4.547 4.782 -8.547) 10.798 2.474 ( -4.547 4.782 8.547) 10.798 2.661 ( 1.473 5.548 -6.177) 8.432 2.661 ( 1.473 5.548 6.177) 8.432 2.871 ( 0.142 0.366 -9.923) 9.931 2.871 ( 0.142 0.366 9.923) 9.931 3.050 ( 6.588 3.785 -4.142) 8.654 3.050 ( 6.588 3.785 4.142) 8.654 3.175 ( 1.568 3.396 -4.437) 5.803 3.175 ( 1.568 3.396 4.437) 5.803 3.315 ( 2.071 -1.532 -3.384) 4.253 3.315 ( 2.071 -1.532 3.384) 4.253 3.370 ( -0.230 1.864 -2.424) 3.066 3.370 ( -0.230 1.864 2.424) 3.066 3.495 ( -1.837 0.547 -1.511) 2.441 3.495 ( -1.837 0.547 1.511) 2.441 3.568 ( 3.176 5.670 -8.453) 10.662 3.568 ( 3.176 5.670 8.453) 10.662 3.880 ( 0.096 1.999 -5.786) 6.122 3.880 ( 0.096 1.999 5.786) 6.122 4.226 ( -9.338 0.683 -4.394) 10.342 4.226 ( -9.338 0.683 4.394) 10.342 4.371 ( -4.494 -1.013 -1.251) 4.773 4.371 ( -4.494 -1.013 1.251) 4.773 4.598 ( -2.169 -6.298 -2.914) 7.270 4.598 ( -2.169 -6.298 2.914) 7.270 4.915 ( -8.171 -6.547 -1.427) 10.567 4.915 ( -8.171 -6.547 1.427) 10.567 5.271 ( 12.142 -1.391 -2.257) 12.428 5.271 ( 12.142 -1.391 2.257) 12.428 5.763 ( -4.563 -2.084 -4.897) 7.010 5.763 ( -4.563 -2.084 4.897) 7.010 6.380 ( 8.101 -1.128 -1.773) 8.369 6.380 ( 8.101 -1.128 1.773) 8.369 6.642 ( -4.463 -7.543 -7.531) 11.556 6.642 ( -4.463 -7.543 7.531) 11.556 6.881 ( 9.495 -1.320 -6.629) 11.655 6.881 ( 9.495 -1.320 6.629) 11.655 7.060 ( -6.306 -2.301 -3.051) 7.374 7.060 ( -6.306 -2.301 3.051) 7.374 7.199 ( 10.082 -4.586 -12.491) 16.695 7.199 ( 10.082 -4.586 12.491) 16.695 7.410 ( 4.632 -0.960 -8.768) 9.963 7.410 ( 4.632 -0.960 8.768) 9.963 7.641 ( -6.630 0.461 -20.572) 21.619 7.641 ( -6.630 0.461 20.572) 21.619 8.002 ( -3.145 4.193 -2.382) 5.757 8.002 ( -3.145 4.193 2.382) 5.757 8.105 ( 7.591 0.834 -9.920) 12.519 8.105 ( 7.591 0.834 9.920) 12.519 8.255 ( -7.255 1.104 -4.867) 8.806 8.255 ( -7.255 1.104 4.867) 8.806 8.494 ( -3.474 2.466 -3.572) 5.559 8.494 ( -3.474 2.466 3.572) 5.559 8.764 ( 0.353 -0.136 -10.668) 10.674 8.764 ( 0.353 -0.136 10.668) 10.674 8.879 ( -3.949 1.739 -2.764) 5.124 8.879 ( -3.949 1.739 2.764) 5.124 9.096 ( -0.465 0.388 -4.025) 4.070 9.096 ( -0.465 0.388 4.025) 4.070 9.585 ( 7.383 -0.682 -4.595) 8.723 9.585 ( 7.383 -0.682 4.595) 8.723 10.004 ( -6.283 0.283 -3.427) 7.163 10.004 ( -6.283 0.283 3.427) 7.163 10.013 ( -0.244 -3.230 -10.145) 10.649 10.013 ( -0.244 -3.230 10.145) 10.649 10.268 ( -13.094 -5.422 -7.921) 16.235 10.268 ( -13.094 -5.422 7.921) 16.235 10.635 ( -0.315 -4.253 -4.808) 6.426 10.635 ( -0.315 -4.253 4.808) 6.426 10.770 ( -0.836 -1.811 -3.741) 4.240 10.770 ( -0.836 -1.811 3.741) 4.240 10.959 ( -2.901 -2.589 -11.512) 12.151 10.959 ( -2.901 -2.589 11.512) 12.151 11.262 ( -0.376 -2.275 -1.105) 2.557 11.262 ( -0.376 -2.275 1.105) 2.557 11.514 ( 4.275 -6.539 -3.021) 8.376 11.514 ( 4.275 -6.539 3.021) 8.376 11.714 ( -5.523 -1.325 -12.071) 13.340 11.714 ( -5.523 -1.325 12.071) 13.340 12.068 ( -1.532 0.273 -2.347) 2.816 12.068 ( -1.532 0.273 2.347) 2.816 12.161 ( 2.992 1.730 -7.451) 8.213 12.161 ( 2.992 1.730 7.451) 8.213 12.282 ( 1.043 -0.696 -2.694) 2.972 12.282 ( 1.043 -0.696 2.694) 2.972 12.356 ( 7.281 2.061 -3.472) 8.326 12.356 ( 7.281 2.061 3.472) 8.326 12.509 ( 1.773 0.977 -8.814) 9.044 12.509 ( 1.773 0.977 8.814) 9.044 12.589 ( 1.589 -3.046 -6.563) 7.408 12.589 ( 1.589 -3.046 6.563) 7.408 12.838 ( -4.641 1.626 -4.710) 6.809 12.838 ( -4.641 1.626 4.710) 6.809 13.038 ( -1.280 2.673 -13.512) 13.833 13.038 ( -1.280 2.673 13.512) 13.833 13.191 ( 0.046 0.984 -8.791) 8.847 13.191 ( 0.046 0.984 8.791) 8.847 13.347 ( 0.504 -4.765 -3.299) 5.817 13.347 ( 0.504 -4.765 3.299) 5.817 13.604 ( 11.075 1.908 -8.269) 13.952 13.604 ( 11.075 1.908 8.269) 13.952 13.900 ( 7.412 2.482 -6.562) 10.205 13.900 ( 7.412 2.482 6.562) 10.205 14.233 ( 9.355 -2.312 -7.729) 12.353 14.233 ( 9.355 -2.312 7.729) 12.353 14.571 ( -8.262 0.223 -15.729) 17.768 14.571 ( -8.262 0.223 15.729) 17.768 14.811 ( 0.740 -1.651 -8.343) 8.537 14.811 ( 0.740 -1.651 8.343) 8.537 15.109 ( -0.958 0.472 -6.679) 6.764 15.109 ( -0.958 0.472 6.679) 6.764 15.213 ( -0.491 1.948 -2.356) 3.096 15.213 ( -0.491 1.948 2.356) 3.096 15.762 ( -2.989 3.920 -9.833) 11.000 15.762 ( -2.989 3.920 9.833) 11.000 15.916 ( -4.911 3.096 -0.971) 5.886 15.916 ( -4.911 3.096 0.971) 5.886 16.197 ( 3.032 2.402 -6.700) 7.736 16.197 ( 3.032 2.402 6.700) 7.736 16.689 ( -15.493 -0.165 -1.126) 15.535 16.689 ( -15.493 -0.165 1.126) 15.535 17.043 ( -9.823 -1.140 -13.078) 16.396 17.043 ( -9.823 -1.140 13.078) 16.396 17.691 ( 8.216 -0.332 -6.056) 10.212 17.691 ( 8.216 -0.332 6.056) 10.212 17.755 ( -0.396 -1.097 -12.738) 12.791 17.755 ( -0.396 -1.097 12.738) 12.791 17.899 ( 1.696 0.605 -7.170) 7.393 17.899 ( 1.696 0.605 7.170) 7.393 18.114 ( -5.880 -1.607 -2.338) 6.528 18.114 ( -5.880 -1.607 2.338) 6.528 18.247 ( 8.499 0.976 -3.006) 9.068 18.247 ( 8.499 0.976 3.006) 9.068 18.404 ( 0.670 1.643 -3.151) 3.616 18.404 ( 0.670 1.643 3.151) 3.616 18.546 ( 3.364 1.756 -2.910) 4.782 18.546 ( 3.364 1.756 2.910) 4.782 18.826 ( 0.751 -0.981 -5.065) 5.214 18.826 ( 0.751 -0.981 5.065) 5.214 18.929 ( 3.110 0.994 -3.470) 4.764 18.929 ( 3.110 0.994 3.470) 4.764 19.538 ( 8.603 0.786 -4.188) 9.600 19.538 ( 8.603 0.786 4.188) 9.600 19.761 ( 16.034 1.263 -9.336) 18.597 19.761 ( 16.034 1.263 9.336) 18.597 20.057 ( -7.059 0.515 -2.088) 7.379 20.057 ( -7.059 0.515 2.088) 7.379 20.435 ( -6.869 -2.424 -8.089) 10.886 20.435 ( -6.869 -2.424 8.089) 10.886 20.525 ( -3.522 -0.724 -2.268) 4.251 20.525 ( -3.522 -0.724 2.268) 4.251 20.811 ( -2.784 -0.246 -0.992) 2.966 20.811 ( -2.784 -0.246 0.992) 2.966 20.884 ( -0.292 -1.950 -4.168) 4.611 20.884 ( -0.292 -1.950 4.168) 4.611 21.082 ( -3.229 -1.465 -3.284) 4.833 21.082 ( -3.229 -1.465 3.284) 4.833 21.338 ( -8.781 -4.450 -3.738) 10.530 21.338 ( -8.781 -4.450 3.738) 10.530 22.027 ( 7.789 -1.361 -2.403) 8.264 22.027 ( 7.789 -1.361 2.403) 8.264 22.513 ( -2.886 -3.054 -7.660) 8.737 22.513 ( -2.886 -3.054 7.660) 8.737 22.712 ( -5.603 -0.035 -10.352) 11.772 22.712 ( -5.603 -0.035 10.352) 11.772 22.928 ( 5.382 -1.041 -6.145) 8.234 22.928 ( 5.382 -1.041 6.145) 8.234 23.138 ( 5.905 0.596 -1.362) 6.089 23.138 ( 5.905 0.596 1.362) 6.089 23.590 ( -10.539 0.230 -11.899) 15.897 23.590 ( -10.539 0.230 11.899) 15.897 23.641 ( -1.386 -1.781 -0.658) 2.350 23.641 ( -1.386 -1.781 0.658) 2.350 23.905 ( -4.305 -2.104 -8.655) 9.893 23.905 ( -4.305 -2.104 8.655) 9.893 24.031 ( -9.295 -1.221 -1.472) 9.490 24.031 ( -9.295 -1.221 1.472) 9.490 24.449 ( 7.063 1.142 -6.575) 9.717 24.449 ( 7.063 1.142 6.575) 9.717 24.911 ( 3.495 0.636 -12.374) 12.874 24.911 ( 3.495 0.636 12.374) 12.874 25.071 ( -3.237 -2.582 -6.456) 7.670 25.071 ( -3.237 -2.582 6.456) 7.670 25.568 ( 31.640 -10.726 -3.144) 33.557 25.568 ( 31.640 -10.726 3.144) 33.557 25.689 ( 6.948 -1.619 -3.738) 8.054 25.689 ( 6.948 -1.619 3.738) 8.054 25.948 ( 18.468 -2.402 -12.041) 22.177 25.948 ( 18.468 -2.402 12.041) 22.177 26.508 ( 2.173 -0.184 -1.344) 2.561 26.508 ( 2.173 -0.184 1.344) 2.561 26.821 ( -8.883 -1.658 -22.319) 24.079 26.821 ( -8.883 -1.658 22.319) 24.079 27.641 ( -29.848 -13.616 -13.194) 35.361 27.641 ( -29.848 -13.616 13.194) 35.361 27.972 ( 1.321 -3.358 -8.780) 9.493 27.972 ( 1.321 -3.358 8.780) 9.493 28.365 ( -4.977 -3.407 -4.393) 7.461 28.365 ( -4.977 -3.407 4.393) 7.461 28.577 ( 2.542 -10.332 -1.175) 10.705 28.577 ( 2.542 -10.332 1.175) 10.705 28.898 ( 5.958 -3.767 -2.038) 7.337 28.898 ( 5.958 -3.767 2.038) 7.337 29.168 ( -4.659 -1.329 -4.780) 6.806 29.168 ( -4.659 -1.329 4.780) 6.806 29.553 ( 2.628 -5.679 -3.326) 7.086 29.553 ( 2.628 -5.679 3.326) 7.086 29.979 ( 5.682 -5.929 -3.118) 8.784 29.979 ( 5.682 -5.929 3.118) 8.784 30.636 ( -2.820 -2.386 -1.310) 3.919 30.636 ( -2.820 -2.386 1.310) 3.919 30.726 ( -2.232 -2.259 -4.055) 5.151 30.726 ( -2.232 -2.259 4.055) 5.151 30.877 ( -1.976 -6.447 -2.055) 7.049 30.877 ( -1.976 -6.447 2.055) 7.049 31.209 ( 8.825 -3.611 -5.066) 10.797 31.209 ( 8.825 -3.611 5.066) 10.797 31.341 ( -3.408 -13.666 -5.966) 15.297 31.341 ( -3.408 -13.666 5.966) 15.297 31.647 ( 1.491 -4.653 -3.561) 6.046 31.647 ( 1.491 -4.653 3.561) 6.046 31.785 ( 1.732 -6.884 -3.172) 7.775 31.785 ( 1.732 -6.884 3.172) 7.775 32.226 ( -2.487 -7.170 -6.604) 10.060 32.226 ( -2.487 -7.170 6.604) 10.060 32.781 ( -12.793 0.801 -8.773) 15.532 32.781 ( -12.793 0.801 8.773) 15.532 33.263 ( 2.938 -1.793 -7.339) 8.107 33.263 ( 2.938 -1.793 7.339) 8.107 33.519 ( 3.775 1.699 -3.002) 5.114 33.519 ( 3.775 1.699 3.002) 5.114 34.484 ( 23.738 10.196 -17.823) 31.386 34.484 ( 23.738 10.196 17.823) 31.386 36.090 ( -26.391 14.086 -48.002) 56.560 36.090 ( -26.391 14.086 48.002) 56.560 ======================= Grid point 134 (45/54) ======================= q-point: (-0.50 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 50 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.055 ( 0.000 9.288 -9.291) 13.137 2.055 ( 0.000 9.288 9.291) 13.137 2.195 ( 0.000 2.514 -18.163) 18.336 2.195 ( 0.000 2.514 18.163) 18.336 2.422 ( -0.000 8.948 -8.907) 12.625 2.422 ( 0.000 8.948 8.907) 12.625 2.666 ( 0.000 9.938 -13.400) 16.683 2.666 ( -0.000 9.938 13.400) 16.683 2.832 ( -0.000 1.560 -1.644) 2.266 2.832 ( 0.000 1.560 1.644) 2.266 3.142 ( -0.000 2.797 -0.165) 2.802 3.142 ( 0.000 2.797 0.165) 2.802 3.252 ( 0.000 -1.049 -0.087) 1.053 3.252 ( 0.000 -1.049 0.087) 1.053 3.310 ( 0.000 1.159 -0.475) 1.253 3.310 ( -0.000 1.159 0.475) 1.253 3.371 ( 0.000 1.811 -0.153) 1.817 3.371 ( 0.000 1.811 0.153) 1.817 3.464 ( 0.000 3.438 -1.114) 3.614 3.464 ( 0.000 3.438 1.114) 3.614 3.694 ( 0.000 3.683 -11.619) 12.189 3.694 ( 0.000 3.683 11.619) 12.189 3.816 ( 0.000 4.346 -10.414) 11.284 3.816 ( -0.000 4.346 10.414) 11.284 4.057 ( 0.000 4.507 -0.215) 4.512 4.057 ( 0.000 4.507 0.215) 4.512 4.336 ( 0.000 -3.045 -1.815) 3.545 4.336 ( 0.000 -3.045 1.815) 3.545 4.637 ( 0.000 -6.989 -2.107) 7.300 4.637 ( 0.000 -6.989 2.107) 7.300 4.785 ( 0.000 -5.807 -1.563) 6.014 4.785 ( -0.000 -5.807 1.563) 6.014 5.398 ( 0.000 -2.473 -5.020) 5.596 5.398 ( 0.000 -2.473 5.020) 5.596 5.711 ( 0.000 -2.331 -2.488) 3.410 5.711 ( 0.000 -2.331 2.488) 3.410 6.465 ( 0.000 -7.695 -1.141) 7.779 6.465 ( 0.000 -7.695 1.141) 7.779 6.631 ( 0.000 -3.874 -9.400) 10.167 6.631 ( 0.000 -3.874 9.400) 10.167 6.857 ( -0.000 1.159 -6.075) 6.185 6.857 ( 0.000 1.159 6.075) 6.185 7.054 ( 0.000 2.166 -4.569) 5.056 7.054 ( 0.000 2.166 4.569) 5.056 7.403 ( -0.000 -4.899 -6.086) 7.813 7.403 ( -0.000 -4.899 6.086) 7.813 7.480 ( 0.000 0.637 -12.188) 12.205 7.480 ( 0.000 0.637 12.188) 12.205 7.611 ( -0.000 -2.486 -5.581) 6.110 7.611 ( -0.000 -2.486 5.581) 6.110 7.888 ( 0.000 -0.258 -0.690) 0.737 7.888 ( 0.000 -0.258 0.690) 0.737 8.139 ( 0.000 4.111 -3.444) 5.363 8.139 ( 0.000 4.111 3.444) 5.363 8.203 ( 0.000 0.556 -2.460) 2.522 8.203 ( 0.000 0.556 2.460) 2.522 8.468 ( 0.000 1.823 -6.739) 6.982 8.468 ( 0.000 1.823 6.739) 6.982 8.613 ( 0.000 4.277 -0.356) 4.292 8.613 ( 0.000 4.277 0.356) 4.292 9.003 ( -0.000 -2.429 -8.612) 8.948 9.003 ( -0.000 -2.429 8.612) 8.948 9.117 ( 0.000 -1.518 -12.352) 12.445 9.117 ( 0.000 -1.518 12.352) 12.445 9.684 ( 0.000 -2.411 -6.947) 7.354 9.684 ( 0.000 -2.411 6.947) 7.354 9.735 ( -0.000 -0.804 -7.090) 7.135 9.735 ( -0.000 -0.804 7.090) 7.135 10.001 ( -0.000 -2.693 -7.267) 7.750 10.001 ( -0.000 -2.693 7.267) 7.750 10.202 ( 0.000 -3.441 -1.225) 3.653 10.202 ( 0.000 -3.441 1.225) 3.653 10.690 ( 0.000 -1.683 -2.609) 3.105 10.690 ( 0.000 -1.683 2.609) 3.105 10.763 ( -0.000 -3.072 -6.511) 7.199 10.763 ( 0.000 -3.072 6.511) 7.199 10.935 ( 0.000 -5.494 -5.030) 7.449 10.935 ( 0.000 -5.494 5.030) 7.449 11.256 ( 0.000 -2.091 -2.626) 3.357 11.256 ( -0.000 -2.091 2.626) 3.357 11.504 ( 0.000 -2.087 -4.813) 5.246 11.504 ( 0.000 -2.087 4.813) 5.246 11.669 ( 0.000 -1.250 -5.488) 5.628 11.669 ( 0.000 -1.250 5.488) 5.628 12.035 ( 0.000 -1.442 -5.303) 5.496 12.035 ( 0.000 -1.442 5.303) 5.496 12.186 ( 0.000 2.708 -4.123) 4.933 12.186 ( 0.000 2.708 4.123) 4.933 12.356 ( 0.000 0.640 -0.521) 0.825 12.356 ( 0.000 0.640 0.521) 0.825 12.422 ( 0.000 -1.590 -9.338) 9.472 12.422 ( 0.000 -1.590 9.338) 9.472 12.571 ( 0.000 -1.147 -1.326) 1.754 12.571 ( 0.000 -1.147 1.326) 1.754 12.599 ( 0.000 0.829 -2.691) 2.816 12.599 ( 0.000 0.829 2.692) 2.816 12.750 ( -0.000 1.819 -0.459) 1.876 12.750 ( 0.000 1.819 0.459) 1.876 13.026 ( 0.000 4.750 -4.480) 6.529 13.026 ( 0.000 4.750 4.480) 6.529 13.188 ( 0.000 -3.533 -6.157) 7.099 13.188 ( 0.000 -3.533 6.157) 7.099 13.360 ( 0.000 -1.926 -2.891) 3.474 13.360 ( -0.000 -1.926 2.891) 3.474 13.714 ( -0.000 3.816 -2.971) 4.836 13.714 ( 0.000 3.816 2.971) 4.836 13.961 ( 0.000 0.502 -1.959) 2.022 13.961 ( 0.000 0.502 1.959) 2.022 14.370 ( 0.000 -3.300 -2.708) 4.269 14.370 ( 0.000 -3.300 2.708) 4.269 14.509 ( 0.000 0.352 -0.034) 0.354 14.509 ( -0.000 0.352 0.034) 0.354 14.803 ( 0.000 -1.296 -2.782) 3.069 14.803 ( -0.000 -1.296 2.782) 3.069 15.072 ( -0.000 0.737 -0.881) 1.149 15.072 ( 0.000 0.737 0.881) 1.149 15.240 ( -0.000 3.283 -1.920) 3.803 15.240 ( 0.000 3.283 1.920) 3.803 15.715 ( 0.000 3.853 -10.391) 11.083 15.715 ( 0.000 3.853 10.391) 11.083 15.936 ( 0.000 2.222 -1.504) 2.683 15.936 ( 0.000 2.222 1.504) 2.683 16.108 ( -0.000 1.055 -5.434) 5.536 16.108 ( 0.000 1.055 5.434) 5.536 16.556 ( 0.000 0.273 -2.457) 2.472 16.556 ( 0.000 0.273 2.457) 2.472 16.925 ( 0.000 -0.180 -2.118) 2.126 16.925 ( 0.000 -0.180 2.118) 2.126 17.756 ( 0.000 -1.712 -7.138) 7.341 17.756 ( 0.000 -1.712 7.138) 7.341 17.815 ( -0.000 -1.226 -6.470) 6.585 17.815 ( 0.000 -1.226 6.470) 6.585 17.895 ( 0.000 -0.383 -3.664) 3.684 17.895 ( -0.000 -0.383 3.664) 3.684 18.007 ( -0.000 -0.258 -6.605) 6.610 18.007 ( -0.000 -0.258 6.605) 6.610 18.367 ( -0.000 1.739 -1.447) 2.263 18.367 ( -0.000 1.739 1.447) 2.263 18.402 ( 0.000 2.360 -4.973) 5.505 18.402 ( 0.000 2.360 4.973) 5.505 18.584 ( 0.000 1.088 -1.010) 1.485 18.584 ( 0.000 1.088 1.010) 1.485 18.840 ( 0.000 -2.175 -0.732) 2.295 18.840 ( 0.000 -2.175 0.732) 2.295 18.966 ( 0.000 1.796 -3.834) 4.234 18.966 ( 0.000 1.796 3.834) 4.234 19.704 ( -0.000 -0.870 -0.015) 0.870 19.704 ( 0.000 -0.870 0.015) 0.870 19.869 ( 0.000 0.826 -0.215) 0.853 19.869 ( 0.000 0.826 0.215) 0.853 20.096 ( -0.000 1.341 -2.336) 2.693 20.096 ( 0.000 1.341 2.336) 2.693 20.290 ( 0.000 -0.369 -5.082) 5.096 20.290 ( -0.000 -0.369 5.082) 5.096 20.459 ( 0.000 -1.056 -0.590) 1.210 20.459 ( -0.000 -1.056 0.590) 1.210 20.675 ( 0.000 -3.138 -2.155) 3.807 20.675 ( 0.000 -3.138 2.155) 3.807 21.031 ( 0.000 -0.908 -0.348) 0.972 21.031 ( 0.000 -0.908 0.348) 0.972 21.099 ( -0.000 -1.611 -2.869) 3.290 21.099 ( 0.000 -1.611 2.869) 3.290 21.119 ( -0.000 -1.225 -0.113) 1.230 21.119 ( 0.000 -1.225 0.113) 1.230 22.143 ( -0.000 -2.669 -4.122) 4.911 22.143 ( -0.000 -2.669 4.122) 4.911 22.417 ( 0.000 -0.418 -3.319) 3.345 22.417 ( 0.000 -0.418 3.319) 3.346 22.679 ( 0.000 -1.067 -0.753) 1.306 22.679 ( 0.000 -1.067 0.753) 1.306 23.037 ( -0.000 -0.879 -0.336) 0.941 23.037 ( 0.000 -0.879 0.336) 0.941 23.208 ( -0.000 -0.162 -2.618) 2.623 23.208 ( -0.000 -0.162 2.618) 2.623 23.417 ( 0.000 0.089 -3.256) 3.258 23.417 ( 0.000 0.089 3.256) 3.258 23.641 ( 0.000 -1.424 -0.001) 1.424 23.641 ( 0.000 -1.424 0.001) 1.424 23.867 ( 0.000 -0.229 -2.275) 2.287 23.867 ( 0.000 -0.229 2.275) 2.287 23.931 ( 0.000 -1.195 -1.219) 1.707 23.931 ( 0.000 -1.195 1.219) 1.707 24.536 ( 0.000 1.964 -1.213) 2.308 24.536 ( -0.000 1.964 1.213) 2.308 24.862 ( 0.000 2.514 -0.425) 2.549 24.862 ( 0.000 2.514 0.425) 2.549 25.084 ( 0.000 -2.273 -1.412) 2.676 25.084 ( 0.000 -2.273 1.412) 2.676 25.676 ( 0.000 0.103 -0.833) 0.840 25.676 ( 0.000 0.103 0.833) 0.840 26.134 ( 0.000 -9.420 -3.331) 9.992 26.134 ( 0.000 -9.420 3.331) 9.992 26.224 ( 0.000 -5.819 -8.708) 10.473 26.224 ( 0.000 -5.819 8.708) 10.473 26.576 ( -0.000 -1.203 -15.843) 15.888 26.576 ( 0.000 -1.203 15.843) 15.888 26.712 ( 0.000 -1.610 -4.290) 4.582 26.712 ( 0.000 -1.610 4.290) 4.582 27.083 ( 0.000 -23.373 -3.525) 23.637 27.083 ( 0.000 -23.373 3.525) 23.637 28.056 ( -0.000 -1.104 -7.063) 7.149 28.056 ( 0.000 -1.104 7.063) 7.149 28.271 ( 0.000 -2.382 -1.482) 2.806 28.271 ( 0.000 -2.382 1.482) 2.806 28.595 ( 0.000 -15.593 -1.761) 15.692 28.595 ( 0.000 -15.593 1.761) 15.692 28.986 ( 0.000 -2.143 -1.251) 2.481 28.986 ( 0.000 -2.143 1.251) 2.481 29.126 ( -0.000 -1.315 -3.300) 3.552 29.126 ( -0.000 -1.315 3.300) 3.552 29.518 ( -0.000 -6.586 -1.076) 6.673 29.518 ( -0.000 -6.586 1.076) 6.673 30.092 ( 0.000 -2.779 -2.090) 3.477 30.092 ( 0.000 -2.779 2.090) 3.477 30.614 ( 0.000 -0.512 -0.281) 0.584 30.614 ( 0.000 -0.512 0.281) 0.584 30.678 ( 0.000 -3.677 -2.490) 4.441 30.678 ( -0.000 -3.677 2.490) 4.441 30.859 ( 0.000 -5.718 -1.712) 5.969 30.859 ( 0.000 -5.718 1.712) 5.969 31.296 ( 0.000 -17.938 -0.899) 17.960 31.296 ( 0.000 -17.938 0.899) 17.960 31.319 ( -0.000 -3.398 -1.607) 3.759 31.319 ( -0.000 -3.398 1.607) 3.759 31.670 ( 0.000 -5.037 -0.995) 5.135 31.670 ( 0.000 -5.037 0.995) 5.135 31.799 ( 0.000 -4.188 -1.647) 4.501 31.799 ( 0.000 -4.188 1.647) 4.501 32.188 ( 0.000 -6.246 -0.188) 6.249 32.188 ( 0.000 -6.246 0.188) 6.249 32.652 ( 0.000 -2.090 -1.733) 2.715 32.652 ( 0.000 -2.090 1.733) 2.715 33.286 ( 0.000 -2.326 -5.607) 6.070 33.286 ( 0.000 -2.326 5.607) 6.070 33.553 ( 0.000 1.523 -2.646) 3.053 33.553 ( 0.000 1.523 2.646) 3.053 34.879 ( -0.000 13.298 -22.810) 26.403 34.879 ( 0.000 13.298 22.810) 26.403 35.665 ( 0.000 16.258 -17.474) 23.868 35.665 ( -0.000 16.258 17.474) 23.868 ======================= Grid point 140 (46/54) ======================= q-point: ( 0.00 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 51 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.173 ( 0.000 9.142 -13.323) 16.158 2.173 ( 0.000 9.142 13.323) 16.159 2.325 ( 0.000 10.793 -13.152) 17.014 2.325 ( 0.000 10.793 13.152) 17.014 2.599 ( 0.000 6.631 -9.999) 11.998 2.599 ( 0.000 6.631 9.999) 11.998 2.807 ( 0.000 9.449 -4.133) 10.314 2.807 ( 0.000 9.449 4.133) 10.314 2.953 ( 0.000 11.146 -13.145) 17.234 2.953 ( 0.000 11.146 13.145) 17.234 2.996 ( 0.000 0.691 -5.253) 5.298 2.996 ( 0.000 0.691 5.253) 5.298 3.183 ( 0.000 -0.901 -4.116) 4.213 3.183 ( 0.000 -0.901 4.116) 4.213 3.318 ( 0.000 3.035 -4.926) 5.785 3.318 ( 0.000 3.035 4.926) 5.785 3.394 ( 0.000 0.327 -3.379) 3.395 3.394 ( 0.000 0.327 3.379) 3.395 3.529 ( 0.000 1.470 -0.343) 1.510 3.529 ( 0.000 1.470 0.343) 1.510 3.728 ( 0.000 10.270 -5.160) 11.493 3.728 ( 0.000 10.270 5.160) 11.493 3.846 ( 0.000 -2.361 -6.418) 6.838 3.846 ( 0.000 -2.361 6.418) 6.838 4.188 ( 0.000 -4.451 -5.565) 7.126 4.188 ( 0.000 -4.451 5.565) 7.126 4.363 ( 0.000 -5.320 -1.619) 5.560 4.363 ( 0.000 -5.320 1.619) 5.561 4.617 ( 0.000 -6.710 -4.633) 8.154 4.617 ( 0.000 -6.710 4.633) 8.154 4.914 ( 0.000 -4.569 -7.078) 8.425 4.914 ( 0.000 -4.569 7.078) 8.425 5.071 ( 0.000 1.360 -4.775) 4.965 5.071 ( 0.000 1.360 4.775) 4.965 5.781 ( 0.000 -2.377 -3.369) 4.123 5.781 ( 0.000 -2.377 3.369) 4.123 6.281 ( 0.000 0.451 -8.971) 8.982 6.281 ( 0.000 0.451 8.971) 8.982 6.550 ( 0.000 -9.834 -3.741) 10.521 6.550 ( 0.000 -9.834 3.741) 10.521 6.719 ( 0.000 -5.290 -20.305) 20.983 6.719 ( 0.000 -5.290 20.305) 20.983 6.828 ( 0.000 -2.255 -2.406) 3.298 6.828 ( 0.000 -2.255 2.406) 3.298 7.168 ( 0.000 -5.526 -10.347) 11.731 7.168 ( 0.000 -5.526 10.347) 11.731 7.308 ( 0.000 -3.298 -17.850) 18.153 7.308 ( 0.000 -3.298 17.850) 18.153 7.847 ( 0.000 0.159 -10.552) 10.554 7.847 ( 0.000 0.159 10.552) 10.554 7.893 ( 0.000 2.234 -14.887) 15.053 7.893 ( 0.000 2.234 14.887) 15.053 8.177 ( 0.000 1.392 -4.777) 4.976 8.177 ( 0.000 1.392 4.777) 4.976 8.335 ( 0.000 -0.573 -1.390) 1.504 8.335 ( 0.000 -0.573 1.390) 1.504 8.562 ( 0.000 -0.970 -6.137) 6.214 8.562 ( 0.000 -0.970 6.137) 6.214 8.655 ( 0.000 -0.276 -2.680) 2.694 8.655 ( 0.000 -0.276 2.680) 2.694 8.964 ( 0.000 0.541 -13.388) 13.399 8.964 ( 0.000 0.541 13.388) 13.399 9.302 ( 0.000 -0.576 -5.386) 5.417 9.302 ( 0.000 -0.576 5.386) 5.417 9.359 ( 0.000 0.089 -3.111) 3.112 9.359 ( 0.000 0.089 3.111) 3.112 9.842 ( 0.000 -1.208 -1.566) 1.978 9.842 ( 0.000 -1.208 1.566) 1.978 10.116 ( 0.000 -2.365 -5.587) 6.067 10.116 ( 0.000 -2.365 5.587) 6.067 10.404 ( 0.000 -0.288 -7.354) 7.359 10.404 ( 0.000 -0.288 7.354) 7.359 10.579 ( 0.000 -6.063 -11.084) 12.634 10.579 ( 0.000 -6.063 11.084) 12.634 10.838 ( 0.000 1.565 -14.000) 14.087 10.838 ( 0.000 1.565 14.000) 14.087 10.936 ( 0.000 -5.109 -8.525) 9.938 10.936 ( 0.000 -5.109 8.525) 9.938 11.180 ( 0.000 -10.217 -5.182) 11.456 11.180 ( 0.000 -10.217 5.182) 11.456 11.240 ( 0.000 -1.070 -1.413) 1.772 11.240 ( 0.000 -1.070 1.413) 1.772 11.713 ( 0.000 -2.268 -17.350) 17.497 11.713 ( 0.000 -2.268 17.350) 17.497 12.122 ( 0.000 -0.953 -5.554) 5.635 12.122 ( 0.000 -0.953 5.554) 5.635 12.145 ( 0.000 -1.414 -9.001) 9.111 12.145 ( 0.000 -1.414 9.001) 9.111 12.193 ( 0.000 1.569 -4.007) 4.303 12.193 ( 0.000 1.569 4.007) 4.303 12.385 ( 0.000 0.233 -5.623) 5.627 12.385 ( 0.000 0.233 5.623) 5.627 12.494 ( 0.000 0.679 -13.807) 13.823 12.494 ( 0.000 0.679 13.807) 13.823 12.541 ( 0.000 0.859 -14.636) 14.661 12.541 ( 0.000 0.859 14.636) 14.661 12.883 ( 0.000 1.334 -4.975) 5.150 12.883 ( 0.000 1.334 4.975) 5.150 13.083 ( 0.000 -2.124 -7.602) 7.893 13.083 ( 0.000 -2.124 7.602) 7.893 13.252 ( 0.000 2.158 -17.097) 17.233 13.252 ( 0.000 2.158 17.097) 17.233 13.258 ( 0.000 -2.543 -4.148) 4.865 13.258 ( 0.000 -2.543 4.148) 4.865 13.408 ( 0.000 -1.413 -6.774) 6.919 13.408 ( 0.000 -1.413 6.774) 6.919 13.829 ( 0.000 2.644 -9.212) 9.584 13.829 ( 0.000 2.644 9.212) 9.584 14.185 ( 0.000 1.415 -8.893) 9.005 14.185 ( 0.000 1.415 8.893) 9.005 14.701 ( 0.000 -3.275 -17.399) 17.705 14.701 ( 0.000 -3.275 17.399) 17.705 14.727 ( 0.000 1.518 -19.941) 19.999 14.727 ( 0.000 1.518 19.941) 19.999 15.086 ( 0.000 -1.319 -13.321) 13.386 15.086 ( 0.000 -1.319 13.321) 13.386 15.277 ( 0.000 1.845 -6.259) 6.525 15.277 ( 0.000 1.845 6.259) 6.525 15.923 ( 0.000 1.562 -13.584) 13.674 15.923 ( 0.000 1.562 13.584) 13.674 15.996 ( 0.000 0.577 -1.434) 1.545 15.996 ( 0.000 0.577 1.434) 1.545 16.158 ( 0.000 4.333 -14.430) 15.066 16.158 ( 0.000 4.333 14.430) 15.066 17.021 ( 0.000 0.250 -2.372) 2.385 17.021 ( 0.000 0.250 2.372) 2.385 17.037 ( 0.000 -2.167 -14.201) 14.365 17.037 ( 0.000 -2.167 14.201) 14.365 17.581 ( 0.000 0.766 -15.079) 15.099 17.581 ( 0.000 0.766 15.079) 15.099 17.777 ( 0.000 -1.742 -18.916) 18.996 17.777 ( 0.000 -1.742 18.916) 18.996 17.865 ( 0.000 2.590 -9.474) 9.821 17.865 ( 0.000 2.590 9.474) 9.821 18.121 ( 0.000 -0.157 -4.147) 4.150 18.121 ( 0.000 -0.157 4.147) 4.150 18.191 ( 0.000 -1.332 -5.112) 5.283 18.191 ( 0.000 -1.332 5.112) 5.283 18.389 ( 0.000 0.603 -2.951) 3.012 18.389 ( 0.000 0.603 2.951) 3.012 18.550 ( 0.000 2.057 -2.626) 3.336 18.550 ( 0.000 2.057 2.626) 3.336 18.831 ( 0.000 0.258 -8.060) 8.064 18.831 ( 0.000 0.258 8.060) 8.064 18.888 ( 0.000 0.410 -4.272) 4.292 18.888 ( 0.000 0.410 4.272) 4.292 19.482 ( 0.000 1.731 -4.506) 4.827 19.482 ( 0.000 1.731 4.506) 4.827 19.612 ( 0.000 0.759 -6.983) 7.024 19.612 ( 0.000 0.759 6.983) 7.024 20.135 ( 0.000 0.575 -2.496) 2.562 20.135 ( 0.000 0.575 2.496) 2.562 20.457 ( 0.000 -1.051 -4.732) 4.847 20.457 ( 0.000 -1.051 4.732) 4.847 20.584 ( 0.000 -4.387 -9.467) 10.433 20.584 ( 0.000 -4.387 9.467) 10.433 20.707 ( 0.000 0.102 -8.679) 8.680 20.707 ( 0.000 0.102 8.679) 8.680 20.869 ( 0.000 -0.937 -5.712) 5.788 20.869 ( 0.000 -0.937 5.712) 5.788 21.219 ( 0.000 -3.706 -14.947) 15.399 21.219 ( 0.000 -3.706 14.947) 15.399 21.322 ( 0.000 0.284 -4.288) 4.297 21.322 ( 0.000 0.284 4.288) 4.297 21.846 ( 0.000 -3.429 -12.853) 13.303 21.846 ( 0.000 -3.429 12.853) 13.303 22.515 ( 0.000 1.351 -1.648) 2.130 22.515 ( 0.000 1.351 1.648) 2.130 22.814 ( 0.000 -0.470 -11.379) 11.389 22.814 ( 0.000 -0.470 11.379) 11.389 22.858 ( 0.000 -0.629 -16.212) 16.224 22.858 ( 0.000 -0.629 16.212) 16.224 23.082 ( 0.000 2.028 -4.545) 4.977 23.082 ( 0.000 2.028 4.545) 4.977 23.619 ( 0.000 -0.066 -2.412) 2.413 23.619 ( 0.000 -0.066 2.412) 2.413 23.742 ( 0.000 -0.860 -11.979) 12.010 23.742 ( 0.000 -0.860 11.979) 12.010 23.920 ( 0.000 -1.852 -14.747) 14.862 23.920 ( 0.000 -1.852 14.747) 14.862 24.134 ( 0.000 0.546 -4.449) 4.482 24.134 ( 0.000 0.546 4.449) 4.482 24.464 ( 0.000 -1.243 -7.271) 7.376 24.464 ( 0.000 -1.243 7.271) 7.376 24.514 ( 0.000 -0.192 -0.962) 0.981 24.514 ( 0.000 -0.192 0.962) 0.981 25.150 ( 0.000 1.008 -14.433) 14.468 25.150 ( 0.000 1.008 14.433) 14.468 25.350 ( 0.000 0.035 -12.327) 12.327 25.350 ( 0.000 0.035 12.327) 12.327 25.479 ( 0.000 0.234 -23.456) 23.457 25.479 ( 0.000 0.234 23.456) 23.457 25.790 ( 0.000 -0.239 -2.482) 2.494 25.790 ( 0.000 -0.239 2.482) 2.494 26.491 ( 0.000 0.012 -1.169) 1.169 26.491 ( 0.000 0.012 1.169) 1.169 26.884 ( 0.000 -1.657 -20.904) 20.969 26.884 ( 0.000 -1.657 20.904) 20.969 27.768 ( 0.000 -2.870 -9.869) 10.278 27.768 ( 0.000 -2.870 9.869) 10.278 28.084 ( 0.000 -6.584 -8.587) 10.821 28.084 ( 0.000 -6.584 8.587) 10.821 28.091 ( 0.000 -8.824 -2.456) 9.160 28.091 ( 0.000 -8.824 2.456) 9.160 28.525 ( 0.000 -0.754 -3.733) 3.808 28.525 ( 0.000 -0.754 3.733) 3.808 28.681 ( 0.000 -7.746 -3.942) 8.691 28.681 ( 0.000 -7.746 3.942) 8.691 29.299 ( 0.000 -0.400 -17.752) 17.756 29.299 ( 0.000 -0.400 17.752) 17.756 29.322 ( 0.000 -2.293 -10.083) 10.340 29.322 ( 0.000 -2.293 10.083) 10.340 29.792 ( 0.000 -6.844 -8.941) 11.260 29.792 ( 0.000 -6.844 8.941) 11.260 30.630 ( 0.000 -3.768 -4.479) 5.854 30.630 ( 0.000 -3.768 4.479) 5.854 30.688 ( 0.000 -1.866 -1.454) 2.366 30.688 ( 0.000 -1.866 1.454) 2.366 30.722 ( 0.000 -7.784 -4.323) 8.904 30.722 ( 0.000 -7.784 4.323) 8.904 31.085 ( 0.000 -0.107 -11.466) 11.467 31.085 ( 0.000 -0.107 11.466) 11.467 31.235 ( 0.000 -5.649 -9.025) 10.647 31.235 ( 0.000 -5.649 9.025) 10.647 31.582 ( 0.000 -2.324 -12.240) 12.459 31.582 ( 0.000 -2.324 12.240) 12.459 31.592 ( 0.000 -5.985 -4.946) 7.765 31.592 ( 0.000 -5.985 4.946) 7.765 32.124 ( 0.000 -5.132 -5.791) 7.737 32.124 ( 0.000 -5.132 5.791) 7.737 33.046 ( 0.000 -5.130 -14.178) 15.078 33.046 ( 0.000 -5.130 14.178) 15.078 33.118 ( 0.000 -0.159 -17.690) 17.691 33.118 ( 0.000 -0.159 17.690) 17.691 33.455 ( 0.000 -0.480 -3.761) 3.792 33.455 ( 0.000 -0.480 3.761) 3.792 34.292 ( 0.000 -0.006 -11.854) 11.854 34.292 ( 0.000 -0.006 11.854) 11.854 36.331 ( 0.000 -12.404 -46.412) 48.041 36.331 ( 0.000 -12.404 46.412) 48.041 ======================= Grid point 142 (47/54) ======================= q-point: ( 0.25 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.196 ( 2.024 6.136 -11.878) 13.521 2.196 ( 2.024 6.136 11.878) 13.521 2.314 ( -1.039 11.723 -9.644) 15.216 2.314 ( -1.039 11.723 9.644) 15.216 2.607 ( 1.160 7.750 -9.269) 12.138 2.607 ( 1.160 7.750 9.269) 12.138 2.800 ( -2.764 7.445 -5.708) 9.780 2.800 ( -2.764 7.445 5.708) 9.780 2.933 ( 3.017 6.162 -0.531) 6.881 2.933 ( 3.017 6.162 0.531) 6.881 3.089 ( 5.048 1.289 -1.266) 5.361 3.089 ( 5.048 1.289 1.266) 5.361 3.282 ( 2.323 3.538 -4.234) 5.987 3.282 ( 2.323 3.538 4.234) 5.987 3.298 ( 3.755 2.978 -3.971) 6.224 3.298 ( 3.755 2.978 3.971) 6.224 3.397 ( -0.113 0.574 -2.925) 2.983 3.397 ( -0.113 0.574 2.925) 2.983 3.519 ( -0.322 1.664 -1.017) 1.977 3.519 ( -0.322 1.664 1.017) 1.977 3.703 ( 0.597 6.718 -6.782) 9.565 3.703 ( 0.597 6.718 6.782) 9.565 3.912 ( 3.480 1.768 -4.835) 6.214 3.912 ( 3.480 1.768 4.835) 6.214 4.164 ( -3.720 -4.916 -4.909) 7.881 4.164 ( -3.720 -4.916 4.909) 7.881 4.367 ( -0.281 -1.970 -3.294) 3.848 4.367 ( -0.281 -1.970 3.294) 3.848 4.498 ( -6.483 -2.362 -1.577) 7.078 4.498 ( -6.483 -2.362 1.577) 7.078 4.778 ( -8.501 -6.580 -1.266) 10.824 4.778 ( -8.501 -6.580 1.266) 10.824 5.243 ( 9.766 -1.664 -1.501) 10.020 5.243 ( 9.766 -1.664 1.501) 10.020 5.712 ( -5.261 -2.843 -4.020) 7.206 5.712 ( -5.261 -2.843 4.020) 7.206 6.327 ( -0.486 -4.677 -0.827) 4.774 6.327 ( -0.486 -4.677 0.827) 4.774 6.510 ( 1.498 -5.005 -10.265) 11.518 6.510 ( 1.498 -5.005 10.265) 11.518 6.839 ( 13.539 -2.771 -6.426) 15.240 6.839 ( 13.539 -2.771 6.426) 15.240 6.997 ( -0.162 -4.222 -0.473) 4.251 6.997 ( -0.162 -4.222 0.473) 4.251 7.106 ( 6.377 -4.040 -9.384) 12.043 7.106 ( 6.377 -4.040 9.384) 12.043 7.362 ( 4.877 -3.582 -11.085) 12.629 7.362 ( 4.877 -3.582 11.085) 12.629 7.638 ( -8.788 -0.437 -19.366) 21.272 7.638 ( -8.788 -0.437 19.366) 21.272 8.049 ( -3.256 -0.031 -4.076) 5.217 8.049 ( -3.256 -0.031 4.076) 5.217 8.121 ( 0.939 0.671 -7.824) 7.909 8.121 ( 0.939 0.671 7.824) 7.909 8.279 ( -3.696 0.863 -5.565) 6.735 8.279 ( -3.696 0.863 5.565) 6.735 8.514 ( -2.920 -0.363 -4.212) 5.138 8.514 ( -2.920 -0.363 4.212) 5.138 8.733 ( 4.343 -2.700 -10.484) 11.665 8.733 ( 4.343 -2.700 10.484) 11.665 8.943 ( -7.368 4.198 -3.363) 9.122 8.943 ( -7.368 4.198 3.363) 9.122 9.097 ( -0.838 -0.178 -3.918) 4.011 9.097 ( -0.838 -0.178 3.918) 4.011 9.566 ( 7.204 -1.200 -4.768) 8.722 9.566 ( 7.204 -1.200 4.768) 8.722 9.929 ( -11.017 -4.240 -11.033) 16.158 9.929 ( -11.017 -4.240 11.033) 16.158 10.006 ( 0.332 -0.056 -1.774) 1.805 10.006 ( 0.332 -0.056 1.774) 1.805 10.162 ( -11.790 -4.996 -8.586) 15.417 10.162 ( -11.790 -4.996 8.586) 15.417 10.554 ( 1.546 -3.732 -3.189) 5.146 10.554 ( 1.546 -3.732 3.189) 5.146 10.733 ( -2.361 -1.885 -3.679) 4.760 10.733 ( -2.361 -1.885 3.679) 4.760 10.910 ( -4.183 -2.264 -12.567) 13.437 10.910 ( -4.183 -2.264 12.567) 13.437 11.220 ( -0.103 -2.057 -2.201) 3.014 11.220 ( -0.103 -2.057 2.201) 3.014 11.391 ( 8.731 -5.305 -2.108) 10.432 11.391 ( 8.731 -5.305 2.108) 10.432 11.679 ( -3.495 -2.205 -12.622) 13.282 11.679 ( -3.495 -2.205 12.622) 13.282 12.066 ( -4.433 -0.448 -3.368) 5.585 12.066 ( -4.433 -0.448 3.368) 5.585 12.171 ( 5.101 -0.420 -4.050) 6.526 12.171 ( 5.101 -0.420 4.050) 6.526 12.290 ( -0.023 0.556 -1.843) 1.925 12.290 ( -0.023 0.556 1.843) 1.925 12.370 ( 8.610 0.713 -0.574) 8.658 12.370 ( 8.610 0.713 0.574) 8.658 12.527 ( -0.734 -0.045 -11.528) 11.551 12.527 ( -0.734 -0.045 11.528) 11.551 12.563 ( 2.116 0.893 -5.659) 6.107 12.563 ( 2.116 0.893 5.659) 6.107 12.846 ( -4.502 -0.904 -3.228) 5.613 12.846 ( -4.502 -0.904 3.228) 5.613 13.089 ( 2.183 2.025 -9.357) 9.819 13.089 ( 2.183 2.025 9.357) 9.819 13.209 ( -5.138 -0.278 -9.090) 10.445 13.209 ( -5.138 -0.278 9.090) 10.445 13.264 ( 3.321 -2.146 -4.839) 6.249 13.264 ( 3.321 -2.146 4.839) 6.249 13.622 ( 14.427 0.049 -8.518) 16.754 13.622 ( 14.427 0.049 8.518) 16.754 13.951 ( 5.584 2.344 -5.778) 8.370 13.951 ( 5.584 2.344 5.778) 8.370 14.195 ( 5.379 -1.302 -8.056) 9.774 14.195 ( 5.379 -1.302 8.056) 9.774 14.571 ( -7.399 -0.298 -19.501) 20.859 14.571 ( -7.399 -0.298 19.501) 20.859 14.780 ( 0.776 -1.308 -10.975) 11.080 14.780 ( 0.776 -1.308 10.975) 11.080 15.119 ( 1.215 0.543 -5.497) 5.656 15.119 ( 1.215 0.543 5.497) 5.656 15.239 ( -1.124 0.659 -2.905) 3.184 15.239 ( -1.124 0.659 2.905) 3.184 15.828 ( 0.070 2.547 -7.189) 7.628 15.828 ( 0.070 2.547 7.189) 7.628 15.979 ( -8.161 3.043 -2.860) 9.168 15.979 ( -8.161 3.043 2.860) 9.168 16.236 ( 2.762 1.483 -4.663) 5.619 16.236 ( 2.762 1.483 4.663) 5.619 16.683 ( -15.576 -0.458 -1.696) 15.675 16.683 ( -15.576 -0.458 1.696) 15.675 17.024 ( -8.710 -0.737 -9.367) 12.812 17.024 ( -8.710 -0.737 9.367) 12.812 17.683 ( 6.971 -0.362 -7.207) 10.033 17.683 ( 6.971 -0.362 7.207) 10.033 17.730 ( -0.819 -1.316 -13.750) 13.837 17.730 ( -0.819 -1.316 13.750) 13.837 17.911 ( 0.281 0.590 -6.238) 6.272 17.911 ( 0.281 0.590 6.238) 6.272 18.081 ( -6.166 -1.610 -1.075) 6.462 18.081 ( -6.166 -1.610 1.075) 6.462 18.272 ( 10.462 1.449 -3.185) 11.031 18.272 ( 10.462 1.449 3.185) 11.031 18.435 ( 2.150 1.404 -1.998) 3.253 18.435 ( 2.150 1.404 1.998) 3.253 18.578 ( 2.292 1.370 -2.717) 3.810 18.578 ( 2.292 1.370 2.717) 3.810 18.807 ( -1.247 -0.854 -4.436) 4.686 18.807 ( -1.247 -0.854 4.436) 4.686 18.950 ( 4.185 0.994 -3.283) 5.412 18.950 ( 4.185 0.994 3.283) 5.412 19.555 ( 7.039 0.836 -4.458) 8.374 19.555 ( 7.039 0.836 4.458) 8.374 19.787 ( 16.061 1.202 -10.279) 19.107 19.787 ( 16.061 1.202 10.279) 19.107 20.067 ( -7.045 0.474 -2.187) 7.392 20.067 ( -7.045 0.474 2.187) 7.392 20.390 ( -6.523 -2.021 -6.467) 9.405 20.390 ( -6.523 -2.021 6.467) 9.405 20.508 ( -1.935 -0.933 -1.638) 2.702 20.508 ( -1.935 -0.933 1.638) 2.702 20.807 ( -1.674 -0.228 -1.045) 1.987 20.807 ( -1.674 -0.228 1.045) 1.987 20.844 ( -2.756 -1.935 -4.117) 5.319 20.844 ( -2.756 -1.935 4.117) 5.319 21.053 ( -2.503 -1.406 -3.155) 4.266 21.053 ( -2.503 -1.406 3.155) 4.266 21.262 ( -6.831 -2.943 -4.633) 8.763 21.262 ( -6.831 -2.943 4.633) 8.763 22.008 ( 9.627 -0.490 -2.916) 10.071 22.008 ( 9.627 -0.490 2.916) 10.071 22.472 ( -4.497 -1.099 -6.714) 8.155 22.472 ( -4.497 -1.099 6.714) 8.155 22.718 ( -5.013 0.589 -10.455) 11.610 22.718 ( -5.013 0.589 10.455) 11.610 22.910 ( 5.489 -0.680 -5.209) 7.598 22.910 ( 5.489 -0.680 5.209) 7.598 23.165 ( 5.581 2.050 -1.428) 6.115 23.165 ( 5.581 2.050 1.428) 6.115 23.582 ( -11.701 -0.940 -12.425) 17.093 23.582 ( -11.701 -0.940 12.425) 17.093 23.623 ( -0.140 0.140 -4.010) 4.015 23.623 ( -0.140 0.140 4.010) 4.015 23.892 ( -1.255 0.630 -3.951) 4.193 23.892 ( -1.255 0.630 3.951) 4.193 24.016 ( -9.322 -0.373 -2.359) 9.623 24.016 ( -9.322 -0.373 2.359) 9.623 24.474 ( 8.410 1.305 -7.083) 11.072 24.474 ( 8.410 1.305 7.083) 11.072 24.901 ( 14.016 -1.525 -5.961) 15.307 24.901 ( 14.016 -1.525 5.961) 15.307 25.050 ( -7.913 0.715 -6.509) 10.271 25.050 ( -7.913 0.715 6.509) 10.271 25.415 ( 22.986 -4.628 -5.872) 24.171 25.415 ( 22.986 -4.628 5.872) 24.171 25.677 ( 3.128 -0.267 -4.513) 5.498 25.677 ( 3.128 -0.267 4.513) 5.498 25.924 ( 17.489 -0.603 -14.088) 22.465 25.924 ( 17.489 -0.603 14.088) 22.465 26.504 ( 1.617 -0.202 -1.135) 1.986 26.504 ( 1.617 -0.202 1.135) 1.986 26.780 ( -10.220 -2.322 -20.754) 23.250 26.780 ( -10.220 -2.322 20.754) 23.250 27.380 ( -37.798 -11.643 -9.623) 40.705 27.380 ( -37.798 -11.643 9.623) 40.705 27.930 ( 5.035 -1.339 -9.269) 10.632 27.930 ( 5.035 -1.339 9.269) 10.632 28.272 ( 0.977 -5.546 -6.488) 8.591 28.272 ( 0.977 -5.546 6.488) 8.591 28.433 ( -7.275 -4.520 -2.022) 8.800 28.433 ( -7.275 -4.520 2.022) 8.800 28.820 ( 10.345 -3.861 -2.716) 11.371 28.820 ( 10.345 -3.861 2.716) 11.371 29.144 ( -5.051 -1.105 -4.040) 6.562 29.144 ( -5.051 -1.105 4.040) 6.562 29.454 ( -0.728 -4.219 -3.678) 5.645 29.454 ( -0.728 -4.219 3.678) 5.645 29.877 ( 10.785 -4.134 -2.180) 11.754 29.877 ( 10.785 -4.134 2.180) 11.754 30.585 ( -2.314 -2.804 -2.950) 4.682 30.585 ( -2.314 -2.804 2.950) 4.682 30.672 ( -2.357 -3.179 -2.971) 4.949 30.672 ( -2.357 -3.179 2.971) 4.949 30.763 ( 2.270 -4.380 -1.488) 5.153 30.763 ( 2.270 -4.380 1.488) 5.153 31.097 ( -4.283 -6.484 -5.982) 9.807 31.097 ( -4.283 -6.484 5.982) 9.807 31.195 ( 2.783 -2.777 -8.114) 9.017 31.195 ( 2.783 -2.777 8.114) 9.017 31.560 ( 1.120 -3.942 -2.196) 4.649 31.560 ( 1.120 -3.942 2.196) 4.649 31.684 ( 3.872 -4.123 -4.436) 7.188 31.684 ( 3.872 -4.123 4.436) 7.188 32.114 ( -0.862 -4.181 -4.363) 6.104 32.114 ( -0.862 -4.181 4.363) 6.104 32.749 ( -15.516 -3.413 -10.259) 18.912 32.749 ( -15.516 -3.413 10.259) 18.912 33.215 ( 1.922 -3.009 -7.145) 7.987 33.215 ( 1.922 -3.009 7.145) 7.987 33.533 ( 3.898 -0.207 -2.914) 4.871 33.533 ( 3.898 -0.207 2.914) 4.871 34.562 ( 24.135 -1.534 -16.678) 29.377 34.562 ( 24.135 -1.534 16.678) 29.377 36.107 ( -20.566 -8.766 -38.984) 44.939 36.107 ( -20.566 -8.766 38.984) 44.939 ======================= Grid point 144 (48/54) ======================= q-point: (-0.50 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 50 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.224 ( 0.000 2.462 -12.079) 12.327 2.224 ( 0.000 2.462 12.079) 12.327 2.299 ( 0.000 12.868 -6.965) 14.632 2.299 ( 0.000 12.868 6.965) 14.632 2.630 ( -0.000 9.868 -10.119) 14.134 2.630 ( 0.000 9.868 10.119) 14.134 2.755 ( 0.000 2.623 -1.203) 2.886 2.755 ( 0.000 2.623 1.203) 2.886 2.974 ( -0.000 9.209 -3.931) 10.013 2.974 ( -0.000 9.209 3.931) 10.013 3.185 ( 0.000 2.355 -1.716) 2.914 3.185 ( -0.000 2.355 1.716) 2.914 3.233 ( 0.000 -0.099 -1.472) 1.475 3.233 ( 0.000 -0.099 1.472) 1.475 3.377 ( -0.000 3.102 -0.246) 3.112 3.377 ( -0.000 3.102 0.246) 3.112 3.385 ( 0.000 1.304 -0.548) 1.414 3.385 ( 0.000 1.304 0.548) 1.414 3.533 ( 0.000 3.083 -1.314) 3.352 3.533 ( 0.000 3.083 1.314) 3.352 3.762 ( -0.000 2.551 -7.630) 8.045 3.762 ( -0.000 2.551 7.630) 8.045 3.946 ( 0.000 8.015 -6.048) 10.041 3.946 ( -0.000 8.015 6.049) 10.041 4.057 ( 0.000 -4.063 -7.836) 8.827 4.057 ( 0.000 -4.063 7.836) 8.827 4.338 ( 0.000 3.711 -3.488) 5.093 4.338 ( 0.000 3.711 3.488) 5.093 4.499 ( 0.000 -6.480 -1.049) 6.564 4.499 ( 0.000 -6.480 1.049) 6.564 4.653 ( 0.000 -7.102 -1.993) 7.376 4.653 ( -0.000 -7.102 1.993) 7.376 5.351 ( 0.000 -2.378 -4.588) 5.167 5.351 ( 0.000 -2.378 4.588) 5.167 5.646 ( -0.000 -4.014 -2.853) 4.925 5.646 ( -0.000 -4.014 2.853) 4.925 6.298 ( 0.000 -8.684 -0.081) 8.685 6.298 ( 0.000 -8.684 0.081) 8.685 6.568 ( 0.000 -2.739 -6.940) 7.461 6.568 ( 0.000 -2.739 6.940) 7.461 6.864 ( 0.000 -0.239 -3.940) 3.947 6.864 ( 0.000 -0.239 3.940) 3.947 7.058 ( 0.000 -2.027 -3.276) 3.852 7.058 ( 0.000 -2.027 3.276) 3.852 7.282 ( -0.000 -6.362 -4.278) 7.667 7.282 ( -0.000 -6.362 4.278) 7.667 7.466 ( 0.000 -2.093 -8.534) 8.787 7.466 ( 0.000 -2.093 8.534) 8.787 7.558 ( 0.000 -2.166 -4.643) 5.123 7.558 ( -0.000 -2.166 4.643) 5.123 7.892 ( 0.000 0.357 -1.493) 1.536 7.892 ( 0.000 0.357 1.493) 1.536 8.140 ( 0.000 -4.083 -2.687) 4.888 8.140 ( 0.000 -4.083 2.687) 4.888 8.249 ( 0.000 3.825 -7.951) 8.823 8.249 ( 0.000 3.825 7.951) 8.823 8.505 ( 0.000 1.689 -6.971) 7.173 8.505 ( 0.000 1.689 6.971) 7.173 8.686 ( 0.000 2.867 -0.006) 2.867 8.686 ( 0.000 2.867 0.006) 2.867 8.947 ( -0.000 -3.231 -1.276) 3.474 8.947 ( -0.000 -3.231 1.276) 3.474 9.076 ( 0.000 -2.686 -6.208) 6.764 9.076 ( 0.000 -2.686 6.208) 6.764 9.604 ( 0.000 -3.751 -4.744) 6.048 9.604 ( 0.000 -3.751 4.744) 6.048 9.734 ( -0.000 0.455 -3.296) 3.327 9.734 ( -0.000 0.455 3.296) 3.327 9.968 ( -0.000 -1.325 -6.447) 6.582 9.968 ( -0.000 -1.325 6.447) 6.582 10.140 ( 0.000 -2.472 -0.943) 2.645 10.140 ( 0.000 -2.472 0.943) 2.645 10.621 ( 0.000 -4.770 -5.779) 7.493 10.621 ( 0.000 -4.770 5.779) 7.493 10.724 ( -0.000 -1.063 -5.410) 5.513 10.724 ( -0.000 -1.063 5.410) 5.513 10.838 ( 0.000 -4.045 -6.374) 7.549 10.838 ( 0.000 -4.045 6.374) 7.549 11.215 ( 0.000 -2.024 -3.426) 3.980 11.215 ( -0.000 -2.024 3.426) 3.980 11.457 ( 0.000 -2.188 -4.937) 5.400 11.457 ( 0.000 -2.188 4.937) 5.400 11.633 ( -0.000 -2.545 -4.792) 5.426 11.633 ( -0.000 -2.545 4.792) 5.426 12.020 ( 0.000 0.093 -6.168) 6.169 12.020 ( 0.000 0.093 6.168) 6.169 12.229 ( 0.000 1.565 -0.119) 1.570 12.229 ( 0.000 1.565 0.119) 1.570 12.364 ( 0.000 0.254 -4.174) 4.182 12.364 ( 0.000 0.254 4.174) 4.182 12.382 ( -0.000 -2.000 -7.036) 7.314 12.382 ( -0.000 -2.000 7.036) 7.314 12.540 ( 0.000 -1.979 -4.277) 4.713 12.540 ( 0.000 -1.979 4.277) 4.713 12.613 ( 0.000 0.622 -2.671) 2.743 12.613 ( -0.000 0.622 2.671) 2.743 12.779 ( -0.000 0.543 -3.512) 3.553 12.779 ( 0.000 0.543 3.512) 3.553 13.103 ( -0.000 1.200 -1.885) 2.235 13.103 ( 0.000 1.200 1.885) 2.235 13.166 ( 0.000 3.024 -6.417) 7.094 13.166 ( 0.000 3.024 6.417) 7.094 13.314 ( 0.000 -2.661 -3.115) 4.096 13.314 ( -0.000 -2.661 3.115) 4.096 13.768 ( -0.000 1.543 -2.704) 3.114 13.768 ( -0.000 1.543 2.704) 3.114 13.970 ( 0.000 0.539 -1.692) 1.775 13.970 ( 0.000 0.539 1.692) 1.775 14.304 ( 0.000 -3.204 -2.164) 3.866 14.304 ( 0.000 -3.204 2.164) 3.866 14.512 ( -0.000 -0.107 -1.996) 1.999 14.512 ( -0.000 -0.107 1.996) 1.999 14.784 ( 0.000 -0.556 -7.475) 7.496 14.784 ( -0.000 -0.556 7.475) 7.496 15.080 ( -0.000 0.011 -2.539) 2.539 15.080 ( 0.000 0.011 2.539) 2.539 15.289 ( -0.000 1.785 -0.752) 1.937 15.289 ( 0.000 1.785 0.752) 1.937 15.788 ( 0.000 3.305 -9.976) 10.509 15.788 ( 0.000 3.305 9.976) 10.509 15.982 ( 0.000 2.268 -0.592) 2.344 15.982 ( 0.000 2.268 0.592) 2.344 16.123 ( -0.000 0.445 -5.805) 5.822 16.123 ( -0.000 0.445 5.805) 5.822 16.561 ( 0.000 0.113 -1.965) 1.968 16.561 ( 0.000 0.113 1.965) 1.968 16.920 ( 0.000 -0.255 -1.863) 1.881 16.920 ( 0.000 -0.255 1.863) 1.881 17.717 ( 0.000 -2.076 -9.375) 9.602 17.717 ( 0.000 -2.076 9.375) 9.602 17.797 ( -0.000 -0.623 -3.248) 3.307 17.797 ( -0.000 -0.623 3.248) 3.307 17.885 ( 0.000 -0.535 -2.891) 2.940 17.885 ( 0.000 -0.535 2.891) 2.940 17.994 ( 0.000 -0.922 -6.091) 6.161 17.994 ( 0.000 -0.922 6.091) 6.161 18.411 ( -0.000 2.573 -2.213) 3.394 18.411 ( -0.000 2.573 2.213) 3.394 18.451 ( 0.000 2.388 -4.287) 4.907 18.451 ( 0.000 2.388 4.287) 4.907 18.603 ( 0.000 0.776 -0.219) 0.806 18.603 ( -0.000 0.776 0.219) 0.806 18.791 ( 0.000 -2.602 -0.658) 2.684 18.791 ( 0.000 -2.602 0.658) 2.684 19.002 ( 0.000 1.761 -4.288) 4.635 19.002 ( 0.000 1.761 4.288) 4.635 19.686 ( 0.000 -0.870 -0.604) 1.059 19.686 ( -0.000 -0.870 0.604) 1.059 19.887 ( 0.000 0.958 -0.011) 0.958 19.887 ( 0.000 0.958 0.011) 0.958 20.131 ( -0.000 2.100 -1.708) 2.707 20.131 ( 0.000 2.100 1.708) 2.707 20.280 ( 0.000 -0.590 -4.967) 5.002 20.280 ( -0.000 -0.590 4.967) 5.002 20.436 ( 0.000 -1.213 -1.163) 1.681 20.436 ( 0.000 -1.213 1.163) 1.681 20.612 ( 0.000 -2.890 -1.849) 3.431 20.612 ( 0.000 -2.890 1.849) 3.431 21.013 ( 0.000 -0.730 -0.385) 0.825 21.013 ( 0.000 -0.730 0.385) 0.825 21.065 ( -0.000 -1.535 -2.604) 3.023 21.065 ( -0.000 -1.535 2.604) 3.023 21.101 ( -0.000 -0.797 -0.572) 0.981 21.101 ( -0.000 -0.797 0.572) 0.981 22.096 ( -0.000 -1.924 -3.909) 4.357 22.096 ( -0.000 -1.924 3.909) 4.357 22.415 ( 0.000 0.270 -2.994) 3.006 22.415 ( 0.000 0.270 2.994) 3.006 22.677 ( 0.000 0.703 -0.720) 1.006 22.677 ( 0.000 0.703 0.720) 1.006 23.009 ( 0.000 -1.703 -0.029) 1.703 23.009 ( -0.000 -1.703 0.029) 1.703 23.227 ( -0.000 1.966 -1.918) 2.747 23.227 ( -0.000 1.966 1.918) 2.747 23.419 ( 0.000 0.086 -2.140) 2.142 23.419 ( 0.000 0.086 2.140) 2.142 23.626 ( 0.000 -0.130 -0.044) 0.138 23.626 ( 0.000 -0.130 0.044) 0.138 23.881 ( 0.000 1.510 -1.575) 2.182 23.881 ( 0.000 1.510 1.575) 2.182 23.911 ( 0.000 -0.772 -1.063) 1.313 23.911 ( 0.000 -0.772 1.063) 1.313 24.581 ( 0.000 2.391 -1.202) 2.676 24.581 ( -0.000 2.391 1.202) 2.676 24.916 ( 0.000 2.709 -0.625) 2.780 24.916 ( 0.000 2.709 0.625) 2.780 25.039 ( 0.000 -2.031 -1.509) 2.530 25.039 ( 0.000 -2.031 1.509) 2.530 25.677 ( 0.000 0.006 -0.530) 0.530 25.677 ( -0.000 0.006 0.530) 0.530 25.912 ( 0.000 -9.411 -7.221) 11.862 25.912 ( 0.000 -9.411 7.221) 11.862 26.189 ( -0.000 -0.651 -0.387) 0.758 26.189 ( 0.000 -0.651 0.387) 0.758 26.551 ( -0.000 -2.314 -9.815) 10.084 26.551 ( -0.000 -2.314 9.815) 10.084 26.636 ( 0.000 -8.908 -6.483) 11.017 26.636 ( -0.000 -8.908 6.483) 11.017 26.739 ( 0.000 -6.812 -6.819) 9.638 26.739 ( 0.000 -6.812 6.819) 9.638 28.040 ( -0.000 -0.599 -8.010) 8.033 28.040 ( -0.000 -0.599 8.010) 8.033 28.217 ( 0.000 -2.787 -1.117) 3.003 28.217 ( 0.000 -2.787 1.117) 3.003 28.355 ( 0.000 -9.005 -1.600) 9.146 28.355 ( 0.000 -9.005 1.600) 9.146 28.953 ( 0.000 -1.262 -1.353) 1.850 28.953 ( 0.000 -1.262 1.353) 1.850 29.096 ( -0.000 -1.772 -2.865) 3.369 29.096 ( -0.000 -1.772 2.865) 3.369 29.399 ( 0.000 -5.173 -1.224) 5.316 29.399 ( -0.000 -5.173 1.224) 5.316 30.044 ( 0.000 -2.129 -1.472) 2.589 30.044 ( 0.000 -2.129 1.472) 2.589 30.565 ( -0.000 -5.079 -2.712) 5.758 30.565 ( 0.000 -5.079 2.712) 5.758 30.621 ( 0.000 -0.319 -0.719) 0.787 30.621 ( 0.000 -0.319 0.719) 0.787 30.787 ( 0.000 -2.247 -0.602) 2.326 30.787 ( 0.000 -2.247 0.602) 2.326 31.020 ( 0.000 -10.426 -0.409) 10.434 31.020 ( 0.000 -10.426 0.409) 10.434 31.263 ( -0.000 -2.361 -2.551) 3.476 31.263 ( -0.000 -2.361 2.551) 3.476 31.580 ( 0.000 -3.789 -1.949) 4.261 31.580 ( 0.000 -3.789 1.949) 4.261 31.718 ( 0.000 -4.605 -7.007) 8.385 31.718 ( 0.000 -4.605 7.007) 8.385 32.102 ( 0.000 -2.468 -1.690) 2.991 32.102 ( -0.000 -2.468 1.690) 2.991 32.582 ( 0.000 -4.601 -1.814) 4.945 32.582 ( 0.000 -4.601 1.814) 4.945 33.230 ( 0.000 -3.238 -3.908) 5.075 33.230 ( 0.000 -3.238 3.908) 5.075 33.566 ( 0.000 -0.039 -2.108) 2.108 33.566 ( 0.000 -0.039 2.108) 2.108 34.934 ( -0.000 -5.470 -15.128) 16.086 34.934 ( 0.000 -5.470 15.128) 16.086 35.777 ( 0.000 -2.830 -10.578) 10.950 35.777 ( -0.000 -2.830 10.578) 10.950 ======================= Grid point 150 (49/54) ======================= q-point: ( 0.00 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 51 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.314 ( 0.000 5.367 -4.768) 7.179 2.314 ( 0.000 5.367 4.768) 7.179 2.451 ( 0.000 3.675 -12.729) 13.249 2.451 ( 0.000 3.675 12.729) 13.249 2.741 ( 0.000 6.654 -7.793) 10.247 2.741 ( 0.000 6.654 7.793) 10.247 2.950 ( 0.000 2.642 -1.690) 3.136 2.950 ( 0.000 2.642 1.690) 3.136 3.015 ( 0.000 1.014 -5.072) 5.172 3.015 ( 0.000 1.014 5.072) 5.172 3.218 ( 0.000 5.243 -2.285) 5.719 3.218 ( 0.000 5.243 2.285) 5.719 3.220 ( 0.000 13.122 -2.517) 13.361 3.220 ( 0.000 13.122 2.517) 13.361 3.373 ( 0.000 -1.763 -2.918) 3.409 3.373 ( 0.000 -1.763 2.918) 3.409 3.388 ( 0.000 4.308 -7.541) 8.684 3.388 ( 0.000 4.308 7.541) 8.685 3.558 ( 0.000 1.001 -1.886) 2.136 3.558 ( 0.000 1.001 1.886) 2.136 3.795 ( 0.000 -1.896 -5.655) 5.964 3.795 ( 0.000 -1.896 5.655) 5.964 3.920 ( 0.000 6.514 -4.020) 7.655 3.920 ( 0.000 6.514 4.020) 7.655 4.136 ( 0.000 -0.894 -2.048) 2.235 4.136 ( 0.000 -0.894 2.048) 2.235 4.258 ( 0.000 -2.737 -5.365) 6.023 4.258 ( 0.000 -2.737 5.365) 6.023 4.486 ( 0.000 -5.894 -6.492) 8.768 4.486 ( 0.000 -5.894 6.492) 8.768 4.836 ( 0.000 -3.636 -7.558) 8.387 4.836 ( 0.000 -3.636 7.558) 8.387 5.080 ( 0.000 -0.540 -2.942) 2.991 5.080 ( 0.000 -0.540 2.942) 2.991 5.741 ( 0.000 -1.477 -2.263) 2.703 5.741 ( 0.000 -1.477 2.263) 2.703 6.281 ( 0.000 -0.333 -10.724) 10.729 6.281 ( 0.000 -0.333 10.724) 10.729 6.346 ( 0.000 -9.831 -2.441) 10.129 6.346 ( 0.000 -9.831 2.441) 10.129 6.640 ( 0.000 -2.805 -17.706) 17.927 6.640 ( 0.000 -2.805 17.706) 17.927 6.791 ( 0.000 -1.457 -1.940) 2.426 6.791 ( 0.000 -1.457 1.940) 2.426 7.058 ( 0.000 -5.194 -11.892) 12.977 7.058 ( 0.000 -5.194 11.892) 12.977 7.240 ( 0.000 -3.252 -19.073) 19.348 7.240 ( 0.000 -3.252 19.073) 19.348 7.843 ( 0.000 -0.836 -6.958) 7.008 7.843 ( 0.000 -0.836 6.958) 7.008 7.937 ( 0.000 2.098 -13.793) 13.951 7.937 ( 0.000 2.098 13.793) 13.951 8.087 ( 0.000 -8.316 -7.948) 11.504 8.087 ( 0.000 -8.316 7.948) 11.504 8.356 ( 0.000 2.024 -12.003) 12.173 8.356 ( 0.000 2.024 12.003) 12.173 8.540 ( 0.000 -1.167 -5.770) 5.887 8.540 ( 0.000 -1.167 5.770) 5.887 8.630 ( 0.000 -1.679 -9.946) 10.087 8.630 ( 0.000 -1.679 9.946) 10.087 8.984 ( 0.000 1.394 -12.922) 12.997 8.984 ( 0.000 1.394 12.922) 12.997 9.284 ( 0.000 -1.093 -6.283) 6.378 9.284 ( 0.000 -1.093 6.283) 6.378 9.387 ( 0.000 2.255 -3.337) 4.028 9.387 ( 0.000 2.255 3.337) 4.028 9.820 ( 0.000 -0.888 -0.416) 0.980 9.820 ( 0.000 -0.888 0.416) 0.980 10.079 ( 0.000 -1.070 -4.310) 4.441 10.079 ( 0.000 -1.070 4.310) 4.441 10.402 ( 0.000 0.037 -8.716) 8.716 10.402 ( 0.000 0.037 8.716) 8.716 10.470 ( 0.000 -4.645 -9.482) 10.559 10.470 ( 0.000 -4.645 9.482) 10.559 10.845 ( 0.000 -3.867 -8.796) 9.608 10.845 ( 0.000 -3.867 8.796) 9.608 10.854 ( 0.000 -0.214 -14.434) 14.436 10.854 ( 0.000 -0.214 14.434) 14.436 11.012 ( 0.000 -6.078 -6.344) 8.786 11.012 ( 0.000 -6.078 6.344) 8.786 11.227 ( 0.000 -0.339 -2.511) 2.534 11.227 ( 0.000 -0.339 2.511) 2.534 11.682 ( 0.000 -0.985 -14.662) 14.695 11.682 ( 0.000 -0.985 14.662) 14.695 12.089 ( 0.000 -1.664 -7.720) 7.897 12.089 ( 0.000 -1.664 7.720) 7.897 12.094 ( 0.000 -2.812 -8.759) 9.199 12.094 ( 0.000 -2.812 8.759) 9.199 12.233 ( 0.000 1.871 -5.316) 5.635 12.233 ( 0.000 1.871 5.316) 5.635 12.413 ( 0.000 1.842 -7.186) 7.419 12.413 ( 0.000 1.842 7.186) 7.419 12.500 ( 0.000 0.051 -16.868) 16.868 12.500 ( 0.000 0.051 16.868) 16.868 12.555 ( 0.000 0.474 -13.764) 13.772 12.555 ( 0.000 0.474 13.764) 13.772 12.923 ( 0.000 2.658 -3.943) 4.755 12.923 ( 0.000 2.658 3.943) 4.755 13.016 ( 0.000 -3.852 -5.992) 7.123 13.016 ( 0.000 -3.852 5.992) 7.123 13.187 ( 0.000 -4.409 -3.093) 5.386 13.187 ( 0.000 -4.409 3.093) 5.386 13.296 ( 0.000 2.317 -6.680) 7.070 13.296 ( 0.000 2.317 6.680) 7.070 13.404 ( 0.000 0.312 -4.041) 4.053 13.404 ( 0.000 0.312 4.041) 4.053 13.868 ( 0.000 1.389 -11.333) 11.418 13.868 ( 0.000 1.389 11.333) 11.418 14.227 ( 0.000 2.399 -12.161) 12.395 14.227 ( 0.000 2.399 12.161) 12.395 14.640 ( 0.000 -2.728 -21.331) 21.505 14.640 ( 0.000 -2.728 21.331) 21.505 14.753 ( 0.000 1.095 -19.716) 19.747 14.753 ( 0.000 1.095 19.716) 19.747 15.059 ( 0.000 -1.210 -11.926) 11.987 15.059 ( 0.000 -1.210 11.926) 11.987 15.308 ( 0.000 1.233 -9.190) 9.272 15.308 ( 0.000 1.233 9.190) 9.272 15.948 ( 0.000 0.937 -15.691) 15.719 15.948 ( 0.000 0.937 15.691) 15.719 15.993 ( 0.000 -0.654 -0.942) 1.147 15.993 ( 0.000 -0.654 0.942) 1.147 16.231 ( 0.000 2.910 -12.827) 13.153 16.231 ( 0.000 2.910 12.827) 13.153 17.003 ( 0.000 -1.298 -12.306) 12.375 17.003 ( 0.000 -1.298 12.306) 12.375 17.025 ( 0.000 0.195 -3.895) 3.900 17.025 ( 0.000 0.195 3.895) 3.900 17.592 ( 0.000 0.396 -16.967) 16.972 17.592 ( 0.000 0.396 16.967) 16.972 17.748 ( 0.000 -1.221 -18.800) 18.839 17.748 ( 0.000 -1.221 18.800) 18.839 17.917 ( 0.000 2.516 -8.132) 8.513 17.917 ( 0.000 2.516 8.132) 8.513 18.119 ( 0.000 -0.008 -2.895) 2.895 18.119 ( 0.000 -0.008 2.895) 2.895 18.161 ( 0.000 -1.660 -6.150) 6.370 18.161 ( 0.000 -1.660 6.150) 6.370 18.398 ( 0.000 0.259 -2.179) 2.195 18.398 ( 0.000 0.259 2.179) 2.195 18.582 ( 0.000 1.223 -1.629) 2.037 18.582 ( 0.000 1.223 1.629) 2.037 18.837 ( 0.000 0.320 -8.001) 8.008 18.837 ( 0.000 0.320 8.001) 8.008 18.897 ( 0.000 0.467 -4.716) 4.739 18.897 ( 0.000 0.467 4.716) 4.739 19.513 ( 0.000 1.296 -4.467) 4.651 19.513 ( 0.000 1.296 4.467) 4.651 19.621 ( 0.000 0.188 -8.052) 8.054 19.621 ( 0.000 0.188 8.052) 8.054 20.144 ( 0.000 0.356 -2.922) 2.943 20.144 ( 0.000 0.356 2.922) 2.943 20.435 ( 0.000 -1.110 -4.968) 5.090 20.435 ( 0.000 -1.110 4.968) 5.090 20.519 ( 0.000 -2.098 -8.596) 8.848 20.519 ( 0.000 -2.098 8.596) 8.848 20.710 ( 0.000 0.139 -7.859) 7.860 20.710 ( 0.000 0.139 7.859) 7.860 20.851 ( 0.000 -0.756 -5.333) 5.386 20.851 ( 0.000 -0.756 5.333) 5.386 21.160 ( 0.000 -2.150 -14.600) 14.757 21.160 ( 0.000 -2.150 14.600) 14.757 21.326 ( 0.000 0.193 -3.751) 3.756 21.326 ( 0.000 0.193 3.751) 3.756 21.807 ( 0.000 -0.816 -10.795) 10.825 21.807 ( 0.000 -0.816 10.795) 10.825 22.535 ( 0.000 0.688 -2.759) 2.843 22.535 ( 0.000 0.688 2.759) 2.843 22.815 ( 0.000 0.427 -8.766) 8.776 22.815 ( 0.000 0.427 8.766) 8.776 22.855 ( 0.000 0.088 -14.607) 14.607 22.855 ( 0.000 0.088 14.607) 14.607 23.124 ( 0.000 2.022 -2.864) 3.506 23.124 ( 0.000 2.022 2.864) 3.506 23.622 ( 0.000 0.237 -2.217) 2.230 23.622 ( 0.000 0.237 2.217) 2.230 23.723 ( 0.000 -0.749 -21.672) 21.685 23.723 ( 0.000 -0.749 21.672) 21.685 23.923 ( 0.000 1.212 -3.901) 4.085 23.923 ( 0.000 1.212 3.901) 4.085 24.146 ( 0.000 0.644 -4.464) 4.510 24.146 ( 0.000 0.644 4.464) 4.510 24.452 ( 0.000 -0.198 -6.391) 6.394 24.452 ( 0.000 -0.198 6.391) 6.394 24.511 ( 0.000 -0.109 -0.973) 0.979 24.511 ( 0.000 -0.109 0.973) 0.979 25.179 ( 0.000 1.550 -16.376) 16.449 25.179 ( 0.000 1.550 16.376) 16.449 25.354 ( 0.000 0.295 -13.286) 13.289 25.354 ( 0.000 0.295 13.286) 13.289 25.484 ( 0.000 0.184 -23.050) 23.051 25.484 ( 0.000 0.184 23.050) 23.051 25.786 ( 0.000 -0.182 -1.468) 1.479 25.786 ( 0.000 -0.182 1.468) 1.479 26.491 ( 0.000 0.006 -1.264) 1.264 26.491 ( 0.000 0.006 1.264) 1.264 26.853 ( 0.000 -1.354 -19.837) 19.883 26.853 ( 0.000 -1.354 19.837) 19.883 27.695 ( 0.000 -4.033 -7.357) 8.390 27.695 ( 0.000 -4.033 7.357) 8.390 27.965 ( 0.000 -3.951 -2.437) 4.642 27.965 ( 0.000 -3.951 2.437) 4.642 27.979 ( 0.000 -3.975 -5.777) 7.012 27.979 ( 0.000 -3.975 5.777) 7.012 28.512 ( 0.000 -0.541 -3.199) 3.244 28.512 ( 0.000 -0.541 3.199) 3.244 28.543 ( 0.000 -5.746 -5.960) 8.278 28.543 ( 0.000 -5.746 5.960) 8.278 29.286 ( 0.000 -1.365 -9.580) 9.677 29.286 ( 0.000 -1.365 9.580) 9.677 29.292 ( 0.000 -0.279 -17.763) 17.765 29.292 ( 0.000 -0.279 17.763) 17.765 29.689 ( 0.000 -3.616 -8.174) 8.938 29.689 ( 0.000 -3.616 8.174) 8.938 30.526 ( 0.000 -5.245 -2.750) 5.922 30.526 ( 0.000 -5.245 2.750) 5.922 30.638 ( 0.000 -1.978 -8.748) 8.968 30.638 ( 0.000 -1.978 8.748) 8.968 30.661 ( 0.000 -0.942 -2.552) 2.721 30.661 ( 0.000 -0.942 2.552) 2.721 31.078 ( 0.000 -0.451 -11.810) 11.819 31.078 ( 0.000 -0.451 11.810) 11.819 31.146 ( 0.000 -3.384 -7.538) 8.263 31.146 ( 0.000 -3.384 7.538) 8.263 31.501 ( 0.000 -3.318 -2.785) 4.331 31.501 ( 0.000 -3.318 2.785) 4.331 31.543 ( 0.000 -1.549 -13.364) 13.453 31.543 ( 0.000 -1.549 13.364) 13.453 32.045 ( 0.000 -2.792 -4.430) 5.236 32.045 ( 0.000 -2.792 4.430) 5.236 32.948 ( 0.000 -4.367 -14.955) 15.580 32.948 ( 0.000 -4.367 14.955) 15.580 33.072 ( 0.000 -3.474 -16.890) 17.244 33.072 ( 0.000 -3.474 16.890) 17.244 33.438 ( 0.000 -0.984 -3.407) 3.546 33.438 ( 0.000 -0.984 3.407) 3.546 34.255 ( 0.000 -3.028 -9.803) 10.260 34.255 ( 0.000 -3.028 9.803) 10.260 36.028 ( 0.000 -15.331 -34.091) 37.380 36.028 ( 0.000 -15.331 34.091) 37.380 ======================= Grid point 152 (50/54) ======================= q-point: ( 0.25 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.292 ( -0.910 4.721 -6.590) 8.158 2.292 ( -0.910 4.721 6.590) 8.158 2.495 ( 2.738 5.319 -6.368) 8.737 2.495 ( 2.738 5.319 6.368) 8.737 2.742 ( 0.424 5.884 -6.290) 8.624 2.742 ( 0.424 5.884 6.290) 8.624 2.941 ( -4.847 4.768 -7.300) 9.976 2.941 ( -4.847 4.768 7.300) 9.976 3.034 ( 4.529 1.825 -1.783) 5.199 3.034 ( 4.529 1.825 1.783) 5.199 3.173 ( 2.243 8.680 -2.221) 9.236 3.173 ( 2.243 8.680 2.221) 9.236 3.304 ( 0.311 1.095 -0.895) 1.448 3.304 ( 0.311 1.095 0.895) 1.448 3.363 ( 0.117 0.856 -2.051) 2.226 3.363 ( 0.117 0.856 2.051) 2.226 3.455 ( 5.369 5.502 -2.963) 8.239 3.455 ( 5.369 5.502 2.963) 8.239 3.553 ( 0.180 1.880 -1.992) 2.745 3.553 ( 0.180 1.880 1.992) 2.745 3.775 ( -0.222 0.201 -5.540) 5.548 3.775 ( -0.222 0.201 5.540) 5.548 3.964 ( 1.330 1.867 -4.381) 4.945 3.964 ( 1.330 1.867 4.381) 4.945 4.103 ( -0.998 -0.787 -1.892) 2.279 4.103 ( -0.998 -0.787 1.892) 2.279 4.307 ( 4.094 -0.876 -4.647) 6.255 4.307 ( 4.094 -0.876 4.647) 6.255 4.471 ( -1.507 -1.866 -5.306) 5.823 4.471 ( -1.507 -1.866 5.306) 5.823 4.675 ( -11.455 -3.611 -4.508) 12.829 4.675 ( -11.455 -3.611 4.508) 12.829 5.200 ( 7.835 -2.600 -1.116) 8.331 5.200 ( 7.835 -2.600 1.116) 8.331 5.661 ( -6.562 -2.075 -2.755) 7.413 5.661 ( -6.562 -2.075 2.755) 7.413 6.202 ( -6.028 -6.894 -0.951) 9.207 6.202 ( -6.028 -6.894 0.951) 9.207 6.444 ( 6.086 -2.156 -9.996) 11.900 6.444 ( 6.086 -2.156 9.996) 11.900 6.780 ( 15.850 -2.856 -7.233) 17.655 6.780 ( 15.850 -2.856 7.233) 17.655 6.902 ( 1.095 -4.812 -3.896) 6.288 6.902 ( 1.095 -4.812 3.896) 6.288 7.046 ( 4.869 -2.188 -6.020) 8.046 7.046 ( 4.869 -2.188 6.020) 8.046 7.286 ( 4.873 -3.500 -10.923) 12.462 7.286 ( 4.873 -3.500 10.923) 12.462 7.629 ( -9.800 -0.429 -15.129) 18.031 7.629 ( -9.800 -0.429 15.129) 18.031 7.981 ( -2.699 -6.259 -4.312) 8.066 7.981 ( -2.699 -6.259 4.312) 8.066 8.139 ( -4.438 1.157 -4.032) 6.106 8.139 ( -4.438 1.157 4.032) 6.106 8.293 ( 1.149 0.875 -9.467) 9.576 8.293 ( 1.149 0.875 9.467) 9.576 8.497 ( -2.420 -0.966 -2.753) 3.791 8.497 ( -2.420 -0.966 2.753) 3.791 8.672 ( 4.908 -3.061 -12.982) 14.213 8.672 ( 4.908 -3.061 12.982) 14.213 9.024 ( -7.199 3.442 -3.766) 8.824 9.024 ( -7.199 3.442 3.766) 8.824 9.093 ( -3.360 -0.209 -4.548) 5.658 9.093 ( -3.360 -0.209 4.548) 5.658 9.542 ( 5.026 -1.088 -4.258) 6.676 9.542 ( 5.026 -1.088 4.258) 6.676 9.870 ( -13.069 -1.604 -8.009) 15.411 9.870 ( -13.069 -1.604 8.009) 15.411 10.006 ( 2.307 0.045 -2.971) 3.761 10.006 ( 2.307 0.045 2.971) 3.761 10.077 ( -8.752 -3.369 -6.744) 11.552 10.077 ( -8.752 -3.369 6.744) 11.552 10.489 ( 0.690 -2.723 -2.013) 3.456 10.489 ( 0.690 -2.723 2.013) 3.456 10.696 ( -2.135 -1.785 -2.458) 3.713 10.696 ( -2.135 -1.785 2.458) 3.713 10.872 ( -5.964 -1.511 -12.648) 14.065 10.872 ( -5.964 -1.511 12.648) 14.065 11.175 ( 2.363 -2.373 -4.024) 5.235 11.175 ( 2.363 -2.373 4.024) 5.235 11.316 ( 10.552 -2.206 -3.078) 11.211 11.316 ( 10.552 -2.206 3.078) 11.211 11.633 ( -4.499 -2.171 -12.081) 13.072 11.633 ( -4.499 -2.171 12.081) 13.072 12.055 ( -1.528 -0.487 -2.336) 2.834 12.055 ( -1.528 -0.487 2.336) 2.834 12.167 ( 4.881 0.138 -3.107) 5.787 12.167 ( 4.881 0.138 3.107) 5.787 12.276 ( 2.343 -1.379 -3.343) 4.310 12.276 ( 2.343 -1.379 3.343) 4.310 12.409 ( 3.409 2.333 -5.347) 6.757 12.409 ( 3.409 2.333 5.347) 6.757 12.513 ( -0.063 -0.889 -11.412) 11.447 12.513 ( -0.063 -0.889 11.412) 11.447 12.599 ( 1.121 2.106 -4.158) 4.794 12.599 ( 1.121 2.106 4.158) 4.794 12.810 ( -5.873 -2.320 -3.801) 7.370 12.810 ( -5.873 -2.320 3.801) 7.370 13.110 ( 4.529 0.123 -8.270) 9.430 13.110 ( 4.529 0.123 8.270) 9.430 13.166 ( 2.267 -2.176 -1.834) 3.639 13.166 ( 2.267 -2.176 1.834) 3.639 13.281 ( -3.125 1.951 -12.939) 13.453 13.281 ( -3.125 1.951 12.939) 13.453 13.614 ( 16.010 -0.665 -9.464) 18.610 13.614 ( 16.010 -0.665 9.464) 18.610 13.986 ( 6.569 1.170 -5.910) 8.913 13.986 ( 6.569 1.170 5.910) 8.913 14.185 ( -0.966 0.216 -6.807) 6.879 14.185 ( -0.966 0.216 6.807) 6.879 14.560 ( -5.316 -0.728 -23.109) 23.723 14.560 ( -5.316 -0.728 23.109) 23.723 14.762 ( 0.024 -0.530 -11.784) 11.796 14.762 ( 0.024 -0.530 11.784) 11.796 15.129 ( 4.206 0.434 -5.813) 7.188 15.129 ( 4.206 0.434 5.813) 7.188 15.243 ( -3.453 -0.056 -5.938) 6.869 15.243 ( -3.453 -0.056 5.938) 6.869 15.864 ( 2.288 1.131 -4.733) 5.377 15.864 ( 2.288 1.131 4.733) 5.377 16.031 ( -9.322 2.086 -3.858) 10.302 16.031 ( -9.322 2.086 3.858) 10.302 16.257 ( 2.480 0.672 -3.830) 4.612 16.257 ( 2.480 0.672 3.830) 4.612 16.673 ( -15.759 -0.463 -2.440) 15.953 16.673 ( -15.759 -0.463 2.440) 15.953 17.014 ( -8.165 -0.337 -6.393) 10.376 17.014 ( -8.165 -0.337 6.393) 10.376 17.678 ( 5.792 -0.169 -8.317) 10.136 17.678 ( 5.792 -0.169 8.317) 10.136 17.706 ( -0.681 -1.057 -12.859) 12.920 17.706 ( -0.681 -1.057 12.859) 12.920 17.921 ( -1.581 0.379 -4.729) 5.001 17.921 ( -1.581 0.379 4.729) 5.001 18.053 ( -6.479 -1.130 -0.985) 6.650 18.053 ( -6.479 -1.130 0.985) 6.650 18.300 ( 12.687 1.260 -3.615) 13.252 18.300 ( 12.687 1.260 3.615) 13.252 18.457 ( 3.633 0.801 -1.035) 3.862 18.457 ( 3.633 0.801 1.035) 3.862 18.598 ( 1.241 0.660 -2.162) 2.579 18.598 ( 1.241 0.660 2.162) 2.579 18.795 ( -3.220 -0.337 -3.723) 4.934 18.795 ( -3.220 -0.337 3.723) 4.934 18.967 ( 5.014 0.708 -2.252) 5.542 18.967 ( 5.014 0.708 2.252) 5.542 19.570 ( 5.649 0.582 -4.289) 7.116 19.570 ( 5.649 0.582 4.289) 7.116 19.807 ( 16.548 0.804 -10.771) 19.761 19.807 ( 16.548 0.804 10.771) 19.761 20.075 ( -6.889 0.277 -1.847) 7.137 20.075 ( -6.889 0.277 1.847) 7.137 20.358 ( -5.741 -1.210 -3.931) 7.062 20.358 ( -5.741 -1.210 3.931) 7.062 20.492 ( -1.026 -0.591 -0.834) 1.448 20.492 ( -1.026 -0.591 0.834) 1.448 20.800 ( -8.577 -0.514 -0.742) 8.625 20.800 ( -8.577 -0.514 0.742) 8.625 20.814 ( 3.760 -0.857 -2.746) 4.734 20.814 ( 3.760 -0.857 2.746) 4.734 21.030 ( -2.686 -0.876 -3.423) 4.439 21.030 ( -2.686 -0.876 3.423) 4.439 21.220 ( -5.844 -1.345 -4.994) 7.804 21.220 ( -5.844 -1.345 4.994) 7.804 22.005 ( 9.912 0.088 -2.931) 10.336 22.005 ( 9.912 0.088 2.931) 10.336 22.462 ( -5.066 -0.125 -4.538) 6.802 22.462 ( -5.066 -0.125 4.538) 6.802 22.733 ( -4.401 0.858 -9.216) 10.249 22.733 ( -4.401 0.858 9.216) 10.249 22.900 ( 4.513 -0.316 -4.376) 6.294 22.900 ( 4.513 -0.316 4.376) 6.294 23.211 ( 5.746 2.237 -1.302) 6.302 23.211 ( 5.746 2.237 1.302) 6.302 23.566 ( -10.070 -0.492 -11.355) 15.185 23.566 ( -10.070 -0.492 11.355) 15.185 23.634 ( -0.879 0.672 -7.486) 7.567 23.634 ( -0.879 0.672 7.486) 7.567 23.916 ( -0.606 1.402 -0.779) 1.715 23.916 ( -0.606 1.402 0.779) 1.715 24.015 ( -9.500 0.209 -2.780) 9.901 24.015 ( -9.500 0.209 2.780) 9.901 24.498 ( 9.766 1.089 -7.448) 12.330 24.498 ( 9.766 1.089 7.448) 12.330 24.869 ( 16.974 -1.365 -2.427) 17.201 24.869 ( 16.974 -1.365 2.427) 17.201 25.080 ( -9.181 1.777 -9.545) 13.363 25.080 ( -9.181 1.777 9.545) 13.363 25.358 ( 15.846 -1.662 -9.354) 18.476 25.358 ( 15.846 -1.662 9.354) 18.476 25.673 ( 2.817 -0.147 -4.726) 5.504 25.673 ( 2.817 -0.147 4.726) 5.504 25.916 ( 17.027 -0.294 -14.312) 22.245 25.916 ( 17.027 -0.294 14.312) 22.245 26.500 ( 1.021 -0.191 -0.844) 1.338 26.500 ( 1.021 -0.191 0.844) 1.338 26.734 ( -12.517 -2.091 -18.731) 22.625 26.734 ( -12.517 -2.091 18.731) 22.625 27.195 ( -37.844 -6.828 -6.988) 39.085 27.195 ( -37.844 -6.828 6.988) 39.085 27.911 ( 5.759 -0.698 -9.541) 11.166 27.911 ( 5.759 -0.698 9.541) 11.166 28.171 ( 2.872 -4.111 -7.364) 8.909 28.171 ( 2.872 -4.111 7.364) 8.909 28.369 ( -10.365 -2.269 -2.344) 10.866 28.369 ( -10.365 -2.269 2.344) 10.866 28.752 ( 13.809 -2.823 -3.192) 14.452 28.752 ( 13.809 -2.823 3.192) 14.452 29.125 ( -5.559 -0.775 -3.201) 6.462 29.125 ( -5.559 -0.775 3.201) 6.462 29.387 ( -2.775 -2.534 -2.990) 4.802 29.387 ( -2.775 -2.534 2.990) 4.802 29.814 ( 13.290 -2.217 -1.547) 13.562 29.814 ( 13.290 -2.217 1.547) 13.562 30.524 ( -1.938 -3.095 -3.415) 5.000 30.524 ( -1.938 -3.095 3.415) 5.000 30.613 ( 0.506 -2.272 -2.661) 3.536 30.613 ( 0.506 -2.272 2.661) 3.536 30.707 ( 2.369 -1.606 -3.507) 4.527 30.707 ( 2.369 -1.606 3.507) 4.527 30.999 ( -9.507 -3.513 -4.878) 11.248 30.999 ( -9.507 -3.513 4.878) 11.248 31.157 ( 4.403 -1.364 -9.224) 10.312 31.157 ( 4.403 -1.364 9.224) 10.312 31.495 ( 1.550 -2.539 -1.659) 3.406 31.495 ( 1.550 -2.539 1.659) 3.406 31.613 ( 2.576 -3.003 -6.092) 7.265 31.613 ( 2.576 -3.003 6.092) 7.265 32.056 ( 1.264 -1.820 -3.978) 4.553 32.056 ( 1.264 -1.820 3.978) 4.553 32.669 ( -16.274 -4.052 -11.493) 20.331 32.669 ( -16.274 -4.052 11.493) 20.331 33.149 ( 1.844 -3.352 -7.729) 8.624 33.149 ( 1.844 -3.352 7.729) 8.624 33.518 ( 4.236 -1.017 -1.638) 4.654 33.518 ( 4.236 -1.017 1.638) 4.654 34.475 ( 19.443 -5.771 -12.589) 23.871 34.475 ( 19.443 -5.771 12.589) 23.871 35.868 ( -14.575 -12.722 -28.518) 34.460 35.868 ( -14.575 -12.722 28.518) 34.460 ======================= Grid point 154 (51/54) ======================= q-point: (-0.50 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 50 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.286 ( 0.000 4.463 -6.073) 7.537 2.286 ( 0.000 4.463 6.073) 7.537 2.526 ( 0.000 7.000 -2.695) 7.501 2.526 ( 0.000 7.000 2.695) 7.501 2.754 ( 0.000 5.303 -0.024) 5.303 2.754 ( 0.000 5.303 0.024) 5.303 2.868 ( 0.000 6.139 -4.836) 7.814 2.868 ( -0.000 6.139 4.836) 7.815 3.082 ( 0.000 1.355 -1.478) 2.005 3.082 ( -0.000 1.355 1.478) 2.005 3.246 ( -0.000 2.513 -1.494) 2.924 3.246 ( 0.000 2.513 1.494) 2.924 3.291 ( 0.000 4.674 -3.013) 5.561 3.291 ( 0.000 4.674 3.013) 5.561 3.346 ( 0.000 0.357 -0.125) 0.378 3.346 ( 0.000 0.357 0.125) 0.378 3.502 ( 0.000 6.302 -0.881) 6.363 3.502 ( 0.000 6.302 0.881) 6.363 3.588 ( 0.000 2.578 -3.019) 3.969 3.588 ( 0.000 2.578 3.019) 3.969 3.779 ( -0.000 -1.253 -4.943) 5.099 3.779 ( 0.000 -1.253 4.943) 5.099 3.948 ( 0.000 -3.409 -3.666) 5.006 3.948 ( 0.000 -3.409 3.666) 5.006 4.128 ( -0.000 6.735 -0.471) 6.752 4.128 ( -0.000 6.735 0.471) 6.752 4.371 ( 0.000 -2.709 -1.138) 2.939 4.371 ( 0.000 -2.709 1.138) 2.939 4.439 ( 0.000 1.565 -6.220) 6.414 4.439 ( -0.000 1.565 6.220) 6.414 4.525 ( -0.000 -4.520 -4.437) 6.334 4.525 ( 0.000 -4.520 4.437) 6.334 5.299 ( 0.000 -2.795 -2.850) 3.992 5.299 ( 0.000 -2.795 2.850) 3.992 5.567 ( -0.000 -3.401 -2.326) 4.120 5.567 ( -0.000 -3.401 2.326) 4.120 6.133 ( 0.000 -7.443 -0.549) 7.463 6.133 ( 0.000 -7.443 0.549) 7.463 6.515 ( 0.000 -2.458 -3.492) 4.271 6.515 ( -0.000 -2.458 3.492) 4.271 6.851 ( -0.000 -1.661 -0.218) 1.675 6.851 ( 0.000 -1.661 0.218) 1.675 6.980 ( 0.000 -4.300 -2.660) 5.057 6.980 ( 0.000 -4.300 2.660) 5.057 7.177 ( -0.000 -4.067 -1.365) 4.290 7.177 ( -0.000 -4.067 1.365) 4.290 7.416 ( 0.000 -2.224 -4.383) 4.914 7.416 ( 0.000 -2.224 4.383) 4.914 7.531 ( 0.000 -0.806 -1.824) 1.994 7.531 ( 0.000 -0.806 1.824) 1.994 7.894 ( 0.000 -0.247 -4.439) 4.446 7.894 ( 0.000 -0.247 4.439) 4.446 8.021 ( 0.000 -6.888 -2.392) 7.292 8.021 ( 0.000 -6.888 2.392) 7.292 8.327 ( 0.000 4.101 -11.132) 11.863 8.327 ( 0.000 4.101 11.132) 11.863 8.523 ( 0.000 -0.180 -8.150) 8.152 8.523 ( 0.000 -0.180 8.150) 8.152 8.720 ( 0.000 0.733 -1.889) 2.026 8.720 ( 0.000 0.733 1.889) 2.026 8.878 ( -0.000 -3.483 -0.230) 3.491 8.878 ( -0.000 -3.483 0.230) 3.491 9.018 ( 0.000 -2.691 -3.414) 4.347 9.018 ( 0.000 -2.691 3.414) 4.347 9.567 ( 0.000 -0.058 -3.657) 3.658 9.567 ( 0.000 -0.058 3.657) 3.658 9.751 ( 0.000 1.112 -1.632) 1.975 9.751 ( 0.000 1.112 1.632) 1.975 9.939 ( -0.000 -1.514 -4.198) 4.463 9.939 ( -0.000 -1.514 4.198) 4.463 10.104 ( 0.000 -1.251 -0.746) 1.457 10.104 ( 0.000 -1.251 0.746) 1.457 10.531 ( 0.000 -3.802 -5.584) 6.756 10.531 ( 0.000 -3.802 5.585) 6.756 10.698 ( -0.000 -1.923 -0.759) 2.067 10.698 ( -0.000 -1.923 0.759) 2.067 10.781 ( 0.000 -1.561 -0.602) 1.673 10.781 ( 0.000 -1.561 0.602) 1.673 11.177 ( 0.000 -1.688 -3.549) 3.930 11.177 ( 0.000 -1.688 3.549) 3.930 11.430 ( 0.000 -0.373 -3.805) 3.824 11.430 ( 0.000 -0.373 3.805) 3.824 11.568 ( -0.000 -3.732 -3.492) 5.110 11.568 ( -0.000 -3.732 3.492) 5.110 12.040 ( 0.000 1.727 -5.326) 5.599 12.040 ( 0.000 1.727 5.326) 5.599 12.253 ( 0.000 1.070 -2.448) 2.672 12.253 ( 0.000 1.070 2.448) 2.672 12.341 ( 0.000 -1.636 -7.271) 7.452 12.341 ( 0.000 -1.636 7.271) 7.452 12.375 ( -0.000 0.128 -2.387) 2.390 12.375 ( -0.000 0.128 2.387) 2.390 12.498 ( 0.000 -1.895 -4.879) 5.234 12.498 ( 0.000 -1.895 4.879) 5.234 12.616 ( 0.000 -0.615 -3.008) 3.071 12.616 ( -0.000 -0.615 3.008) 3.071 12.775 ( -0.000 -0.485 -3.222) 3.258 12.775 ( 0.000 -0.485 3.222) 3.258 13.115 ( -0.000 0.876 -2.471) 2.621 13.115 ( 0.000 0.876 2.471) 2.621 13.248 ( 0.000 2.378 -0.908) 2.545 13.248 ( -0.000 2.378 0.908) 2.545 13.265 ( 0.000 -0.743 -4.152) 4.218 13.265 ( -0.000 -0.743 4.152) 4.218 13.782 ( 0.000 0.121 -1.814) 1.818 13.782 ( 0.000 0.121 1.814) 1.818 13.981 ( -0.000 0.525 -1.952) 2.021 13.981 ( 0.000 0.525 1.952) 2.021 14.248 ( 0.000 -2.287 -1.966) 3.016 14.248 ( 0.000 -2.287 1.966) 3.016 14.507 ( -0.000 -0.292 -2.340) 2.358 14.507 ( -0.000 -0.292 2.340) 2.358 14.781 ( 0.000 0.220 -7.971) 7.974 14.781 ( -0.000 0.220 7.971) 7.974 15.073 ( -0.000 -0.623 -3.252) 3.311 15.073 ( 0.000 -0.623 3.252) 3.311 15.315 ( -0.000 0.914 -0.449) 1.018 15.315 ( 0.000 0.914 0.449) 1.018 15.841 ( 0.000 1.867 -6.187) 6.463 15.841 ( 0.000 1.867 6.187) 6.463 16.024 ( 0.000 1.920 -1.993) 2.768 16.024 ( 0.000 1.920 1.993) 2.768 16.127 ( -0.000 -0.067 -5.513) 5.513 16.127 ( -0.000 -0.067 5.513) 5.513 16.559 ( 0.000 -0.192 -0.976) 0.995 16.559 ( 0.000 -0.192 0.976) 0.995 16.915 ( 0.000 -0.181 -1.150) 1.164 16.915 ( 0.000 -0.181 1.150) 1.164 17.679 ( 0.000 -1.643 -7.133) 7.320 17.679 ( 0.000 -1.643 7.133) 7.320 17.788 ( 0.000 -0.357 -1.585) 1.625 17.788 ( -0.000 -0.357 1.585) 1.625 17.876 ( 0.000 -0.333 -1.936) 1.965 17.876 ( 0.000 -0.333 1.936) 1.965 17.976 ( 0.000 -0.772 -3.969) 4.044 17.976 ( 0.000 -0.772 3.969) 4.044 18.463 ( -0.000 2.414 -2.609) 3.555 18.463 ( -0.000 2.414 2.609) 3.555 18.493 ( 0.000 1.764 -2.662) 3.193 18.493 ( 0.000 1.764 2.662) 3.193 18.613 ( -0.000 0.156 -1.603) 1.611 18.613 ( -0.000 0.156 1.603) 1.611 18.744 ( 0.000 -1.974 -0.749) 2.111 18.744 ( 0.000 -1.974 0.749) 2.111 19.032 ( 0.000 1.194 -3.017) 3.245 19.032 ( 0.000 1.194 3.017) 3.245 19.671 ( 0.000 -0.583 -0.797) 0.987 19.671 ( -0.000 -0.583 0.797) 0.987 19.905 ( 0.000 0.788 -0.139) 0.801 19.905 ( 0.000 0.788 0.139) 0.801 20.175 ( -0.000 2.188 -1.001) 2.407 20.175 ( 0.000 2.188 1.001) 2.407 20.266 ( 0.000 -0.845 -3.527) 3.626 20.266 ( -0.000 -0.845 3.527) 3.626 20.413 ( 0.000 -1.019 -1.158) 1.542 20.413 ( 0.000 -1.019 1.158) 1.542 20.566 ( 0.000 -1.718 -1.207) 2.100 20.566 ( 0.000 -1.718 1.207) 2.100 21.004 ( 0.000 -0.175 -0.756) 0.776 21.004 ( 0.000 -0.175 0.756) 0.776 21.041 ( 0.000 -0.837 -0.351) 0.908 21.041 ( -0.000 -0.837 0.351) 0.908 21.085 ( -0.000 -0.785 -1.524) 1.715 21.085 ( -0.000 -0.785 1.524) 1.715 22.068 ( -0.000 -0.901 -2.603) 2.754 22.068 ( -0.000 -0.901 2.603) 2.754 22.426 ( 0.000 0.749 -1.897) 2.040 22.426 ( 0.000 0.749 1.897) 2.040 22.697 ( 0.000 1.166 -0.469) 1.257 22.697 ( 0.000 1.166 0.469) 1.257 22.977 ( 0.000 -1.413 -0.090) 1.416 22.977 ( -0.000 -1.413 0.090) 1.416 23.273 ( -0.000 2.307 -1.361) 2.679 23.273 ( -0.000 2.307 1.361) 2.679 23.422 ( 0.000 0.187 -1.023) 1.040 23.422 ( 0.000 0.187 1.023) 1.040 23.632 ( 0.000 0.640 -0.057) 0.643 23.632 ( 0.000 0.640 0.057) 0.643 23.899 ( 0.000 -0.329 -2.308) 2.332 23.899 ( 0.000 -0.329 2.308) 2.332 23.919 ( 0.000 1.973 -2.391) 3.100 23.919 ( 0.000 1.973 2.391) 3.100 24.627 ( 0.000 2.109 -0.771) 2.245 24.627 ( 0.000 2.109 0.771) 2.245 24.955 ( 0.000 0.717 -0.345) 0.795 24.955 ( 0.000 0.717 0.345) 0.795 25.015 ( 0.000 0.033 -0.320) 0.322 25.015 ( 0.000 0.033 0.320) 0.322 25.676 ( -0.000 -0.101 -0.075) 0.126 25.676 ( 0.000 -0.101 0.075) 0.126 25.774 ( 0.000 -4.726 -4.839) 6.764 25.774 ( 0.000 -4.726 4.839) 6.764 26.180 ( -0.000 -0.312 -0.764) 0.826 26.180 ( -0.000 -0.312 0.764) 0.826 26.401 ( -0.000 -8.176 -1.671) 8.345 26.401 ( 0.000 -8.176 1.671) 8.345 26.558 ( -0.000 -0.787 -7.537) 7.578 26.558 ( -0.000 -0.787 7.537) 7.578 26.690 ( 0.000 -1.077 -4.605) 4.730 26.690 ( 0.000 -1.077 4.605) 4.730 28.034 ( -0.000 0.156 -8.095) 8.097 28.034 ( -0.000 0.156 8.095) 8.097 28.163 ( 0.000 -2.775 -4.942) 5.668 28.163 ( 0.000 -2.775 4.942) 5.668 28.219 ( 0.000 -4.687 -0.179) 4.690 28.219 ( 0.000 -4.687 0.179) 4.690 28.935 ( 0.000 -0.529 -0.880) 1.027 28.935 ( 0.000 -0.529 0.880) 1.027 29.058 ( -0.000 -1.877 -1.714) 2.542 29.058 ( -0.000 -1.877 1.714) 2.542 29.316 ( 0.000 -3.061 -1.034) 3.230 29.316 ( -0.000 -3.061 1.034) 3.230 30.009 ( 0.000 -1.366 -0.840) 1.604 30.009 ( 0.000 -1.366 0.840) 1.604 30.473 ( -0.000 -3.744 -1.347) 3.979 30.473 ( -0.000 -3.744 1.347) 3.979 30.628 ( 0.000 0.826 -0.496) 0.964 30.628 ( 0.000 0.826 0.496) 0.964 30.748 ( 0.000 -1.896 -0.504) 1.962 30.748 ( 0.000 -1.896 0.504) 1.962 30.861 ( 0.000 -5.786 -0.244) 5.791 30.861 ( -0.000 -5.786 0.244) 5.791 31.225 ( -0.000 -1.479 -2.020) 2.504 31.225 ( -0.000 -1.479 2.020) 2.504 31.523 ( 0.000 -1.927 -2.281) 2.986 31.523 ( 0.000 -1.927 2.281) 2.986 31.623 ( 0.000 -4.516 -5.634) 7.221 31.623 ( 0.000 -4.516 5.634) 7.221 32.080 ( 0.000 -0.009 -3.100) 3.100 32.080 ( -0.000 -0.009 3.100) 3.100 32.484 ( 0.000 -4.877 -3.291) 5.883 32.484 ( 0.000 -4.877 3.291) 5.883 33.163 ( 0.000 -3.231 -2.143) 3.877 33.163 ( 0.000 -3.231 2.143) 3.877 33.557 ( 0.000 -0.759 -1.161) 1.387 33.557 ( 0.000 -0.759 1.161) 1.387 34.758 ( 0.000 -9.987 -7.478) 12.476 34.758 ( 0.000 -9.987 7.478) 12.476 35.644 ( 0.000 -8.413 -4.644) 9.610 35.644 ( -0.000 -8.413 4.644) 9.610 ======================= Grid point 160 (52/54) ======================= q-point: ( 0.00 0.45 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 51 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.392 ( 0.000 2.247 -2.560) 3.406 2.392 ( 0.000 2.247 2.560) 3.406 2.501 ( 0.000 1.377 -6.933) 7.068 2.501 ( 0.000 1.377 6.933) 7.068 2.841 ( 0.000 2.888 -2.953) 4.130 2.841 ( 0.000 2.888 2.953) 4.130 2.963 ( 0.000 -0.014 -1.566) 1.566 2.963 ( 0.000 -0.014 1.566) 1.566 3.006 ( 0.000 -1.045 -3.045) 3.220 3.006 ( 0.000 -1.045 3.045) 3.220 3.283 ( 0.000 -0.313 -1.363) 1.398 3.283 ( 0.000 -0.313 1.363) 1.398 3.388 ( 0.000 3.561 -0.849) 3.661 3.388 ( 0.000 3.561 0.849) 3.661 3.394 ( 0.000 3.480 -1.635) 3.845 3.394 ( 0.000 3.480 1.635) 3.845 3.492 ( 0.000 4.432 -3.202) 5.468 3.492 ( 0.000 4.432 3.202) 5.468 3.568 ( 0.000 0.113 -1.652) 1.656 3.568 ( 0.000 0.113 1.652) 1.656 3.777 ( 0.000 -0.276 -6.572) 6.578 3.777 ( 0.000 -0.276 6.572) 6.578 3.929 ( 0.000 -2.318 -8.260) 8.580 3.929 ( 0.000 -2.318 8.261) 8.580 4.135 ( 0.000 0.305 -7.921) 7.927 4.135 ( 0.000 0.305 7.921) 7.927 4.280 ( 0.000 0.991 -4.990) 5.088 4.280 ( 0.000 0.991 4.990) 5.088 4.429 ( 0.000 1.026 -2.943) 3.116 4.429 ( 0.000 1.026 2.943) 3.116 4.768 ( 0.000 -2.614 -6.188) 6.717 4.768 ( 0.000 -2.614 6.188) 6.717 5.060 ( 0.000 -0.937 -1.848) 2.072 5.060 ( 0.000 -0.937 1.848) 2.072 5.726 ( 0.000 -0.100 -0.953) 0.958 5.726 ( 0.000 -0.100 0.953) 0.958 6.193 ( 0.000 -4.557 -1.274) 4.732 6.193 ( 0.000 -4.557 1.274) 4.732 6.274 ( 0.000 -0.281 -11.552) 11.555 6.274 ( 0.000 -0.281 11.552) 11.555 6.604 ( 0.000 -0.849 -16.314) 16.336 6.604 ( 0.000 -0.849 16.314) 16.337 6.771 ( 0.000 -0.499 -1.460) 1.543 6.771 ( 0.000 -0.499 1.460) 1.543 6.977 ( 0.000 -2.435 -9.624) 9.928 6.977 ( 0.000 -2.435 9.624) 9.928 7.192 ( 0.000 -1.335 -19.281) 19.327 7.192 ( 0.000 -1.335 19.281) 19.327 7.800 ( 0.000 -2.671 -4.060) 4.860 7.800 ( 0.000 -2.671 4.060) 4.860 7.965 ( 0.000 -2.597 -8.687) 9.067 7.965 ( 0.000 -2.597 8.687) 9.067 7.969 ( 0.000 0.928 -12.680) 12.713 7.969 ( 0.000 0.928 12.680) 12.713 8.389 ( 0.000 1.016 -8.039) 8.103 8.389 ( 0.000 1.016 8.039) 8.103 8.521 ( 0.000 -0.609 -5.682) 5.714 8.521 ( 0.000 -0.609 5.682) 5.714 8.602 ( 0.000 -0.841 -7.964) 8.009 8.602 ( 0.000 -0.842 7.964) 8.009 9.008 ( 0.000 0.755 -12.389) 12.412 9.008 ( 0.000 0.755 12.389) 12.412 9.266 ( 0.000 -0.517 -6.723) 6.742 9.266 ( 0.000 -0.517 6.723) 6.742 9.425 ( 0.000 1.130 -3.873) 4.035 9.425 ( 0.000 1.130 3.873) 4.035 9.808 ( 0.000 -0.303 -0.995) 1.040 9.808 ( 0.000 -0.303 0.995) 1.040 10.071 ( 0.000 -0.030 -3.374) 3.374 10.071 ( 0.000 -0.030 3.374) 3.374 10.403 ( 0.000 -1.858 -8.952) 9.143 10.403 ( 0.000 -1.858 8.952) 9.143 10.404 ( 0.000 0.096 -10.000) 10.001 10.404 ( 0.000 0.096 10.000) 10.001 10.789 ( 0.000 -1.507 -9.053) 9.177 10.789 ( 0.000 -1.507 9.053) 9.177 10.830 ( 0.000 -1.332 -12.821) 12.890 10.830 ( 0.000 -1.332 12.821) 12.890 10.948 ( 0.000 -0.979 -11.367) 11.409 10.948 ( 0.000 -0.979 11.367) 11.409 11.224 ( 0.000 -0.050 -3.070) 3.070 11.224 ( 0.000 -0.050 3.070) 3.070 11.671 ( 0.000 -0.221 -13.181) 13.183 11.671 ( 0.000 -0.221 13.181) 13.183 12.053 ( 0.000 -1.140 -6.401) 6.502 12.053 ( 0.000 -1.140 6.401) 6.502 12.065 ( 0.000 -0.638 -8.361) 8.385 12.065 ( 0.000 -0.639 8.361) 8.385 12.259 ( 0.000 0.704 -5.451) 5.496 12.259 ( 0.000 0.704 5.451) 5.496 12.440 ( 0.000 0.743 -4.829) 4.886 12.440 ( 0.000 0.743 4.829) 4.886 12.500 ( 0.000 -0.022 -18.674) 18.674 12.500 ( 0.000 -0.022 18.674) 18.674 12.561 ( 0.000 0.143 -6.915) 6.917 12.561 ( 0.000 0.143 6.915) 6.917 12.956 ( 0.000 -1.698 -5.576) 5.829 12.956 ( 0.000 -1.698 5.576) 5.829 12.986 ( 0.000 3.428 -9.065) 9.691 12.986 ( 0.000 3.428 9.065) 9.691 13.095 ( 0.000 -4.249 -2.011) 4.701 13.095 ( 0.000 -4.249 2.011) 4.701 13.336 ( 0.000 1.329 -10.286) 10.372 13.336 ( 0.000 1.329 10.286) 10.372 13.406 ( 0.000 -0.118 -15.671) 15.672 13.406 ( 0.000 -0.118 15.671) 15.672 13.887 ( 0.000 0.469 -13.178) 13.186 13.887 ( 0.000 0.469 13.178) 13.186 14.266 ( 0.000 1.207 -16.048) 16.094 14.266 ( 0.000 1.207 16.048) 16.094 14.599 ( 0.000 -1.174 -25.524) 25.551 14.599 ( 0.000 -1.174 25.524) 25.551 14.768 ( 0.000 0.398 -19.578) 19.582 14.768 ( 0.000 0.398 19.578) 19.582 15.042 ( 0.000 -0.479 -11.123) 11.133 15.042 ( 0.000 -0.479 11.123) 11.133 15.325 ( 0.000 0.443 -10.861) 10.870 15.325 ( 0.000 0.443 10.861) 10.870 15.960 ( 0.000 0.295 -17.170) 17.172 15.960 ( 0.000 0.295 17.170) 17.172 15.980 ( 0.000 -0.389 -1.678) 1.723 15.980 ( 0.000 -0.389 1.678) 1.723 16.271 ( 0.000 1.005 -11.728) 11.771 16.271 ( 0.000 1.005 11.728) 11.771 16.986 ( 0.000 -0.417 -11.042) 11.050 16.986 ( 0.000 -0.417 11.042) 11.050 17.028 ( 0.000 0.074 -4.828) 4.828 17.028 ( 0.000 0.074 4.828) 4.828 17.597 ( 0.000 0.121 -17.650) 17.651 17.597 ( 0.000 0.121 17.650) 17.651 17.731 ( 0.000 -0.447 -18.677) 18.682 17.731 ( 0.000 -0.447 18.677) 18.682 17.958 ( 0.000 1.274 -5.239) 5.392 17.958 ( 0.000 1.274 5.239) 5.392 18.120 ( 0.000 0.016 -2.098) 2.098 18.120 ( 0.000 0.016 2.098) 2.098 18.132 ( 0.000 -0.978 -7.803) 7.864 18.132 ( 0.000 -0.978 7.803) 7.864 18.401 ( 0.000 0.059 -1.340) 1.342 18.401 ( 0.000 0.059 1.340) 1.342 18.598 ( 0.000 0.383 -0.868) 0.948 18.598 ( 0.000 0.383 0.868) 0.948 18.842 ( 0.000 0.142 -7.894) 7.896 18.842 ( 0.000 0.142 7.894) 7.896 18.905 ( 0.000 0.213 -4.920) 4.925 18.905 ( 0.000 0.213 4.920) 4.925 19.531 ( 0.000 0.476 -4.256) 4.283 19.531 ( 0.000 0.476 4.256) 4.283 19.622 ( 0.000 -0.011 -8.596) 8.596 19.622 ( 0.000 -0.011 8.596) 8.596 20.149 ( 0.000 0.114 -3.203) 3.205 20.149 ( 0.000 0.114 3.203) 3.205 20.417 ( 0.000 -0.525 -4.283) 4.315 20.417 ( 0.000 -0.525 4.283) 4.315 20.495 ( 0.000 -0.484 -6.328) 6.346 20.495 ( 0.000 -0.484 6.328) 6.346 20.712 ( 0.000 0.063 -7.356) 7.356 20.712 ( 0.000 0.063 7.356) 7.356 20.840 ( 0.000 -0.290 -4.601) 4.611 20.840 ( 0.000 -0.290 4.601) 4.611 21.132 ( 0.000 -0.681 -14.051) 14.068 21.132 ( 0.000 -0.681 14.051) 14.068 21.329 ( 0.000 0.071 -3.384) 3.385 21.329 ( 0.000 0.071 3.384) 3.385 21.801 ( 0.000 -0.070 -9.818) 9.818 21.801 ( 0.000 -0.070 9.818) 9.818 22.543 ( 0.000 0.164 -3.502) 3.505 22.543 ( 0.000 0.164 3.502) 3.505 22.824 ( 0.000 0.333 -7.279) 7.287 22.824 ( 0.000 0.333 7.279) 7.287 22.857 ( 0.000 0.084 -13.382) 13.382 22.857 ( 0.000 0.084 13.382) 13.382 23.155 ( 0.000 0.858 -1.022) 1.335 23.155 ( 0.000 0.858 1.022) 1.335 23.626 ( 0.000 0.143 -2.304) 2.308 23.626 ( 0.000 0.143 2.304) 2.308 23.714 ( 0.000 -0.171 -24.047) 24.048 23.714 ( 0.000 -0.171 24.047) 24.048 23.945 ( 0.000 0.705 -0.599) 0.925 23.945 ( 0.000 0.705 0.599) 0.925 24.156 ( 0.000 0.296 -4.452) 4.462 24.156 ( 0.000 0.296 4.452) 4.462 24.451 ( 0.000 0.021 -5.072) 5.072 24.451 ( 0.000 0.021 5.072) 5.072 24.510 ( 0.000 -0.033 -0.981) 0.982 24.510 ( 0.000 -0.033 0.981) 0.982 25.202 ( 0.000 0.662 -17.379) 17.392 25.202 ( 0.000 0.662 17.379) 17.392 25.359 ( 0.000 0.173 -13.786) 13.787 25.359 ( 0.000 0.173 13.786) 13.787 25.486 ( 0.000 0.069 -22.794) 22.794 25.486 ( 0.000 0.069 22.794) 22.794 25.783 ( 0.000 -0.085 -0.541) 0.547 25.783 ( 0.000 -0.085 0.541) 0.547 26.491 ( 0.000 0.002 -1.321) 1.321 26.491 ( 0.000 0.002 1.321) 1.321 26.833 ( 0.000 -0.522 -19.152) 19.159 26.833 ( 0.000 -0.522 19.152) 19.159 27.632 ( 0.000 -1.824 -4.931) 5.258 27.632 ( 0.000 -1.824 4.931) 5.258 27.919 ( 0.000 -0.964 -4.105) 4.216 27.919 ( 0.000 -0.964 4.105) 4.216 27.926 ( 0.000 -1.367 -4.339) 4.549 27.926 ( 0.000 -1.367 4.339) 4.549 28.464 ( 0.000 -2.073 -7.139) 7.434 28.464 ( 0.000 -2.073 7.139) 7.434 28.505 ( 0.000 -0.198 -2.873) 2.880 28.505 ( 0.000 -0.198 2.873) 2.880 29.268 ( 0.000 -0.453 -9.248) 9.259 29.268 ( 0.000 -0.453 9.248) 9.259 29.288 ( 0.000 -0.098 -17.775) 17.775 29.288 ( 0.000 -0.098 17.775) 17.775 29.643 ( 0.000 -1.106 -7.799) 7.877 29.643 ( 0.000 -1.106 7.799) 7.877 30.453 ( 0.000 -1.865 -3.040) 3.567 30.453 ( 0.000 -1.865 3.040) 3.567 30.614 ( 0.000 -0.570 -9.069) 9.087 30.614 ( 0.000 -0.570 9.069) 9.087 30.649 ( 0.000 -0.282 -3.060) 3.073 30.649 ( 0.000 -0.282 3.060) 3.073 31.071 ( 0.000 -0.235 -11.704) 11.706 31.071 ( 0.000 -0.235 11.704) 11.706 31.100 ( 0.000 -1.170 -6.597) 6.700 31.100 ( 0.000 -1.170 6.597) 6.700 31.457 ( 0.000 -1.112 -1.071) 1.544 31.457 ( 0.000 -1.112 1.071) 1.544 31.522 ( 0.000 -0.542 -13.623) 13.634 31.522 ( 0.000 -0.542 13.623) 13.634 32.010 ( 0.000 -0.845 -4.136) 4.222 32.010 ( 0.000 -0.845 4.136) 4.222 32.885 ( 0.000 -1.753 -14.930) 15.032 32.885 ( 0.000 -1.753 14.930) 15.032 33.014 ( 0.000 -1.811 -15.934) 16.037 33.014 ( 0.000 -1.811 15.934) 16.037 33.422 ( 0.000 -0.519 -3.227) 3.269 33.422 ( 0.000 -0.519 3.227) 3.269 34.202 ( 0.000 -1.653 -7.969) 8.138 34.202 ( 0.000 -1.653 7.969) 8.138 35.800 ( 0.000 -6.347 -27.108) 27.841 35.800 ( 0.000 -6.347 27.108) 27.841 ======================= Grid point 162 (53/54) ======================= q-point: ( 0.25 0.45 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.393 ( 0.656 4.735 -2.504) 5.397 2.393 ( 0.656 4.735 2.504) 5.397 2.524 ( 1.297 -1.515 -3.597) 4.113 2.524 ( 1.297 -1.515 3.597) 4.113 2.839 ( 0.704 3.124 -3.026) 4.406 2.839 ( 0.704 3.124 3.026) 4.406 2.981 ( -1.482 0.327 -2.660) 3.063 2.981 ( -1.482 0.327 2.660) 3.063 3.027 ( 3.324 -1.110 -1.566) 3.838 3.027 ( 3.324 -1.110 1.566) 3.838 3.281 ( -0.863 -0.078 -0.216) 0.893 3.281 ( -0.863 -0.078 0.216) 0.893 3.368 ( -1.012 5.306 -0.890) 5.474 3.368 ( -1.012 5.306 0.890) 5.474 3.424 ( 2.012 3.570 -2.335) 4.717 3.424 ( 2.012 3.570 2.335) 4.717 3.536 ( 4.331 2.928 -1.478) 5.432 3.536 ( 4.331 2.928 1.478) 5.432 3.590 ( 2.311 0.781 -2.322) 3.368 3.590 ( 2.311 0.781 2.322) 3.368 3.737 ( -2.387 -2.712 -4.924) 6.108 3.737 ( -2.387 -2.712 4.924) 6.108 3.970 ( 0.667 -0.391 -4.662) 4.726 3.970 ( 0.667 -0.391 4.662) 4.726 4.081 ( -0.076 -1.058 -1.734) 2.032 4.081 ( -0.076 -1.058 1.734) 2.032 4.359 ( 4.553 2.606 -4.615) 6.988 4.359 ( 4.553 2.606 4.615) 6.988 4.444 ( 0.343 0.229 -4.826) 4.843 4.444 ( 0.343 0.229 4.826) 4.843 4.619 ( -10.987 -1.994 -6.944) 13.150 4.619 ( -10.987 -1.994 6.944) 13.150 5.152 ( 6.881 -1.657 -1.392) 7.213 5.152 ( 6.881 -1.657 1.392) 7.213 5.636 ( -7.639 -0.447 -1.118) 7.734 5.636 ( -7.639 -0.447 1.118) 7.734 6.091 ( -6.023 -3.399 -1.006) 6.989 6.091 ( -6.023 -3.399 1.006) 6.989 6.414 ( 6.217 -0.777 -8.959) 10.933 6.414 ( 6.217 -0.777 8.959) 10.933 6.735 ( 14.391 -1.406 -9.252) 17.166 6.735 ( 14.391 -1.406 9.252) 17.166 6.828 ( 1.875 -2.053 -2.878) 4.002 6.828 ( 1.875 -2.053 2.878) 4.002 7.017 ( 5.245 -0.733 -2.220) 5.742 7.017 ( 5.245 -0.733 2.219) 5.742 7.237 ( 5.475 -1.269 -9.205) 10.785 7.237 ( 5.475 -1.269 9.205) 10.785 7.620 ( -9.842 -0.365 -10.782) 14.602 7.620 ( -9.842 -0.365 10.782) 14.602 7.863 ( -1.460 -3.857 -6.075) 7.343 7.863 ( -1.460 -3.857 6.075) 7.343 8.159 ( -8.053 0.611 -4.313) 9.156 8.159 ( -8.053 0.611 4.313) 9.156 8.311 ( 5.053 0.607 -4.520) 6.807 8.311 ( 5.053 0.607 4.520) 6.807 8.485 ( -2.342 -0.168 -4.535) 5.107 8.485 ( -2.342 -0.168 4.535) 5.107 8.623 ( 4.264 -1.550 -12.517) 13.314 8.623 ( 4.264 -1.550 12.517) 13.314 9.068 ( -1.188 0.910 -1.509) 2.125 9.068 ( -1.187 0.910 1.509) 2.125 9.092 ( -11.944 0.160 -2.955) 12.305 9.092 ( -11.944 0.160 2.955) 12.305 9.527 ( 3.287 -0.403 -3.406) 4.751 9.527 ( 3.287 -0.403 3.406) 4.751 9.856 ( -12.070 -0.100 -3.867) 12.675 9.856 ( -12.070 -0.100 3.867) 12.675 10.006 ( 3.571 -0.056 -3.316) 4.874 10.006 ( 3.571 -0.056 3.316) 4.874 10.033 ( -7.482 -0.987 -4.292) 8.682 10.033 ( -7.482 -0.987 4.292) 8.682 10.451 ( 0.019 -1.040 -0.994) 1.439 10.451 ( 0.019 -1.040 0.994) 1.439 10.669 ( -1.901 -0.770 -1.363) 2.462 10.669 ( -1.901 -0.770 1.363) 2.462 10.850 ( -6.954 -0.609 -11.619) 13.555 10.850 ( -6.954 -0.609 11.619) 13.555 11.138 ( 5.562 -1.084 -2.171) 6.068 11.138 ( 5.562 -1.084 2.171) 6.068 11.293 ( 9.720 -0.417 -3.141) 10.223 11.293 ( 9.720 -0.417 3.141) 10.223 11.601 ( -6.014 -0.892 -11.813) 13.286 11.601 ( -6.014 -0.893 11.813) 13.286 12.050 ( 1.724 -0.084 -2.432) 2.983 12.050 ( 1.724 -0.084 2.432) 2.983 12.173 ( 5.517 0.337 -2.772) 6.183 12.173 ( 5.517 0.337 2.772) 6.183 12.252 ( 1.502 -0.740 -4.419) 4.725 12.252 ( 1.502 -0.740 4.419) 4.725 12.443 ( 0.727 0.965 -8.407) 8.493 12.443 ( 0.727 0.965 8.407) 8.493 12.498 ( 0.159 -0.537 -7.743) 7.763 12.498 ( 0.159 -0.537 7.743) 7.763 12.634 ( 0.777 1.097 -0.505) 1.436 12.634 ( 0.777 1.097 0.505) 1.436 12.770 ( -6.846 -1.287 -7.547) 10.271 12.770 ( -6.846 -1.287 7.547) 10.271 13.107 ( 5.821 -0.097 -5.886) 8.279 13.107 ( 5.821 -0.097 5.886) 8.279 13.137 ( 4.158 -0.816 -5.300) 6.786 13.137 ( 4.158 -0.816 5.300) 6.786 13.312 ( -4.018 0.877 -13.049) 13.682 13.312 ( -4.018 0.877 13.049) 13.682 13.602 ( 16.823 -0.351 -10.451) 19.809 13.602 ( 16.823 -0.351 10.451) 19.809 14.000 ( 7.494 0.289 -6.302) 9.796 14.000 ( 7.494 0.289 6.302) 9.796 14.194 ( -5.544 0.371 -4.865) 7.385 14.194 ( -5.544 0.371 4.865) 7.385 14.547 ( -3.317 -0.391 -25.205) 25.425 14.547 ( -3.317 -0.391 25.205) 25.425 14.756 ( -0.688 -0.094 -11.593) 11.614 14.756 ( -0.688 -0.094 11.593) 11.614 15.135 ( 6.642 0.171 -7.096) 9.721 15.135 ( 6.642 0.171 7.096) 9.721 15.241 ( -5.738 -0.099 -8.264) 10.061 15.241 ( -5.738 -0.099 8.264) 10.061 15.877 ( 3.328 0.284 -3.454) 4.805 15.877 ( 3.328 0.284 3.454) 4.805 16.059 ( -9.149 0.720 -3.835) 9.946 16.059 ( -9.149 0.720 3.835) 9.946 16.265 ( 2.054 0.194 -3.870) 4.386 16.265 ( 2.054 0.194 3.870) 4.386 16.666 ( -15.967 -0.183 -2.782) 16.209 16.666 ( -15.967 -0.183 2.782) 16.209 17.010 ( -7.970 -0.090 -4.814) 9.311 17.010 ( -7.970 -0.090 4.814) 9.311 17.677 ( 5.284 0.087 -8.610) 10.103 17.677 ( 5.284 0.087 8.610) 10.103 17.689 ( -0.721 -0.529 -9.417) 9.460 17.689 ( -0.721 -0.529 9.417) 9.460 17.926 ( -2.880 0.131 -3.294) 4.378 17.926 ( -2.880 0.131 3.294) 4.378 18.038 ( -6.471 -0.400 -2.125) 6.822 18.038 ( -6.471 -0.400 2.125) 6.822 18.318 ( 14.169 0.498 -3.848) 14.690 18.318 ( 14.169 0.498 3.848) 14.690 18.468 ( 4.558 0.244 -0.317) 4.576 18.468 ( 4.558 0.244 0.317) 4.576 18.606 ( 0.399 0.137 -0.938) 1.028 18.606 ( 0.399 0.137 0.938) 1.028 18.792 ( -4.238 -0.026 -3.232) 5.330 18.792 ( -4.238 -0.026 3.232) 5.330 18.977 ( 5.404 0.255 -0.791) 5.467 18.977 ( 5.404 0.255 0.791) 5.467 19.577 ( 4.878 0.200 -4.018) 6.323 19.577 ( 4.878 0.200 4.018) 6.323 19.818 ( 17.033 0.280 -10.767) 20.152 19.818 ( 17.033 0.280 10.767) 20.152 20.078 ( -6.783 0.077 -0.981) 6.854 20.078 ( -6.783 0.077 0.981) 6.854 20.342 ( -5.241 -0.400 -1.441) 5.450 20.342 ( -5.241 -0.400 1.441) 5.450 20.484 ( -0.661 -0.165 -0.252) 0.727 20.484 ( -0.661 -0.165 0.252) 0.727 20.789 ( -14.255 -0.367 -2.720) 14.517 20.789 ( -14.255 -0.367 2.720) 14.517 20.807 ( 9.593 -0.092 -0.198) 9.595 20.807 ( 9.593 -0.092 0.198) 9.595 21.018 ( -3.099 -0.289 -3.661) 4.805 21.018 ( -3.099 -0.289 3.661) 4.805 21.204 ( -5.572 -0.368 -4.956) 7.466 21.204 ( -5.572 -0.368 4.956) 7.466 22.008 ( 9.755 0.107 -2.884) 10.173 22.008 ( 9.755 0.107 2.884) 10.173 22.462 ( -4.945 0.023 -3.022) 5.796 22.462 ( -4.945 0.023 3.022) 5.796 22.747 ( -4.157 0.405 -7.906) 8.942 22.747 ( -4.157 0.405 7.906) 8.942 22.897 ( 3.742 -0.080 -3.716) 5.274 22.897 ( 3.742 -0.080 3.716) 5.274 23.244 ( 5.881 0.936 -0.887) 6.020 23.244 ( 5.881 0.936 0.887) 6.020 23.561 ( -9.549 -0.093 -11.445) 14.905 23.561 ( -9.549 -0.093 11.445) 14.905 23.645 ( -0.779 0.330 -8.534) 8.576 23.645 ( -0.779 0.330 8.534) 8.576 23.937 ( -1.105 0.573 -1.541) 1.981 23.937 ( -1.105 0.573 1.541) 1.981 24.021 ( -9.049 0.261 -2.681) 9.441 24.021 ( -9.049 0.261 2.681) 9.441 24.514 ( 10.622 0.436 -7.644) 13.094 24.514 ( 10.622 0.436 7.645) 13.094 24.851 ( 17.042 -0.441 -1.666) 17.129 24.851 ( 17.042 -0.441 1.666) 17.129 25.107 ( -9.176 0.787 -10.706) 14.122 25.107 ( -9.176 0.787 10.706) 14.122 25.338 ( 13.026 -0.436 -11.343) 17.278 25.338 ( 13.026 -0.436 11.343) 17.278 25.671 ( 2.634 -0.055 -4.691) 5.380 25.671 ( 2.634 -0.055 4.691) 5.380 25.912 ( 16.822 -0.100 -14.341) 22.106 25.912 ( 16.822 -0.100 14.341) 22.106 26.497 ( 0.506 -0.087 -0.618) 0.804 26.497 ( 0.506 -0.087 0.618) 0.804 26.703 ( -14.422 -0.851 -17.129) 22.408 26.703 ( -14.422 -0.851 17.129) 22.408 27.106 ( -36.028 -2.166 -6.150) 36.613 27.106 ( -36.028 -2.166 6.150) 36.613 27.902 ( 6.114 -0.211 -9.498) 11.298 27.902 ( 6.114 -0.211 9.498) 11.298 28.115 ( 2.960 -1.453 -7.248) 7.963 28.115 ( 2.960 -1.453 7.248) 7.963 28.339 ( -10.659 -0.804 -2.802) 11.050 28.339 ( -10.659 -0.804 2.802) 11.050 28.713 ( 15.387 -1.011 -3.395) 15.789 28.713 ( 15.387 -1.011 3.395) 15.789 29.114 ( -5.924 -0.279 -2.589) 6.472 29.114 ( -5.924 -0.279 2.589) 6.472 29.353 ( -3.649 -0.832 -1.990) 4.239 29.353 ( -3.649 -0.832 1.990) 4.239 29.786 ( 14.145 -0.685 -1.120) 14.206 29.786 ( 14.145 -0.685 1.120) 14.206 30.477 ( -0.751 -1.330 -3.050) 3.411 30.477 ( -0.751 -1.330 3.050) 3.411 30.585 ( 1.324 -0.672 -4.276) 4.526 30.585 ( 1.324 -0.672 4.276) 4.526 30.689 ( 1.648 -0.402 -4.418) 4.732 30.689 ( 1.648 -0.402 4.418) 4.732 30.953 ( -10.769 -1.160 -4.227) 11.627 30.953 ( -10.769 -1.160 4.227) 11.627 31.138 ( 4.486 -0.461 -9.346) 10.377 31.138 ( 4.486 -0.461 9.346) 10.377 31.461 ( 1.978 -0.889 -1.128) 2.444 31.461 ( 1.978 -0.889 1.128) 2.444 31.570 ( 1.147 -1.114 -6.472) 6.666 31.570 ( 1.147 -1.114 6.472) 6.666 32.035 ( 2.802 -0.428 -4.444) 5.271 32.035 ( 2.802 -0.428 4.444) 5.271 32.608 ( -16.639 -1.769 -11.956) 20.565 32.608 ( -16.639 -1.769 11.956) 20.565 33.097 ( 2.186 -1.514 -8.099) 8.524 33.097 ( 2.186 -1.514 8.099) 8.524 33.501 ( 4.482 -0.560 -0.657) 4.564 33.501 ( 4.482 -0.560 0.657) 4.564 34.381 ( 15.704 -2.831 -9.470) 18.555 34.381 ( 15.704 -2.831 9.470) 18.555 35.675 ( -11.184 -5.422 -22.352) 25.575 35.675 ( -11.184 -5.422 22.352) 25.575 ======================= Grid point 164 (54/54) ======================= q-point: (-0.50 0.45 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 50 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.404 ( 0.000 6.904 -1.407) 7.046 2.404 ( 0.000 6.904 1.407) 7.046 2.539 ( 0.000 -4.189 -1.777) 4.551 2.539 ( 0.000 -4.189 1.778) 4.551 2.868 ( 0.000 4.101 -1.135) 4.255 2.868 ( 0.000 4.101 1.135) 4.255 2.935 ( -0.000 0.804 -3.877) 3.959 2.935 ( -0.000 0.804 3.877) 3.959 3.071 ( -0.000 -1.140 -0.585) 1.281 3.071 ( -0.000 -1.140 0.585) 1.281 3.263 ( 0.000 -0.123 -0.259) 0.286 3.263 ( 0.000 -0.123 0.259) 0.286 3.355 ( 0.000 4.152 -0.802) 4.228 3.355 ( 0.000 4.152 0.802) 4.229 3.445 ( 0.000 3.916 -0.437) 3.940 3.445 ( 0.000 3.915 0.437) 3.940 3.610 ( -0.000 3.636 -0.285) 3.647 3.610 ( -0.000 3.636 0.285) 3.647 3.634 ( 0.000 2.066 -0.836) 2.229 3.634 ( 0.000 2.066 0.836) 2.229 3.709 ( -0.000 -4.641 -2.081) 5.087 3.709 ( -0.000 -4.641 2.081) 5.087 3.918 ( 0.000 -0.306 -0.615) 0.687 3.918 ( 0.000 -0.306 0.615) 0.687 4.188 ( -0.000 0.375 -3.302) 3.323 4.188 ( -0.000 0.375 3.302) 3.323 4.333 ( 0.000 -1.690 -0.435) 1.745 4.333 ( 0.000 -1.690 0.435) 1.745 4.435 ( 0.000 0.291 -1.335) 1.366 4.435 ( 0.000 0.291 1.335) 1.366 4.518 ( 0.000 1.051 -4.088) 4.221 4.518 ( 0.000 1.051 4.088) 4.221 5.252 ( 0.000 -1.513 -0.866) 1.744 5.252 ( 0.000 -1.513 0.866) 1.744 5.521 ( -0.000 -1.139 -0.880) 1.440 5.521 ( -0.000 -1.139 0.880) 1.440 6.021 ( 0.000 -3.193 -0.301) 3.207 6.021 ( 0.000 -3.193 0.301) 3.207 6.479 ( 0.000 -0.955 -1.086) 1.446 6.479 ( 0.000 -0.955 1.086) 1.446 6.783 ( -0.000 -3.277 -0.200) 3.283 6.783 ( -0.000 -3.277 0.200) 3.283 6.952 ( 0.000 0.598 -1.753) 1.853 6.952 ( 0.000 0.598 1.753) 1.853 7.115 ( -0.000 -1.951 -1.597) 2.522 7.115 ( -0.000 -1.951 1.597) 2.522 7.388 ( 0.000 -0.660 -1.545) 1.680 7.388 ( 0.000 -0.660 1.545) 1.680 7.521 ( 0.000 -0.187 -0.535) 0.567 7.521 ( 0.000 -0.187 0.535) 0.567 7.865 ( 0.000 -2.429 -4.860) 5.434 7.865 ( 0.000 -2.429 4.860) 5.434 7.928 ( 0.000 -1.426 -4.114) 4.355 7.928 ( 0.000 -1.426 4.114) 4.355 8.412 ( 0.000 4.275 -12.632) 13.335 8.412 ( 0.000 4.275 12.632) 13.335 8.489 ( 0.000 -3.122 -11.137) 11.566 8.489 ( 0.000 -3.122 11.137) 11.566 8.732 ( 0.000 0.667 -2.852) 2.929 8.732 ( 0.000 0.667 2.852) 2.929 8.819 ( -0.000 -2.093 -2.253) 3.075 8.819 ( -0.000 -2.093 2.253) 3.075 8.982 ( 0.000 -0.892 -1.490) 1.737 8.982 ( 0.000 -0.892 1.490) 1.737 9.580 ( 0.000 0.670 -1.378) 1.533 9.580 ( 0.000 0.670 1.378) 1.533 9.771 ( 0.000 0.635 -0.391) 0.746 9.771 ( 0.000 0.635 0.391) 0.746 9.914 ( -0.000 -0.733 -1.332) 1.520 9.914 ( -0.000 -0.733 1.332) 1.520 10.088 ( 0.000 -0.402 -0.279) 0.490 10.088 ( 0.000 -0.402 0.279) 0.490 10.480 ( 0.000 -1.209 -2.271) 2.573 10.480 ( 0.000 -1.209 2.271) 2.573 10.659 ( -0.000 -1.331 -1.682) 2.145 10.659 ( -0.000 -1.331 1.682) 2.145 10.767 ( 0.000 -0.185 -1.176) 1.190 10.767 ( 0.000 -0.185 1.176) 1.190 11.153 ( 0.000 -0.631 -1.650) 1.767 11.153 ( 0.000 -0.631 1.650) 1.767 11.441 ( 0.000 1.369 -2.626) 2.962 11.441 ( 0.000 1.369 2.626) 2.961 11.498 ( -0.000 -2.998 -2.547) 3.934 11.498 ( -0.000 -2.998 2.547) 3.934 12.074 ( 0.000 1.184 -2.262) 2.553 12.074 ( 0.000 1.184 2.262) 2.553 12.275 ( 0.000 0.891 -2.248) 2.418 12.275 ( -0.000 0.891 2.248) 2.418 12.318 ( -0.000 -0.575 -2.794) 2.853 12.318 ( -0.000 -0.575 2.794) 2.853 12.363 ( -0.000 -1.019 -2.435) 2.639 12.363 ( -0.000 -1.019 2.435) 2.639 12.479 ( 0.000 -0.094 -2.111) 2.113 12.479 ( 0.000 -0.094 2.111) 2.113 12.593 ( -0.000 -1.136 -1.882) 2.198 12.593 ( -0.000 -1.136 1.882) 2.198 12.771 ( 0.000 0.016 -1.033) 1.033 12.771 ( 0.000 0.016 1.033) 1.033 13.134 ( -0.000 0.733 -1.398) 1.579 13.134 ( -0.000 0.733 1.398) 1.579 13.223 ( 0.000 -1.072 -0.066) 1.074 13.223 ( 0.000 -1.072 0.066) 1.074 13.310 ( 0.000 1.485 -1.354) 2.010 13.310 ( -0.000 1.485 1.354) 2.010 13.781 ( 0.000 -0.108 -0.658) 0.667 13.781 ( 0.000 -0.108 0.658) 0.667 13.988 ( -0.000 0.146 -0.935) 0.946 13.988 ( -0.000 0.146 0.935) 0.946 14.217 ( 0.000 -0.784 -0.872) 1.173 14.217 ( 0.000 -0.784 0.872) 1.173 14.502 ( -0.000 -0.143 -0.963) 0.974 14.502 ( -0.000 -0.143 0.963) 0.974 14.788 ( 0.000 0.277 -3.439) 3.451 14.788 ( -0.000 0.277 3.439) 3.451 15.061 ( -0.000 -0.432 -1.580) 1.638 15.061 ( 0.000 -0.432 1.580) 1.638 15.328 ( -0.000 0.327 -0.177) 0.372 15.328 ( -0.000 0.327 0.177) 0.372 15.864 ( 0.000 0.526 -1.858) 1.931 15.864 ( 0.000 0.526 1.858) 1.931 16.055 ( 0.000 1.005 -2.365) 2.569 16.055 ( 0.000 1.005 2.365) 2.569 16.122 ( -0.000 -0.288 -3.233) 3.245 16.122 ( -0.000 -0.288 3.233) 3.245 16.555 ( 0.000 -0.141 -0.249) 0.286 16.555 ( 0.000 -0.141 0.249) 0.286 16.913 ( 0.000 -0.057 -0.374) 0.379 16.913 ( 0.000 -0.057 0.374) 0.379 17.655 ( -0.000 -0.631 -2.585) 2.661 17.655 ( -0.000 -0.631 2.585) 2.661 17.783 ( 0.000 -0.117 -0.495) 0.508 17.783 ( 0.000 -0.117 0.495) 0.508 17.872 ( 0.000 -0.098 -0.682) 0.689 17.872 ( 0.000 -0.098 0.682) 0.689 17.965 ( 0.000 -0.275 -1.344) 1.372 17.965 ( 0.000 -0.275 1.344) 1.372 18.497 ( -0.000 0.820 -0.768) 1.124 18.497 ( 0.000 0.820 0.768) 1.124 18.523 ( -0.000 1.131 -0.021) 1.132 18.523 ( -0.000 1.131 0.021) 1.132 18.608 ( 0.000 -0.451 -1.538) 1.603 18.608 ( 0.000 -0.451 1.538) 1.603 18.717 ( 0.000 -0.616 -0.148) 0.634 18.717 ( 0.000 -0.616 0.148) 0.634 19.049 ( 0.000 0.411 -1.057) 1.134 19.049 ( 0.000 0.411 1.057) 1.134 19.663 ( 0.000 -0.198 -0.358) 0.409 19.663 ( -0.000 -0.198 0.358) 0.409 19.917 ( 0.000 0.308 -0.076) 0.317 19.917 ( 0.000 0.308 0.076) 0.317 20.215 ( -0.000 1.737 -0.969) 1.989 20.215 ( 0.000 1.737 0.969) 1.989 20.246 ( 0.000 -1.212 -1.908) 2.260 20.246 ( -0.000 -1.213 1.908) 2.260 20.399 ( 0.000 -0.408 -0.470) 0.623 20.399 ( 0.000 -0.408 0.470) 0.623 20.544 ( -0.000 -0.536 -0.418) 0.680 20.544 ( 0.000 -0.536 0.418) 0.680 21.003 ( 0.000 -0.012 -0.549) 0.549 21.003 ( 0.000 -0.012 0.549) 0.549 21.031 ( 0.000 -0.189 -0.477) 0.513 21.031 ( 0.000 -0.189 0.477) 0.513 21.073 ( -0.000 -0.384 -0.898) 0.976 21.073 ( -0.000 -0.384 0.897) 0.976 22.057 ( -0.000 -0.233 -0.898) 0.927 22.057 ( -0.000 -0.233 0.898) 0.927 22.439 ( 0.000 0.369 -0.638) 0.738 22.439 ( 0.000 0.369 0.638) 0.737 22.716 ( 0.000 0.522 -0.159) 0.546 22.716 ( 0.000 0.522 0.159) 0.546 22.957 ( 0.000 -0.514 -0.033) 0.515 22.957 ( -0.000 -0.514 0.033) 0.516 23.307 ( -0.000 0.941 -0.535) 1.082 23.307 ( -0.000 0.941 0.535) 1.082 23.425 ( -0.000 0.106 -0.295) 0.314 23.425 ( 0.000 0.106 0.295) 0.314 23.644 ( 0.000 0.386 -0.055) 0.390 23.644 ( 0.000 0.386 0.055) 0.390 23.895 ( 0.000 -0.077 -0.700) 0.704 23.895 ( 0.000 -0.077 0.700) 0.704 23.950 ( 0.000 0.904 -0.688) 1.136 23.950 ( 0.000 0.904 0.688) 1.136 24.658 ( 0.000 0.885 -0.233) 0.915 24.658 ( 0.000 0.885 0.233) 0.915 24.952 ( 0.000 -0.362 -0.558) 0.665 24.952 ( 0.000 -0.362 0.558) 0.665 25.029 ( 0.000 0.668 -0.282) 0.725 25.029 ( 0.000 0.668 0.282) 0.725 25.674 ( -0.000 -0.056 -0.343) 0.347 25.674 ( 0.000 -0.056 0.343) 0.347 25.714 ( 0.000 -1.425 -1.915) 2.387 25.714 ( 0.000 -1.425 1.915) 2.387 26.177 ( -0.000 0.011 -0.708) 0.708 26.177 ( -0.000 0.011 0.708) 0.708 26.292 ( -0.000 -2.789 -0.067) 2.790 26.292 ( -0.000 -2.789 0.067) 2.790 26.549 ( -0.000 -0.205 -2.609) 2.617 26.549 ( -0.000 -0.205 2.609) 2.617 26.676 ( 0.000 -0.339 -1.508) 1.546 26.676 ( 0.000 -0.339 1.508) 1.546 28.048 ( -0.000 1.131 -6.590) 6.687 28.048 ( -0.000 1.131 6.590) 6.687 28.105 ( 0.000 -2.566 -6.314) 6.815 28.105 ( 0.000 -2.566 6.314) 6.815 28.167 ( 0.000 -1.035 -0.857) 1.344 28.167 ( 0.000 -1.035 0.857) 1.344 28.930 ( 0.000 -0.056 -0.313) 0.318 28.930 ( 0.000 -0.056 0.313) 0.318 29.028 ( -0.000 -0.902 -0.553) 1.058 29.028 ( -0.000 -0.902 0.553) 1.058 29.277 ( 0.000 -0.968 -0.416) 1.053 29.277 ( 0.000 -0.968 0.416) 1.053 29.990 ( 0.000 -0.463 -0.270) 0.537 29.990 ( 0.000 -0.463 0.270) 0.537 30.422 ( -0.000 -1.306 -0.369) 1.357 30.422 ( -0.000 -1.306 0.369) 1.357 30.651 ( 0.000 1.273 -0.196) 1.288 30.651 ( 0.000 1.273 0.196) 1.288 30.710 ( 0.000 -1.784 -0.200) 1.795 30.710 ( 0.000 -1.784 0.200) 1.795 30.786 ( 0.000 -1.756 -0.050) 1.757 30.786 ( -0.000 -1.756 0.050) 1.757 31.205 ( -0.000 -0.480 -0.771) 0.908 31.205 ( -0.000 -0.480 0.771) 0.908 31.503 ( -0.000 -0.135 -1.904) 1.909 31.503 ( -0.000 -0.135 1.904) 1.909 31.552 ( 0.000 -2.258 -3.020) 3.771 31.552 ( 0.000 -2.258 3.020) 3.771 32.088 ( -0.000 0.462 -1.771) 1.831 32.088 ( -0.000 0.462 1.771) 1.831 32.408 ( 0.000 -2.261 -1.822) 2.903 32.408 ( 0.000 -2.261 1.822) 2.903 33.114 ( 0.000 -1.411 -0.644) 1.551 33.114 ( 0.000 -1.411 0.644) 1.551 33.543 ( 0.000 -0.449 -0.364) 0.578 33.543 ( 0.000 -0.449 0.364) 0.578 34.603 ( 0.000 -4.451 -2.155) 4.945 34.603 ( 0.000 -4.451 2.155) 4.945 35.509 ( 0.000 -3.964 -1.220) 4.148 35.509 ( -0.000 -3.964 1.220) 4.148 =================== 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 3/42240 10.0 3203.972 2194.245 3745.602 0.000 0.000 0.000 3/42240 20.0 520.864 256.363 613.352 0.000 0.000 0.000 3/42240 30.0 191.905 107.592 232.733 0.000 0.000 0.000 3/42240 40.0 102.005 61.357 124.935 0.000 0.000 -0.000 3/42240 50.0 64.814 40.078 79.274 0.000 0.000 -0.000 3/42240 60.0 45.645 28.525 55.547 0.000 0.000 -0.000 3/42240 70.0 34.364 21.550 41.590 0.000 0.000 -0.000 3/42240 80.0 27.120 17.010 32.665 0.000 0.000 -0.000 3/42240 90.0 22.171 13.883 26.600 0.000 0.000 -0.000 3/42240 100.0 18.628 11.634 22.283 0.000 0.000 -0.000 3/42240 110.0 15.995 9.957 19.091 0.000 0.000 -0.000 3/42240 120.0 13.978 8.669 16.657 0.000 0.000 -0.000 3/42240 130.0 12.393 7.657 14.752 0.000 0.000 -0.000 3/42240 140.0 11.120 6.843 13.228 0.000 0.000 -0.000 3/42240 150.0 10.078 6.178 11.984 0.000 0.000 -0.000 3/42240 160.0 9.213 5.625 10.953 0.000 0.000 -0.000 3/42240 170.0 8.483 5.160 10.085 0.000 0.000 -0.000 3/42240 180.0 7.860 4.763 9.346 0.000 0.000 -0.000 3/42240 190.0 7.323 4.422 8.709 0.000 0.000 0.000 3/42240 200.0 6.855 4.126 8.154 0.000 0.000 0.000 3/42240 210.0 6.445 3.866 7.668 0.000 0.000 0.000 3/42240 220.0 6.083 3.637 7.238 0.000 0.000 0.000 3/42240 230.0 5.760 3.434 6.855 0.000 0.000 0.000 3/42240 240.0 5.471 3.252 6.512 0.000 0.000 0.000 3/42240 250.0 5.211 3.089 6.203 0.000 0.000 0.000 3/42240 260.0 4.976 2.942 5.924 0.000 0.000 0.000 3/42240 270.0 4.762 2.809 5.669 0.000 0.000 0.000 3/42240 280.0 4.567 2.688 5.437 0.000 0.000 0.000 3/42240 290.0 4.389 2.577 5.224 0.000 0.000 0.000 3/42240 300.0 4.224 2.475 5.028 0.000 0.000 0.000 3/42240 310.0 4.073 2.382 4.847 0.000 0.000 0.000 3/42240 320.0 3.933 2.296 4.679 0.000 0.000 0.000 3/42240 330.0 3.803 2.216 4.524 0.000 0.000 0.000 3/42240 340.0 3.682 2.142 4.378 0.000 0.000 0.000 3/42240 350.0 3.568 2.073 4.243 0.000 0.000 0.000 3/42240 360.0 3.463 2.009 4.116 0.000 0.000 0.000 3/42240 370.0 3.364 1.949 3.997 0.000 0.000 0.000 3/42240 380.0 3.270 1.892 3.886 0.000 0.000 0.000 3/42240 390.0 3.183 1.840 3.780 0.000 0.000 0.000 3/42240 400.0 3.100 1.790 3.681 0.000 0.000 0.000 3/42240 410.0 3.022 1.743 3.587 0.000 0.000 0.000 3/42240 420.0 2.948 1.699 3.498 0.000 0.000 0.000 3/42240 430.0 2.877 1.657 3.414 0.000 0.000 0.000 3/42240 440.0 2.811 1.617 3.334 0.000 0.000 0.000 3/42240 450.0 2.747 1.579 3.257 0.000 0.000 0.000 3/42240 460.0 2.687 1.543 3.185 0.000 0.000 0.000 3/42240 470.0 2.629 1.509 3.115 0.000 0.000 0.000 3/42240 480.0 2.574 1.477 3.049 0.000 0.000 0.000 3/42240 490.0 2.521 1.446 2.986 0.000 0.000 0.000 3/42240 500.0 2.471 1.416 2.926 0.000 0.000 0.000 3/42240 510.0 2.422 1.388 2.868 0.000 0.000 0.000 3/42240 520.0 2.376 1.361 2.812 0.000 0.000 0.000 3/42240 530.0 2.332 1.335 2.759 0.000 0.000 0.000 3/42240 540.0 2.289 1.310 2.707 0.000 0.000 0.000 3/42240 550.0 2.248 1.286 2.658 0.000 0.000 0.000 3/42240 560.0 2.208 1.263 2.610 0.000 0.000 0.000 3/42240 570.0 2.170 1.240 2.565 0.000 0.000 0.000 3/42240 580.0 2.133 1.219 2.521 0.000 0.000 0.000 3/42240 590.0 2.097 1.198 2.478 0.000 0.000 0.000 3/42240 600.0 2.063 1.178 2.437 0.000 0.000 0.000 3/42240 610.0 2.030 1.159 2.397 0.000 0.000 0.000 3/42240 620.0 1.998 1.141 2.359 0.000 0.000 0.000 3/42240 630.0 1.967 1.123 2.322 0.000 0.000 0.000 3/42240 640.0 1.937 1.105 2.286 0.000 0.000 0.000 3/42240 650.0 1.907 1.089 2.251 0.000 0.000 0.000 3/42240 660.0 1.879 1.072 2.217 0.000 0.000 0.000 3/42240 670.0 1.852 1.057 2.185 0.000 0.000 0.000 3/42240 680.0 1.825 1.041 2.153 0.000 0.000 0.000 3/42240 690.0 1.799 1.026 2.122 0.000 0.000 0.000 3/42240 700.0 1.774 1.012 2.092 0.000 0.000 0.000 3/42240 710.0 1.750 0.998 2.063 0.000 0.000 0.000 3/42240 720.0 1.726 0.984 2.035 0.000 0.000 0.000 3/42240 730.0 1.703 0.971 2.008 0.000 0.000 0.000 3/42240 740.0 1.681 0.958 1.981 0.000 0.000 0.000 3/42240 750.0 1.659 0.946 1.955 0.000 0.000 0.000 3/42240 760.0 1.638 0.934 1.930 0.000 0.000 0.000 3/42240 770.0 1.617 0.922 1.905 0.000 0.000 0.000 3/42240 780.0 1.597 0.910 1.881 0.000 0.000 0.000 3/42240 790.0 1.577 0.899 1.858 0.000 0.000 0.000 3/42240 800.0 1.558 0.888 1.835 0.000 0.000 0.000 3/42240 810.0 1.539 0.877 1.813 0.000 0.000 0.000 3/42240 820.0 1.521 0.867 1.791 0.000 0.000 0.000 3/42240 830.0 1.503 0.857 1.770 0.000 0.000 0.000 3/42240 840.0 1.486 0.847 1.749 0.000 0.000 0.000 3/42240 850.0 1.469 0.837 1.729 0.000 0.000 0.000 3/42240 860.0 1.452 0.828 1.709 0.000 0.000 0.000 3/42240 870.0 1.436 0.818 1.690 0.000 0.000 0.000 3/42240 880.0 1.420 0.809 1.671 0.000 0.000 0.000 3/42240 890.0 1.404 0.800 1.653 0.000 0.000 0.000 3/42240 900.0 1.389 0.792 1.635 0.000 0.000 0.000 3/42240 910.0 1.374 0.783 1.617 0.000 0.000 0.000 3/42240 920.0 1.360 0.775 1.600 0.000 0.000 0.000 3/42240 930.0 1.346 0.767 1.583 0.000 0.000 0.000 3/42240 940.0 1.332 0.759 1.566 0.000 0.000 0.000 3/42240 950.0 1.318 0.751 1.550 0.000 0.000 0.000 3/42240 960.0 1.305 0.744 1.534 0.000 0.000 0.000 3/42240 970.0 1.292 0.736 1.519 0.000 0.000 0.000 3/42240 980.0 1.279 0.729 1.504 0.000 0.000 0.000 3/42240 990.0 1.266 0.722 1.489 0.000 0.000 0.000 3/42240 1000.0 1.254 0.715 1.474 0.000 0.000 0.000 3/42240 Thermal conductivity related properties were written into "kappa-m4114.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 15:17:31]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|