----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 08:48:04]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 32 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.300464675045524 -6.568316664999999 0.000000000000000 b 3.300464675045524 6.568316664999999 0.000000000000000 c -3.200550757026873 0.000000000000000 4.962974079845401 Atomic positions (fractional): *1 O 0.35813822794064 0.23125556866664 0.79326202355183 15.999 2 O 0.76874443133336 0.64186177205936 0.70673797644817 15.999 3 O 0.64186177205936 0.76874443133336 0.20673797644817 15.999 4 O 0.23125556866664 0.35813822794064 0.29326202355183 15.999 *5 O 0.08309489496407 0.45926748191126 0.79167875326799 15.999 6 O 0.45926748191126 0.08309489496407 0.29167875326799 15.999 7 O 0.91690510503593 0.54073251808874 0.20832124673201 15.999 8 O 0.54073251808874 0.91690510503593 0.70832124673201 15.999 *9 Na 0.18043101496314 0.81956898503686 0.75000000000000 22.990 *10 Na 0.94414023926234 0.05585976073766 0.75000000000000 22.990 11 Na 0.81956898503686 0.18043101496314 0.25000000000000 22.990 12 Na 0.05585976073766 0.94414023926234 0.25000000000000 22.990 *13 Y 0.56714922265896 0.43285077734104 0.25000000000000 88.906 14 Y 0.43285077734104 0.56714922265896 0.75000000000000 88.906 *15 Y 0.30679601468349 0.69320398531651 0.25000000000000 88.906 16 Y 0.69320398531651 0.30679601468349 0.75000000000000 88.906 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.600929350091048 0.000000000000000 0.000000000000000 b 0.000000000000000 13.136633329999999 0.000000000000000 c -3.200550757026873 0.000000000000000 4.962974079845401 Atomic positions (fractional): *1 O 0.29469689830364 0.93655867036300 0.79326202355183 15.999 > 1 2 O 0.70530310169636 0.93655867036300 0.70673797644817 15.999 > 2 3 O 0.20530310169636 0.56344132963700 0.20673797644817 15.999 > 3 4 O 0.79469689830364 0.56344132963700 0.29326202355183 15.999 > 4 *5 O 0.77118118843766 0.68808629347360 0.79167875326799 15.999 > 5 6 O 0.27118118843766 0.81191370652640 0.29167875326799 15.999 > 6 7 O 0.72881881156234 0.81191370652640 0.20832124673201 15.999 > 7 8 O 0.22881881156234 0.68808629347360 0.70832124673201 15.999 > 8 9 O 0.79469689830364 0.43655867036300 0.79326202355183 15.999 > 1 10 O 0.20530310169636 0.43655867036300 0.70673797644817 15.999 > 2 11 O 0.70530310169636 0.06344132963700 0.20673797644817 15.999 > 3 12 O 0.29469689830364 0.06344132963700 0.29326202355183 15.999 > 4 13 O 0.27118118843766 0.18808629347360 0.79167875326799 15.999 > 5 14 O 0.77118118843766 0.31191370652640 0.29167875326799 15.999 > 6 15 O 0.22881881156234 0.31191370652640 0.20832124673201 15.999 > 7 16 O 0.72881881156234 0.18808629347360 0.70832124673201 15.999 > 8 *17 Na 0.00000000000000 0.81956898503686 0.75000000000000 22.990 > 9 *18 Na 0.50000000000000 0.55585976073766 0.75000000000000 22.990 > 10 19 Na 0.50000000000000 0.68043101496314 0.25000000000000 22.990 > 11 20 Na 0.00000000000000 0.94414023926234 0.25000000000000 22.990 > 12 21 Na 0.50000000000000 0.31956898503686 0.75000000000000 22.990 > 9 22 Na 0.00000000000000 0.05585976073766 0.75000000000000 22.990 > 10 23 Na 0.00000000000000 0.18043101496314 0.25000000000000 22.990 > 11 24 Na 0.50000000000000 0.44414023926234 0.25000000000000 22.990 > 12 *25 Y 0.50000000000000 0.93285077734104 0.25000000000000 88.906 > 13 26 Y 0.00000000000000 0.56714922265896 0.75000000000000 88.906 > 14 *27 Y 0.00000000000000 0.69320398531651 0.25000000000000 88.906 > 15 28 Y 0.50000000000000 0.80679601468349 0.75000000000000 88.906 > 16 29 Y 0.00000000000000 0.43285077734104 0.25000000000000 88.906 > 13 30 Y 0.50000000000000 0.06714922265896 0.75000000000000 88.906 > 14 31 Y 0.50000000000000 0.19320398531651 0.25000000000000 88.906 > 15 32 Y 0.00000000000000 0.30679601468349 0.75000000000000 88.906 > 16 -------------------------------- super cell -------------------------------- Lattice vectors: a 13.201858700182097 0.000000000000000 0.000000000000000 b 0.000000000000000 13.136633329999999 0.000000000000000 c -6.401101514053746 0.000000000000000 9.925948159690803 Atomic positions (fractional): *1 O 0.14734844915182 0.93655867036300 0.39663101177592 15.999 > 1 2 O 0.64734844915182 0.93655867036300 0.39663101177592 15.999 > 1 3 O 0.14734844915182 0.93655867036300 0.89663101177592 15.999 > 1 4 O 0.64734844915182 0.93655867036300 0.89663101177592 15.999 > 1 5 O 0.35265155084818 0.93655867036300 0.35336898822408 15.999 > 2 6 O 0.85265155084818 0.93655867036300 0.35336898822408 15.999 > 2 7 O 0.35265155084818 0.93655867036300 0.85336898822408 15.999 > 2 8 O 0.85265155084818 0.93655867036300 0.85336898822408 15.999 > 2 9 O 0.10265155084818 0.56344132963700 0.10336898822408 15.999 > 3 10 O 0.60265155084818 0.56344132963700 0.10336898822408 15.999 > 3 11 O 0.10265155084818 0.56344132963700 0.60336898822408 15.999 > 3 12 O 0.60265155084818 0.56344132963700 0.60336898822408 15.999 > 3 13 O 0.39734844915182 0.56344132963700 0.14663101177592 15.999 > 4 14 O 0.89734844915182 0.56344132963700 0.14663101177592 15.999 > 4 15 O 0.39734844915182 0.56344132963700 0.64663101177592 15.999 > 4 16 O 0.89734844915182 0.56344132963700 0.64663101177592 15.999 > 4 *17 O 0.38559059421883 0.68808629347360 0.39583937663399 15.999 > 5 18 O 0.88559059421883 0.68808629347360 0.39583937663399 15.999 > 5 19 O 0.38559059421883 0.68808629347360 0.89583937663399 15.999 > 5 20 O 0.88559059421883 0.68808629347360 0.89583937663399 15.999 > 5 21 O 0.13559059421883 0.81191370652640 0.14583937663399 15.999 > 6 22 O 0.63559059421883 0.81191370652640 0.14583937663399 15.999 > 6 23 O 0.13559059421883 0.81191370652640 0.64583937663399 15.999 > 6 24 O 0.63559059421883 0.81191370652640 0.64583937663399 15.999 > 6 25 O 0.36440940578117 0.81191370652640 0.10416062336600 15.999 > 7 26 O 0.86440940578117 0.81191370652640 0.10416062336600 15.999 > 7 27 O 0.36440940578117 0.81191370652640 0.60416062336600 15.999 > 7 28 O 0.86440940578117 0.81191370652640 0.60416062336600 15.999 > 7 29 O 0.11440940578117 0.68808629347360 0.35416062336601 15.999 > 8 30 O 0.61440940578117 0.68808629347360 0.35416062336601 15.999 > 8 31 O 0.11440940578117 0.68808629347360 0.85416062336601 15.999 > 8 32 O 0.61440940578117 0.68808629347360 0.85416062336601 15.999 > 8 33 O 0.39734844915182 0.43655867036300 0.39663101177592 15.999 > 1 34 O 0.89734844915182 0.43655867036300 0.39663101177592 15.999 > 1 35 O 0.39734844915182 0.43655867036300 0.89663101177592 15.999 > 1 36 O 0.89734844915182 0.43655867036300 0.89663101177592 15.999 > 1 37 O 0.10265155084818 0.43655867036300 0.35336898822408 15.999 > 2 38 O 0.60265155084818 0.43655867036300 0.35336898822408 15.999 > 2 39 O 0.10265155084818 0.43655867036300 0.85336898822408 15.999 > 2 40 O 0.60265155084818 0.43655867036300 0.85336898822408 15.999 > 2 41 O 0.35265155084818 0.06344132963700 0.10336898822408 15.999 > 3 42 O 0.85265155084818 0.06344132963700 0.10336898822408 15.999 > 3 43 O 0.35265155084818 0.06344132963700 0.60336898822408 15.999 > 3 44 O 0.85265155084818 0.06344132963700 0.60336898822408 15.999 > 3 45 O 0.14734844915182 0.06344132963700 0.14663101177592 15.999 > 4 46 O 0.64734844915182 0.06344132963700 0.14663101177592 15.999 > 4 47 O 0.14734844915182 0.06344132963700 0.64663101177592 15.999 > 4 48 O 0.64734844915182 0.06344132963700 0.64663101177592 15.999 > 4 49 O 0.13559059421883 0.18808629347360 0.39583937663399 15.999 > 5 50 O 0.63559059421883 0.18808629347360 0.39583937663399 15.999 > 5 51 O 0.13559059421883 0.18808629347360 0.89583937663399 15.999 > 5 52 O 0.63559059421883 0.18808629347360 0.89583937663399 15.999 > 5 53 O 0.38559059421883 0.31191370652640 0.14583937663399 15.999 > 6 54 O 0.88559059421883 0.31191370652640 0.14583937663399 15.999 > 6 55 O 0.38559059421883 0.31191370652640 0.64583937663399 15.999 > 6 56 O 0.88559059421883 0.31191370652640 0.64583937663399 15.999 > 6 57 O 0.11440940578117 0.31191370652640 0.10416062336600 15.999 > 7 58 O 0.61440940578117 0.31191370652640 0.10416062336600 15.999 > 7 59 O 0.11440940578117 0.31191370652640 0.60416062336600 15.999 > 7 60 O 0.61440940578117 0.31191370652640 0.60416062336600 15.999 > 7 61 O 0.36440940578117 0.18808629347360 0.35416062336601 15.999 > 8 62 O 0.86440940578117 0.18808629347360 0.35416062336601 15.999 > 8 63 O 0.36440940578117 0.18808629347360 0.85416062336601 15.999 > 8 64 O 0.86440940578117 0.18808629347360 0.85416062336601 15.999 > 8 *65 Na 0.00000000000000 0.81956898503686 0.37500000000000 22.990 > 9 66 Na 0.50000000000000 0.81956898503686 0.37500000000000 22.990 > 9 67 Na 0.00000000000000 0.81956898503686 0.87500000000000 22.990 > 9 68 Na 0.50000000000000 0.81956898503686 0.87500000000000 22.990 > 9 *69 Na 0.25000000000000 0.55585976073766 0.37500000000000 22.990 > 10 70 Na 0.75000000000000 0.55585976073766 0.37500000000000 22.990 > 10 71 Na 0.25000000000000 0.55585976073766 0.87500000000000 22.990 > 10 72 Na 0.75000000000000 0.55585976073766 0.87500000000000 22.990 > 10 73 Na 0.25000000000000 0.68043101496314 0.12500000000000 22.990 > 11 74 Na 0.75000000000000 0.68043101496314 0.12500000000000 22.990 > 11 75 Na 0.25000000000000 0.68043101496314 0.62500000000000 22.990 > 11 76 Na 0.75000000000000 0.68043101496314 0.62500000000000 22.990 > 11 77 Na 0.00000000000000 0.94414023926234 0.12500000000000 22.990 > 12 78 Na 0.50000000000000 0.94414023926234 0.12500000000000 22.990 > 12 79 Na 0.00000000000000 0.94414023926234 0.62500000000000 22.990 > 12 80 Na 0.50000000000000 0.94414023926234 0.62500000000000 22.990 > 12 81 Na 0.25000000000000 0.31956898503686 0.37500000000000 22.990 > 9 82 Na 0.75000000000000 0.31956898503686 0.37500000000000 22.990 > 9 83 Na 0.25000000000000 0.31956898503686 0.87500000000000 22.990 > 9 84 Na 0.75000000000000 0.31956898503686 0.87500000000000 22.990 > 9 85 Na 0.00000000000000 0.05585976073766 0.37500000000000 22.990 > 10 86 Na 0.50000000000000 0.05585976073766 0.37500000000000 22.990 > 10 87 Na 0.00000000000000 0.05585976073766 0.87500000000000 22.990 > 10 88 Na 0.50000000000000 0.05585976073766 0.87500000000000 22.990 > 10 89 Na 0.00000000000000 0.18043101496314 0.12500000000000 22.990 > 11 90 Na 0.50000000000000 0.18043101496314 0.12500000000000 22.990 > 11 91 Na 0.00000000000000 0.18043101496314 0.62500000000000 22.990 > 11 92 Na 0.50000000000000 0.18043101496314 0.62500000000000 22.990 > 11 93 Na 0.25000000000000 0.44414023926234 0.12500000000000 22.990 > 12 94 Na 0.75000000000000 0.44414023926234 0.12500000000000 22.990 > 12 95 Na 0.25000000000000 0.44414023926234 0.62500000000000 22.990 > 12 96 Na 0.75000000000000 0.44414023926234 0.62500000000000 22.990 > 12 *97 Y 0.25000000000000 0.93285077734104 0.12500000000000 88.906 > 13 98 Y 0.75000000000000 0.93285077734104 0.12500000000000 88.906 > 13 99 Y 0.25000000000000 0.93285077734104 0.62500000000000 88.906 > 13 100 Y 0.75000000000000 0.93285077734104 0.62500000000000 88.906 > 13 101 Y 0.00000000000000 0.56714922265896 0.37500000000000 88.906 > 14 102 Y 0.50000000000000 0.56714922265896 0.37500000000000 88.906 > 14 103 Y 0.00000000000000 0.56714922265896 0.87500000000000 88.906 > 14 104 Y 0.50000000000000 0.56714922265896 0.87500000000000 88.906 > 14 *105 Y 0.00000000000000 0.69320398531651 0.12500000000000 88.906 > 15 106 Y 0.50000000000000 0.69320398531651 0.12500000000000 88.906 > 15 107 Y 0.00000000000000 0.69320398531651 0.62500000000000 88.906 > 15 108 Y 0.50000000000000 0.69320398531651 0.62500000000000 88.906 > 15 109 Y 0.25000000000000 0.80679601468349 0.37500000000000 88.906 > 16 110 Y 0.75000000000000 0.80679601468349 0.37500000000000 88.906 > 16 111 Y 0.25000000000000 0.80679601468349 0.87500000000000 88.906 > 16 112 Y 0.75000000000000 0.80679601468349 0.87500000000000 88.906 > 16 113 Y 0.00000000000000 0.43285077734104 0.12500000000000 88.906 > 13 114 Y 0.50000000000000 0.43285077734104 0.12500000000000 88.906 > 13 115 Y 0.00000000000000 0.43285077734104 0.62500000000000 88.906 > 13 116 Y 0.50000000000000 0.43285077734104 0.62500000000000 88.906 > 13 117 Y 0.25000000000000 0.06714922265896 0.37500000000000 88.906 > 14 118 Y 0.75000000000000 0.06714922265896 0.37500000000000 88.906 > 14 119 Y 0.25000000000000 0.06714922265896 0.87500000000000 88.906 > 14 120 Y 0.75000000000000 0.06714922265896 0.87500000000000 88.906 > 14 121 Y 0.25000000000000 0.19320398531651 0.12500000000000 88.906 > 15 122 Y 0.75000000000000 0.19320398531651 0.12500000000000 88.906 > 15 123 Y 0.25000000000000 0.19320398531651 0.62500000000000 88.906 > 15 124 Y 0.75000000000000 0.19320398531651 0.62500000000000 88.906 > 15 125 Y 0.00000000000000 0.30679601468349 0.37500000000000 88.906 > 16 126 Y 0.50000000000000 0.30679601468349 0.37500000000000 88.906 > 16 127 Y 0.00000000000000 0.30679601468349 0.87500000000000 88.906 > 16 128 Y 0.50000000000000 0.30679601468349 0.87500000000000 88.906 > 16 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.5804558 0.0000000 -0.1759332 0.0000000 3.8030237 0.0000000 -0.1759324 0.0000000 3.7726993 -------------------------- Born effective charges -------------------------- 1 O -2.0896639 0.0005013 0.3334439 0.0036019 -2.5098229 -0.0052687 0.3032686 0.0125959 -2.3513378 2 O -2.0896639 -0.0005013 0.3334439 -0.0036019 -2.5098229 0.0052687 0.3032686 -0.0125959 -2.3513378 3 O -2.0896639 0.0005013 0.3334439 0.0036019 -2.5098229 -0.0052687 0.3032686 0.0125959 -2.3513378 4 O -2.0896639 -0.0005013 0.3334439 -0.0036019 -2.5098229 0.0052687 0.3032686 -0.0125959 -2.3513378 5 O -2.3609931 0.9632728 0.0012190 0.9740207 -2.3722695 0.0150788 0.0372816 -0.0153800 -2.3530918 6 O -2.3609931 -0.9632728 0.0012190 -0.9740207 -2.3722695 -0.0150788 0.0372816 0.0153800 -2.3530918 7 O -2.3609931 0.9632728 0.0012190 0.9740207 -2.3722695 0.0150788 0.0372816 -0.0153800 -2.3530918 8 O -2.3609931 -0.9632728 0.0012190 -0.9740207 -2.3722695 -0.0150788 0.0372816 0.0153800 -2.3530918 9 Na 1.1019673 0.0000000 0.0118835 0.0000000 0.9687103 0.0000000 0.0094870 0.0000000 1.1027837 10 Na 1.1189379 0.0000000 0.1505604 0.0000000 0.9917045 0.0000000 0.1743777 0.0000000 1.0944115 11 Na 1.1019673 0.0000000 0.0118835 0.0000000 0.9687103 0.0000000 0.0094870 0.0000000 1.1027837 12 Na 1.1189379 0.0000000 0.1505604 0.0000000 0.9917045 0.0000000 0.1743777 0.0000000 1.0944115 13 Y 3.3521466 0.0000000 -0.9316292 0.0000000 3.9423391 0.0000000 -0.9126383 0.0000000 3.6508276 14 Y 3.3521466 0.0000000 -0.9316292 0.0000000 3.9423391 0.0000000 -0.9126383 0.0000000 3.6508276 15 Y 3.3282620 0.0000000 0.0998596 0.0000000 3.8614308 0.0000000 0.0476732 0.0000000 3.5608364 16 Y 3.3282620 0.0000000 0.0998596 0.0000000 3.8614308 0.0000000 0.0476732 0.0000000 3.5608364 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 384/384 Permutation basis: 11136/11136 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2440 Number of blocks in projector: 2440 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: 544 Use submatrix version of eigh solver. (1) Block: 544 / 544 (2) Block: 250 / 544 (2) 239 eigenvectors found. (2) Block: 544 / 544 (2) 285 eigenvectors found. (2) Complementary block size: 20 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 533 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 480 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 480 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 312 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 312 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 312 Use standard eigh solver. Tree of FC basis block matrices: - (2440, 2403), data: False |-- (312, 306), data: True |-- (312, 306), data: True |-- (312, 306), data: True |-- (480, 476), data: True |-- (480, 476), data: True |-- (544, 533), data: False |-- (544, 533), data: False |-- (544, 9), data: (544, 20) @ (20, 9) |-- (294, 285), data: True |-- (250, 239), data: True ----- Solver_atoms: 1 -- 128 / 128 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 100 / 480 - Time: 0.933 Solver_block: 200 / 480 - Time: 0.865 Solver_block: 300 / 480 - Time: 0.876 Solver_block: 400 / 480 - Time: 0.879 Solver_block: 480 / 480 - Time: 0.665 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 4.654 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 384/384 Permutation basis: 11136/11136 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2440 Number of blocks in projector: 2440 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: 544 Use submatrix version of eigh solver. (1) Block: 544 / 544 (2) Block: 250 / 544 (2) 239 eigenvectors found. (2) Block: 544 / 544 (2) 285 eigenvectors found. (2) Complementary block size: 20 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 533 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 480 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 480 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 312 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 312 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 312 Use standard eigh solver. Tree of FC basis block matrices: - (2440, 2403), data: False |-- (312, 306), data: True |-- (312, 306), data: True |-- (312, 306), data: True |-- (480, 476), data: True |-- (480, 476), data: True |-- (544, 533), data: False |-- (544, 533), data: False |-- (544, 9), data: (544, 20) @ (20, 9) |-- (294, 285), data: True |-- (250, 239), data: True Max drift after symmetrization by symfc projector: -0.00000000 (xx) -0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 08:48:40]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 08:48:40]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.300464675045524 -6.568316664999999 0.000000000000000 b 3.300464675045524 6.568316664999999 0.000000000000000 c -3.200550757026873 0.000000000000000 4.962974079845401 Atomic positions (fractional): 1 O 0.35813822794064 0.23125556866664 0.79326202355183 15.999 2 O 0.76874443133336 0.64186177205936 0.70673797644817 15.999 3 O 0.64186177205936 0.76874443133336 0.20673797644817 15.999 4 O 0.23125556866664 0.35813822794064 0.29326202355183 15.999 5 O 0.08309489496407 0.45926748191126 0.79167875326799 15.999 6 O 0.45926748191126 0.08309489496407 0.29167875326799 15.999 7 O 0.91690510503593 0.54073251808874 0.20832124673201 15.999 8 O 0.54073251808874 0.91690510503593 0.70832124673201 15.999 9 Na 0.18043101496314 0.81956898503686 0.75000000000000 22.990 10 Na 0.94414023926234 0.05585976073766 0.75000000000000 22.990 11 Na 0.81956898503686 0.18043101496314 0.25000000000000 22.990 12 Na 0.05585976073766 0.94414023926234 0.25000000000000 22.990 13 Y 0.56714922265896 0.43285077734104 0.25000000000000 88.906 14 Y 0.43285077734104 0.56714922265896 0.75000000000000 88.906 15 Y 0.30679601468349 0.69320398531651 0.25000000000000 88.906 16 Y 0.69320398531651 0.30679601468349 0.75000000000000 88.906 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.201858700182097 0.000000000000000 0.000000000000000 b 0.000000000000000 13.136633329999999 0.000000000000000 c -6.401101514053746 0.000000000000000 9.925948159690803 Atomic positions (fractional): 1 O 0.14734844915182 0.93655867036300 0.39663101177592 15.999 > 1 2 O 0.64734844915182 0.93655867036300 0.39663101177592 15.999 > 1 3 O 0.14734844915182 0.93655867036300 0.89663101177592 15.999 > 1 4 O 0.64734844915182 0.93655867036300 0.89663101177592 15.999 > 1 5 O 0.35265155084818 0.93655867036300 0.35336898822408 15.999 > 5 6 O 0.85265155084818 0.93655867036300 0.35336898822408 15.999 > 5 7 O 0.35265155084818 0.93655867036300 0.85336898822408 15.999 > 5 8 O 0.85265155084818 0.93655867036300 0.85336898822408 15.999 > 5 9 O 0.10265155084818 0.56344132963700 0.10336898822408 15.999 > 9 10 O 0.60265155084818 0.56344132963700 0.10336898822408 15.999 > 9 11 O 0.10265155084818 0.56344132963700 0.60336898822408 15.999 > 9 12 O 0.60265155084818 0.56344132963700 0.60336898822408 15.999 > 9 13 O 0.39734844915182 0.56344132963700 0.14663101177592 15.999 > 13 14 O 0.89734844915182 0.56344132963700 0.14663101177592 15.999 > 13 15 O 0.39734844915182 0.56344132963700 0.64663101177592 15.999 > 13 16 O 0.89734844915182 0.56344132963700 0.64663101177592 15.999 > 13 17 O 0.38559059421883 0.68808629347360 0.39583937663399 15.999 > 17 18 O 0.88559059421883 0.68808629347360 0.39583937663399 15.999 > 17 19 O 0.38559059421883 0.68808629347360 0.89583937663399 15.999 > 17 20 O 0.88559059421883 0.68808629347360 0.89583937663399 15.999 > 17 21 O 0.13559059421883 0.81191370652640 0.14583937663399 15.999 > 21 22 O 0.63559059421883 0.81191370652640 0.14583937663399 15.999 > 21 23 O 0.13559059421883 0.81191370652640 0.64583937663399 15.999 > 21 24 O 0.63559059421883 0.81191370652640 0.64583937663399 15.999 > 21 25 O 0.36440940578117 0.81191370652640 0.10416062336600 15.999 > 25 26 O 0.86440940578117 0.81191370652640 0.10416062336600 15.999 > 25 27 O 0.36440940578117 0.81191370652640 0.60416062336600 15.999 > 25 28 O 0.86440940578117 0.81191370652640 0.60416062336600 15.999 > 25 29 O 0.11440940578117 0.68808629347360 0.35416062336601 15.999 > 29 30 O 0.61440940578117 0.68808629347360 0.35416062336601 15.999 > 29 31 O 0.11440940578117 0.68808629347360 0.85416062336601 15.999 > 29 32 O 0.61440940578117 0.68808629347360 0.85416062336601 15.999 > 29 33 O 0.39734844915182 0.43655867036300 0.39663101177592 15.999 > 1 34 O 0.89734844915182 0.43655867036300 0.39663101177592 15.999 > 1 35 O 0.39734844915182 0.43655867036300 0.89663101177592 15.999 > 1 36 O 0.89734844915182 0.43655867036300 0.89663101177592 15.999 > 1 37 O 0.10265155084818 0.43655867036300 0.35336898822408 15.999 > 5 38 O 0.60265155084818 0.43655867036300 0.35336898822408 15.999 > 5 39 O 0.10265155084818 0.43655867036300 0.85336898822408 15.999 > 5 40 O 0.60265155084818 0.43655867036300 0.85336898822408 15.999 > 5 41 O 0.35265155084818 0.06344132963700 0.10336898822408 15.999 > 9 42 O 0.85265155084818 0.06344132963700 0.10336898822408 15.999 > 9 43 O 0.35265155084818 0.06344132963700 0.60336898822408 15.999 > 9 44 O 0.85265155084818 0.06344132963700 0.60336898822408 15.999 > 9 45 O 0.14734844915182 0.06344132963700 0.14663101177592 15.999 > 13 46 O 0.64734844915182 0.06344132963700 0.14663101177592 15.999 > 13 47 O 0.14734844915182 0.06344132963700 0.64663101177592 15.999 > 13 48 O 0.64734844915182 0.06344132963700 0.64663101177592 15.999 > 13 49 O 0.13559059421883 0.18808629347360 0.39583937663399 15.999 > 17 50 O 0.63559059421883 0.18808629347360 0.39583937663399 15.999 > 17 51 O 0.13559059421883 0.18808629347360 0.89583937663399 15.999 > 17 52 O 0.63559059421883 0.18808629347360 0.89583937663399 15.999 > 17 53 O 0.38559059421883 0.31191370652640 0.14583937663399 15.999 > 21 54 O 0.88559059421883 0.31191370652640 0.14583937663399 15.999 > 21 55 O 0.38559059421883 0.31191370652640 0.64583937663399 15.999 > 21 56 O 0.88559059421883 0.31191370652640 0.64583937663399 15.999 > 21 57 O 0.11440940578117 0.31191370652640 0.10416062336600 15.999 > 25 58 O 0.61440940578117 0.31191370652640 0.10416062336600 15.999 > 25 59 O 0.11440940578117 0.31191370652640 0.60416062336600 15.999 > 25 60 O 0.61440940578117 0.31191370652640 0.60416062336600 15.999 > 25 61 O 0.36440940578117 0.18808629347360 0.35416062336601 15.999 > 29 62 O 0.86440940578117 0.18808629347360 0.35416062336601 15.999 > 29 63 O 0.36440940578117 0.18808629347360 0.85416062336601 15.999 > 29 64 O 0.86440940578117 0.18808629347360 0.85416062336601 15.999 > 29 65 Na 0.00000000000000 0.81956898503686 0.37500000000000 22.990 > 65 66 Na 0.50000000000000 0.81956898503686 0.37500000000000 22.990 > 65 67 Na 0.00000000000000 0.81956898503686 0.87500000000000 22.990 > 65 68 Na 0.50000000000000 0.81956898503686 0.87500000000000 22.990 > 65 69 Na 0.25000000000000 0.55585976073766 0.37500000000000 22.990 > 69 70 Na 0.75000000000000 0.55585976073766 0.37500000000000 22.990 > 69 71 Na 0.25000000000000 0.55585976073766 0.87500000000000 22.990 > 69 72 Na 0.75000000000000 0.55585976073766 0.87500000000000 22.990 > 69 73 Na 0.25000000000000 0.68043101496314 0.12500000000000 22.990 > 73 74 Na 0.75000000000000 0.68043101496314 0.12500000000000 22.990 > 73 75 Na 0.25000000000000 0.68043101496314 0.62500000000000 22.990 > 73 76 Na 0.75000000000000 0.68043101496314 0.62500000000000 22.990 > 73 77 Na 0.00000000000000 0.94414023926234 0.12500000000000 22.990 > 77 78 Na 0.50000000000000 0.94414023926234 0.12500000000000 22.990 > 77 79 Na 0.00000000000000 0.94414023926234 0.62500000000000 22.990 > 77 80 Na 0.50000000000000 0.94414023926234 0.62500000000000 22.990 > 77 81 Na 0.25000000000000 0.31956898503686 0.37500000000000 22.990 > 65 82 Na 0.75000000000000 0.31956898503686 0.37500000000000 22.990 > 65 83 Na 0.25000000000000 0.31956898503686 0.87500000000000 22.990 > 65 84 Na 0.75000000000000 0.31956898503686 0.87500000000000 22.990 > 65 85 Na 0.00000000000000 0.05585976073766 0.37500000000000 22.990 > 69 86 Na 0.50000000000000 0.05585976073766 0.37500000000000 22.990 > 69 87 Na 0.00000000000000 0.05585976073766 0.87500000000000 22.990 > 69 88 Na 0.50000000000000 0.05585976073766 0.87500000000000 22.990 > 69 89 Na 0.00000000000000 0.18043101496314 0.12500000000000 22.990 > 73 90 Na 0.50000000000000 0.18043101496314 0.12500000000000 22.990 > 73 91 Na 0.00000000000000 0.18043101496314 0.62500000000000 22.990 > 73 92 Na 0.50000000000000 0.18043101496314 0.62500000000000 22.990 > 73 93 Na 0.25000000000000 0.44414023926234 0.12500000000000 22.990 > 77 94 Na 0.75000000000000 0.44414023926234 0.12500000000000 22.990 > 77 95 Na 0.25000000000000 0.44414023926234 0.62500000000000 22.990 > 77 96 Na 0.75000000000000 0.44414023926234 0.62500000000000 22.990 > 77 97 Y 0.25000000000000 0.93285077734104 0.12500000000000 88.906 > 97 98 Y 0.75000000000000 0.93285077734104 0.12500000000000 88.906 > 97 99 Y 0.25000000000000 0.93285077734104 0.62500000000000 88.906 > 97 100 Y 0.75000000000000 0.93285077734104 0.62500000000000 88.906 > 97 101 Y 0.00000000000000 0.56714922265896 0.37500000000000 88.906 > 101 102 Y 0.50000000000000 0.56714922265896 0.37500000000000 88.906 > 101 103 Y 0.00000000000000 0.56714922265896 0.87500000000000 88.906 > 101 104 Y 0.50000000000000 0.56714922265896 0.87500000000000 88.906 > 101 105 Y 0.00000000000000 0.69320398531651 0.12500000000000 88.906 > 105 106 Y 0.50000000000000 0.69320398531651 0.12500000000000 88.906 > 105 107 Y 0.00000000000000 0.69320398531651 0.62500000000000 88.906 > 105 108 Y 0.50000000000000 0.69320398531651 0.62500000000000 88.906 > 105 109 Y 0.25000000000000 0.80679601468349 0.37500000000000 88.906 > 109 110 Y 0.75000000000000 0.80679601468349 0.37500000000000 88.906 > 109 111 Y 0.25000000000000 0.80679601468349 0.87500000000000 88.906 > 109 112 Y 0.75000000000000 0.80679601468349 0.87500000000000 88.906 > 109 113 Y 0.00000000000000 0.43285077734104 0.12500000000000 88.906 > 97 114 Y 0.50000000000000 0.43285077734104 0.12500000000000 88.906 > 97 115 Y 0.00000000000000 0.43285077734104 0.62500000000000 88.906 > 97 116 Y 0.50000000000000 0.43285077734104 0.62500000000000 88.906 > 97 117 Y 0.25000000000000 0.06714922265896 0.37500000000000 88.906 > 101 118 Y 0.75000000000000 0.06714922265896 0.37500000000000 88.906 > 101 119 Y 0.25000000000000 0.06714922265896 0.87500000000000 88.906 > 101 120 Y 0.75000000000000 0.06714922265896 0.87500000000000 88.906 > 101 121 Y 0.25000000000000 0.19320398531651 0.12500000000000 88.906 > 105 122 Y 0.75000000000000 0.19320398531651 0.12500000000000 88.906 > 105 123 Y 0.25000000000000 0.19320398531651 0.62500000000000 88.906 > 105 124 Y 0.75000000000000 0.19320398531651 0.62500000000000 88.906 > 105 125 Y 0.00000000000000 0.30679601468349 0.37500000000000 88.906 > 109 126 Y 0.50000000000000 0.30679601468349 0.37500000000000 88.906 > 109 127 Y 0.00000000000000 0.30679601468349 0.87500000000000 88.906 > 109 128 Y 0.50000000000000 0.30679601468349 0.87500000000000 88.906 > 109 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.5804558 0.0000000 -0.1759332 0.0000000 3.8030237 0.0000000 -0.1759324 0.0000000 3.7726993 -------------------------- Born effective charges -------------------------- 1 O -2.0896639 0.0005013 0.3334439 0.0036019 -2.5098229 -0.0052687 0.3032686 0.0125959 -2.3513378 2 O -2.0896639 -0.0005013 0.3334439 -0.0036019 -2.5098229 0.0052687 0.3032686 -0.0125959 -2.3513378 3 O -2.0896639 0.0005013 0.3334439 0.0036019 -2.5098229 -0.0052687 0.3032686 0.0125959 -2.3513378 4 O -2.0896639 -0.0005013 0.3334439 -0.0036019 -2.5098229 0.0052687 0.3032686 -0.0125959 -2.3513378 5 O -2.3609931 0.9632728 0.0012190 0.9740207 -2.3722695 0.0150788 0.0372816 -0.0153800 -2.3530918 6 O -2.3609931 -0.9632728 0.0012190 -0.9740207 -2.3722695 -0.0150788 0.0372816 0.0153800 -2.3530918 7 O -2.3609931 0.9632728 0.0012190 0.9740207 -2.3722695 0.0150788 0.0372816 -0.0153800 -2.3530918 8 O -2.3609931 -0.9632728 0.0012190 -0.9740207 -2.3722695 -0.0150788 0.0372816 0.0153800 -2.3530918 9 Na 1.1019673 0.0000000 0.0118835 0.0000000 0.9687103 0.0000000 0.0094870 0.0000000 1.1027837 10 Na 1.1189379 0.0000000 0.1505604 0.0000000 0.9917045 0.0000000 0.1743777 0.0000000 1.0944115 11 Na 1.1019673 0.0000000 0.0118835 0.0000000 0.9687103 0.0000000 0.0094870 0.0000000 1.1027837 12 Na 1.1189379 0.0000000 0.1505604 0.0000000 0.9917045 0.0000000 0.1743777 0.0000000 1.0944115 13 Y 3.3521466 0.0000000 -0.9316292 0.0000000 3.9423391 0.0000000 -0.9126383 0.0000000 3.6508276 14 Y 3.3521466 0.0000000 -0.9316292 0.0000000 3.9423391 0.0000000 -0.9126383 0.0000000 3.6508276 15 Y 3.3282620 0.0000000 0.0998596 0.0000000 3.8614308 0.0000000 0.0476732 0.0000000 3.5608364 16 Y 3.3282620 0.0000000 0.0998596 0.0000000 3.8614308 0.0000000 0.0476732 0.0000000 3.5608364 ---------------------------------------------------------------------------- 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] [-0.0054 0.0000 0.0084] [ 0.0054 0.0000 -0.0084] 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] [-0.0054 0.0000 0.0084] [ 0.0054 0.0000 -0.0084] Computing fc3[ 65, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0054 0.0000 0.0084] [ 0.0054 0.0000 -0.0084] Computing fc3[ 69, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0054 0.0000 0.0084] [ 0.0054 0.0000 -0.0084] Computing fc3[ 97, 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] [-0.0054 0.0000 0.0084] [ 0.0054 0.0000 -0.0084] Computing fc3[ 105, 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] [-0.0054 0.0000 0.0084] [ 0.0054 0.0000 -0.0084] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000001 (yyy) -0.00000001 (yyy) -0.00000001 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000001 (zx) 0.00000001 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 08:49:10]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 08:49:11]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.300464675045524 -6.568316664999999 0.000000000000000 b 3.300464675045524 6.568316664999999 0.000000000000000 c -3.200550757026873 0.000000000000000 4.962974079845401 Atomic positions (fractional): 1 O 0.35813822794064 0.23125556866664 0.79326202355183 15.999 2 O 0.76874443133336 0.64186177205936 0.70673797644817 15.999 3 O 0.64186177205936 0.76874443133336 0.20673797644817 15.999 4 O 0.23125556866664 0.35813822794064 0.29326202355183 15.999 5 O 0.08309489496407 0.45926748191126 0.79167875326799 15.999 6 O 0.45926748191126 0.08309489496407 0.29167875326799 15.999 7 O 0.91690510503593 0.54073251808874 0.20832124673201 15.999 8 O 0.54073251808874 0.91690510503593 0.70832124673201 15.999 9 Na 0.18043101496314 0.81956898503686 0.75000000000000 22.990 10 Na 0.94414023926234 0.05585976073766 0.75000000000000 22.990 11 Na 0.81956898503686 0.18043101496314 0.25000000000000 22.990 12 Na 0.05585976073766 0.94414023926234 0.25000000000000 22.990 13 Y 0.56714922265896 0.43285077734104 0.25000000000000 88.906 14 Y 0.43285077734104 0.56714922265896 0.75000000000000 88.906 15 Y 0.30679601468349 0.69320398531651 0.25000000000000 88.906 16 Y 0.69320398531651 0.30679601468349 0.75000000000000 88.906 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.201858700182097 0.000000000000000 0.000000000000000 b 0.000000000000000 13.136633329999999 0.000000000000000 c -6.401101514053746 0.000000000000000 9.925948159690803 Atomic positions (fractional): 1 O 0.14734844915182 0.93655867036300 0.39663101177592 15.999 > 1 2 O 0.64734844915182 0.93655867036300 0.39663101177592 15.999 > 1 3 O 0.14734844915182 0.93655867036300 0.89663101177592 15.999 > 1 4 O 0.64734844915182 0.93655867036300 0.89663101177592 15.999 > 1 5 O 0.35265155084818 0.93655867036300 0.35336898822408 15.999 > 5 6 O 0.85265155084818 0.93655867036300 0.35336898822408 15.999 > 5 7 O 0.35265155084818 0.93655867036300 0.85336898822408 15.999 > 5 8 O 0.85265155084818 0.93655867036300 0.85336898822408 15.999 > 5 9 O 0.10265155084818 0.56344132963700 0.10336898822408 15.999 > 9 10 O 0.60265155084818 0.56344132963700 0.10336898822408 15.999 > 9 11 O 0.10265155084818 0.56344132963700 0.60336898822408 15.999 > 9 12 O 0.60265155084818 0.56344132963700 0.60336898822408 15.999 > 9 13 O 0.39734844915182 0.56344132963700 0.14663101177592 15.999 > 13 14 O 0.89734844915182 0.56344132963700 0.14663101177592 15.999 > 13 15 O 0.39734844915182 0.56344132963700 0.64663101177592 15.999 > 13 16 O 0.89734844915182 0.56344132963700 0.64663101177592 15.999 > 13 17 O 0.38559059421883 0.68808629347360 0.39583937663399 15.999 > 17 18 O 0.88559059421883 0.68808629347360 0.39583937663399 15.999 > 17 19 O 0.38559059421883 0.68808629347360 0.89583937663399 15.999 > 17 20 O 0.88559059421883 0.68808629347360 0.89583937663399 15.999 > 17 21 O 0.13559059421883 0.81191370652640 0.14583937663399 15.999 > 21 22 O 0.63559059421883 0.81191370652640 0.14583937663399 15.999 > 21 23 O 0.13559059421883 0.81191370652640 0.64583937663399 15.999 > 21 24 O 0.63559059421883 0.81191370652640 0.64583937663399 15.999 > 21 25 O 0.36440940578117 0.81191370652640 0.10416062336600 15.999 > 25 26 O 0.86440940578117 0.81191370652640 0.10416062336600 15.999 > 25 27 O 0.36440940578117 0.81191370652640 0.60416062336600 15.999 > 25 28 O 0.86440940578117 0.81191370652640 0.60416062336600 15.999 > 25 29 O 0.11440940578117 0.68808629347360 0.35416062336601 15.999 > 29 30 O 0.61440940578117 0.68808629347360 0.35416062336601 15.999 > 29 31 O 0.11440940578117 0.68808629347360 0.85416062336601 15.999 > 29 32 O 0.61440940578117 0.68808629347360 0.85416062336601 15.999 > 29 33 O 0.39734844915182 0.43655867036300 0.39663101177592 15.999 > 1 34 O 0.89734844915182 0.43655867036300 0.39663101177592 15.999 > 1 35 O 0.39734844915182 0.43655867036300 0.89663101177592 15.999 > 1 36 O 0.89734844915182 0.43655867036300 0.89663101177592 15.999 > 1 37 O 0.10265155084818 0.43655867036300 0.35336898822408 15.999 > 5 38 O 0.60265155084818 0.43655867036300 0.35336898822408 15.999 > 5 39 O 0.10265155084818 0.43655867036300 0.85336898822408 15.999 > 5 40 O 0.60265155084818 0.43655867036300 0.85336898822408 15.999 > 5 41 O 0.35265155084818 0.06344132963700 0.10336898822408 15.999 > 9 42 O 0.85265155084818 0.06344132963700 0.10336898822408 15.999 > 9 43 O 0.35265155084818 0.06344132963700 0.60336898822408 15.999 > 9 44 O 0.85265155084818 0.06344132963700 0.60336898822408 15.999 > 9 45 O 0.14734844915182 0.06344132963700 0.14663101177592 15.999 > 13 46 O 0.64734844915182 0.06344132963700 0.14663101177592 15.999 > 13 47 O 0.14734844915182 0.06344132963700 0.64663101177592 15.999 > 13 48 O 0.64734844915182 0.06344132963700 0.64663101177592 15.999 > 13 49 O 0.13559059421883 0.18808629347360 0.39583937663399 15.999 > 17 50 O 0.63559059421883 0.18808629347360 0.39583937663399 15.999 > 17 51 O 0.13559059421883 0.18808629347360 0.89583937663399 15.999 > 17 52 O 0.63559059421883 0.18808629347360 0.89583937663399 15.999 > 17 53 O 0.38559059421883 0.31191370652640 0.14583937663399 15.999 > 21 54 O 0.88559059421883 0.31191370652640 0.14583937663399 15.999 > 21 55 O 0.38559059421883 0.31191370652640 0.64583937663399 15.999 > 21 56 O 0.88559059421883 0.31191370652640 0.64583937663399 15.999 > 21 57 O 0.11440940578117 0.31191370652640 0.10416062336600 15.999 > 25 58 O 0.61440940578117 0.31191370652640 0.10416062336600 15.999 > 25 59 O 0.11440940578117 0.31191370652640 0.60416062336600 15.999 > 25 60 O 0.61440940578117 0.31191370652640 0.60416062336600 15.999 > 25 61 O 0.36440940578117 0.18808629347360 0.35416062336601 15.999 > 29 62 O 0.86440940578117 0.18808629347360 0.35416062336601 15.999 > 29 63 O 0.36440940578117 0.18808629347360 0.85416062336601 15.999 > 29 64 O 0.86440940578117 0.18808629347360 0.85416062336601 15.999 > 29 65 Na 0.00000000000000 0.81956898503686 0.37500000000000 22.990 > 65 66 Na 0.50000000000000 0.81956898503686 0.37500000000000 22.990 > 65 67 Na 0.00000000000000 0.81956898503686 0.87500000000000 22.990 > 65 68 Na 0.50000000000000 0.81956898503686 0.87500000000000 22.990 > 65 69 Na 0.25000000000000 0.55585976073766 0.37500000000000 22.990 > 69 70 Na 0.75000000000000 0.55585976073766 0.37500000000000 22.990 > 69 71 Na 0.25000000000000 0.55585976073766 0.87500000000000 22.990 > 69 72 Na 0.75000000000000 0.55585976073766 0.87500000000000 22.990 > 69 73 Na 0.25000000000000 0.68043101496314 0.12500000000000 22.990 > 73 74 Na 0.75000000000000 0.68043101496314 0.12500000000000 22.990 > 73 75 Na 0.25000000000000 0.68043101496314 0.62500000000000 22.990 > 73 76 Na 0.75000000000000 0.68043101496314 0.62500000000000 22.990 > 73 77 Na 0.00000000000000 0.94414023926234 0.12500000000000 22.990 > 77 78 Na 0.50000000000000 0.94414023926234 0.12500000000000 22.990 > 77 79 Na 0.00000000000000 0.94414023926234 0.62500000000000 22.990 > 77 80 Na 0.50000000000000 0.94414023926234 0.62500000000000 22.990 > 77 81 Na 0.25000000000000 0.31956898503686 0.37500000000000 22.990 > 65 82 Na 0.75000000000000 0.31956898503686 0.37500000000000 22.990 > 65 83 Na 0.25000000000000 0.31956898503686 0.87500000000000 22.990 > 65 84 Na 0.75000000000000 0.31956898503686 0.87500000000000 22.990 > 65 85 Na 0.00000000000000 0.05585976073766 0.37500000000000 22.990 > 69 86 Na 0.50000000000000 0.05585976073766 0.37500000000000 22.990 > 69 87 Na 0.00000000000000 0.05585976073766 0.87500000000000 22.990 > 69 88 Na 0.50000000000000 0.05585976073766 0.87500000000000 22.990 > 69 89 Na 0.00000000000000 0.18043101496314 0.12500000000000 22.990 > 73 90 Na 0.50000000000000 0.18043101496314 0.12500000000000 22.990 > 73 91 Na 0.00000000000000 0.18043101496314 0.62500000000000 22.990 > 73 92 Na 0.50000000000000 0.18043101496314 0.62500000000000 22.990 > 73 93 Na 0.25000000000000 0.44414023926234 0.12500000000000 22.990 > 77 94 Na 0.75000000000000 0.44414023926234 0.12500000000000 22.990 > 77 95 Na 0.25000000000000 0.44414023926234 0.62500000000000 22.990 > 77 96 Na 0.75000000000000 0.44414023926234 0.62500000000000 22.990 > 77 97 Y 0.25000000000000 0.93285077734104 0.12500000000000 88.906 > 97 98 Y 0.75000000000000 0.93285077734104 0.12500000000000 88.906 > 97 99 Y 0.25000000000000 0.93285077734104 0.62500000000000 88.906 > 97 100 Y 0.75000000000000 0.93285077734104 0.62500000000000 88.906 > 97 101 Y 0.00000000000000 0.56714922265896 0.37500000000000 88.906 > 101 102 Y 0.50000000000000 0.56714922265896 0.37500000000000 88.906 > 101 103 Y 0.00000000000000 0.56714922265896 0.87500000000000 88.906 > 101 104 Y 0.50000000000000 0.56714922265896 0.87500000000000 88.906 > 101 105 Y 0.00000000000000 0.69320398531651 0.12500000000000 88.906 > 105 106 Y 0.50000000000000 0.69320398531651 0.12500000000000 88.906 > 105 107 Y 0.00000000000000 0.69320398531651 0.62500000000000 88.906 > 105 108 Y 0.50000000000000 0.69320398531651 0.62500000000000 88.906 > 105 109 Y 0.25000000000000 0.80679601468349 0.37500000000000 88.906 > 109 110 Y 0.75000000000000 0.80679601468349 0.37500000000000 88.906 > 109 111 Y 0.25000000000000 0.80679601468349 0.87500000000000 88.906 > 109 112 Y 0.75000000000000 0.80679601468349 0.87500000000000 88.906 > 109 113 Y 0.00000000000000 0.43285077734104 0.12500000000000 88.906 > 97 114 Y 0.50000000000000 0.43285077734104 0.12500000000000 88.906 > 97 115 Y 0.00000000000000 0.43285077734104 0.62500000000000 88.906 > 97 116 Y 0.50000000000000 0.43285077734104 0.62500000000000 88.906 > 97 117 Y 0.25000000000000 0.06714922265896 0.37500000000000 88.906 > 101 118 Y 0.75000000000000 0.06714922265896 0.37500000000000 88.906 > 101 119 Y 0.25000000000000 0.06714922265896 0.87500000000000 88.906 > 101 120 Y 0.75000000000000 0.06714922265896 0.87500000000000 88.906 > 101 121 Y 0.25000000000000 0.19320398531651 0.12500000000000 88.906 > 105 122 Y 0.75000000000000 0.19320398531651 0.12500000000000 88.906 > 105 123 Y 0.25000000000000 0.19320398531651 0.62500000000000 88.906 > 105 124 Y 0.75000000000000 0.19320398531651 0.62500000000000 88.906 > 105 125 Y 0.00000000000000 0.30679601468349 0.37500000000000 88.906 > 109 126 Y 0.50000000000000 0.30679601468349 0.37500000000000 88.906 > 109 127 Y 0.00000000000000 0.30679601468349 0.87500000000000 88.906 > 109 128 Y 0.50000000000000 0.30679601468349 0.87500000000000 88.906 > 109 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.5804558 0.0000000 -0.1759332 0.0000000 3.8030237 0.0000000 -0.1759324 0.0000000 3.7726993 -------------------------- Born effective charges -------------------------- 1 O -2.0896639 0.0005013 0.3334439 0.0036019 -2.5098229 -0.0052687 0.3032686 0.0125959 -2.3513378 2 O -2.0896639 -0.0005013 0.3334439 -0.0036019 -2.5098229 0.0052687 0.3032686 -0.0125959 -2.3513378 3 O -2.0896639 0.0005013 0.3334439 0.0036019 -2.5098229 -0.0052687 0.3032686 0.0125959 -2.3513378 4 O -2.0896639 -0.0005013 0.3334439 -0.0036019 -2.5098229 0.0052687 0.3032686 -0.0125959 -2.3513378 5 O -2.3609931 0.9632728 0.0012190 0.9740207 -2.3722695 0.0150788 0.0372816 -0.0153800 -2.3530918 6 O -2.3609931 -0.9632728 0.0012190 -0.9740207 -2.3722695 -0.0150788 0.0372816 0.0153800 -2.3530918 7 O -2.3609931 0.9632728 0.0012190 0.9740207 -2.3722695 0.0150788 0.0372816 -0.0153800 -2.3530918 8 O -2.3609931 -0.9632728 0.0012190 -0.9740207 -2.3722695 -0.0150788 0.0372816 0.0153800 -2.3530918 9 Na 1.1019673 0.0000000 0.0118835 0.0000000 0.9687103 0.0000000 0.0094870 0.0000000 1.1027837 10 Na 1.1189379 0.0000000 0.1505604 0.0000000 0.9917045 0.0000000 0.1743777 0.0000000 1.0944115 11 Na 1.1019673 0.0000000 0.0118835 0.0000000 0.9687103 0.0000000 0.0094870 0.0000000 1.1027837 12 Na 1.1189379 0.0000000 0.1505604 0.0000000 0.9917045 0.0000000 0.1743777 0.0000000 1.0944115 13 Y 3.3521466 0.0000000 -0.9316292 0.0000000 3.9423391 0.0000000 -0.9126383 0.0000000 3.6508276 14 Y 3.3521466 0.0000000 -0.9316292 0.0000000 3.9423391 0.0000000 -0.9126383 0.0000000 3.6508276 15 Y 3.3282620 0.0000000 0.0998596 0.0000000 3.8614308 0.0000000 0.0476732 0.0000000 3.5608364 16 Y 3.3282620 0.0000000 0.0998596 0.0000000 3.8614308 0.0000000 0.0476732 0.0000000 3.5608364 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000001 (yyy) -0.00000001 (yyy) -0.00000001 (yyy) Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 10 10 10 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.69, Number of G-points: 299, Lambda: 0.14 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/282) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.893 ( 0.000 0.000 0.000) 0.000 3.020 ( 0.000 0.000 0.000) 0.000 3.260 ( 0.000 0.000 0.000) 0.000 3.355 ( 0.000 0.000 0.000) 0.000 4.674 ( 0.000 0.000 0.000) 0.000 4.754 ( 0.000 0.000 0.000) 0.000 4.825 ( 0.000 0.000 0.000) 0.000 5.335 ( 0.000 0.000 0.000) 0.000 5.833 ( 0.000 0.000 0.000) 0.000 5.839 ( 0.000 0.000 0.000) 0.000 6.049 ( 0.000 0.000 0.000) 0.000 6.154 ( 0.000 0.000 0.000) 0.000 6.248 ( 0.000 0.000 0.000) 0.000 6.331 ( 0.000 0.000 0.000) 0.000 6.893 ( 0.000 0.000 0.000) 0.000 7.281 ( 0.000 0.000 0.000) 0.000 7.877 ( 0.000 0.000 0.000) 0.000 7.893 ( 0.000 0.000 0.000) 0.000 7.907 ( 0.000 0.000 0.000) 0.000 7.954 ( 0.000 0.000 0.000) 0.000 8.192 ( 0.000 0.000 0.000) 0.000 8.221 ( 0.000 0.000 0.000) 0.000 8.635 ( 0.000 0.000 0.000) 0.000 8.796 ( 0.000 0.000 0.000) 0.000 8.901 ( 0.000 0.000 0.000) 0.000 8.930 ( 0.000 0.000 0.000) 0.000 9.714 ( 0.000 0.000 0.000) 0.000 9.900 ( 0.000 0.000 0.000) 0.000 9.973 ( 0.000 0.000 0.000) 0.000 10.272 ( 0.000 0.000 0.000) 0.000 10.407 ( 0.000 0.000 0.000) 0.000 10.561 ( 0.000 0.000 0.000) 0.000 10.746 ( 0.000 0.000 0.000) 0.000 10.930 ( 0.000 0.000 0.000) 0.000 10.947 ( 0.000 0.000 0.000) 0.000 11.492 ( 0.000 0.000 0.000) 0.000 11.888 ( 0.000 0.000 0.000) 0.000 11.988 ( 0.000 0.000 0.000) 0.000 12.193 ( 0.000 0.000 0.000) 0.000 12.252 ( 0.000 0.000 0.000) 0.000 12.343 ( 0.000 0.000 0.000) 0.000 13.477 ( 0.000 0.000 0.000) 0.000 14.302 ( 0.000 0.000 0.000) 0.000 16.272 ( 0.000 0.000 0.000) 0.000 16.281 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/282) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.665 ( 25.584 -18.542 11.303) 33.558 0.768 ( 29.287 -19.346 16.581) 38.819 1.245 ( 51.447 -28.618 22.862) 63.154 3.098 ( -6.229 9.795 16.961) 20.553 3.114 ( 5.159 1.015 8.216) 9.755 3.328 ( 1.207 4.209 7.180) 8.409 3.395 ( -0.987 -3.897 7.774) 8.752 4.628 ( 1.665 11.837 -3.867) 12.564 4.754 ( -2.458 -4.295 0.386) 4.964 4.898 ( 0.372 -2.667 1.324) 3.000 5.329 ( 1.618 0.800 -3.699) 4.115 5.745 ( 2.489 11.145 -4.482) 12.268 5.918 ( 0.598 -6.693 -3.565) 7.607 5.981 ( 0.374 10.368 -3.287) 10.883 6.119 ( 3.327 14.035 0.205) 14.425 6.273 ( -2.747 -15.436 -3.755) 16.122 6.406 ( 1.520 -14.518 -0.632) 14.611 6.891 ( -1.192 -0.858 1.412) 2.038 7.372 ( -12.513 6.962 24.646) 28.504 7.832 ( -1.725 12.364 3.562) 12.982 7.854 ( 0.279 10.357 1.921) 10.537 7.938 ( 0.530 -3.332 -1.705) 3.780 8.026 ( -4.663 -7.552 8.540) 12.317 8.186 ( -2.281 0.968 -1.212) 2.758 8.263 ( 4.808 13.500 -0.744) 14.350 8.754 ( -4.521 -4.749 -4.939) 8.208 8.845 ( -12.926 -17.104 10.406) 23.831 8.923 ( -6.523 -11.295 0.825) 13.069 9.086 ( 9.739 -24.531 -36.454) 45.005 9.698 ( 3.898 2.750 -8.227) 9.510 9.988 ( 3.762 1.686 0.706) 4.182 10.209 ( -4.375 -4.968 -4.094) 7.784 10.329 ( -0.471 -7.172 -0.902) 7.243 10.402 ( 3.004 3.678 -0.545) 4.780 10.735 ( -2.217 -4.357 -2.395) 5.444 10.950 ( -0.623 -3.340 -0.815) 3.494 11.006 ( 2.383 -4.324 10.579) 11.674 11.396 ( -11.393 1.569 0.231) 11.503 11.774 ( -4.977 10.440 -2.561) 11.846 11.912 ( -8.813 -4.137 -2.707) 10.105 12.188 ( 1.995 0.885 2.109) 3.035 12.236 ( 4.227 0.393 -0.653) 4.295 12.330 ( -2.414 1.231 3.540) 4.458 13.555 ( 7.320 -0.851 2.878) 7.912 14.389 ( 8.670 -0.544 3.004) 9.191 16.131 ( 0.854 14.908 -1.117) 14.974 16.302 ( -1.784 -6.705 0.489) 6.955 16.864 ( 6.697 -29.370 -39.323) 49.536 ======================= Grid point 2 (3/282) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.256 ( 22.159 -16.037 7.623) 28.396 1.491 ( 25.367 -18.653 16.350) 35.479 2.408 ( 45.758 -24.765 19.903) 55.707 3.050 ( -5.740 7.378 7.657) 12.084 3.350 ( 11.527 -0.048 10.739) 15.754 3.397 ( 3.048 -2.506 2.784) 4.830 3.556 ( 5.130 -2.828 13.384) 14.610 4.458 ( 0.529 18.773 -9.832) 21.198 4.749 ( -1.507 -3.616 -1.635) 4.245 4.958 ( 4.175 -8.983 -6.364) 11.774 5.283 ( -0.336 0.544 -6.849) 6.879 5.658 ( 1.546 11.201 -4.836) 12.298 5.772 ( -0.158 14.495 -6.801) 16.012 6.003 ( 1.054 -4.832 -2.414) 5.504 6.065 ( 3.815 9.564 -2.647) 10.632 6.322 ( 0.218 -14.281 -4.743) 15.050 6.562 ( 6.235 -11.641 -0.268) 13.209 6.925 ( -0.039 -5.019 4.549) 6.774 7.365 ( -8.216 3.245 14.003) 16.556 7.700 ( -6.931 13.728 3.241) 15.716 7.804 ( -2.524 10.764 4.959) 12.117 7.907 ( -2.059 0.879 -4.134) 4.701 8.061 ( -5.962 -1.159 8.750) 10.651 8.162 ( 2.230 2.187 0.305) 3.138 8.264 ( 4.014 2.329 -0.083) 4.641 8.645 ( -5.849 -4.371 -7.772) 10.663 8.851 ( -4.295 -4.775 0.327) 6.431 8.932 ( -11.515 -25.170 -3.509) 27.900 9.060 ( 5.077 -1.001 -8.178) 9.678 9.637 ( 5.152 7.885 -8.035) 12.381 10.062 ( 7.121 -3.977 -6.328) 10.323 10.144 ( -3.374 -7.699 -7.238) 11.093 10.358 ( -2.090 0.129 5.967) 6.324 10.460 ( 7.930 1.665 -0.524) 8.120 10.719 ( -1.071 -2.192 0.309) 2.459 10.952 ( -1.424 -2.937 -1.145) 3.459 11.134 ( -8.020 1.242 -2.667) 8.543 11.224 ( -0.538 -5.428 5.375) 7.657 11.535 ( -12.602 1.718 -8.015) 15.034 11.796 ( -10.724 1.197 7.969) 13.414 12.172 ( -0.918 4.140 -2.425) 4.885 12.236 ( -3.061 0.949 -0.303) 3.219 12.409 ( 9.567 3.817 4.097) 11.085 13.740 ( 10.468 -1.483 4.091) 11.336 14.604 ( 13.709 -0.750 3.907) 14.275 15.997 ( -5.773 7.594 -1.034) 9.595 16.312 ( -6.356 -10.048 1.093) 11.940 16.780 ( 2.535 -9.687 -22.431) 24.564 ======================= Grid point 3 (4/282) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.718 ( 17.235 -12.205 3.667) 21.435 2.123 ( 19.028 -17.156 15.302) 29.842 2.954 ( -4.998 5.386 2.556) 7.780 3.251 ( 15.832 -8.156 11.029) 20.947 3.621 ( 20.330 -14.209 4.561) 25.220 3.641 ( 11.896 0.206 13.082) 17.683 3.838 ( 8.631 -3.252 15.699) 18.208 4.212 ( 1.768 18.270 -9.422) 20.632 4.731 ( -0.035 -0.051 -2.206) 2.207 4.976 ( 1.449 -6.758 -15.507) 16.978 5.224 ( -0.063 -2.977 -1.717) 3.437 5.465 ( -5.413 15.063 -4.225) 16.554 5.660 ( 4.633 4.270 -12.623) 14.109 5.966 ( -0.370 11.617 2.304) 11.849 6.058 ( 2.216 -5.504 -7.525) 9.583 6.420 ( 5.532 -10.371 -2.865) 12.098 6.774 ( 12.384 -5.392 1.630) 13.605 7.061 ( 1.837 -10.799 6.758) 12.871 7.342 ( -8.834 1.296 9.844) 13.290 7.490 ( -10.258 10.165 0.531) 14.451 7.679 ( -5.626 7.325 -0.392) 9.244 7.832 ( -3.716 6.442 3.725) 8.317 8.034 ( -7.445 5.252 8.004) 12.128 8.209 ( 5.459 0.438 -2.685) 6.100 8.315 ( 1.413 -3.590 -1.351) 4.088 8.521 ( -2.357 -2.814 -7.261) 8.136 8.784 ( -6.291 -6.638 -7.539) 11.852 8.874 ( -6.883 -9.923 -1.635) 12.187 9.129 ( 1.663 -4.998 4.389) 6.857 9.603 ( 7.232 8.594 -4.870) 12.243 10.089 ( -0.332 -5.444 -6.817) 8.731 10.109 ( 1.776 -5.226 -6.710) 8.689 10.343 ( -5.666 2.724 3.020) 6.974 10.601 ( 10.810 1.833 1.255) 11.036 10.747 ( 1.178 -1.565 0.690) 2.077 10.872 ( -4.433 2.098 -3.963) 6.305 10.997 ( -2.471 -3.312 -1.703) 4.470 11.246 ( -12.379 1.475 -6.959) 14.278 11.369 ( 0.798 -6.928 6.337) 9.424 11.715 ( -9.492 -1.107 6.320) 11.458 12.061 ( -4.432 7.069 -2.723) 8.777 12.177 ( -2.852 1.044 -0.204) 3.044 12.574 ( 9.916 3.510 3.748) 11.167 13.950 ( 9.970 -1.632 3.856) 10.813 14.870 ( 15.585 -0.808 3.117) 15.914 15.823 ( -9.665 4.108 -1.249) 10.576 16.291 ( -8.066 -10.294 2.123) 13.248 16.655 ( 0.661 -1.392 -16.409) 16.482 ======================= Grid point 4 (5/282) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.029 ( 10.607 -7.197 1.069) 12.863 2.601 ( 10.257 -12.941 11.609) 20.185 2.855 ( -4.328 4.229 0.670) 6.088 3.443 ( 0.738 -6.429 5.841) 8.718 3.743 ( 1.618 13.904 -7.302) 15.788 3.979 ( 11.546 6.474 11.103) 17.277 4.176 ( 12.473 -14.112 0.168) 18.834 4.291 ( 6.491 -4.885 13.793) 16.007 4.721 ( 2.426 7.270 -0.470) 7.679 4.837 ( 0.175 -6.452 -16.102) 17.347 5.229 ( -3.022 14.913 -1.049) 15.253 5.312 ( 1.251 -9.331 0.826) 9.451 5.558 ( 1.600 0.552 -13.177) 13.286 5.902 ( -0.071 8.820 2.067) 9.059 6.063 ( 1.845 -3.641 -4.244) 5.889 6.592 ( 9.619 -7.849 0.059) 12.415 6.983 ( 5.894 1.848 -0.773) 6.225 7.205 ( -7.214 -4.854 7.923) 11.763 7.247 ( -5.841 4.932 3.152) 8.270 7.324 ( 0.022 -5.487 -0.238) 5.492 7.611 ( 0.361 -0.952 0.192) 1.036 7.741 ( -4.534 9.305 1.646) 10.481 7.911 ( -8.386 8.518 4.270) 12.693 8.201 ( -4.147 -3.133 -3.870) 6.480 8.302 ( -0.845 -1.701 -3.481) 3.966 8.549 ( 9.141 -1.629 -2.678) 9.664 8.688 ( -3.035 -1.403 -1.550) 3.686 8.824 ( -7.541 -6.105 -0.903) 9.744 9.244 ( 2.008 -5.808 3.930) 7.294 9.634 ( 6.993 4.939 0.187) 8.564 9.992 ( -5.999 7.783 -5.073) 11.059 10.116 ( 2.166 -5.711 -5.165) 7.999 10.259 ( -3.571 -3.076 -0.840) 4.787 10.723 ( 6.515 1.501 -3.912) 7.746 10.732 ( -3.543 1.497 3.671) 5.317 10.866 ( 1.711 -1.026 -1.349) 2.408 10.957 ( -3.135 -4.338 -2.065) 5.737 11.078 ( -1.459 2.871 0.488) 3.257 11.480 ( -0.487 -6.246 5.968) 8.653 11.650 ( -4.514 -2.131 0.125) 4.993 11.897 ( -5.791 7.958 -1.793) 10.004 12.134 ( -1.308 0.735 -0.695) 1.653 12.709 ( 5.834 1.792 2.653) 6.655 14.121 ( 6.329 -1.179 2.474) 6.897 15.137 ( 15.359 -0.809 1.861) 15.493 15.620 ( -12.343 2.055 -1.262) 12.576 16.287 ( -5.407 -8.575 4.261) 10.997 16.509 ( -0.374 3.206 -11.937) 12.365 ======================= Grid point 5 (6/282) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.148 ( 0.000 -0.000 0.000) 0.000 2.800 ( -0.000 -0.000 0.000) 0.000 2.803 ( 0.000 0.000 -0.000) 0.000 3.558 ( 0.000 -0.000 0.000) 0.000 3.575 ( 0.000 -0.000 0.000) 0.000 4.192 ( 0.000 0.000 0.000) 0.000 4.219 ( -0.000 -0.000 -0.000) 0.000 4.516 ( 0.000 -0.000 0.000) 0.000 4.603 ( -0.000 0.000 -0.000) 0.000 4.848 ( 0.000 -0.000 -0.000) 0.000 5.118 ( 0.000 0.000 0.000) 0.000 5.413 ( 0.000 -0.000 0.000) 0.000 5.479 ( 0.000 -0.000 -0.000) 0.000 5.878 ( 0.000 -0.000 0.000) 0.000 6.077 ( 0.000 0.000 0.000) 0.000 6.786 ( -0.000 0.000 -0.000) 0.000 6.867 ( 0.000 -0.000 0.000) 0.000 7.139 ( 0.000 -0.000 0.000) 0.000 7.257 ( -0.000 0.000 0.000) 0.000 7.480 ( -0.000 0.000 -0.000) 0.000 7.601 ( 0.000 -0.000 -0.000) 0.000 7.635 ( 0.000 0.000 0.000) 0.000 7.822 ( 0.000 -0.000 -0.000) 0.000 8.140 ( -0.000 -0.000 0.000) 0.000 8.283 ( 0.000 -0.000 0.000) 0.000 8.665 ( 0.000 0.000 -0.000) 0.000 8.679 ( -0.000 -0.000 0.000) 0.000 8.732 ( 0.000 0.000 0.000) 0.000 9.313 ( 0.000 -0.000 0.000) 0.000 9.745 ( 0.000 -0.000 0.000) 0.000 9.790 ( -0.000 0.000 -0.000) 0.000 10.132 ( 0.000 -0.000 0.000) 0.000 10.255 ( 0.000 -0.000 0.000) 0.000 10.716 ( -0.000 0.000 0.000) 0.000 10.718 ( 0.000 -0.000 -0.000) 0.000 10.856 ( 0.000 -0.000 0.000) 0.000 10.980 ( 0.000 -0.000 0.000) 0.000 11.070 ( 0.000 -0.000 0.000) 0.000 11.547 ( 0.000 0.000 0.000) 0.000 11.624 ( 0.000 0.000 -0.000) 0.000 11.788 ( 0.000 -0.000 -0.000) 0.000 12.117 ( 0.000 -0.000 0.000) 0.000 12.761 ( 0.000 -0.000 0.000) 0.000 14.189 ( 0.000 -0.000 0.000) 0.000 15.352 ( -0.000 -0.000 -0.000) 0.000 15.426 ( 0.000 -0.000 0.000) 0.000 16.330 ( 0.000 -0.000 0.000) 0.000 16.402 ( 0.000 0.000 -0.000) 0.000 ======================= Grid point 12 (7/282) ======================= q-point: ( 0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.126 ( 25.022 -0.000 11.956) 27.732 1.332 ( 29.922 -0.000 16.313) 34.080 2.212 ( 52.998 -0.000 22.523) 57.586 3.122 ( -8.497 0.000 8.514) 12.029 3.338 ( 7.938 -0.000 5.619) 9.725 3.382 ( 4.755 -0.000 6.143) 7.768 3.539 ( 4.937 -0.000 15.168) 15.951 4.660 ( 3.443 -0.000 -10.243) 10.806 4.696 ( -2.996 0.000 -0.404) 3.023 4.853 ( 1.988 -0.000 -7.224) 7.492 5.290 ( -0.702 0.000 -6.586) 6.623 5.782 ( 3.580 -0.000 -11.555) 12.097 5.865 ( 3.585 -0.000 -3.262) 4.847 6.036 ( -7.114 0.000 -5.195) 8.809 6.052 ( 3.031 -0.000 -4.326) 5.282 6.338 ( 9.077 -0.000 2.486) 9.412 6.345 ( 2.114 -0.000 2.184) 3.039 6.890 ( -0.406 0.000 2.939) 2.967 7.404 ( -13.099 0.000 18.486) 22.657 7.819 ( -8.774 0.000 -3.886) 9.596 7.876 ( -6.011 0.000 2.273) 6.426 7.951 ( -0.809 0.000 6.995) 7.041 8.008 ( -3.525 0.000 9.610) 10.236 8.175 ( 1.429 -0.000 0.163) 1.438 8.358 ( 3.048 -0.000 -7.446) 8.046 8.450 ( -9.290 0.000 -0.128) 9.291 8.777 ( 0.375 -0.000 -5.904) 5.916 8.814 ( -4.963 0.000 -0.077) 4.964 9.053 ( 9.105 -0.000 -8.534) 12.479 9.704 ( 7.576 -0.000 -10.223) 12.724 10.027 ( 3.389 -0.000 -3.717) 5.031 10.080 ( -2.599 0.000 -9.256) 9.614 10.353 ( 3.369 -0.000 2.818) 4.392 10.491 ( 7.611 -0.000 0.344) 7.619 10.697 ( -1.307 0.000 1.074) 1.692 10.923 ( -1.118 0.000 0.739) 1.340 11.123 ( 1.045 -0.000 11.000) 11.049 11.199 ( -12.757 0.000 -4.139) 13.411 11.553 ( -12.244 0.000 -10.221) 15.950 11.808 ( -11.376 0.000 7.789) 13.787 12.207 ( 1.838 -0.000 -3.835) 4.253 12.243 ( -4.264 0.000 0.501) 4.293 12.439 ( 8.470 -0.000 5.303) 9.993 13.726 ( 10.478 -0.000 3.968) 11.205 14.599 ( 13.998 -0.000 3.894) 14.529 16.093 ( -9.467 0.000 -2.259) 9.733 16.198 ( -5.616 0.000 1.559) 5.828 16.689 ( 11.511 -0.000 -22.566) 25.332 ======================= Grid point 13 (8/282) ======================= q-point: ( 0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.592 ( 19.837 -4.153 9.192) 22.254 1.927 ( 23.660 -7.375 14.934) 28.935 3.011 ( -0.411 1.230 4.279) 4.471 3.183 ( 30.580 -0.256 13.459) 33.412 3.408 ( 6.131 -8.888 1.112) 10.855 3.683 ( 12.479 1.919 15.537) 20.020 3.803 ( 7.533 -1.594 17.392) 19.020 4.482 ( 0.197 15.528 -13.389) 20.504 4.685 ( -0.014 -6.278 -4.329) 7.626 4.858 ( 4.382 -6.318 -9.356) 12.110 5.193 ( -2.588 -0.681 -6.999) 7.493 5.646 ( -0.648 5.523 -15.864) 16.810 5.781 ( -0.978 10.237 -9.646) 14.100 5.958 ( 1.644 -1.854 1.036) 2.686 6.096 ( 0.746 -5.062 -2.708) 5.789 6.372 ( 8.150 10.047 3.553) 13.416 6.615 ( 10.879 -14.573 3.146) 18.456 6.959 ( 3.378 -2.634 4.665) 6.333 7.360 ( -11.820 1.067 12.324) 17.110 7.587 ( -13.575 2.478 -3.664) 14.278 7.752 ( -10.427 3.127 1.086) 10.940 7.961 ( -3.621 8.000 9.018) 12.587 8.059 ( -5.883 -1.971 10.149) 11.896 8.195 ( 0.103 -1.371 -2.603) 2.944 8.297 ( 2.118 1.851 -4.797) 5.561 8.396 ( -2.919 -10.642 -5.113) 12.162 8.715 ( -2.043 -0.895 -4.378) 4.914 8.762 ( -4.234 -4.066 0.787) 5.923 9.121 ( 7.119 0.969 -2.135) 7.495 9.724 ( 9.534 5.981 -8.250) 13.955 9.979 ( -1.295 -5.734 -8.086) 9.997 10.034 ( 0.893 -3.663 -4.072) 5.549 10.420 ( 2.094 4.454 2.399) 5.475 10.638 ( 11.865 2.020 -0.545) 12.048 10.701 ( -0.606 -3.060 1.332) 3.392 10.909 ( -4.440 1.668 -0.320) 4.754 10.959 ( -8.054 -1.361 -4.674) 9.411 11.219 ( -3.976 -3.150 0.869) 5.147 11.322 ( -4.073 -0.050 -0.987) 4.191 11.705 ( -12.482 -0.270 8.486) 15.096 12.147 ( -4.664 3.892 -1.100) 6.173 12.183 ( -1.068 -0.537 -3.783) 3.967 12.617 ( 7.653 1.614 5.967) 9.838 13.929 ( 10.384 -0.883 3.540) 11.007 14.866 ( 16.203 -0.018 2.901) 16.460 15.888 ( -11.702 3.557 -1.951) 12.385 16.156 ( -6.030 -6.136 2.335) 8.914 16.633 ( 5.568 -1.109 -17.289) 18.198 ======================= Grid point 14 (9/282) ======================= q-point: ( 0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.954 ( 14.018 -2.674 6.586) 15.717 2.426 ( 14.943 -9.180 13.332) 22.029 2.921 ( -5.865 3.774 1.000) 7.046 3.390 ( 2.446 -0.556 2.064) 3.248 3.859 ( 14.475 -8.271 -3.220) 16.979 3.945 ( 8.043 3.095 11.162) 14.102 4.097 ( 8.662 -0.488 13.372) 15.940 4.292 ( 2.646 5.691 -3.964) 7.423 4.713 ( 2.716 -7.475 -6.427) 10.226 4.840 ( 3.028 6.099 -5.718) 8.891 5.150 ( -0.081 -10.351 -3.030) 10.785 5.389 ( -5.156 4.655 -17.754) 19.064 5.639 ( 3.692 10.773 -5.285) 12.555 6.009 ( 1.969 0.417 1.906) 2.772 6.098 ( 1.682 6.941 1.378) 7.273 6.499 ( 9.012 -0.840 2.661) 9.434 6.929 ( 11.151 -12.069 2.172) 16.575 7.077 ( -0.496 -4.561 4.308) 6.293 7.261 ( -12.474 -0.213 6.440) 14.040 7.348 ( -8.497 2.685 -2.869) 9.362 7.601 ( -6.124 0.674 0.483) 6.179 7.893 ( -5.947 9.105 4.473) 11.759 8.016 ( -8.891 4.502 6.108) 11.689 8.138 ( -4.906 -4.748 -2.761) 7.365 8.274 ( 1.102 -1.713 -5.822) 6.168 8.470 ( 3.646 -7.287 3.903) 9.035 8.680 ( 1.146 0.636 -0.903) 1.591 8.739 ( -4.559 -4.430 0.564) 6.381 9.211 ( 6.166 0.442 1.062) 6.273 9.727 ( 5.943 7.111 -4.542) 10.321 9.971 ( -2.859 -8.634 -4.501) 10.148 10.039 ( 3.127 -3.157 -3.084) 5.409 10.337 ( -2.590 10.832 -3.617) 11.710 10.739 ( 3.284 -0.851 -5.398) 6.375 10.751 ( 0.278 -0.753 1.638) 1.824 10.826 ( 5.296 -2.077 -1.559) 5.898 10.894 ( -5.992 -2.613 -0.917) 6.601 11.131 ( 0.108 2.960 0.045) 2.962 11.393 ( 0.577 -4.439 5.750) 7.287 11.609 ( -9.091 -2.482 4.063) 10.262 12.014 ( -5.881 6.711 -0.778) 8.957 12.135 ( -0.531 -0.791 -4.225) 4.331 12.745 ( 3.054 2.340 6.123) 7.232 14.104 ( 7.508 -0.905 2.076) 7.842 15.134 ( 16.045 0.074 1.393) 16.106 15.658 ( -12.966 2.758 -1.648) 13.358 16.164 ( -2.989 -6.904 4.028) 8.534 16.540 ( 2.746 1.079 -13.815) 14.127 ======================= Grid point 15 (10/282) ======================= q-point: ( 0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.169 ( 5.808 2.585 5.210) 8.219 2.743 ( 3.052 -4.416 7.954) 9.596 2.845 ( 0.547 2.073 0.599) 2.227 3.436 ( -1.203 -4.194 1.966) 4.785 3.762 ( -0.554 12.021 -10.823) 16.185 4.058 ( -3.770 -9.148 -11.565) 15.220 4.289 ( 5.142 2.843 11.689) 13.083 4.453 ( 3.710 -8.759 10.440) 14.124 4.622 ( -0.163 3.678 -14.656) 15.112 4.866 ( 1.248 1.751 5.851) 6.233 5.092 ( -6.513 -2.137 -14.381) 15.931 5.275 ( 2.281 -12.828 -1.686) 13.138 5.618 ( 4.579 15.054 3.477) 16.115 6.019 ( 0.093 11.186 4.282) 11.978 6.104 ( 3.376 5.284 2.826) 6.878 6.699 ( 8.688 -8.080 3.026) 12.245 6.908 ( -11.031 2.974 -2.206) 11.636 7.119 ( -7.263 -2.758 3.411) 8.485 7.217 ( -2.998 -7.329 1.471) 8.054 7.358 ( 10.658 -7.099 -1.452) 12.888 7.571 ( -0.485 -4.841 -2.079) 5.291 7.719 ( -7.547 9.002 -3.726) 12.324 7.902 ( -6.746 6.959 5.411) 11.100 8.128 ( 3.722 -1.489 0.291) 4.019 8.261 ( -1.090 -2.500 0.533) 2.779 8.613 ( -4.285 -4.675 11.592) 13.213 8.666 ( -4.695 -2.050 -1.146) 5.250 8.756 ( 9.455 2.344 -0.534) 9.756 9.318 ( 6.366 0.329 1.044) 6.459 9.734 ( 2.378 1.184 0.797) 2.774 9.821 ( -12.858 0.575 -4.212) 13.543 10.122 ( 7.935 -0.145 -5.722) 9.784 10.266 ( 4.273 1.537 0.209) 4.546 10.694 ( 1.435 -1.820 -7.455) 7.807 10.768 ( -4.457 3.493 6.987) 8.994 10.860 ( 1.247 0.858 0.200) 1.527 10.908 ( 6.650 -5.308 -7.821) 11.557 11.139 ( -2.100 5.396 6.208) 8.489 11.490 ( 0.831 -5.768 4.827) 7.567 11.572 ( -0.918 -4.713 -1.242) 4.959 11.871 ( -2.848 7.762 -2.027) 8.513 12.105 ( -0.217 -1.664 -2.241) 2.800 12.782 ( -2.952 2.349 4.540) 5.903 14.188 ( 1.508 -0.031 -0.435) 1.570 15.357 ( 6.973 0.591 -0.016) 6.998 15.439 ( -6.305 1.501 -0.995) 6.557 16.260 ( 2.169 -6.028 6.709) 9.276 16.448 ( 3.238 3.377 -9.689) 10.760 ======================= Grid point 16 (11/282) ======================= q-point: (-0.50 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.168 ( -5.415 10.764 4.411) 12.832 2.775 ( -2.417 3.699 -2.285) 4.975 2.827 ( 1.095 5.933 -4.347) 7.436 3.512 ( -3.559 -14.511 9.037) 17.461 3.571 ( -0.388 9.020 -9.276) 12.944 3.868 ( -10.355 -6.843 -13.548) 18.374 4.292 ( -7.495 2.443 -11.603) 14.028 4.442 ( -6.589 9.902 -2.958) 12.256 4.604 ( 0.254 -7.350 3.603) 8.189 4.910 ( -0.997 0.353 6.826) 6.908 5.026 ( 2.017 -8.012 1.119) 8.338 5.364 ( 1.156 -5.098 -2.829) 5.943 5.571 ( -4.296 7.063 9.146) 12.328 5.950 ( -0.634 13.654 3.186) 14.035 6.137 ( 0.385 5.580 6.549) 8.613 6.698 ( -9.264 5.919 1.060) 11.044 6.909 ( 0.900 -8.659 2.071) 8.948 7.117 ( -2.736 -10.098 -0.834) 10.495 7.202 ( 5.431 -2.269 -4.913) 7.666 7.472 ( -4.025 8.898 -4.062) 10.577 7.573 ( 0.668 -4.462 -1.362) 4.713 7.620 ( 6.924 -9.778 -6.343) 13.556 7.835 ( -1.249 1.224 4.018) 4.382 8.226 ( -1.425 0.010 5.296) 5.485 8.317 ( 8.774 0.305 1.387) 8.888 8.552 ( -11.582 0.108 5.889) 12.993 8.685 ( 1.135 -1.886 4.718) 5.206 8.909 ( 9.570 4.705 3.588) 11.252 9.373 ( 5.478 8.961 -3.145) 10.963 9.580 ( -10.597 -1.735 -3.504) 11.296 9.849 ( 4.166 -8.672 5.413) 11.039 10.158 ( 1.318 1.475 1.458) 2.457 10.352 ( 7.351 5.052 -0.559) 8.937 10.694 ( 4.620 -2.205 -8.645) 10.047 10.747 ( -4.371 3.106 7.297) 9.055 10.855 ( 1.747 -1.519 -3.813) 4.461 10.976 ( 3.549 -1.192 1.037) 3.885 11.098 ( -2.086 5.238 4.572) 7.259 11.554 ( 1.953 2.557 -4.163) 5.262 11.627 ( 1.305 -6.509 3.767) 7.633 11.826 ( 5.348 0.496 -1.851) 5.681 12.113 ( 1.324 -2.170 -1.012) 2.736 12.707 ( -8.855 1.709 1.781) 9.192 14.135 ( -5.702 0.569 -3.101) 6.516 15.165 ( -13.783 2.918 -2.440) 14.298 15.593 ( 11.268 -1.770 0.771) 11.432 16.410 ( 7.953 7.151 -4.217) 11.496 16.445 ( 4.233 -4.818 9.077) 11.114 ======================= Grid point 17 (12/282) ======================= q-point: (-0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.950 ( -12.700 17.697 2.295) 21.903 2.417 ( -14.318 20.559 -13.924) 28.663 2.875 ( 4.006 -4.454 -1.960) 6.303 3.392 ( -3.815 8.944 -9.085) 13.308 3.579 ( -9.773 -4.092 -10.018) 14.581 3.716 ( -8.635 -10.394 1.638) 13.612 3.986 ( -9.691 0.730 -9.003) 13.248 4.048 ( -18.301 15.974 -6.817) 25.230 4.689 ( 1.107 -5.327 2.285) 5.901 5.014 ( 0.723 -4.675 8.478) 9.708 5.180 ( 3.697 -5.299 5.811) 8.689 5.360 ( 1.222 0.074 0.392) 1.286 5.595 ( -7.222 -5.865 9.917) 13.598 5.879 ( -0.689 6.083 0.814) 6.176 6.173 ( 0.616 7.805 9.468) 12.286 6.569 ( -4.677 8.421 5.517) 11.100 6.810 ( -10.856 0.370 -1.402) 10.953 7.232 ( 1.801 -7.878 -5.130) 9.572 7.243 ( 3.169 0.814 -9.054) 9.627 7.350 ( 3.789 -3.599 -2.825) 5.941 7.558 ( -0.108 -5.637 -2.959) 6.367 7.762 ( 5.613 -5.985 0.242) 8.209 7.926 ( 6.611 -6.815 -3.385) 10.080 8.182 ( -9.028 -2.737 3.003) 9.900 8.376 ( -6.188 3.460 0.556) 7.112 8.528 ( 5.695 0.048 4.666) 7.362 8.829 ( 4.403 -1.025 11.344) 12.212 9.010 ( 6.800 8.757 3.082) 11.508 9.318 ( 7.979 16.396 -4.663) 18.821 9.481 ( -6.656 -6.911 1.642) 9.735 10.057 ( 5.240 -7.945 6.276) 11.401 10.175 ( -2.688 3.012 7.400) 8.430 10.391 ( 7.105 5.890 -6.083) 11.053 10.610 ( -5.036 3.170 -2.923) 6.630 10.740 ( -0.002 -1.080 -0.669) 1.271 10.864 ( 0.284 0.550 2.579) 2.652 11.052 ( 2.072 3.905 4.853) 6.565 11.205 ( 11.533 -3.001 5.649) 13.188 11.480 ( 0.801 6.453 -5.555) 8.552 11.724 ( 5.509 -1.143 -1.146) 5.741 11.952 ( 6.975 -6.088 0.330) 9.264 12.154 ( 3.648 -2.154 -1.720) 4.572 12.535 ( -13.478 -0.513 -0.273) 13.491 13.967 ( -10.309 0.252 -4.488) 11.246 14.898 ( -14.220 3.049 -3.681) 15.002 15.766 ( 7.803 -3.535 0.803) 8.604 16.444 ( 8.678 8.956 -2.228) 12.668 16.667 ( 6.696 0.311 14.202) 15.704 ======================= Grid point 18 (13/282) ======================= q-point: (-0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.572 ( -16.556 24.162 -1.280) 29.319 1.833 ( -20.062 24.836 -15.134) 35.332 2.887 ( -21.266 27.359 -10.739) 36.278 2.956 ( -2.381 3.147 -9.473) 10.262 3.330 ( -10.628 -2.432 -9.630) 14.547 3.439 ( -8.908 2.313 -9.023) 12.889 3.650 ( -6.355 10.324 -7.365) 14.185 4.141 ( -0.619 -22.203 9.985) 24.353 4.765 ( 2.269 -2.796 1.624) 3.950 5.069 ( -3.361 3.351 3.799) 6.079 5.283 ( -0.573 0.429 7.585) 7.618 5.465 ( 3.893 -11.287 1.477) 12.031 5.614 ( -6.627 -7.676 7.439) 12.577 5.864 ( -0.457 -5.048 -1.463) 5.275 6.187 ( -1.638 10.932 7.882) 13.577 6.528 ( 0.070 11.603 8.073) 14.135 6.676 ( -4.769 3.860 2.602) 6.665 7.048 ( -1.875 10.418 -7.082) 12.736 7.323 ( 4.257 -4.293 -9.801) 11.516 7.421 ( 1.818 -20.023 -7.164) 21.343 7.641 ( 2.365 -10.311 -1.089) 10.634 7.873 ( 0.851 -3.788 4.499) 5.943 8.018 ( 5.356 -6.027 -6.736) 10.506 8.105 ( -5.285 -4.740 0.472) 7.115 8.258 ( -5.145 -0.388 -2.160) 5.594 8.653 ( 3.077 0.123 5.425) 6.238 8.939 ( 3.009 5.715 3.358) 7.280 9.089 ( 1.987 3.624 4.587) 6.175 9.336 ( 16.925 23.537 4.006) 29.265 9.499 ( -3.762 -9.310 5.480) 11.440 10.133 ( -9.450 4.707 9.999) 14.541 10.245 ( 7.499 2.642 5.521) 9.679 10.324 ( 1.329 -2.100 -13.293) 13.523 10.530 ( 0.947 10.524 2.502) 10.858 10.743 ( 2.016 0.427 -0.825) 2.220 10.963 ( 4.172 -2.887 4.084) 6.513 11.103 ( 1.798 -0.237 7.105) 7.332 11.341 ( -2.976 7.501 -1.779) 8.264 11.525 ( 14.631 0.678 4.143) 15.221 11.786 ( 9.038 0.358 -7.986) 12.066 12.093 ( 4.322 -6.020 0.301) 7.417 12.218 ( 4.085 -1.476 -1.056) 4.470 12.335 ( -13.662 -4.895 -0.225) 14.515 13.756 ( -10.993 0.023 -4.447) 11.859 14.628 ( -12.888 2.658 -4.179) 13.806 15.894 ( 3.300 -5.925 0.436) 6.796 16.467 ( 5.466 9.965 -0.968) 11.407 16.918 ( 8.849 7.290 19.030) 22.217 ======================= Grid point 19 (14/282) ======================= q-point: (-0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.070 ( -17.911 30.257 -4.678) 35.471 1.173 ( -18.778 31.506 -12.813) 38.851 1.952 ( -27.752 56.893 -13.134) 64.650 2.949 ( 1.073 -6.821 -10.842) 12.854 3.118 ( -7.154 0.225 -6.047) 9.370 3.281 ( -4.020 -2.718 -5.778) 7.545 3.480 ( -1.273 7.357 -3.835) 8.393 4.373 ( -0.796 -19.983 5.321) 20.694 4.827 ( 3.632 1.519 0.535) 3.973 4.977 ( -4.646 7.925 0.867) 9.227 5.310 ( -3.112 -1.435 4.208) 5.427 5.593 ( -0.528 -8.836 2.329) 9.153 5.712 ( 0.634 -15.702 3.193) 16.036 5.904 ( -0.547 -10.870 -1.527) 10.990 6.122 ( -2.088 12.029 3.911) 12.820 6.523 ( 2.377 15.435 6.424) 16.887 6.615 ( -1.615 11.469 3.816) 12.195 6.923 ( 0.249 3.875 -3.941) 5.532 7.301 ( 3.054 -2.981 -10.476) 11.312 7.550 ( 1.270 -23.315 -5.428) 23.972 7.704 ( -2.276 -9.429 -0.754) 9.729 7.940 ( -0.885 -3.202 4.322) 5.451 8.053 ( 3.538 -4.002 -7.233) 8.991 8.118 ( -2.638 -6.831 2.253) 7.661 8.198 ( 1.062 0.205 -3.039) 3.226 8.718 ( -1.525 -2.353 4.099) 4.966 8.965 ( 5.062 7.156 0.061) 8.765 9.065 ( 0.088 7.125 -1.377) 7.257 9.510 ( 10.871 11.768 12.754) 20.477 9.616 ( 4.124 -2.028 7.896) 9.136 9.996 ( -7.946 4.336 -0.318) 9.058 10.292 ( 0.043 -4.340 -0.614) 4.384 10.394 ( 12.735 8.536 3.832) 15.803 10.484 ( 2.352 13.669 1.390) 13.939 10.803 ( 5.486 3.542 4.463) 7.910 10.993 ( -2.012 2.428 0.645) 3.219 11.155 ( -5.551 10.197 -4.304) 12.382 11.321 ( 9.101 -6.730 6.542) 13.073 11.645 ( 1.207 -3.377 -7.909) 8.685 11.927 ( 10.870 -1.910 3.124) 11.470 12.145 ( -4.478 -5.072 0.669) 6.799 12.224 ( -0.409 -1.237 1.622) 2.081 12.297 ( 3.512 -2.832 -2.855) 5.339 13.569 ( -7.715 0.428 -2.999) 8.288 14.408 ( -8.328 2.076 -3.029) 9.102 15.959 ( -2.420 -8.303 -0.063) 8.649 16.434 ( 1.366 10.125 -0.423) 10.226 17.211 ( 12.688 13.205 25.356) 31.278 ======================= Grid point 20 (15/282) ======================= q-point: (-0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.562 ( -0.000 36.667 0.000) 36.667 0.652 ( -0.000 42.266 0.000) 42.266 1.113 ( -0.000 72.345 0.000) 72.345 2.883 ( 0.000 -1.202 -0.000) 1.202 3.026 ( -0.000 0.630 0.000) 0.630 3.239 ( 0.000 -2.313 -0.000) 2.313 3.403 ( -0.000 5.588 0.000) 5.588 4.524 ( 0.000 -15.736 -0.000) 15.736 4.839 ( -0.000 10.431 0.000) 10.431 4.871 ( -0.000 1.907 0.000) 1.907 5.319 ( 0.000 -1.976 -0.000) 1.976 5.665 ( 0.000 -9.693 -0.000) 9.693 5.872 ( 0.000 -18.047 -0.000) 18.047 5.984 ( 0.000 -13.504 -0.000) 13.504 6.029 ( -0.000 12.730 0.000) 12.730 6.459 ( -0.000 16.658 0.000) 16.658 6.517 ( -0.000 15.048 0.000) 15.048 6.898 ( -0.000 0.716 0.000) 0.716 7.273 ( 0.000 -1.107 -0.000) 1.107 7.707 ( 0.000 -20.895 -0.000) 20.895 7.746 ( 0.000 -9.624 -0.000) 9.624 7.964 ( -0.000 1.476 0.000) 1.476 8.052 ( -0.000 1.064 0.000) 1.064 8.146 ( 0.000 -5.560 -0.000) 5.560 8.209 ( 0.000 -0.918 -0.000) 0.918 8.743 ( 0.000 -3.780 -0.000) 3.780 8.972 ( -0.000 5.455 0.000) 5.455 8.987 ( -0.000 7.756 0.000) 7.756 9.671 ( 0.000 -8.276 -0.000) 8.276 9.781 ( -0.000 2.572 0.000) 2.572 9.857 ( -0.000 1.204 0.000) 1.204 10.337 ( 0.000 -6.480 -0.000) 6.480 10.409 ( -0.000 12.653 0.000) 12.653 10.592 ( -0.000 4.875 0.000) 4.875 10.863 ( -0.000 9.525 0.000) 9.525 10.937 ( -0.000 0.839 0.000) 0.839 10.986 ( -0.000 7.452 0.000) 7.452 11.505 ( -0.000 1.502 0.000) 1.502 11.616 ( 0.000 -17.644 -0.000) 17.644 12.023 ( 0.000 -0.049 -0.000) 0.049 12.171 ( 0.000 -2.582 -0.000) 2.582 12.256 ( -0.000 0.053 0.000) 0.053 12.329 ( 0.000 -1.732 -0.000) 1.732 13.485 ( -0.000 0.799 0.000) 0.799 14.312 ( -0.000 1.390 0.000) 1.390 15.963 ( 0.000 -5.994 -0.000) 5.994 16.362 ( -0.000 9.559 0.000) 9.559 17.540 ( 0.000 -0.823 -0.000) 0.823 ======================= Grid point 23 (16/282) ======================= q-point: ( 0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.937 ( 15.077 -0.000 9.379) 17.756 2.350 ( 16.811 -0.000 13.233) 21.395 2.952 ( -6.745 0.000 1.253) 6.860 3.399 ( 2.930 -0.000 -0.584) 2.988 3.747 ( 20.154 -0.000 1.745) 20.230 4.038 ( 10.167 -0.000 17.536) 20.270 4.041 ( 4.310 -0.000 12.988) 13.685 4.375 ( -1.897 0.000 -18.625) 18.722 4.631 ( 4.299 -0.000 -2.563) 5.005 4.904 ( 9.272 -0.000 0.641) 9.294 5.050 ( -5.245 0.000 -8.305) 9.823 5.416 ( -5.742 0.000 -23.052) 23.756 5.757 ( 5.475 -0.000 -5.711) 7.911 6.036 ( 2.189 -0.000 6.653) 7.004 6.089 ( 2.936 -0.000 0.632) 3.003 6.595 ( 4.715 -0.000 5.132) 6.969 6.735 ( 12.209 -0.000 2.777) 12.521 7.056 ( 2.060 -0.000 2.188) 3.005 7.260 ( -14.564 0.000 7.176) 16.236 7.366 ( -7.862 0.000 -3.487) 8.601 7.615 ( -10.556 0.000 2.271) 10.798 7.976 ( -8.150 0.000 4.631) 9.373 8.045 ( -7.755 0.000 9.761) 12.467 8.089 ( -3.517 0.000 -5.247) 6.316 8.259 ( 0.743 -0.000 -7.111) 7.150 8.403 ( 4.160 -0.000 6.845) 8.010 8.691 ( -4.080 0.000 0.729) 4.145 8.701 ( 2.862 -0.000 -0.516) 2.908 9.220 ( 6.802 -0.000 -0.554) 6.825 9.827 ( 8.384 -0.000 -8.097) 11.656 9.862 ( -1.073 0.000 -5.764) 5.863 10.001 ( 0.664 -0.000 0.854) 1.082 10.466 ( -1.253 0.000 -4.882) 5.040 10.666 ( -4.313 0.000 3.229) 5.387 10.756 ( 6.350 -0.000 -12.942) 14.416 10.827 ( 3.537 -0.000 4.223) 5.508 10.876 ( -3.524 0.000 -0.037) 3.525 11.154 ( 0.676 -0.000 -1.384) 1.540 11.358 ( 1.822 -0.000 5.474) 5.770 11.588 ( -11.744 0.000 6.005) 13.190 12.081 ( -9.500 0.000 7.070) 11.842 12.114 ( 3.107 -0.000 -12.741) 13.114 12.765 ( 2.139 -0.000 7.330) 7.635 14.097 ( 8.088 -0.000 1.933) 8.316 15.135 ( 16.154 -0.000 1.213) 16.200 15.685 ( -13.517 0.000 -1.821) 13.639 16.105 ( -1.611 0.000 3.921) 4.239 16.548 ( 4.005 -0.000 -14.435) 14.980 ======================= Grid point 24 (17/282) ======================= q-point: ( 0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.212 ( 9.684 2.209 9.063) 13.446 2.676 ( 7.414 -3.292 12.138) 14.599 2.863 ( -4.811 0.505 0.848) 4.911 3.432 ( 3.074 1.930 -2.569) 4.447 3.818 ( -3.239 -3.829 -10.215) 11.380 4.062 ( -0.978 10.170 -10.921) 14.955 4.259 ( 2.052 -9.948 -1.279) 10.238 4.339 ( 3.338 -1.397 13.942) 14.404 4.683 ( 4.571 3.005 -2.817) 6.153 4.891 ( -2.321 1.328 -2.969) 3.995 5.071 ( -8.281 -0.547 -17.850) 19.685 5.110 ( 4.882 -7.148 1.841) 8.849 5.849 ( 10.778 11.665 1.500) 15.952 6.104 ( 1.999 4.694 6.234) 8.056 6.192 ( 3.502 -1.845 5.251) 6.575 6.641 ( 0.714 3.026 3.595) 4.753 6.940 ( -4.605 0.716 -2.265) 5.182 7.017 ( 3.102 -11.480 3.948) 12.530 7.087 ( -13.955 -2.739 2.803) 14.494 7.329 ( 3.274 0.449 -4.164) 5.316 7.523 ( -2.809 -1.525 -0.500) 3.235 7.821 ( -9.078 3.763 -3.977) 10.602 7.984 ( -8.687 3.163 6.925) 11.551 8.103 ( 8.122 -1.411 -0.186) 8.246 8.225 ( -2.239 -1.571 1.261) 3.012 8.552 ( -2.158 -2.406 14.708) 15.059 8.639 ( -4.093 -1.141 0.549) 4.285 8.784 ( 8.808 0.983 0.294) 8.867 9.319 ( 6.037 -0.055 1.673) 6.265 9.771 ( -2.448 1.661 -3.310) 4.439 9.808 ( -5.891 -0.266 -2.158) 6.280 10.109 ( 12.571 -1.619 -5.075) 13.653 10.324 ( -1.470 4.748 -4.797) 6.908 10.642 ( -4.311 -4.140 0.912) 6.047 10.781 ( 8.428 -0.580 -9.823) 12.956 10.862 ( 2.840 -0.666 -0.909) 3.055 10.903 ( 1.808 2.747 2.626) 4.208 11.192 ( 0.383 1.150 5.805) 5.931 11.438 ( 0.885 0.182 3.202) 3.327 11.497 ( -4.128 -4.672 1.330) 6.375 11.983 ( -2.538 6.458 -3.090) 7.595 12.063 ( -1.757 -3.995 -2.390) 4.975 12.815 ( -4.227 1.412 6.939) 8.247 14.188 ( 2.329 -0.034 -0.748) 2.446 15.365 ( 12.481 0.364 0.095) 12.487 15.462 ( -11.935 1.109 -1.635) 12.097 16.186 ( 4.470 -2.959 5.587) 7.743 16.483 ( 4.924 1.154 -10.510) 11.664 ======================= Grid point 25 (18/282) ======================= q-point: (-0.60 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.340 ( 0.808 10.788 8.892) 14.003 2.773 ( -0.598 0.308 1.048) 1.245 2.916 ( 1.714 -0.943 5.285) 5.636 3.372 ( -5.839 -0.868 -1.466) 6.082 3.644 ( -7.035 -3.407 -11.871) 14.214 3.833 ( -3.874 5.088 -13.781) 15.192 4.292 ( -2.481 -2.617 -8.216) 8.973 4.444 ( -3.294 -6.554 2.429) 7.727 4.580 ( -4.152 3.028 -10.483) 11.675 4.835 ( 1.341 -5.512 -4.777) 7.416 5.010 ( 2.128 0.804 12.820) 13.021 5.259 ( 1.963 -5.321 5.018) 7.573 5.788 ( -4.956 18.788 1.248) 19.471 6.154 ( 0.839 7.311 7.395) 10.433 6.248 ( 0.842 9.968 4.793) 11.093 6.699 ( -3.541 -13.622 1.497) 14.154 6.792 ( -5.386 4.089 2.393) 7.173 6.986 ( -8.297 -6.947 1.361) 10.907 7.164 ( 3.074 -2.902 -2.633) 4.980 7.388 ( 7.872 -12.864 -5.354) 16.004 7.534 ( 4.838 -1.974 -5.492) 7.580 7.613 ( -6.983 5.598 -5.256) 10.379 7.890 ( -7.623 3.794 6.868) 10.940 8.207 ( -6.510 -1.856 5.735) 8.873 8.319 ( 16.015 0.138 0.648) 16.029 8.564 ( -10.975 1.295 8.216) 13.771 8.647 ( -0.504 -2.595 6.203) 6.743 8.959 ( 10.346 1.815 5.878) 12.037 9.441 ( 6.522 0.156 2.187) 6.880 9.596 ( -10.290 1.933 -4.108) 11.247 9.775 ( 1.823 -0.068 1.574) 2.410 10.184 ( 4.882 1.856 -4.152) 6.672 10.379 ( 7.837 -0.623 1.766) 8.058 10.647 ( 1.766 -3.870 -1.614) 4.550 10.766 ( 5.923 -0.855 -14.989) 16.139 10.884 ( 0.234 4.364 1.271) 4.551 10.965 ( 3.487 0.519 6.768) 7.631 11.196 ( -3.550 6.850 6.184) 9.888 11.493 ( 0.908 -9.070 3.954) 9.936 11.557 ( 4.385 -1.547 -1.554) 4.902 11.879 ( 3.297 4.645 -8.243) 10.020 12.069 ( -1.355 -3.268 2.438) 4.296 12.749 ( -9.703 3.057 4.794) 11.246 14.138 ( -5.974 -0.126 -3.838) 7.102 15.222 ( -12.196 3.992 -2.888) 13.153 15.561 ( 9.759 -2.297 0.385) 10.033 16.376 ( 8.041 -3.721 6.892) 11.225 16.497 ( 9.824 3.996 -4.471) 11.510 ======================= Grid point 26 (19/282) ======================= q-point: (-0.50 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.241 ( -7.765 19.971 7.150) 22.588 2.713 ( -8.723 15.459 -9.600) 20.179 2.834 ( 0.871 0.809 -2.244) 2.540 3.420 ( -6.227 -15.494 7.240) 18.200 3.450 ( -7.070 -7.435 -5.332) 11.563 3.613 ( -3.261 5.268 -11.812) 13.338 4.008 ( -9.516 4.601 -19.703) 22.359 4.330 ( -10.838 12.482 -2.308) 16.691 4.567 ( 0.808 -11.211 -1.797) 11.383 4.886 ( 3.353 -6.042 -0.969) 6.978 5.184 ( 1.464 2.637 16.374) 16.649 5.333 ( 0.326 -3.359 0.645) 3.436 5.568 ( -10.739 5.816 4.300) 12.948 6.108 ( -0.934 19.872 5.049) 20.525 6.267 ( 1.572 3.090 7.589) 8.344 6.662 ( -5.757 2.131 5.498) 8.241 6.789 ( -6.999 -4.052 0.196) 8.090 6.940 ( -3.391 -15.695 -3.045) 16.343 7.242 ( 7.860 -5.694 -4.247) 10.594 7.413 ( -4.910 7.408 -6.180) 10.825 7.519 ( -0.350 -2.899 -6.918) 7.509 7.592 ( 7.523 -12.792 -3.485) 15.244 7.882 ( 1.242 0.085 4.283) 4.460 8.135 ( -10.760 -3.173 3.408) 11.725 8.403 ( -14.610 0.336 1.944) 14.742 8.550 ( 13.177 2.610 0.742) 13.453 8.793 ( 5.234 -2.771 10.871) 12.380 9.136 ( 6.738 6.413 8.233) 12.423 9.400 ( -6.785 -1.353 -1.885) 7.171 9.551 ( 9.510 11.217 -0.236) 14.708 9.914 ( 5.739 -9.258 7.045) 12.972 10.207 ( -0.427 1.419 4.444) 4.685 10.451 ( 2.916 2.313 -5.193) 6.389 10.644 ( 4.829 0.292 -10.007) 11.115 10.742 ( -0.841 -0.734 -0.936) 1.457 10.893 ( 2.809 4.375 2.271) 5.673 11.116 ( 8.041 2.699 6.947) 10.964 11.180 ( 2.283 2.183 5.545) 6.382 11.549 ( 0.514 1.935 -3.725) 4.229 11.658 ( 4.890 -6.387 3.801) 8.897 11.894 ( 9.262 -2.228 -6.969) 11.803 12.111 ( 0.834 -3.056 1.681) 3.586 12.574 ( -13.586 4.961 2.101) 14.615 13.955 ( -11.918 -1.657 -5.520) 13.238 14.961 ( -12.724 4.869 -4.538) 14.359 15.711 ( 6.209 -3.701 0.634) 7.256 16.539 ( 7.562 3.030 0.939) 8.200 16.683 ( 14.533 2.283 8.294) 16.888 ======================= Grid point 27 (20/282) ======================= q-point: (-0.40 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.963 ( -11.771 26.654 3.036) 29.296 2.220 ( -16.365 25.319 -12.048) 32.466 2.866 ( 2.036 -3.545 -2.923) 5.026 3.252 ( -8.847 -4.516 -7.569) 12.488 3.390 ( -3.814 14.102 -9.894) 17.644 3.485 ( -10.696 7.018 -8.787) 15.521 3.807 ( -2.700 -17.620 3.975) 18.264 3.908 ( -13.775 23.636 -4.948) 27.801 4.660 ( 1.638 -10.432 -0.260) 10.563 5.009 ( 3.759 -8.746 0.160) 9.521 5.292 ( -3.503 0.374 10.454) 11.032 5.364 ( 0.917 -2.964 -0.326) 3.119 5.500 ( -6.145 -6.084 6.750) 10.970 5.975 ( -1.250 17.939 2.343) 18.134 6.339 ( 0.924 7.870 7.445) 10.873 6.628 ( -3.310 -1.268 4.461) 5.698 6.726 ( -1.970 4.816 6.615) 8.416 7.027 ( -1.416 -22.797 -5.014) 23.385 7.211 ( -2.517 9.665 -8.330) 13.006 7.322 ( 2.287 -2.634 -8.114) 8.832 7.498 ( 0.065 -7.930 -0.005) 7.931 7.752 ( 3.904 -13.112 -2.772) 13.959 7.941 ( 0.126 -2.175 -0.155) 2.184 8.032 ( -7.681 -4.659 0.940) 9.033 8.224 ( -8.721 -3.984 -1.755) 9.748 8.678 ( 5.012 2.996 2.021) 6.179 8.984 ( 4.454 0.161 7.788) 8.973 9.201 ( 4.605 10.735 2.096) 11.868 9.374 ( -3.629 -6.591 4.685) 8.863 9.626 ( 12.223 14.824 4.075) 19.641 10.144 ( 2.918 -5.635 6.799) 9.300 10.244 ( -1.340 0.930 9.414) 9.554 10.337 ( 1.245 2.437 -12.737) 13.028 10.690 ( 9.634 5.702 -1.792) 11.337 10.726 ( 1.537 -0.597 -1.392) 2.158 10.923 ( 1.719 0.660 2.694) 3.263 11.147 ( -3.559 5.885 6.161) 9.233 11.396 ( 6.275 -0.554 5.126) 8.121 11.547 ( 9.199 1.568 0.925) 9.378 11.801 ( 7.858 -0.120 -0.980) 7.920 11.999 ( 7.370 -5.637 -6.481) 11.318 12.174 ( 3.228 -4.086 -0.809) 5.270 12.325 ( -15.285 4.907 2.402) 16.232 13.728 ( -12.843 -3.716 -5.207) 14.348 14.687 ( -11.894 4.808 -4.925) 13.742 15.813 ( 2.154 -4.832 0.313) 5.300 16.603 ( 5.236 7.541 0.326) 9.186 16.997 ( 15.009 3.403 13.201) 20.276 ======================= Grid point 28 (21/282) ======================= q-point: (-0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.538 ( -14.398 30.924 -3.539) 34.294 1.682 ( -10.800 34.075 -6.060) 36.256 2.837 ( -10.520 46.571 -5.549) 48.065 2.884 ( -1.070 7.860 -7.877) 11.179 3.109 ( -6.569 -1.959 -4.847) 8.396 3.239 ( -5.335 -2.604 -6.703) 8.954 3.619 ( -3.252 11.142 -2.637) 11.903 4.036 ( -0.527 -24.039 5.848) 24.746 4.762 ( 1.815 -8.840 0.196) 9.027 5.073 ( -0.055 1.034 0.320) 1.084 5.283 ( -5.457 -2.418 3.747) 7.047 5.457 ( 3.815 -9.479 0.697) 10.241 5.539 ( -3.372 -5.868 4.574) 8.168 5.868 ( -0.357 8.875 0.199) 8.884 6.299 ( -1.516 10.845 2.939) 11.338 6.698 ( 3.093 3.020 6.695) 7.969 6.746 ( -0.373 8.484 9.000) 12.374 7.014 ( -2.310 6.470 -7.786) 10.384 7.156 ( -0.264 -24.002 -4.400) 24.403 7.266 ( 0.305 -2.934 -8.257) 8.768 7.565 ( -1.696 -9.033 -0.418) 9.201 7.857 ( -0.715 -8.279 3.340) 8.956 7.934 ( 0.415 -9.556 -5.567) 11.067 8.012 ( -3.573 -6.713 1.002) 7.671 8.178 ( 0.062 -3.387 -2.189) 4.034 8.713 ( 0.015 1.718 2.124) 2.732 9.072 ( 4.049 5.272 2.753) 7.195 9.179 ( 1.504 9.197 -0.708) 9.346 9.431 ( -2.319 -7.990 4.309) 9.369 9.761 ( 8.889 10.210 7.480) 15.466 10.104 ( -6.662 8.927 -0.069) 11.139 10.221 ( 0.744 -4.128 -2.993) 5.153 10.466 ( 10.563 1.869 5.049) 11.856 10.709 ( 5.713 10.823 0.592) 12.253 10.843 ( 11.212 1.907 0.574) 11.388 11.015 ( 0.747 -9.120 3.744) 9.887 11.060 ( -8.175 0.104 -0.282) 8.181 11.435 ( 0.283 10.072 8.795) 13.374 11.695 ( 5.112 9.025 -8.224) 13.237 11.865 ( 4.842 -4.756 -3.412) 7.596 12.044 ( -0.805 -7.351 1.514) 7.548 12.201 ( -0.830 -1.576 3.156) 3.624 12.255 ( 3.874 -2.394 -1.340) 4.747 13.547 ( -8.718 -3.973 -3.279) 10.127 14.456 ( -7.802 4.233 -3.327) 9.480 15.857 ( -1.324 -5.445 -0.183) 5.606 16.590 ( 1.859 9.863 -0.002) 10.037 17.321 ( 12.563 3.081 13.899) 18.987 ======================= Grid point 29 (22/282) ======================= q-point: (-0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.112 ( -0.000 35.476 0.000) 35.476 1.280 ( -0.000 40.048 0.000) 40.048 2.191 ( -0.000 68.913 0.000) 68.913 2.861 ( 0.000 -1.628 -0.000) 1.628 3.034 ( -0.000 0.182 0.000) 0.182 3.194 ( 0.000 -3.561 -0.000) 3.561 3.513 ( -0.000 8.693 0.000) 8.693 4.235 ( 0.000 -21.774 -0.000) 21.774 4.839 ( 0.000 -6.219 -0.000) 6.219 5.020 ( -0.000 10.372 0.000) 10.372 5.279 ( 0.000 -3.192 -0.000) 3.192 5.554 ( 0.000 -4.568 -0.000) 4.568 5.610 ( 0.000 -15.666 -0.000) 15.666 5.842 ( 0.000 -2.386 -0.000) 2.386 6.216 ( -0.000 11.562 0.000) 11.562 6.694 ( -0.000 13.568 0.000) 13.568 6.727 ( -0.000 11.580 0.000) 11.580 6.918 ( -0.000 1.970 0.000) 1.970 7.244 ( 0.000 -2.782 -0.000) 2.782 7.333 ( 0.000 -27.268 -0.000) 27.268 7.605 ( 0.000 -8.714 -0.000) 8.714 7.927 ( 0.000 -5.417 -0.000) 5.417 7.989 ( 0.000 -9.253 -0.000) 9.253 8.041 ( 0.000 -7.626 -0.000) 7.626 8.194 ( 0.000 -1.833 -0.000) 1.833 8.713 ( -0.000 0.032 0.000) 0.032 9.093 ( -0.000 10.266 0.000) 10.266 9.093 ( -0.000 5.530 0.000) 5.530 9.509 ( 0.000 -10.648 -0.000) 10.648 9.836 ( -0.000 4.418 0.000) 4.418 9.956 ( -0.000 9.925 0.000) 9.925 10.249 ( 0.000 -4.778 -0.000) 4.778 10.547 ( -0.000 5.688 0.000) 5.688 10.740 ( -0.000 12.540 0.000) 12.540 10.932 ( -0.000 1.417 0.000) 1.417 10.960 ( -0.000 2.791 0.000) 2.791 11.101 ( 0.000 -6.330 -0.000) 6.330 11.451 ( -0.000 8.141 0.000) 8.141 11.532 ( -0.000 1.844 0.000) 1.844 11.948 ( 0.000 -9.508 -0.000) 9.508 12.123 ( 0.000 -3.517 -0.000) 3.517 12.243 ( 0.000 -1.848 -0.000) 1.848 12.297 ( 0.000 -2.138 -0.000) 2.138 13.483 ( 0.000 -1.944 -0.000) 1.944 14.347 ( -0.000 3.354 0.000) 3.354 15.876 ( 0.000 -5.239 -0.000) 5.239 16.522 ( -0.000 10.837 0.000) 10.837 17.522 ( 0.000 -1.565 -0.000) 1.565 ======================= Grid point 34 (23/282) ======================= q-point: ( 0.30 -0.70 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.440 ( 5.453 -0.000 10.768) 12.070 2.801 ( -3.170 0.000 0.222) 3.178 2.845 ( 0.568 -0.000 12.373) 12.386 3.423 ( -1.591 0.000 -7.211) 7.384 3.565 ( -11.931 0.000 -11.354) 16.470 3.910 ( -2.609 0.000 -17.221) 17.418 4.245 ( 3.095 -0.000 -2.987) 4.302 4.390 ( -4.821 0.000 3.488) 5.951 4.610 ( -9.921 0.000 -24.036) 26.003 4.786 ( 4.510 -0.000 1.566) 4.774 5.014 ( 3.642 -0.000 12.168) 12.701 5.222 ( 1.558 -0.000 9.148) 9.280 6.013 ( 0.919 -0.000 -1.311) 1.601 6.175 ( -3.123 0.000 1.263) 3.368 6.305 ( 2.661 -0.000 11.520) 11.823 6.591 ( -8.946 0.000 3.857) 9.742 6.875 ( -5.978 0.000 3.495) 6.925 6.890 ( -8.620 0.000 -0.235) 8.624 7.121 ( 10.042 -0.000 -0.301) 10.046 7.281 ( 0.874 -0.000 -9.444) 9.485 7.520 ( 5.642 -0.000 -3.828) 6.818 7.657 ( -7.311 0.000 -5.708) 9.275 7.922 ( -9.025 0.000 7.129) 11.501 8.190 ( -7.404 0.000 5.902) 9.468 8.321 ( 17.737 -0.000 0.462) 17.743 8.579 ( -11.226 0.000 10.615) 15.450 8.622 ( 0.177 -0.000 5.163) 5.166 8.971 ( 10.167 -0.000 6.737) 12.197 9.435 ( 5.700 -0.000 4.778) 7.437 9.602 ( -9.451 0.000 -3.589) 10.109 9.796 ( 1.127 -0.000 -0.742) 1.350 10.202 ( 6.399 -0.000 -7.426) 9.803 10.368 ( 7.865 -0.000 3.376) 8.559 10.608 ( -0.069 0.000 1.303) 1.305 10.758 ( 8.335 -0.000 -20.953) 22.550 10.913 ( 4.531 -0.000 0.159) 4.534 10.985 ( -0.540 0.000 9.493) 9.509 11.270 ( -0.960 0.000 9.647) 9.694 11.400 ( -1.990 0.000 0.390) 2.027 11.539 ( 6.132 -0.000 -0.117) 6.133 11.926 ( 4.567 -0.000 -16.845) 17.454 12.035 ( -4.718 0.000 10.454) 11.469 12.776 ( -9.582 0.000 5.761) 11.180 14.136 ( -6.272 0.000 -4.207) 7.553 15.259 ( -11.837 0.000 -3.082) 12.232 15.538 ( 9.231 -0.000 0.278) 9.235 16.346 ( 9.691 -0.000 5.890) 11.341 16.528 ( 10.598 -0.000 -4.440) 11.491 ======================= Grid point 36 (24/282) ======================= q-point: (-0.60 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.527 ( -2.420 15.020 10.935) 18.735 2.778 ( 1.784 -0.011 -1.822) 2.550 2.932 ( -5.599 0.250 2.530) 6.149 3.217 ( -11.108 -1.543 -0.081) 11.215 3.329 ( -11.842 -9.676 -8.771) 17.629 3.698 ( -2.939 3.500 -14.677) 15.372 4.122 ( -6.195 10.113 -17.962) 21.523 4.340 ( 1.399 -12.911 -5.683) 14.176 4.432 ( 0.688 -0.255 -1.177) 1.387 4.851 ( 2.535 -0.491 0.179) 2.588 5.220 ( 2.725 1.603 16.424) 16.725 5.292 ( -3.877 -1.608 7.908) 8.952 5.791 ( -10.790 20.883 -4.151) 23.870 6.173 ( -3.836 -16.380 -1.832) 16.922 6.393 ( -0.905 13.569 10.377) 17.107 6.559 ( -6.814 -7.171 9.097) 13.439 6.790 ( -2.507 3.701 3.763) 5.843 6.841 ( -5.518 -2.634 0.042) 6.115 7.188 ( 5.339 0.640 -6.122) 8.148 7.312 ( 6.625 -14.523 -9.415) 18.532 7.500 ( -4.262 2.755 -6.046) 7.894 7.551 ( 1.804 0.384 -4.446) 4.813 7.892 ( -1.959 0.595 6.195) 6.525 8.097 ( -11.272 -1.404 3.883) 12.004 8.402 ( -17.486 -0.194 1.791) 17.579 8.586 ( 15.306 1.497 -0.902) 15.406 8.761 ( 6.021 -1.160 10.498) 12.157 9.180 ( 3.724 0.351 12.621) 13.164 9.448 ( -1.560 5.909 -3.768) 7.179 9.611 ( 7.603 -3.385 5.665) 10.068 9.836 ( 3.238 -0.314 3.704) 4.930 10.222 ( 0.642 0.512 1.917) 2.085 10.478 ( 2.606 1.225 -3.448) 4.492 10.644 ( 4.769 0.183 -4.903) 6.842 10.697 ( 5.724 -3.247 -8.967) 11.123 10.967 ( 3.866 3.378 -0.149) 5.136 11.106 ( 7.785 -1.381 5.836) 9.827 11.298 ( -1.097 9.775 9.184) 13.457 11.485 ( 3.244 -8.636 3.432) 9.843 11.614 ( 4.172 0.088 -1.335) 4.381 11.864 ( 9.066 -1.449 -14.356) 17.041 12.080 ( -2.353 -0.829 8.129) 8.503 12.646 ( -11.593 3.139 3.218) 12.434 13.929 ( -13.572 -1.185 -6.564) 15.123 15.026 ( -12.139 2.727 -5.324) 13.533 15.663 ( 5.588 -2.027 0.784) 5.995 16.553 ( 9.185 -0.063 4.875) 10.398 16.721 ( 16.788 1.759 2.580) 17.076 ======================= Grid point 37 (25/282) ======================= q-point: (-0.50 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.367 ( -8.205 25.634 5.563) 27.484 2.580 ( -12.510 20.940 -8.283) 25.760 2.825 ( 1.036 -2.060 -2.216) 3.199 3.128 ( -10.918 -10.823 -5.629) 16.371 3.336 ( -3.937 -18.432 7.167) 20.164 3.477 ( -6.491 -1.061 -8.555) 10.791 3.822 ( 0.758 12.581 -13.894) 18.759 4.297 ( -5.655 19.767 -4.031) 20.951 4.473 ( 2.560 -11.842 -2.017) 12.282 4.900 ( 3.219 -4.234 -0.030) 5.319 5.265 ( -6.145 -2.283 6.306) 9.096 5.390 ( 0.223 3.910 7.418) 8.388 5.478 ( -8.064 6.531 1.352) 10.465 6.250 ( -2.695 -12.950 -1.234) 13.285 6.328 ( -0.340 11.673 6.550) 13.390 6.567 ( -6.731 2.212 4.613) 8.454 6.791 ( -1.788 1.235 7.302) 7.618 6.827 ( 1.303 -2.234 3.278) 4.175 7.250 ( 4.830 -5.976 -4.996) 9.165 7.323 ( -0.961 1.710 -10.600) 10.780 7.398 ( -3.181 -5.384 -3.983) 7.414 7.542 ( 1.558 -9.952 -4.329) 10.964 7.941 ( 0.078 1.272 2.804) 3.079 7.973 ( -9.566 -2.701 1.343) 10.030 8.152 ( -13.471 -4.739 -2.193) 14.447 8.729 ( 6.573 3.202 -0.194) 7.314 8.968 ( 6.051 -1.653 8.154) 10.288 9.300 ( -2.644 -2.798 8.073) 8.944 9.389 ( 5.365 12.628 0.101) 13.720 9.785 ( 8.458 5.165 4.759) 10.994 10.010 ( 6.294 -9.466 7.672) 13.714 10.248 ( -2.871 -0.502 7.861) 8.384 10.384 ( 0.157 3.017 -11.284) 11.682 10.687 ( 6.670 0.288 -3.800) 7.682 10.748 ( 3.232 -0.816 0.400) 3.357 10.978 ( 3.912 4.512 -2.847) 6.615 11.271 ( -2.055 7.711 5.795) 9.862 11.359 ( 8.977 -1.382 8.425) 12.389 11.563 ( 4.291 0.781 -1.683) 4.675 11.730 ( 6.286 -8.657 3.055) 11.126 11.943 ( 12.328 -1.915 -9.179) 15.489 12.129 ( -0.543 -1.451 4.853) 5.094 12.446 ( -11.054 8.724 0.744) 14.101 13.655 ( -15.695 -4.950 -6.619) 17.738 14.760 ( -11.439 4.187 -5.862) 13.518 15.749 ( 2.021 -3.277 0.611) 3.898 16.690 ( 5.735 3.800 2.542) 7.334 17.032 ( 17.660 1.405 7.707) 19.319 ======================= Grid point 38 (26/282) ======================= q-point: (-0.40 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.000 ( -11.498 29.195 -3.162) 31.536 2.186 ( -6.387 31.676 -1.122) 32.333 2.829 ( 0.095 -3.238 -2.936) 4.372 3.031 ( -5.798 -7.654 -2.602) 9.948 3.213 ( -6.081 -0.777 -8.167) 10.212 3.583 ( 1.771 13.533 4.757) 14.453 3.676 ( 2.059 -7.212 -4.607) 8.803 3.877 ( -11.426 29.759 -3.611) 32.081 4.592 ( 1.726 -12.472 -0.460) 12.599 5.006 ( 3.104 -7.415 -0.040) 8.039 5.240 ( -7.060 -3.255 3.686) 8.604 5.345 ( 0.934 -3.200 -1.067) 3.500 5.502 ( -1.287 -0.413 5.738) 5.895 6.144 ( -1.230 22.879 2.908) 23.096 6.433 ( 1.851 -0.233 -0.676) 1.984 6.498 ( -4.395 -20.220 0.812) 20.709 6.858 ( -0.935 4.654 12.435) 13.311 6.920 ( 3.390 -1.667 3.197) 4.949 7.155 ( -3.161 7.651 -7.934) 11.467 7.229 ( 0.245 -2.111 -9.967) 10.191 7.422 ( -1.873 -9.933 1.569) 10.229 7.641 ( 1.828 -17.976 -3.957) 18.497 7.851 ( -5.783 -2.101 -0.924) 6.221 7.922 ( -4.733 -4.921 0.230) 6.831 8.104 ( -0.245 -5.590 -0.436) 5.612 8.756 ( 1.052 3.335 0.541) 3.539 9.102 ( 2.993 -0.618 3.654) 4.764 9.332 ( 3.989 1.351 -3.560) 5.514 9.374 ( -2.478 9.372 7.757) 12.415 9.888 ( 4.749 6.467 4.534) 9.216 10.165 ( 1.839 -3.471 -1.189) 4.104 10.242 ( -4.274 8.381 0.649) 9.430 10.416 ( 9.410 -9.995 6.240) 15.079 10.728 ( 0.400 -2.775 -2.156) 3.536 10.827 ( 3.812 -1.938 1.076) 4.410 10.990 ( 8.131 5.580 -4.273) 10.748 11.178 ( -4.726 10.855 3.307) 12.293 11.504 ( 1.014 0.397 6.420) 6.512 11.668 ( 1.506 -9.840 1.745) 10.106 11.935 ( 8.186 -6.270 2.695) 10.658 11.987 ( 6.972 13.716 -9.933) 18.314 12.181 ( -0.685 -1.269 3.413) 3.705 12.251 ( -2.913 4.198 0.236) 5.116 13.445 ( -10.900 -8.948 -4.070) 14.677 14.529 ( -7.436 4.784 -3.865) 9.650 15.788 ( -0.548 -3.642 0.071) 3.684 16.723 ( 2.220 7.193 0.838) 7.575 17.339 ( 12.107 0.001 7.794) 14.399 ======================= Grid point 39 (27/282) ======================= q-point: (-0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.636 ( -0.000 33.036 0.000) 33.036 1.866 ( -0.000 36.756 0.000) 36.756 2.833 ( 0.000 -2.322 -0.000) 2.322 3.014 ( 0.000 -3.714 -0.000) 3.714 3.139 ( 0.000 -2.837 -0.000) 2.837 3.196 ( -0.000 62.445 0.000) 62.445 3.661 ( -0.000 10.415 0.000) 10.415 3.870 ( 0.000 -25.974 -0.000) 25.974 4.696 ( 0.000 -11.686 -0.000) 11.686 5.072 ( 0.000 -3.498 -0.000) 3.498 5.225 ( 0.000 -3.581 -0.000) 3.581 5.411 ( 0.000 -10.002 -0.000) 10.002 5.520 ( 0.000 -0.526 -0.000) 0.526 5.979 ( -0.000 19.687 0.000) 19.687 6.374 ( -0.000 8.967 0.000) 8.967 6.701 ( 0.000 -23.651 -0.000) 23.651 6.879 ( -0.000 9.049 0.000) 9.049 6.963 ( -0.000 4.082 0.000) 4.082 7.031 ( 0.000 -2.039 -0.000) 2.039 7.191 ( 0.000 -3.761 -0.000) 3.761 7.477 ( 0.000 -8.393 -0.000) 8.393 7.780 ( 0.000 -17.690 -0.000) 17.690 7.837 ( 0.000 -5.436 -0.000) 5.436 7.930 ( 0.000 -6.650 -0.000) 6.650 8.142 ( 0.000 -4.655 -0.000) 4.655 8.741 ( -0.000 3.073 0.000) 3.073 9.143 ( -0.000 0.898 0.000) 0.898 9.278 ( -0.000 13.880 0.000) 13.880 9.381 ( 0.000 -5.552 -0.000) 5.552 9.909 ( -0.000 4.888 0.000) 4.888 10.125 ( -0.000 11.502 0.000) 11.502 10.192 ( 0.000 -2.855 -0.000) 2.855 10.623 ( -0.000 4.795 0.000) 4.795 10.766 ( 0.000 -22.889 -0.000) 22.889 10.858 ( -0.000 1.793 0.000) 1.793 11.020 ( -0.000 3.375 0.000) 3.375 11.069 ( -0.000 11.540 0.000) 11.540 11.555 ( -0.000 1.132 0.000) 1.132 11.737 ( 0.000 -3.323 -0.000) 3.323 11.799 ( -0.000 15.550 0.000) 15.550 12.064 ( 0.000 -4.333 -0.000) 4.333 12.205 ( 0.000 -2.658 -0.000) 2.658 12.268 ( 0.000 -1.752 -0.000) 1.752 13.407 ( 0.000 -8.283 -0.000) 8.283 14.412 ( -0.000 4.900 0.000) 4.900 15.807 ( 0.000 -3.820 -0.000) 3.820 16.678 ( -0.000 9.242 0.000) 9.242 17.494 ( 0.000 -1.987 -0.000) 1.987 ======================= Grid point 46 (28/282) ======================= q-point: ( 0.40 -0.60 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.652 ( -4.006 0.000 7.599) 8.591 2.773 ( -13.067 0.000 -5.585) 14.210 2.795 ( 1.795 -0.000 -2.783) 3.312 2.993 ( -10.386 0.000 -3.089) 10.836 3.127 ( -6.898 0.000 6.513) 9.487 3.476 ( -8.680 0.000 -13.416) 15.979 3.952 ( 0.501 -0.000 -13.656) 13.666 4.316 ( 6.045 -0.000 -2.694) 6.619 4.477 ( 3.640 -0.000 -0.809) 3.728 4.874 ( 0.900 -0.000 -0.542) 1.050 5.248 ( -8.393 0.000 6.351) 10.525 5.409 ( 0.901 -0.000 12.911) 12.942 5.697 ( -10.210 0.000 -7.581) 12.717 5.904 ( -6.955 0.000 -4.065) 8.056 6.502 ( -8.185 0.000 11.178) 13.854 6.634 ( 3.081 -0.000 15.671) 15.971 6.783 ( -2.475 0.000 0.776) 2.594 6.834 ( 1.861 -0.000 2.530) 3.141 7.180 ( 3.639 -0.000 -7.447) 8.288 7.246 ( 4.395 -0.000 -9.740) 10.686 7.404 ( -1.255 0.000 -7.032) 7.143 7.482 ( -5.316 0.000 -3.237) 6.224 7.944 ( -4.142 0.000 1.512) 4.409 7.965 ( -3.121 0.000 4.231) 5.258 8.108 ( -17.605 0.000 -3.376) 17.926 8.757 ( 7.144 -0.000 -1.064) 7.223 8.951 ( 6.143 -0.000 8.100) 10.166 9.279 ( -1.909 0.000 7.775) 8.006 9.524 ( 6.894 -0.000 -0.042) 6.894 9.778 ( 7.021 -0.000 8.556) 11.068 9.945 ( 4.493 -0.000 6.867) 8.206 10.242 ( -2.623 0.000 4.381) 5.106 10.409 ( 0.263 -0.000 -9.757) 9.760 10.711 ( 5.855 -0.000 -3.986) 7.083 10.720 ( 3.989 -0.000 1.644) 4.314 11.019 ( 5.069 -0.000 -4.656) 6.883 11.285 ( 7.079 -0.000 5.536) 8.987 11.418 ( -4.107 0.000 11.533) 12.243 11.592 ( 12.504 -0.000 2.628) 12.777 11.604 ( 0.525 -0.000 -6.337) 6.358 11.929 ( 14.258 -0.000 -6.797) 15.795 12.120 ( -1.797 0.000 6.493) 6.737 12.524 ( -8.699 0.000 1.100) 8.768 13.611 ( -17.411 0.000 -7.607) 19.001 14.795 ( -11.447 0.000 -6.331) 13.081 15.722 ( 2.192 -0.000 0.854) 2.352 16.719 ( 6.166 -0.000 3.721) 7.202 17.042 ( 18.262 -0.000 5.374) 19.036 ======================= Grid point 48 (29/282) ======================= q-point: (-0.50 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.406 ( -9.509 23.033 -3.712) 25.193 2.612 ( -3.432 19.222 2.863) 19.734 2.735 ( -4.019 -8.833 -4.375) 10.645 2.930 ( -2.404 -2.067 0.477) 3.206 3.178 ( -3.939 -9.469 -2.128) 10.474 3.277 ( -5.165 -13.660 -0.944) 14.635 3.868 ( 3.551 7.779 -4.998) 9.904 4.380 ( 2.883 14.389 -3.816) 15.163 4.440 ( -0.364 2.526 -0.093) 2.554 4.898 ( 1.429 -5.637 -0.332) 5.825 5.194 ( -5.988 -1.893 4.029) 7.461 5.415 ( -4.250 12.650 -4.306) 14.023 5.503 ( -1.097 0.155 6.420) 6.515 5.944 ( -3.469 -30.505 -3.122) 30.860 6.481 ( -4.616 7.548 10.915) 14.051 6.625 ( 0.556 20.024 -3.722) 20.374 6.874 ( -0.436 -5.110 12.049) 13.095 6.926 ( 5.138 0.486 6.441) 8.253 7.198 ( 1.511 -1.652 -10.878) 11.106 7.212 ( 2.664 -6.036 -6.276) 9.106 7.298 ( -5.608 1.628 -0.046) 5.839 7.404 ( -2.072 -10.727 -5.916) 12.424 7.843 ( -7.352 0.649 -1.075) 7.459 7.867 ( -7.089 -2.322 -1.076) 7.537 8.034 ( 1.288 -2.852 1.559) 3.496 8.796 ( 0.901 1.476 -0.333) 1.761 9.084 ( 3.104 -0.984 3.605) 4.858 9.318 ( 0.296 -0.446 2.312) 2.374 9.569 ( 2.990 10.563 1.881) 11.138 9.942 ( 4.063 -0.007 3.989) 5.694 10.104 ( 4.232 -3.957 5.685) 8.117 10.251 ( -0.516 -6.288 2.786) 6.897 10.341 ( -0.049 3.358 -2.875) 4.421 10.739 ( 0.971 2.897 -0.804) 3.160 10.789 ( 2.801 -3.120 0.062) 4.193 11.071 ( 10.223 3.932 -4.601) 11.880 11.331 ( -3.340 7.805 2.577) 8.872 11.448 ( -4.056 -6.719 6.143) 9.966 11.571 ( 0.449 -1.842 -2.150) 2.867 11.848 ( 12.115 -3.848 2.637) 12.982 12.103 ( 12.503 2.666 -1.527) 12.875 12.157 ( 0.898 -1.467 2.810) 3.295 12.392 ( -5.743 8.919 -0.272) 10.612 13.311 ( -14.213 -6.438 -5.606) 16.580 14.585 ( -7.377 2.122 -4.305) 8.800 15.748 ( -0.025 -1.385 0.366) 1.432 16.800 ( 2.421 2.690 1.683) 3.991 17.334 ( 12.082 -0.327 4.793) 13.002 ======================= Grid point 49 (30/282) ======================= q-point: (-0.40 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.107 ( -0.000 28.310 0.000) 28.310 2.391 ( -0.000 31.559 0.000) 31.559 2.761 ( 0.000 -9.043 -0.000) 9.043 2.933 ( 0.000 -4.325 -0.000) 4.325 3.118 ( 0.000 -0.484 -0.000) 0.484 3.456 ( 0.000 -27.637 -0.000) 27.637 3.817 ( -0.000 9.352 0.000) 9.352 4.057 ( -0.000 48.420 0.000) 48.420 4.515 ( 0.000 -10.936 -0.000) 10.936 4.972 ( 0.000 -8.108 -0.000) 8.108 5.178 ( 0.000 -2.314 -0.000) 2.314 5.329 ( -0.000 0.391 0.000) 0.391 5.522 ( -0.000 0.441 0.000) 0.441 6.151 ( 0.000 -30.922 -0.000) 30.922 6.402 ( -0.000 22.310 0.000) 22.310 6.482 ( -0.000 4.947 0.000) 4.947 6.961 ( -0.000 0.366 0.000) 0.366 7.041 ( -0.000 5.582 0.000) 5.582 7.093 ( -0.000 4.899 0.000) 4.899 7.145 ( 0.000 -1.447 -0.000) 1.447 7.342 ( 0.000 -9.313 -0.000) 9.313 7.479 ( 0.000 -19.949 -0.000) 19.949 7.777 ( 0.000 -2.346 -0.000) 2.346 7.847 ( 0.000 -4.051 -0.000) 4.051 8.074 ( 0.000 -3.539 -0.000) 3.539 8.785 ( -0.000 2.209 0.000) 2.209 9.133 ( 0.000 -1.344 -0.000) 1.344 9.337 ( 0.000 -1.036 -0.000) 1.036 9.502 ( -0.000 14.505 0.000) 14.505 9.974 ( -0.000 3.208 0.000) 3.208 10.161 ( 0.000 -1.093 -0.000) 1.093 10.280 ( -0.000 8.017 0.000) 8.017 10.418 ( 0.000 -20.800 -0.000) 20.800 10.694 ( -0.000 4.417 0.000) 4.417 10.842 ( 0.000 -2.826 -0.000) 2.826 11.106 ( -0.000 7.410 0.000) 7.410 11.240 ( -0.000 9.215 0.000) 9.215 11.522 ( 0.000 -14.462 -0.000) 14.462 11.567 ( -0.000 0.459 0.000) 0.459 11.995 ( 0.000 -4.311 -0.000) 4.311 12.176 ( 0.000 -1.070 -0.000) 1.070 12.181 ( -0.000 23.114 0.000) 23.114 12.243 ( 0.000 -1.390 -0.000) 1.390 13.242 ( 0.000 -12.183 -0.000) 12.183 14.482 ( -0.000 3.705 0.000) 3.705 15.760 ( 0.000 -2.171 -0.000) 2.171 16.793 ( -0.000 5.504 0.000) 5.504 17.465 ( 0.000 -1.567 -0.000) 1.567 ======================= Grid point 59 (31/282) ======================= q-point: (-0.50 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 156 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.429 ( -0.000 0.000 0.000) 0.000 2.577 ( 0.000 -0.000 -0.000) 0.000 2.716 ( -0.000 0.000 0.000) 0.000 2.947 ( -0.000 0.000 0.000) 0.000 3.085 ( 0.000 -0.000 -0.000) 0.000 3.153 ( 0.000 -0.000 -0.000) 0.000 3.902 ( 0.000 -0.000 -0.000) 0.000 4.417 ( 0.000 -0.000 -0.000) 0.000 4.505 ( -0.000 0.000 0.000) 0.000 4.872 ( 0.000 -0.000 -0.000) 0.000 5.160 ( 0.000 -0.000 -0.000) 0.000 5.406 ( -0.000 0.000 0.000) 0.000 5.526 ( 0.000 -0.000 -0.000) 0.000 5.766 ( 0.000 -0.000 -0.000) 0.000 6.520 ( 0.000 -0.000 -0.000) 0.000 6.735 ( -0.000 0.000 0.000) 0.000 6.861 ( 0.000 -0.000 -0.000) 0.000 7.083 ( 0.000 -0.000 -0.000) 0.000 7.137 ( 0.000 -0.000 -0.000) 0.000 7.183 ( 0.000 -0.000 -0.000) 0.000 7.220 ( -0.000 0.000 0.000) 0.000 7.294 ( -0.000 0.000 0.000) 0.000 7.760 ( 0.000 -0.000 -0.000) 0.000 7.814 ( 0.000 -0.000 -0.000) 0.000 8.046 ( 0.000 -0.000 -0.000) 0.000 8.801 ( 0.000 -0.000 -0.000) 0.000 9.121 ( 0.000 -0.000 -0.000) 0.000 9.331 ( 0.000 -0.000 -0.000) 0.000 9.644 ( 0.000 -0.000 -0.000) 0.000 9.996 ( 0.000 -0.000 -0.000) 0.000 10.168 ( 0.000 -0.000 -0.000) 0.000 10.214 ( -0.000 0.000 0.000) 0.000 10.345 ( 0.000 -0.000 -0.000) 0.000 10.742 ( 0.000 -0.000 -0.000) 0.000 10.804 ( 0.000 -0.000 -0.000) 0.000 11.201 ( 0.000 -0.000 -0.000) 0.000 11.315 ( 0.000 -0.000 -0.000) 0.000 11.371 ( 0.000 -0.000 -0.000) 0.000 11.571 ( 0.000 -0.000 -0.000) 0.000 11.956 ( 0.000 -0.000 -0.000) 0.000 12.169 ( 0.000 -0.000 -0.000) 0.000 12.232 ( 0.000 -0.000 -0.000) 0.000 12.389 ( 0.000 -0.000 -0.000) 0.000 13.119 ( 0.000 -0.000 -0.000) 0.000 14.512 ( 0.000 -0.000 -0.000) 0.000 15.743 ( 0.000 -0.000 -0.000) 0.000 16.836 ( 0.000 -0.000 -0.000) 0.000 17.452 ( 0.000 -0.000 -0.000) 0.000 ======================= Grid point 107 (32/282) ======================= q-point: ( 0.00 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.725 ( 20.020 -0.000 35.482) 40.740 0.774 ( -4.265 0.000 37.935) 38.174 1.104 ( -17.186 0.000 54.056) 56.722 3.077 ( 4.389 -0.000 5.412) 6.968 3.218 ( 2.815 -0.000 4.944) 5.689 3.423 ( -3.914 0.000 6.499) 7.586 3.556 ( 6.899 -0.000 6.628) 9.567 4.566 ( 0.979 -0.000 -10.259) 10.306 4.699 ( 2.500 -0.000 -5.607) 6.139 4.884 ( 3.297 -0.000 -10.342) 10.854 5.290 ( -1.596 0.000 -4.729) 4.992 5.728 ( -0.284 0.000 -8.943) 8.947 5.788 ( 1.765 -0.000 -7.553) 7.756 6.070 ( -4.205 0.000 0.751) 4.271 6.127 ( 2.124 -0.000 -2.623) 3.375 6.258 ( 4.253 -0.000 -6.473) 7.745 6.270 ( -5.874 0.000 0.797) 5.928 6.900 ( 0.800 -0.000 0.001) 0.800 7.786 ( 4.026 -0.000 1.857) 4.433 7.843 ( -0.845 0.000 -1.530) 1.748 8.008 ( 0.298 -0.000 2.966) 2.981 8.048 ( -0.284 0.000 9.168) 9.173 8.087 ( 17.491 -0.000 0.153) 17.492 8.219 ( -2.265 0.000 -0.064) 2.266 8.272 ( -5.716 0.000 3.480) 6.692 8.655 ( 2.675 -0.000 0.543) 2.730 8.711 ( -2.557 0.000 -7.027) 7.478 8.878 ( 3.285 -0.000 -4.117) 5.267 9.565 ( 0.446 -0.000 -10.080) 10.090 9.620 ( -43.682 0.000 2.847) 43.775 9.941 ( -1.271 0.000 -7.918) 8.019 10.319 ( -15.793 0.000 -9.101) 18.228 10.330 ( -0.885 0.000 5.886) 5.952 10.346 ( 3.662 -0.000 -2.085) 4.214 10.746 ( -1.039 0.000 -2.584) 2.786 10.946 ( -5.326 0.000 1.923) 5.663 11.010 ( 6.313 -0.000 4.835) 7.951 11.551 ( -6.380 0.000 0.242) 6.384 11.872 ( 7.635 -0.000 1.243) 7.735 11.914 ( -9.838 0.000 -5.874) 11.458 12.232 ( -4.249 0.000 3.556) 5.541 12.288 ( -3.078 0.000 2.700) 4.094 12.318 ( 5.917 -0.000 -1.310) 6.060 13.452 ( 6.153 -0.000 -2.251) 6.552 14.403 ( -1.922 0.000 9.053) 9.255 16.265 ( -10.674 0.000 -2.387) 10.938 16.290 ( -11.245 0.000 -4.381) 12.068 16.291 ( 0.322 -0.000 0.927) 0.981 ======================= Grid point 108 (33/282) ======================= q-point: ( 0.10 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.195 ( 8.392 -0.006 33.454) 34.490 1.319 ( 11.110 -14.376 33.712) 38.296 1.883 ( 32.892 -21.453 36.453) 53.581 3.245 ( -0.623 4.485 4.624) 6.472 3.282 ( 8.622 -0.992 8.647) 12.251 3.437 ( -2.218 -0.090 7.522) 7.843 3.667 ( 1.221 0.895 13.982) 14.063 4.431 ( 2.174 11.552 -14.322) 18.529 4.698 ( 2.103 -4.416 -6.019) 7.756 4.773 ( -1.181 -3.990 -13.081) 13.727 5.213 ( 0.236 0.954 -8.144) 8.203 5.597 ( -0.042 5.467 -10.406) 11.754 5.782 ( 2.458 -3.918 -7.635) 8.927 5.944 ( -2.668 13.447 -0.969) 13.743 6.101 ( 3.397 9.359 -1.944) 10.144 6.228 ( -3.350 -9.378 -2.425) 10.249 6.346 ( 6.564 -11.527 -4.608) 14.042 6.919 ( 0.769 -2.481 0.389) 2.626 7.768 ( -7.126 11.859 7.753) 15.859 7.804 ( -0.027 3.084 -1.726) 3.534 7.952 ( -3.901 5.054 0.841) 6.440 8.024 ( -2.406 14.795 9.005) 17.487 8.169 ( 1.326 3.160 0.455) 3.457 8.213 ( 0.446 -0.912 0.670) 1.217 8.281 ( -7.949 -5.001 8.733) 12.824 8.580 ( -4.268 -1.752 -7.311) 8.645 8.743 ( 2.027 -11.547 -5.677) 13.026 8.877 ( -0.485 -3.052 -2.092) 3.732 9.210 ( -25.576 -11.392 17.651) 33.098 9.510 ( 3.686 0.370 -8.183) 8.983 9.846 ( 5.139 3.308 -10.873) 12.473 10.101 ( -8.626 -8.196 -6.671) 13.642 10.351 ( 2.228 -0.690 -1.588) 2.821 10.454 ( 2.279 -1.306 8.553) 8.947 10.719 ( -0.697 -1.484 -1.133) 1.993 10.908 ( 0.253 -0.570 -1.798) 1.903 11.174 ( 6.493 -2.000 4.888) 8.370 11.310 ( -12.327 5.999 -8.727) 16.251 11.658 ( -14.023 -1.383 -7.301) 15.870 12.046 ( -2.187 0.311 12.603) 12.795 12.155 ( 2.289 4.829 -5.198) 7.455 12.223 ( -6.069 -1.520 -0.627) 6.288 12.408 ( 4.824 1.597 4.560) 6.828 13.593 ( 11.419 -1.040 1.008) 11.511 14.526 ( 5.248 -0.254 9.561) 10.910 16.100 ( 0.512 9.523 -3.300) 10.092 16.300 ( 1.717 -5.158 -2.659) 6.051 16.382 ( -0.052 -18.891 -10.214) 21.476 ======================= Grid point 109 (34/282) ======================= q-point: ( 0.20 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.632 ( 8.121 -2.737 26.960) 28.289 1.942 ( 14.144 -17.623 26.765) 35.029 2.869 ( 32.725 -19.799 23.837) 45.068 3.169 ( -6.163 5.126 4.688) 9.287 3.461 ( -0.310 -5.615 4.697) 7.327 3.618 ( 13.555 2.391 14.400) 19.920 3.889 ( 5.699 -0.011 16.835) 17.774 4.200 ( 1.880 15.190 -12.602) 19.827 4.671 ( -0.475 -5.106 -8.470) 9.902 4.714 ( 4.140 -5.269 -14.010) 15.530 5.139 ( 0.974 -3.281 -8.546) 9.206 5.448 ( 0.039 3.273 -14.002) 14.379 5.653 ( -3.863 11.657 -6.555) 13.920 5.900 ( 4.369 -0.119 -3.071) 5.342 6.056 ( 2.368 10.883 -0.556) 11.151 6.263 ( 2.856 -7.489 -2.552) 8.411 6.524 ( 11.897 -8.413 -3.283) 14.937 6.990 ( 3.335 -7.099 0.991) 7.906 7.627 ( -9.326 7.245 6.602) 13.529 7.714 ( -8.805 5.045 0.955) 10.193 7.826 ( -6.154 8.768 -1.770) 10.857 7.999 ( 0.982 11.105 7.249) 13.298 8.163 ( -0.271 2.994 2.169) 3.707 8.220 ( 1.558 -1.433 -2.154) 3.020 8.266 ( -6.597 1.221 6.442) 9.302 8.470 ( -3.942 -4.860 -6.934) 9.341 8.749 ( -2.542 -4.351 -3.138) 5.936 8.886 ( -3.945 -8.161 2.006) 9.284 9.203 ( -9.093 -10.137 12.431) 18.438 9.498 ( 5.432 3.520 -4.786) 8.050 9.875 ( 10.895 -2.316 -8.650) 14.102 10.006 ( -4.960 -9.345 -5.686) 12.010 10.376 ( 2.394 -1.290 -2.982) 4.036 10.541 ( -0.001 3.955 4.021) 5.640 10.729 ( 0.912 -3.346 -1.199) 3.669 10.917 ( 1.109 -0.091 -0.218) 1.134 10.999 ( -7.891 5.355 -7.499) 12.132 11.313 ( 4.172 -0.280 -3.018) 5.156 11.395 ( -12.853 -5.720 -2.015) 14.211 11.940 ( -10.615 4.919 2.021) 11.873 12.094 ( -6.910 0.802 -3.210) 7.661 12.220 ( 2.345 0.350 0.494) 2.422 12.549 ( 7.730 4.526 9.163) 12.814 13.804 ( 11.947 -2.033 2.335) 12.341 14.731 ( 9.476 -0.505 8.024) 12.428 15.980 ( -6.057 5.296 -1.139) 8.126 16.332 ( -3.620 -8.925 0.161) 9.633 16.372 ( 3.430 -9.071 -17.172) 19.722 ======================= Grid point 110 (35/282) ======================= q-point: ( 0.30 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.997 ( 5.885 -1.979 22.055) 22.912 2.494 ( 10.024 -15.722 20.531) 27.734 3.036 ( -9.120 4.764 5.539) 11.686 3.468 ( 1.362 -6.526 9.653) 11.732 3.642 ( 13.155 -1.965 -3.286) 13.701 3.888 ( 7.449 0.001 4.618) 8.765 3.996 ( 12.928 4.383 8.693) 16.184 4.297 ( 6.860 -6.059 13.062) 15.949 4.589 ( 1.568 -3.440 -20.387) 20.735 4.700 ( 6.362 3.548 1.217) 7.386 5.166 ( 4.126 -12.487 -5.889) 14.409 5.259 ( -4.044 0.780 -14.537) 15.109 5.471 ( 0.597 10.898 -5.128) 12.059 5.948 ( 5.658 0.850 -2.562) 6.269 5.996 ( 1.635 12.295 0.583) 12.417 6.382 ( 9.033 -5.790 -1.895) 10.896 6.759 ( 15.566 -4.471 -3.039) 16.478 7.141 ( 6.116 -10.678 0.330) 12.310 7.469 ( -11.969 4.174 -1.478) 12.762 7.503 ( -13.458 5.291 2.249) 14.635 7.659 ( -5.448 4.889 0.272) 7.325 7.930 ( -5.020 12.712 1.907) 13.800 8.114 ( -5.562 1.121 -5.238) 7.721 8.209 ( -3.591 5.562 8.829) 11.035 8.294 ( 5.149 -2.842 1.146) 5.991 8.414 ( 0.638 -2.407 -3.217) 4.068 8.708 ( -2.168 0.326 -0.286) 2.211 8.907 ( -6.758 -6.397 6.648) 11.436 9.282 ( -4.651 -8.117 9.865) 13.596 9.549 ( 7.848 2.328 -0.469) 8.199 9.960 ( 2.300 -4.897 -4.649) 7.133 10.009 ( 4.132 -5.402 -3.259) 7.542 10.317 ( -7.893 1.863 -4.286) 9.173 10.479 ( 4.361 3.509 -8.831) 10.455 10.734 ( 4.099 -2.100 -7.249) 8.589 10.885 ( -1.153 1.186 3.525) 3.894 10.983 ( -1.590 -3.580 0.142) 3.919 11.139 ( -5.605 0.582 -1.885) 5.942 11.463 ( 3.588 -5.589 0.467) 6.658 11.755 ( -8.359 5.084 -1.888) 9.964 11.933 ( -6.319 2.452 -6.029) 9.071 12.218 ( -3.608 0.304 2.843) 4.603 12.716 ( 6.549 5.933 9.233) 12.780 14.012 ( 9.601 -2.517 2.248) 10.177 14.968 ( 11.557 -0.865 6.432) 13.254 15.818 ( -10.864 2.567 0.510) 11.175 16.292 ( -0.353 -5.804 -11.852) 13.201 16.354 ( -0.485 -7.178 -3.718) 8.098 ======================= Grid point 111 (36/282) ======================= q-point: ( 0.40 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.264 ( 0.942 0.517 20.127) 20.156 2.822 ( 0.403 -5.409 9.753) 11.160 2.912 ( -8.926 3.872 4.832) 10.864 3.552 ( 2.306 11.869 -7.423) 14.188 3.587 ( -1.881 -10.141 7.379) 12.682 4.078 ( -1.672 -11.532 -6.496) 13.341 4.274 ( 10.785 3.529 12.458) 16.852 4.411 ( 1.863 3.334 -17.446) 17.859 4.520 ( 6.077 -8.416 3.531) 10.964 4.873 ( 5.986 1.028 9.070) 10.916 5.065 ( -3.393 -5.013 -10.165) 11.831 5.296 ( 2.374 -10.489 -5.722) 12.182 5.474 ( 10.135 5.714 6.651) 13.401 5.928 ( 2.280 13.250 0.281) 13.447 6.019 ( 5.949 1.078 -0.329) 6.055 6.579 ( 13.147 -5.340 -1.601) 14.280 6.907 ( 4.358 3.016 -6.343) 8.265 7.216 ( -8.506 5.150 -4.903) 11.087 7.294 ( 1.897 -2.014 -2.101) 3.474 7.362 ( -2.733 -9.209 5.095) 10.874 7.584 ( -3.654 -1.680 -2.923) 4.972 7.748 ( -6.795 9.843 0.117) 11.961 7.926 ( -6.336 6.291 -4.344) 9.929 8.173 ( -5.673 0.926 2.011) 6.089 8.381 ( 0.180 1.212 10.413) 10.485 8.522 ( 12.523 3.309 -0.330) 12.957 8.672 ( -0.638 2.149 0.029) 2.242 8.896 ( -9.083 -2.033 8.482) 12.593 9.360 ( -4.600 -6.255 7.367) 10.703 9.678 ( 8.299 0.691 2.516) 8.700 9.898 ( -6.306 7.930 -2.935) 10.549 10.055 ( 0.920 -8.281 -0.347) 8.339 10.224 ( 0.488 -7.562 -3.097) 8.186 10.462 ( 7.095 0.221 -11.970) 13.916 10.761 ( 4.985 -0.904 -7.640) 9.167 10.871 ( -3.467 -4.203 -5.677) 7.869 10.902 ( -0.489 3.505 4.072) 5.395 11.207 ( 1.085 0.044 9.465) 9.527 11.530 ( 4.484 -0.525 -8.415) 9.550 11.606 ( -5.709 -0.180 2.755) 6.342 11.761 ( -4.183 2.509 -7.920) 9.302 12.184 ( -4.377 -0.195 3.689) 5.728 12.815 ( 2.076 6.412 6.795) 9.570 14.154 ( 4.266 -1.977 0.646) 4.746 15.214 ( 11.925 -0.968 5.946) 13.360 15.624 ( -14.439 0.704 1.478) 14.531 16.219 ( 4.450 -0.041 -13.462) 14.178 16.393 ( -0.935 -8.637 2.890) 9.156 ======================= Grid point 112 (37/282) ======================= q-point: (-0.50 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.372 ( -11.082 6.336 19.802) 23.560 2.736 ( -8.138 10.001 -2.813) 13.197 2.857 ( -4.300 -0.858 3.621) 5.687 3.463 ( -1.267 4.568 -2.252) 5.248 3.710 ( -0.714 -9.723 1.036) 9.804 3.966 ( -8.048 -8.325 -8.677) 14.469 4.193 ( -3.842 -1.327 -14.835) 15.382 4.487 ( 0.660 11.379 12.687) 17.055 4.654 ( 1.583 -8.594 -3.217) 9.312 4.961 ( 1.307 -9.523 0.211) 9.614 5.093 ( 1.285 -2.769 5.472) 6.266 5.306 ( 2.772 -0.066 -4.998) 5.716 5.684 ( 3.289 -1.604 13.445) 13.934 5.870 ( 1.516 8.085 -0.966) 8.283 6.095 ( 5.315 3.447 0.792) 6.384 6.736 ( -1.275 5.256 -3.734) 6.572 6.853 ( 10.365 -3.606 -1.050) 11.025 7.080 ( 1.321 3.215 -5.570) 6.565 7.253 ( -6.547 -0.559 -0.845) 6.625 7.436 ( -6.954 7.756 -3.818) 11.094 7.536 ( 6.362 -11.380 -2.106) 13.207 7.626 ( -4.224 -5.663 -2.636) 7.541 7.820 ( 2.812 9.036 -0.857) 9.502 8.128 ( 2.832 1.339 -0.743) 3.219 8.483 ( -5.744 2.228 13.868) 15.175 8.605 ( 8.014 7.084 2.330) 10.947 8.727 ( 7.015 2.303 0.385) 7.394 8.823 ( -8.470 3.395 6.211) 11.038 9.340 ( -7.831 0.362 2.866) 8.347 9.697 ( -3.952 -0.797 -0.848) 4.119 9.899 ( 4.997 -5.422 6.603) 9.898 10.149 ( 2.656 -4.946 1.772) 5.887 10.261 ( -0.187 -1.874 -1.214) 2.241 10.453 ( 7.366 -2.459 -13.061) 15.195 10.758 ( 5.632 -2.548 -4.551) 7.676 10.851 ( 1.249 0.342 -2.767) 3.055 10.956 ( 4.791 0.234 2.817) 5.562 11.220 ( -10.249 2.914 9.010) 13.954 11.448 ( 1.112 5.678 -8.150) 9.994 11.624 ( -0.355 1.163 -1.918) 2.271 11.687 ( 7.291 -5.263 -5.048) 10.312 12.173 ( -3.005 -2.364 3.678) 5.305 12.809 ( -3.445 5.705 3.704) 7.625 14.168 ( -2.613 -0.537 -2.350) 3.555 15.391 ( -16.511 -0.415 2.551) 16.712 15.461 ( 10.441 -0.923 4.703) 11.488 16.177 ( 7.198 4.334 -9.181) 12.445 16.524 ( 3.340 -8.401 6.505) 11.137 ======================= Grid point 113 (38/282) ======================= q-point: (-0.40 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.198 ( -23.182 12.549 14.467) 30.070 2.410 ( -16.135 14.833 -5.945) 22.709 2.891 ( -0.129 -3.483 4.741) 5.884 3.371 ( -6.241 2.138 -0.903) 6.658 3.621 ( -7.045 -2.493 -11.463) 13.683 3.771 ( -7.113 0.757 -17.622) 19.019 4.186 ( -2.393 -18.025 8.166) 19.932 4.209 ( -26.684 21.893 0.306) 34.517 4.706 ( 2.260 -4.594 -1.393) 5.305 5.092 ( 1.436 -12.122 -1.440) 12.291 5.209 ( 5.197 3.141 8.968) 10.830 5.340 ( 4.081 -3.893 1.456) 5.825 5.827 ( -1.633 1.251 5.334) 5.717 5.861 ( -0.544 -8.336 3.612) 9.101 6.144 ( 4.321 6.031 2.582) 7.856 6.625 ( -3.651 9.334 5.081) 11.238 6.939 ( -10.981 1.890 -6.080) 12.693 7.011 ( 7.068 3.869 -9.037) 12.108 7.174 ( 2.906 1.607 -3.551) 4.862 7.326 ( 1.923 -2.571 -0.030) 3.211 7.582 ( -0.047 -5.830 -1.973) 6.155 7.720 ( 6.281 -6.812 0.157) 9.267 7.820 ( 5.918 2.554 -3.305) 7.243 8.220 ( 10.019 3.657 -1.395) 10.756 8.417 ( -9.254 1.056 4.478) 10.334 8.649 ( -8.856 1.809 3.211) 9.593 8.776 ( 9.897 10.462 -0.126) 14.402 8.866 ( 10.115 8.810 10.204) 16.854 9.231 ( -9.976 -2.239 4.843) 11.313 9.684 ( -5.703 -8.555 4.075) 11.060 10.072 ( 6.522 -3.977 0.569) 7.661 10.203 ( 0.392 5.782 -0.294) 5.802 10.251 ( 0.808 -4.590 0.787) 4.726 10.480 ( 6.856 -4.536 -8.551) 11.862 10.831 ( 3.466 1.830 -3.178) 5.046 10.898 ( 7.828 -1.450 0.764) 7.998 11.017 ( -10.764 1.522 7.206) 13.042 11.156 ( 4.623 -0.429 6.107) 7.671 11.345 ( 2.101 5.761 -7.089) 9.373 11.581 ( 2.995 5.689 -5.289) 8.325 11.851 ( 10.933 -6.130 -2.483) 12.777 12.194 ( -2.538 -4.713 2.954) 6.114 12.707 ( -8.145 3.491 1.326) 8.960 14.049 ( -7.668 0.653 -5.093) 9.228 15.129 ( -19.096 -0.489 0.670) 19.114 15.683 ( 9.580 -1.732 5.209) 11.041 16.195 ( 9.727 7.798 -4.460) 13.241 16.730 ( 5.586 -5.980 9.660) 12.660 ======================= Grid point 114 (39/282) ======================= q-point: (-0.30 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.796 ( -28.573 15.696 6.820) 33.306 1.927 ( -25.508 16.493 -3.125) 30.536 2.951 ( -1.746 -3.275 3.153) 4.870 3.087 ( -31.623 14.221 -2.006) 34.731 3.393 ( -9.355 -0.561 -10.846) 14.334 3.477 ( -9.346 1.082 -9.380) 13.286 3.653 ( -14.719 16.344 -0.384) 21.999 4.397 ( -0.329 -19.346 6.010) 20.261 4.746 ( 1.955 -0.382 -1.026) 2.241 5.088 ( -2.034 2.113 -2.904) 4.128 5.350 ( 2.924 3.377 9.196) 10.224 5.515 ( 4.699 -15.466 1.212) 16.209 5.832 ( -1.657 -4.541 0.778) 4.896 5.927 ( -4.466 -14.031 0.426) 14.730 6.170 ( -0.062 7.633 3.522) 8.406 6.565 ( -4.638 14.306 11.102) 18.693 6.696 ( -5.369 7.362 -5.914) 10.863 6.901 ( 0.554 6.640 -7.974) 10.391 7.196 ( 4.363 0.591 -3.543) 5.652 7.458 ( 5.349 -13.002 -2.075) 14.211 7.655 ( 3.819 -7.641 -0.134) 8.543 7.871 ( 7.154 -2.106 -7.285) 10.425 7.891 ( 7.642 0.167 7.291) 10.563 8.239 ( -5.140 0.703 0.008) 5.188 8.329 ( -5.085 0.468 1.078) 5.219 8.596 ( 4.474 2.118 -1.940) 5.317 8.799 ( 7.452 8.552 -4.088) 12.057 8.968 ( 4.904 16.390 0.252) 17.110 9.291 ( -2.838 -5.822 23.479) 24.356 9.714 ( -5.514 -10.560 4.713) 12.811 10.086 ( 2.615 3.488 -12.270) 13.022 10.204 ( 2.323 -1.050 2.443) 3.531 10.322 ( 0.493 -0.814 5.649) 5.729 10.535 ( 1.396 -3.032 -1.751) 3.770 10.772 ( -7.388 3.295 -0.983) 8.149 10.911 ( 1.689 2.978 -0.175) 3.428 11.041 ( 9.663 1.920 1.858) 10.025 11.253 ( -1.264 10.807 -3.350) 11.384 11.419 ( 11.216 -4.677 8.797) 15.002 11.566 ( 9.714 2.047 -5.585) 11.391 12.033 ( 9.440 -5.099 -1.564) 10.842 12.215 ( -2.578 -5.353 1.204) 6.062 12.550 ( -10.609 1.290 -0.030) 10.687 13.849 ( -9.592 1.163 -6.569) 11.684 14.847 ( -18.909 -0.174 0.815) 18.927 15.874 ( 7.033 -3.798 3.804) 8.852 16.250 ( 9.847 9.810 -1.836) 14.020 16.957 ( 6.143 -1.329 12.286) 13.800 ======================= Grid point 115 (40/282) ======================= q-point: (-0.20 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.253 ( -31.887 16.508 1.968) 35.961 1.342 ( -32.746 16.757 1.462) 36.814 2.223 ( -52.064 31.016 6.514) 60.952 2.960 ( -4.313 -1.173 4.832) 6.582 3.169 ( -7.960 0.142 -6.656) 10.378 3.328 ( -5.038 -1.856 -2.776) 6.044 3.480 ( -4.706 6.306 4.593) 9.111 4.549 ( -0.878 -15.993 -1.077) 16.054 4.749 ( 2.161 4.012 -1.779) 4.892 4.991 ( -3.585 4.938 -1.511) 6.286 5.399 ( -2.187 0.663 3.040) 3.803 5.666 ( 1.780 -12.024 -2.544) 12.418 5.888 ( 1.248 -8.312 -0.434) 8.416 5.977 ( -4.304 -15.094 0.789) 15.716 6.087 ( -3.683 2.086 -2.073) 4.713 6.475 ( -2.253 17.505 5.781) 18.572 6.525 ( -1.270 14.714 -2.718) 15.017 6.857 ( 2.508 1.912 -0.793) 3.252 7.247 ( 3.060 -1.482 3.750) 5.061 7.621 ( 4.825 -15.113 -1.712) 15.957 7.775 ( 2.550 -7.901 0.428) 8.313 7.916 ( 6.102 0.700 -4.647) 7.702 8.044 ( -0.540 1.342 8.496) 8.618 8.169 ( -1.191 -1.372 0.527) 1.892 8.264 ( -5.362 -5.512 0.582) 7.712 8.649 ( 12.327 11.341 -6.373) 17.922 8.812 ( 4.654 3.030 -3.272) 6.446 8.887 ( 0.919 8.444 -2.488) 8.851 9.560 ( 2.331 1.733 26.443) 26.602 9.773 ( -3.557 -7.949 4.893) 9.989 9.966 ( -1.325 -1.519 -8.876) 9.102 10.252 ( 2.527 -1.140 -2.564) 3.776 10.371 ( -2.226 1.515 6.965) 7.467 10.491 ( -5.918 3.036 2.042) 6.957 10.715 ( 5.896 3.124 -1.133) 6.768 10.925 ( 4.510 4.916 -3.247) 7.419 11.044 ( -4.588 13.012 -6.628) 15.306 11.222 ( 12.118 2.971 3.760) 13.031 11.645 ( 6.106 -10.333 2.393) 12.239 11.799 ( 14.297 -0.926 8.193) 16.504 12.170 ( 4.800 -4.273 -1.037) 6.510 12.216 ( -0.819 -2.674 -1.647) 3.245 12.374 ( -10.276 1.665 -0.705) 10.434 13.634 ( -8.329 1.152 -6.640) 10.714 14.591 ( -16.359 0.218 2.692) 16.580 16.031 ( 4.111 -7.488 2.395) 8.872 16.292 ( 6.745 9.286 -0.780) 11.504 17.166 ( 7.736 4.703 10.164) 13.612 ======================= Grid point 116 (41/282) ======================= q-point: (-0.10 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.633 ( -30.972 15.579 2.485) 34.759 0.812 ( -31.741 13.072 21.492) 40.501 1.359 ( -49.899 31.330 33.614) 67.834 3.036 ( 1.947 -2.467 15.777) 16.087 3.046 ( -2.605 0.197 1.642) 3.086 3.310 ( 0.278 -3.553 6.619) 7.517 3.440 ( -3.531 3.744 6.857) 8.574 4.603 ( -0.586 -11.161 -6.250) 12.806 4.723 ( 3.078 5.494 -3.469) 7.190 4.898 ( -1.634 3.111 -0.731) 3.589 5.356 ( -3.912 -1.360 -1.372) 4.363 5.738 ( 1.960 -10.181 -5.334) 11.660 5.868 ( 2.610 6.843 -8.041) 10.876 6.053 ( -5.078 -15.111 3.648) 16.354 6.082 ( -0.802 -13.200 -3.378) 13.649 6.340 ( 1.997 14.521 -5.320) 15.593 6.387 ( -3.284 15.534 3.460) 16.250 6.883 ( 1.841 0.849 0.322) 2.053 7.465 ( 9.868 -8.877 18.715) 22.944 7.792 ( 3.766 -10.810 0.709) 11.469 7.852 ( 0.378 -7.550 1.693) 7.747 7.949 ( 1.374 0.551 0.465) 1.552 8.032 ( -2.839 3.904 5.631) 7.417 8.202 ( 0.667 -2.842 0.538) 2.969 8.295 ( -0.525 -3.865 2.616) 4.697 8.651 ( 10.846 16.487 -6.053) 20.643 8.796 ( -3.412 -2.442 -2.341) 4.805 8.861 ( 6.147 3.681 -4.996) 8.735 9.682 ( -2.208 -1.199 -8.970) 9.315 9.873 ( 3.001 -4.448 6.252) 8.239 9.970 ( -5.264 -9.503 5.518) 12.184 10.297 ( 6.102 -3.954 -3.880) 8.241 10.358 ( -3.367 4.789 3.079) 6.614 10.450 ( 7.012 9.460 3.668) 12.334 10.790 ( 3.527 2.775 -8.788) 9.867 10.835 ( 2.849 5.632 6.776) 9.260 10.975 ( 2.268 3.990 4.954) 6.753 11.438 ( 11.729 1.949 5.991) 13.314 11.802 ( -1.775 -16.564 -0.931) 16.684 12.039 ( 3.228 4.019 5.494) 7.534 12.173 ( 0.413 -1.011 2.455) 2.687 12.227 ( 2.012 1.111 -2.162) 3.155 12.277 ( 0.772 0.632 0.960) 1.385 13.476 ( -3.076 0.667 -5.289) 6.155 14.424 ( -10.411 0.293 6.035) 12.037 16.162 ( 0.039 -13.719 1.853) 13.844 16.297 ( 2.224 6.003 -0.052) 6.402 17.150 ( -6.441 17.032 -24.777) 30.748 ======================= Grid point 118 (42/282) ======================= q-point: ( 0.10 0.10 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.649 ( 3.738 -0.000 35.427) 35.624 1.761 ( 18.864 -0.000 24.328) 30.784 2.710 ( 39.503 -0.000 25.340) 46.932 3.218 ( -6.762 0.000 2.758) 7.303 3.412 ( -1.763 0.000 5.282) 5.569 3.637 ( 14.199 -0.000 14.758) 20.479 3.886 ( 5.418 -0.000 18.274) 19.060 4.360 ( 1.961 -0.000 -17.987) 18.094 4.585 ( -1.038 0.000 -13.447) 13.487 4.676 ( 4.901 -0.000 -5.344) 7.251 5.118 ( -0.252 0.000 -11.546) 11.548 5.475 ( -0.919 0.000 -16.310) 16.336 5.735 ( 0.354 -0.000 -7.881) 7.889 6.003 ( 1.135 -0.000 -1.569) 1.936 6.007 ( -2.802 0.000 0.365) 2.826 6.351 ( 8.780 -0.000 -1.194) 8.860 6.354 ( 11.581 -0.000 -1.348) 11.659 6.934 ( 2.552 -0.000 0.720) 2.651 7.718 ( -8.280 0.000 -4.768) 9.555 7.730 ( -14.821 0.000 8.652) 17.161 7.911 ( -5.160 0.000 0.176) 5.163 8.101 ( 0.451 -0.000 4.621) 4.643 8.187 ( 2.664 -0.000 -5.099) 5.753 8.193 ( -2.482 0.000 -0.193) 2.490 8.271 ( -7.079 0.000 14.351) 16.002 8.410 ( -7.139 0.000 -4.317) 8.342 8.699 ( -0.013 0.000 1.662) 1.662 8.818 ( -4.675 0.000 1.309) 4.855 9.129 ( -4.734 0.000 12.314) 13.193 9.528 ( 7.159 -0.000 -6.392) 9.597 9.861 ( 8.675 -0.000 -8.801) 12.358 9.922 ( -3.684 0.000 -5.859) 6.921 10.371 ( 3.175 -0.000 -2.308) 3.925 10.583 ( 3.171 -0.000 7.012) 7.696 10.691 ( 0.249 -0.000 -2.648) 2.660 10.913 ( 1.904 -0.000 -0.523) 1.975 11.053 ( -11.953 0.000 -8.460) 14.644 11.297 ( 4.625 -0.000 4.179) 6.234 11.356 ( -13.250 0.000 -8.446) 15.713 11.980 ( -13.388 0.000 5.808) 14.593 12.100 ( -4.338 0.000 -6.034) 7.431 12.224 ( 2.654 -0.000 -0.443) 2.690 12.585 ( 8.025 -0.000 9.019) 12.072 13.786 ( 12.007 -0.000 2.022) 12.176 14.728 ( 9.485 -0.000 8.217) 12.549 16.039 ( -7.426 0.000 -3.739) 8.314 16.235 ( -4.955 0.000 2.005) 5.345 16.304 ( 9.690 -0.000 -15.958) 18.670 ======================= Grid point 119 (43/282) ======================= q-point: ( 0.20 0.10 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.014 ( 4.326 3.037 29.422) 29.893 2.289 ( 15.283 -9.542 20.056) 26.961 3.094 ( -8.575 2.290 4.512) 9.957 3.413 ( 4.621 0.254 8.429) 9.616 3.497 ( 19.583 -9.449 7.437) 22.980 3.998 ( 9.703 6.603 11.732) 16.595 4.075 ( 6.389 4.808 1.918) 8.223 4.209 ( 1.981 -4.819 -5.921) 7.886 4.526 ( 4.710 -3.309 -9.113) 10.779 4.757 ( 9.430 2.849 2.308) 10.118 5.007 ( 0.338 -6.570 -12.790) 14.383 5.265 ( -4.351 0.206 -17.742) 18.269 5.620 ( 0.427 6.255 -6.835) 9.275 5.987 ( 4.629 5.333 1.555) 7.231 6.085 ( 2.698 -4.205 0.773) 5.056 6.411 ( 11.132 11.827 -0.086) 16.242 6.627 ( 14.193 -12.809 -1.927) 19.215 7.023 ( 5.568 -3.880 1.278) 6.906 7.497 ( -12.857 0.494 -4.103) 13.505 7.555 ( -15.256 1.745 3.684) 15.791 7.759 ( -9.180 5.671 -2.242) 11.021 8.077 ( -6.652 0.486 -7.410) 9.969 8.111 ( -3.510 5.845 1.687) 7.023 8.228 ( -1.109 -4.169 3.383) 5.482 8.295 ( -3.635 2.899 11.884) 12.762 8.363 ( 4.832 -3.464 -0.530) 5.969 8.722 ( -2.362 2.450 4.563) 5.693 8.797 ( -5.182 -6.840 7.012) 11.081 9.210 ( -0.592 -1.795 9.224) 9.416 9.585 ( 8.949 2.026 -5.085) 10.490 9.859 ( -1.474 -5.337 -3.525) 6.564 9.947 ( 8.769 -2.016 -3.536) 9.668 10.377 ( 1.300 2.711 -5.165) 5.976 10.560 ( -3.011 6.091 -7.597) 10.193 10.694 ( 2.019 -3.375 -4.545) 6.010 10.901 ( -1.148 0.705 3.967) 4.190 10.924 ( -2.935 -3.067 -2.629) 4.993 11.143 ( -4.207 -0.025 -2.899) 5.109 11.397 ( 3.235 -2.371 2.165) 4.558 11.810 ( -12.295 1.972 1.750) 12.574 11.963 ( -2.868 1.174 -9.820) 10.297 12.225 ( -3.065 0.396 2.587) 4.030 12.783 ( 6.163 2.465 9.858) 11.884 13.981 ( 10.246 -1.194 1.644) 10.446 14.963 ( 11.736 0.005 6.616) 13.473 15.858 ( -11.518 2.108 -1.104) 11.762 16.202 ( -3.977 -4.347 1.323) 6.039 16.283 ( 7.715 -2.256 -16.734) 18.565 ======================= Grid point 120 (44/282) ======================= q-point: ( 0.30 0.10 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.304 ( 2.169 4.292 25.269) 25.722 2.715 ( 8.487 -7.523 14.273) 18.231 2.977 ( -9.218 3.776 4.853) 11.080 3.467 ( -2.909 -5.104 5.507) 8.052 3.723 ( 2.044 6.842 -9.250) 11.685 3.927 ( 0.755 -3.962 -7.163) 8.220 4.245 ( 3.849 -7.662 -6.634) 10.841 4.395 ( 9.631 -2.160 11.948) 15.498 4.525 ( 5.172 6.235 -5.899) 10.021 4.852 ( 1.951 -4.085 -5.773) 7.337 5.020 ( -2.567 -0.850 -8.437) 8.859 5.118 ( 5.429 -9.248 2.609) 11.037 5.616 ( 11.225 9.400 1.772) 14.748 6.055 ( 5.760 3.733 2.520) 7.312 6.134 ( 4.007 9.501 1.704) 10.451 6.527 ( 11.635 1.362 -0.350) 11.719 6.888 ( 10.209 -7.511 -5.553) 13.837 7.136 ( -0.071 -8.790 0.319) 8.796 7.279 ( -6.973 2.181 -3.495) 8.099 7.342 ( -13.065 0.398 1.775) 13.191 7.574 ( -6.004 1.187 -3.987) 7.305 7.862 ( -8.925 2.308 -8.998) 12.882 8.002 ( -3.073 5.936 -0.364) 6.694 8.200 ( -7.295 1.247 5.042) 8.955 8.389 ( -2.278 0.241 16.108) 16.270 8.551 ( 14.327 0.443 2.285) 14.514 8.689 ( -3.065 0.465 1.049) 3.273 8.855 ( -6.908 -2.987 12.933) 14.964 9.301 ( 0.248 -1.379 6.911) 7.052 9.676 ( 7.953 0.213 -0.949) 8.013 9.890 ( 2.057 -9.667 -2.564) 10.210 10.004 ( -5.225 2.872 -1.145) 6.071 10.218 ( 1.156 5.368 -7.618) 9.391 10.467 ( 5.856 0.167 -12.202) 13.536 10.736 ( 6.606 -2.739 -4.952) 8.698 10.797 ( -7.277 -4.068 -6.687) 10.687 10.963 ( 1.048 3.634 7.056) 8.006 11.195 ( 4.862 -1.463 4.941) 7.085 11.475 ( 2.285 -3.892 0.208) 4.518 11.628 ( -9.952 1.563 -0.479) 10.086 11.806 ( -1.444 2.749 -12.127) 12.518 12.192 ( -4.544 0.858 4.075) 6.163 12.904 ( 0.915 4.603 8.626) 9.820 14.127 ( 5.806 -1.400 0.088) 5.973 15.208 ( 12.057 -0.075 6.199) 13.558 15.644 ( -14.092 1.821 0.123) 14.209 16.209 ( 5.179 -1.714 -7.355) 9.158 16.272 ( 2.568 -5.862 -5.031) 8.140 ======================= Grid point 121 (45/282) ======================= q-point: (-0.60 0.10 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.486 ( -5.016 8.329 23.673) 25.592 2.853 ( -6.197 1.024 3.708) 7.294 2.883 ( -1.534 7.880 2.100) 8.298 3.540 ( -2.508 -8.950 5.299) 10.699 3.568 ( -1.363 5.446 -5.520) 7.873 3.829 ( -8.257 -8.223 -9.801) 15.227 4.189 ( -1.215 -0.849 -17.989) 18.050 4.509 ( 2.435 -8.726 -6.561) 11.185 4.590 ( -1.553 0.605 7.912) 8.086 4.790 ( 1.430 -7.513 -8.275) 11.267 5.089 ( 4.522 -2.517 9.782) 11.067 5.282 ( 4.182 -0.483 4.105) 5.880 5.742 ( 4.021 9.041 7.618) 12.488 6.088 ( 2.219 17.081 2.082) 17.350 6.151 ( 6.852 3.847 1.253) 7.957 6.731 ( 11.867 -5.690 -0.095) 13.161 6.838 ( -5.377 1.792 -3.384) 6.601 7.120 ( -2.878 1.350 -4.421) 5.445 7.204 ( -8.879 -4.683 -2.101) 10.256 7.319 ( 5.563 -14.763 -1.875) 15.887 7.485 ( -2.336 -1.957 -3.675) 4.774 7.628 ( -7.340 5.200 -6.021) 10.824 7.961 ( 3.022 8.400 0.691) 8.954 8.146 ( -0.013 0.884 2.097) 2.276 8.489 ( -10.271 -1.027 17.063) 19.943 8.674 ( 4.303 1.892 4.621) 6.592 8.762 ( 5.981 2.615 0.608) 6.556 8.877 ( -2.918 2.823 11.940) 12.611 9.359 ( 0.655 2.022 2.722) 3.454 9.735 ( -11.530 4.686 -3.960) 13.061 9.804 ( 1.778 -5.532 5.356) 7.903 10.025 ( 8.188 -8.895 -3.052) 12.470 10.267 ( 8.179 1.148 -3.664) 9.035 10.436 ( 5.532 -0.620 -11.917) 13.152 10.700 ( 0.757 -4.811 -6.028) 7.749 10.822 ( 5.606 -2.215 -2.801) 6.647 11.017 ( 1.939 5.837 8.003) 10.093 11.273 ( -5.334 3.519 6.060) 8.807 11.491 ( 2.507 -1.099 -6.488) 7.041 11.574 ( 0.011 -5.458 3.741) 6.617 11.662 ( 2.581 1.383 -13.061) 13.385 12.165 ( -3.369 0.866 4.192) 5.447 12.901 ( -5.562 5.850 6.199) 10.177 14.159 ( -1.178 -0.605 -2.725) 3.029 15.396 ( -13.617 1.195 1.750) 13.780 15.454 ( 8.316 -0.285 4.582) 9.499 16.234 ( 10.923 2.982 -10.051) 15.140 16.387 ( 4.782 -8.856 4.790) 11.146 ======================= Grid point 122 (46/282) ======================= q-point: (-0.50 0.10 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.419 ( -17.439 16.158 16.574) 28.981 2.664 ( -10.998 17.916 -5.164) 21.647 2.846 ( -0.896 -2.241 5.323) 5.844 3.428 ( -3.661 4.318 -4.116) 6.999 3.582 ( -6.104 -2.592 -7.697) 10.160 3.723 ( -5.741 -10.176 -3.714) 12.259 3.963 ( -6.738 -7.241 -8.226) 12.865 4.466 ( -15.880 7.453 0.390) 17.547 4.598 ( 1.638 -10.420 -2.618) 10.868 4.858 ( 4.903 -10.295 -3.298) 11.870 5.286 ( 4.529 3.338 14.211) 15.284 5.310 ( 1.653 1.442 -1.676) 2.760 5.770 ( -6.096 -1.975 8.924) 10.986 5.985 ( 0.917 17.430 -0.010) 17.454 6.228 ( 5.626 4.324 1.951) 7.359 6.739 ( -1.447 5.643 4.103) 7.125 6.919 ( -4.920 -4.569 -1.145) 6.812 7.020 ( 2.388 -3.858 -9.303) 10.350 7.114 ( -0.119 -5.991 -2.699) 6.572 7.370 ( -3.901 4.585 -5.048) 7.856 7.500 ( 1.152 -4.518 -2.363) 5.227 7.551 ( 6.052 -11.720 -1.595) 13.287 7.920 ( -1.036 7.929 3.914) 8.903 8.263 ( 11.918 2.036 -1.540) 12.188 8.415 ( -11.378 -1.428 5.447) 12.695 8.660 ( -13.015 0.707 2.010) 13.188 8.892 ( 6.886 0.584 16.636) 18.014 8.976 ( 9.174 8.942 2.353) 13.025 9.315 ( 1.376 11.888 -2.852) 12.302 9.579 ( -8.291 -5.242 4.259) 10.694 9.965 ( 4.874 -7.876 3.730) 9.985 10.169 ( 5.492 -6.115 -3.279) 8.849 10.287 ( 4.906 3.481 -6.566) 8.905 10.435 ( 6.734 -1.112 -7.431) 10.090 10.801 ( 5.945 -6.990 0.765) 9.208 10.870 ( 2.827 0.513 -0.506) 2.918 11.077 ( -1.556 5.567 8.217) 10.047 11.180 ( -0.751 3.414 2.735) 4.438 11.436 ( 2.015 5.517 -7.051) 9.177 11.622 ( 4.737 -0.530 -5.605) 7.358 11.737 ( 8.313 -8.656 -0.509) 12.012 12.157 ( -2.014 0.079 2.966) 3.586 12.776 ( -11.263 5.412 3.840) 13.072 14.053 ( -7.390 -0.196 -5.435) 9.175 15.134 ( -17.119 1.343 -0.925) 17.197 15.660 ( 7.853 -1.494 6.151) 10.086 16.307 ( 12.631 6.604 -4.799) 15.040 16.622 ( 9.314 -7.756 7.447) 14.226 ======================= Grid point 123 (47/282) ======================= q-point: (-0.40 0.10 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.085 ( -21.773 21.385 6.748) 31.256 2.224 ( -19.855 21.954 -4.329) 29.916 2.906 ( -2.050 -2.407 6.118) 6.887 3.277 ( -9.258 8.674 -1.066) 12.731 3.384 ( -9.090 -0.283 -8.664) 12.561 3.501 ( -10.127 2.900 -11.445) 15.555 3.959 ( -18.450 15.371 -2.456) 24.140 4.099 ( -7.159 -12.916 9.009) 17.299 4.685 ( 2.854 -8.320 -1.796) 8.977 4.998 ( 4.555 -11.485 -4.003) 12.988 5.349 ( 3.226 -5.330 1.080) 6.323 5.430 ( 0.656 4.446 10.016) 10.978 5.746 ( -9.492 -9.018 3.431) 13.535 5.872 ( -0.107 11.368 -0.947) 11.408 6.286 ( 2.913 6.899 1.904) 7.727 6.723 ( -6.778 2.418 -0.075) 7.197 6.768 ( -0.040 7.060 7.019) 9.955 7.025 ( 2.861 7.346 -11.140) 13.647 7.150 ( 0.532 -12.991 -3.246) 13.401 7.273 ( -1.570 -4.047 -2.787) 5.158 7.554 ( 1.984 -5.179 1.967) 5.884 7.740 ( 6.840 -12.396 -2.502) 14.377 7.937 ( 3.648 3.435 4.711) 6.878 8.235 ( -11.386 -1.294 1.411) 11.546 8.349 ( -6.450 1.858 -1.670) 6.917 8.582 ( 5.676 -2.459 -0.896) 6.250 8.953 ( 5.661 11.289 -3.850) 13.203 9.137 ( -4.912 -1.367 4.585) 6.857 9.323 ( 16.913 15.102 13.156) 26.215 9.581 ( -6.044 -6.404 6.817) 11.136 10.064 ( 5.139 -4.810 -14.826) 16.412 10.196 ( 3.237 -0.856 -1.622) 3.720 10.338 ( 2.537 1.984 7.064) 7.763 10.508 ( 7.339 -0.940 -3.072) 8.011 10.797 ( -7.853 -0.018 0.273) 7.857 10.911 ( 2.046 -1.058 1.953) 3.020 11.118 ( 6.428 7.071 0.900) 9.599 11.328 ( 8.839 -4.946 4.851) 11.230 11.410 ( 7.447 6.926 1.407) 10.267 11.620 ( 4.922 4.358 -6.802) 9.459 11.926 ( 7.615 -8.787 -0.350) 11.633 12.158 ( -0.755 -1.475 0.774) 1.829 12.578 ( -14.087 2.785 2.839) 14.638 13.857 ( -10.017 -0.385 -6.816) 12.122 14.854 ( -17.075 1.288 -0.626) 17.135 15.824 ( 4.321 -2.972 4.905) 7.181 16.399 ( 11.102 9.364 -2.070) 14.671 16.915 ( 11.894 -4.053 9.577) 15.799 ======================= Grid point 124 (48/282) ======================= q-point: (-0.30 0.10 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.587 ( -23.616 25.292 -1.404) 34.632 1.678 ( -23.874 26.639 1.046) 35.787 2.790 ( -30.089 38.448 6.320) 49.229 2.944 ( -5.899 0.369 7.976) 9.927 3.172 ( -7.796 0.172 -6.261) 10.000 3.298 ( -6.305 -2.071 -2.805) 7.205 3.615 ( -7.461 11.874 2.984) 14.338 4.260 ( -1.454 -21.278 0.331) 21.331 4.769 ( 3.511 -3.637 -0.628) 5.094 5.035 ( 0.134 0.110 -4.676) 4.679 5.411 ( -4.926 -0.899 -0.583) 5.041 5.496 ( 2.727 -7.948 4.394) 9.482 5.736 ( -6.832 -11.925 3.702) 14.233 5.813 ( 1.332 0.352 -2.789) 3.110 6.203 ( -1.450 9.301 -5.404) 10.854 6.679 ( 1.392 5.931 2.216) 6.483 6.730 ( -1.743 14.322 0.129) 14.428 6.920 ( 0.769 6.578 -0.126) 6.625 7.212 ( 2.184 -4.317 0.199) 4.842 7.339 ( -0.171 -20.040 -0.126) 20.041 7.652 ( 0.759 -7.607 1.668) 7.825 7.871 ( 5.649 -7.105 -4.443) 10.106 8.020 ( -4.235 -3.113 5.929) 7.923 8.135 ( -1.669 -3.997 2.851) 5.185 8.216 ( -6.996 -1.351 -1.004) 7.196 8.699 ( 6.834 -1.071 -2.008) 7.202 8.910 ( 5.456 9.520 -4.736) 11.951 9.053 ( 1.616 9.425 -4.877) 10.735 9.606 ( -3.217 -3.429 6.330) 7.885 9.651 ( 8.745 1.672 18.032) 20.111 9.954 ( 0.712 -1.190 -17.110) 17.166 10.244 ( 4.102 0.928 -3.270) 5.328 10.425 ( 1.356 4.277 10.377) 11.306 10.560 ( 2.163 5.739 0.757) 6.180 10.739 ( 3.479 -0.199 -1.079) 3.648 10.983 ( 5.502 1.507 -1.121) 5.814 11.141 ( 0.202 -1.344 -4.361) 4.568 11.382 ( 3.932 16.738 5.691) 18.111 11.523 ( 3.008 -2.756 -3.915) 5.654 11.754 ( 14.246 -4.652 6.847) 16.476 12.075 ( 3.487 -8.086 -0.624) 8.828 12.179 ( 2.556 -1.955 -1.754) 3.665 12.390 ( -11.987 0.842 3.342) 12.472 13.645 ( -8.715 -0.168 -6.767) 11.035 14.601 ( -14.978 1.268 1.660) 15.123 15.933 ( 0.525 -5.395 3.391) 6.394 16.443 ( 6.577 10.207 -1.313) 12.214 17.209 ( 13.316 0.574 6.965) 15.038 ======================= Grid point 125 (49/282) ======================= q-point: (-0.20 0.10 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.004 ( -19.262 29.765 -0.831) 35.463 1.184 ( -18.693 31.930 13.120) 39.257 2.062 ( -30.933 54.734 22.974) 66.936 2.992 ( -2.601 -2.642 14.574) 15.038 3.053 ( -2.911 0.599 0.076) 2.972 3.257 ( -2.123 -3.319 3.634) 5.360 3.522 ( -3.476 6.901 6.749) 10.259 4.365 ( -0.738 -18.959 -6.162) 19.949 4.824 ( 4.584 3.883 -1.418) 6.173 4.945 ( -2.965 4.016 -3.608) 6.159 5.321 ( -4.422 -2.984 -3.998) 6.666 5.598 ( 0.100 -7.179 -0.727) 7.216 5.794 ( -4.514 -16.685 3.105) 17.562 5.847 ( 3.013 -7.584 -3.886) 9.039 6.056 ( 0.619 8.941 -8.081) 12.068 6.564 ( 0.713 13.787 -7.496) 15.710 6.620 ( -2.203 13.262 0.356) 13.448 6.914 ( 0.719 3.602 2.775) 4.604 7.340 ( 2.504 -6.299 11.879) 13.677 7.540 ( 1.990 -21.871 4.261) 22.371 7.709 ( -2.574 -9.153 1.141) 9.576 7.936 ( 1.976 -3.706 -3.737) 5.622 8.031 ( -1.042 -3.855 4.118) 5.736 8.141 ( -3.704 -5.248 0.073) 6.424 8.252 ( 1.346 -2.388 7.541) 8.024 8.734 ( -0.932 -2.578 -2.677) 3.832 8.891 ( 9.067 11.074 -6.272) 15.626 8.969 ( 4.111 9.830 -6.102) 12.278 9.627 ( -3.165 -6.615 -0.799) 7.377 9.802 ( -1.861 -3.594 -11.400) 12.097 9.873 ( 0.221 0.085 8.788) 8.791 10.256 ( 2.974 -0.943 -3.220) 4.483 10.519 ( 2.977 12.638 1.249) 13.044 10.556 ( 6.371 5.374 6.730) 10.713 10.822 ( 6.737 0.944 -6.507) 9.414 10.973 ( -1.528 9.235 0.528) 9.375 11.044 ( 1.603 4.466 -3.212) 5.730 11.471 ( 6.604 -2.544 6.824) 9.831 11.551 ( -2.731 -7.697 -1.374) 8.282 12.022 ( 2.064 -5.686 4.246) 7.390 12.136 ( 2.150 -3.933 0.430) 4.503 12.228 ( 5.509 -0.757 -2.910) 6.276 12.299 ( -3.488 1.480 4.886) 6.183 13.489 ( -3.216 0.540 -5.111) 6.062 14.434 ( -9.662 1.232 5.381) 11.128 15.989 ( -3.926 -8.323 2.893) 9.647 16.421 ( 2.271 9.814 -0.885) 10.112 17.349 ( 6.873 7.065 -14.341) 17.402 ======================= Grid point 126 (50/282) ======================= q-point: (-0.10 0.10 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.822 ( 8.497 18.212 25.717) 32.638 0.995 ( 0.563 25.875 28.625) 38.591 1.614 ( -9.560 52.382 38.760) 65.861 3.083 ( 4.262 0.669 5.462) 6.961 3.164 ( 0.521 -6.679 9.248) 11.420 3.366 ( -0.087 -6.292 9.582) 11.464 3.536 ( 0.036 1.878 10.509) 10.676 4.420 ( 0.978 -16.514 -10.547) 19.619 4.783 ( 2.214 9.876 -5.669) 11.601 4.877 ( 0.253 -0.592 -4.728) 4.771 5.262 ( -0.816 -3.304 -5.483) 6.453 5.618 ( -1.273 -8.560 -4.608) 9.804 5.867 ( 0.244 -6.138 -7.497) 9.692 5.892 ( 0.622 -5.478 -2.698) 6.138 5.982 ( 1.118 -7.802 -1.830) 8.091 6.420 ( 3.491 12.319 -7.761) 14.972 6.438 ( -5.839 14.312 -1.572) 15.537 6.922 ( 0.915 2.962 1.059) 3.276 7.605 ( 0.127 -17.246 14.035) 22.236 7.755 ( 1.142 -9.377 1.742) 9.606 7.800 ( 0.087 -18.241 7.958) 19.901 7.937 ( -0.466 -3.233 -0.852) 3.376 8.104 ( 2.519 -2.038 2.293) 3.969 8.172 ( -0.180 -4.210 2.711) 5.011 8.322 ( -4.072 -0.329 7.862) 8.860 8.683 ( -2.639 -2.143 -5.091) 6.122 8.854 ( 7.824 14.834 -8.851) 18.963 8.915 ( 3.066 4.728 -4.530) 7.230 9.570 ( -0.796 -0.692 -8.134) 8.202 9.653 ( -18.399 1.739 -2.532) 18.654 9.866 ( -1.290 -4.354 -6.621) 8.028 10.297 ( 2.557 -2.367 -1.073) 3.646 10.434 ( -2.633 9.757 -0.151) 10.107 10.475 ( -9.960 14.500 -5.465) 18.421 10.767 ( 0.479 2.299 -4.372) 4.963 10.964 ( -6.093 1.937 -0.310) 6.401 11.039 ( 7.747 3.761 4.431) 9.685 11.490 ( -9.910 -10.816 -5.813) 15.779 11.728 ( 8.692 -4.801 9.679) 13.866 11.976 ( -4.083 -0.340 -4.618) 6.173 12.187 ( -5.627 -4.351 2.096) 7.415 12.294 ( 0.946 -0.357 1.481) 1.793 12.316 ( 1.027 -0.095 1.317) 1.673 13.465 ( 5.990 1.287 -1.911) 6.418 14.409 ( -1.714 0.848 8.708) 8.916 16.020 ( -3.052 -9.311 3.268) 10.329 16.358 ( 0.371 8.746 -0.838) 8.794 16.865 ( -11.418 34.046 -29.145) 46.249 ======================= Grid point 129 (51/282) ======================= q-point: ( 0.20 0.20 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.353 ( 0.818 -0.000 28.968) 28.980 2.641 ( 12.916 -0.000 14.396) 19.341 3.009 ( -9.220 0.000 4.717) 10.356 3.431 ( -2.409 0.000 3.757) 4.463 3.730 ( 4.179 -0.000 -3.116) 5.213 3.976 ( -2.032 0.000 -18.143) 18.257 4.135 ( 3.320 -0.000 -4.120) 5.291 4.385 ( 9.490 -0.000 12.980) 16.080 4.593 ( 8.109 -0.000 -0.509) 8.125 4.794 ( -2.024 0.000 -19.444) 19.549 5.026 ( -5.525 0.000 -10.344) 11.727 5.042 ( 10.610 -0.000 12.450) 16.358 5.697 ( 12.639 -0.000 -0.319) 12.643 6.112 ( 5.689 -0.000 1.020) 5.780 6.163 ( 5.720 -0.000 6.280) 8.495 6.654 ( 6.926 -0.000 0.699) 6.961 6.710 ( 14.045 -0.000 -5.654) 15.141 7.081 ( -1.841 0.000 0.184) 1.850 7.294 ( -4.860 0.000 -3.525) 6.004 7.345 ( -15.967 0.000 1.246) 16.015 7.594 ( -9.267 0.000 -4.800) 10.437 7.862 ( -5.262 0.000 -12.948) 13.976 8.069 ( -5.764 0.000 1.438) 5.941 8.199 ( -6.514 0.000 6.748) 9.380 8.392 ( -4.228 0.000 17.973) 18.464 8.549 ( 14.723 -0.000 4.541) 15.407 8.693 ( -4.973 0.000 1.284) 5.136 8.828 ( -3.885 0.000 14.099) 14.625 9.296 ( 1.925 -0.000 6.680) 6.952 9.689 ( 10.502 -0.000 -5.615) 11.909 9.800 ( -1.040 0.000 -0.525) 1.165 10.018 ( 0.313 -0.000 0.596) 0.673 10.285 ( -2.705 0.000 -11.481) 11.795 10.468 ( 4.941 -0.000 -12.523) 13.463 10.696 ( 1.533 -0.000 0.185) 1.544 10.770 ( -2.768 0.000 -9.260) 9.665 10.995 ( 2.569 -0.000 8.366) 8.752 11.179 ( 5.277 -0.000 2.467) 5.825 11.444 ( 2.066 -0.000 1.340) 2.463 11.641 ( -12.189 0.000 0.499) 12.199 11.829 ( -0.344 0.000 -13.717) 13.721 12.200 ( -4.558 0.000 4.370) 6.315 12.941 ( 0.539 -0.000 9.246) 9.261 14.116 ( 6.506 -0.000 -0.153) 6.507 15.208 ( 11.912 -0.000 6.272) 13.463 15.663 ( -13.925 0.000 -0.469) 13.933 16.179 ( 0.186 -0.000 3.295) 3.301 16.237 ( 9.301 -0.000 -16.253) 18.726 ======================= Grid point 130 (52/282) ======================= q-point: ( 0.30 0.20 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.598 ( -1.745 4.895 26.050) 26.564 2.886 ( -3.423 3.821 6.347) 8.161 2.943 ( 0.887 -1.172 8.062) 8.194 3.425 ( -4.060 -3.187 2.732) 5.839 3.629 ( -6.695 -0.705 -8.031) 10.480 3.767 ( -3.203 1.136 -14.235) 14.635 4.144 ( 3.049 -3.833 -9.981) 11.118 4.422 ( -3.733 -2.092 -16.878) 17.412 4.570 ( -6.579 -1.298 -3.095) 7.386 4.716 ( 6.063 -2.887 -2.356) 7.117 5.055 ( 7.313 -1.062 10.118) 12.529 5.286 ( 5.359 0.311 13.028) 14.090 5.893 ( 9.111 7.673 2.066) 12.089 6.188 ( 3.831 1.790 1.753) 4.578 6.311 ( 6.016 7.430 6.626) 11.632 6.678 ( 3.769 2.546 0.010) 4.548 6.842 ( 1.373 -3.050 -7.401) 8.122 7.021 ( -2.191 -10.313 -1.718) 10.682 7.151 ( -9.131 -1.546 2.019) 9.478 7.214 ( -4.574 -0.206 -6.631) 8.058 7.454 ( -2.335 -1.278 -4.247) 5.012 7.690 ( -4.031 2.089 -8.013) 9.210 8.062 ( 6.847 4.291 -0.370) 8.089 8.149 ( -6.602 -0.560 5.860) 8.845 8.470 ( -12.794 -0.859 18.267) 22.318 8.680 ( 1.919 -0.214 5.890) 6.199 8.798 ( 6.124 1.498 0.906) 6.370 8.900 ( -0.554 0.437 17.208) 17.223 9.391 ( 4.438 1.503 3.823) 6.047 9.747 ( -6.185 -1.522 0.710) 6.409 9.792 ( -3.797 1.175 0.741) 4.043 9.936 ( 9.510 -2.033 -10.302) 14.167 10.277 ( 9.169 0.244 -5.156) 10.522 10.429 ( 5.498 -0.197 -11.808) 13.027 10.631 ( -2.577 -3.239 -5.311) 6.733 10.801 ( 7.891 -0.557 -2.127) 8.192 11.102 ( 1.438 4.198 10.029) 10.966 11.302 ( 4.224 -0.248 3.820) 5.701 11.460 ( -4.907 -0.200 -2.634) 5.573 11.505 ( -0.106 -3.720 1.019) 3.859 11.688 ( 1.262 1.208 -15.128) 15.228 12.181 ( -3.542 0.820 5.208) 6.351 12.969 ( -6.392 2.538 7.434) 10.127 14.152 ( -0.476 -0.316 -3.063) 3.116 15.423 ( -6.583 1.965 2.329) 7.254 15.446 ( 1.318 -0.941 3.267) 3.646 16.265 ( 13.049 1.029 -10.391) 16.713 16.281 ( 6.329 -4.078 3.661) 8.372 ======================= Grid point 131 (53/282) ======================= q-point: (-0.60 0.20 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.676 ( -11.883 16.708 19.821) 28.517 2.815 ( -3.449 -0.539 4.708) 5.861 2.935 ( -4.227 14.698 -1.863) 15.406 3.447 ( -6.008 -4.177 -4.800) 8.751 3.483 ( -6.845 -14.206 7.386) 17.413 3.580 ( -4.257 1.091 -10.558) 11.436 3.963 ( -6.464 4.710 -19.289) 20.881 4.332 ( 3.069 -17.401 -10.843) 20.731 4.501 ( -6.007 -2.824 2.815) 7.210 4.796 ( 4.468 -2.189 -2.565) 5.598 5.298 ( 6.985 1.348 12.867) 14.702 5.412 ( -1.938 6.503 9.722) 11.856 5.818 ( -8.481 9.157 1.435) 12.563 6.247 ( 3.061 -2.680 -1.214) 4.246 6.301 ( 2.619 21.546 3.499) 21.985 6.771 ( -1.682 -10.307 4.582) 11.404 6.799 ( 1.518 0.712 -0.660) 1.802 6.962 ( -11.765 -2.851 -5.305) 13.217 7.060 ( 3.060 -2.259 -6.196) 7.270 7.245 ( 5.445 -15.888 -6.145) 17.884 7.462 ( 3.810 -0.283 -0.536) 3.857 7.526 ( -5.846 3.567 -3.323) 7.611 8.027 ( -6.494 5.549 6.305) 10.617 8.284 ( 15.201 0.764 -2.260) 15.387 8.382 ( -12.926 -2.408 6.670) 14.744 8.676 ( -15.871 1.090 0.972) 15.938 8.860 ( 2.279 -2.469 17.516) 17.835 9.117 ( 11.659 7.802 4.972) 14.883 9.480 ( 8.418 6.536 1.101) 10.714 9.536 ( -11.688 0.294 0.480) 11.701 9.864 ( 3.107 -4.463 5.828) 7.971 10.083 ( 11.184 -4.561 -7.623) 14.283 10.305 ( 7.853 -0.268 -13.401) 15.535 10.446 ( 5.563 2.433 -2.807) 6.690 10.670 ( 5.638 -9.201 0.057) 10.791 10.889 ( 4.783 1.378 -0.291) 4.986 11.159 ( -4.189 4.499 10.369) 12.054 11.263 ( 0.979 7.452 -0.458) 7.530 11.489 ( 3.359 0.038 -3.280) 4.695 11.581 ( 6.407 -3.738 -6.009) 9.546 11.608 ( 4.520 -6.665 -3.459) 8.764 12.179 ( -2.014 1.918 4.570) 5.350 12.859 ( -12.294 4.739 5.133) 14.140 14.043 ( -8.138 -0.859 -5.845) 10.056 15.166 ( -15.228 2.517 -2.748) 15.677 15.634 ( 5.998 -1.775 7.066) 9.437 16.390 ( 14.378 4.243 -3.709) 15.443 16.513 ( 13.162 -6.067 4.547) 15.189 ======================= Grid point 132 (54/282) ======================= q-point: (-0.50 0.20 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.424 ( -15.737 22.419 5.739) 27.986 2.571 ( -15.243 22.604 -2.846) 27.411 2.882 ( -2.914 -0.602 8.150) 8.676 3.301 ( -9.402 -3.872 -3.280) 10.685 3.400 ( -5.316 0.637 -10.266) 11.579 3.581 ( -3.084 4.522 -1.521) 5.681 3.736 ( -4.922 -17.171 -1.381) 17.916 4.311 ( -12.616 11.370 -0.477) 16.991 4.502 ( 1.928 -12.423 -0.716) 12.592 4.861 ( 5.324 -5.029 -2.218) 7.652 5.330 ( -1.343 4.692 0.238) 4.887 5.486 ( -0.116 2.731 11.372) 11.696 5.652 ( -11.791 -3.078 2.399) 12.420 6.153 ( 1.197 22.596 -1.023) 22.651 6.342 ( 4.040 -1.672 1.720) 4.699 6.703 ( -9.595 -3.094 -5.381) 11.428 6.861 ( 2.353 3.348 9.239) 10.105 6.893 ( -1.809 -13.680 -1.089) 13.842 7.088 ( 5.736 0.316 -9.612) 11.198 7.280 ( -3.689 -0.555 -5.019) 6.254 7.467 ( 1.633 -9.116 0.391) 9.270 7.558 ( 2.680 -6.261 0.765) 6.853 7.988 ( -1.537 3.077 5.650) 6.615 8.207 ( -14.431 -2.004 3.041) 14.884 8.369 ( -13.300 0.360 -3.942) 13.876 8.550 ( 11.322 -1.270 -1.809) 11.536 9.048 ( -1.751 -2.038 11.687) 11.992 9.171 ( 6.988 10.646 -4.805) 13.611 9.473 ( -2.083 -0.694 6.574) 6.930 9.595 ( 10.636 10.354 6.638) 16.260 9.991 ( 5.911 -4.189 -8.884) 11.463 10.147 ( 5.847 -5.365 -4.519) 9.132 10.363 ( 5.807 1.051 3.121) 6.676 10.501 ( 9.194 0.886 -4.673) 10.351 10.769 ( -4.560 -3.668 1.405) 6.019 10.919 ( 1.883 1.668 -0.535) 2.572 11.240 ( 7.830 7.221 4.169) 11.438 11.256 ( 5.140 -1.723 1.443) 5.610 11.489 ( 5.188 3.231 0.252) 6.117 11.660 ( 9.145 0.297 -6.585) 11.274 11.774 ( 5.237 -10.838 1.833) 12.175 12.173 ( -0.968 2.723 2.450) 3.789 12.644 ( -15.648 5.690 3.854) 17.090 13.833 ( -12.021 -2.642 -7.017) 14.168 14.887 ( -15.098 2.791 -2.630) 15.578 15.780 ( 2.228 -2.813 6.108) 7.085 16.527 ( 11.642 7.272 -1.162) 13.775 16.843 ( 17.006 -4.967 6.352) 18.821 ======================= Grid point 133 (55/282) ======================= q-point: (-0.40 0.20 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.987 ( -18.258 26.602 -2.936) 32.398 2.118 ( -15.863 29.885 1.756) 33.880 2.911 ( -4.635 -1.642 8.207) 9.567 3.160 ( -8.180 -1.201 -2.562) 8.656 3.227 ( -5.188 0.679 -4.882) 7.156 3.389 ( -8.730 24.742 4.370) 26.599 3.829 ( -6.673 0.841 -1.929) 6.997 3.961 ( -11.387 -1.045 5.771) 12.809 4.637 ( 3.189 -12.272 -0.731) 12.701 4.978 ( 5.608 -6.448 -3.027) 9.066 5.339 ( 0.709 -4.605 -1.986) 5.065 5.446 ( -9.095 -2.880 3.730) 10.243 5.609 ( -4.048 -3.614 3.461) 6.436 5.983 ( -0.074 20.011 -1.329) 20.055 6.335 ( 0.685 6.916 -7.046) 9.897 6.674 ( 1.541 -8.621 2.192) 9.028 6.906 ( -2.181 5.398 -1.792) 6.091 6.977 ( -1.035 -11.468 3.327) 11.986 7.034 ( 2.122 4.123 -1.897) 5.010 7.206 ( -1.311 -2.293 -1.716) 3.150 7.551 ( -1.903 -5.626 3.865) 7.086 7.694 ( 4.512 -15.535 -2.005) 16.301 7.985 ( -8.132 -1.103 2.521) 8.585 8.067 ( -6.187 -4.356 2.867) 8.092 8.182 ( -6.863 -3.604 -1.150) 7.837 8.689 ( 6.928 0.244 -1.748) 7.149 9.058 ( 4.063 8.220 -2.528) 9.512 9.151 ( 2.382 4.705 -3.192) 6.164 9.520 ( -4.360 -2.933 7.189) 8.905 9.765 ( 9.897 7.886 6.903) 14.415 9.934 ( 5.205 -0.814 -17.369) 18.151 10.265 ( 5.044 0.299 0.057) 5.053 10.480 ( 2.642 2.581 11.249) 11.839 10.624 ( 12.499 0.439 -3.889) 13.097 10.718 ( -0.559 -0.478 -1.171) 1.383 10.938 ( 1.262 -4.786 -1.905) 5.304 11.166 ( -2.015 6.075 -2.120) 6.742 11.500 ( 6.485 2.089 3.854) 7.827 11.650 ( 11.671 0.247 7.982) 14.142 11.678 ( 7.245 6.473 -7.879) 12.509 11.934 ( 3.240 -9.777 1.312) 10.383 12.168 ( 1.804 0.964 -0.509) 2.108 12.417 ( -13.868 3.309 5.274) 15.201 13.614 ( -10.642 -4.121 -6.454) 13.110 14.633 ( -13.156 2.817 -0.038) 13.454 15.863 ( -1.368 -3.856 4.569) 6.134 16.593 ( 6.689 9.143 -1.078) 11.380 17.190 ( 16.293 -2.660 4.557) 17.126 ======================= Grid point 134 (56/282) ======================= q-point: (-0.30 0.20 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.481 ( -12.621 31.923 -1.814) 34.376 1.701 ( -11.395 34.534 7.487) 37.128 2.903 ( -13.040 41.910 15.165) 46.438 2.968 ( -6.651 9.673 11.517) 16.445 3.060 ( -3.204 0.179 0.839) 3.317 3.205 ( -3.295 -2.709 3.443) 5.482 3.651 ( -4.487 10.221 5.359) 12.382 4.044 ( -1.651 -22.582 -4.756) 23.137 4.760 ( 2.177 -9.886 -0.184) 10.125 5.023 ( 3.045 2.363 -5.028) 6.335 5.271 ( -4.727 -3.511 -5.330) 7.942 5.494 ( 0.141 -8.817 2.827) 9.260 5.593 ( -5.190 -7.262 0.175) 8.928 5.848 ( 0.550 10.009 -2.153) 10.253 6.206 ( 2.899 9.725 -10.298) 14.457 6.738 ( -0.262 7.276 -9.962) 12.339 6.759 ( 0.993 4.621 -2.442) 5.320 7.002 ( -2.521 7.575 6.460) 10.270 7.148 ( 0.261 -25.145 4.778) 25.596 7.274 ( 1.225 -4.673 8.071) 9.406 7.581 ( -3.282 -7.749 1.591) 8.565 7.836 ( 2.235 -9.592 -2.698) 10.212 7.937 ( -2.289 -7.439 3.421) 8.502 8.041 ( -5.817 -7.272 1.154) 9.384 8.204 ( 0.399 -4.152 4.969) 6.488 8.718 ( 0.261 0.616 -1.746) 1.869 9.047 ( 8.443 9.742 -5.835) 14.151 9.101 ( 1.838 6.490 -4.763) 8.258 9.519 ( -6.144 -5.421 3.243) 8.812 9.798 ( 3.989 2.021 -12.699) 13.463 9.912 ( 3.784 3.624 -1.207) 5.377 10.274 ( -0.100 2.944 0.578) 3.002 10.611 ( 1.506 3.552 7.138) 8.114 10.713 ( 10.662 10.460 -0.731) 14.954 10.812 ( 9.676 -3.537 -4.629) 11.294 10.964 ( -4.610 -13.952 -6.198) 15.948 11.085 ( -0.234 6.724 2.127) 7.056 11.471 ( -1.389 7.268 -8.831) 11.521 11.629 ( 4.108 11.038 6.503) 13.454 11.892 ( -0.870 -9.662 4.369) 10.639 12.064 ( 5.557 -5.201 1.502) 7.758 12.213 ( 5.236 -1.036 -2.372) 5.841 12.311 ( -6.328 0.329 6.896) 9.365 13.472 ( -4.219 -3.404 -4.310) 6.926 14.465 ( -8.239 2.844 4.187) 9.670 15.893 ( -3.748 -4.731 3.590) 7.022 16.576 ( 2.729 10.111 -1.296) 10.553 17.397 ( 8.269 0.380 -7.027) 10.859 ======================= Grid point 135 (57/282) ======================= q-point: (-0.20 0.20 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.211 ( 5.585 29.900 10.350) 32.129 1.457 ( -0.428 32.683 17.831) 37.233 2.492 ( -5.724 59.973 26.219) 65.704 3.060 ( -3.701 -5.677 13.156) 14.799 3.092 ( 4.028 0.015 5.586) 6.887 3.289 ( 1.916 -4.093 9.377) 10.410 3.610 ( -1.873 6.973 8.529) 11.175 4.125 ( -0.175 -21.354 -9.782) 23.489 4.831 ( -0.825 -6.350 -2.047) 6.723 4.953 ( 2.954 9.910 -6.849) 12.403 5.210 ( 1.102 -2.919 -6.186) 6.928 5.518 ( -2.404 -4.633 -3.172) 6.108 5.623 ( -3.618 -15.658 0.161) 16.071 5.819 ( 2.310 -2.394 -2.635) 4.244 6.075 ( 4.010 10.851 -11.053) 16.000 6.577 ( 1.930 7.958 -10.457) 13.281 6.630 ( -4.751 10.107 -5.020) 12.244 6.993 ( 1.298 6.222 3.175) 7.105 7.426 ( -1.088 -10.801 10.777) 15.297 7.441 ( 1.036 -23.294 11.587) 26.037 7.634 ( -0.195 -8.016 2.826) 8.502 7.866 ( -0.462 -6.146 -3.281) 6.982 8.032 ( 0.582 -6.357 1.936) 6.671 8.077 ( 0.436 -8.601 3.623) 9.343 8.285 ( -2.765 -4.475 6.701) 8.519 8.675 ( -1.341 1.441 -3.018) 3.603 9.009 ( 0.738 7.119 -6.033) 9.360 9.035 ( 6.082 9.302 -6.319) 12.785 9.495 ( -4.573 -7.284 -1.112) 8.672 9.701 ( 0.380 5.099 -9.135) 10.469 9.872 ( 0.625 3.625 -7.747) 8.576 10.284 ( 1.813 0.710 2.311) 3.022 10.552 ( -7.526 5.059 -2.919) 9.526 10.703 ( -2.299 13.203 -2.351) 13.606 10.813 ( 3.424 4.271 -6.186) 8.260 11.004 ( -6.391 3.607 -0.214) 7.342 11.045 ( 6.310 -9.605 -2.645) 11.793 11.330 ( -4.802 -0.859 -5.523) 7.369 11.760 ( 9.486 6.468 11.403) 16.182 11.899 ( -4.545 -8.575 -3.230) 10.228 12.122 ( -5.990 -3.925 0.870) 7.214 12.277 ( 3.844 -1.826 -1.097) 4.395 12.306 ( -5.169 -1.305 5.227) 7.466 13.473 ( 5.642 -0.966 -0.911) 5.796 14.434 ( -0.989 2.543 7.881) 8.340 15.915 ( -1.899 -5.239 3.289) 6.471 16.509 ( 0.822 10.324 -1.585) 10.477 17.207 ( -6.806 13.166 -23.198) 27.529 ======================= Grid point 136 (58/282) ======================= q-point: (-0.10 0.20 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.329 ( 8.870 16.234 21.850) 28.629 1.600 ( 14.907 22.003 26.747) 37.707 2.433 ( 17.337 46.217 30.119) 57.825 3.149 ( -4.514 -7.117 7.502) 11.283 3.288 ( 10.356 -0.416 10.342) 14.641 3.439 ( 1.036 0.108 8.775) 8.837 3.671 ( 1.800 2.337 13.797) 14.109 4.176 ( 0.663 -19.764 -12.713) 23.509 4.770 ( -2.257 2.040 -5.734) 6.491 4.860 ( 4.086 7.435 -11.828) 14.556 5.198 ( 2.247 -0.081 -6.129) 6.529 5.495 ( 0.215 -6.842 -6.921) 9.735 5.667 ( -4.948 -15.307 -2.763) 16.322 5.885 ( 5.421 -6.410 -5.610) 10.097 5.966 ( 2.620 4.684 -5.551) 7.721 6.415 ( -4.665 11.537 -5.238) 13.502 6.493 ( 6.223 7.368 -6.935) 11.879 6.992 ( 2.343 6.958 1.302) 7.456 7.571 ( -4.765 -10.189 11.184) 15.862 7.695 ( -2.638 -14.878 4.220) 15.688 7.772 ( 1.851 -14.834 8.566) 17.230 7.869 ( -1.145 -5.333 -2.354) 5.941 8.102 ( 1.224 -5.352 0.769) 5.544 8.186 ( 0.310 -4.911 4.403) 6.603 8.303 ( -5.788 -1.637 5.488) 8.143 8.600 ( -1.380 2.216 -5.775) 6.337 8.885 ( -1.722 5.913 -7.077) 9.381 8.978 ( 2.769 8.557 -5.311) 10.445 9.450 ( -16.338 13.469 5.573) 21.895 9.478 ( -1.896 -2.347 -6.056) 6.766 9.823 ( 9.665 1.800 -11.151) 14.866 10.268 ( -10.411 10.421 -6.547) 16.120 10.356 ( 3.859 -0.394 -1.181) 4.055 10.537 ( -5.648 11.202 6.423) 14.094 10.755 ( -0.504 2.928 -1.021) 3.141 10.923 ( 0.564 1.139 -3.332) 3.566 11.147 ( -5.014 -13.618 -9.812) 17.517 11.232 ( 4.217 5.052 0.971) 6.652 11.693 ( -14.047 2.651 -3.388) 14.691 12.029 ( -10.816 -4.142 4.991) 12.612 12.072 ( 13.544 -2.778 0.919) 13.856 12.227 ( -8.200 -0.867 1.044) 8.311 12.364 ( 2.632 -4.050 4.241) 6.428 13.615 ( 11.471 1.218 1.653) 11.654 14.539 ( 5.412 1.603 9.032) 10.651 15.977 ( -0.175 -6.608 0.967) 6.681 16.422 ( 0.728 9.455 -2.786) 9.883 16.708 ( -7.672 20.689 -19.372) 29.362 ======================= Grid point 140 (59/282) ======================= q-point: ( 0.30 -0.70 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.803 ( -2.220 0.000 12.417) 12.614 2.859 ( -9.691 0.000 15.037) 17.889 3.046 ( -1.806 0.000 5.191) 5.496 3.344 ( -6.098 0.000 0.003) 6.098 3.396 ( -12.955 0.000 -4.752) 13.799 3.601 ( -1.987 0.000 -12.185) 12.346 4.068 ( -7.921 0.000 -24.431) 25.683 4.119 ( 5.630 -0.000 -7.091) 9.054 4.477 ( -3.968 0.000 2.702) 4.801 4.773 ( 5.611 -0.000 -3.338) 6.529 5.311 ( 7.294 -0.000 14.827) 16.524 5.460 ( -1.684 0.000 13.459) 13.564 5.965 ( -3.439 0.000 -4.217) 5.442 6.163 ( -6.818 0.000 -1.248) 6.931 6.526 ( 5.132 -0.000 10.410) 11.606 6.694 ( -1.734 0.000 5.409) 5.680 6.777 ( 1.780 -0.000 -9.784) 9.944 6.923 ( -7.192 0.000 0.155) 7.194 7.040 ( 0.963 -0.000 -13.098) 13.133 7.100 ( 1.468 -0.000 -1.174) 1.880 7.459 ( 5.679 -0.000 -0.658) 5.717 7.559 ( -7.324 0.000 -3.805) 8.253 8.073 ( -9.285 0.000 7.403) 11.875 8.290 ( 19.451 -0.000 -3.553) 19.773 8.360 ( -15.629 0.000 7.802) 17.468 8.685 ( -16.850 0.000 0.210) 16.851 8.840 ( 1.631 -0.000 16.919) 16.998 9.181 ( 12.923 -0.000 9.426) 15.996 9.526 ( 8.608 -0.000 2.146) 8.872 9.538 ( -12.604 0.000 -0.824) 12.631 9.839 ( 1.655 -0.000 5.298) 5.551 10.044 ( 14.435 -0.000 -9.982) 17.550 10.300 ( 8.843 -0.000 -15.661) 17.985 10.492 ( 7.362 -0.000 4.085) 8.419 10.566 ( 3.231 -0.000 -5.385) 6.280 10.901 ( 5.597 -0.000 0.002) 5.597 11.197 ( -6.668 0.000 10.081) 12.087 11.372 ( 3.410 -0.000 -1.575) 3.757 11.425 ( 6.086 -0.000 3.144) 6.850 11.545 ( 7.272 -0.000 -5.559) 9.153 11.573 ( 0.344 -0.000 -9.267) 9.274 12.196 ( -2.082 0.000 5.305) 5.698 12.898 ( -12.235 0.000 5.561) 13.440 14.035 ( -8.709 0.000 -6.073) 10.617 15.190 ( -14.528 0.000 -3.777) 15.011 15.618 ( 5.171 -0.000 7.651) 9.235 16.439 ( 10.734 -0.000 3.369) 11.250 16.448 ( 19.139 -0.000 -3.150) 19.396 ======================= Grid point 142 (60/282) ======================= q-point: (-0.60 0.30 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.715 ( -8.208 11.573 -0.057) 14.188 2.871 ( -10.057 14.928 10.568) 20.873 2.910 ( -9.636 5.584 3.559) 11.692 3.208 ( -12.569 -6.881 0.309) 14.333 3.312 ( -5.065 -13.958 -1.151) 14.894 3.468 ( -4.892 -3.507 -6.896) 9.153 3.769 ( -0.499 7.972 -11.687) 14.156 4.213 ( 6.792 -11.227 -5.181) 14.107 4.480 ( -1.957 1.601 5.367) 5.933 4.822 ( 4.563 -1.079 -3.218) 5.687 5.457 ( -8.479 5.728 8.175) 13.097 5.514 ( 1.116 1.024 11.311) 11.412 5.708 ( -12.337 13.020 -4.640) 18.527 6.119 ( -6.164 -19.952 -1.786) 20.959 6.555 ( 2.689 24.388 3.191) 24.742 6.692 ( -7.520 2.200 -4.386) 8.979 6.766 ( 2.064 -4.378 -1.876) 5.191 6.856 ( 3.123 -7.778 5.588) 10.073 7.058 ( 6.407 -3.604 -5.708) 9.306 7.145 ( 2.647 -9.455 -4.910) 10.978 7.411 ( -6.157 0.698 -2.504) 6.683 7.529 ( 0.258 -0.209 2.125) 2.151 8.024 ( -4.461 1.384 6.333) 7.869 8.183 ( -15.139 -0.875 4.029) 15.690 8.363 ( -19.533 -0.598 -4.760) 20.113 8.544 ( 16.351 0.098 -3.426) 16.706 9.014 ( 0.029 -1.382 13.568) 13.638 9.318 ( 3.412 5.738 -9.232) 11.393 9.467 ( -0.876 1.139 13.375) 13.452 9.696 ( 11.525 1.582 2.071) 11.816 9.949 ( 4.630 -1.051 3.624) 5.972 10.067 ( 6.914 -3.591 -15.938) 17.740 10.371 ( 8.910 0.142 0.586) 8.931 10.560 ( 7.545 6.764 -1.995) 10.327 10.680 ( 2.915 -7.790 0.841) 8.359 10.941 ( 0.736 0.806 -1.460) 1.823 11.223 ( 5.362 -0.533 4.842) 7.244 11.399 ( 4.494 10.890 -2.565) 12.057 11.511 ( 3.819 -0.476 -2.181) 4.423 11.589 ( 6.640 -9.927 -0.169) 11.944 11.667 ( 8.828 -1.188 0.935) 8.957 12.211 ( -1.573 1.530 4.162) 4.705 12.724 ( -14.576 3.504 3.955) 15.504 13.793 ( -14.333 -1.850 -7.345) 16.211 14.925 ( -13.990 1.623 -4.310) 14.729 15.745 ( 1.278 -1.401 7.145) 7.393 16.613 ( 10.489 3.569 1.329) 11.159 16.778 ( 21.398 -2.974 2.647) 21.766 ======================= Grid point 143 (61/282) ======================= q-point: (-0.50 0.30 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.378 ( -13.823 23.933 -3.117) 27.813 2.557 ( -10.926 26.665 2.080) 28.892 2.870 ( -6.642 -4.179 6.117) 9.950 3.105 ( -9.938 -4.762 3.859) 11.676 3.211 ( -5.151 -0.919 -8.037) 9.590 3.501 ( -3.430 -24.778 -1.203) 25.043 3.689 ( 3.877 13.582 2.512) 14.346 4.270 ( -4.763 13.129 0.895) 13.995 4.470 ( -0.730 -3.206 3.948) 5.138 4.887 ( 5.078 -4.535 -1.568) 6.986 5.349 ( -3.004 6.646 1.971) 7.555 5.399 ( -12.707 -0.496 -1.802) 12.844 5.597 ( -3.077 0.446 4.586) 5.541 6.212 ( -2.255 -19.507 -0.374) 19.641 6.383 ( 0.120 19.367 -5.547) 20.146 6.524 ( -3.503 1.629 -3.915) 5.500 6.855 ( 4.813 -1.226 -0.806) 5.031 6.997 ( 1.117 -0.069 3.350) 3.532 7.089 ( 4.333 1.598 -2.567) 5.284 7.172 ( -2.698 -3.834 -1.525) 4.930 7.419 ( 1.938 -14.004 2.518) 14.360 7.509 ( -5.948 -3.291 2.088) 7.111 7.988 ( -12.442 1.212 -0.275) 12.504 8.014 ( -7.737 -2.130 3.298) 8.676 8.114 ( -7.179 -4.867 -0.104) 8.674 8.703 ( 8.731 1.168 -2.976) 9.297 9.112 ( 0.210 0.138 5.677) 5.682 9.229 ( 3.620 4.160 -9.033) 10.583 9.546 ( -0.767 6.045 8.470) 10.435 9.847 ( 8.075 2.602 -2.467) 8.835 9.945 ( 7.543 2.126 -12.973) 15.157 10.190 ( 6.680 -10.155 1.518) 12.250 10.500 ( 0.218 1.020 10.142) 10.196 10.616 ( 8.169 1.026 -4.601) 9.431 10.748 ( 6.443 2.623 -0.241) 6.961 10.899 ( -1.498 -0.880 -4.379) 4.711 11.280 ( 0.945 7.638 -3.479) 8.446 11.503 ( 10.826 -5.270 4.696) 12.924 11.566 ( 1.330 -0.087 1.433) 1.957 11.758 ( 8.861 -5.955 -1.093) 10.732 11.842 ( 11.371 1.607 2.413) 11.735 12.203 ( -1.045 2.563 1.866) 3.338 12.502 ( -13.772 7.164 4.423) 16.142 13.530 ( -14.055 -6.015 -6.209) 16.501 14.678 ( -11.741 2.631 -1.756) 12.160 15.815 ( -2.091 -2.331 5.702) 6.505 16.711 ( 6.357 5.934 -0.281) 8.701 17.144 ( 18.690 -2.917 2.715) 19.110 ======================= Grid point 144 (62/282) ======================= q-point: (-0.40 0.30 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.957 ( -9.134 30.123 -1.478) 31.512 2.210 ( -7.772 31.890 3.511) 33.011 2.895 ( -4.342 -6.187 8.237) 11.179 3.048 ( -5.905 -1.975 4.551) 7.713 3.136 ( -1.202 -2.270 1.053) 2.776 3.578 ( -1.096 1.593 -1.349) 2.357 3.695 ( 1.996 2.137 3.223) 4.352 3.953 ( -13.634 29.782 10.712) 34.461 4.581 ( 2.047 -12.217 -0.246) 12.390 4.990 ( 4.401 -5.187 -1.868) 7.055 5.222 ( -5.396 -2.352 -5.398) 7.987 5.364 ( -1.180 -5.535 2.959) 6.386 5.551 ( -4.330 -0.370 -1.216) 4.513 6.115 ( 0.091 20.967 -5.975) 21.802 6.328 ( 4.260 2.798 -8.518) 9.926 6.547 ( -3.432 -24.176 3.985) 24.741 6.840 ( -0.107 3.769 -9.051) 9.805 6.954 ( 2.656 -0.025 -7.942) 8.374 7.114 ( -3.503 6.134 7.478) 10.287 7.226 ( 2.757 -2.278 8.713) 9.419 7.470 ( -5.453 -6.678 1.961) 8.842 7.627 ( 2.752 -17.169 3.411) 17.719 7.847 ( -5.465 -3.848 0.564) 6.707 7.941 ( -6.626 -5.581 1.349) 8.768 8.134 ( -0.774 -4.405 3.347) 5.586 8.742 ( 2.261 1.990 -2.177) 3.717 9.143 ( 0.662 1.560 0.275) 1.717 9.184 ( 6.599 5.046 -9.546) 12.654 9.514 ( -5.274 5.752 4.602) 9.059 9.839 ( 7.233 2.953 -12.882) 15.066 9.963 ( 5.433 2.723 -5.231) 8.019 10.307 ( 0.817 -1.507 -0.683) 1.845 10.609 ( 0.512 -12.020 6.647) 13.745 10.676 ( 1.510 0.790 -1.601) 2.338 10.822 ( 2.540 -0.028 -1.593) 2.998 10.880 ( 10.112 5.311 -5.806) 12.812 11.209 ( -0.016 8.644 1.102) 8.714 11.546 ( -1.232 1.599 -5.364) 5.732 11.641 ( -1.803 -10.258 -1.733) 10.559 11.940 ( 10.003 12.055 5.598) 16.635 11.987 ( 5.232 -2.749 2.272) 6.332 12.205 ( 3.263 0.168 -1.294) 3.514 12.329 ( -9.946 3.351 7.550) 12.929 13.378 ( -6.587 -8.634 -2.852) 11.228 14.516 ( -6.674 3.502 2.842) 8.055 15.836 ( -3.766 -2.848 4.445) 6.485 16.715 ( 2.637 7.740 -1.479) 8.310 17.384 ( 9.413 -1.562 -3.617) 10.204 ======================= Grid point 145 (63/282) ======================= q-point: (-0.30 0.30 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.683 ( 3.944 31.275 3.540) 31.721 1.953 ( -1.169 31.788 10.588) 33.525 2.984 ( -4.198 -4.699 12.558) 14.050 3.069 ( 0.932 -3.250 5.298) 6.285 3.224 ( 4.284 0.249 9.180) 10.133 3.377 ( -3.272 44.596 13.162) 46.613 3.729 ( -0.106 5.856 4.316) 7.275 3.816 ( -3.418 -10.870 0.254) 11.398 4.686 ( 0.331 -11.817 -1.416) 11.906 5.029 ( 1.610 -0.105 -5.058) 5.309 5.161 ( 1.970 -3.947 -5.798) 7.285 5.423 ( -1.955 -9.469 0.842) 9.706 5.469 ( -3.419 -2.368 -4.945) 6.461 5.926 ( 1.368 15.491 -5.219) 16.403 6.242 ( 5.308 10.879 -11.321) 16.574 6.636 ( -1.578 -4.458 -8.989) 10.157 6.724 ( -1.908 2.338 -6.663) 7.314 7.013 ( -0.070 -22.337 5.915) 23.107 7.105 ( 1.929 6.798 3.458) 7.867 7.367 ( 0.035 -2.008 11.628) 11.800 7.508 ( -0.770 -8.704 3.342) 9.355 7.764 ( 0.291 -7.691 -0.321) 7.703 7.904 ( 0.544 -11.097 5.258) 12.292 7.942 ( -0.863 -6.666 1.084) 6.809 8.195 ( -2.128 -6.683 4.240) 8.195 8.718 ( 0.179 3.628 -1.687) 4.005 9.094 ( -1.583 3.123 -5.026) 6.125 9.158 ( 6.237 6.534 -8.131) 12.154 9.427 ( -5.773 0.475 1.655) 6.024 9.789 ( 4.447 5.966 -9.698) 12.223 9.934 ( 3.983 3.711 -9.659) 11.087 10.303 ( -0.298 0.316 1.598) 1.656 10.570 ( -9.908 -4.163 -5.778) 12.202 10.791 ( 0.344 -5.675 3.892) 6.890 10.828 ( 3.862 -4.178 -5.027) 7.592 10.924 ( 9.266 7.373 -6.307) 13.416 11.109 ( -8.552 10.143 2.026) 13.421 11.414 ( -1.024 5.311 -9.146) 10.626 11.708 ( 3.489 -11.616 -2.424) 12.369 11.941 ( 0.499 11.894 6.261) 13.451 12.074 ( -3.546 -0.899 3.609) 5.139 12.242 ( 2.163 -2.406 -1.144) 3.432 12.282 ( -7.277 -1.400 6.407) 9.796 13.418 ( 5.047 -6.437 1.066) 8.249 14.487 ( 0.218 4.190 6.951) 8.119 15.850 ( -2.406 -3.504 3.835) 5.725 16.656 ( 0.586 8.671 -2.280) 8.985 17.332 ( -4.065 4.565 -13.983) 15.261 ======================= Grid point 146 (64/282) ======================= q-point: (-0.20 0.30 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.644 ( 8.204 23.979 9.843) 27.188 1.968 ( 12.444 25.581 20.285) 34.939 3.045 ( -6.705 -3.257 11.162) 13.422 3.172 ( 6.923 39.596 16.422) 43.422 3.261 ( 8.448 -0.301 11.325) 14.132 3.441 ( 5.897 0.149 11.883) 13.267 3.745 ( 1.949 7.317 8.904) 11.688 3.879 ( 0.478 -16.067 -5.268) 16.915 4.726 ( -1.364 -7.284 -4.269) 8.553 4.956 ( 2.635 3.708 -12.299) 13.113 5.201 ( 3.955 -1.782 -3.011) 5.280 5.403 ( -0.713 -4.864 -6.321) 8.007 5.458 ( -3.027 -11.125 -2.163) 11.731 5.831 ( 2.326 4.743 -3.814) 6.515 6.112 ( 4.126 10.913 -12.360) 16.997 6.541 ( -0.789 3.586 -8.486) 9.246 6.585 ( 1.679 5.894 -6.839) 9.184 7.112 ( 4.619 7.903 0.556) 9.171 7.318 ( -1.096 -28.045 10.667) 30.025 7.483 ( -2.049 -4.159 10.193) 11.198 7.610 ( -0.756 -9.233 4.057) 10.113 7.803 ( 1.250 -3.421 -1.114) 3.808 8.015 ( 2.125 -5.720 1.389) 6.258 8.061 ( 0.261 -11.080 5.611) 12.423 8.240 ( -2.955 -6.157 2.576) 7.299 8.659 ( -1.356 5.203 -2.058) 5.758 8.960 ( -3.861 3.879 -7.553) 9.327 9.097 ( 2.111 6.906 -6.732) 9.873 9.389 ( -2.018 -4.697 -0.511) 5.137 9.650 ( -7.668 10.325 -2.416) 13.086 9.888 ( 10.049 5.382 -11.577) 16.247 10.315 ( -5.170 -5.483 -5.493) 9.326 10.383 ( -2.697 4.833 -0.246) 5.540 10.748 ( -6.862 9.361 4.536) 12.462 10.827 ( -2.328 11.009 -5.113) 12.360 10.896 ( -2.282 -8.383 -3.284) 9.288 10.985 ( 2.679 -1.712 -6.359) 7.110 11.316 ( 3.651 4.725 -5.229) 7.937 11.707 ( -10.800 -1.892 -1.649) 11.088 11.925 ( -4.112 -6.667 -6.826) 10.390 12.109 ( 7.813 6.096 11.497) 15.178 12.206 ( -10.398 -1.461 3.627) 11.108 12.291 ( -0.439 -5.181 3.210) 6.111 13.611 ( 11.786 -2.194 3.194) 12.407 14.581 ( 5.912 4.044 8.409) 11.046 15.892 ( -1.198 -4.769 2.696) 5.608 16.563 ( -0.376 8.599 -3.411) 9.258 16.967 ( -11.208 13.152 -17.664) 24.710 ======================= Grid point 147 (65/282) ======================= q-point: (-0.10 0.30 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.754 ( 7.470 12.655 17.069) 22.523 2.237 ( 13.944 20.474 23.607) 34.218 3.062 ( -7.476 -4.424 8.023) 11.825 3.269 ( 16.789 23.843 15.694) 33.115 3.554 ( 5.010 0.863 7.575) 9.122 3.578 ( 11.427 1.515 9.752) 15.099 3.855 ( 3.399 -3.735 2.123) 5.478 4.023 ( 7.850 -4.161 10.848) 14.022 4.685 ( -0.491 -2.728 -6.737) 7.284 4.807 ( 2.097 5.514 -18.954) 19.851 5.213 ( 2.384 3.777 -2.269) 5.010 5.382 ( -0.425 -5.300 -8.361) 9.908 5.465 ( -0.998 -9.775 -6.018) 11.522 5.857 ( 3.764 -7.684 -2.829) 9.012 5.984 ( 2.430 6.354 -8.192) 10.649 6.402 ( 0.957 8.473 -5.459) 10.124 6.611 ( 11.258 3.613 -4.046) 12.497 7.127 ( 5.964 9.646 -0.308) 11.346 7.533 ( -6.209 -10.218 9.385) 15.200 7.546 ( -6.704 -12.797 3.794) 14.936 7.680 ( -4.125 -9.630 1.004) 10.524 7.854 ( 0.363 -5.781 3.228) 6.631 8.106 ( 2.142 -4.455 2.832) 5.697 8.159 ( -4.060 -8.380 3.926) 10.105 8.254 ( 1.801 -1.462 -2.920) 3.730 8.547 ( -4.205 5.771 -3.996) 8.183 8.796 ( -4.111 1.871 -6.913) 8.258 9.001 ( -2.650 6.294 -1.030) 6.906 9.389 ( -5.954 6.742 1.732) 9.160 9.452 ( -1.571 3.030 4.414) 5.580 9.926 ( 11.366 3.941 -8.320) 14.627 10.127 ( -6.777 3.170 -5.424) 9.241 10.417 ( 5.847 1.893 -4.607) 7.681 10.528 ( -10.721 6.256 1.602) 12.516 10.768 ( 2.042 1.793 -4.930) 5.630 10.890 ( -3.511 -2.791 2.077) 4.943 10.959 ( 2.779 0.354 -4.391) 5.209 11.304 ( -1.344 -1.320 -6.679) 6.939 11.496 ( -7.275 6.358 0.300) 9.666 11.844 ( -6.850 -7.178 -3.004) 10.367 12.075 ( -9.885 -1.686 -0.579) 10.044 12.227 ( 0.760 1.718 2.216) 2.906 12.458 ( 7.381 -6.709 9.970) 14.103 13.833 ( 12.139 1.320 3.354) 12.662 14.753 ( 9.361 2.653 7.639) 12.371 15.906 ( -5.017 -4.429 1.134) 6.788 16.454 ( 0.485 7.150 -6.550) 9.709 16.554 ( -8.683 13.006 -11.953) 19.683 ======================= Grid point 152 (66/282) ======================= q-point: ( 0.40 -0.60 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.663 ( -4.405 0.000 -3.249) 5.473 2.705 ( -15.343 0.000 0.080) 15.343 2.888 ( -11.144 0.000 5.914) 12.616 3.110 ( -9.614 0.000 15.420) 18.171 3.129 ( -2.838 0.000 -6.469) 7.064 3.249 ( -5.788 0.000 -10.614) 12.090 3.809 ( 4.725 -0.000 0.340) 4.737 4.258 ( 7.998 -0.000 -1.962) 8.235 4.539 ( -1.104 0.000 7.612) 7.692 4.852 ( 3.234 -0.000 -1.847) 3.725 5.361 ( -11.922 0.000 3.302) 12.371 5.571 ( -10.065 0.000 -3.268) 10.582 5.593 ( -2.674 0.000 4.885) 5.569 5.879 ( -7.577 0.000 1.681) 7.761 6.523 ( -2.469 0.000 -13.073) 13.304 6.732 ( 6.649 -0.000 -10.793) 12.677 6.815 ( -2.589 0.000 7.237) 7.686 6.917 ( 6.669 -0.000 8.000) 10.415 7.101 ( 5.622 -0.000 -2.977) 6.361 7.107 ( 0.580 -0.000 -0.729) 0.931 7.320 ( -3.145 0.000 0.271) 3.157 7.491 ( -8.059 0.000 3.818) 8.918 7.989 ( -11.227 0.000 2.548) 11.513 8.023 ( -16.463 0.000 -4.416) 17.045 8.058 ( -1.793 0.000 4.571) 4.911 8.713 ( 9.494 -0.000 -3.695) 10.188 9.109 ( -0.306 0.000 7.248) 7.254 9.258 ( 2.073 -0.000 -8.977) 9.213 9.623 ( 2.358 -0.000 7.470) 7.833 9.865 ( 8.641 -0.000 -0.108) 8.641 9.970 ( 7.437 -0.000 -18.261) 19.717 10.070 ( 4.893 -0.000 3.335) 5.922 10.512 ( 0.704 -0.000 9.552) 9.578 10.632 ( 4.097 -0.000 -5.177) 6.602 10.771 ( 10.348 -0.000 2.846) 10.732 10.894 ( -0.759 0.000 -6.002) 6.049 11.371 ( 4.874 -0.000 2.972) 5.708 11.411 ( 3.394 -0.000 -10.203) 10.753 11.612 ( -1.796 0.000 6.284) 6.536 11.665 ( 11.896 -0.000 5.071) 12.932 11.862 ( 15.817 -0.000 -0.248) 15.819 12.224 ( -2.346 0.000 3.132) 3.913 12.573 ( -11.686 0.000 3.735) 12.268 13.474 ( -16.345 0.000 -6.297) 17.516 14.700 ( -11.267 0.000 -2.496) 11.540 15.796 ( -2.220 0.000 6.210) 6.594 16.759 ( 5.835 -0.000 0.292) 5.842 17.118 ( 19.979 -0.000 1.830) 20.063 ======================= Grid point 154 (67/282) ======================= q-point: (-0.50 0.40 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.380 ( -7.322 24.554 0.214) 25.623 2.623 ( -4.523 12.228 -0.781) 13.061 2.755 ( -6.373 -4.458 4.765) 9.121 3.025 ( -5.711 0.227 4.504) 7.277 3.121 ( -0.806 -0.345 0.801) 1.188 3.245 ( -4.155 -22.974 0.266) 23.349 3.866 ( 3.408 7.003 3.875) 8.699 4.357 ( 4.943 1.455 -0.437) 5.171 4.521 ( -5.696 14.922 9.824) 18.752 4.905 ( 2.647 -4.911 0.413) 5.594 5.204 ( -7.618 -0.550 -4.413) 8.821 5.394 ( -3.038 10.889 3.833) 11.937 5.552 ( -4.363 0.005 -1.840) 4.735 5.958 ( -4.077 -29.569 4.525) 30.190 6.357 ( 2.044 5.543 -16.156) 17.202 6.610 ( 2.811 18.274 -5.580) 19.313 6.851 ( -0.406 -3.738 -5.460) 6.630 6.974 ( 1.611 1.199 -10.262) 10.457 7.163 ( 2.566 -1.836 2.439) 3.988 7.190 ( 1.442 -1.012 11.725) 11.857 7.366 ( -1.173 -8.173 4.516) 9.411 7.417 ( -6.576 -4.450 7.518) 10.935 7.814 ( -6.987 -0.770 -0.805) 7.075 7.877 ( -6.589 -2.458 1.327) 7.157 8.086 ( -1.389 -1.661 3.262) 3.915 8.765 ( 3.116 0.829 -2.925) 4.354 9.145 ( -1.322 -0.276 2.344) 2.705 9.227 ( 5.722 1.024 -9.435) 11.082 9.652 ( -2.046 8.680 4.582) 10.026 9.892 ( 8.403 4.828 -12.416) 15.750 9.976 ( 5.947 -2.371 -7.550) 9.899 10.170 ( 2.677 -10.816 -4.748) 12.112 10.525 ( -5.732 -0.098 5.703) 8.087 10.713 ( 6.870 2.135 -0.327) 7.202 10.793 ( -2.583 -1.996 -0.765) 3.352 10.982 ( 14.067 5.232 -3.107) 15.327 11.323 ( -0.010 6.244 -1.334) 6.385 11.436 ( -2.617 -9.960 -4.951) 11.427 11.603 ( -3.607 1.237 2.806) 4.734 11.908 ( 9.323 -2.995 3.143) 10.285 12.087 ( 13.457 3.145 -0.094) 13.820 12.213 ( -1.225 0.377 1.992) 2.369 12.434 ( -8.931 7.513 4.958) 12.680 13.244 ( -9.856 -6.699 -1.365) 11.995 14.558 ( -5.735 1.606 1.981) 6.276 15.806 ( -3.832 -1.030 5.009) 6.391 16.800 ( 2.274 3.015 -1.607) 4.104 17.362 ( 10.464 -0.942 -2.171) 10.728 ======================= Grid point 155 (68/282) ======================= q-point: (-0.40 0.40 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.145 ( 2.855 28.854 1.369) 29.028 2.407 ( -1.500 26.779 4.484) 27.193 2.863 ( 0.255 -12.308 7.756) 14.550 3.013 ( -4.269 -2.908 6.422) 8.242 3.207 ( 4.668 -1.436 8.675) 9.955 3.350 ( -2.082 -21.591 -4.565) 22.166 3.884 ( 1.120 9.635 5.956) 11.382 4.247 ( -4.142 40.830 15.377) 43.826 4.504 ( -0.161 -10.245 -0.861) 10.283 4.976 ( -0.106 -5.454 -0.347) 5.466 5.107 ( 1.142 -2.671 -6.471) 7.093 5.364 ( -0.245 3.373 2.898) 4.454 5.448 ( -3.245 -0.623 -7.336) 8.045 6.157 ( 2.265 3.267 -8.556) 9.434 6.266 ( 2.646 -22.523 0.801) 22.692 6.460 ( 1.070 12.165 -7.775) 14.477 6.759 ( -0.660 1.832 -9.284) 9.486 6.871 ( -0.729 -1.736 -9.364) 9.551 7.208 ( 2.358 5.363 1.588) 6.070 7.343 ( 1.608 -3.279 10.983) 11.575 7.388 ( -3.851 -4.233 8.191) 9.992 7.581 ( 0.336 -15.204 7.055) 16.765 7.797 ( 1.044 -2.609 1.858) 3.369 7.859 ( -0.615 -4.259 1.255) 4.482 8.105 ( -2.855 -4.435 2.842) 5.992 8.766 ( 1.651 2.217 -1.477) 3.134 9.112 ( -3.232 0.121 -2.365) 4.007 9.212 ( 4.978 1.204 -9.268) 10.589 9.536 ( -4.813 12.122 0.888) 13.073 9.870 ( 5.667 4.332 -9.037) 11.513 9.972 ( 5.523 1.010 -10.572) 11.970 10.199 ( -2.397 -14.554 -9.154) 17.360 10.492 ( -4.465 -1.208 1.352) 4.819 10.738 ( 0.850 0.318 2.456) 2.618 10.830 ( 1.258 -0.083 0.553) 1.376 11.034 ( 7.188 7.665 -6.913) 12.578 11.268 ( -4.680 8.965 1.873) 10.285 11.390 ( -0.990 -8.659 -10.517) 13.658 11.592 ( 1.106 -2.148 1.935) 3.096 11.973 ( -4.402 -3.207 -2.173) 5.864 12.188 ( 2.748 5.016 2.975) 6.446 12.217 ( -0.692 -0.559 -1.649) 1.873 12.307 ( -6.519 8.864 8.903) 14.154 13.289 ( 4.794 -9.349 4.369) 11.379 14.548 ( 1.347 3.358 6.316) 7.279 15.808 ( -3.098 -2.001 4.240) 5.619 16.762 ( 0.089 4.983 -3.022) 5.828 17.373 ( -2.460 1.327 -8.559) 9.004 ======================= Grid point 156 (69/282) ======================= q-point: (-0.30 0.40 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.031 ( 6.680 26.189 1.709) 27.081 2.355 ( 9.253 24.426 15.032) 30.136 2.981 ( -5.749 -4.214 9.067) 11.533 3.145 ( 7.159 -9.606 8.130) 14.478 3.362 ( -1.079 -14.942 -3.949) 15.492 3.473 ( 7.296 -0.706 10.125) 12.500 3.883 ( -0.298 9.935 10.335) 14.339 4.076 ( 2.926 38.883 16.765) 42.444 4.575 ( 0.026 -11.697 -2.835) 12.035 4.961 ( -0.908 -2.795 -6.742) 7.355 5.140 ( 4.537 -4.410 -4.359) 7.684 5.337 ( -1.695 -4.172 -9.114) 10.166 5.366 ( 0.454 1.019 0.111) 1.121 6.017 ( 4.065 15.629 -8.845) 18.412 6.280 ( 2.116 10.880 -13.624) 17.563 6.496 ( 2.185 -12.807 -2.317) 13.197 6.660 ( 0.806 3.541 -7.775) 8.582 6.901 ( 0.152 -20.679 4.673) 21.201 7.218 ( 4.931 4.691 -2.199) 7.153 7.446 ( -2.530 -1.232 9.644) 10.046 7.498 ( 0.186 -4.875 8.342) 9.664 7.728 ( -0.459 -9.365 3.488) 10.004 7.892 ( 2.615 -7.514 3.155) 8.559 7.942 ( 3.820 -3.741 2.111) 5.749 8.133 ( -1.855 -7.312 1.900) 7.779 8.742 ( -0.873 5.042 -0.226) 5.122 8.995 ( -5.853 0.746 -6.898) 9.077 9.168 ( 2.820 1.652 -9.805) 10.335 9.393 ( -4.179 6.599 1.057) 7.882 9.778 ( -3.217 6.443 -4.985) 8.759 9.959 ( 9.109 3.393 -10.846) 14.564 10.156 ( -5.736 -14.433 -9.399) 18.154 10.446 ( -1.069 3.437 1.129) 3.772 10.763 ( -0.571 -3.200 -5.015) 5.977 10.828 ( -3.040 1.203 7.461) 8.146 11.009 ( 5.804 4.101 -9.165) 11.597 11.068 ( -8.294 14.527 -0.362) 16.732 11.334 ( 1.916 -3.187 -10.950) 11.565 11.657 ( -2.197 -2.630 1.787) 3.865 11.844 ( -8.590 -4.482 -6.109) 11.454 12.159 ( -6.269 -1.243 1.540) 6.574 12.200 ( -4.533 -3.664 7.100) 9.186 12.287 ( 2.395 10.054 6.372) 12.141 13.547 ( 12.816 -5.694 6.009) 15.257 14.654 ( 6.748 4.947 8.039) 11.604 15.828 ( -2.328 -3.540 3.561) 5.535 16.673 ( -1.657 5.640 -4.396) 7.341 17.117 ( -11.711 6.972 -12.630) 18.582 ======================= Grid point 157 (70/282) ======================= q-point: (-0.20 0.40 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.995 ( 5.573 18.358 7.836) 20.724 2.552 ( 13.277 20.424 19.546) 31.233 2.990 ( -8.026 -4.156 8.229) 12.223 3.371 ( 3.188 -13.738 -8.538) 16.486 3.472 ( 8.540 -7.327 11.524) 16.106 3.640 ( 2.662 7.596 10.962) 13.600 4.003 ( 9.146 9.819 10.301) 16.917 4.096 ( 10.036 21.620 20.429) 31.392 4.603 ( -0.094 -7.364 -6.919) 10.105 4.865 ( 1.410 1.731 -15.147) 15.311 5.155 ( -3.949 -7.672 -0.926) 8.678 5.343 ( 5.812 -8.502 -7.550) 12.770 5.363 ( 1.947 3.222 -1.707) 4.134 5.889 ( 3.187 12.077 -6.108) 13.904 6.099 ( 1.505 7.548 -13.217) 15.294 6.504 ( 2.713 4.568 -6.463) 8.367 6.647 ( 9.197 1.286 -4.174) 10.182 7.167 ( -1.001 -24.357 6.787) 25.305 7.251 ( 6.094 0.537 -2.822) 6.738 7.476 ( -6.201 -1.596 7.299) 9.710 7.597 ( -0.559 -1.602 7.400) 7.592 7.786 ( -2.403 -5.620 0.504) 6.133 7.998 ( -4.941 -10.356 3.873) 12.110 8.040 ( 4.078 -4.574 2.255) 6.530 8.212 ( 6.857 -3.624 -3.041) 8.331 8.642 ( -5.759 6.268 -1.631) 8.667 8.808 ( -7.035 -0.076 -7.988) 10.645 9.081 ( -1.380 3.681 -5.414) 6.691 9.368 ( 1.873 -0.884 2.001) 2.880 9.610 ( -7.515 9.906 1.924) 12.582 9.966 ( 3.698 -1.145 -7.795) 8.703 10.084 ( -1.370 -4.990 -6.584) 8.374 10.437 ( 3.135 2.092 -2.574) 4.564 10.663 ( -6.814 4.912 -3.834) 9.233 10.835 ( 0.562 7.361 -3.372) 8.116 10.880 ( -3.860 3.884 4.389) 7.018 10.977 ( 3.832 1.969 -4.542) 6.260 11.269 ( -3.714 -3.454 -8.130) 9.582 11.566 ( -4.976 2.268 -1.083) 5.575 11.741 ( -4.968 -5.675 -3.646) 8.378 12.047 ( -9.973 -1.779 0.033) 10.130 12.240 ( -3.958 -2.878 3.730) 6.153 12.397 ( 8.551 1.576 9.224) 12.676 13.834 ( 13.101 -1.344 5.278) 14.188 14.814 ( 9.247 5.214 7.335) 12.903 15.842 ( -4.586 -4.100 2.671) 6.706 16.544 ( -2.456 4.615 -7.586) 9.213 16.739 ( -12.307 10.728 -9.474) 18.876 ======================= Grid point 158 (71/282) ======================= q-point: (-0.10 0.40 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.080 ( 4.311 8.633 14.704) 17.587 2.739 ( 5.216 15.570 16.734) 23.445 2.964 ( -9.237 -4.337 6.695) 12.205 3.463 ( 5.519 -14.613 -8.408) 17.740 3.612 ( -1.803 8.033 8.475) 11.815 3.885 ( 13.490 -5.198 14.719) 20.631 4.114 ( 10.966 15.491 3.673) 19.331 4.398 ( 8.666 8.159 18.578) 22.064 4.565 ( 1.730 -5.959 -13.270) 14.649 4.711 ( 3.863 4.430 -9.883) 11.498 5.173 ( -3.410 -9.787 -1.001) 10.412 5.339 ( 4.681 8.054 -2.006) 9.529 5.386 ( 3.467 -1.212 -9.234) 9.937 5.839 ( 2.639 -1.255 -3.028) 4.209 5.988 ( 3.504 3.673 -6.838) 8.516 6.483 ( 8.183 6.422 -3.960) 11.131 6.786 ( 13.109 -0.475 -3.826) 13.665 7.271 ( 6.650 0.784 -5.285) 8.531 7.333 ( -9.145 -13.765 1.987) 16.645 7.434 ( -8.029 1.189 6.797) 10.587 7.638 ( -1.938 0.874 3.395) 4.006 7.753 ( -6.028 -8.988 -1.613) 10.942 8.005 ( -8.889 -11.424 2.083) 14.624 8.158 ( 3.725 -2.174 2.717) 5.097 8.321 ( 9.927 0.313 -2.773) 10.311 8.453 ( -7.845 3.316 -3.645) 9.264 8.688 ( -2.842 -2.418 -2.990) 4.782 8.982 ( -5.998 3.746 2.602) 7.535 9.430 ( -2.817 9.140 6.011) 11.296 9.518 ( 3.221 -1.073 4.497) 5.635 9.934 ( -3.202 -8.327 -4.961) 10.208 10.072 ( 3.938 4.611 -2.533) 6.571 10.412 ( -7.641 7.359 -2.195) 10.833 10.465 ( 5.969 5.739 -9.619) 12.692 10.772 ( 4.547 3.152 -7.503) 9.323 10.864 ( -1.119 -1.532 0.241) 1.912 11.017 ( -1.519 0.714 1.018) 1.963 11.130 ( -5.296 -0.418 1.397) 5.493 11.530 ( 4.715 1.393 -5.747) 7.563 11.674 ( -6.105 -4.119 -0.755) 7.403 11.900 ( -8.840 -1.636 -2.882) 9.441 12.219 ( -4.479 0.085 3.636) 5.770 12.625 ( 7.348 -5.051 7.593) 11.711 14.047 ( 9.323 1.773 3.390) 10.077 14.998 ( 10.780 3.268 6.144) 12.831 15.783 ( -9.796 -2.271 2.070) 10.267 16.362 ( -1.666 3.440 -15.738) 16.196 16.483 ( -5.838 8.942 1.540) 10.790 ======================= Grid point 164 (72/282) ======================= q-point: (-0.50 0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.516 ( 0.785 0.000 7.544) 7.585 2.550 ( 2.424 -0.000 -4.806) 5.383 2.770 ( -2.282 0.000 7.589) 7.925 2.963 ( 3.383 -0.000 -11.017) 11.525 3.094 ( -11.628 -0.000 14.499) 18.586 3.221 ( 6.429 -0.000 8.688) 10.808 3.973 ( 1.000 0.000 6.623) 6.698 4.387 ( 2.148 -0.000 -2.887) 3.598 4.635 ( -5.370 -0.000 10.241) 11.564 4.909 ( -1.083 -0.000 2.686) 2.896 5.086 ( 0.303 -0.000 -6.580) 6.587 5.443 ( -3.081 -0.000 -8.433) 8.978 5.507 ( 1.321 0.000 9.223) 9.317 5.825 ( -1.403 -0.000 5.853) 6.018 6.277 ( 5.680 -0.000 -15.958) 16.938 6.630 ( 3.870 0.000 -17.264) 17.693 6.761 ( -1.699 -0.000 -4.538) 4.846 6.862 ( -1.425 -0.000 -11.446) 11.535 7.212 ( 1.588 -0.000 5.941) 6.150 7.349 ( 2.223 0.000 10.150) 10.390 7.378 ( -5.053 -0.000 10.531) 11.681 7.407 ( 0.518 -0.000 7.551) 7.568 7.784 ( 2.573 -0.000 2.141) 3.347 7.822 ( -1.046 -0.000 0.740) 1.281 8.070 ( -3.542 -0.000 2.479) 4.323 8.783 ( 2.250 0.000 -1.532) 2.722 9.112 ( -3.951 -0.000 -1.183) 4.124 9.219 ( 4.355 -0.000 -9.168) 10.150 9.682 ( -3.975 0.000 2.240) 4.563 9.910 ( -0.840 -0.000 -7.410) 7.457 9.958 ( 12.154 -0.000 -14.379) 18.827 10.039 ( -2.023 -0.000 -11.045) 11.229 10.495 ( -3.053 -0.000 2.564) 3.987 10.746 ( -0.308 -0.000 -0.501) 0.588 10.826 ( 1.988 -0.000 3.603) 4.115 11.130 ( 7.054 0.000 -7.118) 10.021 11.271 ( -0.207 -0.000 -9.100) 9.103 11.346 ( -4.367 -0.000 2.158) 4.871 11.585 ( 0.083 -0.000 1.957) 1.959 11.942 ( -4.467 -0.000 -1.612) 4.749 12.204 ( 1.179 0.000 -2.278) 2.565 12.209 ( -4.356 -0.000 3.788) 5.773 12.424 ( -2.470 0.000 3.816) 4.546 13.198 ( 5.049 -0.000 7.110) 8.720 14.576 ( 1.802 -0.000 6.116) 6.376 15.792 ( -3.408 -0.000 4.366) 5.538 16.801 ( -0.174 -0.000 -3.388) 3.393 17.382 ( -1.873 -0.000 -6.739) 6.994 ======================= Grid point 166 (73/282) ======================= q-point: (-0.40 0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.418 ( 4.686 22.930 -3.414) 23.652 2.668 ( 6.870 11.053 9.936) 16.373 2.879 ( 4.609 -6.423 2.565) 8.311 3.005 ( 2.895 -7.590 5.492) 9.805 3.099 ( -7.764 -14.027 5.529) 16.959 3.473 ( 10.405 0.209 14.654) 17.973 4.035 ( 0.993 8.073 9.572) 12.561 4.403 ( -0.365 -8.868 -2.780) 9.300 4.551 ( -6.107 17.379 9.386) 20.674 4.909 ( -2.378 -2.530 -0.407) 3.496 5.089 ( 5.857 -1.893 -5.782) 8.445 5.298 ( -2.365 -1.262 -13.155) 13.425 5.531 ( 4.696 21.164 7.121) 22.818 6.057 ( 2.645 -27.661 5.027) 28.238 6.229 ( 7.213 1.977 -10.030) 12.512 6.448 ( 1.068 7.470 -17.099) 18.691 6.696 ( 1.837 1.248 -7.376) 7.703 6.765 ( 0.890 -1.705 -7.732) 7.968 7.271 ( 0.369 3.793 2.879) 4.776 7.433 ( -0.798 -5.359 10.581) 11.887 7.458 ( 0.089 2.499 9.685) 10.002 7.538 ( -0.651 -10.305 6.196) 12.042 7.847 ( 3.771 -0.762 -0.200) 3.852 7.915 ( 8.962 0.071 2.611) 9.335 8.038 ( -4.512 -4.190 2.397) 6.607 8.798 ( 0.340 1.983 0.455) 2.062 8.995 ( -7.346 -0.251 -5.419) 9.132 9.172 ( 1.598 -0.213 -9.743) 9.875 9.557 ( -4.953 12.442 -1.013) 13.430 9.813 ( -4.602 -5.411 -7.006) 9.977 9.928 ( -2.576 -5.959 -9.169) 11.234 10.013 ( 10.952 -0.220 -11.470) 15.860 10.483 ( -0.023 1.278 0.321) 1.318 10.736 ( -0.611 -0.615 -2.077) 2.251 10.849 ( -4.165 0.898 7.172) 8.343 11.080 ( 1.792 4.849 -7.669) 9.249 11.231 ( -1.803 0.810 -5.080) 5.451 11.252 ( 1.411 -0.754 -10.431) 10.553 11.646 ( 1.209 0.434 4.160) 4.354 11.782 ( -12.309 -3.093 -4.192) 13.366 12.140 ( -8.306 -0.763 2.334) 8.661 12.152 ( -6.068 -1.779 2.843) 6.933 12.434 ( 2.132 6.311 3.833) 7.686 13.466 ( 14.408 -3.654 9.272) 17.519 14.713 ( 7.502 2.279 7.975) 11.184 15.788 ( -3.232 -1.452 3.857) 5.237 16.731 ( -2.636 1.926 -5.106) 6.061 17.186 ( -11.411 2.217 -9.304) 14.890 ======================= Grid point 167 (74/282) ======================= q-point: (-0.30 0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.293 ( 3.431 19.983 0.646) 20.286 2.826 ( 9.032 11.039 10.920) 17.964 2.942 ( -5.650 -0.431 9.537) 11.094 3.110 ( 1.491 -14.676 -4.708) 15.484 3.339 ( 10.869 -10.502 12.641) 19.704 3.745 ( 6.141 5.082 13.769) 15.910 4.111 ( 6.177 8.086 11.486) 15.345 4.406 ( -2.694 4.189 2.731) 5.680 4.499 ( 1.561 0.215 3.931) 4.235 4.868 ( -0.189 0.019 -5.537) 5.540 5.085 ( -2.686 -1.157 -8.685) 9.164 5.209 ( 3.871 -7.821 -7.667) 11.616 5.524 ( 7.717 19.447 4.071) 21.314 6.113 ( 6.654 12.657 -10.584) 17.791 6.183 ( -1.565 2.396 -12.591) 12.912 6.482 ( 7.959 -12.521 -1.170) 14.882 6.654 ( 4.361 1.168 -6.566) 7.968 6.812 ( 2.319 -14.020 1.933) 14.342 7.256 ( 0.746 1.598 -2.035) 2.693 7.514 ( -0.750 4.504 8.368) 9.532 7.579 ( 0.441 -5.092 9.321) 10.630 7.630 ( -4.204 -10.755 2.998) 11.930 7.900 ( -1.559 -2.513 -1.838) 3.482 7.985 ( 1.781 -2.482 3.573) 4.701 8.158 ( 12.008 -3.098 -1.996) 12.561 8.727 ( -6.845 4.512 -0.887) 8.246 8.802 ( -9.282 -0.609 -7.398) 11.885 9.098 ( 0.039 -0.808 -8.147) 8.187 9.420 ( -1.079 7.434 1.687) 7.699 9.701 ( -6.545 -0.513 -2.939) 7.193 9.858 ( -3.682 -6.947 -6.024) 9.905 10.078 ( 9.878 1.688 -6.420) 11.901 10.470 ( 1.111 1.605 -2.984) 3.566 10.684 ( -2.201 -0.203 -4.095) 4.653 10.871 ( -1.194 1.155 6.494) 6.703 10.992 ( -2.289 2.891 -2.658) 4.546 11.077 ( -0.130 11.579 -8.291) 14.242 11.203 ( -2.406 -4.475 -7.548) 9.099 11.556 ( -8.159 -3.147 -5.207) 10.178 11.690 ( -2.914 -1.060 1.256) 3.346 12.028 ( -8.467 -0.637 -0.352) 8.498 12.157 ( -4.722 -5.665 8.005) 10.885 12.477 ( 5.512 6.017 3.657) 8.942 13.802 ( 14.523 -2.300 7.727) 16.611 14.895 ( 9.526 4.709 7.217) 12.845 15.784 ( -4.853 -3.171 3.568) 6.807 16.595 ( -5.253 2.101 -7.223) 9.175 16.868 ( -13.492 5.960 -7.658) 16.619 ======================= Grid point 168 (75/282) ======================= q-point: (-0.20 0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.248 ( 1.597 12.986 8.084) 15.380 2.907 ( 0.155 0.922 1.696) 1.937 2.909 ( -11.753 -1.673 10.060) 15.561 3.280 ( 10.390 -3.780 1.954) 11.228 3.693 ( 7.256 -2.555 13.179) 15.260 3.855 ( 5.254 5.629 10.991) 13.419 4.256 ( 4.804 3.431 1.396) 6.066 4.445 ( 3.200 -8.547 -3.952) 9.945 4.562 ( 4.381 10.366 11.322) 15.964 4.789 ( 3.802 5.158 -11.320) 13.008 5.020 ( -3.051 -8.832 2.920) 9.790 5.285 ( 2.881 -10.032 -4.024) 11.186 5.525 ( 7.706 18.334 0.174) 19.888 5.975 ( 2.808 13.423 -7.740) 15.747 6.060 ( 4.087 6.110 -10.620) 12.916 6.572 ( 8.292 5.000 -4.395) 10.634 6.737 ( 8.267 -6.944 -5.374) 12.060 7.024 ( -0.978 -20.978 5.456) 21.698 7.238 ( -0.370 -3.154 -3.783) 4.939 7.534 ( 0.620 7.299 5.693) 9.277 7.610 ( -8.020 -6.490 -1.590) 10.439 7.686 ( 0.779 -0.509 5.293) 5.375 7.831 ( -8.115 -8.997 -0.908) 12.150 8.117 ( 6.396 -3.000 2.581) 7.521 8.313 ( 11.554 -0.886 -5.126) 12.671 8.509 ( -12.682 3.654 -4.441) 13.925 8.649 ( -4.475 -2.203 -2.803) 5.722 9.018 ( -4.634 0.737 -1.431) 4.906 9.468 ( 6.052 -0.711 3.854) 7.211 9.577 ( -7.283 4.259 2.624) 8.836 9.808 ( -2.825 -5.219 -2.752) 6.541 10.145 ( 5.841 4.465 -1.006) 7.421 10.429 ( -0.377 -0.052 -5.011) 5.026 10.610 ( 0.342 4.227 -5.433) 6.892 10.841 ( -7.413 4.454 -0.202) 8.651 10.872 ( 4.249 6.211 -9.709) 12.283 11.005 ( -1.768 -2.157 -0.403) 2.818 11.133 ( -2.946 0.791 4.895) 5.768 11.478 ( 2.152 -6.342 -10.669) 12.597 11.656 ( -4.528 0.171 3.379) 5.652 11.888 ( -7.733 0.197 -3.020) 8.304 12.201 ( -4.483 -2.748 7.126) 8.856 12.588 ( 7.325 0.384 3.395) 8.083 14.062 ( 9.874 0.256 4.951) 11.049 15.064 ( 9.741 5.068 5.666) 12.356 15.744 ( -8.624 -2.856 3.409) 9.703 16.400 ( -6.006 1.648 -11.618) 13.182 16.607 ( -7.851 6.782 -0.308) 10.380 ======================= Grid point 169 (76/282) ======================= q-point: (-0.10 0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.291 ( -2.929 3.951 15.178) 15.955 2.822 ( -10.611 -4.223 3.630) 11.984 2.895 ( -3.760 -0.705 2.028) 4.329 3.429 ( 3.405 -2.414 1.408) 4.405 3.757 ( 0.176 11.521 6.396) 13.179 4.167 ( 9.719 -9.330 14.374) 19.701 4.208 ( -2.814 4.615 -8.507) 10.079 4.378 ( -0.592 -1.353 -15.494) 15.564 4.657 ( 5.393 8.324 2.872) 10.326 4.838 ( 4.231 -2.905 8.074) 9.567 5.130 ( 2.932 1.049 5.192) 6.054 5.321 ( 1.701 -2.771 -8.283) 8.898 5.525 ( 5.313 7.863 6.808) 11.679 5.866 ( 2.403 7.765 -4.849) 9.465 6.024 ( 5.024 2.077 -3.973) 6.734 6.656 ( 12.472 4.612 -3.266) 13.692 6.821 ( 1.296 -8.224 -6.388) 10.494 7.114 ( -5.237 -8.513 -2.092) 10.212 7.238 ( 1.164 -6.383 -0.957) 6.559 7.527 ( -5.687 -5.240 -0.721) 7.766 7.540 ( 2.984 7.703 0.463) 8.273 7.709 ( 1.083 4.103 0.414) 4.264 7.788 ( -7.032 -10.276 -1.286) 12.518 8.182 ( -4.967 1.555 -0.925) 5.286 8.345 ( 0.027 -3.360 4.222) 5.396 8.458 ( 9.768 -4.879 -3.020) 11.328 8.631 ( 0.263 -2.620 1.159) 2.876 8.917 ( -9.177 0.687 3.694) 9.917 9.448 ( -9.392 2.864 4.621) 10.852 9.651 ( 9.629 -0.226 1.990) 9.835 9.809 ( -1.190 -3.552 2.910) 4.743 10.152 ( 1.307 6.406 1.024) 6.618 10.355 ( -5.215 3.136 -0.582) 6.113 10.506 ( 5.736 8.887 -11.460) 15.596 10.753 ( -0.338 -2.653 -2.933) 3.969 10.841 ( 2.099 -2.284 -4.548) 5.505 10.947 ( 1.701 4.609 -5.395) 7.297 11.200 ( -3.177 -0.621 12.329) 12.747 11.466 ( 2.810 -6.373 -10.555) 12.646 11.631 ( -2.508 0.334 3.243) 4.113 11.746 ( -3.429 0.925 -6.581) 7.478 12.200 ( -3.841 1.488 5.117) 6.569 12.729 ( 3.795 -4.337 3.421) 6.702 14.182 ( 2.985 1.571 1.330) 3.626 15.242 ( 10.959 2.763 5.398) 12.525 15.618 ( -13.969 -0.394 3.022) 14.298 16.214 ( -0.619 -0.578 -12.314) 12.343 16.513 ( -1.522 6.726 4.458) 8.211 ======================= Grid point 176 (77/282) ======================= q-point: (-0.40 0.60 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.520 ( 1.054 -0.000 -2.559) 2.768 2.761 ( 4.574 -0.000 -7.827) 9.066 2.969 ( -13.964 0.000 12.620) 18.822 3.134 ( 14.362 -0.000 10.391) 17.727 3.168 ( 12.166 -0.000 13.908) 18.478 3.784 ( 8.690 -0.000 16.138) 18.329 4.227 ( 5.652 -0.000 9.443) 11.005 4.314 ( -1.058 0.000 -4.030) 4.167 4.549 ( -7.125 0.000 7.272) 10.180 4.874 ( -1.658 0.000 -0.837) 1.858 5.106 ( -2.864 0.000 -15.837) 16.094 5.123 ( 6.184 -0.000 -5.731) 8.431 5.859 ( 7.119 -0.000 8.128) 10.805 6.007 ( 5.344 -0.000 3.016) 6.137 6.285 ( 9.888 -0.000 -6.898) 12.056 6.298 ( 0.606 -0.000 -17.297) 17.307 6.689 ( 5.352 -0.000 -6.514) 8.430 6.722 ( 3.444 -0.000 -6.514) 7.369 7.349 ( -1.718 0.000 7.045) 7.251 7.390 ( -5.691 0.000 2.567) 6.244 7.560 ( 0.056 -0.000 8.016) 8.016 7.593 ( 2.864 -0.000 6.514) 7.116 7.885 ( -0.490 0.000 -3.736) 3.768 7.967 ( -0.759 0.000 4.069) 4.139 8.132 ( 14.977 -0.000 -1.358) 15.038 8.767 ( -7.394 0.000 -0.725) 7.430 8.794 ( -9.745 0.000 -6.819) 11.893 9.087 ( 0.146 -0.000 -8.359) 8.360 9.549 ( -4.167 0.000 1.524) 4.437 9.595 ( -5.459 0.000 -7.234) 9.063 9.834 ( -0.575 0.000 -3.890) 3.933 10.093 ( 10.130 -0.000 -6.103) 11.826 10.481 ( 0.974 -0.000 -4.048) 4.164 10.680 ( -3.079 0.000 -2.956) 4.268 10.882 ( -1.594 0.000 8.731) 8.876 11.015 ( -1.248 0.000 -8.317) 8.410 11.160 ( -1.293 0.000 -6.033) 6.170 11.185 ( 0.666 -0.000 -8.085) 8.113 11.517 ( -11.784 0.000 -5.169) 12.868 11.686 ( -1.974 0.000 2.801) 3.426 12.024 ( -7.062 0.000 -1.238) 7.170 12.108 ( -5.910 0.000 9.689) 11.349 12.529 ( 4.415 -0.000 1.583) 4.690 13.781 ( 15.270 -0.000 9.005) 17.727 14.935 ( 9.847 -0.000 7.209) 12.204 15.757 ( -5.199 0.000 3.857) 6.473 16.610 ( -6.315 0.000 -6.943) 9.385 16.914 ( -13.749 0.000 -6.987) 15.422 ======================= Grid point 178 (78/282) ======================= q-point: (-0.30 0.60 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.454 ( -1.953 12.446 3.902) 13.189 2.780 ( -0.131 -12.040 -7.457) 14.163 2.883 ( -11.172 -0.947 8.907) 14.319 3.380 ( 11.052 11.635 12.734) 20.486 3.574 ( 11.475 -10.377 14.537) 21.230 3.995 ( 3.577 8.700 12.446) 15.600 4.268 ( 1.414 -1.515 -1.601) 2.619 4.311 ( 0.530 -6.638 -8.157) 10.530 4.680 ( 6.507 4.845 16.776) 18.634 4.834 ( -0.438 -0.373 -2.710) 2.770 4.933 ( -1.824 -1.631 -6.347) 6.802 5.158 ( 2.593 -5.147 -5.204) 7.765 5.875 ( 6.682 24.150 3.506) 25.301 6.081 ( 1.856 1.792 -11.109) 11.404 6.184 ( 5.850 3.733 -9.620) 11.862 6.482 ( 7.748 -16.743 1.137) 18.484 6.687 ( 6.299 5.310 -5.695) 10.015 6.795 ( 6.314 -9.065 -2.432) 11.312 7.246 ( -5.638 4.216 -1.398) 7.178 7.441 ( -5.152 -11.280 3.467) 12.876 7.633 ( 1.229 3.753 5.609) 6.860 7.669 ( -3.273 -1.501 5.729) 6.767 7.774 ( -1.471 -0.422 -5.997) 6.189 8.079 ( 7.151 -1.537 2.910) 7.872 8.302 ( 11.800 -0.422 -6.756) 13.604 8.552 ( -14.668 1.581 -5.224) 15.651 8.627 ( -5.476 -0.630 -1.695) 5.767 9.013 ( -3.367 -0.691 -3.780) 5.109 9.471 ( -1.981 0.850 -0.098) 2.158 9.569 ( -0.451 -2.790 2.526) 3.790 9.807 ( -0.083 2.221 0.329) 2.247 10.196 ( 7.839 1.918 0.172) 8.072 10.427 ( -2.167 -0.183 -5.266) 5.698 10.603 ( -1.824 -1.870 -4.794) 5.460 10.894 ( -0.584 3.448 -5.901) 6.859 10.953 ( -2.639 -3.025 -4.479) 6.014 11.025 ( -4.473 8.165 2.183) 9.562 11.137 ( 0.044 -1.090 -1.341) 1.729 11.391 ( -0.243 -3.837 -5.769) 6.933 11.651 ( -5.555 -0.541 2.458) 6.099 11.900 ( -4.697 0.842 -5.264) 7.105 12.154 ( -3.925 -2.255 11.415) 12.280 12.610 ( 6.331 1.396 -0.235) 6.487 14.060 ( 10.542 -0.193 6.228) 12.246 15.131 ( 9.333 2.797 5.080) 10.988 15.705 ( -8.169 -1.718 4.429) 9.450 16.415 ( -8.650 0.462 -8.629) 12.227 16.679 ( -9.016 2.509 -1.620) 9.498 ======================= Grid point 179 (79/282) ======================= q-point: (-0.20 -0.40 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.376 ( -8.658 6.733 11.397) 15.818 2.729 ( -9.613 -7.959 -2.689) 12.767 2.858 ( -1.978 -2.470 2.562) 4.072 3.485 ( -0.456 7.905 7.400) 10.838 3.888 ( 4.251 1.057 9.049) 10.054 4.053 ( 3.959 -0.463 4.200) 5.791 4.231 ( 0.291 -1.045 -11.848) 11.897 4.334 ( -0.412 -4.497 -1.138) 4.657 4.760 ( 1.486 4.148 7.151) 8.399 4.811 ( 2.623 0.720 -3.254) 4.241 5.112 ( 6.869 -1.729 10.499) 12.665 5.216 ( 2.828 -8.752 4.196) 10.110 5.765 ( 0.795 21.692 -0.718) 21.718 5.992 ( 2.775 3.723 -8.495) 9.682 6.121 ( 2.808 9.324 -6.219) 11.554 6.647 ( -0.685 -11.414 -4.991) 12.477 6.737 ( 12.931 4.247 -2.531) 13.844 6.958 ( 4.379 -10.619 -0.253) 11.490 7.135 ( -4.273 -6.714 -5.118) 9.462 7.446 ( -3.563 -3.452 1.337) 5.138 7.574 ( -6.176 -5.527 -1.224) 8.378 7.723 ( 3.863 3.411 2.499) 5.727 7.778 ( 4.680 3.616 -2.650) 6.480 8.206 ( -2.119 1.309 1.012) 2.689 8.290 ( -5.157 -3.301 -0.986) 6.202 8.387 ( 7.101 -3.736 -6.265) 10.180 8.602 ( 0.043 -1.126 2.458) 2.704 8.914 ( -7.978 -0.981 -0.104) 8.039 9.435 ( -6.679 -2.130 3.314) 7.754 9.683 ( 8.929 0.652 4.389) 9.971 9.799 ( -0.129 3.449 3.357) 4.814 10.268 ( 2.224 8.260 3.686) 9.314 10.332 ( -5.025 -3.513 -3.468) 7.044 10.595 ( 3.847 -3.459 -4.970) 7.174 10.745 ( -6.592 5.502 -3.370) 9.224 10.827 ( 1.644 -0.256 -9.182) 9.331 11.020 ( 5.112 5.023 -4.281) 8.348 11.178 ( -2.326 -3.042 7.327) 8.267 11.389 ( 0.069 -2.541 -2.491) 3.559 11.596 ( -6.427 -3.821 2.420) 7.859 11.781 ( 1.471 2.680 -9.447) 9.929 12.214 ( -3.069 0.224 9.081) 9.589 12.691 ( 5.003 -0.819 -0.916) 5.152 14.200 ( 2.461 0.716 1.999) 3.251 15.292 ( 9.898 3.302 4.313) 11.291 15.606 ( -12.824 -1.086 4.540) 13.647 16.205 ( -5.579 -0.527 -9.804) 11.293 16.591 ( -1.959 3.467 4.585) 6.073 ======================= Grid point 180 (80/282) ======================= q-point: (-0.10 -0.40 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.300 ( -17.709 -3.035 16.195) 24.189 2.590 ( -11.952 -8.856 -5.111) 15.729 2.874 ( -0.640 1.205 3.539) 3.793 3.444 ( -4.497 2.079 2.114) 5.386 3.832 ( -2.064 6.616 -8.665) 11.095 4.025 ( -4.533 -0.636 -16.235) 16.868 4.229 ( -5.488 -7.638 5.661) 10.978 4.327 ( -2.860 2.565 7.095) 8.068 4.766 ( -0.510 4.754 -4.884) 6.835 4.927 ( 3.829 -5.087 13.821) 15.217 5.225 ( 0.692 -8.445 -3.498) 9.167 5.325 ( 3.626 17.357 2.616) 17.924 5.712 ( 1.512 3.525 13.521) 14.054 5.915 ( 2.454 8.395 -5.811) 10.501 6.066 ( 2.013 1.205 -1.294) 2.680 6.623 ( -4.682 -8.554 -3.360) 10.314 6.901 ( 14.088 2.442 -3.317) 14.678 7.016 ( 1.583 -5.724 -5.836) 8.326 7.173 ( 0.659 -9.646 -1.658) 9.810 7.371 ( -9.502 -0.408 -0.169) 9.513 7.573 ( 1.096 -6.038 -0.252) 6.141 7.739 ( 1.715 7.421 -2.033) 7.883 7.777 ( 7.181 4.111 -6.181) 10.328 8.105 ( 1.637 -1.738 -2.595) 3.526 8.428 ( -1.119 -4.284 10.523) 11.417 8.479 ( 6.785 -8.331 -0.029) 10.744 8.679 ( 4.869 -4.013 1.388) 6.461 8.793 ( -9.384 -0.663 1.746) 9.568 9.353 ( -10.078 2.021 5.897) 11.850 9.762 ( 0.019 7.207 2.411) 7.599 9.914 ( 8.491 -3.467 5.259) 10.573 10.210 ( -3.934 3.276 1.984) 5.490 10.287 ( -2.702 2.059 2.053) 3.969 10.533 ( 4.720 6.859 -12.012) 14.616 10.765 ( 7.285 -3.236 -0.068) 7.972 10.801 ( 2.456 -3.100 -4.690) 6.135 11.016 ( 5.216 6.080 -2.198) 8.307 11.190 ( -11.385 -1.223 10.591) 15.598 11.360 ( -0.349 -4.549 -6.653) 8.067 11.565 ( -3.250 -6.129 -1.124) 7.028 11.765 ( 10.717 4.362 -7.325) 13.694 12.227 ( -2.725 3.914 5.831) 7.533 12.740 ( -0.580 -3.193 -0.063) 3.246 14.175 ( -4.183 0.371 -2.095) 4.693 15.402 ( -17.376 0.885 3.725) 17.792 15.484 ( 10.727 1.998 4.112) 11.660 16.110 ( 2.740 -4.246 -7.880) 9.361 16.629 ( 2.277 5.162 8.079) 9.854 ======================= Grid point 188 (81/282) ======================= q-point: (-0.30 -0.30 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.453 ( -15.317 0.000 11.780) 19.323 2.638 ( -3.284 0.000 -6.818) 7.568 2.840 ( -1.943 0.000 4.185) 4.614 3.579 ( -4.757 0.000 7.365) 8.768 3.830 ( 8.657 -0.000 14.268) 16.689 4.153 ( -1.643 0.000 -11.635) 11.751 4.161 ( 1.261 -0.000 -10.731) 10.805 4.291 ( 3.527 -0.000 12.320) 12.815 4.775 ( -3.897 0.000 0.690) 3.957 4.844 ( 6.214 -0.000 -0.660) 6.249 5.094 ( -1.916 0.000 -4.255) 4.666 5.137 ( 12.248 -0.000 22.392) 25.523 6.010 ( 1.765 -0.000 -6.300) 6.543 6.086 ( 3.719 -0.000 -6.881) 7.822 6.089 ( -6.465 0.000 -4.826) 8.068 6.543 ( 6.875 -0.000 -2.111) 7.192 6.824 ( 9.226 -0.000 -0.064) 9.226 6.825 ( 11.097 -0.000 -5.342) 12.316 7.066 ( -10.305 0.000 -5.698) 11.776 7.418 ( -2.160 0.000 4.827) 5.289 7.521 ( -5.679 0.000 -4.015) 6.955 7.760 ( 4.710 -0.000 3.547) 5.896 7.806 ( 6.198 -0.000 -4.043) 7.400 8.217 ( 5.638 -0.000 6.313) 8.464 8.262 ( -14.189 0.000 -6.876) 15.767 8.358 ( 6.040 -0.000 -7.405) 9.556 8.594 ( -0.460 0.000 2.484) 2.526 8.903 ( -6.946 0.000 -1.550) 7.117 9.419 ( -5.129 0.000 4.702) 6.959 9.676 ( 7.715 -0.000 3.726) 8.568 9.848 ( 0.787 -0.000 3.974) 4.051 10.293 ( -4.559 0.000 -4.714) 6.558 10.361 ( 2.939 -0.000 8.197) 8.708 10.525 ( 1.273 -0.000 -6.630) 6.752 10.806 ( -6.886 0.000 -5.097) 8.567 10.825 ( 1.239 -0.000 -9.443) 9.523 11.099 ( 3.444 -0.000 -6.309) 7.188 11.109 ( 1.692 -0.000 5.103) 5.377 11.381 ( -1.239 0.000 4.121) 4.303 11.556 ( -8.743 0.000 1.685) 8.904 11.804 ( 3.116 -0.000 -11.105) 11.534 12.214 ( -2.649 0.000 11.347) 11.652 12.688 ( 5.269 -0.000 -2.879) 6.004 14.205 ( 2.377 -0.000 2.304) 3.310 15.322 ( 9.660 -0.000 3.453) 10.259 15.594 ( -12.376 0.000 5.454) 13.524 16.200 ( -7.681 0.000 -8.532) 11.480 16.618 ( -2.179 0.000 4.442) 4.948 ======================= Grid point 189 (82/282) ======================= q-point: (-0.20 -0.30 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.277 ( -23.147 -0.338 13.968) 27.037 2.484 ( -12.132 -4.214 -5.632) 14.023 2.888 ( 2.306 0.550 3.434) 4.172 3.502 ( -7.832 3.837 4.184) 9.673 3.920 ( -3.207 4.936 -14.178) 15.351 3.986 ( -4.099 -3.295 -14.781) 15.688 4.048 ( -8.834 -9.072 5.032) 13.625 4.469 ( 2.187 8.857 12.964) 15.852 4.734 ( -3.691 -6.063 -0.696) 7.132 4.950 ( 3.838 6.749 5.013) 9.242 5.077 ( 1.335 -9.531 0.435) 9.634 5.506 ( 9.186 4.995 17.121) 20.061 5.854 ( -5.682 12.742 2.385) 14.154 5.963 ( 1.429 0.211 -6.874) 7.025 6.106 ( 0.501 -2.400 -2.601) 3.574 6.547 ( -1.344 1.033 -4.513) 4.821 6.860 ( -2.137 -8.337 -9.782) 13.029 6.971 ( 9.538 2.762 0.251) 9.933 7.043 ( 7.553 -6.506 -0.845) 10.004 7.379 ( -6.549 0.776 0.935) 6.661 7.487 ( 3.740 -3.484 -2.506) 5.693 7.821 ( 3.657 3.030 -3.187) 5.719 7.838 ( 6.516 2.300 -6.596) 9.553 8.081 ( -0.591 -1.097 -4.039) 4.227 8.373 ( 2.706 -2.268 9.721) 10.342 8.386 ( 2.536 -3.150 -0.612) 4.090 8.626 ( 1.463 -2.145 0.157) 2.601 8.790 ( -6.603 0.017 0.601) 6.630 9.388 ( -8.448 1.804 9.590) 12.907 9.844 ( 9.056 -2.505 1.529) 9.520 9.889 ( 0.225 6.189 6.902) 9.273 10.165 ( -9.891 -5.225 1.761) 11.324 10.413 ( 2.726 11.153 0.529) 11.494 10.567 ( 3.663 -5.809 -7.299) 10.022 10.705 ( 2.990 -0.433 -0.192) 3.027 10.780 ( 4.191 -0.838 -8.195) 9.243 11.101 ( 4.058 4.260 -0.460) 5.902 11.166 ( -6.683 -2.238 7.945) 10.620 11.347 ( -2.138 2.976 -3.371) 4.980 11.457 ( -6.591 -6.999 -0.809) 9.648 11.813 ( 12.103 1.704 -9.514) 15.489 12.271 ( -2.562 1.544 8.812) 9.306 12.711 ( 1.333 -0.763 -3.474) 3.798 14.179 ( -5.131 0.132 -1.963) 5.495 15.413 ( -17.847 0.391 4.290) 18.360 15.513 ( 11.503 1.232 3.637) 12.127 16.060 ( -0.860 -1.903 -6.716) 7.033 16.680 ( 1.614 1.610 8.945) 9.231 ======================= Grid point 190 (83/282) ======================= q-point: (-0.10 -0.30 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.047 ( -27.881 -6.942 12.842) 31.472 2.227 ( -20.462 -8.760 -5.353) 22.893 2.941 ( 1.327 2.682 3.584) 4.669 3.384 ( -9.580 4.138 1.627) 10.561 3.657 ( -7.660 2.188 -14.321) 16.387 3.748 ( -7.576 -1.885 -17.484) 19.147 3.875 ( -30.365 -19.923 -0.979) 36.331 4.460 ( 0.241 16.807 7.954) 18.596 4.739 ( 0.259 -0.381 -0.218) 0.510 5.051 ( -0.582 -9.030 7.373) 11.672 5.198 ( 5.080 -1.109 3.258) 6.136 5.557 ( 4.608 19.897 2.403) 20.565 5.875 ( -1.481 6.101 7.548) 9.818 5.964 ( 3.796 -2.208 3.514) 5.624 6.104 ( 1.506 4.347 0.100) 4.602 6.479 ( -6.449 -7.277 3.489) 10.331 6.804 ( -5.712 -13.945 -9.267) 17.691 6.985 ( -5.942 -0.061 -5.120) 7.844 7.134 ( 7.308 -2.115 -4.743) 8.965 7.390 ( 9.535 4.187 1.242) 10.488 7.604 ( 7.590 -2.714 0.646) 8.086 7.786 ( 3.134 5.614 -3.664) 7.400 7.858 ( 7.340 2.730 -7.357) 10.745 8.156 ( 8.872 -4.335 -1.707) 10.021 8.393 ( -6.015 -1.723 3.632) 7.234 8.556 ( -0.308 -8.319 8.981) 12.246 8.661 ( 4.091 -4.755 -5.367) 8.255 8.770 ( 2.321 -2.463 4.715) 5.804 9.313 ( -10.822 6.160 12.551) 17.681 9.836 ( -4.079 11.030 3.916) 12.395 10.023 ( 6.147 -6.506 0.928) 8.999 10.146 ( -3.820 -5.134 6.267) 8.957 10.346 ( 0.147 8.245 -1.777) 8.436 10.545 ( 6.387 2.536 -8.706) 11.092 10.793 ( 4.611 -2.036 -4.094) 6.494 10.862 ( 8.073 -5.083 -1.580) 9.670 11.025 ( -17.537 1.558 10.497) 20.498 11.197 ( 6.579 4.314 5.365) 9.523 11.277 ( 0.417 -2.951 -4.991) 5.813 11.474 ( 5.927 -7.231 -7.393) 11.919 11.922 ( 12.401 3.156 -4.222) 13.475 12.273 ( -3.134 4.695 5.116) 7.618 12.668 ( -4.780 -1.728 -2.176) 5.530 14.038 ( -8.608 -0.630 -4.856) 9.904 15.141 ( -20.317 0.833 1.787) 20.412 15.716 ( 11.226 2.425 4.213) 12.233 16.083 ( 6.314 -6.320 -3.827) 9.719 16.797 ( 2.717 2.696 11.360) 11.987 ======================= Grid point 199 (84/282) ======================= q-point: (-0.20 -0.20 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.994 ( -29.752 0.000 12.164) 32.143 2.157 ( -22.216 0.000 -4.863) 22.742 2.963 ( 2.070 -0.000 2.916) 3.576 3.453 ( -5.837 0.000 4.750) 7.525 3.673 ( -36.757 0.000 -4.193) 36.996 3.688 ( -8.698 0.000 -16.434) 18.594 3.728 ( -6.886 0.000 -15.721) 17.163 4.650 ( 0.174 -0.000 -0.215) 0.276 4.694 ( 2.205 -0.000 10.830) 11.052 4.955 ( -3.590 0.000 2.889) 4.608 5.191 ( 6.711 -0.000 6.102) 9.070 5.798 ( 4.669 -0.000 12.280) 13.138 5.856 ( 2.931 -0.000 -6.260) 6.912 5.954 ( -1.823 0.000 8.359) 8.555 6.122 ( 2.006 -0.000 4.000) 4.475 6.487 ( -4.915 0.000 -2.860) 5.687 6.626 ( -8.501 0.000 -7.363) 11.246 6.986 ( -8.038 0.000 -5.043) 9.489 7.118 ( 9.141 -0.000 -5.145) 10.489 7.428 ( 11.530 -0.000 2.289) 11.755 7.573 ( 10.873 -0.000 -1.434) 10.967 7.854 ( 4.666 -0.000 -4.917) 6.779 7.861 ( 5.262 -0.000 -7.445) 9.116 8.115 ( 8.069 -0.000 -2.046) 8.324 8.377 ( -4.250 0.000 3.157) 5.294 8.487 ( -1.637 0.000 10.749) 10.873 8.622 ( 4.384 -0.000 -5.934) 7.378 8.758 ( -0.175 0.000 3.563) 3.568 9.368 ( -10.795 0.000 14.529) 18.101 9.947 ( 6.088 -0.000 -4.626) 7.647 10.016 ( -10.470 0.000 9.316) 14.015 10.027 ( 1.833 -0.000 9.879) 10.048 10.439 ( -2.245 0.000 -4.653) 5.166 10.546 ( 8.338 -0.000 -8.612) 11.987 10.788 ( 7.050 -0.000 -7.152) 10.043 10.802 ( 4.528 -0.000 2.056) 4.973 11.041 ( -16.751 0.000 11.028) 20.055 11.241 ( 7.985 -0.000 6.070) 10.030 11.259 ( -8.945 0.000 -3.350) 9.552 11.403 ( 13.368 -0.000 -10.555) 17.033 11.946 ( 12.750 -0.000 -4.795) 13.622 12.312 ( -3.316 0.000 6.687) 7.464 12.654 ( -3.408 0.000 -4.226) 5.429 14.032 ( -9.090 0.000 -4.769) 10.266 15.148 ( -20.689 0.000 2.210) 20.807 15.740 ( 12.553 -0.000 3.742) 13.099 16.028 ( 4.120 -0.000 -3.537) 5.430 16.816 ( 1.559 -0.000 12.019) 12.120 ======================= Grid point 200 (85/282) ======================= q-point: (-0.10 -0.20 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.632 ( -33.570 -5.480 8.243) 34.999 1.741 ( -30.215 -6.976 -2.259) 31.092 2.909 ( -50.545 -7.036 -5.055) 51.282 2.994 ( -2.018 1.883 -0.232) 2.770 3.399 ( -9.484 0.177 -11.564) 14.957 3.446 ( -6.158 -2.907 2.657) 7.310 3.511 ( -6.062 -2.675 -9.093) 11.251 4.636 ( 1.183 8.826 1.939) 9.114 4.747 ( -0.815 2.722 1.036) 3.024 4.985 ( -2.384 -8.476 2.027) 9.035 5.329 ( 3.316 -0.096 6.601) 7.388 5.761 ( 2.923 13.829 -3.018) 14.453 5.917 ( 1.151 1.274 -0.837) 1.910 6.054 ( -2.347 1.837 12.891) 13.232 6.175 ( 1.192 8.677 -0.501) 8.773 6.356 ( -9.657 -8.261 6.606) 14.323 6.514 ( -6.598 -14.435 -6.277) 17.067 6.850 ( -0.571 -1.021 -5.548) 5.670 7.188 ( 5.603 -0.296 -3.071) 6.396 7.611 ( 11.577 6.768 -1.742) 13.523 7.734 ( 9.218 0.689 -1.073) 9.306 7.857 ( 5.624 1.476 -3.480) 6.777 7.909 ( 5.112 -0.860 0.422) 5.201 8.224 ( 1.404 -0.793 0.299) 1.640 8.331 ( -1.725 0.516 1.215) 2.172 8.504 ( -3.046 -6.884 0.552) 7.548 8.696 ( 9.177 -3.886 -4.295) 10.852 8.828 ( 1.693 -2.618 3.860) 4.962 9.371 ( -8.544 3.401 21.889) 23.742 9.871 ( -4.807 7.721 2.175) 9.352 10.023 ( -0.055 -2.150 -1.633) 2.700 10.174 ( 0.952 -4.209 9.225) 10.185 10.372 ( -0.096 3.715 -0.879) 3.818 10.586 ( 4.485 2.435 -4.628) 6.889 10.710 ( -13.136 -3.320 0.649) 13.564 10.847 ( 5.880 -3.271 -4.532) 8.112 11.043 ( 7.588 1.008 0.424) 7.667 11.111 ( -6.468 -6.306 -5.246) 10.446 11.473 ( 11.712 1.981 10.103) 15.594 11.554 ( 14.477 -0.042 -3.494) 14.893 12.083 ( 10.119 1.615 -2.113) 10.463 12.291 ( -4.213 3.365 2.994) 6.168 12.531 ( -8.047 -1.050 -3.576) 8.868 13.832 ( -9.958 -0.675 -6.292) 11.799 14.852 ( -19.933 0.272 1.514) 19.993 15.939 ( 10.130 4.171 3.154) 11.400 16.117 ( 7.638 -6.649 -1.482) 10.234 16.962 ( 1.395 -0.195 14.035) 14.105 ======================= Grid point 210 (86/282) ======================= q-point: (-0.10 -0.10 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.129 ( -36.765 0.000 2.673) 36.862 1.200 ( -37.052 0.000 4.971) 37.384 1.965 ( -62.474 0.000 5.017) 62.675 2.971 ( -4.149 0.000 2.855) 5.036 3.168 ( -8.090 0.000 -6.746) 10.533 3.347 ( -4.715 0.000 -3.407) 5.817 3.426 ( -4.155 0.000 6.116) 7.394 4.676 ( 2.132 -0.000 -2.023) 2.939 4.736 ( -2.712 0.000 -2.682) 3.814 4.923 ( -2.941 0.000 0.534) 2.989 5.396 ( -1.393 0.000 3.537) 3.802 5.808 ( 4.719 -0.000 -7.934) 9.231 5.875 ( -3.686 0.000 -1.239) 3.889 6.184 ( -8.020 0.000 6.166) 10.116 6.221 ( 1.017 -0.000 7.368) 7.438 6.265 ( 2.317 -0.000 -5.075) 5.579 6.280 ( -5.959 0.000 -0.654) 5.995 6.844 ( 2.891 -0.000 -1.040) 3.073 7.260 ( 3.613 -0.000 6.009) 7.012 7.764 ( 8.316 -0.000 -3.721) 9.111 7.841 ( 5.251 -0.000 -1.921) 5.591 7.896 ( 3.432 -0.000 -0.639) 3.491 8.008 ( -0.336 0.000 7.921) 7.929 8.186 ( -2.601 0.000 0.925) 2.761 8.379 ( -3.762 0.000 -3.038) 4.835 8.442 ( 9.974 -0.000 -0.882) 10.013 8.775 ( 8.768 -0.000 -4.796) 9.994 8.850 ( -1.001 0.000 0.796) 1.278 9.555 ( -1.607 0.000 31.843) 31.884 9.820 ( -3.031 0.000 -6.751) 7.400 10.008 ( -3.602 0.000 5.933) 6.941 10.254 ( 0.415 -0.000 7.476) 7.487 10.377 ( -0.078 0.000 -1.524) 1.526 10.466 ( -12.372 0.000 -1.583) 12.473 10.675 ( 7.794 -0.000 -1.630) 7.962 10.878 ( 4.768 -0.000 -5.820) 7.523 10.921 ( -6.392 0.000 -2.422) 6.835 11.206 ( 13.136 -0.000 -0.444) 13.144 11.766 ( 12.017 -0.000 2.159) 12.209 11.774 ( 11.444 -0.000 11.819) 16.451 12.202 ( 6.925 -0.000 -1.791) 7.153 12.246 ( -5.538 0.000 0.135) 5.540 12.352 ( -8.955 0.000 -4.079) 9.841 13.623 ( -8.414 0.000 -6.442) 10.597 14.590 ( -16.871 0.000 3.016) 17.139 16.137 ( 8.339 -0.000 2.190) 8.622 16.177 ( 6.183 -0.000 -0.522) 6.205 17.114 ( 1.801 -0.000 12.276) 12.408 ======================= Grid point 211 (87/282) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.421 ( 18.473 -0.000 33.368) 38.140 1.519 ( -5.235 0.000 35.786) 36.167 2.153 ( -15.301 0.000 48.991) 51.325 3.221 ( 7.777 -0.000 8.149) 11.265 3.334 ( -1.755 0.000 5.928) 6.183 3.589 ( -5.142 0.000 8.495) 9.930 3.778 ( 3.026 -0.000 15.841) 16.127 4.304 ( -0.321 0.000 -13.718) 13.722 4.505 ( 4.160 -0.000 -13.973) 14.579 4.647 ( -0.211 0.000 -10.851) 10.853 5.125 ( -2.232 0.000 -12.012) 12.218 5.535 ( -3.142 0.000 -9.609) 10.109 5.632 ( 6.000 -0.000 -7.935) 9.948 6.057 ( 3.202 -0.000 -3.902) 5.048 6.063 ( -4.844 0.000 -1.224) 4.996 6.110 ( 6.813 -0.000 -7.349) 10.021 6.255 ( -8.041 0.000 -2.169) 8.328 6.858 ( 3.110 -0.000 -4.997) 5.885 7.818 ( -3.346 0.000 -1.233) 3.566 7.822 ( 4.096 -0.000 1.247) 4.282 8.000 ( 2.093 -0.000 -3.280) 3.891 8.091 ( 3.634 -0.000 0.084) 3.635 8.163 ( 3.616 -0.000 -1.111) 3.783 8.248 ( -6.066 0.000 2.834) 6.696 8.367 ( 2.708 -0.000 2.836) 3.922 8.485 ( 5.492 -0.000 -9.717) 11.161 8.723 ( -3.651 0.000 3.431) 5.010 8.851 ( 2.759 -0.000 4.162) 4.994 9.426 ( -1.049 0.000 -1.957) 2.220 9.686 ( -15.429 0.000 3.317) 15.781 9.729 ( -1.010 0.000 -9.849) 9.900 10.141 ( -7.410 0.000 -8.085) 10.967 10.313 ( 0.331 -0.000 -0.470) 0.575 10.502 ( 2.004 -0.000 8.459) 8.693 10.669 ( 2.894 -0.000 -3.914) 4.868 10.970 ( -7.666 0.000 0.398) 7.677 11.065 ( 7.002 -0.000 -1.265) 7.116 11.415 ( -10.636 0.000 -11.291) 15.512 11.800 ( -13.872 0.000 -4.910) 14.715 11.896 ( 15.561 -0.000 -2.320) 15.733 12.332 ( -7.218 0.000 1.738) 7.425 12.333 ( 9.875 -0.000 2.587) 10.208 12.378 ( -10.943 0.000 11.988) 16.231 13.400 ( 11.685 -0.000 -2.539) 11.957 14.614 ( -1.760 0.000 10.739) 10.882 16.083 ( -11.295 0.000 -12.641) 16.951 16.272 ( -1.559 0.000 -0.193) 1.571 16.311 ( 0.938 -0.000 0.856) 1.270 ======================= Grid point 212 (88/282) ======================= q-point: ( 0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.856 ( 4.641 1.101 31.471) 31.830 2.007 ( 11.511 -6.144 32.439) 34.965 2.646 ( 12.581 -15.606 37.394) 42.428 3.323 ( -4.509 2.199 4.003) 6.418 3.455 ( 8.299 -2.117 7.222) 11.203 3.629 ( 2.233 0.590 9.435) 9.714 4.004 ( 3.197 0.885 17.734) 18.042 4.136 ( 0.341 7.088 -10.648) 12.796 4.424 ( 2.245 -5.639 -17.454) 18.479 4.577 ( 2.339 -1.748 -6.748) 7.353 4.978 ( 0.146 -1.983 -15.153) 15.283 5.371 ( -4.064 1.708 -11.040) 11.888 5.626 ( 2.933 1.704 -8.484) 9.137 5.926 ( -2.141 11.505 -0.781) 11.728 6.053 ( 4.607 6.977 -2.427) 8.706 6.158 ( -0.502 -6.526 -4.053) 7.699 6.247 ( 8.487 -9.043 -4.761) 13.284 6.871 ( 4.745 -2.538 -5.825) 7.931 7.748 ( -2.988 2.187 -2.314) 4.366 7.849 ( -0.596 3.974 0.078) 4.019 7.926 ( -2.573 6.562 -3.264) 7.768 8.093 ( 1.084 5.202 0.547) 5.341 8.166 ( -2.401 -2.828 -1.932) 4.183 8.179 ( -0.208 -0.377 -5.454) 5.471 8.389 ( 1.098 4.703 -1.683) 5.114 8.465 ( -3.483 -4.104 -2.335) 5.868 8.752 ( 0.049 -1.815 5.949) 6.220 8.933 ( -0.640 -1.570 8.596) 8.761 9.430 ( 0.510 0.237 1.787) 1.874 9.527 ( -16.014 -3.481 12.889) 20.849 9.663 ( 5.249 2.064 -6.043) 8.266 9.989 ( -7.748 -7.543 -3.992) 11.527 10.318 ( 1.237 -0.062 -1.178) 1.709 10.589 ( 1.639 4.208 1.752) 4.844 10.680 ( -0.333 -5.581 0.216) 5.595 10.905 ( -1.235 -0.298 0.613) 1.411 11.097 ( -6.930 7.445 -10.768) 14.812 11.153 ( 5.069 -0.676 -7.602) 9.162 11.539 ( -15.134 -3.600 -4.740) 16.263 12.021 ( 6.225 4.239 -7.001) 10.283 12.193 ( -9.201 -0.614 0.095) 9.222 12.309 ( -10.414 -0.629 9.720) 14.259 12.540 ( 9.057 1.355 9.201) 12.981 13.601 ( 14.414 -1.534 -0.220) 14.497 14.733 ( 3.450 0.067 10.232) 10.798 15.922 ( 3.434 -1.789 -14.007) 14.532 16.212 ( -4.287 -0.007 -1.927) 4.701 16.343 ( -2.966 -7.660 0.236) 8.217 ======================= Grid point 213 (89/282) ======================= q-point: ( 0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.200 ( 4.691 3.330 27.150) 27.753 2.517 ( 6.734 -12.523 28.469) 31.822 3.246 ( 0.593 1.684 2.832) 3.348 3.337 ( 11.449 -12.168 22.602) 28.107 3.557 ( -0.995 -4.126 3.065) 5.236 3.871 ( 9.719 3.643 -3.113) 10.836 3.931 ( 3.624 6.798 9.258) 12.044 4.252 ( -0.137 -9.897 -1.667) 10.037 4.344 ( 5.747 -0.016 -10.181) 11.691 4.639 ( 8.799 3.169 6.099) 11.165 4.902 ( 3.146 -11.464 -13.188) 17.755 5.185 ( -4.074 0.459 -11.158) 11.888 5.502 ( -1.683 7.923 -8.237) 11.552 5.878 ( 4.727 6.497 -0.166) 8.037 6.036 ( 3.331 8.982 -1.056) 9.638 6.202 ( 6.130 -3.837 -3.421) 8.000 6.443 ( 14.169 -6.921 -4.180) 16.314 6.937 ( 8.257 -5.155 -6.695) 11.814 7.624 ( -8.888 0.984 -3.006) 9.434 7.720 ( -9.333 5.190 -1.870) 10.841 7.787 ( -5.424 5.754 -3.032) 8.469 8.070 ( -1.649 5.363 -3.634) 6.685 8.111 ( -1.189 0.864 -1.119) 1.847 8.183 ( 5.489 -0.052 -0.667) 5.530 8.334 ( 1.607 2.644 -4.477) 5.443 8.410 ( -4.813 0.111 1.487) 5.039 8.819 ( -1.995 2.775 10.283) 10.837 9.028 ( -1.994 -4.407 9.506) 10.666 9.435 ( -2.566 1.694 6.314) 7.023 9.522 ( -6.124 -5.450 11.031) 13.744 9.761 ( 10.702 -3.521 -2.244) 11.487 9.938 ( -4.930 -9.516 -0.838) 10.750 10.322 ( 0.831 -0.350 -1.868) 2.074 10.519 ( -4.394 7.159 -5.015) 9.783 10.624 ( -4.352 1.894 -7.928) 9.240 10.902 ( -0.873 2.264 -2.579) 3.541 10.951 ( 2.630 -4.060 1.165) 4.975 11.153 ( 3.043 1.354 -8.744) 9.357 11.348 ( -4.958 -4.345 -6.431) 9.210 11.901 ( -6.244 7.052 -2.191) 9.670 12.064 ( -10.926 -2.547 -0.360) 11.225 12.286 ( -3.712 -0.502 5.112) 6.337 12.749 ( 8.105 4.131 9.772) 13.351 13.832 ( 13.169 -3.078 0.273) 13.527 14.909 ( 6.989 -0.096 9.546) 11.832 15.873 ( 4.557 -1.748 -12.686) 13.593 16.105 ( -6.182 -2.443 -5.457) 8.601 16.348 ( -4.250 -8.471 0.440) 9.488 ======================= Grid point 214 (90/282) ======================= q-point: ( 0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.478 ( 3.510 4.010 22.815) 23.429 2.897 ( 0.694 -8.843 16.241) 18.506 3.211 ( -10.286 1.034 14.237) 17.595 3.522 ( 1.964 9.619 -4.439) 10.775 3.607 ( -0.935 -5.046 1.596) 5.374 3.970 ( 0.883 -14.551 4.304) 15.199 4.099 ( 4.853 -3.116 -14.708) 15.798 4.302 ( 13.753 5.598 7.264) 16.530 4.380 ( 5.092 -4.593 -3.152) 7.547 4.800 ( 2.799 -9.472 -6.570) 11.863 4.982 ( 3.754 -0.032 1.778) 4.154 5.141 ( 3.758 -9.786 1.512) 10.591 5.405 ( 8.701 8.005 -0.683) 11.842 5.920 ( 7.399 7.526 -1.548) 10.667 6.004 ( 3.342 10.893 0.780) 11.421 6.332 ( 11.293 -3.687 -3.082) 12.273 6.668 ( 14.591 -3.397 -5.153) 15.843 7.058 ( 11.370 -4.916 -8.215) 14.864 7.388 ( -13.994 2.496 -5.362) 15.192 7.524 ( -10.477 1.965 0.739) 10.685 7.640 ( -7.361 -0.951 -2.142) 7.726 7.901 ( -8.409 1.211 -7.519) 11.345 8.027 ( -6.035 8.051 0.657) 10.083 8.281 ( 1.948 3.507 0.329) 4.025 8.356 ( 7.788 1.054 -2.583) 8.272 8.392 ( 7.597 5.790 3.588) 10.204 8.847 ( -6.325 4.217 13.805) 15.760 9.094 ( -4.498 -0.878 8.760) 9.886 9.485 ( -1.057 -2.619 7.783) 8.279 9.602 ( -1.117 -4.578 7.787) 9.101 9.922 ( 5.149 -3.631 -0.300) 6.307 9.968 ( 1.975 -7.600 -0.115) 7.854 10.230 ( -13.774 2.335 -3.295) 14.354 10.329 ( 1.827 1.415 -4.557) 5.110 10.553 ( 5.892 -0.393 -10.248) 11.828 10.837 ( -2.554 -0.075 -7.403) 7.832 10.976 ( -1.444 1.467 1.109) 2.338 11.176 ( 5.472 -3.046 1.732) 6.498 11.302 ( 7.854 0.347 -14.497) 16.491 11.750 ( -7.530 2.979 2.175) 8.385 11.896 ( -13.776 -1.129 2.063) 13.975 12.273 ( -3.488 -0.215 2.463) 4.276 12.894 ( 5.094 7.018 7.463) 11.441 14.032 ( 9.253 -3.742 -0.696) 10.006 15.131 ( 9.372 -0.266 9.942) 13.665 15.822 ( -3.467 -0.196 -2.616) 4.348 15.971 ( -1.317 -4.192 -13.193) 13.905 16.368 ( -2.484 -9.314 1.067) 9.699 ======================= Grid point 215 (91/282) ======================= q-point: (-0.60 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.682 ( 1.241 5.319 17.040) 17.894 2.978 ( -4.652 0.048 5.561) 7.251 3.111 ( -21.241 6.607 17.025) 28.012 3.482 ( 1.282 1.680 0.254) 2.129 3.645 ( 0.421 -4.775 -3.451) 5.907 3.864 ( -1.714 -1.623 -20.125) 20.263 4.128 ( -5.350 -11.034 1.726) 12.384 4.445 ( 6.225 -8.959 -5.530) 12.231 4.606 ( 10.939 2.982 9.071) 14.520 4.796 ( -1.504 -14.570 -6.033) 15.841 5.112 ( 5.017 -6.593 2.608) 8.685 5.220 ( 5.001 6.997 2.023) 8.835 5.673 ( 13.542 -1.932 10.037) 16.966 5.906 ( 4.532 13.627 -2.065) 14.509 6.028 ( 6.426 6.096 1.194) 8.938 6.533 ( 14.601 -3.469 -2.650) 15.240 6.777 ( 5.795 2.880 -4.752) 8.029 7.063 ( -4.025 2.995 -9.031) 10.331 7.243 ( 5.538 -0.991 -2.594) 6.196 7.438 ( -5.205 -7.687 2.357) 9.578 7.528 ( -7.190 -2.836 -2.657) 8.173 7.675 ( -10.805 -2.485 -7.159) 13.198 7.868 ( -3.542 10.778 -0.509) 11.356 8.187 ( -4.133 7.453 -0.231) 8.525 8.506 ( 14.671 7.058 -0.662) 16.294 8.546 ( 10.811 5.978 2.970) 12.706 8.840 ( -8.389 2.102 13.893) 16.365 9.061 ( -7.762 5.128 6.020) 11.081 9.535 ( -9.510 -4.762 9.784) 14.451 9.665 ( 3.374 2.085 -1.918) 4.406 9.948 ( -2.299 0.001 5.038) 5.538 10.071 ( 5.670 -5.036 -3.467) 8.339 10.123 ( -5.244 -16.700 0.922) 17.529 10.311 ( 2.281 1.966 -4.424) 5.351 10.572 ( 7.459 -1.807 -9.113) 11.914 10.747 ( 1.796 -0.966 -6.168) 6.496 10.972 ( 2.048 5.514 3.065) 6.633 11.239 ( 6.853 3.972 -12.448) 14.754 11.348 ( 8.995 -4.072 -0.992) 9.923 11.671 ( -8.101 0.706 1.389) 8.250 11.720 ( -12.196 -2.315 6.062) 13.815 12.241 ( -3.301 -0.555 1.624) 3.721 12.934 ( 0.692 8.873 4.178) 9.832 14.129 ( 2.573 -2.629 -3.786) 5.279 15.380 ( 9.780 0.267 10.328) 14.226 15.676 ( -16.859 -2.061 3.613) 17.364 15.933 ( 10.664 -1.175 -13.597) 17.320 16.452 ( 1.906 -10.218 2.561) 10.706 ======================= Grid point 216 (92/282) ======================= q-point: (-0.50 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.685 ( -9.096 10.847 5.485) 15.182 2.815 ( -23.184 8.728 8.108) 26.065 3.012 ( -6.102 0.424 17.235) 18.288 3.469 ( -4.462 -1.113 2.177) 5.088 3.573 ( -3.341 -0.721 -11.628) 12.120 3.655 ( -1.221 0.861 -16.380) 16.448 4.171 ( -5.395 -15.623 4.171) 17.047 4.531 ( 2.298 -9.848 -7.408) 12.535 4.717 ( -5.029 9.602 8.945) 14.054 4.872 ( -0.703 -18.757 -3.475) 19.089 5.235 ( 5.420 -1.603 -1.637) 5.884 5.277 ( 6.536 7.326 8.218) 12.803 5.808 ( 3.286 7.895 -4.804) 9.809 5.923 ( 1.933 -1.915 4.329) 5.113 6.114 ( 7.545 4.748 5.331) 10.387 6.693 ( 6.534 2.458 -0.144) 6.983 6.818 ( 7.184 2.354 -3.644) 8.392 6.960 ( 2.707 0.869 -4.018) 4.922 7.220 ( -10.300 -0.908 -2.006) 10.533 7.364 ( -3.901 3.237 -3.332) 6.066 7.518 ( 0.131 -8.771 -0.797) 8.808 7.568 ( -0.657 -7.936 -1.367) 8.080 7.800 ( 6.170 10.420 -1.089) 12.159 8.101 ( 2.809 6.296 -1.604) 7.078 8.600 ( -3.111 4.788 3.583) 6.741 8.638 ( 13.186 9.961 -4.039) 17.012 8.829 ( -7.437 3.384 0.027) 8.170 8.954 ( 0.600 9.729 9.300) 13.472 9.486 ( -14.261 -6.186 14.163) 21.030 9.689 ( 2.171 -2.239 -1.926) 3.666 9.977 ( -0.940 -5.447 -2.606) 6.111 10.135 ( 3.020 -3.824 -4.600) 6.701 10.218 ( -0.990 -10.121 3.773) 10.846 10.294 ( 5.141 -0.994 -5.108) 7.315 10.685 ( 11.944 -1.804 -0.147) 12.080 10.758 ( 5.087 0.978 -5.636) 7.655 11.039 ( 7.604 3.149 3.928) 9.120 11.200 ( 6.211 4.220 -7.294) 10.468 11.445 ( -17.750 2.084 3.601) 18.231 11.496 ( 6.048 -3.341 -4.175) 8.073 11.740 ( 0.550 -2.055 7.440) 7.738 12.222 ( -2.342 -2.580 0.932) 3.607 12.866 ( -4.017 8.708 1.189) 9.663 14.073 ( -3.825 -0.808 -7.603) 8.550 15.418 ( -17.859 -2.624 0.379) 18.055 15.638 ( 6.243 0.579 12.106) 13.633 16.010 ( 12.732 3.254 -6.762) 14.779 16.635 ( 6.874 -10.507 4.301) 13.272 ======================= Grid point 217 (93/282) ======================= q-point: (-0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.386 ( -24.746 13.041 3.825) 28.232 2.416 ( -24.077 12.029 3.083) 27.090 3.098 ( -5.809 -0.732 16.106) 17.137 3.369 ( -4.284 -0.396 -14.382) 15.011 3.413 ( -7.770 -1.147 2.271) 8.176 3.518 ( -4.983 2.403 -0.912) 5.607 4.180 ( -19.932 3.688 0.870) 20.289 4.359 ( -10.659 -2.414 2.859) 11.297 4.670 ( 1.866 -1.315 -0.426) 2.322 4.972 ( 3.303 -11.758 -7.213) 14.184 5.350 ( 5.946 -5.107 -2.044) 8.100 5.413 ( 5.675 2.433 8.173) 10.243 5.751 ( 2.190 1.618 -6.008) 6.597 5.941 ( -2.689 -5.004 -1.033) 5.774 6.266 ( 2.488 2.312 9.808) 10.379 6.715 ( -2.479 6.137 -9.824) 11.845 6.799 ( 5.909 4.924 5.941) 9.719 6.890 ( -10.808 3.410 -3.834) 11.964 7.123 ( 3.664 1.410 -1.260) 4.124 7.330 ( 1.142 -4.414 0.694) 4.612 7.570 ( 2.111 -5.729 0.939) 6.177 7.679 ( 5.951 -5.104 -3.831) 8.726 7.861 ( 8.521 5.319 6.502) 11.965 8.157 ( 11.577 3.950 -4.757) 13.125 8.497 ( -10.856 1.083 3.507) 11.459 8.606 ( -6.534 3.764 -7.206) 10.430 8.684 ( 6.558 7.349 -4.847) 10.978 9.015 ( 6.192 14.052 1.087) 15.394 9.554 ( -7.836 -8.715 22.971) 25.788 9.712 ( 0.874 -5.100 -2.865) 5.915 9.930 ( -2.267 -6.192 -9.361) 11.450 10.142 ( 2.157 -2.487 -5.145) 6.108 10.310 ( 4.312 -2.580 0.913) 5.107 10.409 ( 7.037 -4.828 0.643) 8.558 10.745 ( 3.904 3.473 -4.477) 6.881 10.901 ( 12.232 2.174 1.425) 12.505 11.125 ( -14.003 0.579 1.985) 14.155 11.228 ( 6.317 5.936 -3.759) 9.449 11.298 ( 10.198 -4.225 7.719) 13.470 11.494 ( -0.380 5.242 -2.506) 5.823 11.903 ( 5.756 -4.373 8.505) 11.162 12.219 ( -2.518 -4.846 -0.362) 5.473 12.718 ( -7.441 6.795 -0.886) 10.116 13.899 ( -7.259 0.289 -9.996) 12.357 15.153 ( -20.022 -2.536 1.627) 20.247 15.829 ( 5.242 0.390 8.932) 10.364 16.121 ( 12.846 7.298 -2.610) 15.003 16.879 ( 9.226 -8.263 4.506) 13.179 ======================= Grid point 218 (94/282) ======================= q-point: (-0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.834 ( -31.291 13.410 -4.709) 34.367 1.993 ( -28.151 14.189 10.919) 33.362 3.143 ( -7.576 -0.528 8.732) 11.572 3.203 ( -8.717 2.762 4.708) 10.285 3.255 ( -25.903 8.757 11.076) 29.501 3.383 ( -7.576 3.341 1.549) 8.423 3.735 ( -15.612 13.828 7.375) 22.121 4.400 ( -1.393 -16.596 -5.329) 17.486 4.693 ( 3.596 1.794 -4.124) 5.758 4.986 ( 0.721 -2.022 -6.784) 7.116 5.386 ( 3.316 -1.018 -7.665) 8.414 5.561 ( 2.075 -4.829 3.969) 6.586 5.742 ( 3.242 -4.932 -6.854) 9.045 5.956 ( -3.982 -11.887 2.212) 12.730 6.225 ( -11.802 1.914 0.066) 11.957 6.568 ( -0.042 10.513 -5.692) 11.955 6.654 ( -3.581 7.526 -5.415) 9.939 6.898 ( 1.610 9.141 9.875) 13.552 7.201 ( 5.930 -2.270 3.340) 7.174 7.449 ( 4.358 -11.500 1.763) 12.424 7.668 ( 5.095 -3.585 -0.927) 6.298 7.770 ( 6.746 -4.000 -1.117) 7.921 8.075 ( 8.963 0.565 10.116) 13.528 8.207 ( 0.221 0.424 -3.165) 3.201 8.368 ( -8.273 -0.239 2.125) 8.544 8.466 ( 2.603 1.547 -8.883) 9.385 8.681 ( 8.355 7.545 -6.904) 13.206 8.951 ( -0.526 9.775 -1.428) 9.893 9.658 ( 0.266 -0.967 -2.015) 2.251 9.817 ( 2.744 0.845 1.807) 3.392 9.900 ( -4.031 -16.242 10.615) 19.817 10.128 ( 1.695 -3.771 -9.391) 10.261 10.404 ( 6.061 0.421 0.012) 6.076 10.533 ( 3.697 -1.293 0.963) 4.033 10.712 ( -2.598 3.004 -3.959) 5.608 10.911 ( -2.738 7.381 1.796) 8.074 11.032 ( 3.595 1.558 -1.872) 4.343 11.244 ( 3.886 11.769 1.750) 12.517 11.479 ( 6.459 -3.313 -1.608) 7.435 11.642 ( 15.552 -4.693 10.138) 19.149 12.099 ( 3.155 -4.801 8.647) 10.382 12.206 ( -2.835 -5.167 -1.745) 6.147 12.534 ( -8.408 5.627 -1.557) 10.236 13.676 ( -7.739 0.735 -10.571) 13.121 14.898 ( -18.975 -1.645 3.955) 19.453 15.970 ( 3.906 -1.701 5.294) 6.796 16.222 ( 10.534 9.057 -0.767) 13.914 17.089 ( 8.210 -3.164 -0.249) 8.802 ======================= Grid point 219 (95/282) ======================= q-point: (-0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.218 ( -29.257 14.095 0.663) 32.482 1.599 ( -29.559 12.365 21.613) 38.649 2.660 ( -46.567 26.768 31.144) 62.088 3.086 ( -2.824 -0.201 -0.968) 2.992 3.237 ( -6.222 0.388 15.479) 16.687 3.367 ( -0.693 -2.877 8.484) 8.985 3.631 ( -5.512 4.627 9.212) 11.690 4.422 ( -1.353 -14.778 -9.923) 17.852 4.666 ( 3.752 6.091 -6.646) 9.764 4.902 ( -0.695 3.746 -8.137) 8.985 5.345 ( -1.774 -6.068 -7.930) 10.142 5.605 ( 1.761 -0.799 -3.331) 3.852 5.760 ( 2.145 -4.122 -8.708) 9.870 5.995 ( -5.037 -7.818 -2.571) 9.649 6.068 ( -7.499 -12.302 1.456) 14.480 6.365 ( -1.109 13.876 -8.449) 16.283 6.567 ( -1.381 9.772 -0.065) 9.870 6.898 ( -0.508 7.187 3.238) 7.899 7.413 ( 9.172 -5.760 9.218) 14.223 7.654 ( 6.354 -10.769 4.340) 13.236 7.772 ( 5.685 -5.788 -0.947) 8.168 7.896 ( 3.390 -4.722 1.909) 6.118 8.155 ( -4.765 -4.310 0.459) 6.441 8.232 ( -3.557 3.203 6.078) 7.737 8.302 ( 0.932 -2.895 3.801) 4.868 8.470 ( 12.666 7.700 -10.822) 18.353 8.701 ( 8.564 4.666 -5.450) 11.172 8.855 ( -2.740 4.791 -1.337) 5.679 9.603 ( -0.995 -0.419 -8.167) 8.238 9.814 ( 0.012 -6.156 -4.152) 7.425 10.035 ( -4.338 -5.975 -6.351) 9.739 10.170 ( 4.088 -4.834 10.426) 12.197 10.456 ( -0.260 2.723 -0.116) 2.738 10.506 ( -2.984 6.761 -1.240) 7.493 10.608 ( 5.728 4.502 -9.441) 11.925 10.918 ( 1.958 7.802 3.592) 8.810 11.014 ( 0.567 -1.707 3.662) 4.080 11.331 ( 13.306 8.798 4.445) 16.560 11.636 ( 5.037 -14.307 -3.766) 15.628 11.988 ( 12.589 -3.186 8.058) 15.283 12.168 ( -0.943 -1.090 0.355) 1.484 12.207 ( -4.257 -3.012 0.567) 5.245 12.394 ( -4.045 4.773 5.683) 8.453 13.467 ( -5.109 0.972 -9.694) 11.001 14.695 ( -15.341 -0.635 6.868) 16.820 16.087 ( 2.857 -5.548 2.902) 6.882 16.281 ( 6.419 7.872 -0.419) 10.166 17.091 ( -0.987 5.448 -14.523) 15.543 ======================= Grid point 220 (96/282) ======================= q-point: (-0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.972 ( -4.028 7.161 27.485) 28.687 1.397 ( -20.875 6.604 32.874) 39.498 2.185 ( -37.406 19.802 43.390) 60.614 3.089 ( 1.459 0.416 4.568) 4.814 3.284 ( -2.508 -0.332 9.064) 9.410 3.540 ( -0.104 -6.039 13.425) 14.721 3.624 ( -2.332 4.914 11.199) 12.450 4.396 ( -0.867 -11.010 -12.359) 16.575 4.589 ( 3.680 6.738 -9.834) 12.476 4.770 ( 0.055 3.918 -10.738) 11.431 5.262 ( -4.207 -3.844 -8.164) 9.956 5.603 ( 3.515 -3.024 -7.360) 8.699 5.677 ( 0.122 2.654 -9.693) 10.051 5.996 ( 0.940 -11.518 -4.701) 12.475 6.094 ( -5.442 -11.763 -0.263) 12.964 6.194 ( 1.672 11.681 -7.420) 13.939 6.428 ( -6.333 10.034 -0.119) 11.867 6.869 ( 1.685 2.705 -2.618) 4.125 7.689 ( 8.544 -5.618 5.145) 11.447 7.828 ( 1.738 -6.428 1.922) 6.930 7.916 ( 6.116 -3.482 1.833) 7.273 7.980 ( 1.297 -8.356 2.547) 8.832 8.126 ( -1.269 1.308 2.389) 3.005 8.231 ( -0.886 -5.211 2.567) 5.876 8.360 ( 1.151 7.050 3.130) 7.799 8.491 ( 10.115 5.064 -10.712) 15.579 8.755 ( 1.758 -0.234 -0.097) 1.776 8.782 ( 1.198 3.303 -0.792) 3.602 9.499 ( -2.515 0.635 -5.976) 6.515 9.803 ( -3.700 -9.610 -6.822) 12.353 9.903 ( -5.412 1.180 -8.578) 10.211 10.286 ( -0.592 -1.199 -0.740) 1.528 10.347 ( -1.567 7.220 -5.921) 9.468 10.427 ( -0.223 3.477 4.881) 5.997 10.642 ( 7.909 1.010 -6.137) 10.061 10.963 ( 4.283 1.938 3.742) 6.009 11.068 ( -3.159 -0.507 2.538) 4.084 11.536 ( 10.101 1.712 -0.209) 10.248 11.709 ( 0.488 -13.212 -6.039) 14.535 12.039 ( -9.782 3.620 -3.346) 10.954 12.169 ( 9.435 -0.063 -1.056) 9.494 12.298 ( 3.838 -2.909 7.141) 8.613 12.411 ( -5.214 2.198 11.040) 12.406 13.344 ( 1.966 1.029 -7.186) 7.521 14.592 ( -8.872 -0.110 9.540) 13.029 16.197 ( 0.124 -11.142 1.205) 11.208 16.290 ( 1.683 4.201 -1.048) 4.645 16.640 ( -19.056 17.820 -20.406) 33.122 ======================= Grid point 222 (97/282) ======================= q-point: ( 0.10 0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.258 ( 10.025 -0.000 24.185) 26.180 2.388 ( 0.785 -0.000 34.588) 34.597 3.202 ( 23.829 -0.000 19.440) 30.753 3.288 ( -7.116 0.000 8.930) 11.418 3.524 ( -1.540 0.000 3.919) 4.211 3.899 ( 15.985 -0.000 1.923) 16.100 4.042 ( -0.399 0.000 -3.297) 3.321 4.130 ( -2.939 0.000 -2.037) 3.576 4.343 ( 7.500 -0.000 -6.059) 9.642 4.674 ( 10.842 -0.000 10.115) 14.828 4.799 ( -0.021 0.000 -18.743) 18.743 5.190 ( -5.280 0.000 -12.098) 13.200 5.565 ( -0.362 0.000 -9.005) 9.012 5.971 ( 1.899 -0.000 -1.767) 2.594 6.031 ( 1.444 -0.000 1.988) 2.457 6.279 ( 12.695 -0.000 -5.984) 14.035 6.320 ( 12.258 -0.000 -1.170) 12.314 6.894 ( 7.258 -0.000 -5.469) 9.088 7.630 ( -9.618 0.000 -4.130) 10.468 7.762 ( -9.448 0.000 -2.802) 9.854 7.856 ( -6.036 0.000 -4.470) 7.511 8.042 ( -4.359 0.000 -11.958) 12.728 8.166 ( 4.835 -0.000 1.861) 5.181 8.186 ( 6.120 -0.000 2.769) 6.717 8.331 ( -5.424 0.000 -3.652) 6.539 8.431 ( -0.386 0.000 1.490) 1.539 8.854 ( 2.127 -0.000 10.809) 11.016 8.974 ( -6.583 0.000 12.410) 14.047 9.446 ( -12.851 0.000 17.941) 22.069 9.483 ( 1.993 -0.000 2.658) 3.322 9.735 ( 10.031 -0.000 -3.518) 10.630 9.851 ( -3.449 0.000 -1.010) 3.594 10.322 ( 1.007 -0.000 -1.917) 2.166 10.591 ( 0.187 -0.000 -6.296) 6.298 10.634 ( -6.383 0.000 -3.377) 7.221 10.904 ( -0.000 0.000 -1.677) 1.677 10.932 ( -2.195 0.000 -2.499) 3.326 11.162 ( 1.669 -0.000 -7.675) 7.855 11.310 ( -3.093 0.000 -5.582) 6.381 11.987 ( -5.845 0.000 -3.126) 6.628 12.015 ( -10.862 0.000 -1.298) 10.939 12.283 ( -3.687 0.000 5.299) 6.456 12.782 ( 8.850 -0.000 9.763) 13.177 13.806 ( 13.298 -0.000 -0.159) 13.299 14.910 ( 6.995 -0.000 9.663) 11.929 15.855 ( 7.220 -0.000 -15.464) 17.067 16.097 ( -7.232 0.000 -3.931) 8.232 16.273 ( -4.023 0.000 1.553) 4.312 ======================= Grid point 223 (98/282) ======================= q-point: ( 0.20 0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.574 ( 6.614 7.839 21.499) 23.820 2.747 ( 1.381 -9.718 24.615) 26.500 3.232 ( -9.079 1.069 10.994) 14.298 3.538 ( -1.740 -2.146 3.147) 4.188 3.626 ( 7.364 1.115 3.255) 8.128 3.830 ( -0.807 -1.753 -9.207) 9.407 4.047 ( 1.465 -3.257 -10.633) 11.217 4.318 ( 12.713 -1.199 8.658) 15.428 4.406 ( 9.409 4.977 -4.549) 11.576 4.651 ( 1.267 -8.025 -14.168) 16.332 4.994 ( -0.746 0.931 -3.647) 3.837 5.043 ( 8.756 -3.200 12.640) 15.706 5.506 ( 7.088 3.989 -4.280) 9.191 6.002 ( 6.300 3.822 -0.346) 7.377 6.126 ( 5.405 1.315 3.521) 6.583 6.358 ( 12.894 8.996 -5.571) 16.679 6.561 ( 13.501 -10.025 -3.367) 17.150 6.991 ( 10.639 -2.695 -5.219) 12.153 7.408 ( -13.041 0.382 -4.360) 13.756 7.557 ( -12.712 1.116 -2.071) 12.928 7.667 ( -9.025 3.966 -5.119) 11.108 7.842 ( -8.493 -5.170 -12.766) 16.181 8.162 ( -6.444 6.503 0.952) 9.204 8.310 ( 2.055 0.186 4.207) 4.686 8.354 ( 12.100 -0.649 0.475) 12.127 8.463 ( 5.829 2.615 2.919) 7.024 8.926 ( -7.934 6.221 14.523) 17.679 9.043 ( -2.316 -5.772 12.613) 14.063 9.455 ( -8.301 -1.327 14.733) 16.963 9.542 ( 2.429 -1.891 2.153) 3.756 9.842 ( -1.321 -4.381 1.834) 4.930 9.886 ( 11.605 -2.141 -3.255) 12.242 10.292 ( -6.233 1.950 -1.972) 6.822 10.378 ( -7.518 4.244 -8.814) 12.337 10.552 ( 4.770 -0.004 -9.318) 10.468 10.817 ( -6.261 -1.872 -5.678) 8.657 10.984 ( 4.437 0.155 2.437) 5.065 11.141 ( 2.166 -1.363 0.896) 2.712 11.298 ( 9.061 -0.344 -11.763) 14.852 11.811 ( -9.753 4.378 0.211) 10.692 11.868 ( -11.822 -2.810 0.370) 12.157 12.273 ( -2.641 0.118 2.213) 3.448 12.973 ( 5.653 2.901 8.080) 10.279 13.988 ( 10.230 -1.668 -1.309) 10.447 15.133 ( 9.534 0.251 10.428) 14.131 15.820 ( 0.367 -0.064 -6.166) 6.177 15.935 ( -1.938 -0.722 -12.262) 12.435 16.251 ( -2.990 -4.844 1.753) 5.956 ======================= Grid point 224 (99/282) ======================= q-point: ( 0.30 0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.785 ( 3.942 7.790 17.557) 19.608 2.961 ( -2.121 -2.410 8.298) 8.898 3.196 ( -15.403 4.436 20.476) 26.004 3.548 ( 0.736 6.007 -7.089) 9.320 3.571 ( -1.516 -4.490 2.266) 5.253 3.779 ( -5.616 -9.105 -9.090) 14.038 4.015 ( 0.957 -3.176 -7.736) 8.418 4.306 ( -0.518 -7.501 -14.373) 16.221 4.593 ( 9.063 -4.216 -4.270) 10.869 4.667 ( -1.092 -3.302 3.546) 4.967 5.013 ( 8.734 -4.253 2.404) 10.008 5.310 ( 7.127 3.725 11.767) 14.252 5.690 ( 15.723 2.922 4.286) 16.556 6.073 ( 7.539 5.912 -1.210) 9.657 6.184 ( 5.032 14.258 3.581) 15.538 6.485 ( 14.150 -1.706 -3.122) 14.591 6.760 ( 8.468 -6.282 -5.272) 11.788 7.067 ( -1.522 -2.053 -6.554) 7.035 7.228 ( -1.192 0.433 -1.563) 2.012 7.360 ( -11.161 -2.995 0.049) 11.555 7.488 ( -5.181 -0.926 -3.979) 6.597 7.621 ( -8.366 -4.478 -12.193) 15.450 8.015 ( -5.251 7.536 -0.142) 9.186 8.288 ( -5.035 5.051 4.013) 8.183 8.579 ( 15.820 2.892 0.427) 16.087 8.625 ( 10.641 3.513 3.614) 11.775 8.878 ( -11.571 3.014 16.788) 20.611 9.125 ( -5.486 2.876 10.461) 12.157 9.477 ( -8.383 -2.614 10.992) 14.069 9.647 ( 7.214 -4.423 -2.192) 8.741 9.898 ( -0.381 -7.396 3.323) 8.117 9.996 ( -14.680 1.425 1.748) 14.852 10.015 ( 8.154 -1.562 -11.598) 14.263 10.335 ( 2.385 1.038 -1.698) 3.107 10.540 ( 5.499 -2.068 -11.473) 12.890 10.732 ( 0.297 -1.087 -0.796) 1.380 11.052 ( 4.786 5.088 1.232) 7.093 11.236 ( 7.867 -4.307 -4.678) 10.115 11.329 ( 8.244 1.203 -7.951) 11.516 11.673 ( -7.830 -0.300 4.071) 8.830 11.696 ( -13.824 -0.531 1.361) 13.901 12.247 ( -2.412 0.849 1.337) 2.885 13.052 ( 0.287 5.962 5.324) 7.998 14.092 ( 4.438 -1.920 -4.071) 6.321 15.390 ( 9.897 0.753 11.818) 15.433 15.656 ( -16.075 -0.390 0.644) 16.092 15.921 ( 14.425 -0.539 -13.975) 20.092 16.304 ( 1.343 -8.267 2.104) 8.635 ======================= Grid point 225 (100/282) ======================= q-point: (-0.60 0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.868 ( -2.852 12.750 6.261) 14.488 2.914 ( -10.109 2.858 1.821) 10.661 3.076 ( -15.474 9.182 23.076) 29.261 3.471 ( -2.680 0.798 -2.381) 3.673 3.559 ( -3.217 -1.230 -7.686) 8.423 3.657 ( -1.379 -1.808 -10.314) 10.561 3.952 ( -8.369 -11.452 -0.255) 14.186 4.314 ( 2.919 -17.866 -8.320) 19.923 4.643 ( 1.938 -8.710 -3.287) 9.509 4.743 ( -1.709 -5.668 3.118) 6.691 5.247 ( 11.070 2.592 6.705) 13.199 5.432 ( 2.512 11.708 7.888) 14.339 5.855 ( 3.447 0.203 -0.215) 3.460 6.061 ( 4.347 14.874 -2.847) 15.755 6.200 ( 4.859 8.096 4.713) 10.554 6.690 ( 10.703 -2.794 -2.211) 11.280 6.831 ( 3.748 -1.122 1.254) 4.108 6.970 ( -0.771 -0.205 -8.075) 8.114 7.161 ( -12.093 -5.299 -1.961) 13.347 7.292 ( -2.460 -11.207 -0.927) 11.511 7.460 ( -1.706 -4.987 0.335) 5.281 7.491 ( 2.547 3.086 -6.408) 7.554 7.939 ( 6.547 7.382 -2.855) 10.272 8.200 ( -3.954 6.227 2.947) 7.943 8.648 ( -8.444 1.431 3.008) 9.077 8.752 ( 9.478 4.798 -1.826) 10.779 8.923 ( -1.129 8.589 3.524) 9.352 9.075 ( 0.150 5.133 12.623) 13.628 9.431 ( -10.965 -0.669 6.596) 12.814 9.678 ( -0.004 0.445 -2.582) 2.620 9.879 ( -3.333 -6.410 -1.750) 7.434 10.015 ( 2.253 -9.869 1.980) 10.314 10.098 ( 7.193 -5.879 -2.166) 9.540 10.314 ( 3.343 3.106 -7.316) 8.622 10.618 ( 9.456 -6.587 -0.116) 11.525 10.790 ( 5.953 2.628 -0.244) 6.512 11.092 ( 7.069 4.114 -2.653) 8.598 11.276 ( 4.417 5.175 -3.754) 7.771 11.420 ( 7.426 -5.643 -2.684) 9.705 11.483 ( -14.458 1.933 0.947) 14.617 11.682 ( -1.006 -4.900 6.551) 8.242 12.219 ( -1.663 1.493 1.176) 2.526 12.995 ( -5.748 7.727 2.559) 9.965 14.059 ( -2.513 -0.982 -7.767) 8.223 15.392 ( -17.058 -0.745 -1.336) 17.126 15.646 ( 6.426 0.405 13.230) 14.714 16.056 ( 16.947 2.718 -6.727) 18.435 16.468 ( 7.444 -10.622 2.986) 13.310 ======================= Grid point 226 (101/282) ======================= q-point: (-0.50 0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.597 ( -21.098 13.489 -1.096) 25.066 2.644 ( -15.122 17.936 3.832) 23.771 3.099 ( -7.462 1.343 17.851) 19.395 3.358 ( -3.419 -0.860 -13.831) 14.274 3.415 ( -6.841 0.592 0.467) 6.882 3.566 ( -2.475 3.750 -0.132) 4.495 3.978 ( -5.938 -18.611 1.265) 19.576 4.391 ( -2.717 -7.280 -4.829) 9.149 4.688 ( -13.039 0.757 11.114) 17.150 4.769 ( 7.483 -9.833 -6.614) 14.016 5.306 ( 0.789 5.300 0.954) 5.443 5.498 ( 6.114 5.011 5.372) 9.558 5.800 ( -3.219 0.254 -7.362) 8.039 5.977 ( -0.049 12.665 0.535) 12.676 6.301 ( 4.279 2.333 6.664) 8.256 6.763 ( -6.986 0.985 -10.274) 12.463 6.837 ( 9.045 -0.177 1.155) 9.120 6.932 ( -1.891 0.878 1.040) 2.330 7.054 ( -3.004 -9.472 -2.686) 10.293 7.313 ( -3.822 0.350 -0.313) 3.851 7.486 ( 3.610 -5.099 0.741) 6.292 7.558 ( 5.107 -7.472 1.765) 9.221 7.983 ( 5.431 8.981 2.104) 10.704 8.204 ( 9.855 2.125 -3.989) 10.842 8.499 ( -13.608 -0.735 3.175) 13.993 8.625 ( -14.327 0.275 -5.286) 15.274 8.850 ( 10.268 12.524 -8.268) 18.184 9.240 ( 6.529 14.039 -3.380) 15.848 9.406 ( -5.061 -9.007 24.645) 26.723 9.670 ( -0.086 -1.347 -1.132) 1.762 9.836 ( -1.668 -5.370 -7.957) 9.743 10.111 ( 3.097 -3.138 -2.212) 4.932 10.254 ( 8.024 -4.461 -0.813) 9.217 10.337 ( 7.833 -2.985 -2.394) 8.717 10.815 ( 5.860 3.249 -4.124) 7.868 10.854 ( 6.442 -4.369 3.682) 8.611 11.170 ( 1.028 0.549 -0.174) 1.179 11.239 ( -1.775 1.758 4.276) 4.952 11.341 ( 6.552 6.370 -1.231) 9.221 11.521 ( 3.773 -1.650 -2.178) 4.658 11.820 ( 3.465 -6.510 7.720) 10.677 12.193 ( -1.739 1.352 0.742) 2.324 12.826 ( -10.304 7.389 0.858) 12.708 13.898 ( -7.026 -0.537 -10.284) 12.466 15.123 ( -18.071 -1.259 -0.028) 18.115 15.836 ( 3.224 0.300 10.681) 11.161 16.232 ( 16.086 7.090 -2.330) 17.732 16.734 ( 12.154 -10.326 3.314) 16.288 ======================= Grid point 227 (102/282) ======================= q-point: (-0.40 0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.084 ( -24.500 18.690 -6.335) 31.460 2.268 ( -21.805 21.252 9.044) 31.763 3.130 ( -6.236 -1.026 7.878) 10.100 3.207 ( -4.761 -0.733 -0.673) 4.863 3.323 ( -7.455 1.021 3.412) 8.262 3.501 ( -8.911 9.338 10.487) 16.631 3.959 ( -14.722 3.820 2.220) 15.371 4.189 ( -11.148 -1.682 1.501) 11.374 4.676 ( 1.243 -4.295 1.132) 4.613 4.887 ( 5.331 -8.807 -7.065) 12.485 5.338 ( 1.843 -4.950 -4.299) 6.810 5.542 ( 0.611 2.132 1.523) 2.691 5.703 ( -1.340 -3.175 -5.841) 6.782 5.885 ( -3.368 6.365 1.881) 7.443 6.274 ( -8.531 3.861 -3.530) 10.007 6.646 ( 3.021 1.289 -2.628) 4.207 6.786 ( -2.020 8.529 -10.512) 13.687 7.023 ( 5.220 5.183 11.438) 13.599 7.129 ( 1.140 -12.077 1.728) 12.253 7.263 ( -3.201 -6.495 1.490) 7.392 7.616 ( 2.574 -2.552 3.335) 4.926 7.686 ( 5.918 -8.353 -2.298) 10.492 8.072 ( 5.162 0.178 7.616) 9.203 8.209 ( -7.302 -0.005 -3.424) 8.064 8.357 ( -10.741 -1.477 2.146) 11.052 8.470 ( 8.742 -0.974 -9.956) 13.285 8.817 ( 7.794 10.116 -8.154) 15.152 9.114 ( -2.933 9.891 -2.718) 10.669 9.653 ( 2.231 -0.424 -6.607) 6.987 9.693 ( -1.086 -10.293 10.265) 14.577 9.802 ( 1.683 -1.277 4.624) 5.084 10.128 ( 5.987 2.979 -6.263) 9.162 10.390 ( 9.120 -2.143 -2.974) 9.829 10.487 ( 6.862 -3.994 0.515) 7.956 10.778 ( -2.206 5.398 -1.310) 5.977 10.920 ( -2.829 -5.816 -0.138) 6.469 11.095 ( 2.981 6.272 -1.737) 7.159 11.388 ( 9.900 5.260 1.390) 11.296 11.478 ( 1.968 3.609 -0.217) 4.117 11.575 ( 13.134 -3.638 5.888) 14.846 12.003 ( 2.335 -7.627 7.713) 11.096 12.163 ( -1.741 0.049 0.049) 1.742 12.617 ( -11.066 5.564 1.278) 12.452 13.680 ( -7.839 -0.491 -10.797) 13.351 14.876 ( -17.110 -1.023 2.793) 17.367 15.952 ( 0.650 -0.884 7.132) 7.216 16.366 ( 11.671 9.562 -0.964) 15.119 17.017 ( 13.128 -6.081 -0.041) 14.468 ======================= Grid point 228 (103/282) ======================= q-point: (-0.30 0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.505 ( -22.240 22.605 -2.455) 31.806 1.878 ( -22.867 23.170 17.377) 36.901 3.081 ( -2.912 0.187 -0.646) 2.988 3.139 ( -25.032 28.557 21.002) 43.396 3.237 ( -7.931 -0.479 18.945) 20.544 3.337 ( -6.655 2.331 6.887) 9.857 3.732 ( -6.892 8.907 7.607) 13.590 4.173 ( -3.586 -16.662 -6.029) 18.079 4.739 ( 5.324 0.688 -3.328) 6.316 4.904 ( 1.090 -2.749 -8.199) 8.716 5.270 ( -2.213 -3.293 -11.735) 12.388 5.585 ( -0.972 -3.004 2.835) 4.244 5.677 ( 1.783 -5.776 -7.452) 9.596 5.833 ( -5.153 -5.398 2.312) 7.813 6.052 ( -6.132 4.548 -7.768) 10.891 6.558 ( -1.326 11.099 -10.847) 15.576 6.668 ( 2.433 4.173 -3.817) 6.157 7.046 ( -4.093 10.845 6.284) 13.186 7.318 ( 7.248 -7.031 8.057) 12.919 7.411 ( 1.826 -20.292 6.850) 21.495 7.671 ( 1.023 -6.019 -0.523) 6.128 7.827 ( 4.502 -5.200 0.474) 6.895 8.076 ( -6.164 -5.702 0.568) 8.416 8.217 ( -8.629 -4.978 1.568) 10.084 8.262 ( 2.974 -2.226 6.421) 7.418 8.561 ( 14.032 3.474 -10.427) 17.823 8.790 ( 6.856 7.313 -5.989) 11.677 8.975 ( -1.787 9.813 -2.529) 10.290 9.602 ( 1.210 -0.041 -9.033) 9.113 9.689 ( -5.497 -8.023 -2.969) 10.169 9.932 ( -2.158 -5.931 1.421) 6.469 10.191 ( 8.107 5.278 4.438) 10.643 10.484 ( 6.518 1.790 -4.605) 8.178 10.573 ( 5.043 1.055 -1.197) 5.289 10.694 ( 0.558 6.066 -3.984) 7.279 10.971 ( 3.189 -4.806 0.460) 5.786 11.051 ( -0.217 7.301 -0.910) 7.361 11.429 ( -1.102 -2.709 -1.968) 3.525 11.498 ( 9.374 6.380 0.146) 11.340 11.924 ( 13.866 -5.442 7.867) 16.846 12.113 ( -4.204 -6.348 3.991) 8.596 12.158 ( 1.039 -1.694 0.122) 1.991 12.469 ( -6.723 4.601 6.003) 10.119 13.480 ( -4.955 0.198 -9.437) 10.661 14.687 ( -13.976 -0.312 6.281) 15.326 16.018 ( -1.450 -3.548 4.434) 5.860 16.417 ( 6.339 9.771 -1.182) 11.707 17.155 ( 7.443 2.311 -10.891) 13.392 ======================= Grid point 229 (104/282) ======================= q-point: (-0.20 0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.175 ( -5.133 18.808 18.663) 26.989 1.614 ( -16.506 21.093 27.018) 38.043 2.682 ( -27.066 41.256 33.762) 59.787 3.101 ( 1.687 1.169 5.285) 5.670 3.276 ( -4.901 -0.637 10.671) 11.760 3.442 ( -0.483 -6.605 13.604) 15.130 3.701 ( -2.847 5.467 10.344) 12.041 4.177 ( -2.192 -16.173 -9.427) 18.848 4.721 ( 4.815 9.490 -9.074) 13.985 4.823 ( -0.899 0.962 -9.102) 9.196 5.168 ( -1.526 -6.941 -9.778) 12.088 5.563 ( -2.820 -2.032 -3.343) 4.823 5.679 ( 3.751 -4.250 -10.669) 12.081 5.849 ( -3.743 -10.853 -0.137) 11.481 5.919 ( -1.799 -2.629 -3.576) 4.790 6.367 ( 1.182 10.247 -10.455) 14.687 6.578 ( -3.135 8.124 -4.346) 9.732 6.949 ( -1.317 7.351 -0.968) 7.530 7.561 ( 5.823 -8.639 7.486) 12.829 7.693 ( 3.748 -15.556 9.097) 18.406 7.749 ( -0.458 -12.069 3.438) 12.557 7.882 ( 0.086 -4.865 -2.209) 5.344 8.112 ( -0.659 -3.453 3.454) 4.928 8.153 ( -2.281 -5.860 0.731) 6.331 8.378 ( 1.802 -2.803 1.770) 3.773 8.607 ( 8.041 5.489 -7.835) 12.496 8.794 ( 4.525 6.008 -1.693) 7.710 8.869 ( 1.005 8.128 -2.981) 8.715 9.521 ( -0.847 2.232 -5.952) 6.413 9.641 ( -3.625 -10.300 -5.873) 12.399 9.884 ( -5.281 -2.150 -3.974) 6.950 10.278 ( 0.080 0.542 3.959) 3.997 10.501 ( 2.457 9.652 -7.961) 12.750 10.517 ( 0.611 8.444 -4.160) 9.433 10.665 ( 8.045 1.476 -5.041) 9.608 10.996 ( 1.699 0.504 0.366) 1.809 11.068 ( -1.275 1.531 2.600) 3.275 11.429 ( -5.596 -15.245 -7.203) 17.765 11.615 ( 12.960 3.956 2.465) 13.772 12.049 ( -9.316 -2.251 -1.555) 9.710 12.163 ( 8.957 -1.421 0.455) 9.081 12.232 ( 1.104 -4.658 5.587) 7.357 12.456 ( -4.551 3.043 10.810) 12.117 13.368 ( 2.347 1.594 -6.468) 7.063 14.592 ( -8.276 0.244 9.268) 12.427 16.051 ( -3.995 -6.973 2.444) 8.400 16.393 ( 2.000 8.770 -2.077) 9.232 16.933 ( -5.486 17.054 -20.806) 27.457 ======================= Grid point 230 (105/282) ======================= q-point: (-0.10 0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.439 ( 11.658 3.859 32.591) 34.828 1.628 ( -1.210 14.196 32.371) 35.368 2.448 ( -11.870 34.585 41.191) 55.080 3.227 ( 6.984 0.658 8.061) 10.686 3.321 ( -2.278 -1.543 7.175) 7.685 3.572 ( -3.176 -2.232 9.434) 10.202 3.786 ( 1.645 1.371 15.715) 15.860 4.169 ( -0.829 -13.834 -11.349) 17.913 4.593 ( 3.298 8.691 -13.844) 16.675 4.690 ( -0.472 4.060 -11.169) 11.893 5.105 ( -0.328 -2.399 -10.315) 10.595 5.494 ( -3.089 -4.602 -7.723) 9.506 5.644 ( 5.154 0.315 -10.798) 11.969 5.885 ( -2.804 -12.602 -0.867) 12.939 5.941 ( 1.287 -9.382 -2.029) 9.685 6.246 ( 5.105 9.052 -8.619) 13.501 6.382 ( -6.767 10.487 -3.997) 13.105 6.891 ( 3.052 4.138 -5.039) 7.199 7.738 ( 1.395 -8.911 2.003) 9.239 7.789 ( -0.967 -4.249 1.986) 4.790 7.907 ( 0.706 -7.906 -2.654) 8.369 7.981 ( 2.206 -13.514 6.663) 15.228 8.151 ( 0.216 -4.808 2.494) 5.421 8.210 ( 1.224 -1.702 -0.621) 2.187 8.387 ( 0.185 -0.105 -3.508) 3.515 8.566 ( 1.123 6.510 -5.068) 8.326 8.762 ( -0.358 6.301 0.565) 6.337 8.867 ( 3.233 2.219 2.306) 4.550 9.444 ( -1.288 2.180 -1.836) 3.127 9.629 ( -0.651 -7.127 -4.294) 8.346 9.728 ( -11.161 1.568 -1.550) 11.377 10.235 ( -4.998 9.770 -7.896) 13.519 10.316 ( -0.386 0.567 -1.257) 1.433 10.531 ( 2.615 3.848 1.766) 4.976 10.703 ( 3.136 3.937 -0.912) 5.115 10.974 ( -7.799 0.856 0.541) 7.864 11.060 ( 6.394 -1.703 -3.358) 7.420 11.315 ( -10.064 -10.662 -10.186) 17.853 11.822 ( -3.989 2.655 -1.840) 5.132 11.882 ( 6.083 -2.391 -4.272) 7.808 12.273 ( -7.359 -4.682 5.533) 10.329 12.318 ( 8.171 -1.954 2.295) 8.710 12.424 ( -9.771 3.227 9.518) 14.017 13.420 ( 11.605 2.247 -2.231) 12.029 14.614 ( -1.664 0.174 10.611) 10.742 16.029 ( -4.877 -4.851 -4.160) 8.039 16.304 ( -1.126 7.255 -4.119) 8.418 16.516 ( -4.885 18.990 -8.210) 21.258 ======================= Grid point 233 (106/282) ======================= q-point: ( 0.20 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.897 ( 8.295 -0.000 10.819) 13.633 2.898 ( -2.768 0.000 16.854) 17.080 3.234 ( -12.362 0.000 22.799) 25.935 3.528 ( -3.394 0.000 4.323) 5.496 3.646 ( -3.385 0.000 -4.267) 5.447 3.651 ( -2.627 0.000 -13.862) 14.109 3.997 ( 2.615 -0.000 -6.624) 7.121 4.247 ( -4.545 0.000 -22.056) 22.520 4.552 ( 9.113 -0.000 -4.096) 9.991 4.643 ( -2.473 0.000 2.597) 3.586 4.985 ( 11.611 -0.000 4.429) 12.427 5.336 ( 7.748 -0.000 14.653) 16.575 5.720 ( 16.616 -0.000 1.217) 16.661 6.120 ( 7.387 -0.000 -0.198) 7.390 6.308 ( 8.697 -0.000 8.724) 12.318 6.525 ( 13.110 -0.000 -11.107) 17.183 6.637 ( 7.304 -0.000 -2.019) 7.578 7.049 ( -1.772 0.000 -3.880) 4.265 7.237 ( -2.630 0.000 -1.775) 3.173 7.336 ( -13.258 0.000 -1.642) 13.359 7.497 ( -8.851 0.000 -3.467) 9.506 7.570 ( -3.297 0.000 -14.954) 15.313 8.076 ( -6.075 0.000 -0.828) 6.131 8.328 ( -5.264 0.000 5.714) 7.769 8.601 ( 16.541 -0.000 1.164) 16.582 8.649 ( 9.333 -0.000 3.651) 10.021 8.910 ( -13.898 0.000 18.913) 23.471 9.144 ( -3.197 0.000 13.157) 13.540 9.458 ( -6.934 0.000 10.372) 12.476 9.598 ( 7.998 -0.000 -3.424) 8.700 9.841 ( -0.877 0.000 4.303) 4.392 9.989 ( 7.223 -0.000 -6.417) 9.662 10.036 ( -14.782 0.000 -8.186) 16.897 10.343 ( 2.832 -0.000 0.355) 2.854 10.521 ( 3.605 -0.000 -13.687) 14.154 10.721 ( 0.512 -0.000 1.926) 1.993 11.112 ( 7.500 -0.000 3.198) 8.153 11.177 ( 6.605 -0.000 -6.666) 9.384 11.340 ( 8.358 -0.000 -7.148) 10.998 11.673 ( -14.527 0.000 3.755) 15.005 11.692 ( -8.197 0.000 -0.029) 8.197 12.255 ( -1.871 0.000 1.208) 2.227 13.100 ( 0.116 -0.000 5.801) 5.802 14.077 ( 5.252 -0.000 -4.234) 6.746 15.396 ( 9.665 -0.000 12.588) 15.870 15.656 ( -15.467 0.000 -0.948) 15.496 15.916 ( 15.626 -0.000 -14.088) 21.039 16.235 ( 1.258 -0.000 2.135) 2.478 ======================= Grid point 234 (107/282) ======================= q-point: (-0.70 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.929 ( -5.850 0.174 3.951) 7.062 3.039 ( 2.596 7.654 5.398) 9.719 3.248 ( -14.541 10.961 24.463) 30.496 3.472 ( -5.003 -1.741 -5.625) 7.726 3.536 ( -2.545 -1.292 -4.245) 5.116 3.562 ( -6.516 -8.026 3.123) 10.800 3.893 ( -5.585 3.599 -15.929) 17.259 4.055 ( 1.656 -13.978 -8.854) 16.628 4.580 ( -1.979 -0.503 0.350) 2.071 4.642 ( 3.832 -5.527 -3.732) 7.691 5.280 ( 13.695 1.220 9.625) 16.783 5.568 ( 4.921 4.695 13.287) 14.927 5.878 ( 5.529 2.037 -5.174) 7.841 6.189 ( 3.031 3.170 -0.741) 4.448 6.426 ( 5.511 17.399 2.595) 18.435 6.628 ( 9.057 -3.745 -1.766) 9.959 6.752 ( 4.224 -10.106 -0.867) 10.987 6.938 ( -2.700 -2.531 -6.232) 7.248 7.100 ( -13.516 -1.657 -3.029) 13.950 7.170 ( -7.853 -3.629 -0.511) 8.666 7.406 ( -0.118 -1.796 -0.518) 1.873 7.529 ( 7.322 1.228 -7.502) 10.554 8.018 ( 5.276 2.784 -3.511) 6.922 8.271 ( -7.723 2.566 5.444) 9.791 8.655 ( -10.960 -0.080 3.139) 11.401 8.799 ( 5.998 1.610 -1.137) 6.314 9.032 ( 2.335 3.936 18.186) 18.753 9.118 ( -5.002 1.550 4.231) 6.732 9.442 ( -2.913 0.864 2.137) 3.715 9.689 ( 4.178 0.509 -9.187) 10.105 9.804 ( -5.966 -2.620 2.995) 7.171 9.901 ( 1.038 -4.234 4.937) 6.586 10.031 ( 8.132 -2.449 -6.602) 10.757 10.385 ( 3.683 6.252 -5.759) 9.263 10.501 ( 6.297 -8.223 -0.929) 10.399 10.819 ( 6.368 0.974 3.433) 7.299 11.169 ( 8.682 5.385 -10.107) 14.371 11.293 ( 8.826 -4.556 -0.286) 9.937 11.384 ( 3.779 2.416 -3.146) 5.479 11.490 ( -14.461 -1.108 4.611) 15.219 11.623 ( -2.783 -2.023 4.094) 5.347 12.244 ( -0.735 1.091 1.242) 1.809 13.083 ( -6.548 3.239 3.386) 8.052 14.046 ( -1.877 -0.530 -7.944) 8.180 15.391 ( -16.342 0.238 -2.838) 16.588 15.650 ( 6.010 0.065 13.870) 15.116 16.089 ( 19.996 1.358 -6.109) 20.953 16.341 ( 7.670 -4.982 1.981) 9.358 ======================= Grid point 235 (108/282) ======================= q-point: (-0.60 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.774 ( -12.110 8.671 -2.654) 15.128 2.928 ( -9.177 17.879 2.646) 20.270 3.155 ( -11.678 6.580 15.287) 20.331 3.345 ( -3.850 -1.042 -11.360) 12.039 3.412 ( -8.338 -0.971 0.301) 8.399 3.618 ( 0.285 -0.864 2.357) 2.526 3.703 ( -8.510 -12.951 -0.611) 15.509 4.187 ( 4.255 -15.216 -1.521) 15.873 4.611 ( -1.653 -4.563 6.720) 8.289 4.702 ( 4.295 -4.169 -4.887) 7.728 5.487 ( 3.477 10.229 5.411) 12.083 5.590 ( -1.893 11.057 6.043) 12.742 5.784 ( -6.945 -0.810 -6.492) 9.541 6.184 ( 3.149 5.651 -1.895) 6.741 6.376 ( 1.793 12.101 3.041) 12.606 6.740 ( -3.548 -7.295 -5.956) 10.063 6.778 ( -1.146 -2.726 -5.507) 6.251 6.894 ( 2.254 -3.131 4.097) 5.628 6.975 ( -2.506 -2.423 -2.994) 4.596 7.190 ( 1.756 -13.570 0.451) 13.691 7.476 ( -4.550 2.766 -0.777) 5.382 7.504 ( 6.851 -1.198 3.083) 7.607 8.107 ( 5.801 6.901 -0.498) 9.029 8.219 ( 6.191 -0.235 -2.155) 6.560 8.482 ( -15.590 -1.210 3.413) 16.005 8.626 ( -17.906 0.020 -5.451) 18.717 9.033 ( 9.551 10.372 -10.202) 17.403 9.285 ( -9.917 -4.931 19.487) 22.414 9.429 ( 12.492 8.386 -2.698) 15.285 9.646 ( 0.187 -2.055 -1.541) 2.576 9.784 ( 0.791 -1.294 -5.700) 5.898 10.025 ( 3.760 -7.229 2.662) 8.572 10.196 ( 10.802 -2.595 1.361) 11.192 10.351 ( 7.585 4.621 -6.403) 10.949 10.715 ( 7.647 -9.123 2.884) 12.248 10.908 ( 2.844 3.777 2.134) 5.188 11.158 ( 6.179 1.184 -7.451) 9.752 11.299 ( -6.212 1.778 1.218) 6.575 11.418 ( 7.688 3.606 -0.019) 8.491 11.480 ( 4.709 -1.740 2.031) 5.416 11.715 ( 2.044 -6.628 6.811) 9.721 12.233 ( -0.552 2.849 1.306) 3.182 12.931 ( -11.690 5.715 1.922) 13.154 13.883 ( -7.776 -1.167 -10.492) 13.112 15.116 ( -16.362 0.109 -1.872) 16.469 15.836 ( 1.481 -0.280 12.163) 12.256 16.334 ( 19.122 6.367 -1.464) 20.207 16.581 ( 14.208 -9.192 2.026) 17.043 ======================= Grid point 236 (109/282) ======================= q-point: (-0.50 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.382 ( -17.190 19.732 -7.310) 27.172 2.614 ( -15.901 23.383 6.964) 29.122 3.103 ( -8.363 -3.060 7.202) 11.454 3.191 ( -3.028 -1.116 -7.026) 7.731 3.321 ( -8.658 -1.409 4.719) 9.961 3.633 ( 0.188 7.932 7.364) 10.825 3.756 ( -6.782 -18.572 3.537) 20.085 4.291 ( -2.425 -1.201 0.683) 2.791 4.634 ( -9.781 1.786 11.553) 15.242 4.773 ( 8.938 -5.426 -6.569) 12.349 5.338 ( -3.689 8.394 -1.138) 9.239 5.573 ( -6.363 0.941 -2.648) 6.956 5.650 ( -2.081 -1.918 -2.261) 3.623 6.104 ( 1.319 17.762 -2.628) 18.004 6.323 ( -5.504 1.861 -5.312) 7.872 6.622 ( -1.192 -6.148 0.801) 6.313 6.865 ( -1.058 -14.265 -0.528) 14.314 6.886 ( -0.282 4.444 -9.785) 10.750 7.041 ( 7.886 -1.988 5.822) 10.002 7.266 ( -4.661 0.800 3.425) 5.839 7.498 ( 4.612 -12.776 2.368) 13.788 7.608 ( -0.116 -0.407 3.581) 3.606 8.093 ( -0.669 2.194 4.377) 4.942 8.211 ( -13.230 0.422 -3.726) 13.751 8.321 ( -13.745 -3.134 0.743) 14.118 8.448 ( 13.627 -1.523 -8.590) 16.181 8.971 ( 6.571 9.186 -10.876) 15.679 9.222 ( -6.205 4.050 1.676) 7.597 9.601 ( 2.741 -1.510 6.843) 7.525 9.634 ( 4.617 -1.417 -12.372) 13.281 9.802 ( 2.867 0.652 4.125) 5.066 10.158 ( 6.431 -2.941 0.306) 7.078 10.355 ( 12.525 0.344 -5.230) 13.578 10.443 ( 9.405 -0.760 -0.540) 9.452 10.808 ( -5.676 -5.514 1.557) 8.065 10.877 ( 0.544 5.063 -2.275) 5.577 11.165 ( 1.861 2.312 -3.572) 4.645 11.407 ( 12.118 -2.007 8.253) 14.798 11.538 ( 7.528 0.813 2.184) 7.880 11.549 ( 6.886 3.130 -2.610) 8.002 11.880 ( 2.265 -8.105 7.061) 10.985 12.203 ( -1.422 4.259 1.075) 4.617 12.710 ( -13.157 6.543 3.008) 14.999 13.656 ( -9.363 -2.631 -10.767) 14.509 14.870 ( -15.154 0.186 1.293) 15.210 15.939 ( -1.758 -0.898 8.776) 8.995 16.506 ( 12.285 8.624 -0.690) 15.026 16.912 ( 17.625 -7.280 0.180) 19.070 ======================= Grid point 237 (110/282) ======================= q-point: (-0.40 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.879 ( -15.488 25.848 -5.282) 30.593 2.265 ( -16.992 26.442 13.038) 34.028 3.070 ( -2.807 -2.019 0.954) 3.587 3.181 ( -3.678 -5.431 8.767) 10.950 3.263 ( -6.805 -1.227 5.934) 9.112 3.616 ( -5.880 17.990 14.568) 23.883 3.793 ( -7.143 -10.838 1.400) 13.055 4.101 ( -13.904 17.967 10.379) 24.977 4.653 ( -0.077 -8.641 1.953) 8.859 4.867 ( 7.749 -2.571 -8.284) 11.631 5.231 ( -3.468 -1.741 -9.795) 10.536 5.501 ( -3.908 -6.789 3.117) 8.431 5.594 ( -2.710 -2.604 -5.747) 6.867 5.936 ( -2.447 14.897 -3.102) 15.412 6.136 ( -2.221 5.946 -10.353) 12.144 6.680 ( -0.154 1.671 -6.491) 6.705 6.721 ( 0.671 4.939 -6.898) 8.510 7.018 ( -0.417 -24.491 6.424) 25.322 7.193 ( -5.766 4.399 2.543) 7.685 7.255 ( 7.731 -2.480 8.537) 11.781 7.597 ( -3.025 -3.840 0.414) 4.906 7.714 ( 4.564 -10.026 3.953) 11.704 7.996 ( -9.236 -4.296 -0.553) 10.201 8.135 ( -8.424 -4.933 2.652) 10.115 8.209 ( -1.099 -4.362 3.218) 5.531 8.588 ( 12.679 0.742 -8.125) 15.078 8.911 ( 7.113 7.593 -8.548) 13.466 9.113 ( -1.849 7.548 -2.071) 8.042 9.573 ( 1.971 -1.923 -10.996) 11.335 9.637 ( -3.310 0.165 1.362) 3.583 9.872 ( 1.996 -1.979 -1.331) 3.110 10.265 ( 4.489 1.708 2.107) 5.245 10.495 ( 14.122 -0.644 -8.414) 16.451 10.567 ( 7.882 -0.558 -3.829) 8.780 10.774 ( -2.346 3.751 5.464) 7.031 10.845 ( -0.355 -7.572 -5.571) 9.407 11.144 ( 1.398 5.560 0.745) 5.782 11.470 ( -1.891 6.100 -5.403) 8.365 11.602 ( 8.195 3.679 -0.963) 9.034 11.829 ( 13.883 -5.612 8.633) 17.285 12.015 ( -0.615 -5.992 5.066) 7.870 12.161 ( -0.599 2.466 0.471) 2.581 12.537 ( -9.589 4.814 7.696) 13.204 13.460 ( -5.931 -3.063 -8.690) 10.958 14.690 ( -12.152 0.776 5.493) 13.359 15.976 ( -3.886 -2.080 5.781) 7.270 16.565 ( 6.268 9.258 -1.526) 11.283 17.160 ( 12.836 -1.321 -7.003) 14.682 ======================= Grid point 238 (111/282) ======================= q-point: (-0.30 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.519 ( -4.429 25.466 8.236) 27.129 1.990 ( -12.447 26.707 19.893) 35.552 3.093 ( 1.174 0.529 4.599) 4.776 3.209 ( -5.926 2.558 7.199) 9.669 3.335 ( -0.432 -4.417 14.769) 15.421 3.414 ( -14.503 33.412 24.168) 43.712 3.775 ( -2.808 0.272 5.046) 5.781 3.971 ( -7.236 -4.045 3.847) 9.139 4.736 ( 0.891 -9.121 -3.302) 9.741 4.867 ( 5.306 5.845 -10.313) 12.987 5.089 ( -1.062 -3.566 -12.051) 12.612 5.514 ( -4.362 -4.851 -4.834) 8.119 5.555 ( -2.178 -10.736 -0.683) 10.976 5.783 ( -1.341 5.805 -4.061) 7.211 5.984 ( 1.891 7.743 -9.651) 12.517 6.499 ( -0.566 6.992 -12.027) 13.923 6.667 ( -0.601 3.660 -6.423) 7.417 7.069 ( -3.663 7.475 -1.370) 8.436 7.329 ( 0.778 -28.366 11.689) 30.690 7.465 ( 5.067 -4.164 8.792) 10.968 7.621 ( -1.148 -7.142 2.629) 7.697 7.810 ( -0.862 -4.592 -0.195) 4.677 8.017 ( 1.517 -8.920 3.606) 9.740 8.060 ( -6.646 -5.780 1.374) 8.914 8.304 ( 1.012 -6.362 2.485) 6.904 8.652 ( 5.119 1.714 -4.175) 6.824 8.903 ( 7.993 7.018 -6.004) 12.214 9.007 ( 0.016 8.715 -4.641) 9.874 9.518 ( -2.060 -4.836 -5.384) 7.525 9.568 ( 0.372 3.682 -5.173) 6.360 9.861 ( -2.032 -0.815 -3.032) 3.740 10.296 ( -0.206 0.846 1.344) 1.601 10.597 ( 11.621 4.101 -9.355) 15.472 10.630 ( -0.799 -1.060 -5.238) 5.404 10.683 ( 3.883 4.412 -8.394) 10.247 10.912 ( -0.126 -8.849 0.791) 8.885 11.136 ( -0.510 6.950 3.174) 7.657 11.324 ( -3.410 1.623 -7.236) 8.162 11.664 ( 6.203 0.878 -1.217) 6.382 12.013 ( -6.607 -0.721 3.085) 7.327 12.111 ( 8.245 -4.732 3.902) 10.276 12.186 ( 2.065 -1.289 1.609) 2.918 12.495 ( -6.874 2.154 11.707) 13.746 13.375 ( 2.102 -1.191 -4.995) 5.549 14.605 ( -7.070 1.553 8.968) 11.525 15.976 ( -4.581 -3.368 3.700) 6.784 16.536 ( 2.321 9.431 -2.756) 10.096 17.129 ( 1.479 8.972 -16.398) 18.750 ======================= Grid point 239 (112/282) ======================= q-point: (-0.20 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.571 ( 7.429 13.497 24.433) 28.885 1.916 ( -0.261 22.364 25.682) 34.056 3.052 ( -4.862 35.267 21.718) 41.703 3.229 ( 2.245 -0.899 6.934) 7.343 3.318 ( -3.574 6.762 16.755) 18.418 3.527 ( 1.504 -3.302 11.203) 11.775 3.816 ( -0.733 0.497 10.988) 11.023 3.962 ( -3.450 -9.375 -0.176) 9.991 4.711 ( -1.023 -1.696 -10.766) 10.947 4.730 ( 1.812 7.427 -14.456) 16.353 5.069 ( 5.467 -1.913 -7.265) 9.291 5.419 ( -4.850 -5.002 -6.827) 9.754 5.576 ( -0.876 -9.480 -6.119) 11.318 5.740 ( 0.362 -4.244 -3.434) 5.471 5.896 ( 2.774 3.789 -5.777) 7.445 6.360 ( 3.766 5.957 -10.350) 12.522 6.515 ( -5.122 6.599 -6.422) 10.537 6.973 ( 2.834 6.180 -5.791) 8.931 7.609 ( 0.808 -9.223 7.222) 11.742 7.661 ( -1.685 -18.079 6.951) 19.443 7.716 ( 1.992 -10.265 4.979) 11.581 7.826 ( -0.272 -4.767 0.453) 4.796 8.063 ( -0.884 -6.298 0.959) 6.432 8.148 ( 2.446 -6.847 1.796) 7.490 8.352 ( -1.107 -4.538 -1.524) 4.913 8.637 ( -1.191 4.004 -0.830) 4.259 8.887 ( -0.898 7.454 -5.442) 9.273 8.921 ( 5.851 5.169 -1.800) 8.012 9.457 ( -4.229 -2.608 -2.043) 5.372 9.558 ( 6.759 0.988 -4.120) 7.977 9.763 ( -6.884 2.666 -1.460) 7.525 10.305 ( 0.818 -0.908 -0.431) 1.296 10.399 ( -7.649 8.714 -8.456) 14.351 10.607 ( 6.281 5.284 -8.749) 11.997 10.749 ( 5.714 -0.192 -2.107) 6.093 10.960 ( 0.526 -8.466 -4.671) 9.684 11.023 ( -9.497 5.293 1.697) 11.004 11.208 ( -2.604 -1.817 -7.819) 8.440 11.799 ( 8.311 -6.619 -2.787) 10.985 11.886 ( -8.707 3.782 -2.237) 9.753 12.218 ( -4.687 -2.015 7.341) 8.940 12.279 ( 6.785 -2.983 1.672) 7.598 12.460 ( -10.848 1.655 10.846) 15.429 13.452 ( 11.303 1.306 -1.033) 11.425 14.627 ( -1.194 1.668 10.419) 10.619 15.968 ( -2.658 -3.213 0.525) 4.203 16.442 ( -0.207 9.668 -5.289) 11.022 16.806 ( -6.306 17.568 -14.724) 23.774 ======================= Grid point 240 (113/282) ======================= q-point: (-0.10 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.868 ( 3.151 3.550 29.297) 29.679 2.168 ( 14.025 14.317 28.166) 34.569 3.035 ( 7.706 29.867 24.679) 39.503 3.278 ( -5.295 -1.946 7.729) 9.569 3.501 ( 9.866 3.489 9.976) 14.457 3.617 ( 0.683 -0.273 7.567) 7.602 3.915 ( -3.338 -10.427 -0.184) 10.950 4.071 ( 5.923 0.770 16.758) 17.791 4.522 ( 1.590 5.712 -19.661) 20.535 4.608 ( 0.637 1.421 -9.872) 9.994 5.044 ( 3.651 6.575 -9.944) 12.468 5.322 ( -2.899 -4.427 -9.675) 11.027 5.552 ( -1.812 -8.677 -8.512) 12.290 5.778 ( 2.791 -7.102 -2.307) 7.972 5.916 ( 3.774 -6.182 -1.781) 7.459 6.290 ( -0.413 7.396 -6.681) 9.975 6.366 ( 6.294 6.665 -5.537) 10.709 6.937 ( 6.352 5.478 -7.285) 11.110 7.687 ( -2.378 -4.946 1.391) 5.661 7.767 ( -1.752 -7.273 3.404) 8.219 7.799 ( -2.826 -8.524 -2.226) 9.252 7.955 ( 0.551 -12.203 5.153) 13.258 8.128 ( 1.639 -5.193 0.144) 5.447 8.193 ( -0.255 -1.611 -3.223) 3.612 8.327 ( -1.255 -3.977 -3.873) 5.691 8.535 ( -5.137 5.558 -1.980) 7.823 8.792 ( -2.086 2.761 0.842) 3.561 8.973 ( 2.918 3.324 4.938) 6.629 9.416 ( -2.250 -1.709 0.956) 2.983 9.605 ( -10.009 5.359 8.169) 13.987 9.654 ( 9.494 2.307 -4.512) 10.762 10.142 ( -7.813 9.301 -5.004) 13.137 10.324 ( 1.730 0.705 -1.392) 2.329 10.560 ( 0.899 1.382 -4.944) 5.212 10.749 ( -5.076 1.315 -0.639) 5.282 10.912 ( -0.316 0.383 0.339) 0.601 10.953 ( -2.845 -7.556 -6.329) 10.259 11.153 ( 5.591 -0.583 -9.340) 10.901 11.614 ( -14.562 5.098 -4.597) 16.099 11.918 ( 2.103 -8.120 -5.486) 10.022 12.206 ( -5.026 1.025 2.182) 5.575 12.319 ( -9.446 0.380 7.484) 12.057 12.505 ( 5.787 -2.874 10.447) 12.284 13.638 ( 14.388 2.866 0.610) 14.683 14.737 ( 3.531 0.945 10.072) 10.715 15.941 ( 1.090 -0.067 -6.991) 7.075 16.277 ( -3.087 8.348 -7.592) 11.698 16.507 ( -5.215 12.842 -3.340) 14.257 ======================= Grid point 244 (114/282) ======================= q-point: ( 0.30 -0.70 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.840 ( -7.344 0.000 -1.204) 7.442 3.097 ( -4.856 0.000 2.306) 5.375 3.275 ( -7.799 0.000 -7.461) 10.793 3.305 ( -14.363 0.000 12.356) 18.946 3.430 ( -7.291 0.000 -12.063) 14.095 3.448 ( -9.921 0.000 15.322) 18.254 3.700 ( 1.372 -0.000 -6.034) 6.188 4.043 ( 4.859 -0.000 2.217) 5.341 4.579 ( -2.079 0.000 7.764) 8.037 4.661 ( 7.952 -0.000 -7.401) 10.863 5.539 ( 8.420 -0.000 6.061) 10.375 5.728 ( -6.476 0.000 12.276) 13.880 5.806 ( -2.227 0.000 -11.665) 11.876 6.159 ( -7.553 0.000 1.254) 7.656 6.558 ( 3.964 -0.000 -7.934) 8.869 6.685 ( -2.603 0.000 -12.001) 12.280 6.751 ( 4.275 -0.000 9.438) 10.361 6.833 ( -2.354 0.000 2.010) 3.095 6.934 ( -0.075 0.000 -1.973) 1.974 7.078 ( -1.510 0.000 -0.797) 1.707 7.495 ( 7.684 -0.000 3.580) 8.477 7.504 ( -5.209 0.000 -1.811) 5.515 8.179 ( 19.604 -0.000 -7.362) 20.941 8.199 ( -8.799 0.000 4.618) 9.938 8.472 ( -16.288 0.000 3.715) 16.706 8.626 ( -19.372 0.000 -5.741) 20.205 9.123 ( 8.865 -0.000 -12.271) 15.138 9.245 ( -8.008 0.000 20.586) 22.089 9.500 ( 13.020 -0.000 -3.778) 13.557 9.620 ( -2.331 0.000 -0.790) 2.461 9.782 ( 3.772 -0.000 -8.287) 9.105 9.954 ( 2.444 -0.000 3.553) 4.313 10.177 ( 12.103 -0.000 3.748) 12.670 10.420 ( 8.590 -0.000 -8.171) 11.855 10.614 ( 6.566 -0.000 6.528) 9.259 10.934 ( 2.542 -0.000 3.081) 3.995 11.195 ( 8.807 -0.000 -13.963) 16.509 11.278 ( -5.621 0.000 -0.179) 5.624 11.456 ( 7.133 -0.000 -1.690) 7.331 11.476 ( 2.843 -0.000 10.312) 10.697 11.652 ( 1.365 -0.000 5.528) 5.694 12.258 ( -0.045 0.000 1.413) 1.414 12.979 ( -11.836 0.000 2.320) 12.061 13.872 ( -8.394 0.000 -10.600) 13.521 15.118 ( -15.669 0.000 -2.807) 15.919 15.832 ( 0.719 -0.000 12.880) 12.900 16.409 ( 24.487 -0.000 -0.702) 24.497 16.483 ( 10.925 -0.000 1.137) 10.984 ======================= Grid point 246 (115/282) ======================= q-point: (-0.60 0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.648 ( -9.299 12.815 -5.723) 16.836 2.936 ( -12.666 13.814 5.630) 19.569 3.045 ( -11.576 0.307 -2.275) 11.802 3.179 ( -2.960 -0.609 -8.709) 9.219 3.252 ( -10.095 -9.275 0.554) 13.720 3.513 ( -9.866 -9.497 16.240) 21.243 3.743 ( 4.102 5.047 4.946) 8.171 4.184 ( 4.672 -6.961 3.469) 9.073 4.655 ( -1.962 -0.024 11.329) 11.498 4.723 ( 8.323 -1.545 -6.574) 10.718 5.537 ( -10.146 3.900 -10.471) 15.093 5.619 ( -6.617 9.643 5.419) 12.889 5.662 ( -3.992 7.706 2.509) 9.034 6.135 ( -5.569 -16.444 3.395) 17.691 6.409 ( -5.162 7.909 -13.025) 16.088 6.521 ( -1.322 -0.737 -7.462) 7.614 6.817 ( 2.813 6.362 3.219) 7.665 6.927 ( 1.172 -0.423 -5.668) 5.803 6.989 ( 7.313 -4.439 1.970) 8.779 7.158 ( 3.171 -10.944 6.429) 13.083 7.404 ( -4.970 -0.301 1.615) 5.234 7.609 ( -0.086 0.194 5.048) 5.052 8.124 ( -4.154 1.350 3.121) 5.368 8.227 ( -16.896 1.694 -3.959) 17.436 8.270 ( -16.172 -3.161 0.266) 16.480 8.431 ( 17.406 -0.621 -8.185) 19.244 9.071 ( 4.713 3.403 -13.959) 15.121 9.250 ( -7.103 0.427 7.510) 10.346 9.603 ( 4.001 -0.214 -5.023) 6.425 9.662 ( 9.125 5.662 -3.447) 11.279 9.794 ( 3.804 -2.368 -0.044) 4.481 10.042 ( 4.339 -7.305 -1.537) 8.635 10.380 ( 11.075 0.420 0.529) 11.096 10.501 ( 12.766 6.770 -4.108) 15.023 10.722 ( -2.750 -5.257 2.782) 6.553 10.941 ( -3.135 2.149 1.413) 4.055 11.191 ( 6.845 2.223 -7.558) 10.436 11.336 ( 7.953 -5.384 4.563) 10.634 11.579 ( 7.124 2.858 2.065) 7.948 11.596 ( 7.119 2.879 3.047) 8.262 11.768 ( 3.000 -5.763 6.434) 9.143 12.258 ( -0.829 2.141 1.117) 2.553 12.797 ( -13.174 3.719 3.690) 14.177 13.614 ( -11.509 -1.988 -10.752) 15.875 14.876 ( -13.876 0.361 0.057) 13.881 15.927 ( -2.957 -0.483 9.922) 10.365 16.620 ( 10.576 5.566 -0.344) 11.956 16.810 ( 22.328 -5.274 0.198) 22.943 ======================= Grid point 247 (116/282) ======================= q-point: (-0.50 0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.273 ( -9.964 25.111 -6.619) 27.815 2.653 ( -13.445 23.538 9.163) 28.614 2.962 ( -6.339 -12.770 0.465) 14.265 3.122 ( 1.087 -1.415 -0.860) 1.981 3.204 ( -8.307 -7.770 4.103) 12.092 3.586 ( -9.940 -11.035 13.029) 19.757 3.808 ( 2.311 8.960 8.535) 12.588 4.311 ( 2.209 -1.201 3.198) 4.068 4.652 ( -8.903 10.811 12.368) 18.685 4.820 ( 8.837 -3.119 -5.250) 10.741 5.249 ( -8.136 4.150 -9.534) 13.203 5.463 ( -7.305 5.498 5.915) 10.889 5.583 ( -3.589 0.322 -6.523) 7.452 6.149 ( -3.690 8.675 -12.305) 15.501 6.206 ( 1.205 -2.395 -3.761) 4.619 6.497 ( -4.315 -16.232 2.490) 16.979 6.803 ( -1.193 4.491 -5.692) 7.348 6.839 ( 1.755 1.557 -7.268) 7.637 7.147 ( 5.324 -5.106 0.350) 7.385 7.295 ( -0.493 1.720 9.339) 9.509 7.488 ( 2.716 -12.109 4.779) 13.298 7.600 ( -5.034 -1.544 5.433) 7.566 7.954 ( -11.723 -1.292 -2.005) 11.963 8.072 ( -11.828 -3.415 2.593) 12.581 8.151 ( -0.962 -2.670 2.408) 3.722 8.594 ( 12.981 0.198 -7.952) 15.224 8.997 ( 6.294 3.401 -11.233) 13.317 9.195 ( -3.373 3.275 0.865) 4.780 9.594 ( 6.262 2.894 -12.067) 13.899 9.662 ( -1.212 4.923 3.050) 5.916 9.857 ( 4.067 -0.753 -4.475) 6.094 10.162 ( 3.853 -13.313 -4.463) 14.560 10.493 ( 7.046 0.016 -6.507) 9.591 10.599 ( 10.427 5.265 -2.522) 11.950 10.743 ( 1.556 -3.249 -0.224) 3.609 10.871 ( -3.175 4.991 2.136) 6.289 11.219 ( 5.160 3.964 -0.700) 6.544 11.486 ( -2.229 -6.038 -4.200) 7.685 11.631 ( 3.842 4.098 2.482) 6.141 11.791 ( 14.261 -0.952 4.343) 14.938 11.936 ( 5.565 -4.113 5.000) 8.537 12.221 ( -1.555 4.094 0.570) 4.416 12.624 ( -11.428 6.229 8.248) 15.409 13.391 ( -8.249 -5.227 -7.598) 12.373 14.706 ( -10.511 1.101 4.664) 11.551 15.952 ( -5.055 -1.125 6.824) 8.567 16.686 ( 5.571 6.135 -1.930) 8.509 17.128 ( 16.609 -2.298 -4.142) 17.271 ======================= Grid point 248 (117/282) ======================= q-point: (-0.40 0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.926 ( -2.925 27.417 0.757) 27.583 2.393 ( -10.196 25.401 14.185) 30.828 3.017 ( -0.754 -12.015 1.638) 12.150 3.161 ( -3.483 -4.888 2.636) 6.555 3.257 ( 2.769 -3.974 10.492) 11.556 3.630 ( -11.325 -10.103 12.192) 19.467 3.832 ( 1.054 13.754 8.878) 16.404 4.258 ( -8.516 29.489 17.583) 35.373 4.584 ( -2.737 -6.054 0.814) 6.694 4.907 ( 7.902 -0.619 -6.681) 10.366 5.052 ( -3.655 -1.069 -11.457) 12.073 5.419 ( -3.591 -4.363 -2.602) 6.221 5.458 ( -4.676 -2.293 -2.879) 5.951 5.933 ( -0.559 10.022 -10.306) 14.386 6.129 ( 4.305 10.728 -10.396) 15.547 6.551 ( -4.016 -4.525 -7.454) 9.600 6.692 ( -1.543 -0.094 -5.147) 5.374 6.900 ( 0.404 -22.226 5.889) 22.996 7.157 ( -1.148 4.042 -3.075) 5.207 7.424 ( 4.290 -1.949 9.064) 10.215 7.542 ( -3.380 -2.474 5.532) 6.939 7.718 ( 1.079 -9.182 3.747) 9.975 7.877 ( -2.352 -7.314 2.042) 7.950 7.975 ( -7.286 -5.291 2.285) 9.290 8.209 ( -0.332 -5.321 3.179) 6.207 8.673 ( 6.640 1.034 -4.304) 7.980 8.986 ( 7.686 3.594 -8.742) 12.182 9.112 ( -2.004 4.933 -3.629) 6.444 9.515 ( -0.705 4.794 -5.479) 7.314 9.630 ( 3.137 4.219 -4.762) 7.094 9.854 ( 1.108 -0.378 -4.737) 4.879 10.236 ( -0.207 -11.433 -5.700) 12.777 10.508 ( 2.276 -6.319 -7.953) 10.410 10.662 ( 7.248 3.077 -7.828) 11.103 10.750 ( 2.375 2.583 -4.041) 5.352 10.870 ( 2.661 3.123 2.855) 4.999 11.254 ( 1.539 7.513 3.291) 8.345 11.356 ( -4.816 -0.451 -10.868) 11.896 11.644 ( -1.237 -1.655 0.530) 2.133 12.008 ( 0.703 -3.343 -0.358) 3.435 12.071 ( 9.322 1.264 4.573) 10.460 12.196 ( 1.133 2.986 2.278) 3.923 12.534 ( -9.682 3.466 12.743) 16.375 13.325 ( 0.997 -5.226 -2.353) 5.817 14.637 ( -5.527 2.365 8.688) 10.565 15.938 ( -5.103 -1.811 4.659) 7.144 16.665 ( 2.007 7.071 -3.412) 8.104 17.222 ( 5.463 3.666 -11.269) 13.048 ======================= Grid point 249 (118/282) ======================= q-point: (-0.30 0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.833 ( 5.381 20.268 13.260) 24.810 2.275 ( -0.653 23.898 19.492) 30.846 3.119 ( 0.013 -10.796 -2.393) 11.058 3.207 ( 2.405 -3.134 7.737) 8.688 3.483 ( 6.735 -1.811 12.162) 14.019 3.624 ( -14.129 -0.960 17.313) 22.367 3.827 ( 3.142 15.325 8.269) 17.695 4.086 ( -7.138 28.155 22.498) 36.740 4.609 ( -0.393 -9.914 -7.262) 12.296 4.832 ( -0.629 5.187 -14.488) 15.402 5.027 ( 8.811 -4.118 -6.875) 11.910 5.333 ( -3.779 -6.229 -7.932) 10.770 5.434 ( -4.627 -6.855 -0.077) 8.271 5.783 ( 2.120 8.489 -8.119) 11.937 6.007 ( 3.937 9.779 -10.537) 14.904 6.426 ( 1.374 2.292 -10.433) 10.770 6.580 ( -3.341 2.229 -7.718) 8.701 7.069 ( 2.450 6.420 -6.542) 9.488 7.225 ( -0.384 -30.906 12.591) 33.375 7.568 ( 0.192 -1.536 7.695) 7.849 7.603 ( 0.675 -5.876 5.296) 7.939 7.775 ( -0.152 -2.715 1.240) 2.989 7.960 ( 0.479 -7.554 0.289) 7.574 8.011 ( 0.234 -10.171 3.947) 10.912 8.262 ( -2.415 -6.414 1.810) 7.088 8.700 ( 1.784 4.000 -0.366) 4.395 8.967 ( -1.044 3.916 -5.860) 7.125 9.004 ( 3.313 4.142 -6.643) 8.500 9.423 ( -2.982 0.651 -1.890) 3.590 9.623 ( 7.711 5.613 -4.825) 10.688 9.801 ( -2.449 2.030 -2.657) 4.145 10.235 ( -2.536 -10.163 -6.822) 12.500 10.465 ( -5.100 -1.013 -3.438) 6.233 10.645 ( 6.637 0.059 -11.418) 13.207 10.740 ( 7.255 4.227 -9.773) 12.885 10.902 ( 0.263 0.206 2.411) 2.434 11.149 ( -8.947 8.688 0.601) 12.486 11.200 ( -0.695 -0.209 -11.365) 11.388 11.699 ( 2.990 -5.228 1.254) 6.152 11.927 ( -7.502 0.764 -4.057) 8.563 12.220 ( 2.807 0.761 4.915) 5.711 12.235 ( 2.129 -1.141 3.242) 4.043 12.483 ( -11.802 1.785 13.037) 17.676 13.447 ( 10.786 -2.113 1.646) 11.114 14.667 ( -0.171 3.460 10.327) 10.893 15.927 ( -2.979 -2.217 2.707) 4.595 16.579 ( -0.217 7.909 -5.423) 9.593 17.029 ( -4.981 11.494 -14.231) 18.958 ======================= Grid point 250 (119/282) ======================= q-point: (-0.20 0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.973 ( 3.432 10.143 21.781) 24.271 2.423 ( 12.798 18.531 23.410) 32.485 3.147 ( -0.498 -7.505 -2.474) 7.918 3.392 ( 4.388 -0.026 8.784) 9.819 3.590 ( -2.813 4.019 16.155) 16.884 3.654 ( -0.183 4.371 9.054) 10.055 3.868 ( 3.142 13.949 11.229) 18.181 4.139 ( 4.532 10.562 24.589) 27.143 4.542 ( -0.849 -3.984 -16.336) 16.836 4.646 ( 1.308 4.401 -14.470) 15.181 5.126 ( 8.326 1.081 -5.936) 10.282 5.253 ( -1.608 -4.201 -7.465) 8.715 5.401 ( -4.796 -8.710 -4.290) 10.829 5.717 ( 3.777 1.117 -6.293) 7.424 5.910 ( 2.392 4.158 -6.941) 8.438 6.369 ( 3.245 3.233 -8.044) 9.257 6.453 ( 2.838 4.693 -6.405) 8.432 7.020 ( 7.063 5.130 -9.311) 12.763 7.530 ( -3.148 -24.102 8.898) 25.885 7.627 ( -2.335 -3.222 5.172) 6.525 7.694 ( -0.909 -4.489 3.338) 5.668 7.822 ( 1.048 -4.304 2.083) 4.895 8.044 ( 3.857 -5.348 0.307) 6.601 8.113 ( 0.424 -8.938 -0.782) 8.982 8.253 ( -4.760 -5.406 -1.737) 7.409 8.632 ( -3.439 6.870 -2.746) 8.158 8.829 ( -4.785 2.147 -2.938) 6.012 9.017 ( 3.611 2.002 0.804) 4.207 9.389 ( -1.399 -1.120 1.054) 2.079 9.668 ( -0.481 3.723 3.366) 5.042 9.732 ( 5.962 6.248 -2.994) 9.141 10.165 ( -6.692 -7.480 -6.818) 12.134 10.370 ( -0.663 5.418 -0.772) 5.513 10.620 ( 5.061 3.035 -11.621) 13.034 10.682 ( -2.714 -3.957 -10.277) 11.342 10.940 ( 0.756 1.903 1.473) 2.523 10.951 ( -5.870 6.392 3.334) 9.297 11.129 ( 5.239 -2.806 -13.338) 14.603 11.676 ( -12.920 2.776 -3.566) 13.687 11.803 ( -0.133 -6.256 -2.717) 6.821 12.222 ( -6.148 0.904 3.271) 7.023 12.314 ( -2.928 -1.340 4.478) 5.515 12.472 ( -1.043 -0.640 13.170) 13.226 13.672 ( 14.382 1.189 2.618) 14.666 14.770 ( 3.909 3.448 9.889) 11.178 15.926 ( -0.921 -1.589 -0.949) 2.067 16.421 ( -2.767 9.272 -9.552) 13.596 16.710 ( -7.482 13.095 -7.453) 16.822 ======================= Grid point 251 (120/282) ======================= q-point: (-0.10 0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.193 ( 2.430 2.498 24.347) 24.595 2.725 ( 9.434 14.346 23.031) 28.727 3.188 ( -1.108 -5.161 2.769) 5.961 3.456 ( -2.471 -2.503 6.891) 7.737 3.643 ( 0.078 6.805 2.083) 7.117 3.858 ( 11.306 -4.181 14.723) 19.028 3.927 ( 6.750 15.967 11.011) 20.536 4.342 ( 2.128 -0.252 -19.244) 19.363 4.406 ( 2.399 10.346 6.848) 12.637 4.591 ( 8.334 -2.936 4.323) 9.836 5.090 ( 3.874 10.030 -11.784) 15.952 5.198 ( 1.793 3.505 -5.803) 7.012 5.350 ( -3.427 -10.467 -6.411) 12.744 5.775 ( 6.417 -7.563 -3.408) 10.488 5.904 ( 2.385 -4.432 -1.770) 5.335 6.295 ( 3.631 6.185 -5.031) 8.760 6.516 ( 13.635 2.934 -5.053) 14.834 7.020 ( 9.946 4.642 -9.720) 14.662 7.582 ( -8.735 -5.690 -0.389) 10.433 7.635 ( -8.386 -5.391 1.320) 10.056 7.723 ( -3.604 -2.361 2.694) 5.081 7.898 ( -1.897 -12.633 1.357) 12.847 8.109 ( -1.174 -2.507 -3.201) 4.232 8.174 ( 5.693 -1.523 -2.202) 6.291 8.229 ( 1.058 -9.256 -0.980) 9.367 8.460 ( -6.191 5.408 -5.172) 9.712 8.783 ( -4.106 -2.050 7.561) 8.844 9.073 ( -0.449 1.380 6.396) 6.559 9.418 ( 1.870 -0.081 3.462) 3.935 9.614 ( -5.705 5.698 8.581) 11.775 9.830 ( 10.591 4.795 -0.997) 11.669 10.049 ( -5.515 1.125 -1.531) 5.833 10.336 ( 1.275 1.424 -2.864) 3.444 10.461 ( -9.126 2.897 -6.754) 11.717 10.591 ( 1.267 -1.661 -9.278) 9.510 10.874 ( -0.897 -0.733 -1.075) 1.580 11.003 ( 3.010 1.790 -0.145) 3.504 11.121 ( 5.826 -2.344 -9.441) 11.339 11.414 ( -7.334 3.509 -8.059) 11.447 11.803 ( -4.831 -5.155 0.445) 7.079 12.087 ( -12.803 0.664 2.171) 13.003 12.300 ( -3.651 1.198 4.411) 5.850 12.669 ( 6.060 -5.685 9.903) 12.927 13.886 ( 12.979 3.568 1.573) 13.552 14.923 ( 6.870 2.065 9.244) 11.701 15.890 ( -0.200 0.251 -5.631) 5.640 16.188 ( -5.179 7.825 -10.117) 13.799 16.495 ( -4.840 9.996 -0.942) 11.146 ======================= Grid point 256 (121/282) ======================= q-point: ( 0.40 -0.60 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.566 ( -4.061 0.000 -5.996) 7.242 2.741 ( -12.640 0.000 -0.914) 12.673 2.963 ( -5.169 0.000 -4.214) 6.669 3.032 ( -13.447 0.000 9.306) 16.354 3.116 ( 1.721 -0.000 -0.845) 1.917 3.504 ( -12.530 0.000 21.298) 24.710 3.887 ( 4.579 -0.000 5.966) 7.521 4.260 ( 3.954 -0.000 2.279) 4.564 4.755 ( -1.557 0.000 11.992) 12.093 4.787 ( 8.209 -0.000 -4.956) 9.589 5.281 ( -10.401 0.000 -9.440) 14.046 5.576 ( -3.785 0.000 -7.594) 8.486 5.672 ( -10.630 0.000 11.459) 15.630 5.970 ( -7.395 0.000 7.279) 10.376 6.204 ( -3.379 0.000 -15.196) 15.567 6.470 ( 3.943 -0.000 -13.108) 13.688 6.851 ( -2.903 0.000 -6.088) 6.745 6.879 ( 0.669 -0.000 -6.838) 6.871 7.096 ( 6.394 -0.000 4.027) 7.556 7.269 ( 4.503 -0.000 10.714) 11.622 7.391 ( -0.522 0.000 5.161) 5.187 7.597 ( -7.091 0.000 5.628) 9.053 7.947 ( -12.647 0.000 -2.843) 12.963 8.041 ( -13.139 0.000 2.606) 13.395 8.132 ( -0.834 0.000 2.552) 2.685 8.596 ( 13.302 -0.000 -8.178) 15.615 9.021 ( 5.722 -0.000 -12.228) 13.500 9.219 ( -4.233 0.000 2.589) 4.962 9.610 ( 7.952 -0.000 -9.704) 12.546 9.787 ( -1.095 0.000 0.566) 1.233 9.811 ( 6.476 -0.000 -3.590) 7.405 10.015 ( 2.995 -0.000 -8.539) 9.049 10.491 ( 5.872 -0.000 -6.295) 8.608 10.686 ( 10.822 0.000 -7.482) 13.156 10.686 ( -0.073 0.000 4.583) 4.584 10.918 ( -2.091 0.000 3.772) 4.312 11.256 ( 7.714 -0.000 -3.315) 8.396 11.410 ( -2.375 0.000 0.445) 2.416 11.684 ( 0.371 -0.000 0.955) 1.024 11.772 ( 11.162 -0.000 4.733) 12.124 11.903 ( 11.005 -0.000 4.049) 11.726 12.255 ( -1.445 0.000 0.519) 1.536 12.685 ( -11.099 0.000 7.927) 13.639 13.341 ( -9.912 0.000 -7.088) 12.186 14.716 ( -9.852 0.000 4.287) 10.745 15.943 ( -5.401 0.000 7.234) 9.027 16.736 ( 4.821 -0.000 -2.249) 5.320 17.107 ( 18.405 -0.000 -2.975) 18.644 ======================= Grid point 258 (122/282) ======================= q-point: (-0.50 0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.334 ( -1.486 25.156 -3.546) 25.448 2.701 ( -7.393 -2.643 6.535) 10.215 2.792 ( -1.557 1.454 -2.192) 3.057 3.035 ( -6.656 -12.275 5.317) 14.941 3.223 ( 6.048 -0.745 9.443) 11.238 3.525 ( -14.415 -3.269 21.639) 26.205 3.985 ( 2.847 6.656 7.184) 10.199 4.337 ( 2.989 -6.248 -1.614) 7.111 4.771 ( -5.837 13.343 12.178) 18.985 4.878 ( 7.191 -2.252 -3.996) 8.529 5.056 ( -6.354 1.058 -8.916) 10.999 5.405 ( -4.870 -0.314 -11.904) 12.865 5.551 ( -5.840 18.356 10.148) 21.773 6.028 ( 0.075 0.647 -12.901) 12.917 6.108 ( -1.255 -21.852 5.892) 22.668 6.381 ( 1.419 0.172 -11.306) 11.396 6.712 ( -2.748 2.044 -9.283) 9.894 6.782 ( -1.709 -0.505 -8.161) 8.354 7.209 ( 3.982 3.246 1.778) 5.436 7.408 ( 1.737 0.831 8.660) 8.872 7.511 ( 1.617 -7.579 7.786) 10.985 7.559 ( -4.420 -3.789 5.792) 8.213 7.820 ( -3.992 -1.243 1.204) 4.351 7.910 ( -7.719 -2.678 1.638) 8.334 8.156 ( -1.405 -1.628 3.758) 4.329 8.682 ( 7.787 0.263 -4.853) 9.180 9.016 ( 7.500 0.745 -10.034) 12.550 9.159 ( -3.833 1.401 -1.884) 4.495 9.629 ( 7.282 6.094 -10.358) 14.051 9.706 ( -0.918 7.756 -0.173) 7.812 9.843 ( 2.312 -1.382 -6.202) 6.762 9.999 ( -0.689 -15.089 -10.059) 18.147 10.469 ( 1.510 -0.629 -6.809) 7.003 10.697 ( 3.977 1.242 -7.532) 8.608 10.773 ( 5.676 0.782 1.401) 5.898 10.941 ( 3.837 4.070 -2.590) 6.164 11.290 ( -8.167 -3.468 -6.378) 10.927 11.355 ( 4.612 2.623 1.654) 5.558 11.642 ( -4.414 0.725 1.253) 4.646 11.952 ( 3.767 -2.554 0.790) 4.620 12.086 ( 9.305 0.296 -0.162) 9.311 12.250 ( 1.089 2.422 2.333) 3.535 12.599 ( -10.801 3.800 11.301) 16.088 13.242 ( -0.084 -4.138 0.821) 4.219 14.666 ( -4.431 1.167 8.502) 9.658 15.919 ( -5.511 -0.649 5.164) 7.580 16.741 ( 1.535 2.641 -3.973) 5.012 17.254 ( 7.583 0.899 -8.158) 11.174 ======================= Grid point 259 (123/282) ======================= q-point: (-0.40 0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.167 ( 3.942 22.795 3.922) 23.463 2.620 ( -0.954 20.403 14.685) 25.156 2.882 ( 2.828 -18.781 -6.611) 20.111 3.120 ( -0.157 -8.523 8.119) 11.772 3.471 ( 9.286 -0.067 14.187) 16.956 3.537 ( -15.824 -4.830 22.052) 27.568 4.015 ( 1.953 10.367 6.029) 12.150 4.418 ( 2.331 -9.661 -3.327) 10.480 4.625 ( -9.080 25.884 15.200) 31.360 4.889 ( -2.342 2.547 -11.242) 11.762 4.961 ( 7.806 -3.575 -5.912) 10.424 5.244 ( -3.542 -5.099 -10.779) 12.440 5.449 ( -2.732 12.495 5.669) 13.990 5.913 ( 4.300 6.294 -11.817) 14.063 6.162 ( 4.691 8.382 -13.945) 16.933 6.372 ( -3.373 -13.522 -1.742) 14.045 6.596 ( -1.210 0.362 -8.032) 8.131 6.790 ( -0.064 -20.256 4.296) 20.707 7.187 ( 2.318 9.687 -3.232) 10.472 7.536 ( 2.607 -2.824 7.781) 8.678 7.565 ( -2.024 0.302 7.618) 7.888 7.691 ( 0.449 -11.133 3.106) 11.567 7.838 ( 1.018 -4.437 1.475) 4.785 7.893 ( -0.643 -5.437 1.701) 5.733 8.181 ( -3.622 -3.715 4.606) 6.938 8.748 ( 4.750 2.117 -0.323) 5.211 9.008 ( 2.107 1.596 -7.660) 8.103 9.043 ( -2.604 1.392 -6.649) 7.275 9.502 ( -2.250 9.492 -3.862) 10.492 9.707 ( 8.168 5.049 -5.462) 11.048 9.815 ( 0.367 -0.429 -4.155) 4.193 10.000 ( -3.983 -18.053 -9.045) 20.581 10.438 ( 1.097 -1.243 -4.907) 5.179 10.667 ( 3.473 1.745 -8.022) 8.914 10.828 ( 6.918 6.062 -8.459) 12.497 10.922 ( 1.006 1.702 0.274) 1.996 11.129 ( -3.420 -5.763 -13.237) 14.837 11.302 ( -7.511 7.575 -0.089) 10.668 11.655 ( 2.340 -0.891 3.847) 4.590 11.914 ( -7.719 -1.786 -3.501) 8.662 12.187 ( 4.301 -2.113 0.049) 4.792 12.276 ( -1.138 2.632 4.435) 5.281 12.526 ( -10.349 3.780 12.800) 16.889 13.397 ( 10.549 -3.700 5.691) 12.544 14.720 ( 0.987 3.029 10.343) 10.822 15.899 ( -3.784 -1.430 3.800) 5.551 16.673 ( -0.705 4.344 -5.546) 7.080 17.158 ( -3.449 5.527 -11.865) 13.536 ======================= Grid point 260 (124/282) ======================= q-point: (-0.30 0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.167 ( 3.466 15.018 12.600) 19.908 2.711 ( 10.545 18.495 18.800) 28.403 2.976 ( 2.121 -14.457 -6.569) 16.020 3.313 ( 2.923 -6.916 9.624) 12.206 3.544 ( -11.819 -5.260 20.512) 24.251 3.726 ( 6.252 5.003 9.860) 12.702 4.062 ( 5.839 7.426 9.522) 13.413 4.437 ( -1.906 -5.923 -9.381) 11.257 4.493 ( -1.554 24.717 18.832) 31.112 4.711 ( 0.494 3.840 -15.230) 15.714 5.071 ( 8.951 -5.883 -5.471) 12.028 5.162 ( -3.665 -7.884 -5.445) 10.258 5.381 ( -0.111 9.063 1.235) 9.147 5.821 ( 5.261 9.711 -9.762) 14.741 6.000 ( 1.047 6.580 -12.729) 14.367 6.388 ( 4.738 -1.393 -6.881) 8.470 6.507 ( 2.174 2.446 -7.535) 8.215 7.070 ( -0.712 -18.068 4.984) 18.756 7.134 ( 3.783 -5.009 -0.680) 6.314 7.605 ( -1.868 0.235 6.350) 6.623 7.654 ( 1.222 -1.528 6.032) 6.341 7.764 ( -0.685 -5.557 0.357) 5.610 7.937 ( 1.773 -11.653 0.051) 11.787 7.978 ( 4.818 -3.729 0.583) 6.120 8.175 ( -5.955 -4.511 1.550) 7.630 8.731 ( -1.832 5.721 -3.705) 7.058 8.858 ( -6.891 1.712 -4.659) 8.492 9.026 ( 2.925 -0.745 -1.709) 3.468 9.407 ( -0.778 4.152 0.959) 4.332 9.724 ( 0.352 3.357 -0.010) 3.376 9.816 ( 7.631 4.334 -2.805) 9.213 9.973 ( -5.129 -15.701 -7.955) 18.333 10.420 ( -0.092 0.233 -1.769) 1.786 10.614 ( 2.740 1.424 -9.452) 9.944 10.733 ( 3.138 5.379 -14.260) 15.561 10.964 ( 2.086 1.183 2.839) 3.716 11.032 ( 2.041 -2.411 -13.211) 13.584 11.109 ( -5.612 5.506 -2.741) 8.326 11.699 ( -11.595 0.430 -2.370) 11.842 11.739 ( -1.413 -2.213 0.057) 2.626 12.228 ( -9.415 -0.089 4.761) 10.550 12.276 ( 1.380 -3.207 3.331) 4.825 12.499 ( -4.308 3.603 11.869) 13.131 13.672 ( 14.502 -0.951 5.808) 15.650 14.835 ( 4.669 4.662 9.725) 11.752 15.897 ( -2.372 -1.960 2.152) 3.755 16.540 ( -3.242 6.082 -8.230) 10.734 16.885 ( -8.604 9.372 -9.680) 15.987 ======================= Grid point 261 (125/282) ======================= q-point: (-0.20 0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.273 ( 1.808 7.779 18.413) 20.070 2.918 ( 4.273 6.934 11.707) 14.261 3.107 ( 10.086 -2.208 5.449) 11.674 3.358 ( -14.190 -6.392 11.256) 19.207 3.739 ( 1.399 1.641 7.620) 7.920 3.804 ( 10.489 0.946 9.792) 14.381 4.186 ( 3.208 11.062 7.936) 13.987 4.330 ( 1.461 -2.002 -17.891) 18.062 4.569 ( 0.830 5.292 -10.146) 11.473 4.586 ( 7.917 9.568 21.753) 25.048 5.149 ( 0.430 -10.192 -4.352) 11.090 5.168 ( 4.396 1.208 -5.809) 7.384 5.338 ( 4.339 8.483 -0.575) 9.546 5.745 ( 4.904 6.485 -7.079) 10.781 5.890 ( 2.100 1.211 -7.297) 7.689 6.379 ( 4.718 4.800 -5.620) 8.768 6.535 ( 11.197 -0.509 -6.569) 12.991 7.071 ( 7.755 2.821 -9.559) 12.628 7.361 ( -5.936 -22.623 7.170) 24.463 7.606 ( -4.728 1.685 5.425) 7.391 7.714 ( -0.926 0.485 4.254) 4.381 7.753 ( -5.372 -6.670 -3.384) 9.209 8.017 ( -3.316 -10.408 -1.659) 11.049 8.101 ( 4.138 -5.452 0.214) 6.848 8.139 ( 5.069 -3.031 -3.245) 6.738 8.549 ( -7.176 5.732 -8.580) 12.568 8.757 ( -5.643 -1.256 5.248) 7.808 9.072 ( -0.265 -1.310 3.717) 3.950 9.432 ( 3.057 1.777 4.311) 5.576 9.686 ( -4.375 3.795 5.189) 7.776 9.868 ( 0.983 -3.073 -2.032) 3.813 9.983 ( 5.044 -3.480 -2.853) 6.760 10.380 ( -1.626 3.295 -1.188) 3.862 10.538 ( -2.143 2.472 -7.566) 8.243 10.607 ( 5.815 4.715 -13.813) 15.711 10.901 ( -5.407 4.915 0.056) 7.307 10.977 ( 2.399 -4.967 -10.558) 11.912 11.112 ( 8.296 1.173 -1.940) 8.600 11.439 ( -10.931 -0.083 -7.843) 13.454 11.756 ( -3.018 -1.282 2.995) 4.441 12.091 ( -13.993 0.026 4.629) 14.738 12.314 ( -2.741 0.214 3.904) 4.775 12.596 ( 3.038 -3.201 9.245) 10.245 13.929 ( 13.003 1.986 3.725) 13.671 14.975 ( 6.673 4.527 8.673) 11.842 15.883 ( -2.728 -1.076 -0.289) 2.947 16.315 ( -6.113 8.050 -11.122) 15.029 16.637 ( -6.105 8.345 -2.900) 10.738 ======================= Grid point 262 (126/282) ======================= q-point: (-0.10 0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.457 ( 1.636 1.124 20.142) 20.239 2.975 ( -2.177 0.107 5.514) 5.929 3.219 ( -17.470 0.818 19.411) 26.128 3.387 ( 6.452 -4.182 1.991) 7.943 3.704 ( 0.813 7.186 -1.504) 7.387 4.085 ( 0.555 0.153 -19.388) 19.396 4.189 ( 13.005 -3.634 14.044) 19.483 4.252 ( 0.973 9.524 2.406) 9.871 4.477 ( 5.701 7.290 -4.999) 10.518 4.883 ( 7.409 0.484 13.550) 15.451 5.050 ( 0.399 10.393 -9.575) 14.138 5.212 ( 2.202 -5.787 -5.969) 8.600 5.402 ( 12.064 11.483 7.719) 18.357 5.772 ( 5.045 -7.234 -3.243) 9.397 5.907 ( 4.898 -3.192 -2.145) 6.227 6.402 ( 10.237 5.042 -3.840) 12.040 6.671 ( 12.131 -2.669 -6.541) 14.038 7.103 ( 10.032 0.838 -9.872) 14.100 7.323 ( -13.636 -6.768 -3.393) 15.596 7.541 ( -6.341 4.402 3.687) 8.555 7.661 ( -6.418 -1.119 -0.426) 6.528 7.757 ( -3.595 -10.496 2.434) 11.359 7.958 ( -8.378 -5.857 -4.420) 11.137 8.216 ( 3.568 -4.265 -0.823) 5.621 8.296 ( 8.456 -4.755 -2.456) 10.007 8.348 ( 1.582 -0.989 -3.800) 4.233 8.789 ( -5.573 -3.404 12.784) 14.355 9.085 ( -5.269 -1.837 4.951) 7.460 9.533 ( 5.806 2.946 3.587) 7.434 9.644 ( -6.599 1.410 7.900) 10.390 9.895 ( -0.779 -6.609 1.427) 6.806 10.055 ( 5.442 5.650 0.160) 7.846 10.321 ( 0.500 1.072 -4.512) 4.665 10.350 ( -6.787 13.388 -1.807) 15.119 10.570 ( 7.446 1.833 -11.224) 13.593 10.828 ( -0.757 -0.576 -6.016) 6.091 10.926 ( -2.242 -4.861 -3.656) 6.483 11.224 ( 6.462 2.743 2.106) 7.329 11.278 ( 4.206 -2.480 -14.341) 15.149 11.728 ( -5.245 -0.323 3.438) 6.280 11.909 ( -15.241 0.628 4.405) 15.877 12.285 ( -3.963 1.509 2.822) 5.094 12.777 ( 4.083 -7.707 6.410) 10.824 14.090 ( 8.139 3.604 0.306) 8.906 15.149 ( 8.635 2.237 9.069) 12.721 15.826 ( -5.350 0.173 0.467) 5.373 16.056 ( -4.021 6.524 -12.699) 14.832 16.507 ( -2.055 8.288 0.836) 8.580 ======================= Grid point 268 (127/282) ======================= q-point: (-0.50 0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.457 ( 2.197 0.000 -1.887) 2.896 2.605 ( 3.753 -0.000 -1.903) 4.208 2.867 ( 1.105 0.000 6.477) 6.570 2.981 ( -1.755 -0.000 11.894) 12.023 3.472 ( 10.305 0.000 15.229) 18.388 3.500 ( -17.325 -0.000 24.407) 29.931 4.130 ( 2.504 0.000 7.778) 8.171 4.295 ( 1.452 -0.000 -6.564) 6.723 4.808 ( -7.422 -0.000 4.383) 8.619 4.909 ( 1.246 -0.000 -10.513) 10.587 4.944 ( 2.752 -0.000 0.165) 2.757 5.198 ( -4.223 -0.000 -13.888) 14.516 5.741 ( -0.614 0.000 12.507) 12.522 5.913 ( 1.404 -0.000 -6.906) 7.047 6.072 ( 2.306 -0.000 5.603) 6.059 6.267 ( 1.185 0.000 -17.460) 17.500 6.599 ( -0.182 -0.000 -9.313) 9.315 6.667 ( -0.963 -0.000 -7.107) 7.172 7.328 ( 3.736 0.000 3.282) 4.973 7.477 ( -0.979 -0.000 2.047) 2.270 7.553 ( 1.627 -0.000 6.719) 6.913 7.574 ( -1.768 -0.000 8.206) 8.394 7.833 ( 3.227 -0.000 2.355) 3.994 7.834 ( -2.011 0.000 0.055) 2.011 8.153 ( -4.312 -0.000 5.678) 7.129 8.764 ( 5.842 0.000 -0.187) 5.845 9.020 ( 4.913 -0.000 -9.457) 10.657 9.053 ( -6.415 0.000 -5.112) 8.203 9.656 ( 1.595 0.000 -7.124) 7.301 9.755 ( -4.655 0.000 -7.366) 8.713 9.764 ( 5.712 -0.000 -2.073) 6.077 9.817 ( 1.276 -0.000 -8.029) 8.129 10.429 ( 1.986 -0.000 -6.210) 6.520 10.681 ( 3.138 -0.000 -6.615) 7.322 10.890 ( 8.310 -0.000 -1.616) 8.466 10.938 ( 2.484 0.000 -10.790) 11.073 11.064 ( -7.513 -0.000 -8.596) 11.417 11.364 ( -7.206 -0.000 -1.027) 7.279 11.652 ( 2.674 -0.000 4.068) 4.868 11.896 ( -7.543 -0.000 -2.675) 8.004 12.170 ( 3.487 -0.000 -0.300) 3.499 12.295 ( -2.801 -0.000 4.012) 4.893 12.565 ( -8.877 0.000 10.466) 13.723 13.363 ( 10.667 -0.000 8.176) 13.440 14.745 ( 1.502 -0.000 10.383) 10.491 15.887 ( -4.177 -0.000 4.124) 5.869 16.707 ( -0.959 -0.000 -5.609) 5.691 17.199 ( -2.822 -0.000 -10.792) 11.155 ======================= Grid point 270 (128/282) ======================= q-point: (-0.40 0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.413 ( 2.827 16.061 4.787) 16.996 2.722 ( 2.464 -16.096 -3.853) 16.734 2.980 ( 10.379 14.728 13.864) 22.734 3.190 ( 5.477 -9.626 10.841) 15.498 3.480 ( -17.404 -2.465 25.675) 31.116 3.785 ( 10.404 2.181 14.243) 17.772 4.171 ( 3.104 7.777 1.629) 8.530 4.303 ( 0.882 -9.196 -6.144) 11.094 4.704 ( -6.020 2.131 1.930) 6.672 4.809 ( 1.103 7.628 -8.036) 11.134 5.001 ( 5.716 -2.051 -4.703) 7.681 5.047 ( -4.306 -6.338 -6.670) 10.158 5.697 ( 2.962 27.950 7.621) 29.122 5.926 ( 7.164 1.516 -9.480) 11.978 6.082 ( -0.350 3.326 -17.067) 17.392 6.274 ( 3.788 -14.847 4.370) 15.934 6.537 ( 2.933 1.968 -7.398) 8.198 6.688 ( 1.135 -16.231 2.157) 16.413 7.292 ( 1.243 15.368 -1.724) 15.514 7.561 ( -0.792 -16.266 0.798) 16.305 7.623 ( 0.180 1.517 6.613) 6.788 7.649 ( 0.276 -2.379 5.606) 6.096 7.837 ( 1.582 -1.933 -0.573) 2.563 7.943 ( 8.155 -1.052 -0.111) 8.223 8.125 ( -7.368 -1.819 4.329) 8.737 8.795 ( -0.578 2.307 -4.530) 5.117 8.878 ( -8.469 0.805 -4.622) 9.681 9.008 ( 2.463 -1.044 -2.738) 3.828 9.520 ( -1.824 10.481 -1.670) 10.769 9.711 ( -5.167 -12.279 -3.347) 13.736 9.784 ( 2.009 -1.185 -4.178) 4.785 9.858 ( 10.009 1.281 -3.232) 10.596 10.406 ( 1.920 -1.013 -5.447) 5.864 10.649 ( 1.755 1.871 -6.996) 7.452 10.813 ( 1.806 4.765 -14.407) 15.281 10.928 ( -0.120 -5.352 -12.034) 13.171 11.001 ( 7.906 0.468 -1.024) 7.986 11.199 ( -8.036 3.693 -3.097) 9.371 11.695 ( -14.231 -0.461 -3.322) 14.621 11.726 ( 0.869 -0.078 3.131) 3.250 12.224 ( -4.732 -0.365 5.315) 7.126 12.235 ( -5.417 -1.510 4.913) 7.468 12.551 ( -3.790 2.279 8.107) 9.235 13.655 ( 14.735 -0.836 8.639) 17.101 14.893 ( 5.389 2.243 9.648) 11.276 15.873 ( -3.349 -0.985 3.563) 4.988 16.602 ( -3.742 2.075 -7.157) 8.339 16.984 ( -8.868 3.354 -10.243) 13.958 ======================= Grid point 271 (129/282) ======================= q-point: (-0.30 0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.422 ( 1.598 11.424 11.608) 16.365 2.827 ( 0.495 -12.735 -1.427) 12.824 3.210 ( 10.297 7.619 12.028) 17.571 3.313 ( -10.983 2.563 19.503) 22.529 3.656 ( 6.188 -8.071 18.442) 21.060 3.920 ( 4.588 9.799 0.582) 10.835 4.236 ( -1.453 -4.508 -15.913) 16.603 4.271 ( 4.932 -2.564 7.349) 9.215 4.647 ( 3.655 5.954 -9.624) 11.892 4.745 ( 1.255 7.463 9.893) 12.455 5.001 ( -0.665 -8.464 -2.276) 8.790 5.103 ( 5.067 -7.037 -1.486) 8.797 5.615 ( 5.727 25.577 3.537) 26.448 5.901 ( 4.972 8.838 -10.912) 14.896 5.920 ( 3.801 3.911 -9.136) 10.640 6.422 ( 8.148 -1.599 -4.047) 9.238 6.516 ( 5.891 0.454 -6.952) 9.124 6.937 ( -1.484 -26.323 9.046) 27.873 7.182 ( 2.162 8.431 -5.308) 10.195 7.622 ( -4.990 -9.458 -1.215) 10.763 7.663 ( -1.763 1.697 4.631) 5.238 7.721 ( 0.936 -0.068 4.267) 4.369 7.857 ( -4.626 -7.681 -2.429) 9.290 8.051 ( 2.129 -1.730 -0.166) 2.748 8.093 ( 7.395 -2.685 -3.448) 8.589 8.622 ( -7.837 3.547 -10.609) 13.658 8.747 ( -6.946 -0.051 4.291) 8.165 9.040 ( -0.678 -2.464 1.669) 3.053 9.475 ( 1.370 4.047 4.007) 5.858 9.691 ( -5.764 -6.524 2.500) 9.057 9.783 ( 0.363 -0.546 -1.335) 1.487 9.999 ( 12.842 2.310 -1.863) 13.180 10.394 ( -0.046 -1.494 -2.323) 2.762 10.567 ( -0.844 2.236 -7.158) 7.547 10.676 ( 5.395 3.909 -16.210) 17.526 10.883 ( 4.082 -6.019 -13.766) 15.570 11.009 ( -5.146 7.184 -2.463) 9.174 11.133 ( 7.958 0.950 0.482) 8.029 11.428 ( -14.537 -0.946 -5.202) 15.469 11.747 ( -2.454 -0.215 3.325) 4.138 12.091 ( -14.480 0.022 6.244) 15.769 12.300 ( -1.240 -1.705 5.811) 6.181 12.579 ( 0.303 0.439 6.037) 6.061 13.947 ( 13.168 0.535 6.014) 14.486 15.046 ( 6.656 4.152 7.867) 11.110 15.862 ( -3.977 -1.414 3.042) 5.202 16.415 ( -7.070 4.675 -9.343) 12.615 16.739 ( -7.467 4.772 -5.218) 10.284 ======================= Grid point 272 (130/282) ======================= q-point: (-0.20 0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.507 ( 0.203 5.216 15.266) 16.134 2.905 ( -1.538 -8.158 2.661) 8.718 3.174 ( -21.060 -4.063 14.859) 26.093 3.467 ( 6.362 11.114 13.130) 18.341 3.815 ( 2.063 6.876 -5.235) 8.885 4.055 ( 1.218 -5.196 -14.156) 15.129 4.093 ( 10.733 -4.925 7.698) 14.097 4.368 ( -1.408 3.125 4.995) 6.058 4.591 ( 7.423 7.503 -6.191) 12.236 4.857 ( 3.198 -2.952 7.675) 8.823 5.108 ( 5.937 -5.039 1.987) 8.037 5.199 ( 4.164 2.624 -2.070) 5.339 5.580 ( 7.245 14.886 6.347) 17.731 5.808 ( 4.072 6.790 -8.506) 11.621 5.904 ( 6.909 6.014 -4.317) 10.126 6.484 ( 9.469 5.906 -3.816) 11.794 6.595 ( 8.665 -6.986 -7.312) 13.317 7.107 ( 4.760 -1.151 -5.528) 7.385 7.143 ( -9.112 -15.805 1.946) 18.347 7.541 ( -6.901 -7.209 -2.771) 10.357 7.630 ( -2.529 5.793 3.129) 7.053 7.724 ( -2.615 -1.237 -0.126) 2.896 7.827 ( -5.764 -8.480 -0.060) 10.254 8.159 ( 8.436 -3.200 -0.529) 9.038 8.231 ( 8.440 -3.977 -3.550) 9.983 8.351 ( -7.438 1.256 -9.933) 12.472 8.747 ( -5.410 -1.957 11.646) 12.990 9.039 ( -5.011 -4.090 1.170) 6.573 9.546 ( 3.213 -0.563 4.024) 5.180 9.683 ( -5.402 2.483 8.365) 10.263 9.803 ( 1.944 -3.106 1.728) 4.051 10.135 ( 9.408 4.174 -1.435) 10.392 10.343 ( -3.816 2.058 -1.928) 4.745 10.498 ( 1.690 2.979 -4.704) 5.819 10.607 ( 7.373 2.530 -13.942) 15.973 10.849 ( -0.376 -3.705 -6.460) 7.456 10.857 ( -2.340 5.081 -4.875) 7.420 11.207 ( -4.492 -4.208 -6.151) 8.702 11.286 ( 10.474 2.983 -2.058) 11.084 11.723 ( -5.099 -0.667 3.096) 6.002 11.917 ( -16.216 0.455 6.331) 17.414 12.314 ( -2.917 1.881 3.954) 5.261 12.676 ( 2.848 -5.144 4.284) 7.274 14.135 ( 7.474 2.208 1.520) 7.940 15.195 ( 7.544 3.448 7.605) 11.254 15.824 ( -6.254 -0.355 3.460) 7.156 16.154 ( -7.374 5.936 -11.218) 14.678 16.609 ( -1.883 5.008 0.408) 5.366 ======================= Grid point 273 (131/282) ======================= q-point: (-0.10 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.625 ( -2.640 -2.291 13.407) 13.856 2.957 ( -4.475 -3.359 8.670) 10.318 3.009 ( -23.232 -5.419 13.160) 27.244 3.512 ( -2.528 5.483 5.727) 8.322 3.711 ( 0.127 3.973 -9.517) 10.314 3.863 ( -0.162 -0.904 -22.236) 22.255 4.300 ( -4.695 10.173 5.105) 12.312 4.467 ( 9.525 -7.307 12.150) 17.080 4.614 ( 6.371 6.374 -3.230) 9.573 5.027 ( 3.520 -1.826 8.499) 9.378 5.092 ( 2.243 9.196 -9.550) 13.446 5.220 ( 4.023 3.153 -0.400) 5.127 5.764 ( 7.318 7.945 4.494) 11.699 5.766 ( 5.377 -2.356 5.281) 7.897 5.958 ( 7.314 -2.037 -3.277) 8.269 6.578 ( 11.377 2.053 -3.842) 12.183 6.704 ( 6.511 -5.693 -3.677) 9.398 7.002 ( -4.883 -4.439 -7.643) 10.098 7.212 ( 4.337 -5.813 -1.578) 7.422 7.515 ( -7.275 -3.841 0.482) 8.241 7.572 ( -0.907 7.426 1.340) 7.601 7.700 ( -0.951 -5.051 -0.577) 5.172 7.729 ( -9.492 -0.387 -3.883) 10.263 8.092 ( -3.708 -4.382 -6.953) 9.016 8.383 ( 12.937 -7.916 -1.058) 15.203 8.453 ( 9.164 -6.248 1.619) 11.209 8.805 ( -5.705 -2.607 12.375) 13.874 8.977 ( -8.758 -5.635 1.010) 10.463 9.589 ( -9.769 0.521 9.924) 13.935 9.667 ( 4.299 5.607 0.511) 7.084 9.926 ( 3.992 -3.443 5.544) 7.651 10.167 ( 1.984 7.351 -0.699) 7.646 10.283 ( 2.105 -1.646 -5.212) 5.857 10.379 ( -4.997 14.525 -0.807) 15.382 10.589 ( 7.804 0.417 -9.151) 12.035 10.769 ( 2.154 2.144 -7.004) 7.635 10.884 ( 3.614 -5.424 1.853) 6.776 11.163 ( 5.337 -5.303 -11.390) 13.651 11.416 ( 9.313 4.457 0.663) 10.345 11.658 ( -9.432 -0.931 0.705) 9.504 11.740 ( -12.329 -0.101 7.694) 14.533 12.274 ( -2.872 3.787 2.069) 5.184 12.799 ( 1.241 -8.411 2.519) 8.867 14.167 ( 0.709 2.234 -3.546) 4.251 15.386 ( 9.131 0.983 8.806) 12.723 15.710 ( -16.419 2.113 6.106) 17.644 15.957 ( 4.423 1.968 -12.692) 13.584 16.593 ( 2.845 7.722 3.469) 8.931 ======================= Grid point 280 (132/282) ======================= q-point: (-0.40 0.60 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.589 ( 1.430 -0.000 9.302) 9.412 2.646 ( 1.211 -0.000 -1.130) 1.657 3.241 ( -10.445 0.000 13.167) 16.807 3.403 ( 14.392 -0.000 14.255) 20.257 3.557 ( 0.337 -0.000 23.957) 23.960 4.040 ( 6.508 -0.000 2.942) 7.142 4.139 ( 1.125 -0.000 -12.629) 12.679 4.262 ( -0.343 0.000 0.254) 0.427 4.706 ( 4.054 -0.000 -1.510) 4.326 4.809 ( 2.698 -0.000 -6.552) 7.086 4.920 ( -1.210 0.000 6.244) 6.360 5.037 ( 3.673 -0.000 -2.672) 4.542 5.887 ( 7.617 -0.000 -10.902) 13.299 5.928 ( 0.373 -0.000 -12.712) 12.718 6.030 ( 6.977 -0.000 2.055) 7.274 6.335 ( 5.176 -0.000 5.555) 7.592 6.590 ( 6.172 -0.000 -0.608) 6.202 6.634 ( 2.287 -0.000 -1.177) 2.572 7.337 ( -5.555 0.000 -6.802) 8.782 7.444 ( 0.703 -0.000 2.890) 2.974 7.704 ( 1.516 -0.000 3.870) 4.156 7.707 ( 0.359 -0.000 6.129) 6.139 7.804 ( -5.879 0.000 -4.464) 7.382 8.040 ( -1.465 0.000 0.283) 1.492 8.069 ( 10.614 -0.000 -3.940) 11.322 8.650 ( -8.022 0.000 -11.499) 14.020 8.749 ( -7.462 0.000 4.286) 8.605 9.017 ( -1.107 0.000 0.729) 1.325 9.541 ( -3.341 0.000 1.969) 3.878 9.590 ( -0.480 0.000 2.807) 2.848 9.797 ( 1.984 -0.000 0.586) 2.068 10.018 ( 12.906 -0.000 -1.917) 13.048 10.374 ( 1.294 -0.000 -4.444) 4.629 10.588 ( -2.946 0.000 -5.971) 6.659 10.717 ( 4.660 -0.000 -17.758) 18.359 10.823 ( 5.183 -0.000 -12.436) 13.473 11.077 ( -3.839 0.000 -5.404) 6.629 11.133 ( 8.303 -0.000 1.198) 8.389 11.420 ( -15.996 0.000 -3.402) 16.353 11.745 ( -2.639 0.000 3.211) 4.156 12.091 ( -14.619 0.000 6.762) 16.107 12.283 ( -0.758 0.000 7.176) 7.216 12.587 ( -0.496 0.000 4.143) 4.173 13.951 ( 13.253 -0.000 7.031) 15.003 15.081 ( 6.741 -0.000 7.426) 10.029 15.849 ( -4.447 0.000 4.313) 6.195 16.451 ( -7.386 0.000 -8.240) 11.066 16.776 ( -8.047 0.000 -6.290) 10.214 ======================= Grid point 282 (133/282) ======================= q-point: (-0.30 0.60 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.606 ( -1.102 7.290 7.784) 10.721 2.765 ( -0.742 -8.942 8.590) 12.422 3.134 ( -20.456 -1.211 15.090) 25.448 3.643 ( 4.321 9.888 11.984) 16.126 3.867 ( 6.551 -2.924 6.708) 9.822 3.977 ( 1.952 -0.169 -10.196) 10.382 4.043 ( 2.213 -2.787 -10.720) 11.296 4.376 ( 3.290 -0.650 10.845) 11.351 4.695 ( 6.423 5.450 -5.236) 9.919 4.805 ( 1.163 -3.531 -2.352) 4.399 5.057 ( 3.381 -1.666 -1.525) 4.066 5.170 ( 10.267 -2.574 14.555) 17.997 5.821 ( 4.220 4.633 -12.097) 13.624 5.860 ( 6.164 8.827 -6.901) 12.788 6.086 ( 4.610 11.466 1.484) 12.447 6.473 ( 6.097 -7.472 -3.234) 10.171 6.596 ( 7.189 9.285 -2.330) 11.972 6.828 ( 1.853 -19.598 6.129) 20.617 7.138 ( -7.085 1.811 -8.138) 10.941 7.485 ( -2.887 -0.821 0.776) 3.101 7.606 ( -8.691 -6.783 -5.755) 12.436 7.727 ( 0.446 3.715 1.862) 4.179 7.774 ( 0.063 -1.401 3.246) 3.536 8.124 ( 9.307 -1.191 -0.569) 9.400 8.182 ( 8.436 -1.900 -4.440) 9.720 8.370 ( -10.982 0.846 -12.068) 16.339 8.730 ( -5.827 -0.376 10.751) 12.235 8.980 ( -4.564 -2.643 -1.027) 5.373 9.551 ( -1.117 1.167 8.041) 8.201 9.657 ( 1.371 -3.312 5.739) 6.767 9.835 ( 2.337 3.682 2.441) 4.998 10.168 ( 9.529 0.311 -4.651) 10.607 10.377 ( -0.330 2.114 1.960) 2.901 10.478 ( -0.433 -2.843 -6.666) 7.260 10.630 ( 5.941 0.707 -15.618) 16.725 10.808 ( 6.044 -1.289 -11.172) 12.768 10.971 ( -2.022 6.865 -3.629) 8.024 11.135 ( -10.779 -4.542 -2.668) 11.998 11.326 ( 11.372 1.733 -1.256) 11.571 11.709 ( -6.476 -0.797 3.045) 7.201 11.922 ( -16.710 0.206 7.222) 18.206 12.333 ( -1.408 0.567 6.096) 6.282 12.627 ( 1.806 -1.454 1.415) 2.716 14.157 ( 7.225 0.693 2.425) 7.653 15.239 ( 6.802 1.751 6.075) 9.286 15.818 ( -6.788 -0.340 5.881) 8.988 16.221 ( -9.437 2.437 -9.831) 13.843 16.659 ( -1.838 1.556 -0.232) 2.419 ======================= Grid point 283 (134/282) ======================= q-point: (-0.20 -0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.606 ( -6.287 -0.499 7.479) 9.783 2.878 ( -13.338 -4.993 19.362) 24.036 2.969 ( -13.127 -1.086 7.472) 15.144 3.622 ( -6.357 7.588 5.266) 11.212 3.767 ( -0.714 3.505 -14.110) 14.556 3.846 ( -0.203 -1.244 -19.657) 19.697 4.283 ( 3.799 -10.061 14.878) 18.358 4.481 ( 1.531 8.446 8.226) 11.889 4.710 ( 4.569 4.937 -6.373) 9.266 4.908 ( 6.651 -6.804 5.479) 10.980 5.100 ( 1.810 -6.673 -4.381) 8.185 5.406 ( 7.737 13.690 4.655) 16.400 5.800 ( 5.815 -2.776 -7.197) 9.660 5.830 ( 5.442 9.640 4.819) 12.074 6.048 ( 1.864 10.658 -0.323) 10.825 6.545 ( 2.130 -6.202 -3.397) 7.385 6.674 ( 11.489 2.377 -3.496) 12.242 6.933 ( -3.665 -4.317 -4.407) 7.176 7.067 ( 1.469 -11.701 1.297) 11.864 7.450 ( 0.792 -3.686 -1.072) 3.920 7.550 ( -8.172 -6.298 0.541) 10.332 7.705 ( 0.863 5.258 -1.009) 5.423 7.772 ( -2.107 2.278 -0.715) 3.184 8.051 ( -5.733 -1.514 -12.239) 13.600 8.289 ( 11.251 -3.974 -1.820) 12.070 8.365 ( 7.781 -4.876 1.363) 9.283 8.764 ( -5.720 -2.454 11.078) 12.707 8.903 ( -7.150 -3.721 -1.565) 8.211 9.606 ( -3.831 2.549 11.432) 12.323 9.762 ( 1.847 2.177 4.281) 5.146 9.878 ( 5.018 0.895 3.141) 5.987 10.234 ( 4.433 -4.078 -4.334) 7.421 10.288 ( -1.074 6.964 -3.280) 7.773 10.512 ( -0.493 2.353 -3.447) 4.203 10.587 ( 7.088 -0.699 -9.309) 11.721 10.781 ( -6.235 -0.797 4.170) 7.543 10.878 ( 10.259 5.564 -9.381) 14.974 11.083 ( 4.386 -5.313 -7.557) 10.226 11.482 ( 9.709 4.123 0.476) 10.559 11.634 ( -6.935 -2.598 0.095) 7.407 11.727 ( -18.207 -0.829 9.523) 20.564 12.340 ( -1.486 4.099 3.384) 5.519 12.691 ( 1.785 -5.428 0.050) 5.714 14.194 ( -0.499 1.220 -3.343) 3.593 15.404 ( 8.524 1.179 7.081) 11.144 15.734 ( -15.144 1.011 7.956) 17.137 15.989 ( -1.957 1.866 -11.400) 11.716 16.680 ( 3.715 3.739 4.253) 6.773 ======================= Grid point 284 (135/282) ======================= q-point: (-0.10 -0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.545 ( -14.037 -7.352 4.804) 16.558 2.695 ( -28.687 -6.448 12.570) 31.977 3.019 ( -2.403 0.758 13.543) 13.776 3.514 ( -6.716 4.527 3.373) 8.774 3.585 ( -3.740 1.119 -13.336) 13.896 3.644 ( -2.358 -0.527 -16.243) 16.421 4.404 ( -1.399 14.481 3.404) 14.941 4.473 ( -19.191 -17.319 9.829) 27.656 4.654 ( 4.931 4.696 -5.339) 8.653 5.080 ( 3.121 3.766 -9.043) 10.282 5.162 ( 7.285 -7.809 7.990) 13.338 5.363 ( 4.444 16.671 2.130) 17.384 5.771 ( 3.571 2.793 -6.671) 8.065 6.004 ( 2.074 6.489 -2.050) 7.114 6.051 ( 7.079 -2.407 13.304) 15.261 6.621 ( 2.271 -6.593 3.412) 7.763 6.760 ( 5.056 -5.522 -9.325) 11.959 6.951 ( 6.626 -0.262 -0.909) 6.694 7.159 ( -4.900 -6.785 -0.002) 8.370 7.350 ( -8.910 1.249 -1.998) 9.216 7.569 ( 2.974 -7.528 -1.206) 8.184 7.675 ( 3.711 5.916 -2.872) 7.551 7.709 ( 1.303 3.180 0.536) 3.478 8.015 ( 7.113 -4.868 -5.386) 10.163 8.485 ( 11.710 -8.865 -4.969) 15.505 8.519 ( 0.914 -5.308 4.410) 6.961 8.789 ( -9.575 -3.471 -1.163) 10.251 8.823 ( -0.583 -5.500 7.587) 9.389 9.590 ( -11.026 6.576 16.195) 20.666 9.758 ( 3.119 6.372 -3.136) 7.756 10.001 ( 4.127 -1.751 -0.483) 4.509 10.190 ( -0.608 4.128 -2.596) 4.915 10.312 ( 3.503 1.955 -1.103) 4.161 10.366 ( -1.663 6.749 -2.085) 7.257 10.674 ( 8.797 -3.004 -1.995) 9.508 10.754 ( 3.349 -0.076 -4.605) 5.695 11.011 ( 12.823 0.375 0.826) 12.855 11.154 ( 7.930 -1.997 -4.112) 9.153 11.428 ( -19.665 -0.181 3.317) 19.944 11.509 ( -1.630 -1.905 -3.105) 3.991 11.752 ( 4.463 0.309 8.520) 9.623 12.296 ( -1.816 6.272 1.018) 6.608 12.741 ( -1.874 -7.386 -0.724) 7.654 14.083 ( -5.280 0.513 -7.509) 9.194 15.466 ( -18.942 3.317 2.122) 19.347 15.629 ( 6.620 -0.621 10.033) 12.037 15.962 ( 7.822 -2.728 -6.066) 10.268 16.770 ( 6.486 6.894 5.679) 11.038 ======================= Grid point 292 (136/282) ======================= q-point: (-0.30 -0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.603 ( -7.936 0.000 3.607) 8.717 2.837 ( -14.434 0.000 23.491) 27.571 2.961 ( -11.237 0.000 7.203) 13.347 3.690 ( -7.307 0.000 0.760) 7.346 3.807 ( -0.757 0.000 -17.118) 17.134 3.832 ( -1.369 0.000 -14.345) 14.410 4.185 ( 2.863 -0.000 17.137) 17.374 4.566 ( 5.849 -0.000 9.893) 11.492 4.734 ( -2.965 0.000 -5.978) 6.673 4.867 ( 13.271 -0.000 2.270) 13.464 5.029 ( -0.508 0.000 -2.874) 2.919 5.516 ( 13.389 -0.000 13.102) 18.733 5.762 ( 4.371 -0.000 -13.512) 14.201 5.956 ( 8.000 -0.000 -4.441) 9.150 6.128 ( -7.244 0.000 4.741) 8.658 6.487 ( 3.576 -0.000 -2.142) 4.168 6.706 ( 5.016 -0.000 -5.960) 7.790 6.903 ( 8.439 -0.000 7.248) 11.125 6.940 ( -4.677 0.000 -5.620) 7.312 7.415 ( -1.667 0.000 -5.269) 5.526 7.503 ( -4.650 0.000 4.225) 6.283 7.752 ( 0.959 -0.000 -1.609) 1.873 7.786 ( -0.426 0.000 -0.421) 0.599 8.039 ( -6.920 0.000 -13.654) 15.307 8.262 ( 10.703 -0.000 -2.846) 11.075 8.323 ( 7.061 -0.000 1.878) 7.307 8.743 ( -6.537 0.000 10.388) 12.274 8.873 ( -5.607 0.000 -1.845) 5.902 9.644 ( -4.288 0.000 16.062) 16.625 9.734 ( 5.326 -0.000 1.218) 5.463 9.933 ( 4.116 -0.000 3.605) 5.472 10.179 ( 2.002 -0.000 -5.440) 5.796 10.359 ( 0.921 -0.000 -8.833) 8.881 10.503 ( 2.729 -0.000 4.586) 5.337 10.581 ( 6.041 -0.000 -12.283) 13.688 10.778 ( -4.700 0.000 1.564) 4.954 10.960 ( 5.621 -0.000 -11.685) 12.967 11.014 ( 5.786 -0.000 -2.485) 6.297 11.526 ( 13.982 -0.000 -1.291) 14.042 11.598 ( -10.638 0.000 2.171) 10.857 11.722 ( -20.325 0.000 9.524) 22.446 12.376 ( -0.859 0.000 4.812) 4.888 12.647 ( 2.027 -0.000 -1.842) 2.739 14.203 ( -0.900 0.000 -3.250) 3.372 15.415 ( 8.310 -0.000 6.166) 10.348 15.741 ( -14.598 0.000 8.770) 17.030 16.005 ( -4.592 0.000 -10.762) 11.700 16.708 ( 4.081 -0.000 4.545) 6.109 ======================= Grid point 293 (137/282) ======================= q-point: (-0.20 -0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.467 ( -16.787 -2.724 4.696) 17.643 2.627 ( -30.901 -2.270 14.078) 34.032 3.028 ( -0.874 0.327 12.363) 12.398 3.566 ( -3.743 1.240 -7.509) 8.481 3.615 ( -2.960 1.532 -13.321) 13.731 3.651 ( -7.308 2.090 -5.690) 9.495 4.245 ( -24.333 -9.788 11.192) 28.516 4.587 ( 0.565 7.882 -1.937) 8.136 4.704 ( 3.982 1.961 -1.237) 4.607 5.015 ( -0.059 -6.689 -2.777) 7.243 5.106 ( 11.842 -0.459 4.359) 12.627 5.632 ( 4.839 14.313 -4.243) 15.693 5.798 ( 7.178 -2.088 -4.375) 8.662 6.035 ( 6.207 3.629 5.998) 9.363 6.104 ( -1.436 1.443 5.965) 6.303 6.535 ( 0.841 -2.300 4.229) 4.887 6.657 ( -1.567 -6.642 -9.409) 11.623 6.954 ( 7.870 0.505 -0.929) 7.941 7.076 ( -0.946 -3.201 2.903) 4.423 7.371 ( -8.309 1.229 -1.714) 8.572 7.442 ( 6.411 -5.744 -1.943) 8.824 7.744 ( 2.063 2.484 -2.382) 4.012 7.762 ( 2.051 2.042 -1.241) 3.150 7.958 ( 7.389 -2.202 -6.719) 10.226 8.389 ( 10.473 -3.335 -6.122) 12.581 8.458 ( 2.486 -2.217 5.579) 6.498 8.728 ( -8.271 -2.440 6.562) 10.836 8.791 ( -2.473 -0.721 -0.704) 2.670 9.677 ( -8.593 4.510 14.545) 17.485 9.809 ( 3.674 -1.233 -4.081) 5.628 10.022 ( 6.041 5.789 3.415) 9.037 10.197 ( 0.678 -3.749 1.003) 3.939 10.334 ( 5.669 0.914 -3.848) 6.912 10.449 ( -5.809 4.541 -3.037) 7.974 10.609 ( 6.947 -4.445 -5.628) 9.984 10.754 ( 0.519 0.156 0.060) 0.545 11.043 ( 16.414 2.302 -6.161) 17.683 11.134 ( 9.408 -0.661 0.906) 9.475 11.433 ( -17.021 0.629 2.445) 17.207 11.461 ( -12.729 -2.935 -1.081) 13.108 11.759 ( 8.245 0.398 8.710) 12.000 12.383 ( -1.350 3.952 2.362) 4.797 12.651 ( -0.300 -3.792 -3.239) 4.996 14.088 ( -6.187 0.178 -7.468) 9.700 15.508 ( -21.400 1.729 4.118) 21.861 15.620 ( 9.226 -0.472 7.160) 11.688 15.932 ( 3.958 -1.052 -5.107) 6.546 16.840 ( 6.272 2.279 6.625) 9.403 ======================= Grid point 294 (138/282) ======================= q-point: (-0.10 -0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.232 ( -26.530 -6.809 6.297) 28.104 2.269 ( -30.924 -6.970 3.906) 31.939 3.111 ( -4.886 0.721 14.275) 15.105 3.376 ( -5.311 0.706 -13.443) 14.471 3.453 ( -5.587 2.713 -4.223) 7.510 3.503 ( -11.640 2.037 4.684) 12.711 3.917 ( -35.982 -19.921 6.710) 41.672 4.545 ( 1.181 12.352 -0.196) 12.410 4.691 ( 2.490 1.973 -4.791) 5.749 5.031 ( 1.098 -4.205 -6.235) 7.600 5.308 ( 8.168 -1.608 2.979) 8.841 5.567 ( 4.202 11.955 -1.438) 12.754 5.796 ( 4.101 6.461 -6.122) 9.800 6.061 ( 0.739 9.585 -0.728) 9.641 6.230 ( 0.339 -2.515 12.547) 12.801 6.573 ( -2.634 -10.941 -6.793) 13.145 6.692 ( -1.012 -8.233 9.620) 12.702 6.855 ( -13.953 -1.139 -7.901) 16.075 7.089 ( 6.939 -1.758 0.072) 7.158 7.400 ( 8.600 4.158 -0.039) 9.552 7.591 ( 8.072 -3.953 -2.667) 9.375 7.732 ( 3.611 4.770 -1.251) 6.112 7.846 ( 7.779 0.857 6.436) 10.132 8.090 ( 12.093 -4.315 -4.637) 13.651 8.474 ( -7.108 -1.627 2.818) 7.818 8.508 ( 6.630 -6.093 -7.058) 11.441 8.639 ( -6.566 -1.102 -0.421) 6.671 8.850 ( 3.711 -7.012 1.633) 8.099 9.649 ( -6.302 4.567 12.732) 14.922 9.792 ( 1.888 2.091 -4.724) 5.500 10.036 ( -0.955 9.729 0.168) 9.777 10.215 ( 0.947 5.768 -2.064) 6.199 10.332 ( 0.382 0.606 1.275) 1.463 10.444 ( 6.922 -1.225 -0.336) 7.037 10.707 ( 4.348 -2.645 -2.454) 5.650 10.809 ( 8.375 -6.254 -2.756) 10.810 11.133 ( -16.925 -0.440 0.122) 16.932 11.190 ( 3.688 1.736 -1.785) 4.450 11.331 ( 11.712 -2.840 3.043) 12.429 11.410 ( 2.235 -2.076 4.202) 5.192 11.956 ( 7.297 2.484 8.876) 11.756 12.317 ( -2.806 6.908 -0.531) 7.475 12.620 ( -4.799 -5.935 -3.329) 8.327 13.893 ( -8.010 -0.369 -9.697) 12.582 15.191 ( -21.681 2.129 2.890) 21.976 15.829 ( 7.938 0.438 6.890) 10.520 16.020 ( 9.014 -5.541 -2.258) 10.820 16.975 ( 6.835 4.224 5.559) 9.771 ======================= Grid point 303 (139/282) ======================= q-point: (-0.20 -0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.181 ( -26.348 0.000 7.320) 27.346 2.214 ( -34.210 0.000 4.253) 34.473 3.117 ( -4.550 0.000 13.524) 14.269 3.383 ( -5.046 0.000 -12.970) 13.917 3.461 ( -2.186 0.000 -9.747) 9.989 3.592 ( -6.571 0.000 8.228) 10.530 3.695 ( -48.787 0.000 9.231) 49.653 4.626 ( 2.150 -0.000 -2.530) 3.320 4.752 ( 2.023 -0.000 -4.588) 5.014 4.951 ( 0.763 -0.000 -4.160) 4.229 5.306 ( 8.027 -0.000 4.396) 9.152 5.659 ( 4.712 -0.000 -10.566) 11.569 5.884 ( 4.789 -0.000 -3.593) 5.987 6.159 ( 3.749 -0.000 1.706) 4.119 6.198 ( 0.439 -0.000 12.597) 12.604 6.468 ( -5.722 0.000 -7.070) 9.096 6.608 ( -5.489 0.000 12.558) 13.706 6.847 ( -13.653 0.000 -8.687) 16.182 7.076 ( 8.239 -0.000 0.643) 8.264 7.442 ( 10.876 -0.000 -0.860) 10.910 7.541 ( 11.297 -0.000 -2.393) 11.548 7.781 ( 3.486 -0.000 -0.034) 3.487 7.848 ( 6.242 -0.000 4.672) 7.797 8.051 ( 11.797 -0.000 -4.056) 12.474 8.453 ( 9.282 -0.000 -8.527) 12.604 8.465 ( -7.255 0.000 4.879) 8.743 8.630 ( -8.943 0.000 2.206) 9.211 8.799 ( 3.776 -0.000 -0.045) 3.776 9.694 ( -6.577 0.000 11.178) 12.969 9.785 ( 2.974 -0.000 -9.586) 10.037 10.193 ( 6.321 -0.000 3.454) 7.203 10.214 ( -3.509 0.000 8.185) 8.905 10.353 ( -3.759 0.000 -3.529) 5.156 10.406 ( 6.655 -0.000 -0.587) 6.681 10.663 ( 7.943 -0.000 -2.563) 8.346 10.773 ( 5.045 -0.000 -5.311) 7.326 11.143 ( -19.064 0.000 -0.603) 19.074 11.201 ( -8.145 0.000 -1.581) 8.297 11.279 ( 17.486 -0.000 -1.189) 17.526 11.413 ( 9.143 -0.000 9.781) 13.389 11.975 ( 7.698 -0.000 9.028) 11.865 12.386 ( -2.914 0.000 0.875) 3.043 12.561 ( -3.751 0.000 -5.778) 6.889 13.890 ( -8.375 0.000 -9.565) 12.714 15.209 ( -22.411 0.000 3.445) 22.674 15.836 ( 10.395 -0.000 5.697) 11.854 15.972 ( 6.126 -0.000 -1.841) 6.396 17.007 ( 5.867 -0.000 6.022) 8.407 ======================= Grid point 304 (140/282) ======================= q-point: (-0.10 -0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.692 ( -35.691 -4.854 -4.099) 36.252 1.847 ( -31.836 -4.809 12.969) 34.711 3.052 ( -53.261 -7.693 19.974) 57.400 3.165 ( -6.660 0.789 13.686) 15.241 3.204 ( -6.554 -1.156 -4.510) 8.039 3.372 ( -2.057 0.262 -1.956) 2.851 3.604 ( -6.711 -3.909 9.151) 12.003 4.599 ( 0.799 5.735 -5.537) 8.012 4.675 ( 0.729 2.805 -7.390) 7.938 4.941 ( 0.445 -5.438 -6.471) 8.464 5.411 ( 3.082 1.736 -0.247) 3.546 5.622 ( 4.137 2.119 -7.990) 9.244 5.847 ( 1.961 5.943 -6.863) 9.288 6.145 ( -2.365 10.112 0.593) 10.402 6.255 ( -6.131 5.886 3.570) 9.218 6.384 ( -6.642 -9.113 -2.606) 11.574 6.504 ( -8.444 -12.660 1.520) 15.293 6.802 ( 3.070 -2.841 3.078) 5.193 7.228 ( 8.377 1.082 5.558) 10.111 7.573 ( 9.840 4.879 -0.660) 11.003 7.687 ( 10.308 -0.805 -3.792) 11.013 7.843 ( 4.238 4.316 3.403) 6.940 8.039 ( 7.876 -3.149 8.243) 11.828 8.199 ( 8.743 -0.439 -2.782) 9.186 8.371 ( -7.607 0.258 2.429) 7.990 8.438 ( -4.336 -1.422 -4.629) 6.500 8.592 ( 7.110 -3.531 -5.663) 9.752 8.854 ( 1.418 -2.853 -1.082) 3.364 9.693 ( 0.491 3.457 -4.710) 5.863 9.769 ( 2.059 -4.352 1.603) 5.074 10.150 ( -5.727 13.824 11.115) 18.640 10.225 ( 0.432 7.627 -8.700) 11.578 10.360 ( 2.955 -6.354 2.500) 7.440 10.513 ( 6.536 -2.999 -3.101) 7.831 10.695 ( -10.997 0.540 -2.167) 11.221 10.788 ( 3.398 -6.346 1.474) 7.348 11.016 ( 3.673 0.022 -0.531) 3.711 11.086 ( -3.755 -7.238 2.753) 8.606 11.533 ( 16.455 2.361 -0.845) 16.645 11.701 ( 13.731 2.413 11.919) 18.342 12.149 ( 3.479 1.701 8.947) 9.749 12.297 ( -4.608 5.801 -1.971) 7.666 12.444 ( -6.720 -5.642 -4.850) 10.026 13.666 ( -8.115 -0.412 -10.286) 13.109 14.918 ( -20.183 0.800 4.650) 20.727 16.010 ( 7.346 3.665 3.577) 8.955 16.100 ( 8.897 -6.605 -0.026) 11.081 17.116 ( 4.256 0.672 -0.242) 4.316 ======================= Grid point 314 (141/282) ======================= q-point: (-0.10 -0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.106 ( -32.686 0.000 2.086) 32.753 1.509 ( -31.932 0.000 23.382) 39.578 2.437 ( -54.110 0.000 34.410) 64.124 3.088 ( -3.263 0.000 -1.212) 3.480 3.233 ( -5.232 0.000 14.462) 15.379 3.394 ( 1.051 -0.000 10.055) 10.110 3.593 ( -6.205 0.000 9.670) 11.489 4.584 ( -1.496 0.000 -10.950) 11.052 4.587 ( 2.901 -0.000 -7.210) 7.772 4.847 ( -0.017 0.000 -8.683) 8.683 5.403 ( -3.183 0.000 -3.574) 4.786 5.614 ( 5.924 -0.000 -9.780) 11.434 5.780 ( -2.906 0.000 -7.242) 7.803 6.143 ( -1.062 0.000 -5.858) 5.954 6.160 ( -3.441 0.000 -5.284) 6.305 6.252 ( -6.276 0.000 -0.351) 6.286 6.422 ( -3.585 0.000 6.664) 7.567 6.845 ( 1.864 -0.000 0.217) 1.877 7.465 ( 11.321 -0.000 10.072) 15.153 7.750 ( 9.159 -0.000 1.603) 9.299 7.803 ( 8.654 -0.000 -1.395) 8.766 7.953 ( 2.220 -0.000 4.217) 4.766 8.182 ( -0.284 0.000 8.647) 8.651 8.193 ( -3.561 0.000 -0.874) 3.666 8.324 ( -3.518 0.000 -1.410) 3.790 8.396 ( 9.629 -0.000 -4.115) 10.472 8.660 ( 9.665 -0.000 -4.972) 10.869 8.824 ( -1.791 0.000 -2.155) 2.802 9.609 ( -1.641 0.000 -9.223) 9.368 9.853 ( 6.238 -0.000 -0.588) 6.266 10.091 ( -5.678 0.000 -10.587) 12.014 10.278 ( -1.345 0.000 6.577) 6.713 10.357 ( -0.958 0.000 0.358) 1.022 10.480 ( -10.937 0.000 0.497) 10.948 10.564 ( 10.661 -0.000 -9.403) 14.215 10.850 ( 2.151 -0.000 6.034) 6.405 11.033 ( -1.399 0.000 7.426) 7.556 11.252 ( 17.001 -0.000 3.409) 17.339 11.769 ( 12.329 -0.000 -3.078) 12.708 12.019 ( 9.490 -0.000 11.737) 15.094 12.167 ( -4.031 0.000 -5.159) 6.546 12.223 ( -5.045 0.000 -1.833) 5.367 12.354 ( -1.815 0.000 8.664) 8.852 13.459 ( -5.317 0.000 -9.746) 11.102 14.701 ( -15.866 0.000 7.118) 17.390 16.174 ( 6.840 -0.000 0.053) 6.841 16.181 ( 6.214 -0.000 2.163) 6.580 17.036 ( -7.513 0.000 -15.876) 17.564 ======================= Grid point 315 (142/282) ======================= q-point: ( 0.00 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.061 ( 15.650 -0.000 30.028) 33.861 2.204 ( -6.384 0.000 31.868) 32.501 2.998 ( -9.948 0.000 31.177) 32.726 3.370 ( 8.635 -0.000 5.581) 10.282 3.445 ( -3.322 0.000 6.114) 6.958 3.642 ( 0.748 -0.000 -5.943) 5.990 4.137 ( 4.864 -0.000 1.772) 5.176 4.160 ( -7.499 0.000 2.226) 7.822 4.282 ( -4.015 0.000 11.561) 12.239 4.473 ( 1.042 -0.000 -5.171) 5.275 4.824 ( -2.752 0.000 -16.235) 16.466 5.336 ( -4.431 0.000 -10.654) 11.539 5.449 ( 7.675 -0.000 -10.572) 13.065 5.982 ( 5.582 -0.000 -4.785) 7.352 5.985 ( 3.583 -0.000 -3.010) 4.679 6.036 ( -1.192 0.000 -1.429) 1.861 6.197 ( -9.030 0.000 -3.246) 9.596 6.674 ( 6.003 -0.000 -13.619) 14.883 7.787 ( -4.337 0.000 -1.895) 4.733 7.823 ( 3.336 -0.000 -1.097) 3.511 7.903 ( 3.170 -0.000 -5.729) 6.548 8.046 ( 3.858 -0.000 -8.850) 9.654 8.089 ( -0.034 0.000 -0.547) 0.548 8.202 ( -3.377 0.000 -5.172) 6.177 8.360 ( 5.358 -0.000 -1.332) 5.521 8.397 ( 0.405 -0.000 -1.196) 1.263 8.832 ( -1.274 0.000 7.432) 7.540 9.033 ( 1.309 -0.000 10.624) 10.704 9.495 ( -2.695 0.000 6.769) 7.286 9.614 ( -1.144 0.000 -0.190) 1.160 9.748 ( -3.868 0.000 2.967) 4.875 9.997 ( -2.471 0.000 -6.235) 6.707 10.316 ( -1.353 0.000 0.771) 1.557 10.612 ( 4.482 -0.000 -1.552) 4.743 10.644 ( 1.356 -0.000 5.336) 5.505 10.939 ( 3.903 -0.000 -8.378) 9.242 10.968 ( -5.360 0.000 -2.590) 5.953 11.167 ( -9.098 0.000 -12.386) 15.368 11.703 ( -14.998 0.000 -5.198) 15.873 11.792 ( 14.020 -0.000 -6.676) 15.528 12.375 ( -10.785 0.000 2.857) 11.157 12.396 ( 9.600 -0.000 3.373) 10.175 12.670 ( -10.294 0.000 15.490) 18.599 13.355 ( 14.971 -0.000 -2.081) 15.115 14.810 ( -0.022 0.000 8.527) 8.527 15.785 ( -7.829 0.000 -16.398) 18.171 16.269 ( -2.808 0.000 -0.023) 2.808 16.320 ( 1.880 -0.000 -0.087) 1.882 ======================= Grid point 316 (143/282) ======================= q-point: ( 0.10 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.451 ( -0.063 0.145 27.201) 27.202 2.590 ( 14.416 -3.559 25.157) 29.212 3.188 ( 2.631 -2.123 9.195) 9.797 3.490 ( 4.031 0.917 4.715) 6.271 3.546 ( -0.859 -4.994 10.868) 11.991 3.664 ( 10.059 -2.686 -3.520) 10.991 4.097 ( -3.901 1.772 3.474) 5.516 4.106 ( 1.711 0.501 -9.150) 9.322 4.281 ( -7.170 -4.333 2.547) 8.756 4.629 ( 2.625 1.810 1.390) 3.478 4.698 ( 5.730 -5.835 7.314) 10.971 5.147 ( -5.143 1.041 -11.741) 12.861 5.426 ( 3.933 2.568 -11.364) 12.296 5.907 ( -1.128 8.186 -1.427) 8.386 6.007 ( 6.794 7.634 -2.276) 10.469 6.091 ( -1.034 -5.310 -2.332) 5.891 6.171 ( 9.337 -6.826 -2.077) 11.751 6.660 ( 10.221 -1.588 -15.644) 18.755 7.699 ( -4.848 0.374 -2.648) 5.537 7.813 ( -3.130 0.968 -2.724) 4.261 7.842 ( -1.329 5.000 -4.324) 6.742 7.989 ( -0.968 -4.343 -9.880) 10.835 8.101 ( 4.002 1.630 -0.245) 4.328 8.131 ( 0.096 0.032 -2.418) 2.420 8.327 ( -0.758 6.239 -2.058) 6.613 8.427 ( 0.557 -2.522 -1.486) 2.979 8.921 ( 1.591 -0.823 9.217) 9.390 9.119 ( -0.526 0.563 6.934) 6.977 9.557 ( -0.901 -0.945 8.695) 8.792 9.613 ( 1.846 3.341 2.297) 4.455 9.752 ( -3.228 -0.809 9.065) 9.657 9.937 ( -3.152 -6.576 -1.737) 7.496 10.306 ( -0.304 0.617 -0.084) 0.693 10.577 ( -3.922 6.202 0.424) 7.350 10.695 ( -4.757 -1.821 -1.761) 5.389 10.888 ( 0.245 -0.767 -5.172) 5.234 10.922 ( -1.121 2.881 -4.674) 5.603 10.939 ( 4.315 1.255 -10.218) 11.162 11.429 ( -14.906 -3.111 -5.938) 16.344 11.889 ( 7.559 2.028 -5.704) 9.685 12.220 ( -12.565 -1.272 2.495) 12.873 12.465 ( -6.036 0.455 6.247) 8.699 12.755 ( 4.114 0.722 10.771) 11.552 13.581 ( 15.670 -1.978 -2.024) 15.924 14.930 ( 4.113 -0.034 9.591) 10.436 15.599 ( 2.431 -2.983 -16.926) 17.358 16.198 ( -6.476 -0.348 0.024) 6.486 16.343 ( -1.433 -4.807 -0.250) 5.023 ======================= Grid point 317 (144/282) ======================= q-point: ( 0.20 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.693 ( 1.106 1.933 21.484) 21.600 2.985 ( 3.620 -5.586 16.057) 17.383 3.289 ( 8.495 2.520 2.294) 9.153 3.522 ( 2.366 -2.782 -5.189) 6.346 3.630 ( 1.739 1.936 -7.182) 7.639 3.924 ( 0.900 -14.510 19.033) 23.950 3.958 ( -3.629 1.468 -7.966) 8.876 4.179 ( 8.445 3.173 1.560) 9.155 4.311 ( 1.987 -3.642 8.049) 9.055 4.577 ( 0.254 -11.390 -10.691) 15.623 4.952 ( -1.054 0.468 -6.786) 6.883 5.094 ( 8.964 -3.194 19.501) 21.699 5.326 ( 3.261 5.954 -8.847) 11.151 5.861 ( 4.891 7.724 -1.909) 9.340 6.027 ( 5.828 10.467 0.181) 11.982 6.128 ( 5.679 -4.745 -3.675) 8.263 6.387 ( 13.410 -4.701 -0.555) 14.221 6.706 ( 14.255 -3.455 -16.394) 21.998 7.547 ( -11.207 0.682 -3.977) 11.911 7.677 ( -8.092 2.349 -2.072) 8.677 7.721 ( -6.554 0.685 -2.825) 7.170 7.894 ( -5.314 -5.691 -8.391) 11.447 8.156 ( 3.588 5.842 -0.922) 6.917 8.175 ( 7.069 3.624 1.085) 8.017 8.255 ( 2.635 2.973 -1.404) 4.214 8.416 ( 0.148 3.797 0.123) 3.802 9.048 ( 1.064 0.779 9.911) 9.998 9.155 ( 0.011 -0.790 1.981) 2.133 9.588 ( -3.551 3.923 9.998) 11.312 9.698 ( 4.946 -1.171 2.438) 5.637 9.842 ( -0.452 -3.256 9.812) 10.348 9.959 ( -2.362 -9.303 1.295) 9.686 10.297 ( 1.068 1.356 -1.493) 2.282 10.416 ( -7.895 8.195 -3.269) 11.839 10.503 ( -11.724 0.234 -1.109) 11.778 10.789 ( -0.434 3.067 -9.977) 10.447 10.941 ( 5.207 -1.060 -0.977) 5.403 11.005 ( 10.441 0.547 -6.071) 12.090 11.203 ( -10.280 -3.612 -5.125) 12.041 11.879 ( -1.475 4.072 -0.282) 4.340 12.083 ( -11.009 -4.495 1.793) 12.026 12.400 ( -9.045 0.020 5.800) 10.745 12.912 ( 6.890 4.289 5.975) 10.078 13.804 ( 13.679 -4.024 -3.479) 14.677 15.122 ( 7.313 0.059 11.907) 13.974 15.547 ( 8.194 -4.506 -16.870) 19.289 16.081 ( -10.832 -2.453 0.837) 11.138 16.352 ( -2.558 -6.716 -0.096) 7.187 ======================= Grid point 318 (145/282) ======================= q-point: ( 0.30 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.870 ( 0.384 3.340 16.187) 16.533 3.096 ( -3.116 -1.095 6.460) 7.255 3.432 ( 3.237 1.033 -5.204) 6.215 3.509 ( 2.499 -2.528 -3.809) 5.210 3.557 ( 2.501 -1.063 -6.311) 6.872 3.757 ( -13.121 4.983 3.010) 14.354 4.195 ( -5.211 -15.624 12.541) 20.701 4.266 ( 2.129 -4.002 -2.845) 5.352 4.432 ( 6.278 -4.333 -5.700) 9.522 4.683 ( 10.146 -5.043 5.223) 12.476 4.958 ( 3.563 -10.640 -3.428) 11.733 5.226 ( 6.926 8.574 0.021) 11.022 5.519 ( 13.477 -2.230 9.879) 16.858 5.876 ( 7.396 9.126 -1.635) 11.859 6.036 ( 5.784 11.930 2.160) 13.433 6.266 ( 12.500 -3.981 -2.954) 13.447 6.603 ( 11.358 -2.163 -0.276) 11.566 6.824 ( 16.984 -3.228 -14.635) 22.651 7.296 ( -12.924 3.135 -2.981) 13.629 7.527 ( -8.848 -2.051 -0.798) 9.117 7.597 ( -8.665 -4.485 -1.905) 9.941 7.744 ( -10.940 -5.666 -5.444) 13.469 8.033 ( -6.087 9.853 -1.405) 11.667 8.273 ( 5.046 8.196 -1.037) 9.681 8.331 ( 10.048 5.797 0.327) 11.605 8.451 ( 9.866 5.014 3.197) 11.520 9.066 ( -4.768 3.341 3.600) 6.845 9.190 ( 0.613 2.115 1.352) 2.584 9.609 ( -2.557 0.952 6.726) 7.258 9.792 ( 2.112 -1.409 2.964) 3.903 9.904 ( -3.982 -0.799 3.733) 5.517 10.016 ( -0.872 -9.606 0.254) 9.649 10.206 ( -5.257 2.361 1.932) 6.078 10.346 ( -9.864 -2.516 -0.366) 10.186 10.369 ( 4.374 -2.286 0.707) 4.986 10.669 ( 1.994 5.739 -7.740) 9.840 11.009 ( -2.549 -3.966 -7.494) 8.853 11.024 ( 8.352 5.155 -1.118) 9.879 11.172 ( 7.442 -2.200 -1.223) 7.856 11.805 ( -6.293 1.618 2.808) 7.078 11.979 ( -12.000 -4.215 5.207) 13.744 12.315 ( -6.774 -0.336 1.673) 6.986 12.994 ( 4.458 7.993 2.256) 9.426 13.962 ( 8.644 -4.378 -6.783) 11.828 15.373 ( 8.853 0.954 14.006) 16.597 15.583 ( 12.075 -4.436 -14.318) 19.248 15.930 ( -14.521 -4.174 3.285) 15.462 16.384 ( -0.654 -8.862 0.465) 8.898 ======================= Grid point 319 (146/282) ======================= q-point: (-0.60 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.945 ( -4.901 6.114 11.640) 14.032 3.070 ( -8.362 -0.212 2.462) 8.720 3.312 ( 1.601 0.099 -16.166) 16.245 3.500 ( -3.636 3.192 -0.909) 4.923 3.541 ( -4.132 4.068 -2.100) 6.167 3.606 ( -7.768 -2.425 10.507) 13.290 4.193 ( -7.349 -11.245 -1.812) 13.555 4.373 ( -0.000 -9.342 3.191) 9.872 4.526 ( 8.038 -11.594 -8.517) 16.479 4.948 ( 2.719 -7.912 13.326) 15.735 5.076 ( 9.726 -2.832 -3.857) 10.839 5.328 ( 8.743 9.463 4.690) 13.711 5.698 ( 6.786 3.186 -5.116) 9.076 5.909 ( 4.904 7.465 0.533) 8.948 6.108 ( 8.512 6.074 6.489) 12.307 6.495 ( 15.271 -2.770 -0.720) 15.537 6.744 ( 6.241 1.844 -1.078) 6.596 6.881 ( 3.754 1.973 -7.183) 8.341 7.191 ( 6.558 0.758 -2.295) 6.989 7.452 ( -10.291 -6.928 -3.675) 12.938 7.462 ( -8.081 -8.046 0.266) 11.407 7.585 ( -8.702 -6.132 -1.224) 10.716 7.841 ( -4.370 11.221 -2.603) 12.320 8.195 ( -1.673 12.922 1.184) 13.083 8.461 ( 13.430 8.387 -3.083) 16.131 8.615 ( 10.059 5.917 3.674) 12.234 8.960 ( -6.036 4.828 -2.325) 8.072 9.103 ( -5.309 5.961 -2.843) 8.473 9.611 ( -1.415 -1.638 -0.460) 2.213 9.830 ( -5.609 -2.278 8.343) 10.308 9.883 ( -2.080 -1.358 2.550) 3.560 10.060 ( 0.900 -5.326 -5.320) 7.581 10.157 ( -0.346 -1.737 -6.447) 6.686 10.288 ( -8.870 -10.412 9.303) 16.542 10.509 ( 9.533 -2.636 2.957) 10.324 10.650 ( 6.232 5.229 -1.477) 8.268 10.976 ( 3.312 -2.706 -2.755) 5.087 11.077 ( 7.673 9.275 -1.658) 12.152 11.322 ( 8.033 -5.224 -0.554) 9.598 11.707 ( -10.144 0.831 1.685) 10.316 11.903 ( -10.925 -4.650 11.052) 16.222 12.247 ( -2.918 -0.708 -0.947) 3.148 12.968 ( 0.580 10.304 -0.842) 10.354 13.980 ( 1.736 -2.738 -11.157) 11.619 15.556 ( -1.449 -1.138 0.368) 1.879 15.706 ( 12.815 -0.138 0.799) 12.841 15.829 ( -6.445 -3.060 8.569) 11.150 16.491 ( 3.934 -11.221 1.163) 11.948 ======================= Grid point 320 (147/282) ======================= q-point: (-0.50 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.819 ( -21.072 5.256 -5.078) 22.303 2.846 ( -14.473 9.717 11.412) 20.836 3.182 ( 3.126 -1.979 -17.745) 18.127 3.418 ( -8.775 2.313 9.321) 13.009 3.474 ( -1.870 2.813 3.951) 5.198 3.636 ( -3.446 -2.634 7.321) 8.509 4.190 ( -4.179 -14.397 -1.305) 15.048 4.431 ( 0.674 -3.457 -2.391) 4.257 4.653 ( 4.836 -13.564 -7.325) 16.156 5.052 ( -13.487 5.735 14.590) 20.680 5.176 ( 8.402 -0.941 -6.564) 10.703 5.414 ( 5.771 4.112 6.068) 9.329 5.660 ( 3.003 4.294 -8.057) 9.611 5.917 ( 2.719 3.082 -0.561) 4.148 6.289 ( 7.733 0.176 6.935) 10.389 6.672 ( 0.853 3.884 -5.611) 6.877 6.730 ( 8.661 0.124 -0.626) 8.684 6.943 ( 6.724 0.087 0.686) 6.759 7.186 ( -17.090 -1.722 -1.462) 17.239 7.302 ( 6.806 1.566 -1.885) 7.233 7.510 ( -0.793 -9.401 0.702) 9.461 7.570 ( 0.280 -2.948 0.257) 2.972 7.772 ( 8.971 3.036 -1.589) 9.603 8.087 ( -0.293 11.422 0.447) 11.434 8.515 ( 9.880 11.759 -7.298) 17.005 8.675 ( -3.139 2.827 3.350) 5.392 8.749 ( -11.100 1.892 -5.737) 12.638 9.006 ( 4.657 8.862 -3.242) 10.523 9.598 ( 0.565 -3.698 -4.559) 5.897 9.840 ( -1.028 -4.712 -2.715) 5.535 9.868 ( -7.977 1.803 12.232) 14.714 10.029 ( 0.223 -4.059 -7.885) 8.871 10.173 ( 5.417 -6.616 -4.100) 9.483 10.359 ( -2.739 -7.482 7.807) 11.155 10.668 ( 5.013 0.752 -1.858) 5.399 10.761 ( 10.426 0.162 5.720) 11.894 11.097 ( 8.955 7.654 -0.655) 11.798 11.132 ( 9.739 -3.486 3.708) 10.989 11.390 ( -4.791 -0.174 -2.634) 5.470 11.543 ( -8.143 0.648 2.229) 8.468 11.967 ( -2.588 -6.055 13.840) 15.327 12.217 ( -1.256 -1.382 -0.883) 2.066 12.847 ( -3.202 10.548 -2.832) 11.382 13.854 ( -3.333 -1.125 -13.890) 14.329 15.408 ( -15.064 -4.108 -1.233) 15.662 15.908 ( 2.914 0.999 6.138) 6.868 15.935 ( 12.466 5.043 7.112) 15.213 16.688 ( 8.284 -11.820 0.683) 14.450 ======================= Grid point 321 (148/282) ======================= q-point: (-0.40 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.311 ( -28.050 9.845 -7.123) 30.569 2.612 ( -22.035 11.448 15.355) 29.196 3.105 ( 1.966 -2.266 -9.562) 10.022 3.384 ( -1.429 0.473 2.380) 2.815 3.478 ( -7.843 0.501 13.205) 15.367 3.677 ( -4.157 -1.800 8.632) 9.749 4.227 ( -7.416 -10.038 3.047) 12.847 4.361 ( -9.162 4.549 -0.058) 10.229 4.671 ( -5.626 0.481 -1.091) 5.751 4.874 ( -4.793 3.650 -0.078) 6.026 5.198 ( 5.087 -0.477 -10.749) 11.901 5.552 ( 2.930 -1.184 4.852) 5.790 5.600 ( 3.176 -1.021 -8.562) 9.190 5.951 ( -0.475 -5.223 2.051) 5.631 6.369 ( -4.373 1.510 -3.373) 5.725 6.565 ( 1.008 3.091 -1.776) 3.705 6.731 ( -11.086 4.552 -6.418) 13.595 7.004 ( 5.978 1.318 7.489) 9.672 7.131 ( 6.365 0.007 2.313) 6.772 7.361 ( 1.457 -3.029 2.423) 4.144 7.570 ( 4.338 3.473 -3.700) 6.676 7.636 ( 4.988 -8.537 1.979) 10.084 7.971 ( 15.331 0.309 -3.502) 15.729 8.067 ( 5.906 3.122 2.363) 7.086 8.422 ( -3.528 3.335 -7.815) 9.200 8.580 ( -10.004 0.047 3.442) 10.580 8.587 ( -0.692 3.446 -4.396) 5.628 8.978 ( 4.491 10.567 -3.880) 12.120 9.585 ( -0.399 -3.730 -4.719) 6.028 9.787 ( 0.867 3.820 -4.172) 5.723 9.961 ( 2.138 -7.767 7.561) 11.048 9.971 ( 0.155 -4.123 -9.873) 10.701 10.303 ( 2.922 -7.296 3.836) 8.746 10.457 ( 2.589 -4.512 2.702) 5.862 10.695 ( 2.397 3.191 -1.016) 4.118 10.943 ( 7.316 -0.266 1.401) 7.454 11.138 ( -10.635 2.538 0.800) 10.963 11.169 ( 6.502 6.477 -2.780) 9.589 11.447 ( 7.633 3.339 2.147) 8.604 11.499 ( 4.567 -4.439 6.963) 9.436 12.142 ( 0.263 -8.470 9.200) 12.508 12.207 ( -1.860 -1.229 3.446) 4.104 12.675 ( -5.099 9.579 -2.271) 11.087 13.651 ( -5.431 -0.295 -14.075) 15.090 15.192 ( -17.423 -3.683 2.285) 17.954 15.989 ( 3.139 2.339 3.786) 5.446 16.122 ( 10.712 8.020 4.977) 14.277 16.892 ( 8.563 -8.540 -3.446) 12.575 ======================= Grid point 322 (149/282) ======================= q-point: (-0.30 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.754 ( -27.602 11.705 0.855) 29.994 2.335 ( -25.724 11.306 21.584) 35.432 3.084 ( 1.045 -1.076 -2.097) 2.578 3.397 ( -2.839 1.416 5.469) 6.323 3.499 ( -6.592 -2.842 12.515) 14.427 3.674 ( -12.278 1.732 12.246) 17.428 3.967 ( -25.418 17.151 18.256) 35.687 4.298 ( -4.674 -9.549 -0.636) 10.650 4.576 ( 1.401 4.542 -6.109) 7.741 4.806 ( 1.787 1.691 -10.792) 11.069 5.169 ( 2.355 -6.693 -11.163) 13.227 5.534 ( 3.967 2.534 -8.621) 9.822 5.640 ( -0.143 -3.764 -2.033) 4.281 6.008 ( -4.439 -11.339 1.947) 12.331 6.150 ( -12.241 -1.349 -6.108) 13.747 6.433 ( -7.870 10.006 -8.411) 15.258 6.565 ( 1.241 1.800 -2.455) 3.287 7.091 ( -4.240 12.834 7.245) 15.335 7.286 ( 10.764 -5.657 4.023) 12.808 7.522 ( 9.022 -8.946 4.441) 13.459 7.602 ( 7.379 -0.258 -3.253) 8.069 7.810 ( 5.551 -7.516 2.442) 9.658 8.066 ( 12.588 3.276 -11.671) 17.476 8.242 ( 3.930 -2.588 3.513) 5.872 8.311 ( -1.700 -4.547 -1.258) 5.015 8.442 ( -11.661 -0.600 3.941) 12.324 8.579 ( 7.400 6.344 -1.365) 9.842 8.908 ( 0.454 7.937 -2.660) 8.383 9.555 ( -1.800 -2.408 -2.601) 3.975 9.740 ( 0.044 0.197 -4.194) 4.199 9.898 ( 1.641 -2.250 -11.022) 11.368 10.166 ( 9.371 -7.205 1.575) 11.926 10.410 ( -1.450 -3.388 6.464) 7.441 10.530 ( 1.434 -0.785 -1.223) 2.042 10.621 ( -5.898 4.220 -4.767) 8.679 10.984 ( 1.124 6.501 2.237) 6.966 11.015 ( -1.885 -2.564 1.052) 3.351 11.251 ( 10.526 7.890 -2.052) 13.314 11.439 ( 3.462 -2.828 -2.202) 4.983 11.838 ( 12.944 -6.412 7.989) 16.507 12.169 ( -0.461 -1.660 -0.925) 1.955 12.287 ( -4.969 -3.939 5.178) 8.186 12.561 ( -2.561 6.397 8.154) 10.676 13.438 ( -5.118 0.523 -12.240) 13.277 14.992 ( -16.426 -2.168 5.045) 17.320 16.053 ( 3.491 0.555 1.820) 3.976 16.233 ( 7.725 8.491 2.330) 11.714 16.954 ( 2.817 -1.358 -12.070) 12.469 ======================= Grid point 323 (150/282) ======================= q-point: (-0.20 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.431 ( -14.549 8.845 20.097) 26.340 2.119 ( -23.741 8.692 28.354) 37.989 3.109 ( 0.308 0.157 3.800) 3.816 3.267 ( -27.879 13.892 22.646) 38.511 3.454 ( -7.723 4.600 10.977) 14.188 3.651 ( -2.956 -7.644 7.949) 11.417 3.837 ( -5.256 6.504 15.315) 17.449 4.276 ( -5.726 -7.798 -0.932) 9.720 4.491 ( 2.322 7.016 -9.704) 12.198 4.687 ( -0.006 4.215 -9.992) 10.844 5.141 ( -0.450 -9.373 -11.854) 15.119 5.477 ( 3.414 4.230 -9.582) 11.016 5.599 ( -1.890 -2.914 -7.467) 8.235 5.920 ( -6.747 -5.156 -4.321) 9.528 6.071 ( -4.630 -10.681 -2.269) 11.860 6.206 ( -2.718 8.660 -6.532) 11.182 6.516 ( -1.828 1.360 -4.302) 4.868 6.922 ( -6.573 10.962 -1.812) 12.910 7.549 ( 10.538 -6.519 4.037) 13.033 7.717 ( 7.809 -3.865 -1.003) 8.771 7.782 ( 10.809 -3.572 3.128) 11.806 7.940 ( 0.492 -8.947 2.635) 9.340 8.091 ( 7.113 1.700 -9.773) 12.206 8.253 ( -0.824 -3.921 -4.076) 5.716 8.300 ( -4.397 -2.542 -0.476) 5.101 8.419 ( 2.284 4.912 4.806) 7.242 8.689 ( 8.263 2.515 5.776) 10.390 8.839 ( -1.417 3.919 0.177) 4.172 9.520 ( -3.017 -0.402 1.029) 3.213 9.699 ( -2.365 -7.457 -6.399) 10.107 9.845 ( 2.674 2.011 -7.158) 7.902 10.343 ( 2.310 7.213 -11.510) 13.778 10.365 ( 2.353 -3.090 2.542) 4.642 10.438 ( -8.813 0.017 0.128) 8.814 10.538 ( 1.293 1.369 3.171) 3.688 10.966 ( 0.642 2.096 -0.884) 2.364 11.088 ( 2.057 -1.834 2.320) 3.602 11.342 ( 14.324 7.371 -3.669) 16.522 11.521 ( 1.558 -13.889 -6.939) 15.604 12.037 ( 6.046 -1.703 -0.907) 6.346 12.171 ( -7.672 1.460 -2.684) 8.258 12.282 ( 6.678 -0.400 8.962) 11.184 12.636 ( -3.544 0.767 15.921) 16.328 13.264 ( -1.875 1.649 -9.584) 9.904 14.839 ( -12.355 -0.626 6.788) 14.110 16.126 ( 2.912 -4.019 0.148) 4.965 16.276 ( 3.913 6.413 0.072) 7.513 16.730 ( -8.027 8.634 -19.108) 22.452 ======================= Grid point 324 (151/282) ======================= q-point: (-0.10 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.591 ( 5.177 3.123 32.103) 32.667 2.066 ( -15.824 4.064 32.625) 36.487 2.984 ( -25.111 10.721 32.651) 42.563 3.210 ( 4.173 1.399 6.993) 8.262 3.445 ( -3.769 0.584 6.488) 7.526 3.687 ( -2.038 -3.249 -1.855) 4.261 3.951 ( 0.308 1.782 20.279) 20.359 4.234 ( -6.226 -6.102 -0.063) 8.718 4.352 ( 1.100 7.015 -11.031) 13.119 4.566 ( -2.014 2.253 -6.608) 7.266 5.025 ( -3.480 -2.336 -14.872) 15.452 5.431 ( 6.261 0.136 -9.874) 11.692 5.490 ( -3.011 -0.939 -9.583) 10.089 5.901 ( 2.082 -7.950 -4.489) 9.364 6.028 ( 0.725 2.827 -5.031) 5.816 6.092 ( -3.909 -2.761 -3.325) 5.828 6.390 ( -7.735 3.798 -3.273) 9.217 6.751 ( -0.083 3.931 -9.325) 10.120 7.741 ( 5.791 -4.415 0.739) 7.319 7.841 ( 4.125 -4.083 -1.949) 6.123 7.873 ( 1.523 0.092 -3.050) 3.410 8.048 ( 3.405 -3.134 -1.679) 4.923 8.078 ( 2.922 1.351 -2.881) 4.320 8.255 ( 2.191 -7.316 -1.421) 7.768 8.284 ( 1.923 -0.321 -6.589) 6.871 8.418 ( 0.905 7.746 1.901) 8.027 8.812 ( -2.329 1.041 3.772) 4.553 8.873 ( 5.199 -0.360 10.733) 11.931 9.495 ( -4.076 0.676 5.235) 6.669 9.652 ( -3.151 -6.749 -5.494) 9.255 9.797 ( -0.531 2.567 -2.877) 3.892 10.130 ( -2.733 6.478 -8.893) 11.337 10.346 ( -4.256 -0.203 0.814) 4.337 10.506 ( 6.481 -4.955 -1.063) 8.227 10.591 ( 3.040 3.787 3.941) 6.255 10.956 ( 2.084 -0.112 -4.399) 4.869 11.074 ( -4.134 0.472 -1.663) 4.481 11.379 ( -2.991 -4.484 -12.185) 13.324 11.614 ( 13.574 -3.225 -5.165) 14.877 11.964 ( -11.484 2.478 -4.007) 12.413 12.190 ( 11.455 0.212 2.666) 11.763 12.431 ( -1.530 -2.237 5.929) 6.519 12.689 ( -9.413 1.384 15.792) 18.437 13.211 ( 7.720 1.491 -5.495) 9.593 14.772 ( -5.939 -0.005 7.861) 9.852 16.119 ( -11.461 -6.481 -13.354) 18.753 16.257 ( 1.364 1.572 -0.244) 2.095 16.367 ( -1.543 13.577 -5.424) 14.701 ======================= Grid point 326 (152/282) ======================= q-point: ( 0.10 0.10 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.712 ( 3.143 -0.000 20.220) 20.463 2.936 ( 3.509 -0.000 18.513) 18.843 3.309 ( 7.577 -0.000 2.129) 7.871 3.499 ( 2.841 -0.000 -5.438) 6.136 3.668 ( 4.416 -0.000 -15.149) 15.779 3.775 ( 0.742 -0.000 25.706) 25.716 3.981 ( -6.191 0.000 -5.278) 8.135 4.224 ( 6.676 -0.000 -4.946) 8.309 4.273 ( 8.855 -0.000 13.737) 16.344 4.475 ( -2.982 0.000 -10.773) 11.178 4.954 ( -4.559 0.000 -11.713) 12.569 5.075 ( 10.909 -0.000 24.010) 26.373 5.374 ( 3.461 -0.000 -9.810) 10.402 5.931 ( 2.865 -0.000 -2.005) 3.497 6.075 ( 5.488 -0.000 0.030) 5.488 6.143 ( 9.812 -0.000 -4.206) 10.675 6.324 ( 12.088 -0.000 1.668) 12.203 6.677 ( 14.311 -0.000 -16.823) 22.086 7.551 ( -10.432 0.000 -3.430) 10.982 7.690 ( -8.804 0.000 -3.377) 9.429 7.773 ( -6.319 0.000 -3.282) 7.121 7.806 ( -6.353 0.000 -9.891) 11.756 8.183 ( 8.123 -0.000 -0.918) 8.174 8.232 ( 10.511 -0.000 1.522) 10.621 8.270 ( -4.825 0.000 -1.378) 5.018 8.446 ( 1.243 -0.000 1.308) 1.804 9.051 ( 4.418 -0.000 8.093) 9.220 9.148 ( -2.144 0.000 3.223) 3.871 9.625 ( -3.712 0.000 9.770) 10.452 9.704 ( 6.805 -0.000 -0.099) 6.806 9.801 ( -5.621 0.000 14.543) 15.591 9.876 ( -1.586 0.000 2.830) 3.244 10.303 ( -0.141 0.000 -0.148) 0.205 10.484 ( -7.851 0.000 -2.663) 8.291 10.518 ( -12.859 0.000 -5.250) 13.890 10.817 ( -0.819 0.000 -6.295) 6.348 10.912 ( 4.411 -0.000 -0.378) 4.427 11.019 ( 10.452 -0.000 -8.640) 13.561 11.174 ( -8.572 0.000 -3.935) 9.433 11.926 ( 1.247 -0.000 -2.241) 2.565 12.035 ( -13.370 0.000 2.116) 13.537 12.400 ( -9.278 0.000 5.900) 10.995 12.947 ( 8.063 -0.000 6.104) 10.113 13.771 ( 13.784 -0.000 -3.734) 14.281 15.124 ( 7.675 -0.000 11.955) 14.207 15.511 ( 9.020 -0.000 -16.995) 19.241 16.063 ( -10.530 0.000 -0.339) 10.535 16.295 ( -2.874 0.000 0.677) 2.952 ======================= Grid point 327 (153/282) ======================= q-point: ( 0.20 0.10 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.919 ( 3.213 2.427 13.686) 14.266 3.071 ( -2.465 -1.579 8.226) 8.731 3.451 ( 6.111 1.172 -0.063) 6.223 3.485 ( 2.312 -1.113 -7.751) 8.165 3.559 ( 2.333 1.059 -9.416) 9.758 3.825 ( -11.532 2.952 4.303) 12.658 3.975 ( -3.058 -9.670 13.244) 16.681 4.225 ( -10.848 -1.513 -5.997) 12.488 4.376 ( 9.715 -2.346 -1.880) 10.169 4.648 ( 13.458 -0.720 8.698) 16.040 4.838 ( 3.503 -4.242 -7.144) 9.017 5.320 ( 7.320 3.271 1.710) 8.198 5.506 ( 13.825 -0.097 8.810) 16.394 5.980 ( 7.427 3.841 -1.397) 8.477 6.210 ( 12.135 2.059 -7.116) 14.218 6.232 ( 8.821 6.654 6.875) 13.014 6.522 ( 9.696 -6.995 -1.695) 12.076 6.788 ( 19.482 -1.291 -13.991) 24.020 7.337 ( -12.313 1.827 -2.189) 12.639 7.508 ( -11.417 -1.430 -2.190) 11.713 7.567 ( -10.286 1.854 -5.523) 11.821 7.651 ( -10.665 -5.806 -4.381) 12.909 8.141 ( -5.703 3.846 -2.342) 7.267 8.360 ( 12.412 2.912 0.451) 12.757 8.394 ( 5.407 2.242 3.023) 6.587 8.504 ( 8.855 1.840 2.241) 9.318 9.114 ( -3.328 2.569 2.000) 4.656 9.196 ( 4.459 -0.794 2.844) 5.348 9.622 ( -5.956 0.562 6.323) 8.705 9.781 ( 4.236 0.329 -1.946) 4.673 9.858 ( -9.111 -4.900 14.270) 17.625 9.910 ( -1.283 -2.308 3.715) 4.558 10.248 ( -11.678 2.206 -0.720) 11.906 10.328 ( -3.916 -0.204 2.308) 4.550 10.347 ( 0.384 -0.722 -7.496) 7.541 10.745 ( -0.811 2.924 -1.414) 3.348 10.971 ( 2.199 -0.183 -11.291) 11.505 11.026 ( 7.929 -3.017 -0.983) 8.540 11.180 ( 6.925 1.646 0.107) 7.119 11.842 ( -9.438 3.001 2.128) 10.130 11.915 ( -8.921 -3.887 3.721) 10.418 12.314 ( -6.552 0.046 1.697) 6.769 13.085 ( 5.458 3.405 2.813) 7.021 13.910 ( 9.805 -1.993 -6.938) 12.175 15.391 ( 9.884 0.949 15.219) 18.171 15.535 ( 13.633 -1.712 -15.001) 20.343 15.885 ( -13.464 -1.489 1.234) 13.602 16.278 ( -1.945 -4.103 0.841) 4.618 ======================= Grid point 328 (154/282) ======================= q-point: (-0.70 0.10 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.030 ( 0.176 4.454 8.018) 9.174 3.066 ( -6.276 -0.140 2.701) 6.834 3.333 ( 1.400 2.571 -16.395) 16.655 3.523 ( 1.870 0.636 -2.589) 3.257 3.565 ( 2.332 -0.372 0.231) 2.373 3.660 ( -14.661 7.616 9.189) 18.905 4.020 ( -10.955 -11.263 -6.927) 17.172 4.156 ( -3.066 -14.210 14.012) 20.191 4.456 ( 5.372 -0.492 -5.769) 7.898 4.781 ( -3.518 -10.271 6.386) 12.596 5.074 ( 19.566 0.517 1.570) 19.635 5.459 ( 13.085 6.752 -0.569) 14.735 5.728 ( 7.601 1.081 1.591) 7.841 6.046 ( 7.379 8.085 -0.385) 10.953 6.245 ( 6.490 11.138 1.366) 12.963 6.459 ( 15.409 -1.083 0.084) 15.447 6.706 ( 8.698 -7.271 -1.211) 11.401 6.911 ( 5.291 1.833 -6.483) 8.567 7.206 ( 3.022 1.378 -0.746) 3.404 7.343 ( -8.252 -5.267 -3.201) 10.299 7.365 ( -12.542 -5.429 -4.045) 14.253 7.498 ( -9.074 -4.832 -1.133) 10.342 7.984 ( -5.828 6.870 -2.740) 9.417 8.358 ( -2.960 8.011 2.605) 8.929 8.562 ( 14.593 4.527 -2.011) 15.411 8.681 ( 8.721 2.547 2.608) 9.453 9.047 ( -2.264 6.149 -1.027) 6.632 9.175 ( -3.948 3.209 -6.078) 7.926 9.583 ( -2.801 -2.070 -1.162) 3.672 9.790 ( -4.183 -2.437 1.977) 5.230 9.841 ( -11.007 -4.311 9.967) 15.462 9.960 ( 1.038 -5.826 1.129) 6.024 10.144 ( -6.579 -1.122 8.195) 10.569 10.213 ( -1.132 1.344 -6.538) 6.770 10.447 ( 7.221 -4.731 1.772) 8.813 10.751 ( 5.246 6.193 1.787) 8.311 10.934 ( 5.464 -1.947 -7.057) 9.135 11.180 ( 8.532 1.357 1.310) 8.738 11.260 ( 6.401 -0.264 -2.153) 6.759 11.718 ( -8.706 0.678 1.986) 8.956 11.831 ( -12.517 -4.089 9.170) 16.046 12.250 ( -1.832 0.636 -0.870) 2.126 13.105 ( 0.526 7.026 0.028) 7.046 13.941 ( 3.538 -2.181 -11.320) 12.059 15.544 ( -2.662 -0.367 -6.439) 6.977 15.709 ( 11.703 0.271 11.797) 16.619 15.793 ( 1.472 -1.357 4.351) 4.789 16.333 ( 2.446 -8.569 0.641) 8.934 ======================= Grid point 329 (155/282) ======================= q-point: (-0.60 0.10 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.895 ( -14.479 4.426 -4.088) 15.683 3.002 ( -7.339 9.461 7.367) 14.058 3.175 ( 1.926 2.014 -16.477) 16.711 3.459 ( -13.538 3.103 6.026) 15.140 3.513 ( -1.812 2.253 3.580) 4.601 3.614 ( 0.454 -0.498 4.312) 4.364 3.964 ( -5.812 -15.154 -0.287) 16.233 4.332 ( -3.913 -9.916 11.609) 15.761 4.494 ( 7.809 -5.166 -9.542) 13.368 4.900 ( -4.875 -14.148 10.626) 18.354 5.301 ( 12.493 7.365 -3.695) 14.966 5.519 ( 5.187 7.576 -3.077) 9.684 5.745 ( -1.129 7.335 -1.160) 7.512 6.047 ( 3.582 11.719 -0.366) 12.259 6.313 ( 6.648 3.659 4.217) 8.681 6.680 ( 10.851 -3.467 0.557) 11.405 6.737 ( -0.759 1.519 -8.256) 8.429 6.938 ( 2.009 -1.098 2.731) 3.564 7.130 ( -15.747 -4.577 -1.021) 16.431 7.279 ( 0.761 -8.095 -0.347) 8.138 7.389 ( 8.666 -2.648 -2.406) 9.375 7.494 ( 2.066 -5.393 2.210) 6.183 7.856 ( 3.733 6.159 -5.095) 8.822 8.248 ( -4.824 9.117 1.399) 10.409 8.675 ( 9.524 7.185 -4.825) 12.870 8.701 ( -5.106 1.233 1.207) 5.390 8.799 ( -14.084 5.406 -10.912) 18.619 9.140 ( 10.230 7.850 -4.819) 13.766 9.546 ( 0.028 -2.818 -5.507) 6.187 9.741 ( -11.674 -5.581 9.782) 16.220 9.853 ( -5.456 -6.555 7.542) 11.385 10.009 ( 3.243 -1.553 -4.873) 6.056 10.100 ( 4.254 0.627 -8.226) 9.282 10.266 ( -0.307 -3.900 10.978) 11.654 10.637 ( 9.550 -4.380 0.468) 10.517 10.810 ( 6.777 5.435 1.809) 8.874 11.051 ( 7.994 -4.705 3.696) 9.985 11.231 ( 7.163 7.519 -2.985) 10.805 11.360 ( 2.029 -3.878 -1.358) 4.583 11.565 ( -10.404 2.914 3.882) 11.481 11.857 ( -3.264 -7.883 10.235) 13.325 12.226 ( -0.057 1.854 0.295) 1.878 13.001 ( -4.569 9.187 -1.534) 10.374 13.834 ( -2.195 -1.453 -14.476) 14.713 15.356 ( -14.682 -2.616 -1.778) 15.018 15.932 ( 4.536 2.065 8.494) 9.848 16.000 ( 15.801 3.399 6.708) 17.499 16.502 ( 8.639 -11.723 0.338) 14.566 ======================= Grid point 330 (156/282) ======================= q-point: (-0.50 0.10 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.482 ( -21.976 12.287 -7.403) 26.243 2.820 ( -16.440 15.253 13.002) 25.922 3.078 ( 2.968 -1.156 -10.290) 10.772 3.354 ( -7.148 -4.599 3.257) 9.103 3.493 ( -6.272 1.262 6.910) 9.417 3.668 ( -0.249 0.430 6.079) 6.100 4.034 ( -4.373 -13.151 6.380) 15.257 4.396 ( -4.223 -1.116 5.544) 7.058 4.581 ( 7.809 -8.066 -9.302) 14.580 4.965 ( -15.046 -0.745 14.236) 20.727 5.230 ( 3.005 8.948 -11.754) 15.075 5.532 ( 3.174 1.209 -0.737) 3.476 5.630 ( -1.858 3.367 -5.309) 6.556 5.992 ( 0.073 9.808 0.709) 9.834 6.381 ( -3.525 0.316 -2.639) 4.415 6.613 ( -0.647 3.334 -2.309) 4.107 6.789 ( -3.206 2.441 -4.381) 5.953 6.992 ( 4.566 -2.180 2.819) 5.793 7.035 ( 0.710 -12.401 1.146) 12.474 7.345 ( -1.479 -0.320 2.999) 3.359 7.516 ( 5.250 -6.976 1.454) 8.850 7.594 ( 4.611 -0.105 1.689) 4.912 7.967 ( 18.034 0.292 -5.212) 18.774 8.137 ( -0.842 5.351 -1.249) 5.559 8.445 ( -14.109 0.493 -9.915) 17.252 8.565 ( -12.308 -1.635 1.970) 12.572 8.692 ( 7.304 8.640 -6.160) 12.882 9.138 ( 5.066 9.895 -6.547) 12.901 9.519 ( -0.125 -4.134 -5.793) 7.118 9.749 ( -3.453 -6.616 3.239) 8.135 9.879 ( -4.646 -5.432 3.803) 8.097 10.009 ( 7.623 8.840 -1.649) 11.789 10.175 ( 7.216 -9.259 -3.491) 12.247 10.393 ( 2.283 -3.217 5.518) 6.783 10.740 ( 5.114 2.080 -2.972) 6.270 10.909 ( 3.140 -1.557 1.714) 3.902 11.177 ( -6.642 0.034 0.842) 6.695 11.281 ( 9.684 6.974 -1.340) 12.009 11.404 ( 10.688 -3.112 8.253) 13.858 11.512 ( -1.047 1.967 0.086) 2.230 12.005 ( 0.486 -9.300 8.210) 12.415 12.217 ( -1.252 2.305 3.102) 4.062 12.822 ( -7.279 9.547 -0.313) 12.009 13.640 ( -4.978 -1.231 -14.794) 15.658 15.142 ( -16.053 -2.782 2.093) 16.426 16.028 ( 1.753 2.670 5.585) 6.434 16.243 ( 13.195 7.526 5.079) 16.017 16.744 ( 11.883 -10.434 -2.457) 16.003 ======================= Grid point 331 (157/282) ======================= q-point: (-0.40 0.10 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.972 ( -22.510 16.536 -1.445) 27.968 2.560 ( -20.900 17.603 18.916) 33.234 3.068 ( 2.292 -0.898 -1.951) 3.141 3.371 ( -2.235 -8.779 4.098) 9.943 3.442 ( -7.959 -0.483 5.796) 9.857 3.708 ( -2.331 2.506 7.451) 8.199 4.111 ( -9.903 -6.021 13.302) 17.643 4.298 ( -12.937 13.449 9.968) 21.157 4.626 ( 4.282 0.499 -6.783) 8.037 4.801 ( -7.479 1.775 0.529) 7.704 5.119 ( 1.214 -0.434 -14.285) 14.343 5.530 ( 1.715 -2.544 -10.952) 11.374 5.599 ( -0.249 -2.717 3.529) 4.461 5.918 ( -4.295 2.577 0.750) 5.065 6.157 ( -13.053 1.433 -7.236) 14.994 6.574 ( -4.714 8.324 -10.201) 13.985 6.607 ( 1.443 3.634 -2.558) 4.672 7.186 ( 7.734 -7.474 1.604) 10.874 7.234 ( 4.588 -2.890 8.954) 10.468 7.324 ( -3.646 -8.027 5.062) 10.167 7.606 ( 2.685 0.175 -2.181) 3.464 7.717 ( 7.141 -5.030 3.062) 9.256 8.102 ( 5.754 1.204 -8.719) 10.516 8.189 ( 1.114 -3.535 0.023) 3.707 8.247 ( 5.163 -3.489 -5.927) 8.600 8.416 ( -11.523 -2.984 3.534) 12.417 8.686 ( 6.936 7.343 -3.220) 10.602 9.041 ( -0.038 8.949 -4.833) 10.171 9.497 ( -1.037 -4.452 -3.281) 5.627 9.714 ( -4.747 -2.467 -4.346) 6.892 9.886 ( 0.662 -2.814 -2.944) 4.126 10.122 ( 12.954 3.919 0.577) 13.546 10.330 ( 3.476 -7.857 2.644) 8.989 10.480 ( 2.067 -3.547 -0.851) 4.193 10.715 ( 0.114 5.792 -5.305) 7.855 10.925 ( -3.116 -6.746 -0.420) 7.443 11.096 ( 0.309 6.691 2.225) 7.058 11.370 ( 10.851 7.847 -3.056) 13.735 11.445 ( -2.409 2.801 -2.554) 4.491 11.747 ( 14.260 -5.984 8.587) 17.688 12.123 ( 0.279 -5.543 1.945) 5.881 12.221 ( -4.186 -1.997 6.313) 7.834 12.676 ( -5.263 8.153 6.098) 11.462 13.438 ( -4.544 -0.738 -12.239) 13.076 14.961 ( -14.790 -1.694 5.449) 15.852 16.066 ( 0.055 1.025 2.844) 3.024 16.375 ( 8.249 9.610 2.281) 12.869 16.916 ( 9.495 -3.602 -9.367) 13.815 ======================= Grid point 332 (158/282) ======================= q-point: (-0.30 0.10 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.619 ( -13.057 15.475 14.572) 24.946 2.320 ( -20.641 17.096 25.077) 36.704 3.113 ( 1.900 0.259 3.754) 4.215 3.374 ( -8.445 -0.506 4.451) 9.559 3.482 ( 0.902 -8.905 5.150) 10.327 3.663 ( -10.875 12.774 12.906) 21.166 4.002 ( -15.864 16.434 24.228) 33.298 4.181 ( -8.742 -2.700 7.953) 12.123 4.600 ( 5.648 6.567 -9.541) 12.886 4.718 ( -0.223 -1.328 -9.887) 9.978 5.006 ( -0.996 -6.749 -12.364) 14.121 5.486 ( 2.910 -4.639 -10.918) 12.214 5.590 ( -3.188 2.802 -2.740) 5.052 5.850 ( -6.752 -6.144 -1.406) 9.237 5.931 ( -6.899 -2.387 -3.495) 8.094 6.345 ( -2.920 8.770 -9.868) 13.521 6.553 ( 1.389 3.309 -7.361) 8.189 7.080 ( -9.045 8.038 -3.745) 12.667 7.453 ( 9.875 -4.771 5.191) 12.134 7.594 ( 5.074 -19.760 9.901) 22.677 7.662 ( 4.373 -3.600 0.470) 5.683 7.848 ( 1.817 -3.709 0.599) 4.173 8.073 ( 0.029 -4.572 -2.448) 5.187 8.212 ( 1.977 -1.284 -8.614) 8.931 8.249 ( -1.378 -3.666 -0.934) 4.027 8.457 ( 6.894 -0.293 1.621) 7.089 8.742 ( 6.762 4.259 2.641) 8.416 8.927 ( -1.583 7.250 -2.504) 7.832 9.493 ( -1.311 -3.537 -0.026) 3.772 9.604 ( -5.296 -3.543 -5.423) 8.367 9.876 ( 0.359 1.260 -2.105) 2.479 10.297 ( 12.221 -1.793 -3.751) 12.909 10.390 ( -4.490 -2.975 1.014) 5.480 10.506 ( 2.108 1.644 -4.409) 5.156 10.568 ( -1.487 6.860 -5.509) 8.923 10.952 ( 0.457 -5.910 -3.863) 7.075 11.106 ( 2.648 4.889 4.246) 6.996 11.337 ( -3.582 -5.494 -7.114) 9.676 11.469 ( 11.059 6.984 -2.996) 13.418 12.008 ( 8.340 -2.306 0.870) 8.697 12.154 ( -4.059 -3.138 0.008) 5.131 12.251 ( 0.279 -3.326 8.412) 9.050 12.676 ( -2.621 4.299 13.673) 14.571 13.289 ( -1.178 1.114 -8.520) 8.673 14.832 ( -11.348 -0.079 7.639) 13.680 16.076 ( -1.541 -2.348 0.271) 2.822 16.399 ( 3.552 9.213 -0.409) 9.883 16.862 ( 1.731 7.709 -16.292) 18.107 ======================= Grid point 333 (159/282) ======================= q-point: (-0.20 0.10 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.679 ( 3.678 8.295 29.047) 30.432 2.197 ( -14.799 13.071 29.627) 35.604 3.171 ( -3.422 5.886 9.898) 12.014 3.279 ( -5.614 5.955 8.599) 11.872 3.512 ( -8.683 13.517 16.625) 23.119 3.606 ( 1.216 -6.231 -0.037) 6.349 4.008 ( -3.346 6.341 22.195) 23.324 4.149 ( -9.253 -4.361 7.988) 12.979 4.475 ( 1.615 8.811 -14.087) 16.694 4.607 ( -1.337 1.737 -9.293) 9.548 4.958 ( 1.019 -6.111 -10.909) 12.545 5.448 ( -4.822 -2.554 -8.616) 10.199 5.453 ( 3.903 0.699 -10.932) 11.629 5.801 ( 0.228 -4.607 -3.165) 5.594 5.900 ( -5.219 -10.897 -0.068) 12.083 6.173 ( 0.372 7.125 -8.372) 10.999 6.456 ( -1.351 4.281 -7.316) 8.583 6.843 ( -4.283 6.795 -9.591) 12.510 7.654 ( 5.882 -5.605 2.515) 8.505 7.762 ( 3.352 -5.442 0.155) 6.393 7.849 ( -4.110 -4.998 0.059) 6.470 7.902 ( 4.974 -13.078 7.061) 15.673 8.110 ( 5.201 -0.248 -5.726) 7.739 8.147 ( -3.015 -6.186 -1.541) 7.052 8.278 ( 4.336 -0.247 -6.583) 7.887 8.524 ( 4.219 4.889 -2.399) 6.889 8.848 ( -2.142 3.939 2.459) 5.113 8.871 ( 4.626 0.369 7.703) 8.993 9.508 ( -1.243 -0.517 3.654) 3.894 9.531 ( -3.669 -6.388 -2.370) 7.739 9.831 ( -2.616 1.953 -1.270) 3.503 10.290 ( -3.702 13.064 -9.450) 16.543 10.337 ( -3.411 -1.235 -0.401) 3.650 10.434 ( 7.495 -3.841 -3.244) 9.025 10.617 ( 5.939 -1.551 -1.141) 6.243 10.941 ( 0.791 -2.576 -5.514) 6.137 11.102 ( -3.577 3.840 0.410) 5.264 11.243 ( -6.150 -10.590 -11.051) 16.495 11.598 ( 14.299 1.374 -3.314) 14.742 11.995 ( -9.084 0.959 -3.675) 9.846 12.189 ( 8.786 -0.725 2.541) 9.175 12.374 ( -2.181 -4.625 6.988) 8.659 12.726 ( -7.874 3.218 15.425) 17.614 13.248 ( 7.832 2.881 -4.969) 9.713 14.776 ( -5.854 0.756 8.603) 10.433 16.032 ( -5.742 -4.039 -6.387) 9.491 16.340 ( -0.485 7.915 -2.314) 8.260 16.601 ( -1.650 15.806 -11.484) 19.607 ======================= Grid point 334 (160/282) ======================= q-point: (-0.10 0.10 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.081 ( 12.708 2.205 30.544) 33.156 2.262 ( -4.621 7.819 29.972) 31.318 3.121 ( -6.720 12.233 19.375) 23.879 3.358 ( 5.308 -1.209 4.094) 6.811 3.502 ( -1.404 9.050 13.844) 16.599 3.624 ( 1.249 -1.901 -4.887) 5.391 4.115 ( -6.577 -2.692 5.779) 9.160 4.175 ( 0.724 2.875 9.102) 9.573 4.323 ( -2.005 4.322 3.786) 6.086 4.485 ( -0.163 1.159 -7.827) 7.914 4.853 ( -0.401 3.660 -13.420) 13.915 5.310 ( -4.259 -3.278 -10.502) 11.797 5.431 ( 6.275 -2.214 -10.968) 12.828 5.857 ( 2.366 -8.147 -1.603) 8.633 5.911 ( -2.859 -10.805 -0.983) 11.220 6.097 ( 5.850 6.357 -5.828) 10.421 6.290 ( -6.058 7.547 -4.719) 10.767 6.699 ( 5.412 3.049 -14.066) 15.377 7.748 ( -0.943 -3.711 -0.343) 3.845 7.813 ( 0.426 -2.455 -0.265) 2.506 7.841 ( 1.083 -5.137 -3.052) 6.073 8.040 ( 0.813 -4.707 -1.626) 5.046 8.103 ( 3.098 2.638 -5.799) 7.084 8.191 ( -2.414 -4.745 -1.063) 5.428 8.256 ( 4.110 -4.400 -5.813) 8.369 8.487 ( 1.046 5.631 -3.743) 6.842 8.845 ( -1.190 1.642 7.137) 7.420 9.017 ( 1.629 -1.576 9.946) 10.200 9.522 ( -3.419 1.852 8.435) 9.288 9.551 ( 1.165 -5.220 -0.858) 5.417 9.759 ( -4.559 1.158 2.402) 5.282 10.081 ( -2.169 9.517 -6.618) 11.793 10.310 ( -0.870 -0.678 -0.350) 1.157 10.527 ( 2.203 -5.976 0.025) 6.369 10.704 ( 6.200 1.137 -1.590) 6.501 10.920 ( 2.485 -2.382 -7.510) 8.261 10.979 ( -7.248 2.099 -1.126) 7.629 11.093 ( -7.348 -7.562 -11.792) 15.819 11.734 ( -8.111 2.913 -5.677) 10.320 11.785 ( 6.544 -0.598 -5.174) 8.364 12.359 ( -8.460 -1.798 3.688) 9.402 12.382 ( 8.176 -1.826 3.626) 9.128 12.691 ( -11.080 2.446 15.139) 18.919 13.379 ( 15.137 2.906 -1.966) 15.538 14.812 ( -0.239 0.501 8.881) 8.899 15.814 ( -5.816 3.369 -15.386) 16.790 16.267 ( -2.423 2.485 0.352) 3.489 16.426 ( -0.218 10.693 -2.746) 11.042 ======================= Grid point 337 (161/282) ======================= q-point: ( 0.20 0.20 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.059 ( -5.903 0.000 3.200) 6.715 3.072 ( 3.412 -0.000 3.850) 5.144 3.364 ( 0.763 -0.000 -13.105) 13.127 3.527 ( 2.242 -0.000 -0.950) 2.435 3.564 ( 2.524 -0.000 -0.492) 2.571 3.745 ( -7.674 0.000 5.097) 9.212 3.903 ( -16.287 0.000 -10.520) 19.389 4.035 ( -5.176 0.000 21.041) 21.668 4.460 ( 4.010 -0.000 -3.271) 5.175 4.693 ( -4.341 0.000 3.865) 5.812 5.078 ( 21.304 -0.000 2.247) 21.422 5.513 ( 14.802 -0.000 -3.105) 15.124 5.736 ( 7.592 -0.000 4.792) 8.978 6.113 ( 8.373 -0.000 -0.069) 8.374 6.343 ( 11.488 -0.000 -4.920) 12.497 6.539 ( 11.628 -0.000 13.464) 17.790 6.547 ( 7.805 -0.000 -9.355) 12.183 6.927 ( 6.441 -0.000 -6.633) 9.246 7.222 ( 0.658 -0.000 -0.044) 0.660 7.303 ( -11.632 0.000 -0.949) 11.671 7.319 ( -10.782 0.000 -8.336) 13.628 7.456 ( -8.510 0.000 -1.070) 8.577 8.038 ( -6.180 0.000 -2.828) 6.796 8.422 ( -3.950 0.000 3.356) 5.183 8.597 ( 15.312 -0.000 -1.632) 15.399 8.698 ( 7.762 -0.000 1.985) 8.012 9.108 ( 2.411 -0.000 0.229) 2.421 9.197 ( -5.134 0.000 -8.529) 9.955 9.561 ( -3.031 0.000 -0.844) 3.146 9.772 ( 2.129 -0.000 -8.270) 8.540 9.791 ( -20.013 0.000 20.802) 28.866 9.919 ( 0.147 -0.000 1.462) 1.470 10.136 ( -9.177 0.000 13.800) 16.573 10.244 ( 3.160 -0.000 -12.786) 13.170 10.398 ( 5.253 -0.000 3.362) 6.236 10.800 ( 3.663 -0.000 5.386) 6.513 10.926 ( 7.299 -0.000 -11.561) 13.672 11.158 ( 8.919 -0.000 2.199) 9.186 11.284 ( 5.811 -0.000 -1.807) 6.086 11.724 ( -7.364 0.000 2.295) 7.714 11.797 ( -14.157 0.000 8.082) 16.302 12.256 ( -1.252 0.000 -0.888) 1.535 13.162 ( 0.415 -0.000 0.486) 0.638 13.923 ( 4.360 -0.000 -11.494) 12.293 15.542 ( -2.868 0.000 -9.486) 9.910 15.711 ( 8.705 -0.000 18.261) 20.230 15.785 ( 6.911 -0.000 0.856) 6.963 16.262 ( 1.701 -0.000 0.471) 1.764 ======================= Grid point 338 (162/282) ======================= q-point: (-0.70 0.20 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.944 ( -9.625 1.787 -2.008) 9.993 3.079 ( 2.662 1.251 -9.110) 9.573 3.265 ( -3.086 6.989 -1.040) 7.711 3.508 ( -16.820 3.008 -3.922) 17.531 3.537 ( -2.943 0.711 4.064) 5.068 3.619 ( 2.798 1.467 1.681) 3.579 3.746 ( -5.296 -11.931 1.310) 13.120 4.199 ( -5.150 -5.329 21.673) 22.906 4.469 ( 4.879 0.372 -6.152) 7.861 4.726 ( -2.716 -7.086 8.403) 11.322 5.364 ( 15.731 1.653 -2.450) 16.006 5.593 ( 8.153 2.079 -15.432) 17.577 5.865 ( 0.874 5.799 10.205) 11.770 6.193 ( 3.484 5.680 1.082) 6.751 6.411 ( 5.392 7.707 -2.132) 9.645 6.588 ( 7.139 -7.068 -7.623) 12.611 6.778 ( 1.330 4.212 4.382) 6.222 6.896 ( -1.799 -4.775 3.765) 6.342 7.056 ( -12.851 -4.664 -1.710) 13.778 7.154 ( -7.513 -4.034 -1.003) 8.586 7.392 ( 12.988 1.341 -3.732) 13.580 7.429 ( 5.920 -3.034 0.654) 6.684 7.927 ( 0.376 2.661 -5.326) 5.965 8.347 ( -7.149 3.470 1.693) 8.125 8.697 ( -8.362 -0.132 1.157) 8.443 8.742 ( 4.211 1.404 -4.368) 6.228 8.896 ( -8.546 4.825 -15.842) 18.635 9.226 ( 13.546 3.118 -4.521) 14.617 9.519 ( 0.489 -0.683 -5.838) 5.898 9.685 ( -17.166 -1.750 16.941) 24.181 9.745 ( -0.591 -5.229 -2.004) 5.631 9.945 ( 1.912 -3.484 -2.483) 4.686 10.178 ( 5.235 5.403 -6.411) 9.884 10.234 ( -0.432 -1.136 13.815) 13.868 10.566 ( 9.548 -3.654 4.399) 11.130 10.887 ( 5.847 3.429 -1.696) 6.988 10.998 ( 6.662 -1.944 2.540) 7.390 11.297 ( 4.200 -3.106 0.201) 5.228 11.315 ( 5.447 2.925 -4.458) 7.622 11.631 ( -9.564 5.438 6.661) 12.861 11.740 ( -3.516 -7.140 7.515) 10.946 12.252 ( 1.020 1.065 0.340) 1.513 13.106 ( -5.360 3.900 -0.517) 6.649 13.815 ( -1.529 -0.828 -15.138) 15.238 15.330 ( -14.246 -0.827 -2.501) 14.487 15.965 ( 2.666 1.704 14.738) 15.074 16.034 ( 20.818 1.044 1.790) 20.921 16.362 ( 8.565 -5.537 0.344) 10.205 ======================= Grid point 339 (163/282) ======================= q-point: (-0.60 0.20 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.670 ( -14.823 11.505 -6.512) 19.862 3.015 ( -0.730 4.748 -2.281) 5.318 3.102 ( -6.772 8.014 -0.826) 10.525 3.261 ( -12.677 -5.956 -1.609) 14.099 3.503 ( -8.339 -0.420 6.895) 10.829 3.683 ( 1.939 1.269 4.823) 5.351 3.843 ( -1.008 -11.396 7.838) 13.868 4.346 ( -6.082 -4.049 17.296) 18.775 4.504 ( 9.495 -1.778 -9.613) 13.628 4.853 ( -3.403 -9.152 11.327) 14.955 5.398 ( 2.554 8.674 -14.454) 17.049 5.536 ( 5.123 -1.673 -10.823) 12.091 5.782 ( -10.682 16.862 8.895) 21.853 6.171 ( 1.272 10.357 -0.727) 10.460 6.382 ( -3.753 0.282 -4.113) 5.575 6.629 ( -2.870 -7.382 -0.094) 7.920 6.779 ( 2.765 0.345 1.193) 3.031 6.877 ( -6.160 -2.859 -3.573) 7.674 6.962 ( 0.185 -2.219 -0.121) 2.230 7.244 ( 5.264 -12.552 4.070) 14.207 7.472 ( -0.679 0.760 0.668) 1.219 7.587 ( 8.227 -0.470 4.551) 9.413 7.983 ( 18.152 1.325 -9.660) 20.605 8.211 ( -6.240 3.765 -0.914) 7.345 8.451 ( -17.316 0.312 -10.528) 20.268 8.537 ( -13.904 -1.732 1.158) 14.059 8.812 ( 7.322 6.185 -9.144) 13.247 9.267 ( 5.012 6.792 -8.535) 12.004 9.477 ( 0.624 -1.225 -5.783) 5.944 9.669 ( -4.524 -2.885 8.926) 10.414 9.790 ( -1.204 -5.985 1.497) 6.286 10.000 ( 5.387 -9.360 -4.436) 11.675 10.185 ( 10.245 9.296 -4.450) 14.532 10.365 ( 1.215 -0.678 8.623) 8.734 10.749 ( 5.566 -0.426 0.926) 5.659 10.922 ( 2.357 2.432 -0.351) 3.405 11.129 ( 0.752 -4.678 3.589) 5.944 11.332 ( 3.129 -1.722 2.392) 4.299 11.391 ( 10.755 1.886 -0.802) 10.949 11.571 ( -0.694 6.082 3.773) 7.191 11.866 ( 1.002 -8.578 7.515) 11.448 12.259 ( -0.178 2.556 1.910) 3.195 12.954 ( -8.669 7.101 1.424) 11.296 13.615 ( -5.228 -1.856 -15.872) 16.813 15.111 ( -14.802 -1.327 1.685) 14.956 16.066 ( -1.182 2.066 8.250) 8.587 16.345 ( 17.742 5.856 3.375) 18.986 16.592 ( 13.780 -8.977 -0.850) 16.468 ======================= Grid point 340 (164/282) ======================= q-point: (-0.50 0.20 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.245 ( -16.699 18.836 -3.738) 25.448 2.844 ( -15.617 18.342 14.686) 28.214 3.058 ( 3.089 -0.418 -1.802) 3.601 3.176 ( -5.850 -15.039 -2.557) 16.338 3.441 ( -9.112 -1.050 7.094) 11.596 3.746 ( 0.760 2.356 6.534) 6.988 3.994 ( -3.554 -7.890 13.118) 15.715 4.407 ( -5.546 0.666 11.357) 12.656 4.589 ( 10.974 -3.039 -10.034) 15.177 4.896 ( -12.293 3.932 12.486) 17.958 5.162 ( -2.322 7.557 -15.185) 17.120 5.488 ( 1.416 -2.474 -12.977) 13.286 5.604 ( -7.329 7.262 6.942) 12.436 6.053 ( -3.013 11.780 -3.047) 12.535 6.180 ( -10.895 1.343 -7.616) 13.361 6.669 ( 0.763 3.420 0.488) 3.538 6.689 ( -3.427 6.766 -9.646) 12.271 6.914 ( -1.542 -23.914 6.473) 24.822 7.085 ( 7.763 -6.907 -1.446) 10.491 7.374 ( -1.614 2.923 6.320) 7.148 7.543 ( 5.501 -8.967 1.639) 10.647 7.687 ( 0.537 1.334 3.806) 4.068 8.106 ( -5.934 -0.235 -5.603) 8.164 8.150 ( 1.087 -1.235 0.050) 1.646 8.214 ( 13.201 -0.990 -12.482) 18.194 8.358 ( -12.932 -4.180 1.935) 13.728 8.786 ( 5.464 5.224 -5.584) 9.398 9.166 ( -0.277 7.144 -6.503) 9.664 9.449 ( 0.456 -1.269 -3.484) 3.736 9.683 ( -1.828 -1.128 -3.590) 4.183 9.816 ( -0.060 -4.719 1.033) 4.831 10.154 ( 6.124 -14.100 -4.717) 16.080 10.255 ( 11.960 10.274 -0.724) 15.784 10.442 ( 1.893 -1.372 0.710) 2.443 10.765 ( 0.528 0.692 -3.856) 3.953 10.883 ( -3.850 1.907 0.501) 4.325 11.164 ( 1.089 1.978 3.164) 3.887 11.468 ( 8.829 1.871 -1.369) 9.129 11.500 ( -0.117 5.493 -4.419) 7.051 11.659 ( 13.551 -4.169 8.911) 16.746 12.012 ( 0.612 -7.761 5.643) 9.615 12.237 ( -2.606 2.745 2.317) 4.438 12.803 ( -7.763 8.358 7.082) 13.427 13.410 ( -4.760 -3.000 -12.718) 13.907 14.943 ( -13.082 -0.687 5.832) 14.340 16.080 ( -2.801 0.769 3.771) 4.760 16.514 ( 8.669 8.317 1.918) 12.165 16.849 ( 15.361 -4.928 -6.199) 17.282 ======================= Grid point 341 (165/282) ======================= q-point: (-0.40 0.20 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.890 ( -10.664 19.710 7.984) 23.790 2.611 ( -17.173 20.082 20.155) 33.233 3.102 ( 0.513 -3.801 2.144) 4.394 3.237 ( -0.248 -12.306 -2.060) 12.480 3.413 ( -4.305 -2.026 8.946) 10.133 3.793 ( -0.183 5.190 7.896) 9.451 4.078 ( -10.912 -2.530 17.678) 20.928 4.387 ( -7.984 15.761 15.899) 23.769 4.655 ( 8.058 0.354 -11.437) 13.995 4.708 ( -8.829 7.213 3.830) 12.026 4.959 ( -2.527 0.134 -15.084) 15.294 5.398 ( -0.102 -5.689 -11.746) 13.052 5.579 ( -4.055 -3.026 4.052) 6.482 5.852 ( -7.235 6.259 -5.497) 11.034 5.964 ( -4.196 5.349 -6.684) 9.534 6.468 ( -3.903 7.344 -10.704) 13.556 6.615 ( 0.870 4.868 -6.495) 8.164 7.126 ( -3.631 -1.770 -7.965) 8.931 7.218 ( 1.475 -28.216 11.621) 30.551 7.435 ( 5.288 1.729 7.826) 9.602 7.627 ( 0.448 -1.062 3.003) 3.217 7.779 ( 2.920 -6.271 1.358) 7.049 7.986 ( -4.639 -5.585 -0.748) 7.299 8.172 ( -9.491 -3.747 -0.765) 10.233 8.212 ( 6.409 -1.866 -3.453) 7.515 8.427 ( 13.221 -2.697 -5.106) 14.427 8.806 ( 5.523 3.540 -0.525) 6.581 9.041 ( -1.164 7.129 -5.356) 8.993 9.442 ( -0.216 -1.808 -1.151) 2.154 9.587 ( -3.095 0.730 -5.318) 6.196 9.863 ( -0.965 -3.030 1.946) 3.728 10.270 ( 5.604 -10.708 -8.785) 14.941 10.333 ( 4.974 3.077 -1.442) 6.024 10.479 ( 4.412 -2.225 -3.703) 6.175 10.682 ( -2.167 5.402 -6.953) 9.068 10.859 ( 0.501 -2.814 -0.627) 2.926 11.202 ( 2.731 6.404 4.137) 8.099 11.332 ( -6.128 2.530 -8.796) 11.015 11.561 ( 8.460 4.908 -3.181) 10.285 11.957 ( 9.999 -4.488 3.129) 11.398 12.091 ( -2.111 -4.652 2.708) 5.782 12.221 ( -0.991 0.171 5.692) 5.781 12.754 ( -4.798 5.830 13.268) 15.266 13.286 ( -0.604 -1.675 -7.526) 7.734 14.839 ( -9.957 0.996 8.848) 13.358 16.052 ( -3.687 -0.988 0.598) 3.864 16.539 ( 3.063 8.591 -0.826) 9.158 16.952 ( 8.778 4.098 -12.465) 15.787 ======================= Grid point 342 (166/282) ======================= q-point: (-0.30 0.20 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.842 ( 1.554 13.134 22.710) 26.280 2.444 ( -12.999 18.357 23.972) 32.873 3.169 ( -0.041 -7.796 -0.321) 7.803 3.264 ( -0.613 -2.145 2.228) 3.153 3.529 ( 3.221 -3.161 6.870) 8.220 3.804 ( -1.996 14.847 12.710) 19.646 4.078 ( -13.761 -1.294 20.513) 24.735 4.250 ( -9.841 24.350 22.062) 34.300 4.570 ( -0.975 -2.668 -13.631) 13.924 4.625 ( 1.126 6.501 -11.922) 13.626 4.862 ( 4.566 -5.694 -7.684) 10.598 5.345 ( -1.177 -8.066 -9.795) 12.743 5.511 ( -4.565 2.602 -5.727) 7.772 5.720 ( -3.715 -3.978 -1.218) 5.577 5.839 ( -0.347 3.074 -5.187) 6.039 6.275 ( -0.683 6.212 -9.922) 11.725 6.516 ( -0.316 3.500 -8.156) 8.881 6.933 ( -4.348 4.905 -11.466) 13.207 7.557 ( 1.920 -20.746 9.420) 22.865 7.606 ( 5.165 -7.038 5.773) 10.466 7.691 ( 0.204 -3.693 3.822) 5.319 7.821 ( -1.294 -3.175 1.228) 3.642 8.019 ( 0.523 -8.452 -2.718) 8.894 8.093 ( -2.447 -3.995 -1.082) 4.808 8.273 ( 4.244 -0.771 -3.863) 5.791 8.559 ( 8.578 0.325 -5.731) 10.322 8.885 ( 4.305 1.296 4.872) 6.629 8.926 ( -1.885 5.598 -2.343) 6.355 9.428 ( -1.519 -3.854 -2.895) 5.054 9.535 ( -0.456 1.564 3.176) 3.569 9.854 ( -3.810 0.664 1.884) 4.302 10.284 ( -2.927 -6.857 -4.190) 8.552 10.394 ( 10.115 -1.659 -8.849) 13.541 10.490 ( -4.917 10.343 -6.493) 13.165 10.538 ( 5.138 -5.466 -6.040) 9.631 10.882 ( 1.560 -3.550 -4.038) 5.598 11.139 ( -4.964 -2.732 -11.143) 12.501 11.194 ( -2.913 7.464 1.531) 8.158 11.627 ( 8.579 1.727 -2.294) 9.047 11.997 ( -6.041 -0.570 -2.964) 6.753 12.164 ( 6.656 -2.500 2.669) 7.594 12.312 ( -0.347 -2.804 7.521) 8.034 12.778 ( -8.466 3.556 15.916) 18.375 13.284 ( 8.212 1.429 -3.748) 9.140 14.800 ( -5.490 2.418 9.991) 11.653 15.993 ( -3.934 -1.450 -3.475) 5.446 16.472 ( -0.454 8.755 -2.989) 9.262 16.821 ( 0.852 12.591 -13.077) 18.174 ======================= Grid point 343 (167/282) ======================= q-point: (-0.20 0.20 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.127 ( 7.681 4.235 29.314) 30.598 2.437 ( -1.888 14.495 25.066) 29.017 3.178 ( -2.319 -5.839 -2.283) 6.685 3.365 ( 7.017 1.453 6.015) 9.356 3.608 ( 1.820 0.576 -1.116) 2.211 3.776 ( -2.465 23.826 21.367) 32.098 4.080 ( -11.840 -1.641 15.055) 19.223 4.250 ( 0.786 7.959 8.467) 11.647 4.389 ( -0.834 3.328 -3.300) 4.761 4.503 ( -2.367 2.396 -6.464) 7.289 4.909 ( 6.276 2.096 -8.475) 10.752 5.250 ( -4.611 -4.295 -9.668) 11.541 5.395 ( 1.885 -1.727 -10.641) 10.944 5.717 ( -3.687 -8.971 0.478) 9.711 5.810 ( 2.718 -1.912 -3.358) 4.724 6.180 ( 5.017 4.689 -7.229) 9.971 6.383 ( -3.974 4.402 -6.394) 8.721 6.760 ( 4.501 5.007 -14.644) 16.118 7.700 ( -0.004 -2.363 2.267) 3.275 7.743 ( 0.151 -6.211 1.804) 6.470 7.766 ( -0.880 -7.103 1.662) 7.347 7.908 ( 0.690 -11.072 4.480) 11.965 8.055 ( 0.545 -8.384 -1.367) 8.512 8.112 ( 2.813 -2.953 -4.641) 6.179 8.253 ( 0.183 0.758 -7.432) 7.473 8.553 ( 1.804 3.219 -7.762) 8.594 8.874 ( -1.756 1.862 4.778) 5.420 9.003 ( 2.423 0.098 8.456) 8.797 9.443 ( -0.224 -5.621 1.420) 5.802 9.584 ( 2.224 3.234 6.719) 7.781 9.785 ( -5.383 2.426 2.240) 6.315 10.214 ( -3.830 1.803 -6.281) 7.574 10.316 ( -0.167 5.486 -3.183) 6.345 10.455 ( 3.384 -2.976 -4.440) 6.326 10.614 ( 5.728 -11.391 -8.829) 15.509 10.888 ( 2.275 -1.719 -3.940) 4.864 10.991 ( -3.194 -4.339 -12.385) 13.506 11.053 ( -7.829 6.443 -0.009) 10.139 11.743 ( 8.387 -1.391 -3.035) 9.027 11.805 ( -12.131 2.722 -4.493) 13.219 12.326 ( 1.552 -2.813 3.816) 4.988 12.352 ( 0.312 -1.464 4.686) 4.919 12.734 ( -12.563 3.020 15.181) 19.935 13.431 ( 15.411 3.478 -1.204) 15.844 14.833 ( -0.646 2.410 9.881) 10.191 15.867 ( -2.545 3.120 -11.263) 11.961 16.349 ( -3.502 7.558 -1.888) 8.542 16.610 ( -1.739 12.696 -6.316) 14.287 ======================= Grid point 344 (168/282) ======================= q-point: (-0.10 0.20 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.449 ( -0.923 0.056 27.519) 27.534 2.693 ( 13.972 9.615 23.307) 28.825 3.184 ( 1.161 -4.089 -0.969) 4.359 3.525 ( 8.182 4.479 3.504) 9.964 3.588 ( 1.020 0.631 -2.233) 2.535 3.826 ( 4.485 18.888 18.225) 26.627 4.061 ( -8.372 -2.173 12.300) 15.037 4.103 ( 0.860 0.063 -18.903) 18.922 4.375 ( -4.475 6.606 -0.986) 8.040 4.611 ( 6.183 0.349 19.589) 20.545 4.833 ( 4.064 10.651 -6.285) 13.018 5.121 ( -2.836 -1.701 -10.004) 10.536 5.355 ( 1.500 -6.267 -10.845) 12.615 5.760 ( 0.257 -10.058 -0.466) 10.072 5.882 ( 4.949 -7.134 -1.443) 8.802 6.177 ( 1.615 4.916 -4.096) 6.599 6.267 ( 6.586 5.280 -4.199) 9.428 6.701 ( 10.746 3.647 -15.711) 19.381 7.686 ( -4.121 -1.413 -1.170) 4.511 7.763 ( -3.803 -3.719 -1.140) 5.440 7.796 ( -1.720 -1.916 -0.479) 2.619 7.992 ( 1.268 -6.291 -2.846) 7.020 8.086 ( 0.555 -0.184 -3.319) 3.370 8.124 ( -0.189 -1.299 -2.678) 2.982 8.205 ( 2.176 -8.182 -3.892) 9.318 8.454 ( -2.205 1.201 -5.653) 6.186 8.933 ( -0.132 0.113 10.471) 10.472 9.109 ( 1.343 -0.419 6.161) 6.320 9.510 ( -2.389 -4.949 7.479) 9.281 9.643 ( 2.909 6.106 3.055) 7.421 9.765 ( -0.475 0.369 7.289) 7.314 10.073 ( -2.522 9.039 -2.315) 9.665 10.290 ( 0.974 -1.480 -2.903) 3.401 10.462 ( -2.880 -7.539 -2.811) 8.546 10.653 ( -4.987 -7.324 -4.640) 10.002 10.886 ( 4.828 -4.861 -15.470) 16.919 10.902 ( -3.031 0.684 -1.821) 3.602 10.924 ( 3.419 3.693 -0.264) 5.039 11.499 ( -15.016 5.197 -5.859) 16.936 11.843 ( 4.371 -3.393 -2.488) 6.067 12.250 ( -9.511 2.346 2.484) 10.107 12.449 ( -3.859 -1.682 5.697) 7.083 12.739 ( -0.434 -1.031 11.401) 11.456 13.633 ( 15.993 4.454 -1.444) 16.665 14.938 ( 3.576 1.263 10.049) 10.741 15.678 ( 2.181 6.738 -16.459) 17.918 16.227 ( -6.793 3.853 0.941) 7.866 16.458 ( -2.184 9.299 -2.164) 9.794 ======================= Grid point 348 (169/282) ======================= q-point: ( 0.30 -0.70 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.779 ( -9.528 0.000 -4.016) 10.340 3.021 ( 4.689 -0.000 -12.141) 13.015 3.152 ( -14.979 0.000 -9.528) 17.752 3.268 ( -11.084 0.000 8.999) 14.277 3.483 ( -12.775 0.000 9.499) 15.920 3.706 ( 0.199 -0.000 5.925) 5.928 3.729 ( 5.535 -0.000 4.614) 7.206 4.311 ( -6.113 0.000 21.085) 21.954 4.499 ( 7.163 -0.000 -6.758) 9.848 4.771 ( -0.117 0.000 10.140) 10.141 5.480 ( -0.158 0.000 -18.137) 18.137 5.499 ( 8.951 -0.000 -10.018) 13.434 5.986 ( -5.348 0.000 12.083) 13.214 6.222 ( -5.712 0.000 4.782) 7.450 6.440 ( -6.309 0.000 -10.948) 12.636 6.450 ( -1.872 0.000 -2.613) 3.215 6.867 ( -0.070 0.000 -2.765) 2.766 6.895 ( 1.949 -0.000 0.631) 2.049 6.895 ( -3.956 0.000 2.748) 4.816 7.100 ( 4.476 -0.000 4.272) 6.187 7.483 ( -0.698 0.000 -0.249) 0.741 7.583 ( 9.732 -0.000 4.894) 10.893 7.995 ( 17.681 -0.000 -10.828) 20.733 8.241 ( -8.127 0.000 -0.710) 8.158 8.454 ( -17.924 0.000 -11.058) 21.061 8.522 ( -14.765 0.000 1.340) 14.825 8.861 ( 6.509 -0.000 -10.714) 12.536 9.326 ( 4.547 -0.000 -9.053) 10.131 9.471 ( 1.145 -0.000 -5.750) 5.863 9.666 ( -5.646 0.000 16.161) 17.119 9.719 ( 4.022 -0.000 -3.930) 5.623 9.917 ( 2.481 -0.000 -6.936) 7.366 10.269 ( 12.050 -0.000 -6.396) 13.642 10.361 ( 0.076 -0.000 10.714) 10.714 10.743 ( 5.117 -0.000 6.315) 8.128 10.947 ( 3.493 -0.000 -3.033) 4.626 11.085 ( 1.984 -0.000 3.635) 4.141 11.303 ( 0.637 -0.000 3.023) 3.089 11.412 ( 11.052 -0.000 -2.500) 11.331 11.647 ( -1.424 0.000 4.876) 5.079 11.775 ( 2.058 -0.000 7.336) 7.619 12.281 ( 0.327 -0.000 1.416) 1.453 13.013 ( -8.946 0.000 2.338) 9.247 13.597 ( -5.580 0.000 -16.607) 17.519 15.101 ( -14.269 0.000 1.431) 14.340 16.083 ( -3.298 0.000 9.941) 10.474 16.406 ( 25.178 -0.000 -0.115) 25.178 16.503 ( 9.802 -0.000 2.009) 10.006 ======================= Grid point 350 (170/282) ======================= q-point: (-0.60 0.30 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.525 ( -10.577 16.221 -4.707) 19.929 2.901 ( -9.111 -13.865 -8.010) 18.423 3.048 ( 5.611 0.171 -1.441) 5.795 3.133 ( -14.821 11.117 12.615) 22.414 3.393 ( -13.671 -4.943 10.268) 17.798 3.776 ( 0.635 1.461 7.716) 7.878 3.891 ( 3.942 -4.577 8.145) 10.141 4.393 ( -8.728 -0.947 16.993) 19.127 4.561 ( 11.177 -0.761 -9.146) 14.462 4.883 ( -0.749 -2.152 9.600) 9.867 5.263 ( -4.603 3.199 -15.015) 16.027 5.461 ( 2.562 -0.985 -15.454) 15.696 5.860 ( -12.428 22.173 12.652) 28.393 6.180 ( -10.406 -0.506 -8.048) 13.165 6.197 ( -3.493 3.267 -1.564) 5.032 6.463 ( -6.111 -21.611 3.723) 22.764 6.779 ( -1.862 4.832 -8.095) 9.610 6.814 ( -1.020 3.203 -3.287) 4.702 7.013 ( 8.116 -1.178 -0.277) 8.206 7.313 ( 6.821 -9.072 7.104) 13.390 7.460 ( -1.757 -0.410 3.659) 4.080 7.710 ( -0.395 1.037 4.555) 4.688 8.104 ( -10.467 0.011 -5.928) 12.030 8.146 ( -1.001 0.188 -0.740) 1.259 8.207 ( 18.074 -0.182 -13.665) 22.659 8.306 ( -15.358 -2.109 1.323) 15.558 8.836 ( 3.914 1.470 -7.318) 8.428 9.247 ( -0.975 3.071 -7.017) 7.721 9.448 ( 2.524 0.368 -4.262) 4.967 9.708 ( 1.918 5.014 -0.581) 5.400 9.765 ( 0.894 -2.025 -0.359) 2.242 9.933 ( 3.897 -12.435 -6.658) 14.634 10.386 ( 11.764 5.418 -4.840) 13.826 10.430 ( 1.047 -0.543 1.788) 2.142 10.772 ( -3.664 0.556 1.890) 4.160 10.929 ( -0.173 2.386 -3.364) 4.128 11.169 ( 3.399 -0.496 4.933) 6.011 11.433 ( 4.219 -3.385 2.940) 6.157 11.562 ( 10.094 1.709 -2.570) 10.555 11.665 ( 6.066 3.179 2.405) 7.259 11.910 ( 2.010 -4.706 7.942) 9.448 12.274 ( -1.637 1.532 0.654) 2.335 12.911 ( -8.840 4.668 8.632) 13.208 13.360 ( -5.566 -2.591 -13.977) 15.266 14.938 ( -11.919 -0.104 5.989) 13.340 16.088 ( -4.559 0.254 4.443) 6.371 16.618 ( 7.237 4.787 0.876) 8.721 16.778 ( 20.584 -3.762 -3.500) 21.216 ======================= Grid point 351 (171/282) ======================= q-point: (-0.50 0.30 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.206 ( -7.773 21.386 2.123) 22.853 2.854 ( -6.060 -4.931 0.612) 7.837 2.944 ( -13.277 2.434 9.661) 16.599 3.170 ( 5.307 0.680 6.272) 8.243 3.359 ( -7.727 -5.668 10.351) 14.105 3.848 ( -0.072 2.255 9.111) 9.386 4.041 ( -2.215 -2.034 12.574) 12.929 4.410 ( -6.043 -4.170 7.598) 10.567 4.656 ( 11.594 -0.843 -9.257) 14.860 4.910 ( -6.597 7.188 9.210) 13.417 5.008 ( -5.523 7.030 -13.313) 16.036 5.329 ( -1.441 -3.144 -13.854) 14.279 5.650 ( -9.692 16.300 11.510) 22.183 5.930 ( -7.183 3.118 -9.674) 12.446 6.076 ( -1.223 7.461 -7.773) 10.844 6.544 ( -7.110 -2.507 -5.136) 9.122 6.665 ( -1.964 -2.782 -4.289) 5.477 6.798 ( -0.191 -17.809 5.028) 18.506 7.100 ( 4.599 0.822 -5.224) 7.008 7.459 ( 1.601 0.405 6.923) 7.117 7.587 ( 4.872 -8.008 4.135) 10.245 7.686 ( -3.545 -1.675 2.632) 4.722 7.927 ( -7.408 -2.110 -0.768) 7.741 8.112 ( -12.335 -3.843 0.104) 12.920 8.186 ( 3.361 -1.125 1.629) 3.901 8.396 ( 18.359 -1.205 -10.883) 21.376 8.839 ( 4.521 0.918 -3.038) 5.524 9.132 ( -1.274 4.525 -7.066) 8.487 9.450 ( 2.483 2.128 -2.101) 3.887 9.629 ( -0.317 5.448 -6.356) 8.377 9.804 ( 0.556 -3.774 1.221) 4.006 10.035 ( 1.739 -17.171 -7.081) 18.656 10.396 ( 0.656 2.442 -3.063) 3.972 10.475 ( 7.984 2.069 -7.292) 11.009 10.731 ( -1.012 1.887 -1.593) 2.669 10.872 ( 0.361 2.551 -3.102) 4.032 11.279 ( 4.943 3.458 5.410) 8.104 11.356 ( -7.791 0.033 -9.241) 12.087 11.626 ( 5.483 3.770 -2.442) 7.088 11.886 ( 10.603 -4.124 3.655) 11.950 12.028 ( 1.107 -3.152 4.483) 5.591 12.246 ( -0.611 2.259 2.347) 3.314 12.849 ( -7.825 6.212 13.636) 16.904 13.238 ( -0.062 -4.139 -6.721) 7.893 14.857 ( -8.621 1.144 9.881) 13.163 16.042 ( -4.748 -0.441 0.926) 4.857 16.647 ( 2.343 5.215 -1.501) 5.911 16.991 ( 13.327 1.350 -8.960) 16.116 ======================= Grid point 352 (172/282) ======================= q-point: (-0.40 0.30 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.074 ( 0.172 17.071 14.497) 22.397 2.725 ( -10.573 17.291 17.048) 26.484 2.960 ( -1.824 -16.659 -2.722) 16.978 3.254 ( -0.764 -1.079 6.457) 6.591 3.497 ( 5.229 -1.504 11.593) 12.806 3.925 ( 0.688 3.177 10.763) 11.243 4.077 ( -11.101 2.027 16.563) 20.042 4.436 ( -1.698 -8.350 -2.889) 8.997 4.688 ( -1.637 15.685 -1.065) 15.806 4.738 ( 1.593 7.470 -13.337) 15.370 4.821 ( -3.030 5.277 4.984) 7.865 5.230 ( -1.728 -6.123 -8.683) 10.764 5.528 ( -7.802 5.188 4.422) 10.360 5.746 ( -1.867 4.578 -7.342) 8.851 5.929 ( 0.964 7.447 -9.143) 11.832 6.358 ( -3.015 4.399 -9.625) 11.004 6.556 ( -3.029 1.098 -7.858) 8.493 7.016 ( 0.845 7.167 -9.748) 12.129 7.124 ( -0.146 -30.972 12.927) 33.562 7.572 ( 3.989 -1.728 5.674) 7.148 7.661 ( -1.494 0.021 5.565) 5.762 7.758 ( 1.141 -6.863 0.423) 6.970 7.891 ( -1.144 -6.705 -0.954) 6.869 8.009 ( -5.709 -6.506 -0.254) 8.660 8.255 ( 1.762 -1.198 1.465) 2.586 8.556 ( 13.528 -0.264 -8.828) 16.155 8.896 ( 4.139 -0.078 1.889) 4.551 9.004 ( -2.255 4.393 -5.960) 7.740 9.421 ( -0.561 2.993 -3.018) 4.287 9.568 ( 2.159 2.960 -0.131) 3.666 9.840 ( -2.102 -2.521 2.697) 4.248 10.093 ( -1.664 -16.937 -7.975) 18.794 10.371 ( 3.442 -1.166 -5.634) 6.705 10.478 ( 4.209 0.717 -8.778) 9.762 10.653 ( -0.103 7.768 -5.414) 9.469 10.852 ( 2.582 -0.924 -4.956) 5.664 11.123 ( -7.438 -0.192 -11.817) 13.964 11.312 ( -1.393 7.363 0.983) 7.557 11.647 ( 3.701 1.030 -0.364) 3.859 11.976 ( -3.062 -2.137 -2.513) 4.501 12.123 ( 5.741 -2.398 2.627) 6.754 12.296 ( 1.879 0.475 5.763) 6.080 12.833 ( -10.354 3.595 16.527) 19.832 13.286 ( 8.904 -1.062 -1.459) 9.085 14.845 ( -4.798 3.149 11.547) 12.895 15.978 ( -3.528 -0.683 -1.832) 4.033 16.590 ( -0.562 6.413 -3.385) 7.273 16.977 ( 3.569 7.676 -12.215) 14.862 ======================= Grid point 353 (173/282) ======================= q-point: (-0.30 0.30 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.220 ( 4.514 8.059 23.958) 25.677 2.679 ( -0.444 16.477 19.414) 25.468 3.025 ( -1.203 -12.694 -2.723) 13.038 3.360 ( 5.262 -2.244 6.606) 8.738 3.647 ( 4.433 4.280 3.033) 6.868 4.030 ( -4.814 6.960 14.201) 16.531 4.066 ( -5.852 0.328 20.964) 21.768 4.344 ( -2.363 -2.603 -19.302) 19.619 4.466 ( -0.613 9.475 -7.872) 12.334 4.650 ( -4.758 17.725 18.414) 25.998 4.891 ( 8.905 -3.097 -5.554) 10.942 5.179 ( -1.449 -4.634 -6.474) 8.093 5.396 ( -5.102 2.446 -4.620) 7.305 5.656 ( -0.826 2.001 -2.690) 3.453 5.827 ( 2.206 3.472 -7.564) 8.610 6.241 ( 3.070 3.238 -7.608) 8.820 6.426 ( -2.854 1.493 -7.277) 7.958 6.865 ( 4.163 9.587 -12.820) 16.541 7.465 ( -1.211 -27.075 10.368) 29.018 7.680 ( 0.776 -0.799 3.665) 3.830 7.698 ( 0.228 -2.793 4.064) 4.937 7.807 ( 0.214 -3.603 1.608) 3.952 7.936 ( 1.731 -7.628 -2.698) 8.274 8.024 ( 0.167 -8.078 -1.867) 8.292 8.255 ( -2.181 -0.385 -3.641) 4.262 8.594 ( 5.211 2.340 -11.491) 12.833 8.899 ( -2.925 1.560 0.790) 3.409 9.011 ( 2.873 0.261 7.549) 8.081 9.391 ( 1.162 -0.678 0.250) 1.368 9.624 ( 4.406 2.295 4.519) 6.716 9.823 ( -4.471 1.822 3.580) 6.010 10.092 ( -4.159 -14.075 -6.274) 15.962 10.415 ( 7.104 -1.867 -10.116) 12.502 10.430 ( -1.005 -1.936 -1.491) 2.642 10.518 ( 1.586 7.368 -10.919) 13.267 10.848 ( 3.315 -3.889 -10.430) 11.614 10.951 ( -1.739 -0.723 -7.798) 8.022 11.165 ( -7.882 7.256 -1.629) 10.837 11.724 ( 5.158 -0.706 0.701) 5.253 11.837 ( -10.590 1.222 -4.252) 11.477 12.275 ( 6.042 -3.561 3.571) 7.870 12.344 ( -2.240 0.303 4.446) 4.987 12.779 ( -13.680 2.838 15.687) 21.007 13.474 ( 15.547 2.020 0.737) 15.695 14.886 ( -0.823 4.331 11.195) 12.032 15.903 ( -1.150 1.535 -6.371) 6.654 16.470 ( -3.490 7.653 -3.718) 9.197 16.793 ( -2.506 10.734 -9.308) 14.427 ======================= Grid point 354 (174/282) ======================= q-point: (-0.20 0.30 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.463 ( -0.945 2.055 25.459) 25.559 2.869 ( 12.936 12.967 20.166) 27.243 3.076 ( 0.632 -9.294 -1.342) 9.412 3.546 ( 7.236 -1.900 4.800) 8.889 3.643 ( 3.066 6.614 -4.035) 8.332 4.023 ( -10.254 -0.756 16.994) 19.862 4.102 ( -1.744 1.093 -18.072) 18.189 4.156 ( 2.091 16.897 10.121) 19.807 4.421 ( 2.813 -1.284 -5.203) 6.053 4.703 ( -0.246 11.815 25.876) 28.447 4.945 ( 5.882 1.798 -10.716) 12.356 5.134 ( 2.713 3.724 -3.167) 5.591 5.272 ( -2.281 -1.929 -7.834) 8.384 5.638 ( 0.753 -4.057 -1.418) 4.363 5.806 ( 2.950 -2.864 -4.042) 5.765 6.237 ( 4.404 3.042 -4.625) 7.074 6.329 ( 4.019 2.995 -5.750) 7.628 6.775 ( 9.652 6.615 -14.233) 18.425 7.629 ( -4.591 -9.558 1.412) 10.697 7.720 ( -3.638 -2.393 3.080) 5.333 7.760 ( 1.173 -2.458 3.409) 4.363 7.847 ( -1.989 -9.022 0.225) 9.242 8.027 ( 4.900 -6.405 -0.994) 8.125 8.069 ( 1.434 -6.258 -1.713) 6.645 8.136 ( -3.857 -1.928 -8.900) 9.889 8.479 ( -1.772 2.390 -11.449) 11.829 8.918 ( -2.199 -1.780 10.064) 10.454 9.109 ( 1.698 0.086 5.448) 5.708 9.457 ( 0.629 -1.833 6.124) 6.423 9.745 ( 5.931 5.321 4.647) 9.224 9.765 ( -2.521 1.212 3.990) 4.873 10.085 ( -4.060 -10.041 -0.565) 10.846 10.326 ( 0.223 8.182 -6.441) 10.416 10.394 ( 0.975 -0.897 -9.997) 10.084 10.524 ( 1.592 -8.701 -1.769) 9.021 10.792 ( 4.231 -6.749 -17.378) 19.117 10.925 ( 0.232 1.992 -3.013) 3.620 10.998 ( -1.809 5.270 -0.469) 5.592 11.571 ( -14.941 3.945 -4.872) 16.203 11.802 ( 2.251 -1.721 0.868) 2.964 12.283 ( -7.224 1.915 2.537) 7.893 12.413 ( -0.485 -3.046 5.090) 5.951 12.732 ( -6.672 0.289 12.222) 13.927 13.702 ( 16.269 4.270 -0.092) 16.821 14.975 ( 2.832 3.736 10.691) 11.674 15.782 ( 1.734 6.216 -13.008) 14.520 16.310 ( -7.278 6.642 -0.336) 9.859 16.604 ( -3.156 9.233 -4.199) 10.622 ======================= Grid point 355 (175/282) ======================= q-point: (-0.10 0.30 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.670 ( -1.061 -0.791 21.969) 22.009 3.063 ( -0.343 2.320 8.992) 9.293 3.260 ( 13.062 0.724 8.023) 15.347 3.572 ( 0.297 3.220 -4.164) 5.273 3.625 ( -0.135 1.328 -4.570) 4.761 3.906 ( -4.742 -3.157 -11.663) 12.980 4.131 ( 7.898 0.694 6.330) 10.146 4.203 ( 4.311 13.529 14.090) 20.004 4.380 ( -2.593 5.166 3.852) 6.946 4.778 ( 1.471 14.659 -8.982) 17.255 4.932 ( 5.075 -2.325 2.654) 6.181 5.188 ( -0.888 2.023 -2.183) 3.106 5.229 ( 10.643 1.953 7.146) 12.967 5.723 ( 5.379 -9.325 -2.090) 10.966 5.878 ( 4.032 -8.352 -0.993) 9.327 6.206 ( 4.775 5.309 -3.884) 8.128 6.431 ( 13.056 0.883 -2.454) 13.314 6.769 ( 13.604 4.672 -14.833) 20.661 7.524 ( -12.654 -2.610 -4.153) 13.571 7.655 ( -6.910 0.279 0.522) 6.936 7.737 ( -5.053 1.764 -0.360) 5.365 7.906 ( -2.717 -7.112 -2.220) 7.931 8.051 ( -3.025 -4.773 -1.931) 5.972 8.120 ( 7.236 -4.615 -2.546) 8.952 8.189 ( 6.655 -4.963 -0.250) 8.306 8.345 ( -2.238 -4.478 -5.347) 7.324 9.018 ( -2.488 -3.053 11.658) 12.306 9.161 ( 0.637 -0.529 1.173) 1.436 9.541 ( -0.717 -1.710 8.400) 8.602 9.739 ( 1.390 3.416 3.519) 5.097 9.879 ( 3.389 1.562 4.747) 6.038 10.090 ( -2.849 3.586 3.957) 6.053 10.224 ( -0.436 -4.296 -7.484) 8.641 10.348 ( 1.881 -0.152 -4.755) 5.116 10.505 ( -9.461 0.157 3.212) 9.993 10.739 ( 1.442 -3.961 -15.486) 16.049 10.888 ( 5.256 -4.847 -3.267) 7.861 11.043 ( 8.095 3.702 -1.537) 9.033 11.269 ( -12.638 4.470 -4.934) 14.284 11.831 ( -2.080 -2.077 1.742) 3.417 12.147 ( -10.750 3.675 2.888) 11.722 12.400 ( -7.933 0.088 5.386) 9.589 12.832 ( 3.602 -5.721 5.948) 9.005 13.879 ( 13.352 5.381 -2.845) 14.674 15.132 ( 6.327 1.643 11.769) 13.462 15.639 ( 6.110 7.217 -15.688) 18.317 16.138 ( -11.373 4.936 2.207) 12.593 16.473 ( -2.077 8.386 -1.158) 8.716 ======================= Grid point 360 (176/282) ======================= q-point: ( 0.40 -0.60 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.476 ( -4.631 0.000 -1.274) 4.803 2.628 ( -6.140 0.000 -4.120) 7.395 3.063 ( -9.894 0.000 8.303) 12.916 3.221 ( 5.409 -0.000 11.712) 12.901 3.256 ( -14.092 0.000 12.104) 18.576 3.865 ( -1.972 0.000 11.222) 11.394 4.024 ( 5.061 -0.000 7.110) 8.728 4.373 ( -10.622 0.000 10.134) 14.681 4.647 ( 11.331 -0.000 -8.451) 14.136 4.941 ( -1.123 0.000 3.457) 3.635 5.067 ( -5.591 0.000 -10.431) 11.835 5.305 ( -1.531 0.000 -15.370) 15.446 5.926 ( -9.719 0.000 10.079) 14.001 5.953 ( -6.665 0.000 -10.582) 12.506 6.166 ( -6.390 0.000 11.682) 13.316 6.271 ( -3.728 0.000 -3.825) 5.341 6.673 ( -3.974 0.000 -10.110) 10.863 6.729 ( -2.164 0.000 -7.071) 7.395 7.144 ( 8.297 -0.000 -0.832) 8.339 7.434 ( 4.826 -0.000 4.717) 6.748 7.500 ( 1.198 -0.000 5.465) 5.595 7.690 ( -5.396 0.000 3.493) 6.428 7.913 ( -7.774 0.000 -0.643) 7.801 8.078 ( -13.471 0.000 0.148) 13.471 8.178 ( 2.506 -0.000 2.897) 3.830 8.387 ( 19.601 -0.000 -12.325) 23.153 8.844 ( 4.144 -0.000 -3.918) 5.703 9.168 ( -1.580 0.000 -7.489) 7.654 9.472 ( 4.540 -0.000 -3.004) 5.444 9.748 ( 1.932 -0.000 -4.823) 5.195 9.758 ( 1.674 -0.000 -6.209) 6.431 9.833 ( -1.031 0.000 -2.095) 2.335 10.409 ( -2.065 0.000 -1.570) 2.594 10.502 ( 9.018 -0.000 -9.226) 12.901 10.747 ( -0.782 0.000 0.462) 0.908 10.896 ( 0.271 -0.000 -5.444) 5.450 11.305 ( 6.308 -0.000 6.020) 8.719 11.349 ( -8.262 0.000 -7.222) 10.973 11.661 ( 3.958 -0.000 -2.824) 4.862 11.849 ( 10.188 -0.000 3.063) 10.639 12.003 ( 3.039 -0.000 5.309) 6.117 12.266 ( -0.222 0.000 1.101) 1.123 12.909 ( -9.830 0.000 14.302) 17.354 13.195 ( 0.862 -0.000 -7.009) 7.062 14.867 ( -8.053 0.000 10.282) 13.060 16.038 ( -5.100 0.000 1.056) 5.208 16.688 ( 1.879 -0.000 -1.927) 2.691 17.000 ( 15.068 -0.000 -7.465) 16.816 ======================= Grid point 362 (177/282) ======================= q-point: (-0.50 0.40 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.349 ( -0.384 18.032 6.637) 19.218 2.670 ( -0.533 -17.935 -0.397) 17.947 2.969 ( -8.762 10.701 12.660) 18.750 3.211 ( -7.089 -4.096 9.792) 12.764 3.480 ( 8.952 -0.630 14.708) 17.229 3.940 ( -4.106 -0.094 14.107) 14.692 4.136 ( -0.487 4.504 8.223) 9.388 4.307 ( -6.412 -6.864 0.550) 9.409 4.711 ( 7.821 -1.215 -10.767) 13.363 4.844 ( -2.921 5.019 -13.128) 14.355 4.933 ( -3.151 0.786 -0.606) 3.303 5.170 ( -3.741 -1.973 -4.458) 6.145 5.754 ( -4.976 12.575 -2.346) 13.726 5.824 ( -3.102 9.986 2.178) 10.681 6.052 ( -0.561 11.598 -6.463) 13.289 6.350 ( -6.834 -12.407 1.059) 14.204 6.530 ( -2.418 -3.185 -8.211) 9.133 6.698 ( -1.207 -16.331 3.686) 16.785 7.186 ( 5.579 12.306 -4.205) 14.151 7.525 ( 1.751 -6.667 1.355) 7.025 7.607 ( 2.116 -7.214 2.921) 8.066 7.676 ( -1.743 0.946 5.879) 6.205 7.849 ( -2.358 0.030 1.344) 2.715 7.922 ( -7.600 -4.044 -0.700) 8.637 8.243 ( 0.394 -0.368 4.278) 4.312 8.554 ( 16.061 -0.044 -10.204) 19.028 8.888 ( 4.108 -0.500 0.230) 4.144 9.053 ( -2.808 1.750 -7.638) 8.323 9.493 ( 2.737 4.415 -3.499) 6.264 9.638 ( 1.899 7.144 -4.785) 8.805 9.786 ( 0.879 -5.474 -1.255) 5.684 9.844 ( -3.014 -12.108 -2.959) 12.823 10.361 ( -0.720 -0.276 -3.005) 3.102 10.506 ( 5.683 1.654 -10.452) 12.011 10.735 ( 2.154 3.079 -4.676) 5.999 10.837 ( 0.645 -1.019 -7.684) 7.778 11.123 ( -8.840 0.078 -9.466) 12.952 11.397 ( -0.189 3.189 0.131) 3.197 11.659 ( 1.032 0.482 0.406) 1.209 11.943 ( -0.792 -1.548 -1.330) 2.189 12.098 ( 5.231 -0.866 1.999) 5.667 12.310 ( 2.743 0.768 3.344) 4.393 12.880 ( -12.425 2.011 16.174) 20.495 13.264 ( 10.115 -1.254 0.994) 10.241 14.884 ( -4.197 1.493 12.605) 13.369 15.970 ( -3.613 -0.293 -1.072) 3.780 16.658 ( -0.719 2.321 -3.619) 4.359 17.054 ( 5.220 2.549 -11.142) 12.565 ======================= Grid point 363 (178/282) ======================= q-point: (-0.40 0.40 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.371 ( 2.633 11.641 16.381) 20.268 2.796 ( 0.814 -12.668 0.990) 12.733 2.939 ( -0.417 12.817 15.477) 20.099 3.297 ( 1.972 -5.961 8.181) 10.312 3.723 ( 7.764 5.125 7.771) 12.121 4.032 ( -11.641 -2.395 23.925) 26.715 4.107 ( -0.062 2.328 2.837) 3.670 4.277 ( -1.340 -4.174 -9.169) 10.164 4.582 ( -0.936 6.425 -15.871) 17.148 4.753 ( 4.222 -4.252 -7.032) 9.239 4.917 ( 0.165 3.071 3.677) 4.793 5.117 ( -3.250 -3.837 -0.320) 5.039 5.570 ( -2.924 18.519 1.434) 18.803 5.744 ( 0.976 9.087 -1.171) 9.214 5.899 ( 0.338 6.335 -9.926) 11.780 6.275 ( 0.100 1.243 -5.666) 5.802 6.437 ( -1.140 0.464 -7.002) 7.109 6.997 ( -1.443 -32.166 13.036) 34.737 7.072 ( 4.108 17.060 -7.892) 19.241 7.633 ( 2.913 -8.409 0.016) 8.899 7.675 ( -0.581 -0.825 4.067) 4.191 7.730 ( -0.096 -6.031 2.099) 6.386 7.841 ( 0.273 -2.813 -0.374) 2.851 7.912 ( 0.020 -5.245 0.339) 5.256 8.248 ( -3.965 -0.366 -0.241) 3.989 8.623 ( 8.228 1.436 -13.945) 16.255 8.925 ( -3.635 1.756 -1.938) 4.478 9.001 ( 3.128 -1.416 6.980) 7.778 9.431 ( 1.363 5.720 -2.095) 6.242 9.655 ( 5.678 1.163 0.094) 5.797 9.823 ( -1.527 -1.881 3.626) 4.360 9.859 ( -3.632 -14.047 -4.089) 15.074 10.345 ( 1.960 -2.917 -3.967) 5.300 10.457 ( 4.553 2.530 -11.546) 12.666 10.647 ( -0.310 6.762 -8.301) 10.710 10.779 ( 1.297 -4.623 -13.676) 14.495 10.960 ( -1.094 1.339 -4.241) 4.580 11.257 ( -8.148 4.389 -4.664) 10.364 11.721 ( 3.764 0.106 2.334) 4.430 11.845 ( -9.283 0.038 -3.028) 9.764 12.227 ( 5.925 -2.464 3.638) 7.376 12.353 ( -1.402 0.619 2.950) 3.325 12.817 ( -14.188 1.992 15.694) 21.251 13.493 ( 15.636 0.549 3.254) 15.980 14.951 ( -0.716 3.664 12.326) 12.879 15.916 ( -1.073 0.274 -3.170) 3.358 16.565 ( -3.152 4.471 -4.174) 6.881 16.923 ( -2.543 6.022 -10.978) 12.776 ======================= Grid point 364 (179/282) ======================= q-point: (-0.30 0.40 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.517 ( -0.454 5.178 20.841) 21.480 2.920 ( 0.782 -10.734 2.674) 11.089 3.072 ( 11.029 13.269 16.477) 23.858 3.496 ( 6.756 -4.567 7.423) 11.028 3.757 ( 3.808 8.077 -5.441) 10.457 4.006 ( -11.877 -1.163 12.810) 17.508 4.099 ( -4.474 -1.073 -12.309) 13.140 4.309 ( 5.339 -0.376 13.423) 14.451 4.423 ( 3.340 6.265 -10.535) 12.703 4.791 ( 1.027 -3.541 -0.317) 3.701 4.951 ( 3.569 0.551 0.011) 3.611 5.133 ( 0.230 -4.390 1.120) 4.536 5.421 ( 0.868 20.086 2.957) 20.321 5.679 ( 2.184 8.571 -3.259) 9.426 5.793 ( 1.116 1.818 -6.479) 6.821 6.269 ( 6.087 1.240 -4.091) 7.438 6.366 ( 2.271 2.495 -6.017) 6.898 6.927 ( 5.959 13.838 -10.287) 18.243 7.321 ( -3.053 -27.687 9.715) 29.501 7.696 ( -0.423 -3.076 1.468) 3.435 7.729 ( -0.174 -1.990 1.650) 2.591 7.769 ( -1.696 -3.117 1.607) 3.896 7.913 ( 4.333 -8.671 -1.195) 9.767 7.967 ( 2.348 -4.626 -0.916) 5.267 8.114 ( -7.279 -1.104 -7.573) 10.562 8.521 ( -0.052 2.617 -15.236) 15.459 8.896 ( -3.222 -0.778 7.865) 8.535 9.100 ( -0.097 -1.439 5.002) 5.206 9.455 ( 3.064 1.759 4.370) 5.620 9.758 ( 4.885 -0.138 2.065) 5.305 9.832 ( 0.431 1.985 1.209) 2.364 9.888 ( -3.272 -11.490 3.402) 12.422 10.393 ( 2.974 -2.923 -5.858) 7.191 10.398 ( 5.932 -2.459 -9.500) 11.467 10.478 ( -2.609 8.363 -7.795) 11.726 10.696 ( 2.916 -5.686 -16.393) 17.594 10.960 ( 3.685 2.649 -2.489) 5.176 11.068 ( -4.660 3.375 -3.543) 6.757 11.618 ( -14.831 2.303 -3.059) 15.317 11.789 ( 1.551 -0.260 2.426) 2.891 12.306 ( -6.010 1.056 2.350) 6.539 12.363 ( 1.568 -3.119 4.826) 5.956 12.745 ( -10.775 1.254 12.479) 16.535 13.756 ( 16.344 2.650 1.800) 16.655 15.044 ( 2.212 4.730 11.085) 12.253 15.856 ( 1.096 3.323 -7.380) 8.167 16.413 ( -7.047 6.211 -2.481) 9.715 16.726 ( -4.364 6.456 -6.470) 10.128 ======================= Grid point 365 (180/282) ======================= q-point: (-0.20 0.40 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.674 ( -1.804 1.365 19.983) 20.110 3.023 ( -1.022 -5.945 6.125) 8.597 3.337 ( 11.780 7.541 11.940) 18.390 3.610 ( -1.947 2.055 3.609) 4.587 3.669 ( 0.659 3.946 -8.384) 9.290 3.862 ( -2.048 -2.644 -17.575) 17.890 4.123 ( 3.423 -0.306 15.261) 15.643 4.368 ( 5.784 7.573 -0.937) 9.575 4.440 ( -2.458 1.802 5.586) 6.363 4.871 ( 6.249 -5.918 -1.069) 8.673 4.990 ( 4.399 7.487 -2.603) 9.065 5.125 ( -0.583 1.054 -3.305) 3.517 5.441 ( 9.490 15.260 13.383) 22.406 5.638 ( 3.287 1.197 -3.778) 5.149 5.784 ( 3.338 -2.933 -3.410) 5.601 6.291 ( 5.076 6.083 -2.922) 8.444 6.415 ( 10.640 -2.621 -4.072) 11.690 6.860 ( 10.338 7.869 -11.737) 17.509 7.437 ( -11.232 -11.090 0.152) 15.785 7.682 ( -5.208 2.309 1.253) 5.833 7.707 ( -5.517 -10.173 0.503) 11.584 7.778 ( -1.655 -0.725 2.125) 2.789 7.959 ( -3.728 -9.038 -3.444) 10.366 8.048 ( 6.259 -4.454 -2.053) 7.951 8.112 ( 8.741 -5.137 0.306) 10.143 8.314 ( -4.952 0.578 -13.655) 14.536 8.966 ( -3.481 -3.335 11.528) 12.495 9.131 ( -1.601 -3.433 0.491) 3.819 9.534 ( 1.659 0.559 5.477) 5.750 9.779 ( -0.492 1.564 2.568) 3.047 9.885 ( 0.463 -1.941 3.374) 3.920 10.017 ( 3.481 -4.927 7.812) 9.870 10.287 ( 0.775 6.195 -12.424) 13.904 10.367 ( 4.661 2.492 -7.096) 8.848 10.486 ( -1.836 -3.584 3.941) 5.635 10.646 ( 6.572 -7.022 -17.870) 20.294 10.872 ( -2.452 2.569 -3.334) 4.871 11.096 ( 8.624 3.054 -0.488) 9.162 11.329 ( -15.278 3.400 -2.750) 15.891 11.814 ( -1.930 -0.410 2.626) 3.285 12.192 ( -10.755 2.240 3.969) 11.681 12.400 ( -5.004 -0.194 4.511) 6.740 12.753 ( -1.442 -4.219 6.326) 7.740 13.955 ( 12.920 4.379 -1.930) 13.778 15.172 ( 4.957 3.436 11.203) 12.723 15.752 ( 3.715 7.035 -11.981) 14.382 16.222 ( -11.610 5.717 1.747) 13.059 16.588 ( -1.999 6.272 -2.018) 6.885 ======================= Grid point 366 (181/282) ======================= q-point: (-0.10 0.40 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.828 ( -2.216 -2.161 16.428) 16.717 3.093 ( -2.801 -1.406 7.503) 8.131 3.421 ( -2.906 -0.420 -3.092) 4.264 3.563 ( 3.339 2.968 -9.325) 10.340 3.590 ( 2.780 4.277 -4.583) 6.858 3.695 ( -13.881 -2.473 4.419) 14.776 4.319 ( 8.159 4.036 -1.845) 9.287 4.378 ( -4.181 6.091 4.430) 8.614 4.492 ( 9.966 3.169 6.085) 12.099 4.844 ( 4.436 14.643 -5.358) 16.211 5.079 ( 7.355 -8.091 4.037) 11.656 5.111 ( 3.034 6.197 -2.350) 7.289 5.598 ( 9.153 7.904 3.982) 12.732 5.750 ( 7.524 -4.302 5.018) 10.015 5.878 ( 6.705 -8.847 -0.168) 11.102 6.336 ( 10.869 5.148 -2.565) 12.297 6.587 ( 10.496 -3.693 -0.321) 11.131 6.874 ( 12.165 3.145 -13.363) 18.343 7.248 ( -12.376 -3.206 -2.765) 13.080 7.585 ( -5.426 5.012 0.632) 7.414 7.656 ( -7.210 1.221 -0.127) 7.314 7.780 ( -5.627 -3.803 -0.284) 6.798 7.889 ( -10.019 -5.245 -2.759) 11.640 8.127 ( -0.726 -9.848 -5.495) 11.300 8.228 ( 11.159 -7.229 -1.511) 13.382 8.361 ( 11.054 -6.402 2.519) 13.020 9.013 ( -5.185 -3.620 3.992) 7.478 9.130 ( -3.428 -5.564 1.093) 6.626 9.600 ( 0.689 -0.150 4.074) 4.135 9.808 ( -0.566 0.791 5.646) 5.729 9.906 ( -1.056 -0.418 -0.117) 1.142 10.138 ( -1.197 5.793 2.537) 6.437 10.184 ( 3.331 -0.342 -2.580) 4.227 10.378 ( 7.748 0.492 -6.370) 10.043 10.436 ( -8.714 5.728 6.114) 12.088 10.612 ( 3.294 -1.020 -9.594) 10.195 10.909 ( 6.879 -7.724 -1.982) 10.532 11.067 ( -7.133 3.256 -4.312) 8.948 11.225 ( 8.899 3.914 -0.135) 9.723 11.790 ( -5.170 -0.603 2.764) 5.893 12.038 ( -13.273 3.351 6.962) 15.358 12.329 ( -6.313 1.681 1.589) 6.723 12.861 ( 2.522 -8.936 1.738) 9.447 14.031 ( 7.084 4.388 -6.735) 10.714 15.369 ( 7.418 0.436 12.751) 14.758 15.666 ( 8.852 6.347 -12.923) 16.901 16.004 ( -15.659 5.185 4.776) 17.172 16.521 ( 0.948 8.380 0.569) 8.453 ======================= Grid point 372 (182/282) ======================= q-point: (-0.50 0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.536 ( 2.010 0.000 10.260) 10.455 2.615 ( 0.524 -0.000 5.920) 5.944 3.087 ( 2.830 0.000 12.316) 12.637 3.212 ( -1.541 -0.000 10.277) 10.392 3.772 ( 10.101 0.000 11.961) 15.656 4.003 ( -8.261 -0.000 18.868) 20.597 4.126 ( -7.628 -0.000 -5.503) 9.405 4.243 ( 1.522 -0.000 2.166) 2.647 4.669 ( 3.838 0.000 -11.962) 12.562 4.675 ( -1.645 -0.000 -13.999) 14.096 4.929 ( 3.444 -0.000 -1.628) 3.809 5.080 ( -6.355 -0.000 2.218) 6.731 5.700 ( 3.306 0.000 -10.678) 11.178 5.849 ( 1.798 -0.000 -8.055) 8.253 6.048 ( -7.091 0.000 0.628) 7.118 6.279 ( -1.757 -0.000 5.533) 5.805 6.466 ( 2.191 -0.000 1.294) 2.545 6.627 ( -1.422 -0.000 4.571) 4.787 7.328 ( 6.974 0.000 -2.684) 7.473 7.428 ( -1.510 -0.000 -6.576) 6.747 7.667 ( 2.390 -0.000 4.424) 5.028 7.698 ( -2.342 -0.000 4.024) 4.656 7.829 ( -1.155 -0.000 0.148) 1.165 7.871 ( 1.768 -0.000 1.476) 2.303 8.245 ( -4.581 -0.000 0.960) 4.680 8.634 ( 9.283 -0.000 -14.793) 17.465 8.943 ( -4.245 -0.000 -3.345) 5.404 8.984 ( 3.597 0.000 7.197) 8.046 9.524 ( 3.806 0.000 -4.576) 5.952 9.616 ( -0.990 0.000 -5.017) 5.114 9.760 ( 3.968 -0.000 0.331) 3.982 9.795 ( -2.418 -0.000 4.562) 5.164 10.325 ( 0.198 -0.000 -3.092) 3.098 10.482 ( 5.151 0.000 -12.261) 13.299 10.710 ( 2.124 -0.000 -11.902) 12.090 10.727 ( -1.936 -0.000 -10.107) 10.291 10.973 ( -1.038 0.000 -3.611) 3.757 11.291 ( -8.501 -0.000 -6.187) 10.514 11.723 ( 3.523 -0.000 2.653) 4.410 11.844 ( -8.739 -0.000 -2.291) 9.034 12.207 ( 5.723 -0.000 3.698) 6.813 12.358 ( -1.163 -0.000 2.213) 2.500 12.834 ( -14.316 -0.000 15.443) 21.058 13.496 ( 15.704 -0.000 4.489) 16.333 14.981 ( -0.619 -0.000 12.789) 12.804 15.917 ( -1.190 -0.000 -2.111) 2.423 16.600 ( -3.017 -0.000 -4.184) 5.158 16.969 ( -2.455 -0.000 -11.470) 11.730 ======================= Grid point 374 (183/282) ======================= q-point: (-0.40 0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.619 ( -0.082 8.055 14.609) 16.682 2.759 ( 0.435 -10.058 8.718) 13.317 3.260 ( 9.603 11.080 12.884) 19.518 3.404 ( 7.817 -7.701 9.844) 14.741 3.882 ( 2.759 7.883 -8.459) 11.887 3.977 ( -7.015 -3.539 -2.339) 8.198 4.069 ( -8.206 -2.073 13.275) 15.744 4.268 ( 3.296 -2.046 3.332) 5.114 4.549 ( 4.069 8.770 -7.621) 12.310 4.683 ( 4.630 -8.611 -7.820) 12.519 4.961 ( 2.336 1.122 -0.492) 2.638 5.054 ( -2.196 -4.320 5.147) 7.069 5.647 ( 5.129 6.649 -8.227) 11.756 5.755 ( 1.443 0.637 -13.093) 13.188 5.963 ( -0.293 14.078 6.278) 15.418 6.286 ( 3.988 1.173 -2.751) 4.984 6.460 ( 2.329 13.760 2.189) 14.127 6.851 ( -1.881 -30.768 11.660) 32.957 7.196 ( 1.753 19.211 -7.553) 20.717 7.519 ( 1.644 -17.777 -3.457) 18.185 7.718 ( 0.809 -0.255 2.817) 2.942 7.744 ( 1.658 -0.434 3.687) 4.066 7.835 ( -0.494 -1.663 0.414) 1.784 7.927 ( 4.463 -1.149 -0.952) 4.706 8.103 ( -9.143 -0.368 -6.837) 11.423 8.550 ( 0.983 1.008 -16.718) 16.778 8.894 ( -3.665 0.307 6.345) 7.334 9.073 ( -1.472 -1.447 4.280) 4.752 9.517 ( 3.284 6.574 1.579) 7.516 9.653 ( 2.184 -10.845 -1.765) 11.203 9.814 ( 0.441 2.013 6.162) 6.497 9.859 ( 4.645 -1.043 3.147) 5.707 10.316 ( 2.179 -2.660 -3.293) 4.761 10.425 ( 5.661 1.516 -14.545) 15.681 10.573 ( -3.209 3.523 -8.930) 10.121 10.627 ( 2.470 -2.990 -13.613) 14.155 10.999 ( 6.210 1.836 -1.235) 6.593 11.096 ( -6.587 0.522 -6.792) 9.476 11.642 ( -14.593 0.861 -1.696) 14.716 11.788 ( 1.315 0.000 2.780) 3.075 12.316 ( -4.339 0.413 2.569) 5.059 12.327 ( 1.022 -1.434 4.407) 4.745 12.762 ( -12.303 0.681 12.263) 17.384 13.782 ( 16.317 0.859 3.226) 16.655 15.101 ( 1.869 2.226 11.156) 11.529 15.886 ( 0.618 0.854 -3.441) 3.598 16.483 ( -6.510 2.514 -3.404) 7.764 16.793 ( -5.275 2.282 -8.242) 10.048 ======================= Grid point 375 (184/282) ======================= q-point: (-0.30 0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.709 ( -2.103 2.986 15.527) 15.951 2.925 ( -0.002 -6.130 11.402) 12.945 3.440 ( 3.655 5.016 10.179) 11.922 3.642 ( 5.038 2.078 9.276) 10.758 3.730 ( 0.397 3.745 -13.457) 13.974 3.823 ( -0.089 -2.586 -19.925) 20.092 4.127 ( -3.498 0.667 21.660) 21.951 4.406 ( 4.496 -2.297 1.174) 5.183 4.497 ( 4.011 6.997 -2.116) 8.338 4.753 ( 5.124 -8.837 -5.688) 11.691 5.000 ( 3.838 -0.917 -0.220) 3.952 5.164 ( 5.084 -0.178 4.586) 6.849 5.613 ( 6.107 8.229 -1.021) 10.298 5.670 ( 2.798 -0.672 -10.214) 10.612 5.928 ( 3.480 18.890 6.423) 20.253 6.358 ( 8.265 -2.763 -2.824) 9.161 6.419 ( 4.100 10.884 -0.508) 11.642 7.012 ( 2.945 10.297 -7.962) 13.345 7.146 ( -4.731 -24.053 7.088) 25.518 7.576 ( -5.486 -6.842 -2.026) 9.000 7.731 ( -5.514 0.505 -0.761) 5.589 7.748 ( -2.769 -3.807 0.882) 4.790 7.828 ( -1.398 -4.340 0.347) 4.573 7.996 ( 5.714 -1.956 -2.995) 6.741 8.041 ( 8.266 -3.909 -1.306) 9.236 8.337 ( -5.744 1.660 -16.241) 17.307 8.930 ( -3.961 -1.135 10.595) 11.368 9.066 ( -3.783 -4.384 -0.463) 5.809 9.557 ( 2.814 2.652 2.907) 4.838 9.743 ( 1.569 -6.841 0.114) 7.020 9.868 ( -1.975 2.679 10.107) 10.641 10.000 ( 8.245 -0.034 3.764) 9.063 10.341 ( 3.682 1.326 -16.444) 16.904 10.389 ( 6.496 -4.567 -3.278) 8.591 10.436 ( -1.551 2.653 -1.569) 3.450 10.573 ( 5.074 -2.579 -13.911) 15.030 10.924 ( -2.720 3.159 -5.566) 6.954 11.131 ( 9.788 1.377 0.231) 9.887 11.372 ( -17.246 2.244 -0.487) 17.398 11.811 ( -2.180 -0.134 2.856) 3.596 12.216 ( -10.572 1.003 4.576) 11.564 12.393 ( -1.040 -0.661 3.489) 3.700 12.709 ( -6.526 -1.609 6.752) 9.527 14.007 ( 12.563 2.325 -1.024) 12.817 15.224 ( 3.656 2.916 10.191) 11.213 15.839 ( 1.959 4.097 -6.668) 8.068 16.301 ( -11.436 4.178 -0.188) 12.177 16.657 ( -2.272 2.843 -2.810) 4.598 ======================= Grid point 376 (185/282) ======================= q-point: (-0.20 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.803 ( -4.385 -1.166 14.398) 15.096 3.064 ( -1.283 -2.093 11.348) 11.611 3.418 ( -9.967 -0.005 3.793) 10.664 3.583 ( 1.153 0.210 -15.739) 15.782 3.633 ( -1.012 0.183 -14.432) 14.468 3.735 ( -5.166 7.330 11.424) 14.523 4.347 ( 10.395 -1.205 4.290) 11.309 4.444 ( 0.712 4.377 -0.028) 4.435 4.542 ( 7.238 3.883 6.245) 10.318 4.873 ( 7.298 -8.945 -5.626) 12.843 5.064 ( 2.476 -0.591 0.935) 2.712 5.219 ( 6.444 11.627 0.241) 13.295 5.642 ( 3.799 -0.854 -7.650) 8.584 5.757 ( 10.141 -3.126 6.325) 12.354 5.906 ( 4.768 17.907 6.484) 19.633 6.426 ( 7.854 6.295 -1.934) 10.250 6.514 ( 9.311 -4.548 0.497) 10.375 6.920 ( 3.386 2.838 -11.169) 12.011 7.182 ( -9.250 -6.913 0.553) 11.561 7.534 ( -4.219 -12.170 1.639) 12.984 7.662 ( -3.305 2.935 0.592) 4.459 7.736 ( -4.116 -1.858 1.345) 4.712 7.835 ( -4.955 -3.869 1.610) 6.489 8.031 ( -8.172 -1.974 -14.364) 16.643 8.129 ( 10.396 -5.255 -2.333) 11.880 8.264 ( 11.441 -5.933 0.720) 12.908 8.960 ( -5.032 -3.022 3.686) 6.931 9.036 ( -5.545 -6.109 1.918) 8.471 9.607 ( 2.907 1.388 1.390) 3.508 9.813 ( 3.939 -2.067 -1.415) 4.668 9.900 ( -3.784 1.903 8.142) 9.178 10.161 ( 3.898 -1.384 7.234) 8.333 10.219 ( 0.955 2.497 -9.636) 10.000 10.383 ( 5.210 1.340 -7.838) 9.506 10.491 ( 0.551 1.496 -0.386) 1.640 10.596 ( 10.001 -3.018 -6.567) 12.339 10.856 ( 1.599 1.564 -1.439) 2.660 11.106 ( -12.674 1.982 -1.033) 12.870 11.281 ( 10.342 3.239 1.115) 10.895 11.779 ( -5.821 -0.937 2.442) 6.382 12.079 ( -13.710 2.011 7.948) 15.974 12.365 ( -4.047 2.822 1.386) 5.125 12.735 ( -0.221 -7.169 1.411) 7.309 14.089 ( 5.797 3.013 -6.713) 9.368 15.383 ( 5.844 1.103 11.125) 12.615 15.765 ( 5.177 6.168 -10.153) 12.959 16.077 ( -16.423 4.214 4.709) 17.596 16.625 ( 2.365 5.051 1.098) 5.684 ======================= Grid point 377 (186/282) ======================= q-point: (-0.10 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.857 ( -9.191 -5.173 12.179) 16.111 3.071 ( -10.466 -0.053 2.383) 10.734 3.321 ( -1.600 0.828 -5.667) 5.947 3.436 ( -9.924 -3.604 1.232) 10.629 3.503 ( 0.396 -1.857 -10.049) 10.226 3.675 ( -6.739 6.147 7.985) 12.123 4.359 ( -2.999 10.162 -1.256) 10.670 4.449 ( 6.972 3.462 -6.346) 10.043 4.720 ( 6.549 8.115 2.526) 10.729 4.933 ( 5.014 -5.608 -2.077) 7.804 5.197 ( 3.266 -7.940 6.477) 10.755 5.217 ( 4.123 12.856 3.900) 14.053 5.646 ( 4.258 -2.528 -6.777) 8.393 5.875 ( 4.602 2.722 -2.140) 5.759 6.064 ( 10.002 0.919 11.483) 15.256 6.535 ( 11.878 2.253 -0.165) 12.091 6.679 ( 4.623 -5.655 -0.386) 7.314 6.853 ( 2.932 -1.663 -6.347) 7.187 7.173 ( 5.447 -1.910 -1.645) 6.002 7.528 ( -13.823 2.900 0.343) 14.128 7.590 ( -0.950 6.068 0.159) 6.144 7.630 ( -8.783 -5.357 -5.105) 11.485 7.705 ( -2.072 0.495 0.296) 2.151 7.986 ( 0.423 -13.626 -1.767) 13.746 8.324 ( 11.545 -8.990 -4.106) 15.197 8.514 ( 10.652 -6.897 3.728) 13.226 8.895 ( -6.396 -3.869 -3.172) 8.121 9.010 ( -6.933 -5.644 1.344) 9.040 9.636 ( 1.455 1.656 -1.162) 2.492 9.862 ( 1.094 1.378 2.531) 3.082 9.883 ( -3.291 -0.394 1.422) 3.607 10.124 ( 1.513 3.194 -7.836) 8.596 10.214 ( 0.325 5.197 -2.367) 5.720 10.408 ( -3.957 1.382 5.380) 6.820 10.536 ( 10.486 3.100 4.270) 11.739 10.645 ( 2.751 4.449 -1.356) 5.404 10.933 ( 4.260 -7.549 1.228) 8.755 11.011 ( 5.073 0.763 -2.536) 5.723 11.395 ( 7.117 4.192 -0.566) 8.279 11.690 ( -10.556 -1.589 1.415) 10.768 11.960 ( -11.112 2.716 12.887) 17.232 12.283 ( -2.787 4.086 -1.105) 5.068 12.809 ( 0.390 -10.193 -1.680) 10.338 14.019 ( -0.059 2.230 -11.209) 11.428 15.573 ( 2.048 0.836 7.154) 7.488 15.720 ( 7.183 1.820 -7.592) 10.609 15.878 ( -11.406 3.229 9.780) 15.368 16.650 ( 5.523 9.092 2.063) 10.836 ======================= Grid point 384 (187/282) ======================= q-point: (-0.40 0.60 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.743 ( -2.704 0.000 10.397) 10.743 2.866 ( 0.766 -0.000 17.017) 17.034 3.478 ( -2.647 0.000 9.999) 10.343 3.661 ( 12.762 -0.000 9.764) 16.069 3.775 ( 0.522 -0.000 -15.687) 15.696 3.787 ( -0.457 0.000 -19.716) 19.721 4.135 ( -8.346 0.000 24.117) 25.520 4.379 ( 7.037 -0.000 4.167) 8.178 4.609 ( 8.689 -0.000 -12.432) 15.167 4.627 ( 1.318 -0.000 -0.621) 1.457 4.994 ( 2.431 -0.000 -1.847) 3.053 5.154 ( 7.632 -0.000 9.877) 12.482 5.647 ( 1.746 -0.000 -12.233) 12.357 5.697 ( 7.803 -0.000 -6.311) 10.036 6.097 ( 5.111 -0.000 2.735) 5.796 6.328 ( 5.697 -0.000 -3.524) 6.699 6.686 ( -3.299 0.000 5.491) 6.406 6.743 ( 2.866 -0.000 12.539) 12.862 7.158 ( -4.854 0.000 -10.230) 11.323 7.487 ( 4.265 -0.000 1.432) 4.499 7.676 ( -12.153 0.000 -5.589) 13.377 7.770 ( -1.361 0.000 0.704) 1.532 7.801 ( 0.326 -0.000 3.137) 3.154 7.987 ( 4.133 -0.000 -3.270) 5.271 8.004 ( 8.657 -0.000 -2.084) 8.904 8.351 ( -5.798 0.000 -16.659) 17.639 8.926 ( -4.186 0.000 10.483) 11.288 9.025 ( -4.616 0.000 -1.133) 4.753 9.604 ( 3.333 -0.000 0.920) 3.458 9.656 ( 1.991 -0.000 2.864) 3.488 9.909 ( -0.855 0.000 12.422) 12.451 9.988 ( 8.799 -0.000 -0.952) 8.851 10.344 ( 6.244 -0.000 0.511) 6.265 10.348 ( 4.401 -0.000 -18.415) 18.934 10.466 ( -2.037 0.000 -5.169) 5.556 10.555 ( 4.962 -0.000 -11.546) 12.567 10.950 ( -2.465 0.000 -6.827) 7.259 11.140 ( 10.424 -0.000 0.793) 10.454 11.391 ( -17.634 0.000 0.247) 17.636 11.809 ( -2.449 0.000 2.949) 3.833 12.224 ( -10.491 0.000 4.807) 11.540 12.387 ( 0.729 -0.000 3.043) 3.129 12.698 ( -8.541 0.000 6.864) 10.957 14.025 ( 12.423 -0.000 -0.640) 12.439 15.249 ( 3.098 -0.000 9.636) 10.121 15.871 ( 1.342 -0.000 -4.037) 4.254 16.335 ( -11.269 0.000 -1.255) 11.338 16.678 ( -2.455 0.000 -3.192) 4.026 ======================= Grid point 386 (188/282) ======================= q-point: (-0.30 -0.40 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.791 ( -5.875 -0.421 12.187) 13.536 3.040 ( -0.108 -0.860 14.801) 14.826 3.419 ( -15.010 0.056 9.527) 17.778 3.580 ( 0.932 -0.290 -20.097) 20.121 3.635 ( -1.401 0.180 -14.386) 14.455 3.837 ( -0.224 4.439 6.344) 7.746 4.307 ( 4.564 -2.421 13.262) 14.233 4.508 ( 7.426 2.942 -0.216) 7.990 4.609 ( 6.718 4.505 -2.417) 8.442 4.741 ( 8.212 -7.021 -0.369) 10.810 5.015 ( 0.599 -2.937 -0.334) 3.016 5.370 ( 11.853 6.152 2.255) 13.544 5.590 ( 3.989 -4.027 -9.944) 11.446 5.781 ( 9.085 3.326 1.262) 9.757 6.157 ( 3.105 10.923 4.431) 12.190 6.412 ( 6.452 -3.977 -1.286) 7.687 6.604 ( 1.889 12.705 2.739) 13.133 6.953 ( -7.034 0.077 -7.495) 10.279 6.994 ( 0.283 -14.495 6.766) 15.999 7.433 ( -6.875 -0.632 -3.258) 7.634 7.597 ( 0.369 -7.025 3.029) 7.659 7.747 ( -1.649 2.026 0.098) 2.614 7.810 ( -1.388 -0.425 0.331) 1.489 8.023 ( -10.504 -0.054 -14.283) 17.730 8.077 ( 9.132 -1.565 -3.070) 9.760 8.197 ( 10.615 -2.448 -1.031) 10.942 8.931 ( -5.116 -0.692 0.129) 5.164 8.962 ( -6.015 -3.086 6.386) 9.300 9.651 ( 4.548 4.438 -0.452) 6.371 9.737 ( 4.503 -6.208 -1.804) 7.879 9.981 ( -2.281 7.054 9.560) 12.098 10.103 ( 3.275 -6.049 2.099) 7.192 10.236 ( 3.312 0.321 -11.307) 11.786 10.419 ( 2.028 2.151 -3.505) 4.585 10.495 ( 3.467 -0.331 2.652) 4.377 10.550 ( 13.082 -1.828 -9.926) 16.523 10.897 ( 3.296 1.935 -3.699) 5.319 11.128 ( -17.327 0.765 2.064) 17.467 11.318 ( 11.342 1.440 1.616) 11.547 11.765 ( -7.116 -0.668 2.321) 7.515 12.099 ( -13.846 0.681 8.388) 16.203 12.404 ( -0.689 1.674 1.161) 2.150 12.654 ( -3.340 -3.038 1.206) 4.673 14.120 ( 5.104 1.054 -6.671) 8.466 15.397 ( 4.707 0.541 9.891) 10.967 15.836 ( 2.720 2.627 -7.464) 8.367 16.124 ( -16.749 1.676 3.687) 17.231 16.674 ( 3.286 1.507 1.598) 3.953 ======================= Grid point 387 (189/282) ======================= q-point: (-0.20 -0.40 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.793 ( -11.613 -3.067 11.980) 16.965 3.069 ( -12.840 -0.145 2.395) 13.063 3.325 ( -9.947 -0.365 15.445) 18.375 3.410 ( -2.295 0.113 -13.360) 13.556 3.475 ( 0.379 -1.718 -13.715) 13.827 3.775 ( -7.374 6.106 5.655) 11.119 4.457 ( 5.990 2.012 -4.136) 7.552 4.533 ( 5.499 7.659 -6.140) 11.252 4.704 ( -2.417 -6.575 12.998) 14.766 4.903 ( 9.314 1.393 -6.473) 11.428 5.066 ( 0.118 -8.784 3.993) 9.649 5.421 ( 6.386 11.939 -0.955) 13.573 5.619 ( 6.577 -1.481 -8.571) 10.904 5.933 ( 7.727 3.409 3.160) 9.017 6.155 ( 2.361 9.614 9.126) 13.464 6.540 ( 6.698 -2.720 2.465) 7.638 6.613 ( 1.367 -1.472 -2.240) 3.009 6.838 ( 3.611 0.198 -4.179) 5.527 7.126 ( 2.205 -4.325 3.299) 5.870 7.432 ( 0.864 -10.467 -0.677) 10.524 7.590 ( -17.814 1.595 -0.078) 17.885 7.692 ( -0.329 4.258 -0.567) 4.308 7.740 ( -2.390 0.340 -2.625) 3.566 7.820 ( 3.625 -6.278 -5.771) 9.266 8.208 ( 9.580 -5.651 -5.096) 12.234 8.422 ( 11.278 -4.626 3.474) 12.676 8.845 ( -5.522 -2.513 -2.899) 6.724 8.941 ( -7.962 -3.202 4.712) 9.790 9.667 ( 2.970 2.681 -2.636) 4.791 9.817 ( 6.147 -4.636 -9.442) 12.183 9.942 ( -3.436 5.629 4.739) 8.121 10.137 ( 4.257 -1.365 -6.228) 7.667 10.296 ( 0.930 3.646 5.365) 6.553 10.402 ( 1.336 1.337 0.113) 1.894 10.545 ( 6.136 -2.698 1.556) 6.881 10.725 ( 9.418 3.353 -2.688) 10.352 10.880 ( -5.582 1.364 4.996) 7.614 11.008 ( 5.933 -1.101 -0.514) 6.057 11.449 ( 5.514 2.873 -0.883) 6.280 11.658 ( -10.763 -2.342 1.227) 11.083 11.989 ( -12.074 1.270 14.332) 18.782 12.361 ( -1.143 5.494 -0.993) 5.699 12.668 ( -0.175 -7.885 -2.562) 8.293 14.046 ( -1.283 1.222 -11.327) 11.464 15.579 ( 5.430 0.059 9.725) 11.138 15.755 ( 0.166 2.249 -11.106) 11.333 15.920 ( -13.860 2.016 10.034) 17.229 16.757 ( 6.796 4.746 3.037) 8.828 ======================= Grid point 388 (190/282) ======================= q-point: (-0.10 -0.40 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.720 ( -18.414 -6.413 12.130) 22.964 2.747 ( -26.077 -4.058 -4.609) 26.790 3.224 ( 1.918 3.314 -15.729) 16.188 3.387 ( -4.064 -1.905 4.388) 6.277 3.432 ( -3.428 -2.530 8.518) 9.524 3.694 ( -6.237 4.753 8.533) 11.589 4.390 ( -2.344 9.878 -3.187) 10.641 4.465 ( 0.516 2.694 -8.132) 8.582 4.775 ( -14.960 -5.872 12.366) 20.278 4.890 ( 3.950 -1.352 -7.812) 8.857 5.182 ( 4.992 -3.686 -3.505) 7.127 5.454 ( 5.536 6.310 5.211) 9.880 5.625 ( 4.856 0.867 -7.889) 9.305 5.969 ( 2.885 8.625 1.368) 9.197 6.296 ( 6.272 0.878 7.999) 10.202 6.588 ( -1.799 -6.498 -6.322) 9.243 6.715 ( 8.410 -1.952 4.451) 9.713 6.941 ( 8.650 -0.041 -0.506) 8.664 7.161 ( -15.888 -4.190 -0.579) 16.442 7.297 ( 1.739 0.927 -2.366) 3.079 7.515 ( 2.412 -6.735 -2.964) 7.744 7.654 ( 0.439 7.160 0.214) 7.177 7.785 ( 7.515 2.763 4.637) 9.253 7.927 ( 6.018 -8.676 -1.822) 10.715 8.349 ( 8.900 -9.390 -6.918) 14.671 8.619 ( 1.685 -4.002 4.671) 6.378 8.732 ( -7.893 -0.376 -3.394) 8.600 8.889 ( -2.420 -6.318 -1.218) 6.874 9.645 ( 0.936 2.248 -3.934) 4.627 9.793 ( 0.979 -3.876 -8.565) 9.452 9.941 ( 1.863 5.234 3.583) 6.611 10.117 ( -0.598 6.332 -6.317) 8.965 10.266 ( 4.979 5.914 -0.937) 7.788 10.448 ( -2.778 2.999 8.594) 9.517 10.662 ( 0.049 1.171 -1.726) 2.087 10.756 ( 7.724 -2.674 7.968) 11.415 10.992 ( 10.166 -3.478 -1.652) 10.871 11.184 ( 12.537 2.048 5.217) 13.733 11.386 ( -9.915 -0.253 -3.204) 10.423 11.522 ( -8.119 -2.214 1.616) 8.569 12.036 ( -1.700 3.230 17.463) 17.840 12.277 ( -1.379 6.137 -2.495) 6.767 12.691 ( -1.864 -9.687 -4.185) 10.716 13.868 ( -4.469 0.673 -13.577) 14.309 15.476 ( -15.290 4.506 -1.343) 15.997 15.853 ( 8.206 -5.300 8.688) 13.073 15.901 ( 1.854 -0.144 3.045) 3.568 16.843 ( 7.928 8.160 1.175) 11.437 ======================= Grid point 396 (191/282) ======================= q-point: (-0.30 -0.30 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.769 ( -12.404 0.000 11.887) 17.180 3.068 ( -13.968 0.000 2.415) 14.175 3.320 ( -13.082 0.000 22.254) 25.815 3.418 ( 1.691 -0.000 -16.855) 16.940 3.458 ( -0.404 0.000 -15.996) 16.002 3.829 ( -7.192 0.000 3.984) 8.221 4.466 ( 8.484 -0.000 -2.579) 8.868 4.617 ( 6.492 -0.000 -3.932) 7.590 4.631 ( -5.702 0.000 5.565) 7.968 4.934 ( 14.322 -0.000 3.170) 14.669 4.970 ( -5.479 0.000 0.767) 5.532 5.524 ( 3.472 -0.000 -9.444) 10.062 5.601 ( 13.215 -0.000 -3.784) 13.746 5.965 ( 8.948 -0.000 4.869) 10.187 6.251 ( -2.340 0.000 6.833) 7.222 6.505 ( 6.721 -0.000 3.958) 7.799 6.606 ( -5.054 0.000 -3.293) 6.032 6.853 ( 3.009 -0.000 -3.308) 4.472 7.072 ( 4.757 -0.000 8.102) 9.395 7.342 ( -0.134 0.000 -1.506) 1.512 7.602 ( -15.926 0.000 3.214) 16.248 7.714 ( 2.495 -0.000 -12.129) 12.383 7.731 ( -0.454 0.000 -0.805) 0.924 7.794 ( 0.994 -0.000 -1.702) 1.971 8.164 ( 8.695 -0.000 -5.536) 10.308 8.385 ( 11.676 -0.000 3.412) 12.165 8.825 ( -4.943 0.000 -2.448) 5.516 8.916 ( -8.430 0.000 5.788) 10.225 9.704 ( 1.664 -0.000 -3.662) 4.023 9.762 ( 7.881 -0.000 -8.365) 11.493 10.003 ( -0.884 0.000 -3.879) 3.978 10.112 ( 4.879 -0.000 -1.543) 5.118 10.308 ( 2.114 -0.000 11.024) 11.225 10.473 ( 2.015 0.000 -7.232) 7.508 10.473 ( 3.533 0.000 3.782) 5.175 10.745 ( 14.467 -0.000 -1.659) 14.562 10.911 ( -14.366 0.000 4.983) 15.206 10.992 ( 10.064 -0.000 0.159) 10.066 11.474 ( 5.028 -0.000 -1.161) 5.160 11.635 ( -11.266 0.000 1.347) 11.346 11.999 ( -12.408 0.000 14.883) 19.377 12.416 ( 0.315 -0.000 -0.445) 0.545 12.595 ( -1.048 0.000 -3.442) 3.598 14.055 ( -1.710 0.000 -11.379) 11.507 15.578 ( 6.323 -0.000 9.935) 11.776 15.774 ( -2.488 0.000 -11.731) 11.992 15.936 ( -14.525 0.000 10.089) 17.685 16.793 ( 7.298 -0.000 3.478) 8.085 ======================= Grid point 397 (192/282) ======================= q-point: (-0.20 -0.30 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.652 ( -19.774 -2.282 13.024) 23.787 2.704 ( -29.144 -1.505 -4.621) 29.547 3.273 ( 0.375 2.617 -13.633) 13.887 3.357 ( 1.006 -1.832 -6.427) 6.758 3.404 ( -6.486 -0.966 17.838) 19.005 3.762 ( -6.395 3.153 7.342) 10.234 4.408 ( -12.486 -2.309 -3.699) 13.226 4.581 ( -0.280 7.017 -1.962) 7.292 4.651 ( -7.732 -4.439 7.877) 11.897 4.880 ( -1.254 -2.966 -7.029) 7.731 5.156 ( 12.188 0.409 -1.441) 12.279 5.494 ( 3.820 -0.033 -6.688) 7.703 5.694 ( 8.309 5.028 -6.474) 11.672 6.106 ( 4.908 6.378 4.550) 9.245 6.308 ( 1.225 0.419 8.183) 8.285 6.503 ( -4.130 -3.409 -3.049) 6.162 6.676 ( 6.484 -2.394 6.698) 9.625 6.943 ( 9.219 0.234 -0.260) 9.225 7.101 ( -15.897 -2.614 -2.005) 16.234 7.321 ( -0.080 2.135 -2.452) 3.252 7.407 ( 4.626 -5.942 -1.578) 7.694 7.732 ( 2.213 2.831 0.617) 3.646 7.814 ( 5.303 0.793 5.304) 7.542 7.839 ( 9.806 -2.823 -3.781) 10.882 8.247 ( 8.607 -3.614 -6.395) 11.315 8.572 ( 4.371 -1.777 4.945) 6.835 8.738 ( -3.676 1.000 -2.147) 4.373 8.815 ( -8.800 -3.155 0.459) 9.359 9.671 ( 0.868 1.274 -5.040) 5.270 9.744 ( 1.815 -2.317 -9.853) 10.283 10.014 ( 8.629 3.596 -4.368) 10.319 10.168 ( 3.863 0.314 -4.580) 6.000 10.377 ( 2.158 7.981 0.080) 8.268 10.454 ( 0.080 -1.661 6.894) 7.092 10.648 ( 4.446 -4.979 8.689) 10.957 10.716 ( -7.859 0.559 2.510) 8.269 10.997 ( 14.112 2.071 -0.026) 14.264 11.187 ( 10.993 -1.096 3.310) 11.533 11.386 ( -11.828 0.187 -3.412) 12.312 11.491 ( -8.168 -1.219 3.001) 8.787 12.070 ( -1.011 1.189 18.880) 18.944 12.379 ( -0.755 6.055 -2.289) 6.517 12.560 ( -1.363 -6.831 -5.857) 9.101 13.875 ( -5.144 0.226 -13.458) 14.409 15.534 ( -15.987 2.497 -2.141) 16.322 15.786 ( 7.241 -2.814 8.611) 11.598 15.901 ( -0.099 0.075 2.762) 2.765 16.928 ( 7.708 2.837 1.591) 8.366 ======================= Grid point 398 (193/282) ======================= q-point: (-0.10 -0.30 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.192 ( -32.310 -5.512 -6.767) 33.467 2.480 ( -25.368 -5.779 16.732) 30.934 3.142 ( 0.137 2.429 -8.778) 9.108 3.361 ( 2.008 -1.892 -1.057) 2.955 3.472 ( -8.424 -0.389 17.766) 19.666 3.724 ( -7.097 4.102 10.231) 13.110 4.150 ( -31.578 -12.129 12.736) 36.145 4.458 ( -0.829 11.128 -5.979) 12.660 4.609 ( -5.615 -3.927 0.056) 6.852 4.849 ( 3.717 -3.824 -11.087) 12.303 5.238 ( 7.402 5.237 -7.858) 11.999 5.514 ( 3.931 -3.701 -5.354) 7.604 5.683 ( 3.759 6.438 -4.147) 8.531 6.106 ( 0.228 12.394 3.535) 12.890 6.330 ( -4.163 -3.468 -4.538) 7.068 6.519 ( 0.414 -2.542 4.761) 5.413 6.669 ( -16.127 -2.974 -9.087) 18.748 6.930 ( -0.721 -7.534 10.759) 13.154 7.119 ( 10.046 -0.244 2.469) 10.348 7.403 ( 8.524 1.848 0.350) 8.729 7.510 ( 7.791 -3.475 -4.451) 9.623 7.763 ( 4.589 7.270 2.796) 9.040 7.937 ( 12.193 -3.215 -7.385) 14.613 8.046 ( 9.590 -0.672 8.479) 12.819 8.353 ( 7.039 -4.458 -4.614) 9.524 8.568 ( -9.470 -0.265 3.224) 10.007 8.591 ( -8.524 1.847 -2.340) 9.030 8.835 ( 3.879 -7.680 -2.251) 8.893 9.620 ( -0.631 1.147 -3.969) 4.179 9.720 ( 3.609 -3.659 -6.994) 8.679 10.053 ( 2.149 6.157 -9.711) 11.698 10.098 ( 5.880 7.511 -2.905) 9.972 10.398 ( 0.142 5.483 7.108) 8.979 10.506 ( -1.613 1.118 5.207) 5.565 10.660 ( 3.054 -0.973 -2.652) 4.161 10.869 ( 2.926 -8.020 7.338) 11.258 11.107 ( -2.273 -1.064 -2.774) 3.741 11.155 ( -5.211 3.052 -1.033) 6.127 11.346 ( 4.775 -7.676 0.319) 9.045 11.585 ( 11.832 4.902 10.267) 16.414 12.236 ( 0.115 2.994 14.645) 14.949 12.269 ( -2.183 7.240 -2.309) 7.906 12.533 ( -3.543 -9.093 -3.940) 10.524 13.652 ( -6.098 -0.025 -13.724) 15.018 15.246 ( -18.620 2.966 2.358) 19.002 15.960 ( 3.797 -1.267 2.664) 4.808 16.012 ( 9.153 -5.766 4.442) 11.694 16.994 ( 5.827 4.572 -4.016) 8.426 ======================= Grid point 407 (194/282) ======================= q-point: (-0.20 -0.20 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.149 ( -33.874 0.000 -6.635) 34.517 2.436 ( -26.335 0.000 17.248) 31.481 3.165 ( -1.026 0.000 -8.509) 8.571 3.343 ( 3.318 -0.000 -2.015) 3.882 3.469 ( -8.452 0.000 18.721) 20.540 3.771 ( -4.882 0.000 8.362) 9.683 4.033 ( -40.621 0.000 18.683) 44.712 4.557 ( -3.723 0.000 -2.115) 4.282 4.590 ( 1.103 -0.000 -9.010) 9.078 4.790 ( 2.122 -0.000 -9.704) 9.933 5.299 ( 9.820 -0.000 -6.288) 11.661 5.473 ( 3.602 -0.000 -7.736) 8.534 5.743 ( 4.419 -0.000 -7.354) 8.579 6.228 ( 1.790 -0.000 2.712) 3.250 6.290 ( -4.636 0.000 -3.871) 6.039 6.498 ( -1.128 0.000 10.241) 10.303 6.646 ( -17.469 0.000 -10.520) 20.392 6.851 ( -4.352 0.000 10.136) 11.031 7.119 ( 11.991 -0.000 3.069) 12.377 7.417 ( 10.199 -0.000 -1.118) 10.260 7.481 ( 9.771 -0.000 -3.118) 10.257 7.827 ( 5.599 -0.000 2.973) 6.340 7.905 ( 10.889 -0.000 -7.108) 13.004 8.038 ( 9.761 -0.000 8.886) 13.200 8.315 ( 9.003 -0.000 -3.518) 9.666 8.564 ( -9.247 0.000 4.932) 10.480 8.618 ( -11.236 0.000 -2.719) 11.561 8.767 ( 5.305 -0.000 -2.093) 5.703 9.630 ( -0.403 0.000 -4.783) 4.800 9.689 ( 3.720 -0.000 -7.187) 8.093 10.123 ( 0.422 -0.000 -11.034) 11.042 10.143 ( 12.955 -0.000 -7.047) 14.748 10.478 ( -1.570 0.000 3.420) 3.763 10.480 ( -4.462 0.000 10.396) 11.313 10.658 ( 4.791 -0.000 -4.535) 6.597 10.788 ( 1.423 -0.000 12.070) 12.154 11.111 ( -13.766 0.000 -2.510) 13.993 11.188 ( -6.590 0.000 -0.046) 6.590 11.267 ( 15.150 -0.000 -0.143) 15.151 11.625 ( 13.058 -0.000 11.046) 17.104 12.261 ( 0.232 -0.000 14.369) 14.371 12.366 ( -2.654 0.000 -2.254) 3.483 12.421 ( -3.005 0.000 -4.904) 5.752 13.652 ( -6.382 0.000 -13.633) 15.053 15.271 ( -19.211 0.000 2.406) 19.361 15.954 ( 5.424 -0.000 -0.135) 5.425 15.962 ( 7.263 -0.000 6.551) 9.781 17.029 ( 4.744 -0.000 -4.182) 6.324 ======================= Grid point 408 (195/282) ======================= q-point: (-0.10 -0.20 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.629 ( -30.795 -4.316 2.299) 31.180 2.223 ( -28.246 -3.534 22.923) 36.549 3.098 ( -0.111 0.570 -2.304) 2.376 3.378 ( -3.852 -0.764 5.502) 6.760 3.490 ( -17.287 -2.427 16.625) 24.107 3.662 ( -25.442 -0.048 25.502) 36.023 3.792 ( -9.275 -5.104 9.530) 14.244 4.440 ( -1.974 7.392 -7.367) 10.621 4.516 ( -0.169 -2.848 -7.109) 7.660 4.741 ( 1.514 -4.685 -10.649) 11.732 5.294 ( 4.142 7.632 -10.188) 13.386 5.472 ( 3.893 -4.704 -8.237) 10.254 5.699 ( 0.839 2.767 -6.863) 7.447 6.139 ( -8.582 5.452 -2.943) 10.585 6.228 ( -0.879 4.466 -2.278) 5.090 6.292 ( -13.608 -5.732 -8.395) 16.986 6.552 ( -2.463 0.035 4.185) 4.856 6.908 ( -4.126 -8.864 4.580) 10.797 7.352 ( 13.058 2.559 5.673) 14.465 7.591 ( 12.112 1.534 1.880) 12.353 7.611 ( 11.501 0.467 -3.720) 12.097 7.921 ( 5.098 5.405 2.767) 7.929 8.015 ( 12.911 -2.783 -10.492) 16.867 8.252 ( 6.487 -0.601 7.261) 9.755 8.376 ( -5.053 3.330 -0.056) 6.052 8.444 ( -11.773 -0.280 3.472) 12.278 8.504 ( 6.608 -2.951 -0.811) 7.283 8.818 ( 1.571 -3.265 -1.324) 3.857 9.572 ( -2.072 0.363 -2.574) 3.324 9.716 ( 6.530 -1.531 -5.631) 8.757 9.973 ( -1.669 4.913 -12.452) 13.490 10.261 ( 12.784 3.353 -6.470) 14.715 10.430 ( -5.923 -1.153 0.864) 6.096 10.485 ( -6.492 -1.713 8.452) 10.794 10.631 ( -7.625 1.873 -3.512) 8.601 10.907 ( 0.664 -2.985 6.103) 6.826 11.028 ( 6.371 0.417 -0.150) 6.386 11.143 ( 0.849 -5.155 1.552) 5.450 11.499 ( 14.755 3.003 -2.049) 15.197 11.937 ( 13.334 5.328 10.507) 17.793 12.185 ( -4.249 0.425 -6.187) 7.517 12.292 ( -5.759 -2.320 -2.465) 6.680 12.507 ( -0.726 -0.813 16.067) 16.103 13.430 ( -5.704 -0.351 -12.488) 13.733 15.019 ( -17.541 1.070 4.874) 18.237 16.052 ( 7.040 0.423 0.092) 7.054 16.133 ( 6.689 -4.061 3.329) 8.503 16.963 ( -2.317 0.078 -13.561) 13.758 ======================= Grid point 418 (196/282) ======================= q-point: (-0.10 -0.10 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.361 ( -15.122 0.000 22.308) 26.950 2.055 ( -24.685 0.000 29.257) 38.279 3.112 ( 1.350 -0.000 3.322) 3.586 3.130 ( -39.218 0.000 30.409) 49.626 3.428 ( -4.149 0.000 8.227) 9.214 3.751 ( -4.455 0.000 2.966) 5.352 3.752 ( -2.119 0.000 20.917) 21.024 4.389 ( -4.885 0.000 -4.649) 6.744 4.391 ( 2.104 -0.000 -11.531) 11.721 4.642 ( -0.377 0.000 -7.672) 7.681 5.231 ( -2.073 0.000 -13.265) 13.426 5.429 ( 5.105 -0.000 -9.089) 10.425 5.623 ( -2.066 0.000 -8.333) 8.585 6.014 ( -4.956 0.000 -6.966) 8.549 6.059 ( -3.187 0.000 -4.439) 5.464 6.197 ( -1.998 0.000 -4.747) 5.150 6.510 ( -7.684 0.000 2.129) 7.974 6.818 ( -2.836 0.000 -3.465) 4.478 7.609 ( 11.193 -0.000 4.267) 11.978 7.759 ( 11.690 -0.000 -3.729) 12.270 7.786 ( 9.583 -0.000 1.031) 9.639 8.028 ( 1.771 -0.000 3.785) 4.178 8.069 ( 8.374 -0.000 -11.258) 14.030 8.295 ( -1.705 0.000 -3.145) 3.578 8.319 ( -5.055 0.000 0.265) 5.062 8.359 ( -0.798 0.000 5.732) 5.788 8.670 ( 9.050 -0.000 7.501) 11.754 8.810 ( -0.901 0.000 1.119) 1.437 9.521 ( -3.484 0.000 1.008) 3.627 9.768 ( 6.568 -0.000 -5.020) 8.267 9.832 ( -4.125 0.000 -10.747) 11.512 10.251 ( -4.210 0.000 -9.778) 10.646 10.421 ( 10.068 -0.000 -3.638) 10.705 10.443 ( -10.346 0.000 2.797) 10.718 10.515 ( -3.282 0.000 7.130) 7.849 10.946 ( 1.099 -0.000 1.196) 1.624 11.117 ( -1.086 0.000 0.733) 1.310 11.269 ( 18.836 -0.000 -2.583) 19.013 11.655 ( 5.520 -0.000 -8.162) 9.853 12.057 ( 2.204 -0.000 -3.571) 4.197 12.135 ( -8.194 0.000 -1.600) 8.349 12.282 ( 10.214 -0.000 9.108) 13.685 12.636 ( -4.937 0.000 17.144) 17.840 13.250 ( -2.161 0.000 -10.232) 10.458 14.844 ( -12.742 0.000 6.515) 14.311 16.171 ( 7.717 -0.000 -0.543) 7.737 16.220 ( 3.793 -0.000 1.479) 4.071 16.650 ( -15.138 0.000 -20.458) 25.450 ======================= Grid point 419 (197/282) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.618 ( 11.143 -0.000 24.646) 27.048 2.776 ( -6.736 0.000 23.410) 24.360 3.263 ( -3.873 0.000 0.467) 3.901 3.387 ( 4.360 -0.000 -4.762) 6.457 3.488 ( 2.392 -0.000 -4.746) 5.315 3.677 ( 3.013 -0.000 12.096) 12.466 3.905 ( 1.374 -0.000 -12.630) 12.705 4.194 ( -5.815 0.000 -6.290) 8.566 4.494 ( -6.376 0.000 8.889) 10.939 4.634 ( -4.739 0.000 2.818) 5.514 4.893 ( -2.305 0.000 31.919) 32.002 5.093 ( -3.825 0.000 -13.425) 13.960 5.220 ( 5.835 -0.000 -9.142) 10.845 5.916 ( 4.237 -0.000 -2.004) 4.687 5.938 ( 3.053 -0.000 -1.716) 3.502 6.007 ( 4.935 -0.000 -2.510) 5.537 6.134 ( -8.373 0.000 -2.799) 8.829 6.312 ( 5.443 -0.000 -21.080) 21.772 7.746 ( -4.486 0.000 -1.842) 4.849 7.780 ( 4.026 -0.000 -3.492) 5.329 7.809 ( 1.914 -0.000 -2.138) 2.869 7.885 ( 1.772 -0.000 -6.225) 6.472 8.067 ( -0.135 0.000 -1.249) 1.257 8.102 ( -1.300 0.000 -3.951) 4.160 8.358 ( 4.845 -0.000 0.931) 4.934 8.386 ( -3.445 0.000 -0.196) 3.451 8.994 ( 0.173 -0.000 8.008) 8.010 9.173 ( -0.137 0.000 2.191) 2.196 9.594 ( -1.452 0.000 4.678) 4.898 9.758 ( -2.922 0.000 10.616) 11.011 9.793 ( 2.998 -0.000 -0.689) 3.076 9.910 ( -0.578 0.000 -0.642) 0.864 10.349 ( -2.941 0.000 2.771) 4.040 10.582 ( 8.602 -0.000 -3.450) 9.268 10.711 ( -1.005 0.000 1.285) 1.632 10.744 ( 0.868 -0.000 -7.243) 7.295 10.913 ( -3.509 0.000 -3.604) 5.030 10.948 ( -6.009 0.000 -8.430) 10.353 11.604 ( -15.599 0.000 -3.703) 16.033 11.661 ( 14.149 -0.000 -5.702) 15.255 12.439 ( -11.870 0.000 2.939) 12.228 12.456 ( 10.356 -0.000 2.220) 10.591 12.966 ( -12.128 0.000 13.262) 17.971 13.302 ( 15.666 -0.000 -3.698) 16.097 14.971 ( 2.454 -0.000 8.132) 8.495 15.450 ( -6.288 0.000 -16.011) 17.201 16.273 ( -3.428 0.000 0.456) 3.458 16.309 ( 2.849 -0.000 -0.919) 2.993 ======================= Grid point 420 (198/282) ======================= q-point: ( 0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.906 ( -2.106 -1.208 14.521) 14.723 3.004 ( 10.541 -2.985 14.946) 18.531 3.234 ( 0.940 1.434 0.718) 1.859 3.401 ( 4.766 -0.835 -5.982) 7.695 3.446 ( 0.286 0.733 -9.811) 9.843 3.806 ( 5.513 1.107 -15.142) 16.152 3.926 ( 8.671 -4.675 12.510) 15.923 4.180 ( 9.026 -5.921 -3.811) 11.448 4.449 ( -13.787 -1.501 16.651) 21.670 4.610 ( -9.379 -1.824 9.712) 13.625 4.885 ( -3.696 0.965 -13.445) 13.977 5.159 ( 7.292 1.273 -7.179) 10.312 5.255 ( 1.064 -0.256 23.487) 23.513 5.865 ( -1.058 6.744 -2.692) 7.338 5.957 ( 4.440 1.035 -2.332) 5.121 6.065 ( 1.007 1.646 -1.683) 2.560 6.165 ( 14.864 -2.157 -3.782) 15.489 6.256 ( 10.889 -4.891 -17.494) 21.179 7.652 ( -6.570 -0.206 -1.367) 6.714 7.766 ( -4.329 1.604 -1.852) 4.974 7.775 ( -2.461 0.911 -1.828) 3.198 7.829 ( -1.424 -4.033 -5.123) 6.674 8.083 ( 3.029 1.222 -1.472) 3.582 8.097 ( 5.940 1.648 0.032) 6.165 8.311 ( -3.893 2.852 -0.581) 4.861 8.419 ( 2.904 2.214 0.592) 3.699 9.091 ( 1.737 -1.629 7.121) 7.508 9.164 ( -0.585 0.117 -2.048) 2.133 9.650 ( 1.829 -1.339 3.753) 4.384 9.788 ( -3.030 3.358 8.143) 9.315 9.835 ( 3.854 -1.569 -1.883) 4.567 9.937 ( -0.299 -3.699 1.864) 4.153 10.319 ( -2.308 3.156 1.922) 4.357 10.606 ( -7.601 6.817 0.256) 10.213 10.634 ( 6.558 2.781 -9.155) 11.600 10.680 ( -6.761 -0.462 -1.327) 6.905 10.870 ( 1.020 -0.490 -0.913) 1.454 10.876 ( 3.557 0.174 -0.137) 3.563 11.346 ( -16.037 -3.073 -1.479) 16.395 11.802 ( 9.610 -0.245 -2.651) 9.972 12.270 ( -13.338 -0.930 1.907) 13.505 12.565 ( -0.439 0.752 3.430) 3.538 12.943 ( -3.488 0.301 7.536) 8.309 13.503 ( 15.654 -2.187 -6.198) 16.977 15.139 ( 6.666 -0.471 11.761) 13.527 15.278 ( 1.436 -2.601 -14.160) 14.468 16.207 ( -7.072 -2.125 0.945) 7.444 16.333 ( -0.165 -3.127 -0.709) 3.210 ======================= Grid point 421 (199/282) ======================= q-point: ( 0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.991 ( 1.669 -2.410 -0.605) 2.993 3.183 ( -1.432 -2.114 5.449) 6.018 3.282 ( 0.433 3.648 -9.950) 10.606 3.343 ( 8.085 -1.336 -1.855) 8.402 3.454 ( 3.639 -0.736 1.294) 3.932 3.781 ( 5.393 -5.227 -11.508) 13.742 4.186 ( 10.968 2.038 6.509) 12.916 4.417 ( 4.238 -7.456 -3.923) 9.431 4.467 ( -11.556 -5.709 21.021) 24.658 4.494 ( -3.769 -0.931 3.841) 5.461 4.830 ( 2.351 -7.105 2.081) 7.767 5.104 ( 5.997 5.032 -11.266) 13.718 5.528 ( 3.154 -0.476 16.636) 16.939 5.819 ( 5.447 6.977 -1.367) 8.956 6.024 ( 6.944 3.276 -0.520) 7.696 6.049 ( 9.164 3.727 -9.448) 13.680 6.330 ( 16.606 -6.117 -14.021) 22.578 6.434 ( 12.704 -3.330 5.138) 14.103 7.499 ( -12.208 1.402 -0.090) 12.289 7.638 ( -8.070 0.817 -1.764) 8.301 7.679 ( -7.693 -2.482 -1.019) 8.148 7.794 ( -5.469 -5.494 -1.352) 7.869 8.120 ( 2.541 4.456 -1.114) 5.249 8.185 ( 5.218 6.642 -1.055) 8.512 8.251 ( 6.473 3.207 0.332) 7.231 8.443 ( 2.730 4.918 2.364) 6.101 9.113 ( -1.328 1.428 -4.622) 5.016 9.184 ( 1.168 -1.518 2.304) 2.996 9.714 ( 1.718 -2.447 -0.473) 3.027 9.789 ( -5.250 1.983 8.336) 10.049 9.885 ( 5.331 -2.232 -6.307) 8.554 9.960 ( 0.734 -2.097 -1.587) 2.731 10.289 ( -0.223 2.076 1.547) 2.599 10.425 ( -8.930 7.958 2.586) 12.238 10.569 ( -0.404 3.785 -2.027) 4.312 10.616 ( -4.679 0.351 3.735) 5.997 10.899 ( 3.215 2.680 -0.148) 4.188 10.981 ( 4.650 -4.909 2.647) 7.261 11.158 ( -9.196 -1.979 0.001) 9.407 11.893 ( 2.599 1.807 1.919) 3.701 12.113 ( -10.351 -4.589 0.819) 11.352 12.501 ( -11.007 0.181 3.665) 11.602 12.984 ( 3.988 4.336 1.355) 6.045 13.672 ( 13.109 -4.290 -9.930) 16.996 15.249 ( 7.893 -4.455 -11.901) 14.959 15.402 ( 9.364 0.401 15.903) 18.460 16.115 ( -10.647 -5.072 2.437) 12.042 16.346 ( -1.321 -5.599 -0.386) 5.766 ======================= Grid point 422 (200/282) ======================= q-point: ( 0.30 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.946 ( 5.984 -3.472 -23.337) 24.341 3.184 ( -4.773 -0.768 2.261) 5.338 3.217 ( -3.370 4.177 7.607) 9.310 3.410 ( 5.413 2.870 -3.874) 7.249 3.568 ( 3.858 -3.858 4.917) 7.345 3.794 ( 0.634 -5.698 -5.344) 7.837 4.165 ( -13.710 -6.770 -9.500) 18.001 4.346 ( 5.039 5.131 2.462) 7.601 4.566 ( -9.861 -6.229 21.774) 24.701 4.765 ( 18.355 -2.476 -3.125) 18.783 4.983 ( 0.320 -9.802 6.624) 11.834 5.152 ( 14.361 -0.570 -4.434) 15.041 5.660 ( 4.086 4.542 5.519) 8.233 5.872 ( 6.951 6.096 -1.651) 9.392 6.052 ( 11.105 7.599 -3.742) 13.967 6.200 ( 14.226 -5.512 -4.355) 15.865 6.508 ( 15.284 -2.437 -8.108) 17.472 6.717 ( 13.016 -0.637 8.164) 15.378 7.289 ( -13.084 3.077 2.553) 13.682 7.492 ( -9.029 -3.511 -2.240) 9.944 7.579 ( -9.187 -5.857 0.336) 10.900 7.701 ( -11.921 -5.950 0.109) 13.324 7.979 ( -5.990 10.317 -3.403) 12.406 8.245 ( 9.092 8.953 -1.298) 12.826 8.351 ( 6.803 7.698 0.975) 10.319 8.522 ( 9.756 4.243 3.505) 11.201 9.011 ( -2.722 3.493 -5.973) 7.435 9.139 ( -4.154 1.614 -7.521) 8.742 9.692 ( -5.693 -3.286 -1.706) 6.792 9.775 ( -0.900 2.679 2.619) 3.853 9.900 ( 3.888 -2.704 -8.623) 9.838 9.980 ( 1.730 -3.979 -3.305) 5.454 10.272 ( -7.061 9.642 6.692) 13.697 10.341 ( 3.484 -2.521 2.043) 4.762 10.561 ( -6.128 -3.958 10.764) 13.003 10.624 ( 1.869 2.356 4.154) 5.128 10.904 ( -0.679 -2.003 0.946) 2.317 11.061 ( 1.982 4.949 0.834) 5.396 11.177 ( 6.626 -4.623 2.364) 8.418 11.857 ( -7.146 1.191 2.175) 7.564 12.090 ( -3.188 -5.226 5.737) 8.390 12.336 ( -12.220 -0.645 0.323) 12.242 12.991 ( 3.442 8.645 -2.041) 9.526 13.748 ( 7.581 -4.408 -14.259) 16.740 15.338 ( 11.918 -4.491 -9.237) 15.734 15.683 ( 7.135 3.364 15.132) 17.065 16.038 ( -10.523 -7.393 7.994) 15.143 16.386 ( 0.253 -8.833 -0.376) 8.845 ======================= Grid point 423 (201/282) ======================= q-point: (-0.60 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.843 ( 7.817 -3.512 -23.346) 24.869 3.054 ( -11.668 0.584 -3.259) 12.128 3.208 ( -7.723 5.551 12.586) 15.776 3.422 ( 4.567 5.991 -2.713) 8.007 3.694 ( 0.223 -4.425 3.242) 5.490 3.728 ( -9.905 -1.443 6.617) 11.999 4.049 ( 1.952 -14.823 -10.903) 18.504 4.351 ( 0.501 3.642 -1.801) 4.094 4.657 ( -8.216 -4.740 16.344) 18.897 4.930 ( 13.006 2.974 -9.968) 16.654 5.199 ( 7.660 -9.332 7.481) 14.203 5.317 ( 5.248 -6.644 -2.375) 8.794 5.718 ( 1.841 12.068 6.801) 13.974 5.889 ( 5.645 5.916 -1.496) 8.313 6.180 ( 10.891 -0.563 -1.669) 11.032 6.439 ( 17.735 -4.896 -6.936) 19.663 6.622 ( 6.735 2.383 -2.859) 7.695 6.928 ( 4.066 4.895 7.364) 9.732 7.182 ( 0.307 1.229 1.921) 2.301 7.424 ( -9.234 -8.658 0.393) 12.664 7.460 ( -10.029 -7.114 -0.634) 12.312 7.580 ( -5.169 -5.537 0.341) 7.582 7.779 ( -4.722 9.957 -3.067) 11.439 8.224 ( -1.022 12.254 1.429) 12.380 8.392 ( 8.949 9.554 -3.691) 13.601 8.676 ( 8.873 5.028 1.629) 10.328 8.852 ( -7.545 2.109 -6.616) 10.254 8.962 ( -2.360 2.203 -9.017) 9.578 9.605 ( -6.828 -2.826 0.261) 7.394 9.761 ( 3.253 4.919 -3.286) 6.751 9.876 ( 0.670 -4.732 -8.429) 9.690 9.977 ( 2.218 -2.970 -10.479) 11.115 10.204 ( -6.678 4.490 14.440) 16.531 10.460 ( 1.115 -4.592 6.016) 7.650 10.627 ( -5.463 -7.674 8.324) 12.571 10.707 ( 6.842 2.819 4.617) 8.722 10.991 ( 7.421 -1.416 1.611) 7.725 11.070 ( 4.884 6.119 3.464) 8.561 11.330 ( 4.822 -4.643 0.571) 6.718 11.734 ( -10.243 1.631 1.135) 10.434 12.139 ( -9.753 -7.870 10.224) 16.173 12.216 ( 0.226 0.459 -0.415) 0.659 12.915 ( 0.584 11.364 -3.631) 11.945 13.691 ( 1.645 -3.137 -16.711) 17.082 15.434 ( 4.822 -2.765 -6.728) 8.727 15.814 ( 1.844 0.727 5.774) 6.105 16.111 ( -2.194 -0.310 16.970) 17.114 16.493 ( 4.461 -11.913 -1.129) 12.771 ======================= Grid point 424 (202/282) ======================= q-point: (-0.50 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.655 ( -16.326 4.290 -9.263) 19.255 2.904 ( 4.957 -2.381 -8.665) 10.263 3.128 ( -14.214 7.158 15.098) 21.937 3.402 ( 1.932 4.798 -0.694) 5.219 3.639 ( -5.206 -6.072 -0.554) 8.017 3.799 ( -3.928 -1.926 11.338) 12.153 4.152 ( 6.395 -12.279 -5.671) 14.961 4.301 ( 1.855 2.121 -6.369) 6.965 4.719 ( -5.651 -3.162 11.562) 13.252 4.944 ( 6.607 4.806 -11.047) 13.740 5.348 ( -8.012 -4.497 4.054) 10.043 5.406 ( 4.367 -6.448 -1.834) 8.000 5.634 ( -3.962 15.294 6.293) 17.006 5.939 ( 1.887 0.128 3.113) 3.643 6.301 ( 6.621 -1.436 -6.281) 9.239 6.553 ( 3.279 2.030 -4.490) 5.919 6.742 ( 8.437 -1.730 0.933) 8.663 6.960 ( 3.095 1.464 0.844) 3.526 7.152 ( -11.739 -0.600 -1.590) 11.861 7.314 ( 7.030 0.671 2.395) 7.457 7.529 ( 1.162 -8.198 -0.343) 8.287 7.569 ( -3.069 3.708 0.781) 4.876 7.744 ( 7.705 -4.030 -1.199) 8.778 8.109 ( -1.996 8.789 1.294) 9.105 8.378 ( 4.601 9.083 -5.435) 11.541 8.622 ( -6.667 -1.055 -5.149) 8.489 8.744 ( -6.187 -0.603 2.618) 6.745 8.900 ( 6.940 6.855 -5.675) 11.285 9.557 ( -3.179 -3.812 0.522) 4.991 9.743 ( 4.894 7.290 -3.117) 9.317 9.839 ( -1.782 -7.436 -7.381) 10.627 9.907 ( 2.244 2.411 -7.966) 8.620 10.286 ( 0.522 -4.702 9.640) 10.738 10.528 ( -5.449 -5.614 7.646) 10.940 10.672 ( 0.222 -1.611 1.479) 2.198 10.841 ( 7.055 1.269 2.134) 7.479 11.070 ( 7.066 4.703 -1.422) 8.606 11.261 ( 5.019 -4.368 4.732) 8.165 11.368 ( 1.407 1.294 2.152) 2.879 11.570 ( -7.676 1.941 0.604) 7.940 12.139 ( -2.355 -5.722 0.390) 6.200 12.300 ( -0.749 -3.677 10.293) 10.956 12.786 ( -1.438 11.673 -1.512) 11.858 13.543 ( -1.978 -1.921 -15.648) 15.889 15.381 ( -8.118 -2.999 -1.153) 8.730 15.908 ( 6.915 1.633 0.273) 7.111 16.226 ( -0.222 6.332 13.991) 15.359 16.653 ( 6.901 -11.259 -4.201) 13.858 ======================= Grid point 425 (203/282) ======================= q-point: (-0.40 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.241 ( -23.421 8.755 2.225) 25.103 2.971 ( -10.282 2.340 9.649) 14.293 2.985 ( -1.320 3.845 7.010) 8.103 3.433 ( 3.367 -0.331 2.724) 4.344 3.598 ( -5.554 -5.826 -1.696) 8.226 3.838 ( -4.336 -0.673 8.040) 9.160 4.209 ( 6.597 4.382 -13.079) 15.290 4.323 ( 0.809 -8.314 4.153) 9.329 4.739 ( -2.001 2.974 0.648) 3.642 4.853 ( -8.149 1.451 1.725) 8.455 5.190 ( -21.410 4.883 13.222) 25.633 5.371 ( 3.452 0.163 -12.582) 13.048 5.609 ( 2.409 4.517 -0.752) 5.174 5.995 ( -1.593 -7.147 2.134) 7.627 6.225 ( -6.317 0.544 -8.693) 10.760 6.492 ( -4.031 2.539 -6.253) 7.861 6.661 ( -11.251 3.270 -1.271) 11.785 7.093 ( 11.024 -4.949 1.420) 12.167 7.216 ( 10.685 -1.035 4.864) 11.785 7.405 ( -1.528 4.032 0.573) 4.350 7.488 ( 7.812 1.715 -2.655) 8.427 7.684 ( 4.787 -6.433 1.468) 8.152 7.782 ( 7.417 3.211 -9.943) 12.813 8.177 ( 6.600 -3.963 4.672) 9.005 8.322 ( -3.975 -4.204 -1.989) 6.118 8.545 ( 1.643 4.393 1.164) 4.833 8.653 ( -10.396 -2.112 3.733) 11.246 8.892 ( 4.402 6.808 -3.773) 8.942 9.564 ( -2.186 -3.996 2.238) 5.075 9.731 ( 2.211 7.526 -1.235) 7.941 9.769 ( -0.995 -3.353 -7.352) 8.141 9.927 ( 8.944 -2.920 -6.280) 11.312 10.427 ( 4.889 -2.637 2.079) 5.931 10.568 ( -7.190 -9.759 9.056) 15.131 10.660 ( -1.965 0.919 -2.895) 3.617 10.933 ( 5.114 0.457 -1.687) 5.404 11.079 ( 0.777 4.477 -6.417) 7.862 11.183 ( -3.108 4.558 2.803) 6.188 11.426 ( -1.099 3.784 -2.724) 4.790 11.674 ( 12.219 -6.065 7.147) 15.400 12.147 ( -0.001 -1.575 -0.905) 1.817 12.375 ( -3.400 -2.419 3.210) 5.265 12.725 ( -0.853 5.295 8.726) 10.242 13.379 ( -3.206 -0.347 -10.603) 11.082 15.247 ( -13.225 -2.690 3.167) 13.862 15.983 ( 6.667 2.901 -2.334) 7.636 16.285 ( 1.662 9.299 8.386) 12.631 16.744 ( 4.595 -6.376 -10.936) 13.467 ======================= Grid point 426 (204/282) ======================= q-point: (-0.30 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.942 ( -17.959 8.087 17.537) 26.372 2.806 ( -21.018 8.792 23.622) 32.818 3.096 ( 5.287 -0.255 3.230) 6.201 3.518 ( -4.562 0.860 2.831) 5.437 3.550 ( 1.209 -11.244 -2.733) 11.634 3.838 ( -4.704 2.446 6.352) 8.274 4.121 ( 4.575 9.886 -8.115) 13.584 4.399 ( -7.363 -1.100 6.644) 9.978 4.555 ( -7.717 7.307 -2.785) 10.987 4.796 ( -13.655 -2.173 16.814) 21.769 5.010 ( -9.126 -0.321 1.492) 9.253 5.315 ( 4.981 -0.049 -12.493) 13.450 5.544 ( -0.305 4.580 -8.392) 9.565 5.993 ( -11.613 -3.507 -5.648) 13.382 6.028 ( -2.959 -5.849 -3.696) 7.525 6.279 ( -7.795 5.732 -5.856) 11.310 6.516 ( -6.582 -2.378 -2.547) 7.447 7.126 ( -10.583 8.661 -4.782) 14.487 7.361 ( 12.331 -3.303 3.989) 13.374 7.515 ( 14.563 -0.236 -3.555) 14.992 7.638 ( 9.098 -1.370 3.430) 9.819 7.765 ( 12.048 -2.181 -9.175) 15.300 7.881 ( 6.991 -4.335 -0.816) 8.266 8.256 ( -8.110 -7.569 -0.649) 11.112 8.326 ( 1.487 -4.472 1.452) 4.931 8.535 ( -8.709 -1.078 3.860) 9.587 8.663 ( 8.110 3.000 9.134) 12.578 8.870 ( 1.284 3.704 -0.332) 3.934 9.588 ( -2.650 -3.072 4.557) 6.101 9.660 ( -3.745 -1.737 -2.064) 4.615 9.757 ( 4.580 5.111 -2.625) 7.348 10.058 ( 12.602 -3.600 -7.789) 15.246 10.461 ( -2.386 4.358 -2.929) 5.768 10.519 ( -6.747 -2.422 -3.385) 7.928 10.636 ( -6.748 -7.155 7.542) 12.394 10.918 ( -0.593 -1.166 -6.311) 6.445 11.046 ( 8.557 6.559 -2.014) 10.968 11.189 ( 4.274 3.061 -2.530) 5.834 11.368 ( 0.176 -2.716 -5.496) 6.133 11.914 ( 7.457 -3.568 -0.149) 8.268 12.190 ( 3.186 -1.628 2.142) 4.170 12.319 ( -1.181 4.508 0.893) 4.745 12.823 ( -1.276 -3.299 12.470) 12.962 13.251 ( -3.970 2.765 -2.940) 5.661 15.093 ( -13.683 -0.739 4.895) 14.551 16.033 ( 5.603 0.548 -3.323) 6.537 16.303 ( 2.092 8.798 3.677) 9.762 16.646 ( -1.483 1.911 -17.480) 17.647 ======================= Grid point 427 (205/282) ======================= q-point: (-0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.950 ( -5.524 4.611 29.423) 30.290 2.690 ( -18.633 6.721 27.090) 33.560 3.206 ( 3.669 0.171 5.399) 6.530 3.434 ( -6.649 -3.741 -2.186) 7.937 3.600 ( 0.379 -4.168 -5.590) 6.983 3.743 ( -11.558 10.137 10.316) 18.514 4.126 ( 4.080 7.577 6.709) 10.911 4.219 ( -2.646 3.879 -7.173) 8.573 4.487 ( -10.255 0.122 10.748) 14.857 4.757 ( -12.177 -3.666 10.520) 16.505 4.911 ( -6.690 0.504 0.558) 6.732 5.258 ( 4.359 2.742 -11.773) 12.850 5.397 ( -0.988 0.370 -13.565) 13.606 5.827 ( -4.634 -4.412 -4.729) 7.957 5.984 ( -1.619 -2.277 -4.968) 5.700 6.108 ( -4.291 3.118 -3.946) 6.611 6.420 ( -6.123 -6.123 -4.755) 9.878 6.811 ( -11.271 9.399 -8.981) 17.206 7.592 ( 9.640 -5.246 0.641) 10.993 7.659 ( 10.408 0.546 -3.862) 11.115 7.788 ( 10.641 0.988 -4.594) 11.632 7.882 ( 8.990 3.960 -6.198) 11.615 8.020 ( 2.659 -11.362 4.798) 12.617 8.186 ( -3.454 -3.822 -3.167) 6.048 8.291 ( -7.904 -2.715 -0.801) 8.396 8.487 ( -2.220 1.864 1.676) 3.348 8.875 ( 1.566 0.051 5.302) 5.529 8.900 ( 5.861 0.022 11.501) 12.908 9.607 ( -3.632 -6.059 1.152) 7.157 9.640 ( -3.008 -0.838 7.123) 7.777 9.758 ( 3.651 5.339 -1.914) 6.745 10.117 ( 3.672 6.848 -10.364) 12.954 10.341 ( 0.500 -2.959 -1.960) 3.584 10.439 ( -5.479 -2.195 -0.338) 5.912 10.654 ( -3.866 -3.698 5.239) 7.488 10.863 ( 1.596 -0.921 -8.496) 8.693 11.099 ( 0.142 2.456 -1.013) 2.661 11.202 ( 8.406 2.169 -9.449) 12.831 11.362 ( 4.509 -6.707 -8.533) 11.753 12.019 ( 5.030 -1.514 -1.326) 5.418 12.125 ( -3.785 3.850 -1.696) 5.659 12.447 ( 7.232 -0.787 6.616) 9.833 12.941 ( -1.512 -4.252 9.895) 10.876 13.153 ( -4.676 5.620 3.032) 7.915 14.959 ( -9.658 0.846 5.294) 11.047 16.050 ( -1.970 -5.594 -9.234) 10.974 16.271 ( -0.141 7.523 -2.123) 7.818 16.396 ( -0.687 9.999 -10.530) 14.538 ======================= Grid point 428 (206/282) ======================= q-point: (-0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.227 ( 4.863 2.039 30.491) 30.944 2.681 ( -12.850 3.007 27.501) 30.503 3.313 ( 2.942 -1.257 4.563) 5.573 3.338 ( -6.159 -1.622 -0.297) 6.376 3.537 ( 0.259 -0.422 -9.188) 9.201 3.627 ( -6.177 9.234 11.773) 16.187 4.020 ( -1.595 2.506 -9.332) 9.793 4.361 ( 3.561 -1.169 6.214) 7.257 4.382 ( -7.446 1.189 6.457) 9.927 4.704 ( -4.560 -3.187 -0.885) 5.634 4.792 ( -15.862 5.991 19.715) 26.004 5.214 ( 5.921 -0.396 -10.396) 11.970 5.257 ( -0.740 -0.920 -13.732) 13.783 5.827 ( 3.651 -4.906 -2.722) 6.694 5.944 ( 1.702 1.860 -3.403) 4.235 6.016 ( -1.414 -1.258 -4.331) 4.727 6.307 ( -7.842 -2.722 -5.019) 9.700 6.503 ( -5.558 5.295 -14.317) 16.245 7.728 ( 5.529 -3.033 -2.477) 6.776 7.759 ( 6.954 -0.876 -3.242) 7.723 7.833 ( -1.163 2.445 -2.253) 3.522 7.882 ( 7.213 1.360 -7.676) 10.620 8.101 ( -3.023 -1.867 -0.485) 3.586 8.180 ( -3.208 -1.367 -4.232) 5.483 8.238 ( 5.271 -5.272 1.216) 7.554 8.442 ( -2.674 2.271 0.360) 3.526 8.926 ( -0.596 0.382 7.135) 7.170 9.097 ( 3.046 -0.913 9.125) 9.664 9.602 ( -4.358 -2.098 3.161) 5.778 9.690 ( -2.889 -1.457 9.909) 10.424 9.759 ( 2.921 2.107 -1.137) 3.777 9.977 ( -1.088 5.701 -5.698) 8.133 10.364 ( -3.646 -3.257 1.275) 5.053 10.466 ( 8.108 -1.857 -1.775) 8.505 10.682 ( -1.236 -3.142 2.894) 4.446 10.809 ( 1.952 0.540 -8.626) 8.860 11.017 ( -3.570 2.040 -3.961) 5.709 11.124 ( -4.779 -4.785 -12.133) 13.891 11.489 ( 16.021 0.116 -6.620) 17.335 11.870 ( -12.142 1.927 -5.009) 13.275 12.249 ( 12.621 0.213 2.659) 12.900 12.536 ( -4.775 -1.476 4.349) 6.625 13.015 ( -10.298 0.279 15.330) 18.470 13.131 ( 9.259 2.380 -2.316) 9.837 14.909 ( -3.201 0.804 6.129) 6.961 15.773 ( -12.590 0.131 -18.441) 22.330 16.257 ( 4.384 1.998 -0.531) 4.847 16.319 ( 0.856 5.420 -0.802) 5.545 ======================= Grid point 430 (207/282) ======================= q-point: ( 0.10 0.10 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.971 ( 2.793 -0.000 -3.361) 4.370 3.164 ( -0.244 0.000 5.635) 5.641 3.324 ( 8.998 -0.000 -0.610) 9.019 3.331 ( -0.137 0.000 -8.994) 8.995 3.450 ( 2.954 -0.000 2.590) 3.929 3.721 ( 4.057 -0.000 -14.643) 15.194 4.235 ( 13.251 -0.000 11.406) 17.484 4.321 ( 10.810 -0.000 -5.335) 12.055 4.428 ( -14.605 0.000 26.242) 30.033 4.489 ( -6.956 0.000 0.134) 6.957 4.778 ( -0.628 0.000 -0.010) 0.628 5.145 ( 6.509 -0.000 -11.837) 13.509 5.527 ( 3.999 -0.000 17.551) 18.001 5.892 ( 4.189 -0.000 -2.937) 5.116 5.977 ( 8.107 -0.000 -3.831) 8.967 6.198 ( 15.793 -0.000 -26.427) 30.787 6.229 ( 8.875 -0.000 8.793) 12.494 6.398 ( 14.776 -0.000 2.747) 15.029 7.511 ( -10.804 0.000 -0.105) 10.804 7.647 ( -9.597 0.000 -0.516) 9.611 7.670 ( -8.043 0.000 -3.664) 8.838 7.735 ( -5.983 0.000 -0.453) 6.000 8.153 ( 4.478 -0.000 -1.064) 4.603 8.258 ( -0.713 0.000 -0.909) 1.155 8.258 ( 12.518 -0.000 1.329) 12.588 8.480 ( 2.243 -0.000 1.550) 2.727 9.124 ( -0.517 0.000 -4.475) 4.505 9.168 ( 1.941 -0.000 2.913) 3.501 9.692 ( 1.115 -0.000 -0.601) 1.266 9.802 ( -6.017 0.000 5.344) 8.048 9.869 ( 5.808 -0.000 -3.708) 6.891 9.944 ( 1.765 -0.000 -1.433) 2.274 10.310 ( -2.000 0.000 1.645) 2.590 10.501 ( -9.600 0.000 3.778) 10.317 10.558 ( -12.901 0.000 7.599) 14.973 10.658 ( 5.903 -0.000 -7.434) 9.492 10.912 ( -2.645 0.000 0.628) 2.718 10.930 ( 5.127 -0.000 2.696) 5.793 11.153 ( -3.998 0.000 0.806) 4.079 11.913 ( 5.959 -0.000 1.231) 6.085 12.069 ( -13.769 0.000 0.942) 13.802 12.502 ( -11.430 0.000 3.691) 12.011 13.021 ( 5.777 -0.000 1.404) 5.945 13.636 ( 13.171 -0.000 -10.009) 16.543 15.215 ( 8.261 -0.000 -11.644) 14.277 15.407 ( 10.430 -0.000 16.287) 19.341 16.073 ( -10.597 0.000 1.223) 10.667 16.301 ( -1.896 0.000 -0.077) 1.897 ======================= Grid point 431 (208/282) ======================= q-point: ( 0.20 0.10 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.908 ( 6.293 -1.385 -22.604) 23.504 3.165 ( -4.217 -0.782 1.159) 4.443 3.301 ( -0.119 4.834 5.964) 7.678 3.442 ( 6.643 0.921 0.095) 6.707 3.532 ( 3.152 -0.727 4.080) 5.206 3.678 ( 4.957 -7.078 -12.484) 15.183 4.103 ( -18.213 -1.551 -7.539) 19.773 4.421 ( -0.391 3.023 9.552) 10.027 4.519 ( -8.449 0.793 24.976) 26.378 4.694 ( 18.788 -6.363 -5.825) 20.673 4.853 ( 1.792 -4.068 10.768) 11.650 5.179 ( 14.325 1.640 -11.715) 18.578 5.709 ( 5.437 1.629 8.444) 10.174 5.953 ( 9.594 3.701 -3.242) 10.782 6.130 ( 12.062 -2.652 -0.885) 12.381 6.167 ( 15.321 4.607 -21.168) 26.534 6.498 ( 13.295 1.011 7.780) 15.437 6.670 ( 15.103 -4.016 3.551) 16.026 7.333 ( -12.147 2.158 1.909) 12.484 7.475 ( -12.170 0.762 -1.529) 12.289 7.502 ( -11.663 -3.584 0.283) 12.205 7.620 ( -10.960 -3.824 0.019) 11.608 8.087 ( -5.816 3.606 -2.799) 7.394 8.350 ( 11.928 4.218 -1.232) 12.712 8.436 ( 6.305 3.046 1.046) 7.080 8.554 ( 9.001 0.415 2.226) 9.281 9.056 ( -0.927 1.959 -5.886) 6.273 9.152 ( -2.911 0.222 -7.805) 8.333 9.645 ( -4.856 -2.017 -3.633) 6.392 9.763 ( -4.850 -1.895 3.696) 6.385 9.895 ( 2.661 -0.262 -4.582) 5.305 9.955 ( 4.949 0.652 -7.107) 8.685 10.325 ( 1.893 0.559 3.717) 4.208 10.395 ( -14.408 5.316 13.010) 20.128 10.473 ( -11.510 -5.244 11.880) 17.353 10.674 ( 6.507 1.774 -5.750) 8.862 10.870 ( -1.278 -0.871 3.329) 3.671 11.070 ( 7.345 -2.604 3.318) 8.470 11.186 ( 4.290 3.275 1.228) 5.535 11.877 ( -10.026 1.253 1.224) 10.178 12.016 ( -1.154 -3.486 6.316) 7.306 12.332 ( -11.763 -0.027 -0.160) 11.764 13.094 ( 4.945 4.009 -1.344) 6.507 13.692 ( 8.589 -2.264 -14.662) 17.143 15.292 ( 13.266 -1.522 -8.551) 15.857 15.742 ( 10.060 3.440 18.337) 21.196 15.937 ( -10.541 -4.872 4.330) 12.393 16.284 ( -1.575 -3.781 -0.270) 4.105 ======================= Grid point 432 (209/282) ======================= q-point: ( 0.30 0.10 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.799 ( 8.895 -2.065 -23.843) 25.532 3.061 ( -9.003 0.377 -2.376) 9.319 3.316 ( -2.559 8.454 9.481) 12.957 3.510 ( 4.474 5.183 1.761) 7.070 3.638 ( 1.276 -3.018 2.288) 3.997 3.697 ( -6.003 -3.262 0.570) 6.856 3.821 ( -4.277 -13.244 -10.505) 17.437 4.408 ( -4.557 3.124 2.814) 6.200 4.621 ( -8.805 0.611 23.081) 24.711 4.892 ( 5.633 -8.722 -0.166) 10.384 5.081 ( 10.959 -3.162 4.060) 12.108 5.268 ( 12.208 -0.916 -13.162) 17.975 5.860 ( 6.108 6.082 9.166) 12.582 6.017 ( 10.194 9.130 -6.607) 15.196 6.189 ( 11.685 1.347 -9.121) 14.884 6.365 ( 16.526 -4.813 -3.473) 17.560 6.690 ( 9.025 7.112 0.413) 11.498 6.959 ( 7.190 -2.562 9.132) 11.902 7.207 ( -1.709 1.129 1.304) 2.429 7.283 ( -10.363 -5.782 -1.506) 11.962 7.365 ( -14.074 -5.636 1.992) 15.291 7.492 ( -7.574 -5.353 0.189) 9.277 7.915 ( -6.624 6.800 -3.779) 10.217 8.382 ( -1.498 8.087 -0.292) 8.229 8.508 ( 10.712 5.173 -3.030) 12.276 8.721 ( 6.743 1.174 0.811) 6.892 8.891 ( -9.834 2.773 -12.788) 16.369 9.001 ( 2.396 2.403 -8.320) 8.985 9.557 ( -6.044 -3.021 -0.600) 6.783 9.744 ( -2.930 -4.142 -0.398) 5.090 9.881 ( 2.989 -0.551 -7.655) 8.237 9.935 ( 4.049 1.720 -7.498) 8.694 10.240 ( -17.947 -0.626 12.798) 22.052 10.448 ( 1.572 2.863 13.566) 13.954 10.513 ( -0.346 -6.548 5.682) 8.676 10.743 ( 7.360 1.470 0.953) 7.565 10.973 ( 7.506 -0.395 5.464) 9.292 11.172 ( 3.007 5.804 -1.282) 6.661 11.256 ( 5.383 -4.362 1.467) 7.082 11.763 ( -7.350 2.066 2.702) 8.099 12.023 ( -12.312 -6.693 8.218) 16.245 12.228 ( 0.909 0.852 -0.191) 1.261 13.072 ( 1.034 8.467 -2.421) 8.867 13.640 ( 3.013 -3.167 -17.814) 18.343 15.401 ( 4.900 -1.564 -5.495) 7.527 15.830 ( 1.421 1.308 4.224) 4.645 16.109 ( 4.110 -0.036 19.528) 19.956 16.326 ( 2.924 -9.022 -1.290) 9.571 ======================= Grid point 433 (210/282) ======================= q-point: (-0.60 0.10 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.714 ( -2.254 3.104 -12.853) 13.413 2.882 ( -2.734 -0.139 -5.698) 6.322 3.263 ( -8.915 9.958 11.702) 17.764 3.431 ( -8.790 -1.819 -4.039) 9.843 3.593 ( 0.859 1.431 2.209) 2.769 3.765 ( -2.488 -2.714 10.256) 10.897 3.938 ( 6.962 -14.814 -3.540) 16.747 4.338 ( -0.565 2.124 -3.459) 4.099 4.692 ( -8.707 0.452 19.866) 21.695 4.990 ( 6.392 -1.107 -8.774) 10.912 5.230 ( -3.121 -7.093 5.617) 9.571 5.322 ( 9.322 -4.288 -11.930) 15.735 5.887 ( -4.888 16.437 9.069) 19.399 6.022 ( 5.785 8.888 -1.741) 10.747 6.280 ( 8.784 -1.289 -7.921) 11.898 6.584 ( 9.686 -0.013 -3.874) 10.432 6.723 ( 4.561 1.436 1.402) 4.983 6.978 ( -3.750 0.383 0.907) 3.877 7.116 ( -16.068 -2.945 -0.540) 16.344 7.296 ( 2.679 -5.443 2.027) 6.396 7.385 ( 8.204 -7.264 1.249) 11.028 7.553 ( 4.657 -5.924 3.843) 8.459 7.751 ( -0.534 4.936 -4.790) 6.899 8.243 ( -5.891 7.836 -2.080) 10.022 8.506 ( -4.037 6.415 -11.365) 13.661 8.622 ( -0.004 1.510 -4.190) 4.454 8.723 ( -7.595 -1.712 0.304) 7.791 9.004 ( 9.399 6.191 -7.311) 13.421 9.501 ( -4.321 -2.968 1.031) 5.343 9.726 ( -2.048 -5.511 -3.686) 6.939 9.851 ( 2.922 2.002 -6.017) 6.982 9.926 ( 6.204 2.361 -7.731) 10.190 10.167 ( -10.319 -8.470 11.979) 17.937 10.512 ( -5.607 1.121 11.404) 12.757 10.651 ( 6.339 0.551 1.285) 6.491 10.868 ( 6.000 1.463 4.180) 7.458 11.144 ( 9.008 4.636 -5.304) 11.436 11.190 ( 4.764 -4.446 6.223) 9.011 11.358 ( 2.712 -2.827 1.323) 4.135 11.626 ( -8.387 5.669 1.982) 10.315 12.025 ( -3.471 -8.930 5.308) 10.953 12.276 ( 0.737 0.137 4.945) 5.002 12.966 ( -1.970 11.288 -1.163) 11.517 13.503 ( -1.141 -3.303 -16.862) 17.221 15.338 ( -9.293 -2.444 0.225) 9.612 15.953 ( 11.094 4.253 -0.062) 11.882 16.291 ( 1.353 0.902 12.874) 12.976 16.488 ( 8.085 -8.689 -0.328) 11.873 ======================= Grid point 434 (211/282) ======================= q-point: (-0.50 0.10 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.396 ( -18.652 11.350 0.621) 21.843 2.935 ( 8.930 -2.523 -2.462) 9.601 3.139 ( -13.772 10.383 15.259) 23.028 3.335 ( -5.253 -9.102 -2.706) 10.851 3.597 ( -3.010 3.739 5.042) 6.962 3.824 ( -2.682 -1.317 7.536) 8.107 4.130 ( 6.200 -12.158 -0.168) 13.649 4.302 ( 5.256 3.062 -7.397) 9.577 4.739 ( -8.953 -0.036 17.270) 19.453 4.924 ( 2.362 4.757 -14.184) 15.146 5.210 ( -11.549 -2.773 5.132) 12.939 5.347 ( 1.117 -3.907 -8.366) 9.301 5.735 ( -7.661 13.440 9.359) 18.081 5.992 ( -0.672 6.472 -0.458) 6.523 6.231 ( -4.951 0.182 -10.241) 11.376 6.557 ( -0.427 5.875 -5.338) 7.949 6.717 ( -9.125 3.788 -2.675) 10.236 7.009 ( 6.024 -5.852 -1.216) 8.486 7.103 ( 6.733 -13.346 4.903) 15.732 7.410 ( 4.380 -3.759 1.906) 6.079 7.514 ( 0.168 0.746 -0.841) 1.137 7.638 ( 8.315 1.223 2.342) 8.725 7.811 ( 8.819 -0.775 -7.860) 11.839 8.132 ( 1.220 -0.717 -0.397) 1.470 8.265 ( -9.647 -2.852 -6.750) 12.115 8.596 ( -9.816 -2.543 0.676) 10.163 8.641 ( 3.516 5.007 1.691) 6.348 8.994 ( 4.796 6.244 -6.954) 10.505 9.493 ( -2.631 -4.300 2.021) 5.431 9.685 ( -3.086 -4.833 -5.165) 7.717 9.838 ( 2.280 0.137 -1.454) 2.707 9.936 ( 9.183 6.564 -6.353) 12.952 10.282 ( -0.355 -14.218 6.670) 15.709 10.506 ( -4.584 0.594 5.338) 7.061 10.681 ( 1.123 2.745 -3.032) 4.242 10.942 ( -0.586 0.544 1.876) 2.039 11.148 ( 3.095 3.911 -5.058) 7.103 11.270 ( 3.169 5.498 1.465) 6.513 11.458 ( -0.654 0.606 -3.932) 4.031 11.600 ( 9.626 -3.227 7.190) 12.441 12.105 ( 0.287 -4.405 3.334) 5.532 12.320 ( -3.020 -2.893 5.084) 6.583 12.852 ( -1.685 10.289 2.171) 10.649 13.359 ( -2.645 -2.552 -9.895) 10.556 15.210 ( -12.462 -2.080 4.610) 13.449 16.038 ( 6.372 4.287 -2.710) 8.144 16.411 ( 3.420 6.212 8.351) 10.955 16.640 ( 8.336 -6.353 -7.144) 12.684 ======================= Grid point 435 (212/282) ======================= q-point: (-0.40 0.10 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.096 ( -16.034 11.925 13.877) 24.329 2.974 ( -15.778 11.995 19.592) 27.869 3.095 ( 5.045 0.407 5.032) 7.137 3.339 ( -2.959 -13.929 -3.824) 14.745 3.558 ( -4.522 2.446 5.584) 7.590 3.864 ( -1.004 1.051 6.271) 6.437 4.238 ( 7.107 2.006 -9.421) 11.971 4.341 ( 3.270 -2.930 4.184) 6.065 4.699 ( -4.632 8.948 -9.969) 14.174 4.768 ( -12.130 -0.614 12.377) 17.341 5.047 ( -16.749 4.362 11.316) 20.679 5.285 ( 2.434 -2.673 -11.414) 11.972 5.647 ( -3.182 7.564 0.272) 8.210 5.915 ( -6.717 -2.293 -0.772) 7.140 6.000 ( -9.395 0.494 -7.742) 12.184 6.378 ( -5.529 7.320 -8.859) 12.753 6.534 ( -5.449 3.939 -4.272) 7.966 7.112 ( -0.208 -7.532 -8.214) 11.146 7.400 ( 6.629 -2.194 7.027) 9.907 7.446 ( 4.719 -5.546 5.515) 9.135 7.581 ( 7.972 -2.450 -1.533) 8.480 7.724 ( 5.134 -0.815 -3.476) 6.253 7.881 ( 12.870 1.974 -7.048) 14.805 8.138 ( -7.523 -7.262 -1.340) 10.542 8.244 ( 3.789 -6.050 -0.012) 7.139 8.480 ( -9.502 -5.877 2.006) 11.351 8.721 ( 6.471 4.253 6.300) 9.983 8.938 ( 1.404 4.816 -4.316) 6.618 9.512 ( -3.093 -5.275 1.928) 6.412 9.622 ( -4.400 -2.804 0.172) 5.221 9.870 ( 2.866 4.587 0.855) 5.476 10.000 ( 12.343 -0.683 -8.244) 14.859 10.415 ( -1.573 -9.516 -1.163) 9.715 10.498 ( -3.202 -6.232 4.245) 8.192 10.590 ( -2.505 6.391 -6.231) 9.271 10.888 ( -3.900 -1.846 -2.669) 5.073 11.146 ( 4.034 6.665 1.195) 7.882 11.259 ( 3.836 5.792 -8.498) 10.976 11.372 ( 0.230 2.284 -3.993) 4.605 11.863 ( 10.418 -3.553 2.537) 11.296 12.160 ( 0.608 -2.191 2.213) 3.173 12.332 ( -3.259 -2.193 4.742) 6.157 12.828 ( 1.612 3.984 4.584) 6.284 13.277 ( -3.657 0.420 0.425) 3.705 15.087 ( -12.111 0.120 6.941) 13.959 16.045 ( 2.224 0.994 -4.512) 5.128 16.448 ( 1.623 9.622 4.069) 10.572 16.671 ( 6.286 1.152 -14.138) 15.516 ======================= Grid point 436 (213/282) ======================= q-point: (-0.30 0.10 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.049 ( -5.602 8.308 26.301) 28.145 2.836 ( -17.589 11.907 24.765) 32.626 3.209 ( 3.080 -0.346 5.120) 5.985 3.330 ( -4.665 -8.657 -3.988) 10.612 3.559 ( 0.296 -1.154 0.081) 1.194 3.888 ( -2.498 7.261 9.380) 12.122 4.235 ( 7.977 3.605 -6.761) 11.060 4.345 ( -7.700 13.448 0.366) 15.501 4.494 ( -5.235 1.075 4.487) 6.978 4.685 ( -9.379 -4.979 -0.026) 10.618 4.938 ( -12.941 3.680 18.694) 23.032 5.252 ( 4.410 -3.737 -11.894) 13.224 5.466 ( -5.858 8.526 -9.558) 14.084 5.775 ( -5.350 -2.180 -4.521) 7.336 5.908 ( -4.627 -6.063 -0.231) 7.630 6.171 ( -4.317 5.271 -7.216) 9.924 6.396 ( -1.760 2.512 -7.401) 8.011 6.907 ( -11.074 2.495 -12.219) 16.679 7.540 ( 8.255 -0.784 3.433) 8.975 7.672 ( 7.636 1.027 -0.797) 7.746 7.762 ( 8.238 -11.441 4.181) 14.705 7.815 ( 6.790 -7.816 -3.084) 10.803 7.942 ( 3.947 2.394 -4.360) 6.350 8.104 ( -1.905 -6.371 -2.729) 7.188 8.243 ( -5.201 -2.996 -1.346) 6.151 8.474 ( 0.004 -4.324 -0.913) 4.419 8.877 ( 4.389 0.512 6.318) 7.710 8.915 ( 2.204 1.820 5.415) 6.123 9.501 ( -4.380 -6.512 0.360) 7.856 9.634 ( -2.874 -0.941 9.172) 9.658 9.860 ( 1.445 7.040 -0.026) 7.186 10.135 ( 12.109 -4.752 -8.996) 15.815 10.350 ( -6.487 -0.449 -6.258) 9.024 10.424 ( -3.177 5.012 -2.638) 6.494 10.562 ( -2.427 -8.406 2.020) 8.979 10.838 ( 0.590 -2.369 -6.202) 6.666 11.122 ( -3.116 -4.807 -9.688) 11.255 11.179 ( -0.510 4.759 -1.781) 5.107 11.385 ( 11.791 6.342 -5.025) 14.300 11.996 ( 4.298 -1.553 -1.830) 4.923 12.157 ( -2.131 0.314 0.487) 2.209 12.415 ( 2.392 -3.519 6.985) 8.179 12.916 ( 5.039 1.143 5.967) 7.893 13.225 ( -5.927 3.591 6.063) 9.208 14.984 ( -9.055 2.470 7.429) 11.970 15.991 ( -2.660 -2.330 -9.107) 9.769 16.400 ( -0.757 9.135 -0.088) 9.167 16.559 ( 4.085 10.447 -12.284) 16.635 ======================= Grid point 437 (214/282) ======================= q-point: (-0.20 0.10 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.282 ( 4.877 4.864 29.861) 30.646 2.768 ( -13.607 8.060 25.933) 30.375 3.268 ( -4.979 -6.411 -0.673) 8.145 3.313 ( 3.919 0.618 1.961) 4.426 3.538 ( 1.214 0.675 -7.167) 7.301 3.849 ( -2.989 17.117 11.590) 20.887 4.088 ( -3.683 6.070 -12.311) 14.212 4.348 ( 4.866 -0.579 2.272) 5.402 4.397 ( -11.490 1.079 7.784) 13.920 4.668 ( 1.582 -1.703 2.689) 3.554 4.900 ( -15.551 7.407 22.689) 28.487 5.222 ( 3.301 -2.640 -12.026) 12.748 5.229 ( -2.521 2.347 -12.574) 13.037 5.747 ( 1.931 -4.382 -1.969) 5.178 5.895 ( -3.389 -7.613 -0.558) 8.352 6.032 ( -0.827 3.515 -5.940) 6.951 6.298 ( 0.935 2.107 -8.297) 8.611 6.590 ( -8.669 4.850 -14.137) 17.278 7.680 ( 5.577 -2.334 0.302) 6.054 7.750 ( 4.427 -0.205 -0.815) 4.506 7.849 ( -2.886 -1.383 -1.049) 3.368 7.901 ( 6.440 -0.397 -7.826) 10.143 8.043 ( 3.258 -6.098 2.423) 7.326 8.101 ( 1.157 -7.946 -1.755) 8.220 8.178 ( -1.941 -1.164 -3.963) 4.564 8.462 ( -0.708 -0.678 -3.689) 3.817 8.934 ( 0.479 0.439 6.398) 6.431 9.077 ( 2.581 -1.250 9.806) 10.216 9.528 ( -1.537 -6.602 4.590) 8.187 9.689 ( -3.378 0.874 10.674) 11.230 9.814 ( -0.511 5.032 -0.679) 5.103 10.113 ( -0.432 10.727 -7.678) 13.199 10.274 ( 0.350 -8.064 -4.070) 9.040 10.417 ( 4.483 -3.956 -0.525) 6.002 10.595 ( -1.856 -7.946 -0.906) 8.210 10.813 ( 2.672 -0.262 -5.947) 6.525 10.992 ( -6.003 -10.050 -12.828) 17.367 11.082 ( -3.981 5.448 -2.890) 7.340 11.516 ( 14.868 3.382 -4.324) 15.849 11.904 ( -9.587 1.863 -4.922) 10.937 12.250 ( 9.947 -0.414 2.978) 10.392 12.496 ( -4.380 -3.546 4.894) 7.464 13.036 ( -3.474 2.687 12.670) 13.410 13.184 ( 4.247 4.038 0.223) 5.865 14.937 ( -3.671 2.980 7.612) 8.961 15.783 ( -8.133 1.341 -16.294) 18.260 16.326 ( 0.018 6.685 0.368) 6.695 16.448 ( 2.734 10.476 -4.906) 11.887 ======================= Grid point 438 (215/282) ======================= q-point: (-0.10 0.10 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.651 ( 10.970 3.856 25.424) 27.957 2.807 ( -7.238 3.844 22.873) 24.297 3.233 ( -3.359 -3.621 0.148) 4.942 3.392 ( 5.462 0.950 -2.616) 6.130 3.480 ( 2.618 0.239 -6.982) 7.460 3.810 ( 2.911 13.580 5.317) 14.871 3.903 ( -1.292 1.358 -9.711) 9.891 4.235 ( -4.993 4.414 -1.860) 6.919 4.473 ( -3.450 -2.350 7.862) 8.901 4.689 ( -4.060 6.614 1.588) 7.921 4.904 ( -3.875 1.555 26.690) 27.015 5.086 ( -4.292 -0.312 -6.818) 8.062 5.199 ( 5.051 -2.506 -9.797) 11.304 5.835 ( 4.549 -6.592 -0.304) 8.015 5.887 ( -4.914 -8.936 -1.769) 10.350 6.013 ( 8.933 3.168 -3.861) 10.235 6.198 ( -3.684 5.292 -4.511) 7.869 6.343 ( 4.087 3.634 -19.553) 20.304 7.735 ( -1.773 -0.871 -0.705) 2.097 7.772 ( 1.182 -0.992 -2.504) 2.941 7.808 ( 0.250 -0.112 -0.941) 0.980 7.905 ( 3.120 1.406 -7.193) 7.966 8.053 ( 0.099 -1.589 -1.479) 2.173 8.095 ( -1.205 -0.745 -4.918) 5.118 8.263 ( 2.203 -9.100 3.414) 9.966 8.412 ( -0.850 0.030 -3.591) 3.690 9.010 ( 0.759 1.680 8.223) 8.427 9.166 ( -0.258 -0.898 3.335) 3.463 9.605 ( -0.036 -0.023 5.317) 5.317 9.724 ( -4.312 -1.342 10.394) 11.333 9.798 ( 2.180 0.571 0.070) 2.255 9.987 ( -0.160 8.194 -1.997) 8.436 10.297 ( -1.408 -6.389 -0.149) 6.544 10.549 ( 7.511 -4.618 -1.286) 8.911 10.613 ( -1.192 -8.539 -3.521) 9.312 10.791 ( 0.807 1.187 -6.808) 6.957 10.869 ( -3.982 -6.976 -6.281) 10.197 10.945 ( -4.691 2.927 -3.670) 6.637 11.634 ( -9.188 3.332 -3.380) 10.341 11.682 ( 7.373 2.452 -4.683) 9.072 12.430 ( -7.944 -1.218 3.021) 8.586 12.446 ( 7.042 -1.198 2.391) 7.533 12.985 ( -12.964 2.410 13.347) 18.762 13.327 ( 16.162 3.086 -3.748) 16.875 14.984 ( 1.878 1.861 8.778) 9.168 15.484 ( -5.205 4.305 -16.236) 17.585 16.289 ( -2.625 3.017 1.601) 4.308 16.375 ( 1.418 7.295 -2.467) 7.831 ======================= Grid point 441 (216/282) ======================= q-point: ( 0.20 0.20 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.783 ( 9.347 -0.000 -23.956) 25.715 3.064 ( -7.925 0.000 -1.996) 8.173 3.417 ( -0.419 0.000 11.830) 11.838 3.562 ( 4.285 -0.000 5.177) 6.721 3.610 ( 0.755 -0.000 5.552) 5.603 3.619 ( 8.790 -0.000 -13.039) 15.725 3.728 ( -18.803 0.000 -8.054) 20.455 4.431 ( -8.469 0.000 7.051) 11.020 4.657 ( -8.940 0.000 27.097) 28.533 4.780 ( 3.478 -0.000 1.723) 3.881 5.067 ( 15.875 -0.000 -0.867) 15.899 5.264 ( 12.231 -0.000 -15.738) 19.932 5.905 ( 7.839 -0.000 8.822) 11.801 6.103 ( 14.099 -0.000 -7.036) 15.757 6.204 ( 14.009 -0.000 -17.243) 22.217 6.315 ( 12.189 -0.000 1.389) 12.268 6.821 ( 10.919 -0.000 13.033) 17.002 6.855 ( 9.173 -0.000 -1.411) 9.281 7.205 ( -9.788 0.000 -1.067) 9.846 7.271 ( -9.383 0.000 2.144) 9.625 7.313 ( -13.052 0.000 2.186) 13.234 7.443 ( -7.740 0.000 -0.234) 7.743 7.969 ( -7.139 0.000 -3.818) 8.096 8.450 ( -3.563 0.000 -0.804) 3.652 8.545 ( 12.682 -0.000 -2.923) 13.015 8.727 ( 6.320 -0.000 0.606) 6.349 8.917 ( -11.101 0.000 -16.601) 19.971 9.022 ( 5.111 -0.000 -6.895) 8.583 9.530 ( -4.582 0.000 -1.900) 4.961 9.708 ( -4.721 0.000 1.502) 4.954 9.857 ( 1.337 -0.000 -6.958) 7.085 9.973 ( 5.524 -0.000 -7.003) 8.920 10.228 ( -22.429 0.000 14.071) 26.478 10.454 ( 6.381 -0.000 2.268) 6.772 10.483 ( -3.148 0.000 18.227) 18.497 10.753 ( 8.636 -0.000 -1.687) 8.799 10.974 ( 6.710 -0.000 6.435) 9.297 11.203 ( 7.248 -0.000 1.883) 7.489 11.235 ( -0.120 0.000 -2.091) 2.094 11.784 ( -4.038 0.000 4.178) 5.810 11.964 ( -14.803 0.000 6.755) 16.271 12.236 ( 1.200 -0.000 -0.240) 1.224 13.143 ( 0.932 -0.000 -1.243) 1.554 13.612 ( 3.773 -0.000 -18.932) 19.304 15.388 ( 4.762 -0.000 -5.080) 6.963 15.844 ( 1.673 -0.000 3.843) 4.191 16.109 ( 6.544 -0.000 20.423) 21.446 16.251 ( 2.011 -0.000 -1.434) 2.469 ======================= Grid point 442 (217/282) ======================= q-point: ( 0.30 0.20 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.742 ( 10.417 0.701 -15.943) 19.058 2.895 ( -9.736 1.112 -2.760) 10.180 3.349 ( -17.872 -1.005 -4.096) 18.363 3.463 ( -3.830 9.376 7.989) 12.900 3.648 ( 1.620 4.166 6.170) 7.619 3.699 ( 3.145 -8.680 0.512) 9.246 3.738 ( 4.980 -7.370 3.406) 9.525 4.360 ( -4.313 0.673 0.947) 4.467 4.739 ( -8.866 5.258 22.333) 24.598 4.892 ( 0.482 -8.639 5.693) 10.357 5.207 ( 7.194 2.324 -9.142) 11.863 5.261 ( 8.341 -3.696 -14.133) 16.822 6.068 ( 2.998 5.589 8.549) 10.645 6.185 ( 10.968 10.640 -9.093) 17.782 6.265 ( 7.626 -0.289 -6.778) 10.207 6.507 ( 6.962 -7.683 2.168) 10.592 6.831 ( 0.175 10.095 -0.183) 10.098 6.967 ( -11.780 -0.508 0.106) 11.791 7.086 ( -12.386 -3.647 4.233) 13.588 7.130 ( -0.563 -9.812 0.270) 9.832 7.345 ( 11.688 -0.614 -0.504) 11.715 7.480 ( 8.270 -2.616 3.923) 9.520 7.816 ( -4.523 2.558 -5.233) 7.374 8.329 ( -7.416 3.012 -3.569) 8.764 8.553 ( -13.551 0.787 -15.352) 20.492 8.666 ( 8.289 2.609 -2.994) 9.191 8.701 ( -7.733 -0.905 -0.984) 7.848 9.077 ( 10.519 2.961 -8.761) 14.007 9.472 ( -3.097 -0.933 0.405) 3.260 9.661 ( -2.123 -2.652 -1.953) 3.919 9.815 ( 1.666 -2.873 -8.511) 9.136 9.984 ( -0.269 2.196 1.684) 2.780 10.085 ( -7.597 -1.763 6.070) 9.883 10.509 ( -3.243 -0.941 7.714) 8.421 10.698 ( 8.121 3.521 9.891) 13.273 10.877 ( 5.417 -0.197 3.286) 6.339 11.138 ( 0.544 -1.978 6.074) 6.411 11.198 ( 9.490 1.988 -6.407) 11.622 11.308 ( 3.598 -2.487 0.752) 4.438 11.734 ( -8.420 7.855 2.766) 11.842 11.885 ( -2.522 -8.841 6.916) 11.505 12.285 ( 1.621 0.508 2.824) 3.296 13.105 ( -2.783 5.778 1.653) 6.623 13.451 ( -0.304 -2.658 -19.976) 20.154 15.312 ( -9.654 -0.943 0.829) 9.735 16.032 ( 16.512 5.255 0.618) 17.339 16.225 ( 0.375 -6.695 2.437) 7.134 16.434 ( 7.565 -0.126 11.203) 13.519 ======================= Grid point 443 (218/282) ======================= q-point: (-0.60 0.20 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.578 ( -12.995 12.267 -0.865) 17.892 2.892 ( 10.695 -3.714 -3.151) 11.752 3.118 ( -12.493 -9.372 -2.791) 15.865 3.384 ( -9.111 12.414 12.721) 19.974 3.658 ( -5.738 3.476 7.846) 10.323 3.793 ( 1.073 -3.235 3.657) 4.999 3.940 ( 6.668 -11.338 3.098) 13.513 4.335 ( 4.435 1.269 -4.546) 6.476 4.766 ( -10.502 3.455 20.087) 22.928 4.954 ( 2.100 -1.672 -8.539) 8.951 5.150 ( -3.291 -2.717 -3.528) 5.537 5.274 ( 3.752 -4.490 -10.005) 11.591 6.007 ( -10.191 19.976 12.071) 25.468 6.122 ( 0.796 8.789 -5.541) 10.421 6.232 ( -3.720 0.147 -8.744) 9.503 6.643 ( 1.731 1.104 -1.923) 2.813 6.777 ( -0.704 4.112 -1.889) 4.580 6.855 ( -9.506 -13.202 3.068) 16.555 6.932 ( 0.920 -4.825 -2.519) 5.520 7.315 ( 7.738 -8.334 2.027) 11.551 7.505 ( 3.297 -1.240 2.532) 4.338 7.673 ( 8.227 1.843 3.012) 8.953 7.777 ( 11.498 -2.040 -8.731) 14.581 8.153 ( -5.009 2.232 -4.751) 7.256 8.237 ( -11.592 -0.987 -9.026) 14.725 8.547 ( -12.506 -2.747 -0.476) 12.813 8.719 ( 4.825 3.979 0.130) 6.255 9.077 ( 5.292 4.414 -9.597) 11.815 9.450 ( -2.303 -1.401 1.930) 3.315 9.630 ( -0.926 -1.882 -4.550) 5.010 9.790 ( 1.030 -4.876 -5.737) 7.599 9.997 ( -1.085 -3.906 3.787) 5.548 10.135 ( 6.805 -0.063 -0.021) 6.805 10.517 ( -4.630 0.149 5.019) 6.830 10.762 ( 0.827 7.522 0.081) 7.568 10.942 ( -2.652 -1.111 1.936) 3.467 11.177 ( 3.818 -0.163 -0.445) 3.847 11.333 ( 8.768 2.993 0.256) 9.268 11.429 ( 6.010 -4.135 0.281) 7.300 11.606 ( 0.056 3.571 0.384) 3.591 12.019 ( 0.768 -5.895 8.409) 10.298 12.304 ( -1.671 0.282 2.007) 2.627 13.015 ( -2.954 10.481 1.560) 11.001 13.298 ( -2.314 -5.428 -10.907) 12.401 15.186 ( -11.446 -1.077 5.638) 12.805 16.108 ( 2.870 4.476 -2.937) 6.074 16.429 ( 14.597 -3.640 -0.079) 15.044 16.598 ( 4.521 1.026 4.475) 6.443 ======================= Grid point 444 (219/282) ======================= q-point: (-0.50 0.20 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.298 ( -13.402 14.403 9.563) 21.875 3.037 ( -7.651 -9.624 1.051) 12.339 3.092 ( 9.402 -2.167 4.237) 10.538 3.261 ( -12.920 10.399 15.910) 22.983 3.591 ( -8.118 1.644 5.989) 10.221 3.869 ( 2.341 -0.586 3.949) 4.628 4.141 ( 5.174 -9.635 1.562) 11.047 4.370 ( 9.000 2.858 -6.159) 11.274 4.757 ( -13.158 1.143 17.409) 21.852 4.818 ( -1.009 4.726 -16.418) 17.114 5.074 ( -6.368 -2.022 -1.221) 6.792 5.256 ( -1.556 -1.985 -2.946) 3.878 5.811 ( -10.443 17.088 11.754) 23.221 5.946 ( -8.616 3.422 -7.728) 12.069 6.034 ( -7.403 4.366 -5.863) 10.404 6.499 ( -5.240 8.142 -9.044) 13.249 6.621 ( -3.771 7.006 -4.217) 9.005 6.986 ( 3.352 -7.979 -7.506) 11.456 7.102 ( 2.348 -24.515 10.514) 26.778 7.492 ( 3.903 -0.311 3.498) 5.250 7.551 ( 6.540 -1.773 -0.637) 6.806 7.738 ( -1.202 2.385 0.815) 2.793 7.903 ( 16.836 0.472 -10.881) 20.051 8.051 ( -8.048 -3.837 -2.963) 9.396 8.159 ( 6.574 -4.460 -0.791) 7.983 8.381 ( -12.369 -6.227 -0.071) 13.848 8.779 ( 4.163 3.012 4.616) 6.907 9.006 ( 1.752 4.051 -7.835) 8.993 9.458 ( -1.656 -1.653 1.904) 3.016 9.578 ( -2.428 -2.074 -1.458) 3.510 9.827 ( 3.104 -6.460 -2.472) 7.581 10.049 ( 3.278 -1.137 -2.232) 4.125 10.246 ( 4.911 -5.561 -2.153) 7.725 10.469 ( -4.925 0.241 1.610) 5.187 10.685 ( -0.678 6.103 -4.281) 7.486 10.873 ( -5.397 -0.547 -1.115) 5.538 11.239 ( 4.217 4.849 2.338) 6.838 11.331 ( -4.162 2.917 -12.132) 13.153 11.426 ( 8.190 4.741 -2.286) 9.735 11.797 ( 11.306 -4.897 4.210) 13.021 12.121 ( -1.071 -2.945 4.981) 5.885 12.297 ( -2.542 -1.401 3.999) 4.941 12.921 ( 1.789 7.421 -1.399) 7.761 13.260 ( -3.710 -2.590 4.056) 6.077 15.095 ( -10.294 0.769 8.999) 13.694 16.060 ( -0.608 0.843 -5.448) 5.546 16.579 ( 2.859 7.056 3.389) 8.334 16.681 ( 11.439 0.230 -9.712) 15.007 ======================= Grid point 445 (220/282) ======================= q-point: (-0.40 0.20 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.200 ( -5.698 11.366 21.524) 24.998 2.997 ( -11.668 3.179 12.669) 17.514 3.142 ( -8.563 -3.324 8.281) 12.367 3.279 ( 3.163 2.435 5.452) 6.757 3.552 ( -0.525 -0.127 1.908) 1.983 3.956 ( 2.548 1.975 7.968) 8.595 4.231 ( 2.980 -3.551 -6.021) 7.599 4.471 ( 10.324 0.462 -1.262) 10.411 4.563 ( -6.038 7.027 -13.119) 16.060 4.654 ( -15.854 2.308 8.321) 18.053 5.004 ( -7.258 1.577 9.477) 12.041 5.208 ( -1.949 0.625 -1.031) 2.292 5.607 ( -9.144 9.469 -5.678) 14.336 5.765 ( -5.785 2.400 0.993) 6.341 5.867 ( -6.297 1.387 -1.760) 6.684 6.269 ( -4.530 7.284 -9.020) 12.447 6.472 ( -1.408 6.631 -7.036) 9.770 6.901 ( -5.355 -1.454 -13.221) 14.339 7.448 ( 3.122 -24.731 10.815) 27.172 7.561 ( 4.285 1.853 4.461) 6.457 7.684 ( 6.564 -0.178 0.232) 6.571 7.753 ( 4.807 -4.275 -3.116) 7.147 7.949 ( -3.119 -1.997 -2.189) 4.302 8.027 ( 5.599 -2.234 -6.461) 8.837 8.212 ( -2.087 -1.039 -0.919) 2.506 8.362 ( 3.575 -9.469 -3.338) 10.657 8.891 ( 4.048 1.007 6.266) 7.527 8.945 ( 0.968 1.901 -0.563) 2.206 9.432 ( -3.498 -1.998 -0.290) 4.039 9.605 ( -1.400 -2.641 8.129) 8.661 9.903 ( 1.130 -4.055 0.527) 4.243 10.074 ( 6.045 -2.196 -7.887) 10.177 10.279 ( -1.264 -5.329 -5.324) 7.638 10.440 ( -1.838 -5.011 0.057) 5.337 10.558 ( -2.285 8.793 -5.688) 10.719 10.805 ( -1.548 -1.688 -3.385) 4.087 11.085 ( -5.932 0.304 -14.534) 15.701 11.276 ( 0.647 6.572 1.227) 6.717 11.481 ( 10.008 5.746 -4.552) 12.406 11.966 ( 4.326 -2.585 -1.429) 5.238 12.144 ( -1.473 -1.679 2.673) 3.483 12.355 ( 0.697 -3.626 6.545) 7.514 12.963 ( 8.083 4.409 2.894) 9.651 13.260 ( -6.498 0.930 8.987) 11.129 15.033 ( -8.025 3.742 10.176) 13.489 15.971 ( -2.351 -0.626 -8.619) 8.956 16.535 ( -1.562 8.037 0.032) 8.187 16.699 ( 8.278 7.664 -11.745) 16.285 ======================= Grid point 446 (221/282) ======================= q-point: (-0.30 0.20 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.369 ( 3.748 6.461 28.110) 29.086 2.908 ( -13.061 9.226 20.391) 25.913 3.149 ( -5.016 -8.161 2.908) 10.011 3.336 ( 3.700 1.934 2.316) 4.774 3.561 ( 2.923 2.502 -5.119) 6.404 4.056 ( 3.528 8.904 6.285) 11.456 4.165 ( -2.670 1.002 -13.342) 13.644 4.346 ( -0.923 0.947 -2.578) 2.898 4.447 ( -14.370 5.964 7.672) 17.347 4.645 ( 9.487 -1.375 1.424) 9.691 5.000 ( -10.008 3.801 18.701) 21.549 5.169 ( -2.138 -0.665 -2.130) 3.090 5.329 ( -5.431 9.305 -10.917) 15.338 5.711 ( 0.143 0.207 -1.388) 1.411 5.788 ( -6.781 -4.725 1.872) 8.474 6.102 ( 0.360 5.422 -7.587) 9.332 6.354 ( 1.017 4.508 -7.634) 8.924 6.651 ( -5.827 4.352 -15.207) 16.857 7.661 ( 4.810 -0.722 2.146) 5.317 7.729 ( -0.297 -14.554 4.599) 15.266 7.756 ( 0.158 -1.540 2.551) 2.984 7.838 ( 4.700 -5.805 -1.906) 7.709 7.934 ( 2.124 -6.300 -1.977) 6.935 8.026 ( 0.007 -2.824 -3.328) 4.365 8.182 ( 1.079 1.496 -5.786) 6.073 8.415 ( 2.533 -5.169 -8.101) 9.938 8.935 ( 1.008 -0.266 4.259) 4.385 9.068 ( 2.786 -0.137 9.914) 10.299 9.433 ( -1.207 -5.061 4.705) 7.015 9.693 ( -1.975 -0.763 11.017) 11.218 9.894 ( -2.881 4.005 1.103) 5.056 10.127 ( 4.114 -10.433 -9.361) 14.609 10.234 ( 1.940 1.559 -7.415) 7.821 10.402 ( -1.318 4.484 -3.997) 6.150 10.461 ( -2.321 -7.591 -1.077) 8.011 10.782 ( 0.136 -4.562 -4.736) 6.577 10.884 ( -3.149 -2.272 -13.115) 13.677 11.178 ( -4.442 6.587 -3.457) 8.664 11.576 ( 11.532 3.993 -2.611) 12.480 11.921 ( -6.726 0.383 -4.091) 7.882 12.232 ( 6.971 -1.843 3.712) 8.110 12.439 ( -2.307 -3.549 4.872) 6.454 13.092 ( -1.039 4.384 11.918) 12.741 13.241 ( 2.972 3.086 1.645) 4.589 15.001 ( -4.190 5.374 10.044) 12.137 15.812 ( -3.824 2.304 -13.541) 14.258 16.441 ( -1.989 7.827 -0.066) 8.076 16.612 ( 3.311 10.413 -8.067) 13.582 ======================= Grid point 447 (222/282) ======================= q-point: (-0.20 0.20 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.710 ( 7.741 3.175 27.683) 28.919 2.893 ( -5.361 7.404 19.140) 21.211 3.163 ( -3.221 -5.154 2.908) 6.738 3.419 ( 7.401 2.044 -1.496) 7.823 3.504 ( 2.629 3.001 -8.923) 9.774 3.874 ( -1.480 0.033 -23.215) 23.262 4.102 ( -0.125 16.925 10.141) 19.731 4.295 ( -4.701 2.657 2.985) 6.170 4.437 ( 0.150 -1.618 9.513) 9.651 4.780 ( 4.175 2.240 0.076) 4.739 4.942 ( -8.752 3.381 3.594) 10.047 5.124 ( -5.670 5.449 17.101) 18.823 5.168 ( 2.562 1.376 -10.696) 11.085 5.739 ( -2.137 -5.929 1.231) 6.422 5.754 ( -0.671 -6.682 -1.989) 7.004 6.068 ( 7.993 3.907 -4.864) 10.140 6.264 ( -2.292 3.246 -5.282) 6.610 6.418 ( 4.329 6.740 -17.973) 19.677 7.723 ( -1.601 -1.254 0.489) 2.092 7.756 ( 0.280 -1.526 -0.248) 1.571 7.794 ( 0.187 -1.730 0.832) 1.929 7.891 ( 1.739 -3.780 -5.099) 6.581 8.029 ( 1.524 -2.315 -2.312) 3.609 8.086 ( 0.706 -3.382 -3.565) 4.964 8.100 ( 0.076 -7.901 1.692) 8.081 8.379 ( -0.083 -3.895 -8.501) 9.351 9.026 ( 1.591 -0.177 8.456) 8.606 9.154 ( -0.489 -0.224 4.488) 4.520 9.559 ( 1.011 -4.858 9.925) 11.097 9.757 ( -1.878 3.312 8.449) 9.267 9.817 ( -2.083 2.596 0.479) 3.363 10.125 ( -0.707 7.762 -3.070) 8.377 10.171 ( 2.738 -8.302 -8.415) 12.134 10.437 ( 0.717 -9.803 0.684) 9.853 10.480 ( 2.651 -7.699 -5.068) 9.591 10.714 ( -4.535 -8.085 -10.999) 14.384 10.832 ( 4.251 0.948 -1.942) 4.769 11.011 ( -5.591 4.858 -4.659) 8.750 11.686 ( 1.786 3.174 -1.922) 4.118 11.726 ( -4.547 3.112 -3.252) 6.398 12.399 ( 2.485 -2.754 3.215) 4.909 12.426 ( -1.890 -1.328 2.394) 3.327 13.033 ( -14.722 3.645 13.754) 20.474 13.388 ( 17.192 4.596 -3.635) 18.163 15.032 ( 0.500 4.597 10.392) 11.374 15.573 ( -2.691 6.949 -16.017) 17.665 16.362 ( -3.421 6.001 2.267) 7.271 16.505 ( 0.822 9.132 -4.540) 10.231 ======================= Grid point 448 (223/282) ======================= q-point: (-0.10 0.20 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.929 ( -4.096 1.332 17.388) 17.913 3.089 ( 10.361 7.816 15.294) 20.059 3.199 ( 1.013 -2.958 3.691) 4.837 3.420 ( 4.030 1.751 -13.385) 14.087 3.445 ( 1.271 1.152 -8.027) 8.209 3.756 ( 9.944 -4.222 -13.582) 17.354 4.071 ( 1.191 11.435 6.120) 13.025 4.296 ( 5.531 7.162 4.363) 10.046 4.497 ( -6.889 4.467 13.260) 15.596 4.680 ( -9.529 7.880 4.830) 13.275 4.860 ( 0.625 -2.082 -10.204) 10.433 5.118 ( 3.669 -3.903 -12.000) 13.141 5.287 ( 0.616 5.133 28.409) 28.876 5.740 ( -1.325 -8.713 -1.587) 8.955 5.860 ( 5.821 -8.966 -1.194) 10.757 6.096 ( 0.520 4.505 -6.437) 7.874 6.211 ( 12.037 3.090 -3.002) 12.785 6.344 ( 11.646 6.084 -14.801) 19.792 7.654 ( -7.088 -0.220 -1.191) 7.191 7.744 ( -4.453 -0.455 -0.843) 4.555 7.781 ( -2.726 0.887 -0.505) 2.911 7.877 ( 1.571 0.990 -5.331) 5.645 8.045 ( 2.285 -3.556 -1.850) 4.614 8.061 ( 3.481 -2.424 -0.660) 4.293 8.230 ( -2.111 -7.432 1.810) 7.935 8.351 ( 1.382 -6.638 -3.043) 7.432 9.125 ( 1.535 1.758 7.303) 7.667 9.158 ( -1.059 -0.499 -1.463) 1.874 9.672 ( 0.685 -0.272 5.995) 6.041 9.754 ( -3.746 0.820 8.868) 9.662 9.852 ( 5.039 0.838 -1.022) 5.209 10.021 ( -0.161 6.464 -4.121) 7.668 10.234 ( 0.601 -7.443 1.274) 7.575 10.468 ( -7.450 -10.139 3.240) 12.992 10.544 ( 5.969 -7.824 -15.714) 18.540 10.660 ( -1.878 -3.737 2.462) 4.853 10.845 ( -1.015 -0.972 -3.075) 3.381 10.919 ( 4.117 3.664 0.360) 5.523 11.421 ( -16.147 6.103 -1.329) 17.313 11.809 ( 6.976 0.569 -0.746) 7.039 12.292 ( -10.602 1.729 1.316) 10.823 12.541 ( 0.994 -2.404 3.023) 3.989 12.940 ( -7.824 0.234 8.273) 11.389 13.562 ( 16.295 5.129 -6.129) 18.149 15.159 ( 5.242 2.307 12.380) 13.640 15.354 ( 1.732 7.180 -14.719) 16.468 16.267 ( -7.108 5.375 2.595) 9.282 16.416 ( -0.206 7.118 -1.937) 7.379 ======================= Grid point 452 (224/282) ======================= q-point: ( 0.30 -0.70 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.723 ( -10.530 0.000 -0.427) 10.539 2.820 ( 9.481 -0.000 -5.172) 10.800 3.034 ( -12.586 0.000 -2.864) 12.908 3.524 ( -11.893 0.000 15.401) 19.459 3.685 ( -8.657 0.000 9.648) 12.963 3.730 ( 8.730 -0.000 -4.245) 9.707 3.850 ( 5.931 -0.000 6.969) 9.151 4.344 ( 3.390 -0.000 -2.465) 4.192 4.815 ( -13.713 0.000 21.487) 25.490 4.909 ( 3.076 -0.000 -0.873) 3.198 5.141 ( 0.526 -0.000 -13.147) 13.157 5.234 ( 4.404 -0.000 -10.166) 11.078 6.170 ( -2.220 0.000 4.025) 4.596 6.199 ( -0.983 0.000 -13.915) 13.949 6.330 ( -0.409 0.000 4.539) 4.558 6.490 ( -7.023 0.000 8.623) 11.121 6.784 ( -6.072 0.000 -4.545) 7.585 6.868 ( -10.965 0.000 -3.978) 11.664 6.884 ( 4.845 -0.000 -2.472) 5.439 7.219 ( 7.908 -0.000 5.743) 9.773 7.493 ( 5.971 -0.000 1.041) 6.061 7.684 ( 10.239 -0.000 4.967) 11.381 7.764 ( 9.344 -0.000 -10.891) 14.350 8.173 ( -6.653 0.000 -5.806) 8.830 8.230 ( -11.987 0.000 -9.637) 15.380 8.525 ( -12.938 0.000 -1.054) 12.980 8.750 ( 4.081 -0.000 -0.239) 4.088 9.115 ( 5.533 -0.000 -10.954) 12.272 9.442 ( -2.495 0.000 2.209) 3.332 9.627 ( 2.764 -0.000 -4.280) 5.095 9.732 ( 0.365 -0.000 -8.384) 8.392 9.941 ( -8.716 0.000 10.197) 13.414 10.163 ( 11.077 -0.000 -4.161) 11.833 10.515 ( -3.533 0.000 4.160) 5.457 10.863 ( -1.489 0.000 5.006) 5.222 10.902 ( -2.038 0.000 -1.919) 2.799 11.168 ( 4.643 -0.000 2.555) 5.300 11.366 ( 11.668 -0.000 -1.180) 11.727 11.379 ( 5.565 -0.000 2.734) 6.200 11.647 ( -2.899 0.000 -3.729) 4.723 11.965 ( 1.747 -0.000 11.185) 11.320 12.309 ( -1.143 0.000 0.966) 1.497 13.132 ( -4.361 0.000 10.306) 11.191 13.221 ( -1.338 0.000 -20.076) 20.121 15.177 ( -10.974 0.000 6.005) 12.509 16.151 ( -2.036 0.000 -3.176) 3.772 16.384 ( 22.790 -0.000 -2.510) 22.927 16.614 ( 2.653 -0.000 8.323) 8.736 ======================= Grid point 454 (225/282) ======================= q-point: (-0.60 0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.522 ( -10.112 13.841 5.299) 17.941 2.820 ( -9.018 -14.194 0.984) 16.845 3.086 ( 10.533 -0.017 4.938) 11.633 3.440 ( -13.538 9.198 16.863) 23.500 3.602 ( -12.526 -0.377 8.324) 15.045 3.840 ( 6.953 -2.761 -1.789) 7.692 4.025 ( 6.088 -4.162 5.558) 9.235 4.397 ( 7.789 0.788 -5.172) 9.383 4.775 ( -15.479 0.929 18.022) 23.775 4.873 ( 1.511 2.406 -14.777) 15.047 5.024 ( -2.666 -2.940 -8.456) 9.341 5.218 ( 0.293 -1.959 -0.987) 2.214 5.971 ( -9.183 0.744 -12.708) 15.696 6.077 ( -8.755 4.958 0.835) 10.096 6.193 ( -7.630 24.903 8.634) 27.440 6.612 ( -2.175 -0.452 -4.759) 5.252 6.620 ( -10.787 -12.294 2.642) 16.567 6.744 ( -2.020 -10.140 1.037) 10.391 6.954 ( 8.738 2.417 -5.264) 10.483 7.408 ( 7.638 -6.663 1.666) 10.272 7.548 ( -0.275 0.166 4.911) 4.922 7.775 ( -2.615 1.702 1.587) 3.501 7.898 ( 21.492 -0.618 -15.160) 26.308 8.020 ( -7.801 -0.615 -2.813) 8.316 8.115 ( 5.418 -1.412 -2.011) 5.949 8.312 ( -14.089 -2.395 -0.916) 14.320 8.807 ( 1.987 0.742 4.129) 4.642 9.054 ( 2.038 1.875 -10.216) 10.584 9.446 ( -0.592 -0.375 3.293) 3.366 9.594 ( 1.100 4.812 -5.283) 7.230 9.713 ( 2.670 -8.309 -6.284) 10.754 9.947 ( -4.679 -5.651 6.171) 9.587 10.267 ( 9.569 2.716 -5.597) 11.413 10.476 ( -5.040 0.319 1.500) 5.268 10.778 ( -3.274 5.755 -2.213) 6.981 10.852 ( -4.068 -2.711 -2.933) 5.701 11.285 ( 5.421 1.342 4.381) 7.098 11.352 ( -4.979 0.318 -11.620) 12.646 11.494 ( 9.318 3.066 -3.065) 10.278 11.732 ( 10.942 -2.793 4.116) 12.020 12.081 ( -1.175 -1.645 8.226) 8.471 12.291 ( -1.611 0.129 1.422) 2.153 13.029 ( 2.331 5.560 -9.960) 11.643 13.206 ( -5.014 -3.650 11.956) 13.469 15.105 ( -9.005 0.440 10.307) 13.693 16.069 ( -2.284 0.305 -5.997) 6.424 16.653 ( 12.230 2.513 -2.424) 12.718 16.682 ( 5.765 -0.000 -1.541) 5.968 ======================= Grid point 455 (226/282) ======================= q-point: (-0.50 0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.390 ( -5.408 13.379 15.679) 21.309 2.855 ( -4.821 -14.029 4.291) 15.443 3.203 ( -7.788 3.675 10.446) 13.538 3.372 ( -4.718 8.960 12.914) 16.411 3.549 ( -0.891 -0.513 5.931) 6.020 3.948 ( 5.073 -3.050 1.700) 6.158 4.168 ( 3.925 -3.174 0.011) 5.048 4.449 ( 5.684 -1.918 -5.932) 8.437 4.653 ( -5.215 5.538 -10.675) 13.108 4.705 ( -12.362 2.657 8.981) 15.509 4.952 ( -0.707 -5.735 -6.496) 8.694 5.230 ( -2.874 -0.265 4.355) 5.225 5.707 ( -7.142 2.629 -12.198) 14.378 5.906 ( -7.933 3.314 -1.904) 8.805 5.978 ( -8.281 24.863 12.368) 28.978 6.381 ( -6.229 7.173 -8.190) 12.543 6.537 ( -4.863 -0.772 -7.430) 8.913 6.938 ( 4.112 6.271 -7.636) 10.703 7.031 ( 0.178 -26.995 12.176) 29.614 7.549 ( 3.210 -6.551 -0.591) 7.319 7.626 ( 4.837 -4.158 1.503) 6.553 7.733 ( -1.146 1.404 2.754) 3.296 7.914 ( -4.686 -1.433 -0.795) 4.965 8.027 ( 4.419 1.247 -8.100) 9.311 8.182 ( 1.917 -5.567 -5.125) 7.806 8.240 ( 7.786 -3.122 -1.803) 8.581 8.896 ( 2.518 -0.395 7.722) 8.131 8.973 ( 0.623 1.674 -6.261) 6.511 9.445 ( -1.592 3.120 -0.833) 3.600 9.570 ( 0.873 -0.971 3.804) 4.022 9.778 ( 3.642 -10.377 -5.425) 12.263 9.980 ( -4.129 -7.916 2.948) 9.402 10.288 ( 4.794 4.313 -7.380) 9.801 10.409 ( -3.863 -0.249 0.265) 3.880 10.666 ( -1.556 5.406 -4.934) 7.482 10.780 ( -2.536 -1.956 -4.829) 5.794 11.106 ( -6.715 1.654 -15.280) 16.772 11.362 ( 1.838 4.386 1.574) 5.010 11.553 ( 7.800 3.604 -4.437) 9.670 11.919 ( 5.275 -3.161 -0.045) 6.149 12.117 ( -1.653 -1.484 4.290) 4.831 12.317 ( 1.158 -1.342 4.289) 4.641 13.033 ( 9.776 4.220 -1.227) 10.719 13.256 ( -7.943 -1.074 13.776) 15.938 15.087 ( -6.911 2.968 12.582) 14.658 15.966 ( -2.082 -0.197 -8.217) 8.479 16.633 ( -2.135 4.570 -0.204) 5.049 16.788 ( 11.118 3.940 -10.728) 15.944 ======================= Grid point 456 (227/282) ======================= q-point: (-0.40 0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.480 ( 1.722 8.114 24.340) 25.714 2.937 ( -3.969 -7.750 7.113) 11.243 3.120 ( -10.941 6.212 15.359) 19.855 3.361 ( -0.003 1.094 2.804) 3.010 3.620 ( 5.298 5.440 -1.762) 7.795 4.088 ( 3.213 -7.528 0.272) 8.189 4.160 ( 2.015 3.836 -7.501) 8.663 4.368 ( -5.576 1.099 -6.365) 8.533 4.521 ( -6.279 2.525 2.144) 7.099 4.641 ( 1.356 1.335 5.779) 6.085 4.957 ( -0.043 -6.333 -2.705) 6.887 5.213 ( -5.256 1.502 5.901) 8.044 5.485 ( -3.734 8.563 -7.461) 11.956 5.761 ( -3.589 0.835 -5.975) 7.020 5.823 ( -8.116 17.240 13.997) 23.643 6.189 ( -1.721 5.927 -6.880) 9.243 6.402 ( -3.025 0.881 -6.865) 7.554 6.782 ( 1.732 14.330 -12.726) 19.243 7.380 ( -0.118 -27.714 11.790) 30.118 7.634 ( 3.348 -5.468 -0.743) 6.454 7.739 ( 1.564 -6.097 0.469) 6.312 7.760 ( 1.376 -0.016 2.521) 2.872 7.864 ( -1.872 -2.177 -0.668) 2.948 7.975 ( -2.215 -4.334 -2.097) 5.299 8.213 ( 4.053 2.265 -7.044) 8.436 8.331 ( 7.532 -4.860 -11.420) 14.517 8.934 ( 0.644 0.232 1.236) 1.412 9.058 ( 3.393 -1.538 10.287) 10.941 9.396 ( -1.078 0.602 1.734) 2.129 9.663 ( 0.095 -3.016 8.365) 8.893 9.857 ( 1.962 -9.596 -4.465) 10.764 9.998 ( -3.301 -5.903 1.703) 6.975 10.231 ( 3.085 1.987 -8.394) 9.161 10.372 ( -2.112 -2.348 -1.883) 3.676 10.536 ( -1.699 8.164 -6.481) 10.561 10.704 ( -2.787 -4.870 -8.601) 10.269 10.891 ( -1.233 1.905 -9.999) 10.253 11.270 ( -5.353 5.214 -5.209) 9.109 11.628 ( 8.738 2.681 -1.406) 9.248 11.919 ( -4.370 -0.525 -2.891) 5.265 12.199 ( 4.980 -2.191 4.541) 7.087 12.394 ( 0.200 -2.256 3.743) 4.375 13.161 ( -2.031 4.456 12.277) 13.218 13.272 ( 4.308 0.971 2.697) 5.175 15.090 ( -4.458 5.788 12.621) 14.583 15.844 ( -1.180 1.679 -10.974) 11.164 16.548 ( -2.725 5.840 -0.722) 6.485 16.750 ( 3.958 7.250 -10.099) 13.047 ======================= Grid point 457 (228/282) ======================= q-point: (-0.30 0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.748 ( 2.599 2.257 27.342) 27.558 2.991 ( -0.707 1.511 10.700) 10.829 3.115 ( -3.778 2.402 12.086) 12.889 3.434 ( 7.493 -0.301 -0.299) 7.505 3.574 ( 3.176 6.007 -9.561) 11.730 3.875 ( -3.951 -0.079 -25.404) 25.709 4.274 ( 2.870 3.721 7.509) 8.858 4.295 ( -1.615 -1.202 -3.293) 3.860 4.465 ( -3.659 5.257 16.291) 17.505 4.742 ( 3.408 -5.297 -1.449) 6.463 4.957 ( -1.234 -2.085 -3.083) 3.921 5.158 ( -2.628 1.707 -3.347) 4.585 5.350 ( -2.440 14.354 11.059) 18.284 5.676 ( -3.500 -2.566 -2.664) 5.093 5.734 ( -3.573 7.797 6.289) 10.635 6.127 ( 5.479 3.595 -3.940) 7.646 6.299 ( -2.154 1.772 -4.892) 5.631 6.577 ( 5.757 15.015 -15.521) 22.349 7.617 ( -3.205 -16.206 4.441) 17.106 7.714 ( 3.465 -4.531 -0.588) 5.734 7.771 ( -1.058 -1.513 3.042) 3.559 7.815 ( 0.367 -4.280 -0.932) 4.395 7.910 ( 2.355 -7.737 2.270) 8.400 7.993 ( 1.052 -5.202 -0.471) 5.329 8.115 ( -3.615 2.080 -8.226) 9.223 8.318 ( 3.549 -3.230 -13.924) 14.727 9.005 ( 1.263 -1.978 7.872) 8.215 9.157 ( -0.577 0.096 3.877) 3.921 9.487 ( 2.610 -3.887 9.705) 10.776 9.766 ( 0.250 -2.374 7.979) 8.328 9.859 ( -2.781 -0.311 -1.514) 3.182 10.020 ( 0.583 -6.340 -1.097) 6.460 10.228 ( 5.355 -0.462 -8.366) 9.944 10.308 ( -3.212 -3.597 -5.839) 7.573 10.420 ( 0.732 1.419 -3.601) 3.939 10.608 ( -2.688 -5.902 -9.458) 11.468 10.855 ( 4.261 1.983 -1.664) 4.986 11.078 ( -6.383 3.700 -6.798) 10.033 11.727 ( 5.433 2.146 -0.087) 5.842 11.769 ( -8.736 2.387 -2.417) 9.373 12.352 ( 5.163 -3.172 3.660) 7.079 12.406 ( -3.013 -1.255 1.571) 3.623 13.089 ( -16.230 3.481 14.377) 21.959 13.456 ( 18.076 4.101 -3.092) 18.792 15.120 ( -1.067 6.483 12.227) 13.881 15.680 ( -0.019 6.613 -14.198) 15.663 16.457 ( -4.109 5.991 1.837) 7.494 16.636 ( 0.219 7.605 -6.575) 10.056 ======================= Grid point 458 (229/282) ======================= q-point: (-0.20 0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.940 ( -5.359 0.198 19.824) 20.536 3.148 ( -0.007 -3.537 8.381) 9.097 3.226 ( 10.718 9.650 15.141) 20.911 3.458 ( 1.244 2.810 -16.843) 17.121 3.480 ( 3.201 3.512 -10.954) 11.940 3.694 ( 10.200 -3.763 -12.361) 16.462 4.203 ( -2.889 5.288 0.697) 6.066 4.372 ( 2.860 2.830 8.583) 9.480 4.558 ( -3.851 2.492 10.257) 11.236 4.769 ( 0.324 -1.629 -3.191) 3.597 4.890 ( 0.913 8.718 -1.880) 8.965 5.066 ( 0.563 -1.622 -9.426) 9.581 5.431 ( 1.415 12.200 24.267) 27.198 5.630 ( -2.988 -4.358 -0.272) 5.291 5.740 ( 2.914 -4.728 -2.168) 5.962 6.177 ( 2.082 5.782 -2.520) 6.642 6.243 ( 8.668 0.953 -2.241) 9.004 6.460 ( 11.847 10.289 -16.000) 22.410 7.630 ( -7.059 -4.049 -0.246) 8.142 7.749 ( -4.203 0.973 0.285) 4.323 7.798 ( -0.527 1.044 0.507) 1.275 7.826 ( 1.641 -7.772 -2.346) 8.282 7.979 ( -1.660 -5.180 -3.376) 6.402 8.029 ( 2.196 -2.525 0.038) 3.346 8.106 ( 2.250 -8.488 4.647) 9.936 8.238 ( -0.703 -6.239 -10.907) 12.585 9.113 ( -0.844 -2.503 5.761) 6.338 9.158 ( -0.130 -0.440 0.459) 0.649 9.630 ( -1.406 -4.101 9.568) 10.505 9.795 ( -2.083 1.336 0.371) 2.502 9.870 ( 4.198 2.058 4.212) 6.293 10.092 ( 4.123 -2.556 -7.983) 9.341 10.136 ( -0.310 0.782 0.323) 0.901 10.325 ( -3.162 -8.430 0.748) 9.034 10.434 ( 5.322 -5.404 -11.225) 13.548 10.574 ( 0.854 -6.310 -0.017) 6.367 10.858 ( -3.499 2.130 -3.198) 5.197 10.972 ( 4.748 3.135 0.031) 5.690 11.514 ( -15.296 5.645 -0.734) 16.321 11.819 ( 4.417 0.741 0.953) 4.579 12.314 ( -7.393 1.060 0.376) 7.478 12.493 ( 2.361 -3.717 2.444) 5.036 12.954 ( -12.901 1.652 9.539) 16.129 13.645 ( 16.856 5.476 -6.041) 18.724 15.212 ( 3.000 4.601 13.076) 14.182 15.486 ( 2.298 9.685 -14.714) 17.764 16.358 ( -7.235 6.125 3.998) 10.288 16.529 ( -0.391 7.133 -3.144) 7.805 ======================= Grid point 459 (230/282) ======================= q-point: (-0.10 0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.029 ( -1.151 2.071 8.426) 8.753 3.210 ( -1.283 1.246 2.081) 2.744 3.237 ( -1.442 -2.025 -13.207) 13.439 3.378 ( 6.674 2.584 -6.653) 9.772 3.488 ( 5.351 4.473 4.351) 8.220 3.819 ( 8.632 -0.193 -5.467) 10.219 4.192 ( 4.485 1.873 3.619) 6.060 4.463 ( -8.090 0.172 -4.865) 9.442 4.520 ( 3.368 1.802 10.944) 11.592 4.643 ( -3.592 15.101 4.576) 16.183 4.968 ( 10.420 6.250 5.075) 13.168 5.018 ( 2.167 -2.428 -8.273) 8.890 5.559 ( -0.404 3.845 11.110) 11.764 5.720 ( 6.535 -4.283 4.627) 9.081 5.848 ( 7.077 -11.461 -2.721) 13.742 6.133 ( 5.968 7.053 -3.696) 9.951 6.419 ( 18.409 4.766 -12.145) 22.563 6.469 ( 10.231 2.097 0.743) 10.470 7.473 ( -14.351 -2.007 0.172) 14.492 7.647 ( -6.549 1.964 -1.238) 6.948 7.726 ( -5.504 3.095 -0.537) 6.337 7.862 ( -2.699 1.491 -0.317) 3.100 8.015 ( -2.593 -7.935 -1.814) 8.543 8.083 ( 4.032 -6.072 -3.353) 8.023 8.171 ( 5.956 -6.841 -0.180) 9.072 8.330 ( 4.505 -9.643 3.653) 11.253 9.083 ( -2.744 -2.472 -4.651) 5.939 9.194 ( -0.693 -0.648 1.313) 1.620 9.712 ( 0.397 -4.363 3.273) 5.469 9.774 ( -3.329 0.857 3.166) 4.673 9.931 ( 5.126 3.520 -3.162) 6.976 10.006 ( -0.167 3.950 -3.012) 4.970 10.256 ( 4.258 -4.065 2.299) 6.320 10.302 ( -4.433 -5.557 -3.479) 7.914 10.466 ( 3.011 -6.174 0.053) 6.869 10.644 ( -4.678 0.314 5.740) 7.412 10.818 ( 5.321 -5.874 -2.768) 8.395 11.060 ( 6.170 5.226 3.485) 8.805 11.227 ( -14.600 6.291 0.606) 15.909 11.872 ( 0.035 -0.901 2.562) 2.717 12.181 ( -7.244 3.942 0.483) 8.261 12.494 ( -8.928 -0.821 3.218) 9.526 12.910 ( -1.224 -4.627 2.112) 5.231 13.751 ( 12.772 5.582 -10.080) 17.201 15.347 ( 7.004 7.989 -12.320) 16.268 15.405 ( 6.802 1.278 15.085) 16.597 16.211 ( -10.951 7.037 4.660) 13.826 16.452 ( -0.123 7.636 -0.776) 7.677 ======================= Grid point 464 (231/282) ======================= q-point: ( 0.40 -0.60 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.561 ( -4.361 0.000 10.086) 10.988 2.678 ( -5.832 0.000 9.257) 10.941 3.227 ( -3.262 0.000 7.681) 8.345 3.468 ( -12.687 0.000 6.781) 14.386 3.536 ( 1.110 -0.000 17.647) 17.682 3.908 ( 6.868 -0.000 -4.773) 8.364 4.147 ( 5.111 -0.000 3.797) 6.367 4.433 ( 2.715 -0.000 -6.485) 7.031 4.712 ( -14.013 0.000 16.376) 21.553 4.721 ( -0.913 0.000 -18.856) 18.878 4.894 ( -1.534 0.000 -6.610) 6.785 5.220 ( -2.051 0.000 3.653) 4.190 5.724 ( -5.961 0.000 -13.007) 14.308 5.929 ( -7.201 0.000 -5.903) 9.312 6.363 ( -13.017 0.000 3.656) 13.521 6.417 ( -1.802 0.000 11.909) 12.044 6.470 ( -6.488 0.000 -8.964) 11.066 6.688 ( -1.738 0.000 8.199) 8.381 7.070 ( 9.731 -0.000 -5.519) 11.187 7.438 ( 1.443 -0.000 -4.029) 4.280 7.605 ( 1.454 -0.000 4.708) 4.927 7.749 ( -1.488 0.000 2.589) 2.986 7.906 ( -2.842 0.000 -0.952) 2.997 8.050 ( -12.099 0.000 -2.204) 12.298 8.109 ( 21.549 -0.000 -14.109) 25.757 8.230 ( 4.859 -0.000 0.595) 4.895 8.890 ( 1.694 -0.000 8.008) 8.186 8.987 ( 0.637 -0.000 -8.086) 8.111 9.479 ( 0.036 -0.000 2.205) 2.206 9.611 ( 0.293 -0.000 -4.622) 4.631 9.636 ( 4.047 -0.000 -4.306) 5.909 9.915 ( -4.603 0.000 6.161) 7.691 10.329 ( 5.558 -0.000 -7.528) 9.358 10.410 ( -4.986 0.000 0.950) 5.075 10.721 ( -4.235 0.000 -2.407) 4.871 10.750 ( -0.566 0.000 -8.302) 8.321 11.120 ( -6.668 0.000 -14.862) 16.290 11.398 ( 2.494 -0.000 1.702) 3.019 11.583 ( 6.541 -0.000 -4.708) 8.059 11.890 ( 6.045 -0.000 0.890) 6.110 12.105 ( -1.766 0.000 4.875) 5.185 12.308 ( 1.416 -0.000 2.964) 3.285 13.071 ( 11.605 -0.000 -5.291) 12.754 13.243 ( -9.864 0.000 18.206) 20.707 15.111 ( -6.407 0.000 13.571) 15.007 15.964 ( -2.025 0.000 -8.086) 8.335 16.668 ( -2.339 0.000 -0.336) 2.363 16.818 ( 12.122 -0.000 -10.264) 15.883 ======================= Grid point 466 (232/282) ======================= q-point: (-0.50 0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.612 ( 0.028 8.716 18.698) 20.630 2.791 ( -2.351 -9.510 12.306) 15.729 3.208 ( -6.186 3.565 10.326) 12.554 3.368 ( -5.793 0.009 4.012) 7.047 3.720 ( 5.861 6.517 5.132) 10.157 3.955 ( 3.321 -7.872 -7.173) 11.156 4.208 ( 2.545 1.916 -3.197) 4.513 4.368 ( -3.505 -0.663 -4.422) 5.681 4.548 ( -0.201 1.328 -7.272) 7.395 4.665 ( -9.619 1.000 11.405) 14.953 4.873 ( 2.188 -3.485 -2.789) 4.971 5.203 ( -5.156 -1.177 2.989) 6.074 5.556 ( 0.166 1.836 -10.885) 11.040 5.772 ( -4.196 0.425 -7.884) 8.941 6.143 ( -9.690 13.920 5.569) 17.851 6.287 ( -4.557 5.174 -5.100) 8.576 6.441 ( -0.600 11.643 4.167) 12.381 6.922 ( -1.845 -28.968 14.597) 32.490 7.063 ( 6.029 18.334 -7.206) 20.601 7.452 ( 1.247 -15.830 -6.720) 17.243 7.679 ( 2.037 -1.614 3.450) 4.319 7.771 ( -1.031 0.711 3.400) 3.623 7.862 ( -3.466 1.438 -0.036) 3.753 7.906 ( -3.621 -3.979 -0.169) 5.383 8.245 ( 9.737 1.824 -11.174) 14.933 8.278 ( 6.993 -2.312 -9.375) 11.922 8.940 ( 0.424 0.452 -1.188) 1.340 9.031 ( 3.433 -1.346 10.650) 11.271 9.444 ( -0.671 4.554 -1.610) 4.877 9.603 ( 0.355 -4.804 0.289) 4.826 9.715 ( 4.264 -5.682 -0.819) 7.150 9.926 ( -3.871 -2.882 7.109) 8.593 10.289 ( 2.084 3.604 -9.104) 10.011 10.355 ( -3.275 -0.580 0.106) 3.328 10.617 ( -2.053 1.528 -6.679) 7.153 10.649 ( -2.540 -1.210 -10.466) 10.838 10.920 ( -1.319 1.302 -9.612) 9.789 11.327 ( -6.345 2.025 -6.746) 9.480 11.655 ( 7.247 0.911 -0.771) 7.345 11.910 ( -2.727 -0.414 -1.776) 3.281 12.174 ( 4.037 -0.974 5.053) 6.541 12.372 ( 1.613 -0.735 2.498) 3.063 13.221 ( -7.973 3.001 14.430) 16.757 13.270 ( 10.320 -1.038 1.636) 10.500 15.159 ( -4.523 2.603 14.382) 15.300 15.860 ( -0.047 0.480 -9.459) 9.471 16.610 ( -2.908 2.126 -1.131) 3.775 16.825 ( 4.451 2.562 -11.110) 12.239 ======================= Grid point 467 (233/282) ======================= q-point: (-0.40 0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.790 ( -0.221 3.417 23.784) 24.029 2.936 ( -1.578 -5.572 12.420) 13.704 3.225 ( 0.694 8.449 12.175) 14.835 3.410 ( 5.919 -2.895 1.961) 6.875 3.677 ( 2.370 7.206 -11.251) 13.569 3.858 ( -3.683 -2.662 -22.644) 23.096 4.236 ( 3.156 -2.988 0.773) 4.415 4.320 ( 1.900 0.970 -1.200) 2.447 4.540 ( -4.119 3.689 12.718) 13.868 4.660 ( -2.583 -4.761 2.894) 6.141 4.916 ( 2.292 -2.392 -1.211) 3.527 5.156 ( -3.575 -1.602 -0.266) 3.927 5.481 ( 2.550 4.295 -3.750) 6.246 5.648 ( -1.846 -1.188 -8.265) 8.551 5.983 ( -7.030 15.747 10.038) 19.954 6.183 ( 2.014 3.861 -3.813) 5.788 6.373 ( -0.402 12.865 3.564) 13.355 6.875 ( 4.977 23.210 -11.562) 26.404 7.255 ( -2.802 -29.055 11.657) 31.431 7.561 ( 3.468 -16.246 -5.261) 17.425 7.743 ( 0.293 -1.540 2.694) 3.118 7.770 ( -0.213 -2.389 1.501) 2.830 7.854 ( 0.343 -0.871 1.586) 1.841 7.918 ( -0.083 -3.347 0.407) 3.373 8.143 ( -6.011 1.426 -8.035) 10.136 8.291 ( 8.028 -0.707 -16.673) 18.519 8.981 ( 0.959 -0.923 6.371) 6.508 9.147 ( -0.955 -1.319 3.441) 3.807 9.459 ( 3.778 0.691 5.710) 6.881 9.668 ( 1.254 -9.404 -0.843) 9.525 9.810 ( 2.566 -2.702 2.705) 4.604 9.981 ( -2.417 -2.120 9.500) 10.030 10.198 ( 3.271 1.011 -11.201) 11.713 10.301 ( -2.456 0.058 -3.970) 4.669 10.487 ( -1.428 4.541 -9.017) 10.197 10.532 ( -1.558 -3.795 -7.916) 8.916 10.888 ( 4.670 2.021 -1.422) 5.284 11.119 ( -7.625 1.659 -8.476) 11.522 11.751 ( 5.518 1.118 0.960) 5.711 11.797 ( -8.788 1.191 -1.772) 9.043 12.310 ( 5.265 -2.132 4.068) 6.987 12.389 ( -2.096 -0.848 0.551) 2.327 13.133 ( -17.097 2.116 14.831) 22.732 13.506 ( 18.605 2.316 -2.403) 18.902 15.212 ( -2.368 5.013 13.584) 14.672 15.761 ( 1.941 3.687 -11.491) 12.224 16.533 ( -4.232 3.682 0.923) 5.685 16.727 ( -0.373 4.112 -8.311) 9.280 ======================= Grid point 468 (234/282) ======================= q-point: (-0.30 0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.941 ( -5.302 0.087 19.393) 20.104 3.096 ( -0.293 -3.104 13.775) 14.124 3.369 ( 9.531 8.610 12.977) 18.258 3.498 ( 2.309 2.547 -14.632) 15.031 3.541 ( 0.334 3.765 -17.175) 17.586 3.641 ( 10.075 -3.182 -9.199) 14.009 4.250 ( -0.407 1.817 -1.991) 2.726 4.387 ( 5.070 -0.656 2.931) 5.893 4.565 ( -9.161 -0.920 9.264) 13.061 4.710 ( 3.467 -4.403 1.344) 5.763 4.958 ( 2.649 0.101 1.539) 3.065 5.103 ( 0.715 3.981 -6.006) 7.242 5.518 ( 4.611 1.482 5.841) 7.588 5.582 ( -0.083 -4.044 -6.138) 7.351 5.872 ( -3.916 18.435 10.871) 21.757 6.228 ( 8.398 -0.745 -0.997) 8.490 6.306 ( 0.165 11.536 2.050) 11.718 6.681 ( 8.444 18.731 -14.368) 25.072 7.469 ( -5.059 -18.888 4.902) 20.158 7.670 ( 0.876 -11.562 -2.104) 11.785 7.768 ( -2.111 0.926 0.890) 2.471 7.805 ( 0.436 -0.456 1.149) 1.311 7.899 ( -2.687 -5.363 -0.658) 6.034 7.963 ( 1.175 -7.803 1.117) 7.969 7.983 ( -0.080 -2.792 -2.549) 3.782 8.205 ( 0.455 0.724 -13.551) 13.578 9.073 ( -1.374 -2.281 6.449) 6.978 9.132 ( -1.722 -2.795 -0.753) 3.368 9.567 ( -0.021 -3.416 5.104) 6.142 9.746 ( 1.933 -6.892 -3.612) 8.018 9.899 ( 2.727 0.931 6.550) 7.156 10.059 ( 2.869 1.520 7.013) 7.728 10.169 ( -1.490 -3.202 -9.141) 9.800 10.221 ( 5.034 -1.122 -7.057) 8.741 10.405 ( 1.485 0.999 -3.753) 4.158 10.493 ( 0.225 -4.045 -2.650) 4.841 10.897 ( -4.025 2.690 -4.394) 6.538 11.009 ( 5.977 1.643 0.844) 6.256 11.586 ( -14.107 3.760 -0.231) 14.602 11.830 ( 2.974 0.628 1.781) 3.523 12.325 ( -5.038 0.396 -0.539) 5.082 12.435 ( 2.656 -3.638 2.008) 4.932 12.984 ( -16.090 1.969 10.605) 19.371 13.719 ( 17.103 3.918 -5.890) 18.508 15.289 ( 0.631 4.935 13.297) 14.197 15.630 ( 3.198 8.501 -13.394) 16.183 16.442 ( -7.281 4.619 4.364) 9.664 16.620 ( -0.848 4.509 -4.018) 6.099 ======================= Grid point 469 (235/282) ======================= q-point: (-0.20 0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.044 ( -4.062 -0.113 16.504) 16.997 3.214 ( -2.036 -0.748 8.020) 8.309 3.240 ( 0.945 2.660 -22.840) 23.014 3.398 ( 3.379 0.091 -13.218) 13.643 3.591 ( 5.600 7.783 9.226) 13.306 3.801 ( 10.184 -1.307 -2.422) 10.549 4.222 ( 1.448 1.966 0.069) 2.442 4.450 ( -3.899 -1.771 -6.450) 7.742 4.540 ( 3.312 1.003 9.913) 10.500 4.783 ( 0.283 -1.372 -1.215) 1.854 4.996 ( 4.422 8.782 -3.724) 10.514 5.085 ( 6.894 2.454 6.677) 9.906 5.565 ( 0.321 -3.927 -3.848) 5.508 5.704 ( 8.162 -5.862 3.598) 10.674 5.816 ( 1.373 15.995 11.786) 19.916 6.257 ( 4.144 9.527 -0.675) 10.411 6.414 ( 12.200 -3.011 3.129) 12.949 6.580 ( 11.754 11.333 -14.704) 21.973 7.430 ( -14.447 -4.463 1.175) 15.166 7.684 ( -4.693 1.278 -0.777) 4.925 7.722 ( -3.733 -8.363 0.010) 9.158 7.799 ( -2.293 -1.860 -0.279) 2.966 7.927 ( 3.011 -6.881 0.323) 7.518 8.028 ( -5.271 -3.165 -10.496) 12.165 8.062 ( 2.266 -4.076 2.826) 5.453 8.170 ( 8.714 -10.090 3.182) 13.707 9.039 ( -3.806 -3.245 -4.394) 6.658 9.164 ( -2.362 -2.905 2.340) 4.416 9.626 ( 0.005 -5.873 1.414) 6.041 9.761 ( 0.086 -2.979 -3.073) 4.281 9.976 ( 1.014 1.837 5.097) 5.512 10.069 ( -0.506 1.423 -5.893) 6.084 10.164 ( 8.410 -1.889 -11.755) 14.577 10.286 ( 1.573 0.323 10.628) 10.749 10.415 ( 2.131 -0.788 0.417) 2.310 10.578 ( 3.600 -7.168 3.148) 8.616 10.789 ( -0.337 1.271 -3.585) 3.818 11.135 ( 7.562 4.510 4.772) 10.015 11.323 ( -15.868 5.780 1.781) 16.982 11.864 ( -1.118 -0.259 2.521) 2.770 12.227 ( -5.273 2.139 -0.257) 5.696 12.471 ( -4.592 -2.292 1.714) 5.411 12.858 ( -8.607 -2.012 4.292) 9.826 13.831 ( 12.220 4.627 -10.489) 16.756 15.426 ( 4.349 2.522 11.711) 12.744 15.495 ( 5.353 9.582 -10.211) 14.991 16.314 ( -11.354 6.076 6.413) 14.386 16.560 ( 0.955 5.991 -0.713) 6.109 ======================= Grid point 470 (236/282) ======================= q-point: (-0.10 0.40 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.005 ( 5.719 3.793 -25.274) 26.189 3.142 ( -5.387 -2.929 13.330) 14.673 3.224 ( -7.129 1.879 3.572) 8.192 3.363 ( 5.145 -3.171 -8.672) 10.570 3.644 ( 1.018 5.860 6.874) 9.090 3.839 ( -4.311 1.140 0.903) 4.550 4.257 ( 1.606 0.342 -11.984) 12.096 4.308 ( -0.554 3.768 0.308) 3.821 4.674 ( -3.911 6.509 13.234) 15.258 4.777 ( 10.722 -1.508 -6.213) 12.483 5.053 ( 12.203 3.887 -1.749) 12.926 5.255 ( 5.680 7.455 11.336) 14.708 5.581 ( 1.637 -5.563 -0.662) 5.836 5.800 ( 3.897 -1.635 -0.926) 4.326 5.990 ( 11.120 0.631 6.980) 13.145 6.297 ( 11.938 7.128 -2.684) 14.161 6.564 ( 12.408 4.804 -13.280) 18.799 6.683 ( 11.208 -4.453 7.867) 14.399 7.247 ( -13.121 -2.228 3.317) 13.716 7.571 ( -4.685 6.094 -1.671) 7.866 7.663 ( -6.450 4.248 0.686) 7.754 7.780 ( -13.180 -1.686 -6.063) 14.605 7.793 ( -4.978 -7.433 0.139) 8.947 8.083 ( 4.338 -12.249 0.728) 13.015 8.219 ( 6.749 -9.012 0.306) 11.263 8.426 ( 11.353 -7.914 3.530) 14.283 8.958 ( -3.843 -3.430 -5.246) 7.353 9.107 ( -5.313 -2.137 -5.639) 8.037 9.691 ( -0.986 -6.142 2.049) 6.549 9.722 ( -0.475 -0.503 -6.369) 6.406 9.977 ( 1.749 5.215 -6.586) 8.581 10.053 ( 1.253 4.158 3.619) 5.653 10.119 ( -1.858 -7.934 -5.879) 10.048 10.409 ( 6.060 5.579 2.874) 8.724 10.527 ( 3.369 -3.860 9.841) 11.095 10.666 ( -2.708 2.462 7.970) 8.770 10.860 ( 8.095 -5.448 0.725) 9.784 11.063 ( -10.937 4.708 1.648) 12.021 11.262 ( 6.681 5.779 3.301) 9.430 11.841 ( -6.242 -1.044 2.203) 6.701 12.156 ( -2.972 3.323 4.367) 6.241 12.356 ( -11.335 1.894 1.336) 11.570 12.855 ( 0.040 -8.649 -1.829) 8.841 13.814 ( 6.260 4.033 -14.392) 16.205 15.425 ( 9.506 6.636 -10.518) 15.654 15.647 ( 5.242 -1.461 13.974) 14.996 16.148 ( -12.761 6.774 9.324) 17.195 16.528 ( 2.498 9.142 0.004) 9.477 ======================= Grid point 476 (237/282) ======================= q-point: (-0.50 0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.854 ( 1.243 0.000 20.212) 20.250 2.854 ( -4.140 -0.000 16.697) 17.203 3.321 ( 5.803 -0.000 10.433) 11.938 3.358 ( 1.742 -0.000 3.020) 3.486 3.772 ( 0.353 0.000 -14.920) 14.924 3.798 ( -1.369 -0.000 -16.915) 16.971 4.212 ( 3.155 -0.000 -1.065) 3.330 4.326 ( 2.469 -0.000 -3.065) 3.936 4.573 ( 2.986 0.000 4.277) 5.216 4.616 ( -11.672 -0.000 11.939) 16.696 4.897 ( 3.119 -0.000 -0.037) 3.119 5.139 ( -4.125 -0.000 1.335) 4.335 5.513 ( 4.118 -0.000 -6.796) 7.947 5.639 ( -2.101 -0.000 -9.580) 9.807 6.079 ( -4.578 -0.000 0.916) 4.669 6.211 ( 0.762 -0.000 -5.825) 5.875 6.696 ( 1.455 0.000 14.800) 14.872 6.838 ( -5.793 -0.000 14.042) 15.190 7.241 ( -2.326 0.000 -11.239) 11.477 7.249 ( 9.923 -0.000 -4.894) 11.065 7.734 ( 2.322 -0.000 2.380) 3.325 7.746 ( -2.529 -0.000 1.411) 2.896 7.851 ( -0.041 -0.000 1.633) 1.634 7.896 ( 0.342 -0.000 0.930) 0.991 8.154 ( -7.156 -0.000 -7.856) 10.627 8.287 ( 9.685 -0.000 -17.206) 19.745 8.976 ( 1.010 -0.000 5.470) 5.563 9.133 ( -1.164 -0.000 3.565) 3.750 9.493 ( 5.711 0.000 2.103) 6.086 9.562 ( -0.264 -0.000 -0.893) 0.931 9.791 ( 4.407 -0.000 3.869) 5.865 9.956 ( -1.831 -0.000 10.302) 10.463 10.225 ( 1.603 0.000 -12.508) 12.610 10.297 ( -3.464 -0.000 -0.973) 3.599 10.494 ( -0.774 -0.000 -8.979) 9.012 10.530 ( -1.716 -0.000 -8.901) 9.064 10.906 ( 5.069 0.000 -1.516) 5.290 11.131 ( -8.414 -0.000 -9.069) 12.371 11.760 ( 5.430 -0.000 1.263) 5.575 11.806 ( -8.591 -0.000 -1.515) 8.724 12.293 ( 5.168 -0.000 4.240) 6.685 12.382 ( -1.657 -0.000 0.105) 1.660 13.150 ( -17.375 -0.000 14.975) 22.937 13.524 ( 18.783 -0.000 -2.093) 18.899 15.254 ( -2.914 0.000 14.074) 14.372 15.789 ( 2.673 -0.000 -10.168) 10.513 16.562 ( -4.148 -0.000 0.484) 4.176 16.758 ( -0.646 -0.000 -9.051) 9.074 ======================= Grid point 478 (238/282) ======================= q-point: (-0.40 0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.943 ( -5.037 0.177 17.220) 17.942 3.060 ( -0.593 -1.328 18.298) 18.355 3.472 ( 9.267 4.213 7.425) 12.600 3.533 ( 2.347 1.700 -12.514) 12.845 3.578 ( -1.555 1.048 -21.376) 21.458 3.600 ( 9.484 -2.090 -2.450) 10.016 4.275 ( 4.734 1.500 -1.728) 5.258 4.360 ( 7.220 -2.160 -7.328) 10.511 4.553 ( -12.401 -0.379 13.260) 18.160 4.657 ( 0.742 -1.988 4.559) 5.029 4.952 ( 2.369 -0.316 3.082) 3.900 5.130 ( 2.447 0.227 -0.968) 2.642 5.534 ( -0.163 -1.504 -7.964) 8.106 5.546 ( 5.689 1.333 -0.814) 5.900 6.057 ( 0.431 4.809 3.651) 6.053 6.212 ( 5.300 -0.784 -3.225) 6.254 6.625 ( -2.309 28.861 11.631) 31.202 6.995 ( 1.496 19.034 -11.435) 22.255 7.088 ( -3.468 -28.677 10.079) 30.594 7.443 ( 6.445 -16.775 -4.814) 18.604 7.760 ( 0.691 -1.440 1.559) 2.232 7.797 ( 2.326 0.037 1.652) 2.854 7.840 ( -6.231 -1.438 0.205) 6.398 7.911 ( 1.470 -0.861 -1.018) 1.985 7.955 ( -4.945 -0.907 -4.871) 7.000 8.221 ( 1.526 0.707 -12.869) 12.979 9.054 ( -0.851 -0.149 6.921) 6.975 9.088 ( -3.690 -2.352 -1.807) 4.735 9.545 ( 1.062 0.431 -0.738) 1.363 9.639 ( 4.773 -5.454 -0.884) 7.301 9.906 ( 4.289 0.357 5.702) 7.144 10.071 ( 0.793 -2.511 10.928) 11.240 10.119 ( 2.190 1.146 -11.090) 11.362 10.246 ( 1.768 1.138 -4.665) 5.117 10.429 ( 0.199 1.476 -4.661) 4.893 10.450 ( 0.551 -1.717 -3.677) 4.095 10.930 ( -5.324 1.392 -7.131) 9.008 11.022 ( 7.832 0.263 3.210) 8.468 11.625 ( -13.287 1.317 -0.050) 13.352 11.837 ( 2.352 0.230 2.086) 3.152 12.330 ( -3.870 0.283 -1.189) 4.058 12.392 ( 2.534 -1.733 1.903) 3.612 13.007 ( -17.411 0.845 11.127) 20.680 13.760 ( 17.160 1.400 -5.761) 18.155 15.346 ( -0.970 2.152 13.150) 13.361 15.724 ( 4.032 3.404 -11.725) 12.858 16.492 ( -7.225 1.740 3.997) 8.438 16.664 ( -1.325 1.382 -4.469) 4.862 ======================= Grid point 479 (239/282) ======================= q-point: (-0.30 0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.035 ( -5.470 -0.798 16.530) 17.429 3.206 ( -1.402 -0.244 12.201) 12.284 3.291 ( 1.222 3.555 -23.103) 23.407 3.388 ( 1.803 -1.249 -17.269) 17.408 3.680 ( 4.569 2.875 11.332) 12.553 3.802 ( 10.288 1.860 0.239) 10.457 4.254 ( 1.452 2.246 -6.687) 7.202 4.409 ( 2.902 -3.407 -5.969) 7.461 4.552 ( 1.570 0.490 7.279) 7.462 4.721 ( 0.380 -3.714 1.947) 4.210 5.061 ( 2.739 -1.387 10.333) 10.779 5.154 ( 7.898 6.471 -4.998) 11.368 5.491 ( 1.380 -4.640 -7.165) 8.647 5.671 ( 8.038 0.759 5.357) 9.690 6.064 ( 2.621 12.511 6.272) 14.238 6.328 ( 7.938 -3.741 0.856) 8.817 6.501 ( 1.241 19.724 6.154) 20.699 6.790 ( 4.593 15.255 -12.361) 20.164 7.276 ( -7.517 -17.820 5.294) 20.052 7.540 ( -3.777 -8.883 -3.212) 10.173 7.692 ( -5.017 -5.679 -1.173) 7.668 7.775 ( -2.740 -3.346 0.905) 4.418 7.826 ( -1.118 -1.362 -1.761) 2.491 7.953 ( 5.061 -2.381 -2.532) 6.139 8.040 ( 6.650 -5.630 1.239) 8.801 8.086 ( -3.443 1.424 -3.486) 5.102 8.991 ( -4.474 -2.582 -4.012) 6.541 9.122 ( -3.015 -2.213 4.952) 6.206 9.555 ( 2.317 -3.012 -3.463) 5.142 9.698 ( 1.863 -4.419 -4.056) 6.281 9.984 ( 0.218 -0.435 0.413) 0.638 10.026 ( 3.045 -3.018 -11.150) 11.946 10.234 ( 7.348 6.264 -5.838) 11.283 10.284 ( 2.273 -0.580 17.935) 18.088 10.417 ( 2.468 0.205 -0.876) 2.627 10.491 ( 3.361 -3.486 2.690) 5.540 10.813 ( -0.500 1.276 -4.580) 4.781 11.191 ( 8.737 2.674 5.944) 10.901 11.394 ( -15.899 3.286 2.319) 16.400 11.861 ( -1.983 -0.173 2.176) 2.949 12.251 ( -3.975 1.101 -0.849) 4.211 12.431 ( -0.990 -2.511 0.034) 2.699 12.845 ( -14.049 -0.111 6.374) 15.428 13.886 ( 11.743 2.539 -10.844) 16.185 15.462 ( 1.779 1.930 12.854) 13.119 15.628 ( 4.596 6.931 -12.448) 14.970 16.387 ( -11.605 3.384 7.399) 14.172 16.627 ( 1.620 2.832 -0.296) 3.276 ======================= Grid point 480 (240/282) ======================= q-point: (-0.20 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.038 ( 0.573 -0.036 -15.141) 15.152 3.134 ( -2.929 2.412 6.673) 7.677 3.247 ( -6.937 1.039 3.585) 7.878 3.314 ( 4.394 -3.210 -10.849) 12.137 3.728 ( -6.200 4.224 11.441) 13.681 3.858 ( -2.223 2.055 0.930) 3.167 4.227 ( 7.735 -2.035 -11.323) 13.863 4.391 ( 1.341 4.914 -3.715) 6.305 4.696 ( 9.924 -5.368 -3.528) 11.821 4.760 ( 0.558 2.232 3.455) 4.151 5.165 ( 10.090 8.511 0.513) 13.210 5.282 ( 3.717 -1.899 13.494) 14.125 5.493 ( 2.313 -5.740 -6.960) 9.314 5.830 ( 6.793 3.549 3.622) 8.477 6.093 ( 5.481 11.837 8.604) 15.626 6.415 ( 7.738 7.735 0.092) 10.942 6.608 ( 7.671 -3.280 7.886) 11.480 6.658 ( 7.124 7.167 -13.811) 17.113 7.220 ( -10.843 -1.697 4.586) 11.894 7.534 ( -3.543 -14.961 -5.058) 16.185 7.661 ( -1.372 3.882 -1.282) 4.312 7.738 ( -5.726 2.259 -2.513) 6.649 7.792 ( -6.608 -8.033 -3.840) 11.088 7.918 ( -4.862 -4.184 5.950) 8.749 8.096 ( 5.893 -6.626 -0.679) 8.894 8.303 ( 12.996 -7.428 2.561) 15.186 8.909 ( -4.173 -2.792 -3.584) 6.169 9.082 ( -5.744 -1.109 -2.067) 6.204 9.601 ( 3.768 -4.987 -3.483) 7.156 9.695 ( -0.183 -2.774 -5.042) 5.758 9.944 ( 0.513 -6.970 -10.589) 12.688 10.051 ( 1.635 0.803 4.173) 4.554 10.183 ( 2.979 8.412 -7.862) 11.893 10.461 ( 2.118 -1.391 3.265) 4.133 10.512 ( 6.749 3.871 12.086) 14.374 10.642 ( 3.506 -3.921 8.467) 9.968 10.829 ( 7.471 0.620 0.165) 7.499 11.143 ( -14.908 4.972 3.637) 16.131 11.343 ( 6.343 4.579 4.078) 8.822 11.821 ( -6.766 -1.599 1.623) 7.139 12.195 ( -2.469 1.984 2.976) 4.346 12.384 ( -6.627 1.382 0.764) 6.813 12.743 ( -5.672 -5.661 0.103) 8.014 13.866 ( 5.156 2.665 -14.824) 15.920 15.528 ( 6.726 6.378 -11.789) 14.997 15.635 ( 3.359 -0.295 12.963) 13.394 16.236 ( -14.688 4.678 9.817) 18.275 16.647 ( 4.409 6.165 0.831) 7.625 ======================= Grid point 481 (241/282) ======================= q-point: (-0.10 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.898 ( 5.608 3.315 -20.505) 21.515 3.044 ( -14.815 -0.750 -4.261) 15.434 3.147 ( -10.647 -2.351 13.636) 17.459 3.336 ( 3.957 -5.164 -5.159) 8.303 3.741 ( -8.256 0.825 14.807) 16.974 3.774 ( -2.509 5.349 0.310) 5.916 4.228 ( 7.115 5.914 -12.938) 15.906 4.325 ( 0.599 2.630 -3.088) 4.100 4.732 ( -1.525 2.777 2.055) 3.776 4.865 ( 9.514 -2.987 -4.246) 10.838 5.309 ( 14.072 6.076 -0.582) 15.339 5.418 ( -5.060 2.757 11.699) 13.041 5.529 ( -0.516 -11.354 0.601) 11.381 5.887 ( 3.440 6.343 3.498) 8.019 6.214 ( 8.905 4.088 2.611) 10.141 6.516 ( 13.406 5.137 -7.442) 16.171 6.602 ( 3.408 -0.527 -0.430) 3.475 6.844 ( 6.612 -5.428 4.546) 9.687 7.178 ( 1.475 0.767 2.238) 2.789 7.441 ( -15.047 -6.897 -7.338) 18.106 7.592 ( -0.040 7.211 -1.062) 7.289 7.597 ( -6.462 -2.641 2.300) 7.350 7.716 ( -0.956 3.515 0.511) 3.678 8.022 ( -1.519 -13.549 4.077) 14.230 8.240 ( 7.584 -9.566 -3.730) 12.765 8.577 ( 11.270 -7.278 2.052) 13.571 8.827 ( -5.963 -1.193 -2.264) 6.489 8.944 ( -5.702 -0.289 -6.831) 8.903 9.633 ( -4.063 0.835 -0.243) 4.156 9.666 ( 5.232 -6.108 -7.155) 10.765 9.912 ( 1.574 -4.439 -8.446) 9.670 10.026 ( -2.164 6.930 -7.614) 10.521 10.172 ( 3.512 0.461 7.615) 8.398 10.533 ( 2.171 2.649 4.527) 5.677 10.666 ( 6.452 0.280 -0.147) 6.460 10.740 ( -3.944 5.127 13.155) 14.659 10.985 ( -2.814 -0.906 3.237) 4.384 11.037 ( 11.897 0.771 6.736) 13.693 11.391 ( 1.955 3.457 -0.626) 4.021 11.707 ( -10.999 -2.140 0.276) 11.209 12.218 ( 0.896 1.437 4.947) 5.229 12.255 ( -8.011 6.511 5.428) 11.663 12.745 ( -1.008 -10.486 -3.514) 11.105 13.732 ( 0.430 2.145 -16.484) 16.629 15.481 ( 3.963 3.147 -8.575) 9.957 15.806 ( 3.023 -0.419 8.259) 8.805 16.119 ( -9.654 0.683 13.423) 16.549 16.665 ( 5.823 10.071 -0.880) 11.666 ======================= Grid point 488 (242/282) ======================= q-point: (-0.40 -0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.028 ( -5.860 0.000 15.779) 16.832 3.205 ( -1.178 0.000 13.938) 13.988 3.328 ( 2.081 -0.000 -21.546) 21.647 3.370 ( 0.354 -0.000 -19.941) 19.944 3.694 ( 5.086 -0.000 9.941) 11.167 3.826 ( 9.203 -0.000 4.188) 10.111 4.279 ( 0.503 -0.000 -14.003) 14.012 4.371 ( 7.625 -0.000 -2.258) 7.952 4.555 ( -0.343 0.000 5.405) 5.416 4.693 ( 0.735 -0.000 4.883) 4.938 5.045 ( 1.233 -0.000 11.456) 11.523 5.205 ( 9.949 -0.000 -4.807) 11.049 5.451 ( 0.620 -0.000 -7.310) 7.336 5.684 ( 8.647 -0.000 4.416) 9.709 6.164 ( 5.127 -0.000 4.517) 6.833 6.281 ( 7.357 -0.000 -0.322) 7.364 6.796 ( -7.202 0.000 3.251) 7.902 6.952 ( -4.045 0.000 -8.638) 9.538 6.994 ( 1.009 -0.000 10.941) 10.987 7.450 ( 9.254 -0.000 -7.730) 12.058 7.614 ( -16.271 0.000 1.071) 16.306 7.763 ( -0.499 0.000 -1.162) 1.264 7.823 ( -1.526 0.000 -1.166) 1.921 7.949 ( 4.332 -0.000 -0.596) 4.373 7.984 ( 9.063 -0.000 -0.126) 9.064 8.101 ( -5.654 0.000 -3.845) 6.837 8.970 ( -4.685 0.000 -3.736) 5.992 9.104 ( -3.104 0.000 6.177) 6.913 9.534 ( 3.774 -0.000 -6.583) 7.588 9.658 ( 2.211 -0.000 -2.842) 3.601 9.979 ( 2.133 -0.000 -16.080) 16.221 10.003 ( 2.353 -0.000 2.176) 3.206 10.277 ( 1.873 -0.000 19.779) 19.867 10.291 ( 7.964 -0.000 -5.416) 9.631 10.413 ( 1.345 -0.000 0.324) 1.383 10.469 ( 3.171 -0.000 2.720) 4.178 10.823 ( -0.330 0.000 -5.169) 5.180 11.212 ( 9.194 -0.000 6.465) 11.240 11.419 ( -15.748 0.000 2.396) 15.929 11.860 ( -2.411 0.000 1.991) 3.127 12.260 ( -3.502 0.000 -1.006) 3.643 12.409 ( 0.144 -0.000 -0.630) 0.646 12.845 ( -15.729 0.000 7.092) 17.253 13.906 ( 11.560 -0.000 -10.976) 15.941 15.477 ( 0.797 -0.000 12.851) 12.876 15.684 ( 4.299 -0.000 -12.918) 13.614 16.413 ( -11.676 0.000 7.695) 13.984 16.648 ( 1.837 -0.000 -0.030) 1.837 ======================= Grid point 489 (243/282) ======================= q-point: (-0.30 -0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.026 ( -4.592 -0.715 -1.124) 4.782 3.191 ( 0.994 3.950 -7.952) 8.934 3.255 ( -4.816 -0.779 2.187) 5.347 3.266 ( 1.857 -2.321 -8.033) 8.566 3.761 ( -11.833 0.621 15.699) 19.668 3.900 ( 0.309 2.300 -0.377) 2.351 4.204 ( 10.051 -0.922 -15.474) 18.474 4.449 ( 6.198 2.509 -4.045) 7.815 4.613 ( 5.254 -3.826 -3.937) 7.599 4.788 ( 6.355 1.050 3.327) 7.250 5.208 ( -1.995 -1.347 19.311) 19.461 5.310 ( 12.715 4.388 -5.608) 14.573 5.418 ( 2.897 -3.633 -7.285) 8.641 5.874 ( 9.481 1.722 5.977) 11.339 6.259 ( 4.166 7.507 5.711) 10.312 6.441 ( 8.137 -3.347 3.879) 9.616 6.684 ( -1.201 10.765 4.043) 11.561 6.765 ( -3.814 5.175 -8.881) 10.964 7.144 ( -1.360 -9.144 5.452) 10.732 7.398 ( -4.590 1.520 -4.519) 6.618 7.554 ( 0.449 -14.491 -6.174) 15.758 7.723 ( -1.678 1.244 -2.396) 3.178 7.765 ( -3.038 0.613 -0.014) 3.099 7.924 ( -11.708 1.400 4.775) 12.721 8.026 ( 5.119 -2.501 -1.576) 5.912 8.220 ( 13.801 -3.022 2.082) 14.281 8.878 ( -4.149 -1.061 -2.014) 4.732 9.072 ( -5.956 -0.270 0.812) 6.017 9.549 ( 6.029 -1.667 -6.974) 9.368 9.656 ( 1.101 -1.746 -4.073) 4.566 9.870 ( 2.428 -2.463 -14.119) 14.537 10.049 ( 2.413 -0.558 0.949) 2.652 10.296 ( 3.698 5.331 -7.445) 9.876 10.425 ( 0.976 -2.447 4.840) 5.511 10.565 ( 4.683 1.858 17.581) 18.289 10.600 ( 6.455 -1.098 7.510) 9.964 10.838 ( 7.730 0.303 -1.773) 7.936 11.198 ( -15.964 1.954 4.480) 16.696 11.394 ( 6.410 1.910 4.732) 8.193 11.798 ( -7.820 -1.009 0.880) 7.934 12.218 ( -2.197 0.918 2.857) 3.720 12.393 ( -0.753 0.071 -1.825) 1.975 12.687 ( -11.461 -1.710 2.832) 11.929 13.893 ( 4.549 0.923 -15.145) 15.840 15.603 ( 4.379 2.993 -11.731) 12.874 15.632 ( 2.519 -0.278 11.267) 11.548 16.285 ( -15.701 1.664 10.010) 18.694 16.710 ( 5.563 2.076 1.570) 6.142 ======================= Grid point 490 (244/282) ======================= q-point: (-0.20 -0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 504 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.935 ( 0.631 1.430 -10.732) 10.845 3.029 ( -19.078 -1.129 -5.167) 19.798 3.140 ( -3.371 1.316 2.794) 4.572 3.267 ( -0.083 -3.851 -2.171) 4.421 3.749 ( -9.840 0.245 17.035) 19.674 3.852 ( -1.899 4.295 1.039) 4.810 4.234 ( 9.823 -1.384 -14.502) 17.570 4.427 ( 2.302 7.228 -4.713) 8.931 4.685 ( 5.380 -6.281 -6.866) 10.749 4.896 ( 7.059 4.297 -0.052) 8.265 5.331 ( -7.073 -5.498 15.278) 17.711 5.418 ( 1.242 -0.062 5.974) 6.102 5.437 ( 8.927 0.861 -10.016) 13.444 6.017 ( 5.726 7.677 4.892) 10.754 6.305 ( 3.573 6.947 4.417) 8.974 6.573 ( -1.940 1.750 -2.180) 3.403 6.616 ( 6.583 2.135 4.192) 8.091 6.787 ( 10.033 -1.017 0.213) 10.086 7.201 ( 0.342 -0.311 4.363) 4.387 7.286 ( -4.062 -7.193 -14.364) 16.571 7.523 ( -10.257 -8.476 0.305) 13.309 7.678 ( 1.107 3.369 -1.867) 4.008 7.776 ( 0.825 3.028 1.326) 3.407 7.856 ( -3.083 -6.626 7.941) 10.792 8.121 ( 6.472 -5.551 -2.790) 8.972 8.478 ( 12.551 -4.980 2.028) 13.655 8.815 ( -4.903 -0.383 0.854) 4.992 8.946 ( -7.753 0.393 -4.181) 8.817 9.589 ( 5.090 -3.659 -7.209) 9.553 9.635 ( -0.594 -0.527 -2.252) 2.388 9.831 ( 5.005 -4.061 -10.253) 12.111 10.098 ( 0.069 0.447 -0.747) 0.873 10.220 ( 4.464 6.067 -5.224) 9.167 10.515 ( 2.543 -3.303 3.988) 5.769 10.723 ( 8.506 5.224 1.207) 10.055 10.785 ( -1.068 1.111 15.892) 15.967 11.002 ( -9.298 2.291 7.195) 11.978 11.041 ( 11.695 -0.504 4.838) 12.666 11.437 ( -1.027 2.464 -1.305) 2.972 11.669 ( -10.755 -2.515 -0.245) 11.047 12.248 ( 1.165 2.141 5.476) 5.994 12.340 ( -3.833 4.383 2.996) 6.548 12.607 ( -4.512 -7.237 -1.123) 8.602 13.756 ( -0.363 1.061 -16.645) 16.683 15.523 ( 2.786 2.185 -10.389) 10.976 15.801 ( 3.664 -0.324 10.459) 11.087 16.130 ( -15.022 0.624 10.430) 18.299 16.786 ( 6.779 5.555 -0.527) 8.780 ======================= Grid point 491 (245/282) ======================= q-point: (-0.10 -0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.595 ( -24.235 -3.285 -7.456) 25.568 2.928 ( 3.443 -0.245 -3.961) 5.254 3.067 ( -14.892 0.121 11.826) 19.017 3.320 ( 5.059 -5.594 -1.398) 7.671 3.728 ( -6.420 4.628 5.167) 9.452 3.830 ( -3.536 2.524 8.143) 9.230 4.225 ( 6.574 -2.016 -14.400) 15.958 4.356 ( 1.047 8.763 -0.728) 8.856 4.728 ( 2.192 -3.977 -3.976) 6.036 4.919 ( 0.675 3.612 -0.884) 3.780 5.334 ( -23.869 -8.111 20.171) 32.286 5.416 ( 3.781 -3.143 -10.709) 11.784 5.521 ( 8.698 1.482 -1.747) 8.995 6.036 ( 1.453 10.758 4.055) 11.588 6.322 ( 1.571 1.293 -4.463) 4.905 6.543 ( 0.194 1.046 0.434) 1.149 6.759 ( 4.449 0.440 -0.473) 4.495 6.942 ( 8.363 -0.812 1.203) 8.488 7.117 ( -7.183 -5.049 -2.283) 9.072 7.297 ( 7.649 -1.098 1.801) 7.934 7.466 ( -3.804 -6.446 -2.170) 7.793 7.665 ( 3.239 6.913 0.487) 7.650 7.766 ( 2.182 -2.242 -4.728) 5.669 8.019 ( 5.979 -2.275 7.925) 10.185 8.254 ( 7.242 -6.684 -1.459) 9.963 8.641 ( -2.507 0.686 -2.128) 3.359 8.731 ( -3.857 -1.600 2.538) 4.887 8.822 ( -1.653 -2.932 -2.971) 4.490 9.595 ( 0.777 -0.029 -3.361) 3.450 9.642 ( 2.043 -4.523 -1.439) 5.167 9.863 ( 6.530 -2.216 -8.114) 10.649 9.964 ( -3.477 7.767 -7.051) 11.052 10.310 ( 8.055 0.296 2.029) 8.312 10.617 ( 1.679 -1.114 4.620) 5.040 10.704 ( -7.804 7.286 6.085) 12.289 10.861 ( 5.451 3.826 0.939) 6.725 11.009 ( 3.199 -3.041 3.101) 5.395 11.306 ( -0.304 1.167 2.037) 2.367 11.333 ( 1.327 -3.321 1.684) 3.953 11.556 ( -3.399 0.237 2.125) 4.016 12.210 ( -1.281 4.309 -3.860) 5.926 12.368 ( -0.845 3.762 10.340) 11.035 12.627 ( -1.913 -8.577 2.818) 9.228 13.563 ( -2.690 0.822 -15.599) 15.850 15.424 ( -6.025 2.457 -3.198) 7.251 15.903 ( 2.652 0.949 2.087) 3.506 16.120 ( -2.897 -7.187 11.474) 13.846 16.804 ( 5.854 8.054 -5.234) 11.249 ======================= Grid point 499 (246/282) ======================= q-point: (-0.30 -0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.945 ( -2.255 0.000 -2.882) 3.659 3.018 ( -21.137 0.000 -7.479) 22.421 3.162 ( 7.145 -0.000 -10.703) 12.869 3.229 ( -7.716 0.000 6.266) 9.940 3.750 ( -10.184 0.000 17.926) 20.616 3.888 ( -2.021 0.000 1.089) 2.296 4.221 ( 10.479 -0.000 -15.708) 18.883 4.498 ( 4.723 -0.000 -6.159) 7.761 4.617 ( 3.838 -0.000 -4.910) 6.232 4.935 ( 10.626 -0.000 -2.765) 10.980 5.276 ( -12.848 0.000 16.658) 21.037 5.402 ( -0.980 0.000 3.187) 3.334 5.468 ( 13.600 -0.000 -8.352) 15.960 6.077 ( 8.063 -0.000 5.260) 9.627 6.368 ( -0.022 0.000 3.828) 3.828 6.598 ( -8.875 0.000 2.743) 9.289 6.618 ( 9.137 -0.000 6.535) 11.233 6.804 ( 7.851 -0.000 -1.235) 7.947 7.128 ( 1.486 -0.000 -8.112) 8.247 7.357 ( -3.785 0.000 -9.428) 10.159 7.362 ( -3.934 0.000 3.440) 5.226 7.702 ( 1.691 -0.000 -2.485) 3.005 7.797 ( -3.101 0.000 0.254) 3.111 7.816 ( -1.886 0.000 10.407) 10.577 8.079 ( 5.970 -0.000 -2.100) 6.328 8.439 ( 12.988 -0.000 1.999) 13.141 8.813 ( -4.394 0.000 2.081) 4.862 8.950 ( -8.702 0.000 -2.977) 9.197 9.561 ( 5.017 -0.000 -7.527) 9.046 9.628 ( 0.581 -0.000 -2.987) 3.043 9.802 ( 7.213 -0.000 -11.319) 13.421 10.090 ( 2.270 -0.000 -0.643) 2.360 10.284 ( 4.130 -0.000 -8.851) 9.767 10.479 ( 1.359 -0.000 4.878) 5.064 10.771 ( 9.324 -0.000 3.128) 9.834 10.790 ( -0.435 0.000 17.484) 17.489 11.026 ( -13.764 0.000 6.028) 15.026 11.030 ( 14.002 -0.000 5.367) 14.995 11.458 ( -2.299 0.000 -1.486) 2.738 11.647 ( -10.389 0.000 -0.394) 10.396 12.267 ( 1.061 -0.000 7.568) 7.642 12.378 ( 0.934 -0.000 -2.777) 2.930 12.545 ( -8.733 0.000 2.714) 9.145 13.764 ( -0.636 0.000 -16.755) 16.767 15.541 ( 2.255 -0.000 -11.177) 11.402 15.798 ( 3.714 -0.000 11.308) 11.903 16.135 ( -16.849 0.000 9.299) 19.245 16.829 ( 7.130 -0.000 -0.346) 7.139 ======================= Grid point 500 (247/282) ======================= q-point: (-0.20 -0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.560 ( -27.874 -1.205 -6.705) 28.695 2.908 ( -5.277 -1.211 5.671) 7.840 3.110 ( -9.476 3.546 3.434) 10.685 3.241 ( 7.477 -4.094 -2.284) 8.825 3.769 ( -7.833 0.996 12.530) 14.811 3.871 ( -1.873 1.992 2.419) 3.651 4.192 ( 5.294 -1.410 -15.219) 16.175 4.473 ( 1.885 5.750 -3.024) 6.765 4.639 ( 1.469 -5.526 -4.354) 7.187 5.012 ( 5.233 6.307 -4.251) 9.233 5.194 ( -22.870 -7.648 18.495) 30.391 5.385 ( -2.334 -1.272 -1.290) 2.955 5.556 ( 9.696 1.691 -8.320) 12.888 6.177 ( 2.926 5.611 1.696) 6.551 6.334 ( -4.128 0.161 -2.286) 4.721 6.591 ( -0.148 4.206 7.804) 8.867 6.753 ( -2.313 -1.230 -1.162) 2.866 6.941 ( 10.774 1.196 0.513) 10.853 7.022 ( -2.200 -5.944 -2.326) 6.751 7.290 ( 4.453 0.087 -1.371) 4.660 7.379 ( -0.151 -4.046 -1.194) 4.221 7.721 ( 0.131 -1.758 -6.103) 6.353 7.738 ( 5.824 2.242 -0.644) 6.273 8.010 ( 8.428 0.060 10.742) 13.654 8.185 ( 7.874 -2.274 1.236) 8.289 8.627 ( 7.693 -1.389 1.197) 7.908 8.742 ( -9.505 2.670 -0.451) 9.883 8.786 ( -7.023 -2.514 0.662) 7.488 9.558 ( 3.437 -2.080 -6.396) 7.553 9.615 ( -0.528 -0.716 -0.241) 0.922 9.854 ( 11.574 0.441 -9.254) 14.825 10.042 ( -3.311 2.123 -6.040) 7.208 10.332 ( 11.787 2.362 -3.789) 12.604 10.552 ( 0.889 -4.208 2.892) 5.183 10.814 ( -11.016 4.502 9.064) 14.959 10.911 ( 1.161 0.803 7.003) 7.143 11.001 ( 7.532 2.373 0.663) 7.925 11.259 ( 3.377 -4.473 3.755) 6.746 11.318 ( -10.669 0.127 -3.512) 11.233 11.571 ( 3.052 1.021 5.182) 6.100 12.278 ( -0.674 4.174 -6.870) 8.067 12.376 ( 0.063 -2.528 -0.840) 2.665 12.549 ( -3.266 -1.597 16.620) 17.013 13.570 ( -3.102 0.203 -15.890) 16.191 15.451 ( -4.114 0.961 -4.966) 6.521 15.936 ( 0.731 3.269 5.862) 6.751 16.018 ( -6.022 -5.645 7.549) 11.185 16.888 ( 5.227 2.865 -5.669) 8.226 ======================= Grid point 501 (248/282) ======================= q-point: (-0.10 -0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.136 ( -26.791 -4.831 3.452) 27.441 2.872 ( -21.176 -4.663 20.916) 30.128 3.023 ( 3.843 2.690 -2.885) 5.507 3.397 ( 6.630 -3.000 4.520) 8.566 3.711 ( -5.122 6.634 0.670) 8.408 3.846 ( -4.034 0.386 4.289) 5.901 4.128 ( 1.877 -4.923 -12.539) 13.601 4.436 ( -1.637 5.957 4.266) 7.508 4.634 ( -3.841 -8.059 -4.725) 10.101 4.897 ( -18.146 4.367 15.535) 24.283 5.113 ( -9.088 -3.896 3.545) 10.504 5.351 ( 3.142 -2.135 -9.621) 10.344 5.577 ( 4.822 -0.165 -8.562) 9.828 6.134 ( -0.852 8.086 -1.459) 8.260 6.219 ( -6.888 -0.173 -5.518) 8.827 6.475 ( -12.789 -0.129 -6.202) 14.214 6.641 ( -7.465 1.825 3.243) 8.341 7.112 ( 2.176 -8.399 7.277) 11.325 7.168 ( 11.124 0.211 1.594) 11.240 7.374 ( 8.098 0.793 -4.277) 9.193 7.455 ( 10.277 -2.708 -0.324) 10.633 7.711 ( 7.844 -2.213 -11.473) 14.073 7.812 ( 7.304 5.678 0.711) 9.279 8.224 ( 7.406 1.908 7.710) 10.859 8.364 ( 6.997 0.473 5.276) 8.776 8.522 ( -7.989 1.699 -1.784) 8.360 8.665 ( -9.768 -0.329 4.425) 10.728 8.803 ( 3.422 -4.559 0.048) 5.701 9.587 ( 2.474 -1.763 -1.901) 3.584 9.622 ( 0.227 -3.868 0.702) 3.938 9.854 ( -1.732 6.471 -7.759) 10.251 9.972 ( 10.338 1.760 -7.545) 12.919 10.450 ( 6.550 2.227 -1.262) 7.032 10.614 ( -0.536 -4.933 -2.003) 5.351 10.702 ( -9.233 5.482 11.500) 15.734 10.940 ( 2.527 1.118 -3.637) 4.568 11.025 ( -3.218 -1.972 -4.718) 6.042 11.162 ( -3.096 1.603 2.022) 4.030 11.346 ( 3.223 -6.212 -0.805) 7.044 11.777 ( 13.277 6.813 7.523) 16.712 12.159 ( -1.381 -0.075 -5.911) 6.071 12.357 ( -2.931 -3.704 -2.953) 5.570 12.708 ( -1.302 1.818 19.231) 19.361 13.376 ( -3.838 -0.520 -12.190) 12.791 15.286 ( -13.307 2.174 1.747) 13.597 15.954 ( 4.681 -0.868 -1.431) 4.971 16.152 ( 2.443 -7.335 6.833) 10.318 16.821 ( 0.987 3.508 -12.685) 13.198 ======================= Grid point 510 (249/282) ======================= q-point: (-0.20 -0.20 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.099 ( -28.040 0.000 3.919) 28.313 2.837 ( -21.720 0.000 21.344) 30.453 3.047 ( 1.933 -0.000 -3.019) 3.584 3.370 ( 7.860 -0.000 4.527) 9.070 3.765 ( -5.885 0.000 7.337) 9.405 3.850 ( -2.199 0.000 -2.392) 3.250 4.086 ( -0.786 0.000 -11.528) 11.555 4.502 ( -0.755 0.000 2.224) 2.349 4.546 ( -8.159 0.000 -0.989) 8.219 4.935 ( -30.229 0.000 26.546) 40.230 5.085 ( 8.671 -0.000 -12.457) 15.178 5.329 ( 0.870 -0.000 -6.584) 6.641 5.580 ( 5.518 -0.000 -11.138) 12.430 6.195 ( -0.599 0.000 -5.974) 6.004 6.219 ( -6.750 0.000 -2.736) 7.284 6.474 ( -18.596 0.000 -5.873) 19.502 6.690 ( -3.054 0.000 7.929) 8.497 6.997 ( -5.589 0.000 4.193) 6.986 7.180 ( 15.835 -0.000 2.452) 16.023 7.402 ( 13.347 -0.000 -0.493) 13.357 7.415 ( 8.043 -0.000 -3.624) 8.822 7.692 ( 9.341 -0.000 -12.167) 15.339 7.860 ( 7.947 -0.000 0.801) 7.988 8.238 ( 7.228 -0.000 9.265) 11.751 8.359 ( 9.945 -0.000 7.635) 12.538 8.549 ( -11.243 0.000 -3.251) 11.703 8.659 ( -8.814 0.000 4.029) 9.691 8.764 ( 2.621 -0.000 2.743) 3.794 9.557 ( 4.979 -0.000 -4.653) 6.815 9.604 ( -1.704 0.000 2.057) 2.671 9.929 ( -3.893 0.000 -6.858) 7.887 9.967 ( 13.683 -0.000 -9.271) 16.528 10.512 ( -5.418 0.000 0.084) 5.418 10.524 ( 14.851 -0.000 -4.013) 15.383 10.743 ( -10.734 0.000 10.235) 14.832 10.945 ( -0.940 0.000 0.666) 1.152 11.020 ( -8.860 0.000 -6.493) 10.985 11.195 ( -4.883 0.000 1.139) 5.014 11.277 ( 11.658 -0.000 0.508) 11.670 11.841 ( 15.682 -0.000 9.754) 18.468 12.152 ( -3.823 0.000 -12.160) 12.747 12.320 ( -2.926 0.000 -1.927) 3.504 12.729 ( -1.459 0.000 22.322) 22.370 13.371 ( -4.130 0.000 -13.187) 13.819 15.304 ( -13.147 0.000 1.091) 13.192 15.951 ( 2.464 -0.000 -0.670) 2.553 16.089 ( 3.996 -0.000 5.859) 7.092 16.848 ( -0.420 0.000 -13.256) 13.263 ======================= Grid point 511 (250/282) ======================= q-point: (-0.10 -0.20 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.857 ( -19.064 -2.918 19.703) 27.571 2.718 ( -23.298 -2.839 24.882) 34.205 3.100 ( 4.507 0.161 2.448) 5.131 3.496 ( -0.580 -0.884 5.214) 5.320 3.708 ( -2.226 7.943 -2.138) 8.521 3.791 ( -6.411 -3.544 2.149) 7.634 3.994 ( -0.544 -5.284 -3.182) 6.192 4.365 ( -13.456 -2.844 -0.225) 13.755 4.511 ( -5.616 -0.246 7.960) 9.745 4.816 ( -18.479 0.426 23.430) 29.843 5.042 ( 2.494 2.399 -12.979) 13.432 5.286 ( 3.092 -2.325 -9.988) 10.711 5.517 ( 2.149 -0.095 -13.175) 13.349 6.037 ( -8.937 2.929 -8.348) 12.575 6.091 ( -4.230 0.631 -5.114) 6.666 6.211 ( -9.759 -2.496 -2.706) 10.430 6.614 ( -7.761 8.723 1.568) 11.781 6.940 ( -9.686 -11.827 -1.887) 15.404 7.433 ( 14.539 3.248 2.192) 15.058 7.522 ( 12.535 1.253 -5.076) 13.582 7.624 ( 12.329 -1.997 0.600) 12.504 7.759 ( 14.067 -1.014 -11.860) 18.427 7.974 ( 6.693 4.517 2.360) 8.412 8.341 ( -9.401 2.996 -2.128) 10.094 8.373 ( 1.109 1.504 4.383) 4.765 8.530 ( -10.924 -0.709 3.943) 11.636 8.632 ( 10.076 -1.111 11.837) 15.584 8.831 ( 1.304 -1.302 2.854) 3.397 9.604 ( -1.604 0.163 4.419) 4.704 9.624 ( 5.376 -2.933 -2.033) 6.453 9.791 ( -3.784 4.374 -4.815) 7.525 10.072 ( 11.338 -1.196 -10.026) 15.182 10.404 ( -6.317 -1.537 -1.709) 6.723 10.571 ( -4.831 2.416 -1.773) 5.685 10.704 ( -9.580 2.028 9.564) 13.688 10.920 ( 0.658 -0.297 -5.608) 5.654 10.962 ( 13.591 -3.441 -6.344) 15.388 11.152 ( -2.089 -1.659 -0.093) 2.669 11.438 ( 9.203 4.098 -4.972) 11.234 11.977 ( 1.271 4.161 -5.462) 6.983 12.191 ( 13.288 -2.876 6.737) 15.173 12.237 ( -5.942 -2.764 -2.663) 7.073 12.889 ( -3.758 3.523 19.511) 20.180 13.206 ( -4.108 -2.272 -7.868) 9.162 15.104 ( -14.607 0.547 3.596) 15.054 16.029 ( 8.228 -0.045 -2.189) 8.514 16.203 ( 2.963 -3.732 3.050) 5.657 16.621 ( -7.579 -1.044 -19.340) 20.798 ======================= Grid point 521 (251/282) ======================= q-point: (-0.10 -0.10 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.914 ( -5.579 0.000 30.528) 31.034 2.638 ( -19.025 0.000 27.552) 33.482 3.205 ( 4.051 -0.000 5.491) 6.824 3.457 ( -7.117 0.000 0.896) 7.173 3.647 ( -14.860 0.000 11.018) 18.499 3.650 ( -1.373 0.000 -10.187) 10.279 4.064 ( 2.736 -0.000 7.717) 8.188 4.191 ( 0.518 -0.000 -5.394) 5.419 4.486 ( -11.486 0.000 11.886) 16.529 4.785 ( -17.715 0.000 24.818) 30.492 4.908 ( -1.364 0.000 -17.609) 17.662 5.230 ( 4.578 -0.000 -10.473) 11.430 5.401 ( 0.894 -0.000 -14.778) 14.806 5.876 ( -2.794 0.000 -6.316) 6.907 5.986 ( -3.553 0.000 -2.805) 4.527 6.082 ( -1.798 0.000 -5.913) 6.181 6.516 ( -10.898 0.000 -1.222) 10.966 6.693 ( -8.261 0.000 -9.002) 12.218 7.650 ( 9.920 -0.000 0.146) 9.921 7.656 ( 11.490 -0.000 -5.772) 12.858 7.771 ( 9.450 -0.000 -2.764) 9.846 7.843 ( 9.686 -0.000 -8.885) 13.144 8.118 ( 4.068 -0.000 4.653) 6.180 8.215 ( -3.813 0.000 -3.572) 5.224 8.313 ( -9.189 0.000 -0.685) 9.215 8.461 ( -3.300 0.000 3.265) 4.642 8.874 ( -0.321 0.000 5.210) 5.220 8.903 ( 8.004 -0.000 13.310) 15.531 9.630 ( -3.487 0.000 8.664) 9.340 9.691 ( 6.448 -0.000 -2.361) 6.867 9.706 ( -4.932 0.000 -1.497) 5.154 10.044 ( 0.211 -0.000 -9.647) 9.649 10.377 ( 5.084 -0.000 -1.319) 5.252 10.455 ( -8.061 0.000 0.656) 8.088 10.681 ( -4.503 0.000 6.737) 8.103 10.870 ( 1.556 -0.000 -8.381) 8.524 11.090 ( -2.634 0.000 -2.763) 3.818 11.156 ( 17.049 -0.000 -7.729) 18.719 11.447 ( 1.531 -0.000 -11.711) 11.811 12.040 ( 10.243 -0.000 1.133) 10.305 12.074 ( -9.421 0.000 -4.212) 10.319 12.451 ( 9.497 -0.000 6.637) 11.586 13.004 ( -8.514 0.000 18.783) 20.623 13.083 ( -0.293 0.000 -5.557) 5.565 14.954 ( -9.847 0.000 4.484) 10.820 16.148 ( 8.839 -0.000 -1.694) 9.000 16.168 ( -9.904 0.000 -14.620) 17.659 16.306 ( -3.179 0.000 -5.545) 6.392 ======================= Grid point 522 (252/282) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 141 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.983 ( -5.586 0.000 -7.170) 9.089 2.983 ( 5.586 -0.000 7.170) 9.089 3.277 ( 2.536 -0.000 -3.838) 4.600 3.277 ( -2.536 0.000 3.838) 4.600 3.545 ( 7.146 -0.000 -12.743) 14.610 3.545 ( -7.146 0.000 12.743) 14.610 3.979 ( 1.357 -0.000 -11.411) 11.492 3.979 ( -1.357 0.000 11.411) 11.492 4.731 ( 4.061 -0.000 -8.527) 9.444 4.731 ( -4.061 0.000 8.527) 9.444 4.912 ( 11.608 -0.000 -6.969) 13.540 4.912 ( -11.608 0.000 6.969) 13.540 5.651 ( 12.200 -0.000 -30.830) 33.156 5.651 ( -12.200 0.000 30.830) 33.156 5.916 ( 0.402 -0.000 -0.142) 0.426 5.916 ( -0.402 0.000 0.142) 0.426 6.097 ( -3.917 0.000 -0.014) 3.917 6.097 ( 3.917 -0.000 0.014) 3.917 7.731 ( -4.502 0.000 0.755) 4.565 7.731 ( 4.502 -0.000 -0.755) 4.565 7.806 ( -0.356 0.000 -1.704) 1.741 7.806 ( 0.356 -0.000 1.704) 1.741 8.057 ( -0.575 0.000 -0.608) 0.837 8.057 ( 0.575 -0.000 0.608) 0.837 8.378 ( -4.265 0.000 -0.747) 4.329 8.378 ( 4.265 -0.000 0.747) 4.329 9.133 ( -0.695 0.000 -5.214) 5.260 9.133 ( 0.695 -0.000 5.214) 5.260 9.707 ( 2.805 -0.000 -5.910) 6.542 9.707 ( -2.805 0.000 5.910) 6.542 9.913 ( 1.610 -0.000 -3.015) 3.418 9.913 ( -1.610 0.000 3.015) 3.418 10.445 ( 6.157 -0.000 -7.100) 9.398 10.445 ( -6.157 0.000 7.100) 9.398 10.706 ( -2.964 0.000 -0.914) 3.101 10.706 ( 2.964 -0.000 0.914) 3.101 10.861 ( -0.300 0.000 0.001) 0.300 10.861 ( 0.300 -0.000 -0.001) 0.300 11.582 ( -15.155 0.000 1.696) 15.250 11.582 ( 15.155 -0.000 -1.696) 15.250 12.475 ( -11.481 0.000 0.436) 11.489 12.475 ( 11.481 -0.000 -0.436) 11.489 13.185 ( 14.501 -0.000 -8.269) 16.693 13.185 ( -14.501 0.000 8.269) 16.693 15.166 ( -4.767 0.000 -11.805) 12.731 15.166 ( 4.767 -0.000 11.805) 12.731 16.288 ( -3.439 0.000 0.972) 3.573 16.288 ( 3.439 -0.000 -0.972) 3.573 ======================= Grid point 524 (253/282) ======================= q-point: ( 0.10 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.787 ( -1.274 -2.229 -23.113) 23.256 3.092 ( 9.064 -2.790 -9.310) 13.289 3.280 ( -0.488 1.864 2.847) 3.438 3.310 ( 1.306 -1.612 3.610) 4.164 3.475 ( 0.592 6.793 -3.799) 7.805 3.611 ( -1.785 -7.763 7.771) 11.128 4.017 ( 12.452 -2.140 -6.998) 14.443 4.214 ( 10.606 -4.814 13.196) 17.601 4.586 ( -7.688 1.757 -12.645) 14.903 4.747 ( -0.983 -1.959 0.856) 2.352 4.883 ( -3.671 -0.141 13.192) 13.694 4.999 ( 0.484 0.642 4.736) 4.804 5.541 ( 15.542 -0.832 -33.825) 37.234 5.732 ( -7.507 -0.871 13.853) 15.781 5.860 ( 0.255 6.815 1.640) 7.014 5.946 ( 1.728 -3.212 1.158) 3.826 6.165 ( 7.228 4.637 7.322) 11.286 6.281 ( 10.942 -5.791 6.141) 13.819 7.662 ( -7.193 -0.120 2.410) 7.587 7.738 ( -4.927 1.411 -0.427) 5.143 7.780 ( -6.108 -0.275 2.377) 6.560 7.794 ( 0.773 -3.063 0.940) 3.296 8.078 ( 3.361 1.431 0.855) 3.752 8.116 ( 6.133 1.808 2.032) 6.709 8.283 ( -4.736 3.415 -2.236) 6.252 8.437 ( 3.583 1.499 0.804) 3.967 9.070 ( -0.330 -0.213 -6.503) 6.515 9.182 ( 0.279 -0.714 0.927) 1.203 9.702 ( 2.829 1.126 -4.386) 5.339 9.730 ( 0.298 -2.572 0.663) 2.672 9.880 ( 1.653 0.635 -6.906) 7.129 9.914 ( -2.303 -2.877 1.673) 4.047 10.385 ( -4.651 5.151 2.268) 7.301 10.452 ( 3.434 2.819 -4.081) 6.032 10.639 ( -4.035 3.078 4.211) 6.595 10.723 ( -1.323 0.126 1.365) 1.905 10.912 ( 3.570 2.195 5.656) 7.040 10.936 ( 3.640 -0.340 5.706) 6.777 11.375 ( -16.924 -2.384 4.076) 17.570 11.793 ( 11.470 -1.425 1.907) 11.714 12.284 ( -13.200 -0.508 -0.575) 13.222 12.592 ( 3.865 1.073 -0.850) 4.101 13.056 ( -9.604 -0.039 3.899) 10.365 13.317 ( 14.521 -2.307 -12.195) 19.103 15.049 ( 1.508 -1.862 -8.592) 8.920 15.419 ( 9.826 -0.779 16.040) 18.827 16.233 ( -6.786 -3.181 1.485) 7.641 16.319 ( 0.448 -2.679 -0.538) 2.769 ======================= Grid point 525 (254/282) ======================= q-point: ( 0.20 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.556 ( 3.565 -2.869 -29.543) 29.895 3.138 ( 9.100 -4.703 -14.187) 17.499 3.281 ( -0.528 2.084 0.801) 2.295 3.404 ( 6.662 -1.351 -2.725) 7.323 3.436 ( -0.149 3.976 6.716) 7.806 3.729 ( -2.104 -9.931 8.023) 12.939 4.217 ( 16.349 -3.041 -4.194) 17.150 4.280 ( -11.975 1.360 -10.150) 15.756 4.549 ( 8.931 -2.079 11.346) 14.588 4.737 ( 5.851 1.974 -7.801) 9.949 5.003 ( -5.316 -1.501 11.177) 12.467 5.068 ( 0.371 -5.202 16.462) 17.268 5.484 ( 18.684 -1.256 -32.283) 37.321 5.738 ( 0.318 2.207 4.039) 4.614 5.895 ( 4.220 2.907 3.749) 6.350 6.041 ( 5.237 -3.371 2.312) 6.644 6.322 ( 10.663 7.208 5.071) 13.834 6.596 ( 12.863 -6.238 10.697) 17.855 7.549 ( -11.968 0.381 4.469) 12.780 7.615 ( -9.386 1.387 -0.361) 9.495 7.693 ( -8.770 -1.556 2.619) 9.284 7.812 ( -6.193 -5.867 2.455) 8.877 8.104 ( -5.163 8.136 -2.213) 9.887 8.148 ( 7.543 5.591 -0.535) 9.405 8.268 ( 9.877 3.267 1.245) 10.477 8.487 ( 3.449 1.744 1.472) 4.136 8.992 ( -1.078 1.320 -6.567) 6.785 9.126 ( -4.083 0.490 -8.179) 9.155 9.664 ( 1.059 3.058 -4.426) 5.483 9.761 ( 1.414 -3.571 -3.077) 4.921 9.840 ( 2.060 -1.716 -9.324) 9.702 9.938 ( -4.539 -4.645 7.229) 9.718 10.311 ( -0.223 4.383 0.946) 4.490 10.435 ( 3.091 7.459 0.037) 8.074 10.646 ( -1.030 2.488 7.848) 8.297 10.720 ( -0.898 0.195 3.097) 3.230 10.999 ( -0.955 3.626 9.228) 9.960 11.054 ( 2.562 -4.910 3.398) 6.498 11.209 ( -10.356 -0.552 5.583) 11.778 11.958 ( 2.908 1.582 4.060) 5.239 12.115 ( -6.947 -4.583 -0.290) 8.327 12.529 ( -9.561 0.452 -1.230) 9.650 12.988 ( -0.270 4.271 -0.190) 4.283 13.408 ( 11.373 -4.716 -15.482) 19.781 15.070 ( 8.174 -3.053 -6.423) 10.835 15.751 ( 10.211 2.303 17.935) 20.767 16.180 ( -8.014 -8.274 4.209) 12.263 16.339 ( -1.262 -5.478 -0.214) 5.625 ======================= Grid point 526 (255/282) ======================= q-point: ( 0.30 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.405 ( 10.242 -4.534 -26.679) 28.935 3.137 ( -2.357 -2.525 -6.140) 7.045 3.261 ( 6.811 -1.707 -10.571) 12.691 3.436 ( 3.410 7.665 2.565) 8.773 3.553 ( 5.624 -3.012 2.249) 6.765 3.847 ( -1.917 -7.065 7.514) 10.490 3.993 ( -14.568 -4.951 -3.706) 15.827 4.421 ( 6.326 3.912 2.411) 7.819 4.640 ( 6.431 1.349 -6.738) 9.412 4.872 ( 12.421 -3.434 -1.326) 12.955 5.029 ( -4.375 2.649 13.428) 14.369 5.297 ( 0.316 -10.145 11.392) 15.258 5.508 ( 20.938 -3.381 -26.670) 34.075 5.834 ( 7.152 2.624 7.802) 10.904 5.986 ( 6.824 2.266 0.780) 7.233 6.197 ( 9.136 -2.457 2.609) 9.814 6.474 ( 11.588 4.972 1.382) 12.685 6.940 ( 11.528 -2.344 11.945) 16.765 7.393 ( -14.485 1.091 6.755) 16.020 7.440 ( -10.446 -2.340 -2.796) 11.064 7.610 ( -8.048 -4.111 2.884) 9.487 7.707 ( -14.220 -3.287 -0.320) 14.599 7.912 ( -5.593 10.106 -2.877) 11.903 8.236 ( 9.074 7.251 0.559) 11.628 8.355 ( 3.710 7.148 -0.714) 8.085 8.569 ( 8.933 2.700 0.583) 9.350 8.881 ( -5.735 1.330 -8.477) 10.321 8.931 ( -4.348 0.121 -8.959) 9.959 9.631 ( 1.649 2.226 -2.523) 3.747 9.757 ( -0.679 -2.980 -4.513) 5.450 9.783 ( 0.400 -2.259 -7.464) 7.809 9.916 ( -8.157 0.643 4.932) 9.554 10.391 ( 6.149 -3.888 3.451) 8.052 10.434 ( 1.245 9.158 6.080) 11.063 10.687 ( 2.398 5.639 3.040) 6.840 10.782 ( 1.065 -3.300 7.597) 8.351 10.966 ( -10.539 -7.265 3.196) 13.193 11.122 ( 2.257 4.980 5.435) 7.709 11.247 ( 3.273 -2.512 4.711) 6.262 11.891 ( -7.815 0.911 1.386) 7.989 12.191 ( 4.290 -1.467 3.021) 5.448 12.333 ( -13.379 -3.717 -0.366) 13.890 12.941 ( 1.593 9.016 -2.338) 9.450 13.423 ( 6.161 -5.177 -16.185) 18.075 15.195 ( 12.233 -2.122 -5.585) 13.615 15.923 ( -2.256 2.437 8.066) 8.723 16.285 ( 0.538 -7.023 15.794) 17.293 16.366 ( -1.023 -8.339 -1.186) 8.485 ======================= Grid point 527 (256/282) ======================= q-point: ( 0.40 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.431 ( 14.916 -6.092 -16.112) 22.786 2.982 ( -10.988 2.042 -2.696) 11.497 3.303 ( 7.109 -3.269 -8.620) 11.642 3.428 ( 1.106 10.216 2.871) 10.670 3.620 ( -0.642 -4.954 -4.500) 6.724 3.866 ( 0.929 -3.533 2.839) 4.627 3.978 ( -4.099 -7.919 7.805) 11.850 4.365 ( -5.274 7.880 0.836) 9.519 4.712 ( 7.988 -0.208 -5.009) 9.431 4.995 ( -0.072 -1.161 4.395) 4.546 5.108 ( 4.642 -0.249 0.884) 4.732 5.445 ( 3.876 -4.188 3.379) 6.632 5.636 ( 13.686 -6.842 -12.242) 19.596 6.009 ( 3.595 1.856 9.309) 10.150 6.067 ( 8.368 2.925 -2.981) 9.353 6.394 ( 10.287 -1.418 2.495) 10.680 6.631 ( 9.691 -0.007 1.615) 9.824 7.062 ( -5.697 7.297 4.634) 10.353 7.245 ( -9.433 1.818 2.703) 9.980 7.412 ( 2.690 -11.410 -1.986) 11.890 7.462 ( -14.455 1.115 1.375) 14.563 7.616 ( -0.434 -6.963 4.009) 8.047 7.730 ( -6.797 7.395 -1.697) 10.186 8.238 ( -4.232 8.603 -0.782) 9.619 8.323 ( 6.848 9.183 -2.360) 11.696 8.635 ( -3.669 -1.196 -5.961) 7.101 8.730 ( 6.715 1.689 -4.360) 8.183 8.854 ( -3.134 -1.275 -0.773) 3.471 9.609 ( -1.232 1.939 -0.490) 2.349 9.718 ( 1.247 2.823 -1.744) 3.545 9.758 ( -0.820 -6.134 -4.187) 7.471 9.834 ( -4.039 0.824 0.241) 4.129 10.402 ( -4.441 1.038 4.758) 6.591 10.570 ( 5.026 1.699 5.597) 7.712 10.686 ( 3.591 6.135 -1.534) 7.273 10.881 ( -8.807 -7.153 8.470) 14.159 10.959 ( 7.580 -0.524 -0.471) 7.612 11.198 ( 3.925 -2.287 3.459) 5.710 11.352 ( 2.891 -2.236 2.989) 4.721 11.747 ( -10.648 4.069 -0.513) 11.410 12.151 ( -3.827 -1.821 -1.503) 4.497 12.351 ( 0.707 -4.966 5.345) 7.330 12.858 ( 0.534 9.229 -2.350) 9.538 13.374 ( 1.816 -3.443 -11.467) 12.109 15.323 ( 9.048 0.026 -4.474) 10.094 15.916 ( -4.174 -1.544 4.239) 6.146 16.401 ( -1.217 -5.679 1.416) 5.978 16.487 ( 1.990 -2.205 9.775) 10.216 ======================= Grid point 528 (257/282) ======================= q-point: (-0.50 0.00 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.545 ( -0.000 0.000 0.000) 0.000 2.820 ( 0.000 -0.000 -0.000) 0.000 3.330 ( -0.000 0.000 0.000) 0.000 3.404 ( -0.000 -0.000 -0.000) 0.000 3.600 ( 0.000 0.000 -0.000) 0.000 3.946 ( -0.000 -0.000 0.000) 0.000 4.015 ( 0.000 0.000 -0.000) 0.000 4.273 ( 0.000 -0.000 -0.000) 0.000 4.749 ( 0.000 0.000 -0.000) 0.000 5.018 ( 0.000 -0.000 0.000) 0.000 5.145 ( 0.000 -0.000 -0.000) 0.000 5.519 ( -0.000 -0.000 0.000) 0.000 5.719 ( 0.000 0.000 0.000) 0.000 6.060 ( -0.000 0.000 0.000) 0.000 6.121 ( 0.000 -0.000 -0.000) 0.000 6.508 ( 0.000 -0.000 -0.000) 0.000 6.754 ( 0.000 -0.000 -0.000) 0.000 6.970 ( 0.000 -0.000 -0.000) 0.000 7.135 ( 0.000 -0.000 0.000) 0.000 7.351 ( 0.000 -0.000 -0.000) 0.000 7.508 ( 0.000 -0.000 -0.000) 0.000 7.590 ( 0.000 -0.000 0.000) 0.000 7.728 ( 0.000 -0.000 -0.000) 0.000 8.124 ( 0.000 -0.000 -0.000) 0.000 8.321 ( 0.000 -0.000 -0.000) 0.000 8.564 ( 0.000 -0.000 0.000) 0.000 8.788 ( 0.000 -0.000 -0.000) 0.000 8.821 ( 0.000 -0.000 -0.000) 0.000 9.579 ( 0.000 -0.000 -0.000) 0.000 9.714 ( 0.000 0.000 0.000) 0.000 9.759 ( 0.000 -0.000 -0.000) 0.000 9.800 ( 0.000 -0.000 -0.000) 0.000 10.387 ( 0.000 -0.000 -0.000) 0.000 10.603 ( 0.000 -0.000 -0.000) 0.000 10.701 ( 0.000 -0.000 -0.000) 0.000 10.871 ( 0.000 0.000 -0.000) 0.000 11.042 ( 0.000 -0.000 -0.000) 0.000 11.281 ( 0.000 -0.000 -0.000) 0.000 11.436 ( 0.000 -0.000 -0.000) 0.000 11.571 ( 0.000 -0.000 -0.000) 0.000 12.135 ( 0.000 -0.000 -0.000) 0.000 12.409 ( 0.000 -0.000 -0.000) 0.000 12.807 ( 0.000 -0.000 -0.000) 0.000 13.339 ( 0.000 -0.000 0.000) 0.000 15.369 ( 0.000 -0.000 0.000) 0.000 15.913 ( 0.000 -0.000 -0.000) 0.000 16.423 ( 0.000 -0.000 -0.000) 0.000 16.557 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 535 (258/282) ======================= q-point: ( 0.10 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.533 ( 3.876 -0.000 -29.718) 29.969 3.100 ( 10.146 -0.000 -15.100) 18.192 3.312 ( 0.990 -0.000 -3.220) 3.368 3.372 ( 2.448 -0.000 6.002) 6.482 3.494 ( 1.725 -0.000 -0.128) 1.730 3.626 ( -1.147 0.000 10.352) 10.415 4.190 ( 13.984 -0.000 -7.300) 15.775 4.299 ( -7.761 0.000 -12.112) 14.385 4.528 ( 9.925 -0.000 16.212) 19.009 4.758 ( 4.579 -0.000 -5.590) 7.226 4.962 ( -1.639 0.000 12.017) 12.128 5.052 ( -5.158 0.000 14.567) 15.453 5.474 ( 19.997 -0.000 -34.345) 39.742 5.756 ( -0.475 0.000 6.594) 6.611 5.951 ( 4.213 -0.000 0.198) 4.218 5.981 ( 5.582 -0.000 3.630) 6.659 6.463 ( 11.237 -0.000 13.039) 17.213 6.469 ( 12.628 -0.000 3.285) 13.048 7.552 ( -11.224 0.000 3.962) 11.903 7.642 ( -8.880 0.000 0.248) 8.884 7.680 ( -10.477 0.000 3.883) 11.173 7.752 ( -6.803 0.000 2.020) 7.096 8.152 ( -0.817 0.000 0.923) 1.232 8.216 ( 2.754 -0.000 -3.080) 4.132 8.289 ( 12.099 -0.000 1.554) 12.198 8.494 ( 3.291 -0.000 -0.304) 3.305 9.003 ( -0.132 0.000 -6.894) 6.895 9.129 ( -3.984 0.000 -7.398) 8.402 9.674 ( -4.560 0.000 -0.557) 4.594 9.753 ( 7.257 -0.000 -5.658) 9.202 9.826 ( 1.425 -0.000 -9.048) 9.159 9.888 ( -3.384 0.000 5.392) 6.366 10.353 ( -3.390 0.000 1.535) 3.722 10.498 ( 6.916 -0.000 -4.131) 8.056 10.658 ( -4.504 0.000 10.880) 11.776 10.731 ( -1.029 0.000 2.988) 3.160 11.002 ( -10.244 0.000 6.690) 12.235 11.013 ( 4.228 -0.000 4.677) 6.304 11.231 ( -3.945 0.000 8.045) 8.960 11.976 ( 8.820 -0.000 4.724) 10.005 12.068 ( -13.052 0.000 -1.012) 13.091 12.531 ( -10.826 0.000 -1.144) 10.886 13.029 ( 2.362 -0.000 0.480) 2.410 13.366 ( 11.322 -0.000 -16.392) 19.922 15.047 ( 8.294 -0.000 -5.618) 10.018 15.776 ( 13.245 -0.000 19.935) 23.934 16.108 ( -9.936 0.000 2.071) 10.149 16.294 ( -1.480 0.000 -0.469) 1.553 ======================= Grid point 536 (259/282) ======================= q-point: ( 0.20 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.357 ( 10.585 -1.635 -28.091) 30.064 3.107 ( 3.436 -1.043 -7.972) 8.743 3.253 ( 7.020 0.232 -16.015) 17.488 3.489 ( 4.534 -1.363 4.773) 6.723 3.560 ( 2.115 4.263 8.544) 9.780 3.742 ( -0.423 -5.272 10.076) 11.380 3.939 ( -17.568 -1.947 -5.927) 18.643 4.466 ( 20.090 1.660 -7.544) 21.523 4.659 ( -5.148 0.813 3.816) 6.459 4.843 ( 12.008 -0.736 -2.522) 12.292 5.055 ( -2.152 0.751 11.913) 12.130 5.166 ( -3.821 -5.228 18.236) 19.352 5.479 ( 24.673 -0.790 -33.760) 41.823 5.869 ( 6.637 1.367 7.732) 10.281 6.031 ( 7.155 2.785 1.604) 7.844 6.153 ( 10.818 -2.810 2.517) 11.456 6.611 ( 11.526 11.561 2.205) 16.473 6.825 ( 12.620 -11.086 8.967) 19.041 7.407 ( -13.337 0.449 4.900) 14.216 7.460 ( -12.863 3.398 -0.127) 13.305 7.561 ( -11.330 -1.942 5.474) 12.732 7.633 ( -13.348 -4.523 1.220) 14.146 8.030 ( -7.288 4.248 -2.916) 8.925 8.325 ( 10.939 3.838 -0.656) 11.611 8.433 ( 4.103 2.623 -1.476) 5.089 8.575 ( 9.890 -0.774 -0.467) 9.931 8.905 ( -8.173 1.407 -12.723) 15.187 8.932 ( -2.071 -0.179 -7.910) 8.179 9.597 ( -5.216 -2.867 -0.685) 5.991 9.759 ( 1.596 -0.564 -8.223) 8.395 9.790 ( 4.763 3.937 -4.390) 7.580 9.892 ( -7.310 -3.126 7.049) 10.625 10.370 ( 4.909 0.399 1.652) 5.195 10.557 ( 2.947 5.685 0.196) 6.406 10.720 ( -2.122 -0.778 11.734) 11.950 10.729 ( -8.305 -2.779 10.616) 13.762 10.894 ( -1.129 -1.658 -2.349) 3.089 11.131 ( 5.274 -1.690 2.231) 5.971 11.288 ( -1.892 4.278 8.514) 9.714 11.902 ( -7.397 0.445 1.814) 7.629 12.151 ( 5.040 -2.577 6.076) 8.304 12.299 ( -15.290 -0.769 -3.321) 15.666 13.068 ( 4.003 6.181 -0.306) 7.370 13.343 ( 6.669 -4.342 -18.716) 20.338 15.174 ( 13.212 -0.607 -3.921) 13.795 15.966 ( -7.874 2.486 4.326) 9.321 16.183 ( 8.624 -4.913 15.566) 18.461 16.279 ( -1.575 -2.879 3.072) 4.495 ======================= Grid point 537 (260/282) ======================= q-point: ( 0.30 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.359 ( 17.024 -3.278 -17.919) 24.933 3.010 ( -8.628 1.472 -1.697) 8.916 3.274 ( 14.807 -0.560 -15.976) 21.790 3.521 ( -8.607 -0.809 -6.522) 10.829 3.611 ( 4.918 6.473 5.812) 9.993 3.786 ( -3.887 -6.049 9.278) 11.738 3.871 ( -2.447 -5.879 10.367) 12.167 4.488 ( -6.688 7.556 2.280) 10.345 4.696 ( 11.400 -2.004 -9.297) 14.846 4.962 ( 4.153 -2.186 -1.127) 4.826 5.125 ( -1.213 1.777 9.290) 9.536 5.322 ( -4.627 -8.552 14.708) 17.631 5.589 ( 28.735 -1.078 -28.239) 40.303 6.043 ( 6.000 1.994 7.389) 9.725 6.135 ( 6.972 4.562 1.944) 8.556 6.385 ( 13.486 -0.510 3.127) 13.853 6.686 ( 7.926 7.955 -1.197) 11.293 7.136 ( 0.078 -2.260 5.919) 6.336 7.220 ( -6.148 -8.829 -2.981) 11.164 7.280 ( -8.544 3.420 3.465) 9.834 7.435 ( -16.620 -3.671 3.271) 17.332 7.522 ( -3.591 -4.875 4.769) 7.707 7.846 ( -7.447 6.287 -2.735) 10.122 8.346 ( -4.376 5.188 -3.787) 7.772 8.451 ( 7.872 6.764 -2.420) 10.657 8.608 ( -8.294 -1.476 -10.844) 13.731 8.731 ( 6.030 -1.435 -2.122) 6.552 8.860 ( 1.454 1.462 -5.448) 5.826 9.557 ( -4.516 -5.479 0.476) 7.116 9.717 ( 1.516 -1.588 -6.531) 6.890 9.769 ( -1.562 3.411 0.828) 3.842 9.856 ( -1.907 1.963 2.133) 3.470 10.399 ( -9.320 0.707 3.995) 10.165 10.569 ( 3.705 -4.431 2.819) 6.427 10.754 ( -4.548 3.520 12.342) 13.616 10.837 ( 4.438 0.478 4.174) 6.111 10.959 ( 10.807 0.629 -3.287) 11.314 11.193 ( 0.531 1.505 0.452) 1.658 11.302 ( 0.228 -3.943 3.147) 5.050 11.827 ( -7.424 6.568 2.524) 10.229 12.089 ( -8.856 -6.796 0.448) 11.172 12.289 ( 3.098 -2.250 4.341) 5.788 13.020 ( 2.205 11.135 -6.043) 12.859 13.300 ( 2.295 -6.362 -10.473) 12.466 15.325 ( 8.624 0.205 -2.434) 8.963 15.908 ( -2.006 0.397 3.180) 3.780 16.264 ( -0.127 -8.593 -4.042) 9.497 16.505 ( 3.900 1.650 18.020) 18.510 ======================= Grid point 538 (261/282) ======================= q-point: ( 0.40 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.537 ( 14.036 -0.895 -3.002) 14.382 2.842 ( -7.861 2.573 1.447) 8.398 3.332 ( -8.597 -6.510 -5.037) 11.902 3.350 ( 8.790 2.124 -6.602) 11.197 3.675 ( 3.361 7.333 5.520) 9.775 3.929 ( 0.926 -2.305 2.706) 3.673 3.942 ( -1.763 -7.049 9.441) 11.914 4.343 ( -5.909 6.884 1.542) 9.203 4.744 ( 4.137 -0.702 -6.943) 8.112 4.993 ( 1.644 -2.598 -4.410) 5.376 5.163 ( -4.275 1.880 9.925) 10.969 5.419 ( -6.879 -9.067 8.135) 13.990 5.761 ( 21.635 2.298 -18.439) 28.520 6.106 ( 1.994 5.296 -1.457) 5.844 6.179 ( -2.728 6.587 6.940) 9.949 6.549 ( 4.484 5.114 -0.524) 6.821 6.739 ( 2.846 -1.277 0.622) 3.181 6.974 ( -6.757 0.103 -1.223) 6.868 7.104 ( -10.349 -3.490 -0.518) 10.934 7.325 ( -2.940 -4.009 -0.042) 4.972 7.421 ( 8.286 -6.575 2.181) 10.801 7.648 ( 0.937 -2.285 4.972) 5.552 7.686 ( -0.795 1.851 -0.964) 2.233 8.163 ( -6.526 3.765 -5.833) 9.528 8.310 ( -8.219 -1.017 -6.833) 10.737 8.600 ( 6.368 3.973 1.357) 7.628 8.728 ( -6.592 -4.514 0.685) 8.019 8.870 ( 7.174 3.180 -5.684) 9.690 9.538 ( -4.038 -4.054 1.693) 5.967 9.681 ( -2.478 -0.940 -1.198) 2.908 9.752 ( -0.340 -4.701 -1.104) 4.841 9.870 ( 5.578 8.370 1.903) 10.237 10.306 ( -8.101 -6.679 2.720) 10.846 10.644 ( -2.441 -5.050 0.931) 5.686 10.721 ( -4.202 10.907 5.254) 12.815 10.923 ( 9.575 4.792 -2.472) 10.989 11.040 ( 0.945 -0.436 -2.054) 2.302 11.264 ( 6.164 -1.689 2.117) 6.733 11.394 ( 2.774 -5.023 0.443) 5.755 11.617 ( -7.450 5.191 -2.985) 9.559 12.121 ( 0.205 -2.216 4.983) 5.457 12.368 ( -0.554 -3.679 3.752) 5.284 12.874 ( 1.309 7.153 -12.473) 14.439 13.322 ( 0.277 -2.146 4.208) 4.732 15.365 ( -2.515 -0.396 2.329) 3.451 15.940 ( 5.219 3.585 -1.322) 6.468 16.313 ( 4.259 -10.161 -7.075) 13.093 16.636 ( -1.093 6.138 10.862) 12.524 ======================= Grid point 539 (262/282) ======================= q-point: (-0.50 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.540 ( -11.791 8.117 13.430) 19.628 2.951 ( 13.852 -2.082 3.651) 14.475 3.254 ( -7.032 -10.873 -0.080) 12.949 3.382 ( 3.431 5.512 -0.986) 6.567 3.707 ( -1.054 6.004 5.129) 7.967 3.892 ( -3.589 0.141 1.820) 4.026 4.063 ( 4.402 0.835 -1.817) 4.835 4.288 ( 1.381 -0.233 1.656) 2.169 4.707 ( -3.608 -0.756 -2.115) 4.250 4.978 ( 2.837 -2.815 -9.076) 9.917 5.142 ( -11.034 3.525 11.294) 16.178 5.415 ( -7.874 -6.053 4.240) 10.799 5.777 ( 3.448 7.942 -9.636) 12.955 6.013 ( -2.977 3.629 -9.307) 10.424 6.094 ( -11.268 7.077 11.688) 17.710 6.448 ( -6.795 5.885 -3.532) 9.658 6.656 ( -8.828 2.728 -3.398) 9.845 6.947 ( 1.161 -7.491 -4.638) 8.887 7.198 ( 9.500 -6.099 2.952) 11.669 7.368 ( 6.313 -8.330 -2.297) 10.702 7.551 ( -1.537 5.882 2.980) 6.771 7.648 ( 10.807 -2.851 -2.021) 11.358 7.721 ( -1.374 4.982 -0.752) 5.222 8.102 ( 3.175 -8.128 -3.046) 9.243 8.194 ( -6.952 -7.085 0.020) 9.926 8.599 ( -9.087 -5.396 -0.419) 10.576 8.740 ( 4.455 3.359 7.148) 9.067 8.885 ( 3.682 2.116 -3.097) 5.256 9.541 ( -3.175 -4.705 2.795) 6.327 9.669 ( -0.617 -3.285 1.614) 3.712 9.787 ( 1.196 -4.826 -0.381) 4.987 9.909 ( 5.111 10.609 3.255) 12.218 10.305 ( -1.451 -10.283 -3.836) 11.071 10.606 ( -7.967 -2.360 4.085) 9.259 10.615 ( -1.978 5.744 -3.286) 6.906 10.962 ( -5.699 0.617 -4.231) 7.125 11.010 ( 12.459 7.543 -4.470) 15.235 11.250 ( -6.615 3.788 -8.503) 11.420 11.369 ( -0.077 0.389 -0.248) 0.468 11.693 ( 11.165 -3.459 2.151) 11.884 12.170 ( 0.990 1.069 3.121) 3.444 12.393 ( -1.935 -0.491 0.465) 2.050 12.772 ( 2.987 -1.450 -7.600) 8.293 13.409 ( -1.415 1.216 13.271) 13.402 15.325 ( -8.449 0.297 6.761) 10.825 15.950 ( 3.803 2.756 -5.860) 7.510 16.382 ( 8.453 -3.925 -11.362) 14.695 16.609 ( -3.474 9.361 4.238) 10.847 ======================= Grid point 540 (263/282) ======================= q-point: (-0.40 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.492 ( -9.638 6.775 23.907) 26.652 3.167 ( 6.084 0.814 5.077) 7.965 3.256 ( -4.630 -6.176 3.139) 8.333 3.371 ( 0.852 3.329 0.874) 3.545 3.604 ( -11.154 3.708 3.615) 12.297 3.928 ( 5.563 3.381 -2.235) 6.883 4.070 ( 6.214 3.890 -0.468) 7.346 4.360 ( 3.292 -3.317 -3.499) 5.838 4.622 ( -9.542 -1.160 5.720) 11.186 4.943 ( -4.749 3.519 -2.743) 6.517 4.983 ( -6.526 -1.199 -4.302) 7.908 5.390 ( -5.836 0.640 5.899) 8.322 5.597 ( -8.956 6.747 -3.251) 11.675 5.823 ( -6.895 2.819 -5.032) 8.989 5.991 ( -8.249 4.284 5.838) 10.977 6.244 ( -9.015 4.657 -3.024) 10.588 6.463 ( -10.002 2.860 -1.749) 10.549 6.900 ( -6.579 -6.138 -11.828) 14.862 7.380 ( 16.203 -0.749 -8.698) 18.406 7.521 ( 3.521 6.834 3.408) 8.409 7.623 ( 8.728 -14.748 7.193) 18.585 7.677 ( 3.882 3.885 -0.686) 5.535 7.828 ( 9.651 -0.173 -1.469) 9.764 8.113 ( -7.023 -8.574 -1.480) 11.181 8.233 ( -0.099 -8.248 -0.916) 8.299 8.483 ( -9.907 -8.050 -1.623) 12.868 8.871 ( 4.191 0.054 4.270) 5.983 8.937 ( 4.687 0.930 7.746) 9.102 9.555 ( -4.954 -5.614 4.913) 8.955 9.748 ( 1.598 -3.685 6.208) 7.394 9.864 ( 5.794 -3.644 -1.639) 7.038 9.914 ( 1.380 9.480 3.523) 10.208 10.295 ( -1.323 -8.793 -9.475) 12.994 10.483 ( -3.834 7.016 -4.572) 9.210 10.576 ( -5.467 -7.159 2.722) 9.410 10.823 ( -4.041 2.103 -4.791) 6.612 11.023 ( -4.162 -2.023 -13.397) 14.174 11.116 ( 11.809 7.240 -3.284) 14.236 11.318 ( -2.296 5.489 -1.979) 6.270 11.873 ( 8.139 -1.596 -0.848) 8.337 12.196 ( -1.715 -0.250 0.549) 1.818 12.384 ( 5.845 1.852 -0.369) 6.142 12.827 ( 4.173 -5.113 -0.379) 6.611 13.489 ( -5.561 3.456 16.292) 17.558 15.239 ( -10.324 3.587 8.194) 13.660 15.897 ( -0.379 -1.082 -10.152) 10.216 16.381 ( 8.207 5.561 -13.629) 16.853 16.511 ( -2.135 9.836 1.864) 10.236 ======================= Grid point 541 (264/282) ======================= q-point: (-0.30 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.615 ( -2.995 4.747 28.687) 29.231 3.204 ( -7.600 0.860 8.766) 11.634 3.275 ( 3.382 1.474 -1.211) 3.883 3.373 ( -2.571 0.488 4.083) 4.850 3.442 ( -7.377 1.376 -2.452) 7.895 3.868 ( 2.251 7.507 -10.519) 13.117 4.214 ( -1.628 -3.115 5.055) 6.157 4.322 ( 2.801 5.137 2.393) 6.322 4.569 ( -6.131 -0.145 -1.958) 6.438 4.736 ( -11.007 3.483 9.643) 15.042 4.971 ( 7.352 -3.934 -12.884) 15.347 5.212 ( -6.101 10.325 -13.461) 18.029 5.499 ( -12.243 -0.140 21.096) 24.392 5.712 ( -2.833 0.014 0.342) 2.853 5.888 ( -3.378 2.672 -3.180) 5.354 6.068 ( -8.110 1.644 -1.411) 8.395 6.285 ( -8.027 2.236 -2.352) 8.658 6.645 ( -11.769 0.254 -12.345) 17.058 7.544 ( 13.326 -0.381 -5.543) 14.437 7.618 ( 8.811 1.653 0.758) 8.997 7.724 ( 5.535 2.271 -0.526) 6.006 7.891 ( 1.094 1.105 -2.120) 2.629 7.923 ( 7.637 -11.615 6.405) 15.306 8.061 ( -4.764 -6.674 -1.284) 8.300 8.199 ( -7.152 -5.014 -2.329) 9.040 8.419 ( -3.504 -7.463 -4.149) 9.230 8.967 ( 2.404 -1.863 5.670) 6.434 9.114 ( 4.423 -0.846 8.722) 9.815 9.589 ( -3.932 -5.851 8.017) 10.676 9.850 ( -0.708 2.662 7.416) 7.911 9.872 ( -0.197 6.046 2.597) 6.583 9.966 ( 6.595 -2.602 -5.971) 9.269 10.237 ( -4.101 -6.780 -3.587) 8.698 10.349 ( -1.200 0.552 -4.866) 5.043 10.572 ( -2.939 -6.577 -2.023) 7.483 10.739 ( 0.947 2.105 -3.986) 4.606 10.874 ( -5.721 -9.975 -10.304) 15.441 11.145 ( -2.699 6.593 -3.445) 7.913 11.283 ( 14.245 7.101 -4.555) 16.556 11.937 ( 0.166 -1.213 -3.624) 3.825 12.174 ( 3.366 2.680 0.927) 4.402 12.509 ( 5.467 -2.395 2.007) 6.297 12.935 ( 7.186 -1.997 -0.798) 7.501 13.486 ( -11.279 5.012 15.266) 19.631 15.140 ( -7.689 6.044 8.494) 12.954 15.727 ( -6.241 -0.581 -15.814) 17.011 16.325 ( 7.032 9.961 -6.580) 13.856 16.445 ( 0.585 7.808 -0.317) 7.836 ======================= Grid point 542 (265/282) ======================= q-point: (-0.20 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.846 ( 2.362 5.127 24.280) 24.927 3.157 ( -8.702 4.207 9.856) 13.805 3.265 ( 0.354 0.952 -2.135) 2.365 3.330 ( -0.700 1.066 -5.853) 5.991 3.392 ( -0.665 -3.692 3.576) 5.183 3.690 ( -4.339 2.172 -13.821) 14.648 4.116 ( -4.342 9.917 4.718) 11.809 4.315 ( -8.974 6.970 -4.535) 12.234 4.546 ( 4.748 -2.692 10.076) 11.459 4.782 ( 3.991 1.563 5.937) 7.323 4.904 ( -4.428 2.543 -14.773) 15.630 4.988 ( 2.848 0.479 -7.927) 8.437 5.559 ( -11.629 0.840 27.932) 30.268 5.737 ( 2.457 -3.333 1.661) 4.461 5.789 ( 3.828 1.570 -15.012) 15.571 5.937 ( -8.342 -2.078 -0.427) 8.608 6.154 ( -2.204 3.008 -3.168) 4.893 6.353 ( -10.751 3.215 -7.901) 13.724 7.664 ( 7.077 0.066 -1.783) 7.299 7.734 ( 6.158 0.797 -0.236) 6.214 7.786 ( 4.920 0.490 -1.630) 5.206 7.835 ( -3.635 1.057 -0.666) 3.844 8.038 ( -2.325 -3.631 -0.962) 4.418 8.074 ( -2.548 -2.909 -1.730) 4.236 8.188 ( 3.261 -8.595 3.954) 10.007 8.382 ( -3.091 -6.058 -4.036) 7.908 9.072 ( 1.966 -0.309 6.324) 6.630 9.194 ( -0.417 0.574 1.079) 1.292 9.678 ( -0.325 -2.557 7.418) 7.853 9.791 ( -2.012 5.611 -0.460) 5.979 9.889 ( -3.821 1.624 7.642) 8.697 9.961 ( 4.056 2.301 -8.630) 9.809 10.270 ( -1.327 -8.671 5.770) 10.499 10.360 ( 2.615 -7.977 -4.676) 9.609 10.565 ( 1.025 -5.960 -3.573) 7.024 10.715 ( -1.044 -2.702 -4.230) 5.127 10.812 ( -1.855 -6.607 -1.872) 7.113 10.990 ( -4.350 4.715 -5.649) 8.548 11.440 ( 16.066 5.665 -2.772) 17.259 11.824 ( -8.936 2.133 -2.479) 9.516 12.294 ( 10.633 0.563 1.164) 10.711 12.560 ( -4.116 -3.075 1.233) 5.284 13.066 ( 13.014 1.581 -4.202) 13.767 13.376 ( -15.249 4.910 12.039) 20.040 15.106 ( -2.161 5.650 9.882) 11.586 15.446 ( -7.305 2.900 -16.030) 17.853 16.319 ( 5.652 7.442 -1.904) 9.537 16.392 ( -0.275 6.383 -0.236) 6.394 ======================= Grid point 543 (266/282) ======================= q-point: (-0.10 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 255 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.027 ( -5.950 5.374 -6.780) 10.500 3.027 ( 5.950 5.374 6.780) 10.500 3.277 ( 1.835 0.050 -5.037) 5.361 3.277 ( -1.835 0.050 5.037) 5.361 3.507 ( 1.788 -4.032 -13.580) 14.278 3.507 ( -1.788 -4.032 13.580) 14.278 4.079 ( 0.036 11.237 -10.106) 15.113 4.079 ( -0.036 11.237 10.106) 15.113 4.718 ( 1.014 -1.437 -12.557) 12.680 4.718 ( -1.014 -1.437 12.557) 12.680 4.914 ( 3.937 0.230 -10.527) 11.242 4.914 ( -3.937 0.230 10.527) 11.242 5.668 ( 11.265 1.878 -30.151) 32.242 5.668 ( -11.265 1.878 30.151) 32.242 5.851 ( -5.129 -5.944 -1.462) 7.986 5.851 ( 5.129 -5.944 1.462) 7.986 6.143 ( -5.682 4.301 -1.851) 7.363 6.143 ( 5.682 4.301 1.851) 7.363 7.734 ( -3.138 0.435 -0.236) 3.176 7.734 ( 3.138 0.435 0.236) 3.176 7.812 ( 0.580 0.629 -1.923) 2.105 7.812 ( -0.580 0.629 1.923) 2.105 8.041 ( -0.601 -1.930 -0.704) 2.140 8.041 ( 0.601 -1.930 0.704) 2.140 8.339 ( -2.754 -5.181 -3.626) 6.898 8.339 ( 2.754 -5.181 3.626) 6.898 9.146 ( -1.358 1.336 -4.633) 5.009 9.146 ( 1.358 1.336 4.633) 5.009 9.723 ( 2.065 2.196 -5.708) 6.455 9.723 ( -2.065 2.196 5.708) 6.455 9.919 ( 2.186 0.476 -7.317) 7.651 9.919 ( -2.186 0.476 7.317) 7.651 10.385 ( 3.802 -6.997 -9.163) 12.140 10.385 ( -3.802 -6.997 9.163) 12.140 10.663 ( -2.284 -6.112 -4.311) 7.820 10.663 ( 2.284 -6.112 4.311) 7.820 10.860 ( -2.487 0.810 -3.526) 4.390 10.860 ( 2.487 0.810 3.526) 4.390 11.615 ( -13.534 3.785 0.649) 14.068 11.615 ( 13.534 3.785 -0.649) 14.068 12.467 ( -10.469 -1.111 0.253) 10.530 12.467 ( 10.469 -1.111 -0.253) 10.530 13.208 ( 14.272 2.816 -8.208) 16.703 13.208 ( -14.272 2.816 8.208) 16.703 15.192 ( -3.939 3.417 -12.354) 13.409 15.192 ( 3.939 3.417 12.354) 13.409 16.328 ( 0.736 4.909 -1.883) 5.309 16.328 ( -0.736 4.909 1.883) 5.309 ======================= Grid point 547 (267/282) ======================= q-point: ( 0.20 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.333 ( 17.800 -0.000 -18.568) 25.722 3.022 ( -7.733 0.000 -1.290) 7.839 3.274 ( 18.899 -0.000 -20.117) 27.602 3.504 ( -8.485 0.000 -7.419) 11.271 3.708 ( -4.987 0.000 10.106) 11.269 3.713 ( 2.957 -0.000 8.781) 9.266 3.811 ( -3.236 0.000 12.531) 12.942 4.562 ( -9.758 0.000 2.627) 10.106 4.667 ( 14.939 -0.000 -10.136) 18.053 4.944 ( 4.730 -0.000 -2.136) 5.190 5.146 ( 0.273 -0.000 6.827) 6.832 5.246 ( -7.698 0.000 20.157) 21.577 5.582 ( 30.953 -0.000 -30.515) 43.466 6.059 ( 6.910 -0.000 6.767) 9.672 6.175 ( 7.975 -0.000 1.765) 8.168 6.377 ( 14.192 -0.000 4.283) 14.824 6.809 ( 6.661 -0.000 -3.880) 7.709 7.004 ( 9.478 -0.000 4.193) 10.364 7.203 ( -16.784 0.000 0.078) 16.784 7.336 ( -6.697 0.000 3.916) 7.758 7.381 ( -18.193 0.000 2.633) 18.383 7.482 ( -4.781 0.000 6.448) 8.027 7.896 ( -8.289 0.000 -2.976) 8.808 8.387 ( -4.851 0.000 -5.382) 7.246 8.505 ( 9.991 -0.000 -0.923) 10.033 8.598 ( -10.935 0.000 -13.628) 17.472 8.715 ( 5.563 -0.000 -1.737) 5.828 8.874 ( 3.504 -0.000 -7.144) 7.957 9.509 ( -3.739 0.000 0.289) 3.750 9.701 ( 1.431 -0.000 -7.145) 7.287 9.799 ( -11.132 0.000 6.919) 13.107 9.873 ( 6.498 -0.000 -1.494) 6.668 10.431 ( -18.614 0.000 5.934) 19.537 10.493 ( 6.970 -0.000 1.616) 7.155 10.808 ( -0.608 0.000 12.787) 12.801 10.824 ( 6.811 -0.000 6.120) 9.157 10.968 ( 12.349 -0.000 -5.251) 13.419 11.219 ( 5.693 -0.000 -0.434) 5.709 11.258 ( -9.275 0.000 2.666) 9.651 11.920 ( 0.986 -0.000 9.669) 9.719 11.989 ( -16.868 0.000 -4.144) 17.370 12.276 ( 3.833 -0.000 3.015) 4.877 13.172 ( 2.114 -0.000 5.484) 5.878 13.187 ( 2.979 -0.000 -22.534) 22.730 15.327 ( 8.158 -0.000 -1.576) 8.309 15.915 ( 0.087 -0.000 2.853) 2.854 16.190 ( -1.486 0.000 -3.980) 4.249 16.518 ( 5.430 -0.000 18.859) 19.625 ======================= Grid point 548 (268/282) ======================= q-point: ( 0.30 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.525 ( 20.662 -0.474 -4.482) 21.148 2.881 ( -9.489 1.794 1.644) 9.796 3.248 ( -14.292 -3.351 -3.697) 15.138 3.386 ( 17.904 1.774 -14.610) 23.177 3.783 ( 2.377 6.198 6.081) 9.002 3.848 ( -1.781 -4.100 14.192) 14.879 3.881 ( -2.570 -3.762 7.128) 8.460 4.432 ( -8.497 3.666 3.542) 9.909 4.730 ( 7.259 -0.843 -11.491) 13.618 4.960 ( 0.588 -1.313 -3.181) 3.491 5.191 ( -2.000 1.459 7.217) 7.629 5.308 ( -9.896 -4.516 15.098) 18.609 5.775 ( 27.357 0.129 -24.928) 37.011 6.174 ( 2.380 2.494 2.053) 4.012 6.282 ( 4.345 5.117 2.842) 7.290 6.608 ( 7.329 0.523 6.650) 9.910 6.763 ( -0.393 4.953 -5.467) 7.388 6.963 ( -12.298 -1.008 -0.558) 12.352 7.050 ( -12.792 -3.383 -3.478) 13.681 7.232 ( -1.719 -5.518 4.731) 7.469 7.356 ( 5.497 -1.968 1.126) 5.947 7.587 ( 7.449 -2.317 6.492) 10.149 7.740 ( -7.255 2.211 -1.765) 7.787 8.207 ( -8.031 1.677 -8.262) 11.644 8.298 ( -10.426 -0.521 -9.463) 14.089 8.655 ( 1.577 2.004 -0.174) 2.556 8.678 ( -0.483 -1.435 0.933) 1.779 8.903 ( 7.812 1.135 -7.983) 11.227 9.491 ( -1.399 -1.743 1.235) 2.554 9.664 ( 0.329 -1.868 -4.554) 4.933 9.696 ( -9.179 -1.058 4.824) 10.423 9.969 ( 7.876 3.630 0.949) 8.725 10.237 ( -14.201 -2.089 5.876) 15.510 10.576 ( 0.140 -2.919 0.595) 2.982 10.882 ( -1.888 8.805 6.178) 10.921 10.971 ( 6.141 0.127 2.192) 6.522 11.026 ( 2.495 -0.956 -7.091) 7.578 11.245 ( 7.280 -0.492 3.465) 8.078 11.314 ( 5.236 -4.069 -0.741) 6.673 11.694 ( -11.185 3.606 -5.768) 13.091 12.074 ( 1.478 -2.715 11.361) 11.774 12.332 ( 0.259 -1.010 1.713) 2.006 12.974 ( 1.380 4.432 -21.038) 21.544 13.284 ( 0.465 -2.018 10.338) 10.543 15.360 ( -3.897 -0.241 3.732) 5.402 16.019 ( 10.292 6.299 -2.259) 12.276 16.162 ( 3.372 -8.908 -6.025) 11.271 16.703 ( -0.220 2.332 12.337) 12.558 ======================= Grid point 549 (269/282) ======================= q-point: ( 0.40 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.673 ( -7.717 9.101 10.151) 15.667 2.912 ( 15.154 -3.591 4.609) 16.242 3.101 ( -9.752 -8.245 1.808) 12.898 3.469 ( 11.081 5.170 -9.472) 15.468 3.794 ( -3.839 5.137 5.581) 8.502 3.877 ( -6.521 -1.886 8.527) 10.900 4.013 ( 4.606 -4.946 2.807) 7.318 4.344 ( -2.795 4.942 3.519) 6.679 4.692 ( 0.571 -1.161 -9.214) 9.305 4.933 ( -0.328 -2.620 -5.207) 5.839 5.195 ( -10.596 3.128 13.622) 17.539 5.314 ( -5.979 -6.109 5.214) 10.012 5.830 ( 8.086 0.524 -20.589) 22.126 6.110 ( -4.127 6.507 -4.169) 8.761 6.260 ( -5.495 13.000 9.318) 16.912 6.568 ( -4.722 9.236 -3.320) 10.892 6.708 ( -4.056 3.845 -4.523) 7.189 6.844 ( -4.522 -5.590 -4.128) 8.291 7.016 ( 1.056 -16.095 10.641) 19.323 7.296 ( 5.622 -1.189 -3.839) 6.911 7.546 ( 11.580 -6.766 -0.283) 13.415 7.636 ( -2.328 1.399 0.123) 2.718 7.764 ( 4.494 1.039 2.162) 5.094 8.026 ( -1.064 -1.763 -7.735) 8.004 8.117 ( -7.122 -3.090 -2.679) 8.213 8.518 ( -11.658 -4.237 -2.047) 12.572 8.798 ( 5.741 3.526 6.320) 9.238 8.909 ( 3.787 1.040 -6.005) 7.175 9.494 ( -1.857 -1.077 2.076) 2.987 9.629 ( -4.181 -1.829 3.673) 5.858 9.687 ( 0.269 -7.187 -1.648) 7.378 10.057 ( 6.262 7.779 2.586) 10.316 10.158 ( -6.123 -7.499 1.704) 9.830 10.561 ( -4.287 -2.339 -0.331) 4.895 10.748 ( -5.429 9.196 -1.264) 10.754 10.956 ( -5.985 -1.550 -1.889) 6.465 11.106 ( 13.381 4.516 -5.215) 15.055 11.283 ( -6.103 0.184 -13.273) 14.610 11.384 ( 4.362 1.693 3.500) 5.843 11.642 ( 8.851 -2.834 2.400) 9.598 12.185 ( -0.387 0.833 6.753) 6.815 12.355 ( -2.157 -3.036 3.359) 5.015 12.792 ( 4.537 2.603 -16.503) 17.312 13.417 ( -1.220 0.034 15.570) 15.618 15.330 ( -7.307 0.334 8.543) 11.247 15.992 ( 0.807 2.391 -8.039) 8.426 16.323 ( 15.565 -3.320 -8.303) 17.951 16.725 ( -3.750 5.449 5.504) 8.605 ======================= Grid point 550 (270/282) ======================= q-point: (-0.50 0.20 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.608 ( -8.625 8.335 19.955) 23.282 3.093 ( -6.154 -9.779 6.106) 13.069 3.203 ( 10.731 0.281 5.277) 11.962 3.456 ( 5.417 5.482 -8.411) 11.408 3.674 ( -14.770 5.797 10.423) 18.984 3.950 ( 5.451 -0.739 4.327) 6.999 4.081 ( 1.903 -2.087 -5.435) 6.125 4.347 ( 3.097 1.611 1.001) 3.632 4.603 ( -6.202 -1.318 -1.039) 6.425 4.901 ( 1.904 -4.141 -8.412) 9.567 5.058 ( -16.912 5.706 10.008) 20.463 5.350 ( -3.041 -4.313 6.412) 8.304 5.645 ( -4.868 0.405 -17.328) 18.003 5.920 ( -6.665 7.116 -4.800) 10.868 6.139 ( -8.578 14.494 10.713) 19.960 6.356 ( -8.818 9.852 -1.891) 13.357 6.540 ( -7.089 6.091 -2.637) 9.711 6.800 ( -1.730 -5.054 -10.119) 11.443 7.328 ( 5.436 -19.119 11.367) 22.898 7.378 ( 12.486 -2.874 -9.435) 15.912 7.612 ( 0.338 3.957 3.540) 5.320 7.727 ( 3.075 1.762 -0.866) 3.648 7.796 ( 8.789 -5.203 -1.709) 10.356 8.005 ( -4.247 -4.067 -2.234) 6.290 8.123 ( 5.373 -5.697 -2.839) 8.330 8.354 ( -12.401 -7.812 -2.231) 14.825 8.880 ( 2.937 1.010 -0.499) 3.146 8.954 ( 3.962 1.016 7.736) 8.750 9.489 ( -3.973 -2.442 3.602) 5.892 9.677 ( 0.970 -4.743 5.700) 7.479 9.754 ( 1.250 -9.073 0.122) 9.159 10.072 ( 0.410 8.489 3.419) 9.161 10.166 ( 0.041 -7.105 -5.359) 8.899 10.499 ( -5.448 -2.218 0.583) 5.911 10.596 ( -3.486 6.828 -3.681) 8.504 10.841 ( -5.895 0.060 -2.262) 6.314 11.008 ( -6.794 0.237 -18.419) 19.633 11.225 ( 12.920 6.025 -3.683) 14.724 11.399 ( -0.218 4.937 -1.208) 5.088 11.837 ( 8.685 -3.012 0.226) 9.196 12.196 ( -2.331 0.495 2.301) 3.312 12.377 ( 0.088 -2.295 2.521) 3.410 12.792 ( 10.298 0.048 -5.944) 11.890 13.529 ( -5.088 1.791 17.365) 18.184 15.297 ( -7.937 3.690 10.881) 13.965 15.886 ( -1.306 -0.394 -11.185) 11.268 16.452 ( 13.590 3.653 -11.186) 17.977 16.644 ( -3.923 7.117 1.390) 8.244 ======================= Grid point 551 (271/282) ======================= q-point: (-0.40 0.20 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.697 ( -2.636 5.962 26.617) 27.404 3.151 ( -5.263 -6.157 9.110) 12.190 3.288 ( 2.159 1.093 -2.339) 3.365 3.423 ( 4.504 0.763 -11.759) 12.615 3.509 ( -14.326 9.891 15.516) 23.319 3.954 ( 0.807 3.767 -15.566) 16.035 4.151 ( 3.290 -4.903 7.940) 9.894 4.368 ( 0.466 0.765 -1.788) 2.000 4.548 ( -4.058 -1.815 4.162) 6.089 4.836 ( -11.670 5.741 6.839) 14.694 4.912 ( 3.576 -1.510 -6.985) 7.991 5.317 ( -7.341 2.744 -8.382) 11.475 5.470 ( -3.511 -3.016 3.165) 5.607 5.747 ( -5.048 3.463 -2.600) 6.651 6.000 ( -4.538 11.906 2.404) 12.966 6.150 ( -10.038 10.070 5.114) 15.111 6.361 ( -6.189 6.396 -2.716) 9.306 6.632 ( -7.143 0.298 -12.332) 14.254 7.524 ( 13.634 -3.157 -7.544) 15.899 7.648 ( 3.315 -18.849 8.166) 20.808 7.655 ( 5.166 2.529 2.002) 6.091 7.763 ( 3.044 1.398 1.844) 3.823 7.930 ( 2.547 -0.551 0.055) 2.606 7.948 ( -2.631 -7.405 -1.942) 8.095 8.145 ( -1.947 -1.420 -4.817) 5.386 8.268 ( -3.254 -11.449 -5.533) 13.126 8.938 ( 2.797 -1.718 3.959) 5.142 9.104 ( 4.407 -0.462 7.984) 9.131 9.504 ( -4.049 -4.835 7.674) 9.933 9.805 ( 4.354 -6.296 0.966) 7.715 9.860 ( -1.242 -9.699 6.441) 11.709 10.015 ( -1.522 9.656 0.997) 9.826 10.140 ( 0.251 -4.662 -7.604) 8.923 10.424 ( -3.977 4.782 -5.297) 8.170 10.482 ( -4.055 -2.336 0.697) 4.732 10.745 ( -7.174 -6.140 -8.815) 12.918 10.775 ( 0.517 1.927 -8.141) 8.381 11.244 ( -3.594 6.119 -4.346) 8.321 11.387 ( 13.301 6.123 -4.345) 15.274 11.919 ( 1.421 -1.223 -2.839) 3.403 12.197 ( 1.663 0.596 2.392) 2.974 12.456 ( 1.765 -4.175 3.104) 5.494 12.932 ( 13.496 1.233 -3.156) 13.915 13.553 ( -10.967 3.692 16.057) 19.792 15.246 ( -6.754 7.562 11.108) 15.039 15.730 ( -3.100 0.710 -14.267) 14.617 16.466 ( 7.797 8.214 -8.246) 14.009 16.558 ( -0.591 6.568 -0.808) 6.644 ======================= Grid point 552 (272/282) ======================= q-point: (-0.30 0.20 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.929 ( 3.304 5.412 25.990) 26.752 3.177 ( -5.282 -0.740 8.303) 9.868 3.295 ( 2.114 0.139 -6.882) 7.201 3.338 ( -3.063 -0.292 1.705) 3.517 3.406 ( -3.399 7.132 2.200) 8.201 3.704 ( -7.414 0.546 -19.339) 20.719 4.234 ( 2.573 3.846 0.311) 4.638 4.374 ( -6.013 -0.904 3.751) 7.144 4.543 ( 2.157 3.006 6.180) 7.203 4.803 ( -1.391 1.575 10.472) 10.681 4.903 ( 2.003 -1.228 -10.379) 10.642 5.061 ( -3.540 6.805 -11.947) 14.198 5.536 ( -3.860 -4.018 12.849) 14.005 5.675 ( -2.291 -3.538 -1.502) 4.475 5.885 ( 5.161 10.076 -8.937) 14.423 5.986 ( -12.483 9.869 10.957) 19.320 6.223 ( -0.825 5.660 -3.916) 6.932 6.389 ( -8.489 2.802 -8.515) 12.346 7.654 ( 7.000 -2.165 -2.452) 7.727 7.750 ( 6.712 0.763 -0.406) 6.768 7.790 ( -1.254 -5.577 0.547) 5.743 7.797 ( -1.779 -1.002 0.744) 2.173 7.964 ( 1.142 -6.236 -0.626) 6.371 8.032 ( 2.725 -7.011 6.910) 10.214 8.070 ( -2.354 -0.932 -4.120) 4.836 8.253 ( -1.891 -10.300 -7.528) 12.897 9.055 ( 3.214 -1.900 6.252) 7.282 9.194 ( -0.089 -0.515 1.669) 1.749 9.615 ( 1.036 -5.509 10.832) 12.196 9.869 ( -1.560 -3.213 -5.077) 6.208 9.909 ( -2.656 4.583 4.773) 7.130 9.958 ( 0.561 -1.076 -1.776) 2.151 10.152 ( 1.124 -6.338 1.469) 6.603 10.285 ( -0.913 -0.046 -6.572) 6.635 10.475 ( -1.795 -5.419 -0.104) 5.710 10.606 ( -4.918 -8.317 -9.147) 13.305 10.788 ( 3.625 1.097 2.517) 4.547 11.062 ( -5.801 4.577 -7.076) 10.231 11.529 ( 13.967 5.476 -1.843) 15.115 11.851 ( -6.098 1.424 -2.508) 6.746 12.295 ( 7.485 -0.422 2.220) 7.819 12.504 ( -3.369 -4.086 1.417) 5.481 13.104 ( 16.332 3.175 -5.088) 17.398 13.454 ( -15.869 4.960 12.576) 20.847 15.217 ( -3.045 8.581 11.722) 14.843 15.506 ( -3.801 4.705 -15.585) 16.718 16.440 ( 4.121 7.904 -2.240) 9.191 16.496 ( 0.259 6.706 -1.743) 6.933 ======================= Grid point 553 (273/282) ======================= q-point: (-0.20 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 255 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.124 ( -6.776 6.263 -3.362) 9.820 3.124 ( 6.776 6.263 3.362) 9.820 3.288 ( 1.286 1.974 -9.037) 9.339 3.288 ( -1.286 1.974 9.037) 9.339 3.446 ( -0.980 -3.637 -13.371) 13.892 3.446 ( 0.980 -3.637 13.371) 13.892 4.248 ( 0.307 8.516 -5.496) 10.140 4.248 ( -0.307 8.516 5.496) 10.140 4.703 ( -2.781 -0.076 -14.494) 14.759 4.703 ( 2.781 -0.076 14.494) 14.759 4.926 ( 1.777 1.765 -11.158) 11.435 4.926 ( -1.777 1.765 11.158) 11.435 5.654 ( 2.912 -5.085 -14.072) 15.244 5.654 ( -2.912 -5.085 14.072) 15.244 5.840 ( 13.251 7.081 -13.889) 20.460 5.840 ( -13.251 7.081 13.889) 20.460 6.204 ( -5.045 3.790 -1.439) 6.472 6.204 ( 5.045 3.790 1.439) 6.472 7.737 ( -3.355 -0.778 -0.400) 3.467 7.737 ( 3.355 -0.778 0.400) 3.467 7.814 ( 0.600 -0.569 -1.786) 1.968 7.814 ( -0.600 -0.569 1.786) 1.968 8.011 ( -2.148 -1.564 -0.968) 2.828 8.011 ( 2.148 -1.564 0.968) 2.828 8.223 ( -2.323 -9.691 -6.963) 12.157 8.223 ( 2.323 -9.691 6.963) 12.157 9.159 ( -2.490 0.005 -3.774) 4.521 9.159 ( 2.490 0.005 3.774) 4.521 9.762 ( -1.012 1.422 -6.971) 7.186 9.762 ( 1.012 1.422 6.971) 7.186 9.920 ( 4.183 0.049 -10.069) 10.904 9.920 ( -4.183 0.049 10.069) 10.904 10.265 ( 3.197 -7.643 -11.168) 13.906 10.265 ( -3.197 -7.643 11.168) 13.906 10.544 ( 0.926 -8.089 -6.494) 10.414 10.544 ( -0.926 -8.089 6.494) 10.414 10.888 ( -4.298 2.328 -6.147) 7.853 10.888 ( 4.298 2.328 6.147) 7.853 11.679 ( -11.300 4.182 -0.320) 12.054 11.679 ( 11.300 4.182 0.320) 12.054 12.442 ( -8.037 -2.098 -0.380) 8.315 12.442 ( 8.037 -2.098 0.380) 8.315 13.265 ( 14.778 4.422 -8.383) 17.556 13.265 ( -14.778 4.422 8.383) 17.556 15.270 ( -1.911 6.698 -13.489) 15.181 15.270 ( 1.911 6.698 13.489) 15.181 16.423 ( 1.703 6.966 -3.518) 7.988 16.423 ( -1.703 6.966 3.518) 7.988 ======================= Grid point 559 (274/282) ======================= q-point: ( 0.30 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.788 ( -8.759 0.000 6.899) 11.149 2.841 ( 15.366 -0.000 6.739) 16.778 3.035 ( -8.035 0.000 2.924) 8.551 3.514 ( 15.527 -0.000 -15.377) 21.853 3.845 ( -4.168 0.000 5.425) 6.841 3.853 ( -11.442 0.000 15.026) 18.887 3.965 ( 5.772 -0.000 3.166) 6.583 4.388 ( -4.369 0.000 4.971) 6.618 4.680 ( 2.686 -0.000 -12.781) 13.060 4.911 ( -2.117 0.000 -2.816) 3.523 5.240 ( -0.306 0.000 5.242) 5.251 5.244 ( -15.249 0.000 14.490) 21.036 5.831 ( 8.799 -0.000 -22.505) 24.164 6.163 ( -5.028 0.000 -3.035) 5.873 6.392 ( 3.540 -0.000 1.189) 3.735 6.689 ( -1.855 0.000 -5.061) 5.390 6.732 ( -2.865 0.000 0.833) 2.983 6.811 ( -12.862 0.000 11.222) 17.069 6.819 ( -2.686 0.000 -2.753) 3.846 7.298 ( 5.827 -0.000 1.989) 6.157 7.464 ( 12.820 -0.000 -5.351) 13.892 7.648 ( -4.529 0.000 0.946) 4.627 7.771 ( 8.032 -0.000 3.107) 8.612 8.019 ( -3.029 0.000 -9.148) 9.637 8.095 ( -7.211 0.000 -3.735) 8.121 8.485 ( -12.100 0.000 -2.564) 12.368 8.829 ( 5.277 -0.000 6.880) 8.670 8.917 ( 4.086 -0.000 -7.985) 8.970 9.496 ( 0.377 -0.000 1.052) 1.118 9.615 ( -6.731 0.000 5.565) 8.734 9.616 ( -0.560 0.000 -2.452) 2.515 10.094 ( -2.214 0.000 0.211) 2.224 10.125 ( 0.710 -0.000 5.909) 5.951 10.541 ( -2.749 0.000 -1.181) 2.992 10.845 ( -7.541 0.000 -3.681) 8.391 10.923 ( -5.335 0.000 0.532) 5.362 11.140 ( 13.108 -0.000 -4.653) 13.909 11.279 ( -3.800 0.000 -13.304) 13.836 11.400 ( 6.156 -0.000 3.646) 7.154 11.619 ( 6.375 -0.000 1.719) 6.603 12.192 ( -0.956 0.000 10.129) 10.174 12.329 ( -1.442 0.000 1.608) 2.160 12.816 ( 4.574 -0.000 -19.228) 19.764 13.416 ( -1.182 0.000 16.807) 16.848 15.333 ( -6.740 0.000 9.225) 11.425 16.012 ( -1.702 0.000 -9.451) 9.603 16.296 ( 19.545 -0.000 -6.318) 20.540 16.768 ( -3.843 0.000 5.778) 6.940 ======================= Grid point 560 (275/282) ======================= q-point: (-0.60 0.30 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.736 ( -7.003 7.513 15.077) 18.243 2.946 ( -7.467 -8.246 10.933) 15.598 3.210 ( 11.965 0.299 5.907) 13.347 3.512 ( 5.321 1.739 -15.224) 16.220 3.780 ( -10.836 7.752 13.381) 18.883 3.894 ( -2.041 -6.315 9.642) 11.705 4.052 ( 5.955 -0.914 -6.425) 8.808 4.380 ( -1.047 1.687 2.309) 3.045 4.585 ( -2.139 -0.803 -6.787) 7.161 4.852 ( -1.624 -1.828 -4.148) 4.815 5.119 ( -16.699 2.117 12.323) 20.861 5.295 ( -0.873 -2.192 5.251) 5.757 5.643 ( -3.521 -0.226 -19.825) 20.136 5.992 ( -8.956 2.248 -5.621) 10.810 6.361 ( -2.513 10.925 -1.134) 11.268 6.533 ( -6.678 8.368 -0.463) 10.716 6.569 ( -11.448 2.021 1.024) 11.670 6.819 ( 8.863 5.700 -6.402) 12.330 6.998 ( -2.316 -19.946 16.408) 25.931 7.369 ( 6.075 -0.037 -4.685) 7.671 7.620 ( 6.249 -4.444 -5.042) 9.177 7.664 ( 8.798 -2.624 -0.053) 9.181 7.781 ( -1.980 1.193 -0.673) 2.408 7.990 ( -3.205 0.862 -0.630) 3.378 8.060 ( 9.328 -2.680 -4.027) 10.507 8.270 ( -13.313 -2.846 -2.787) 13.896 8.894 ( 2.342 0.604 -4.187) 4.835 8.964 ( 2.639 0.357 9.175) 9.553 9.487 ( -1.397 1.664 -0.151) 2.178 9.620 ( 0.836 -4.001 0.327) 4.101 9.627 ( -2.539 -4.496 7.182) 8.845 10.054 ( -4.459 -3.460 2.603) 6.216 10.198 ( 3.605 4.047 0.416) 5.436 10.480 ( -3.761 -0.658 -1.228) 4.011 10.688 ( -4.466 4.360 -5.344) 8.217 10.825 ( -7.914 -1.673 -0.384) 8.098 11.018 ( -5.596 0.565 -20.365) 21.128 11.288 ( 12.482 2.136 -3.580) 13.159 11.459 ( 0.860 2.403 -1.359) 2.892 11.794 ( 9.282 -2.027 1.557) 9.628 12.207 ( -4.183 0.633 3.727) 5.638 12.341 ( -0.680 -1.673 3.124) 3.608 12.803 ( 12.454 0.690 -9.123) 15.454 13.546 ( -4.858 0.525 18.327) 18.968 15.340 ( -6.162 1.616 12.675) 14.185 15.883 ( -1.605 -0.125 -11.628) 11.739 16.490 ( 16.209 1.270 -9.790) 18.979 16.719 ( -4.811 2.538 1.013) 5.533 ======================= Grid point 561 (276/282) ======================= q-point: (-0.50 0.30 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.793 ( -2.513 6.434 23.063) 24.075 3.047 ( -4.052 -7.048 13.992) 16.182 3.313 ( 0.862 1.943 -1.517) 2.611 3.412 ( 0.305 -1.357 -11.424) 11.508 3.682 ( -8.507 11.588 10.708) 17.925 3.963 ( -3.431 -3.876 -11.377) 12.500 4.088 ( 7.237 -1.982 4.576) 8.789 4.363 ( -2.169 -0.858 -1.620) 2.840 4.529 ( -2.154 -0.573 3.054) 3.781 4.815 ( 0.230 -3.358 -5.836) 6.737 4.981 ( -11.608 5.016 11.354) 16.995 5.314 ( -5.883 -1.804 -1.267) 6.283 5.434 ( 0.111 -1.305 -10.028) 10.114 5.788 ( -7.555 1.777 -6.012) 9.817 6.181 ( -4.605 9.626 -4.241) 11.483 6.378 ( -13.660 7.899 7.440) 17.445 6.410 ( -2.339 10.589 2.086) 11.043 6.756 ( 2.737 16.014 -8.413) 18.295 7.297 ( 1.008 -23.897 10.359) 26.065 7.452 ( 6.157 -9.418 -3.849) 11.892 7.677 ( 3.338 0.013 1.768) 3.777 7.783 ( 1.805 1.066 1.935) 2.853 7.835 ( 9.855 -5.899 -6.147) 13.027 7.928 ( -3.675 0.849 -0.301) 3.784 8.095 ( -8.647 -8.699 -3.324) 12.708 8.156 ( 5.931 0.389 -6.589) 8.874 8.918 ( 2.745 -0.848 1.773) 3.376 9.097 ( 3.288 -0.548 8.040) 8.704 9.457 ( -2.904 -0.991 3.383) 4.568 9.675 ( 1.061 -9.153 -2.540) 9.558 9.742 ( -0.155 -4.966 11.346) 12.386 10.055 ( -1.933 -3.908 1.425) 4.587 10.167 ( -0.745 7.015 -2.474) 7.476 10.422 ( -3.847 -0.609 0.284) 3.905 10.544 ( -2.862 4.760 -6.482) 8.536 10.673 ( -9.111 -3.403 -10.751) 14.497 10.804 ( 0.845 1.574 -8.416) 8.603 11.323 ( -4.423 3.878 -5.340) 7.945 11.461 ( 12.127 3.331 -4.271) 13.282 11.900 ( 2.592 -1.208 -1.607) 3.280 12.200 ( 0.190 0.071 3.717) 3.723 12.397 ( 0.956 -3.158 3.163) 4.570 12.956 ( 16.273 1.534 -4.746) 17.020 13.596 ( -10.664 1.905 16.984) 20.144 15.352 ( -5.694 5.675 13.509) 15.720 15.741 ( -1.080 0.473 -13.167) 13.220 16.566 ( 9.522 4.717 -9.670) 14.368 16.634 ( -2.328 3.334 -0.958) 4.178 ======================= Grid point 562 (277/282) ======================= q-point: (-0.40 0.30 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.004 ( 2.615 4.236 26.537) 26.999 3.156 ( -4.913 -1.893 12.692) 13.741 3.283 ( 5.174 -0.735 -11.272) 12.424 3.337 ( -1.728 0.026 1.265) 2.142 3.541 ( -7.201 8.945 1.569) 11.590 3.716 ( -7.737 1.018 -20.839) 22.253 4.239 ( 3.547 -2.383 1.652) 4.582 4.325 ( -4.260 -3.647 2.714) 6.230 4.581 ( 3.215 1.076 4.951) 6.001 4.791 ( -1.913 -2.903 -1.779) 3.906 4.937 ( -2.175 4.619 7.437) 9.021 5.136 ( -3.606 2.752 -12.083) 12.906 5.466 ( 0.121 -4.176 4.768) 6.339 5.636 ( -4.356 -1.527 -5.810) 7.420 6.043 ( 1.773 8.282 -4.621) 9.648 6.186 ( -13.486 8.979 8.763) 18.420 6.329 ( 0.290 13.900 3.826) 14.420 6.533 ( -1.708 18.290 -9.575) 20.715 7.545 ( 4.794 -15.548 -1.776) 16.367 7.595 ( -1.558 -15.619 4.616) 16.361 7.757 ( 4.123 -0.576 1.149) 4.319 7.804 ( -0.918 0.295 1.218) 1.553 7.883 ( 0.480 -2.630 2.108) 3.405 7.948 ( 2.493 -3.427 0.329) 4.250 8.044 ( 0.186 -6.839 -6.912) 9.725 8.136 ( 0.041 -1.156 -6.791) 6.888 9.020 ( 3.539 -2.292 5.813) 7.182 9.181 ( 0.287 -1.141 0.223) 1.197 9.527 ( 1.165 -5.329 9.438) 10.901 9.728 ( -0.216 -10.517 -4.257) 11.348 9.890 ( -1.528 -4.844 11.848) 12.891 10.045 ( -2.247 7.655 -4.120) 8.979 10.084 ( 2.160 -2.864 -0.361) 3.606 10.323 ( -6.255 3.136 -6.852) 9.793 10.425 ( -1.671 -0.630 -1.218) 2.162 10.509 ( -2.851 -4.447 -9.109) 10.530 10.809 ( 4.067 1.350 2.099) 4.771 11.123 ( -7.273 3.296 -8.273) 11.498 11.599 ( 12.025 3.586 -1.246) 12.610 11.868 ( -4.083 0.732 -2.130) 4.663 12.284 ( 5.053 -0.895 3.383) 6.147 12.444 ( -1.839 -3.531 1.093) 4.129 13.153 ( 18.164 2.918 -5.854) 19.306 13.519 ( -16.125 3.494 13.369) 21.235 15.352 ( -3.885 8.511 13.292) 16.254 15.577 ( -0.608 4.148 -14.377) 14.976 16.546 ( 2.256 5.691 -2.031) 6.450 16.583 ( 1.508 4.399 -3.975) 6.118 ======================= Grid point 563 (278/282) ======================= q-point: (-0.30 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 255 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.184 ( 4.206 1.536 -3.532) 5.703 3.184 ( -4.206 1.536 3.532) 5.703 3.352 ( -5.380 5.373 -16.405) 18.082 3.352 ( 5.380 5.373 16.405) 18.082 3.405 ( -0.952 -0.948 -9.229) 9.326 3.405 ( 0.952 -0.948 9.229) 9.326 4.302 ( 3.760 -0.866 -2.318) 4.501 4.302 ( -3.760 -0.866 2.318) 4.501 4.707 ( -5.027 -0.038 -7.884) 9.350 4.707 ( 5.027 -0.038 7.884) 9.350 4.975 ( -0.438 4.177 -9.145) 10.063 4.975 ( 0.438 4.177 9.145) 10.063 5.566 ( -0.575 -5.227 -6.923) 8.693 5.566 ( 0.575 -5.227 6.923) 8.693 6.009 ( 11.558 11.390 -11.910) 20.128 6.009 ( -11.558 11.390 11.910) 20.128 6.295 ( 0.943 11.120 -7.668) 13.540 6.295 ( -0.943 11.120 7.668) 13.540 7.674 ( 3.612 -8.699 -2.168) 9.666 7.674 ( -3.612 -8.699 2.168) 9.666 7.805 ( -0.137 -0.604 -0.259) 0.672 7.805 ( 0.137 -0.604 0.259) 0.672 7.980 ( -1.950 -4.348 -3.189) 5.734 7.980 ( 1.950 -4.348 3.189) 5.734 8.081 ( 0.165 -5.997 -8.516) 10.417 8.081 ( -0.165 -5.997 8.516) 10.417 9.144 ( -2.735 -1.830 -4.604) 5.659 9.144 ( 2.735 -1.830 4.604) 5.659 9.712 ( -1.708 -7.370 -9.961) 12.508 9.712 ( 1.708 -7.370 9.961) 12.508 9.952 ( 2.757 3.215 -6.431) 7.700 9.952 ( -2.757 3.215 6.431) 7.700 10.177 ( -2.382 -3.397 -5.219) 6.667 10.177 ( 2.382 -3.397 5.219) 6.667 10.449 ( 1.887 -3.950 -6.852) 8.131 10.449 ( -1.887 -3.950 6.852) 8.131 10.923 ( -5.494 2.170 -7.154) 9.277 10.923 ( 5.494 2.170 7.154) 9.277 11.735 ( -9.271 3.016 -0.760) 9.779 11.735 ( 9.271 3.016 0.760) 9.779 12.407 ( -5.530 -2.420 -1.286) 6.172 12.407 ( 5.530 -2.420 1.286) 6.172 13.333 ( 16.470 4.201 -8.916) 19.194 13.333 ( -16.470 4.201 8.916) 19.194 15.386 ( 0.558 7.998 -14.219) 16.324 15.386 ( -0.558 7.998 14.219) 16.324 16.524 ( 2.145 5.875 -4.520) 7.716 16.524 ( -2.145 5.875 4.520) 7.716 ======================= Grid point 571 (279/282) ======================= q-point: ( 0.40 -0.60 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 275 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.865 ( -2.255 0.000 19.118) 19.251 2.970 ( -3.962 0.000 18.413) 18.835 3.333 ( 0.307 -0.000 1.226) 1.264 3.397 ( -0.120 0.000 -13.806) 13.807 3.848 ( -3.173 0.000 0.498) 3.212 3.848 ( -8.692 0.000 7.186) 11.277 4.082 ( 8.278 -0.000 -5.048) 9.696 4.355 ( -3.431 0.000 -1.175) 3.627 4.526 ( -1.023 0.000 1.592) 1.892 4.786 ( -0.324 0.000 -4.518) 4.530 5.019 ( -12.790 0.000 12.780) 18.080 5.296 ( -5.030 0.000 0.858) 5.102 5.426 ( 0.869 -0.000 -13.866) 13.893 5.801 ( -8.631 0.000 -6.326) 10.701 6.288 ( -4.864 0.000 -7.697) 9.105 6.321 ( -10.038 0.000 -3.767) 10.721 6.669 ( -0.015 0.000 11.660) 11.660 6.956 ( 9.894 -0.000 -5.151) 11.155 7.007 ( -4.420 0.000 15.459) 16.079 7.323 ( -3.295 0.000 -4.143) 5.294 7.672 ( 4.615 -0.000 0.563) 4.649 7.790 ( 13.985 -0.000 -7.791) 16.009 7.792 ( 1.651 -0.000 1.648) 2.333 7.954 ( -1.048 0.000 -1.361) 1.718 8.007 ( -11.416 0.000 -1.885) 11.571 8.164 ( 5.843 -0.000 -6.163) 8.493 8.912 ( 2.709 -0.000 0.721) 2.803 9.091 ( 2.367 -0.000 8.535) 8.857 9.460 ( -1.459 0.000 -1.563) 2.139 9.591 ( -1.386 0.000 2.210) 2.609 9.704 ( 0.707 -0.000 10.190) 10.215 10.019 ( -1.915 0.000 2.516) 3.162 10.228 ( -1.294 0.000 -1.088) 1.690 10.419 ( -2.829 0.000 -0.548) 2.882 10.583 ( -2.890 0.000 -7.696) 8.221 10.644 ( -10.137 0.000 -9.326) 13.774 10.817 ( 1.018 -0.000 -9.709) 9.762 11.354 ( -4.795 0.000 -5.810) 7.533 11.486 ( 11.587 -0.000 -4.320) 12.366 11.889 ( 3.270 -0.000 -0.878) 3.386 12.201 ( -0.622 0.000 4.342) 4.386 12.371 ( 1.132 -0.000 2.846) 3.062 12.969 ( 16.958 -0.000 -5.258) 17.755 13.611 ( -10.545 0.000 17.381) 20.330 15.399 ( -5.204 0.000 14.645) 15.542 15.744 ( -0.412 0.000 -12.874) 12.881 16.604 ( 10.939 -0.000 -10.549) 15.197 16.659 ( -3.717 0.000 -0.706) 3.784 ======================= Grid point 573 (280/282) ======================= q-point: (-0.50 0.40 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.056 ( 1.058 2.505 24.312) 24.464 3.124 ( -3.944 -1.953 18.441) 18.958 3.278 ( 3.371 -0.050 -13.317) 13.737 3.337 ( 2.024 0.044 0.561) 2.101 3.648 ( -8.488 4.287 -8.713) 12.897 3.729 ( -7.731 0.446 -11.775) 14.093 4.192 ( 2.235 -2.479 4.705) 5.769 4.288 ( -3.125 -1.207 -1.468) 3.657 4.586 ( 3.365 0.040 5.672) 6.595 4.752 ( -0.144 -1.529 -3.844) 4.140 4.990 ( -5.985 1.829 11.390) 12.996 5.155 ( -2.911 0.309 -10.705) 11.098 5.423 ( 2.381 -1.420 1.080) 2.975 5.624 ( -6.175 -0.272 -6.407) 8.902 6.134 ( -2.437 4.450 -3.453) 6.136 6.193 ( -6.859 -3.019 -2.219) 7.816 6.686 ( 0.070 25.573 13.769) 29.044 6.886 ( 3.371 24.697 -8.661) 26.388 7.204 ( 0.137 -24.612 6.844) 25.546 7.325 ( -2.972 -20.372 -1.318) 20.630 7.739 ( 1.416 -1.041 2.597) 3.136 7.810 ( -2.774 0.385 0.509) 2.847 7.873 ( -1.556 0.238 1.624) 2.262 7.912 ( 2.323 -1.641 0.375) 2.869 7.955 ( 9.593 -2.801 -11.193) 15.006 8.147 ( -0.792 0.782 -4.615) 4.747 8.994 ( 3.631 -0.965 4.893) 6.169 9.165 ( 0.101 -0.762 -0.510) 0.923 9.471 ( 1.558 -1.759 4.930) 5.462 9.606 ( -2.028 -4.602 1.137) 5.156 9.831 ( 0.896 -2.202 11.017) 11.271 10.031 ( 0.799 -2.067 -1.955) 2.955 10.154 ( -3.884 4.284 0.570) 5.811 10.357 ( -6.541 1.235 -3.750) 7.640 10.422 ( -1.175 -0.868 -9.549) 9.661 10.474 ( -2.105 -0.182 -6.041) 6.400 10.824 ( 4.437 0.571 1.457) 4.705 11.158 ( -8.282 1.216 -8.904) 12.221 11.636 ( 10.933 1.223 -0.933) 11.041 11.875 ( -3.022 0.206 -1.765) 3.506 12.273 ( 3.622 -0.413 4.232) 5.586 12.404 ( -0.596 -1.434 0.605) 1.666 13.185 ( 18.899 1.149 -6.255) 19.940 13.556 ( -16.180 1.245 13.900) 21.367 15.452 ( -4.674 3.833 14.402) 15.619 15.621 ( 1.532 1.429 -13.395) 13.558 16.607 ( -0.647 2.227 -0.218) 2.329 16.625 ( 4.165 1.239 -7.273) 8.472 ======================= Grid point 574 (281/282) ======================= q-point: (-0.40 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 255 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.191 ( 2.967 -0.023 -6.906) 7.516 3.191 ( -2.967 -0.023 6.906) 7.516 3.365 ( -6.252 -0.945 -16.196) 17.386 3.365 ( 6.252 -0.945 16.196) 17.386 3.469 ( -4.278 5.503 -8.673) 11.127 3.469 ( 4.278 5.503 8.673) 11.127 4.262 ( 1.223 -3.122 -2.754) 4.339 4.262 ( -1.223 -3.122 2.754) 4.339 4.698 ( -3.517 -0.832 -4.859) 6.056 4.698 ( 3.517 -0.832 4.859) 6.056 5.028 ( 1.092 2.318 -10.625) 10.929 5.028 ( -1.092 2.318 10.625) 10.929 5.508 ( -2.815 -2.379 -5.197) 6.371 5.508 ( 2.815 -2.379 5.197) 6.371 6.104 ( 1.708 2.136 -3.560) 4.489 6.104 ( -1.708 2.136 3.560) 4.489 6.601 ( 3.481 26.867 -14.973) 30.954 6.601 ( -3.481 26.867 14.973) 30.954 7.444 ( 3.891 -21.380 -6.865) 22.789 7.444 ( -3.891 -21.380 6.865) 22.789 7.783 ( -0.574 -2.067 -0.642) 2.239 7.783 ( 0.574 -2.067 0.642) 2.239 7.907 ( -0.873 -2.649 -2.908) 4.029 7.907 ( 0.873 -2.649 2.908) 4.029 8.056 ( -0.824 0.303 -2.017) 2.199 8.056 ( 0.824 0.303 2.017) 2.199 9.113 ( -3.006 -1.878 -5.361) 6.427 9.113 ( 3.006 -1.878 5.361) 6.427 9.597 ( -1.462 -6.182 -5.696) 8.532 9.597 ( 1.462 -6.182 5.696) 8.532 9.966 ( -0.197 -1.211 -11.042) 11.110 9.966 ( 0.197 -1.211 11.042) 11.110 10.176 ( -3.280 2.378 -8.852) 9.735 10.176 ( 3.280 2.378 8.852) 9.735 10.415 ( 0.284 -1.067 -3.301) 3.481 10.415 ( -0.284 -1.067 3.301) 3.481 10.950 ( -6.765 1.306 -7.012) 9.831 10.950 ( 6.765 1.306 7.012) 9.831 11.770 ( -7.898 1.524 -0.954) 8.100 11.770 ( 7.898 1.524 0.954) 8.100 12.374 ( -3.856 -1.656 -2.005) 4.651 12.374 ( 3.856 -1.656 2.005) 4.651 13.385 ( 18.306 2.484 -9.456) 20.754 13.385 ( -18.306 2.484 9.456) 20.754 15.494 ( 2.840 5.565 -14.120) 15.440 15.494 ( -2.840 5.565 14.120) 15.440 16.593 ( 2.216 3.095 -4.888) 6.196 16.593 ( -2.216 3.095 4.888) 6.196 ======================= Grid point 585 (282/282) ======================= q-point: (-0.50 0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 141 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.190 ( 2.970 -0.000 -8.056) 8.586 3.190 ( -2.970 -0.000 8.056) 8.586 3.357 ( -5.894 -0.000 -15.646) 16.719 3.357 ( 5.894 -0.000 15.646) 16.719 3.515 ( -6.721 -0.000 -8.876) 11.133 3.515 ( 6.721 -0.000 8.876) 11.133 4.234 ( -0.679 -0.000 -2.953) 3.030 4.234 ( 0.679 -0.000 2.953) 3.030 4.691 ( -2.470 -0.000 -4.650) 5.265 4.691 ( 2.470 -0.000 4.650) 5.265 5.044 ( 1.657 -0.000 -10.575) 10.704 5.044 ( -1.657 -0.000 10.575) 10.704 5.491 ( -3.889 -0.000 -4.443) 5.905 5.491 ( 3.889 -0.000 4.443) 5.905 6.116 ( 2.426 -0.000 -3.289) 4.087 6.116 ( -2.426 -0.000 3.289) 4.087 6.984 ( -0.954 0.000 -13.014) 13.049 6.984 ( 0.954 -0.000 13.014) 13.049 7.107 ( 11.331 -0.000 -9.812) 14.989 7.107 ( -11.331 0.000 9.812) 14.989 7.764 ( -1.686 -0.000 -0.256) 1.705 7.764 ( 1.686 -0.000 0.256) 1.705 7.892 ( -0.260 -0.000 -2.074) 2.090 7.892 ( 0.260 -0.000 2.074) 2.090 8.060 ( -8.945 -0.000 2.088) 9.185 8.060 ( 8.945 -0.000 -2.088) 9.185 9.097 ( -3.250 -0.000 -5.324) 6.237 9.097 ( 3.250 -0.000 5.324) 6.237 9.548 ( -3.800 -0.000 -1.455) 4.069 9.548 ( 3.800 -0.000 1.455) 4.069 9.951 ( -1.134 -0.000 -11.119) 11.177 9.951 ( 1.134 -0.000 11.119) 11.177 10.201 ( -1.910 -0.000 -9.389) 9.581 10.201 ( 1.910 -0.000 9.389) 9.581 10.407 ( -1.116 0.000 -2.025) 2.313 10.407 ( 1.116 -0.000 2.025) 2.313 10.960 ( -7.429 -0.000 -6.694) 10.000 10.960 ( 7.429 -0.000 6.694) 10.000 11.781 ( -7.426 -0.000 -1.006) 7.494 11.781 ( 7.426 -0.000 1.006) 7.494 12.361 ( -3.268 -0.000 -2.270) 3.979 12.361 ( 3.268 -0.000 2.270) 3.979 13.405 ( 19.122 -0.000 -9.685) 21.435 13.405 ( -19.122 -0.000 9.685) 21.435 15.539 ( 3.901 -0.000 -13.865) 14.404 15.539 ( -3.901 -0.000 13.865) 14.404 16.616 ( 2.175 -0.000 -4.907) 5.368 16.616 ( -2.175 -0.000 4.907) 5.368 =================== 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 3/48000 10.0 7837.189 10776.291 8973.974 0.000 1964.739 -0.000 3/48000 20.0 1121.052 1560.193 1045.912 0.000 -35.220 -0.000 3/48000 30.0 381.776 480.421 336.086 0.000 -34.269 -0.000 3/48000 40.0 186.266 221.846 168.150 0.000 -22.392 -0.000 3/48000 50.0 108.581 125.802 102.440 0.000 -15.087 -0.000 3/48000 60.0 71.086 81.143 69.996 0.000 -10.738 -0.000 3/48000 70.0 50.586 57.225 51.588 0.000 -8.027 -0.000 3/48000 80.0 38.294 43.052 40.107 0.000 -6.251 -0.000 3/48000 90.0 30.375 33.984 32.441 0.000 -5.037 -0.000 3/48000 100.0 24.972 27.824 27.048 0.000 -4.174 -0.000 3/48000 110.0 21.111 23.434 23.097 0.000 -3.540 -0.000 3/48000 120.0 18.244 20.181 20.104 0.000 -3.061 -0.000 3/48000 130.0 16.047 17.692 17.774 0.000 -2.690 -0.000 3/48000 140.0 14.318 15.737 15.917 0.000 -2.396 -0.000 3/48000 150.0 12.927 14.166 14.407 0.000 -2.158 -0.000 3/48000 160.0 11.785 12.879 13.158 0.000 -1.962 -0.000 3/48000 170.0 10.832 11.807 12.110 0.000 -1.799 -0.000 3/48000 180.0 10.026 10.902 11.219 0.000 -1.660 -0.000 3/48000 190.0 9.335 10.129 10.453 0.000 -1.542 -0.000 3/48000 200.0 8.736 9.460 9.787 0.000 -1.440 -0.000 3/48000 210.0 8.212 8.876 9.203 0.000 -1.350 -0.000 3/48000 220.0 7.750 8.362 8.687 0.000 -1.272 -0.000 3/48000 230.0 7.340 7.906 8.227 0.000 -1.202 -0.000 3/48000 240.0 6.972 7.499 7.815 0.000 -1.140 -0.000 3/48000 250.0 6.641 7.133 7.444 0.000 -1.084 -0.000 3/48000 260.0 6.341 6.802 7.108 0.000 -1.033 -0.000 3/48000 270.0 6.068 6.502 6.802 0.000 -0.987 -0.000 3/48000 280.0 5.819 6.228 6.522 0.000 -0.945 -0.000 3/48000 290.0 5.590 5.977 6.265 0.000 -0.907 -0.000 3/48000 300.0 5.379 5.746 6.028 0.000 -0.872 -0.000 3/48000 310.0 5.184 5.533 5.809 0.000 -0.839 -0.000 3/48000 320.0 5.003 5.336 5.606 0.000 -0.809 -0.000 3/48000 330.0 4.835 5.153 5.417 0.000 -0.781 -0.000 3/48000 340.0 4.678 4.982 5.241 0.000 -0.755 -0.000 3/48000 350.0 4.532 4.823 5.076 0.000 -0.731 -0.000 3/48000 360.0 4.394 4.674 4.922 0.000 -0.708 -0.000 3/48000 370.0 4.265 4.534 4.777 0.000 -0.687 -0.000 3/48000 380.0 4.144 4.402 4.641 0.000 -0.667 -0.000 3/48000 390.0 4.029 4.279 4.512 0.000 -0.648 -0.000 3/48000 400.0 3.921 4.162 4.390 0.000 -0.630 -0.000 3/48000 410.0 3.819 4.051 4.275 0.000 -0.614 -0.000 3/48000 420.0 3.721 3.947 4.167 0.000 -0.598 -0.000 3/48000 430.0 3.629 3.847 4.063 0.000 -0.583 -0.000 3/48000 440.0 3.542 3.753 3.965 0.000 -0.568 -0.000 3/48000 450.0 3.458 3.664 3.871 0.000 -0.555 -0.000 3/48000 460.0 3.379 3.578 3.782 0.000 -0.542 -0.000 3/48000 470.0 3.303 3.497 3.697 0.000 -0.529 -0.000 3/48000 480.0 3.231 3.420 3.616 0.000 -0.518 -0.000 3/48000 490.0 3.162 3.345 3.538 0.000 -0.506 -0.000 3/48000 500.0 3.095 3.274 3.464 0.000 -0.496 -0.000 3/48000 510.0 3.032 3.207 3.393 0.000 -0.485 -0.000 3/48000 520.0 2.971 3.141 3.325 0.000 -0.475 -0.000 3/48000 530.0 2.913 3.079 3.259 0.000 -0.466 -0.000 3/48000 540.0 2.857 3.019 3.196 0.000 -0.457 -0.000 3/48000 550.0 2.803 2.961 3.136 0.000 -0.448 -0.000 3/48000 560.0 2.751 2.906 3.078 0.000 -0.440 -0.000 3/48000 570.0 2.701 2.853 3.021 0.000 -0.432 -0.000 3/48000 580.0 2.652 2.801 2.967 0.000 -0.424 -0.000 3/48000 590.0 2.606 2.752 2.915 0.000 -0.416 -0.000 3/48000 600.0 2.561 2.704 2.865 0.000 -0.409 -0.000 3/48000 610.0 2.518 2.658 2.817 0.000 -0.402 -0.000 3/48000 620.0 2.476 2.613 2.770 0.000 -0.395 -0.000 3/48000 630.0 2.435 2.570 2.724 0.000 -0.389 -0.000 3/48000 640.0 2.396 2.528 2.680 0.000 -0.382 -0.000 3/48000 650.0 2.358 2.488 2.638 0.000 -0.376 -0.000 3/48000 660.0 2.322 2.449 2.597 0.000 -0.370 -0.000 3/48000 670.0 2.286 2.411 2.557 0.000 -0.365 -0.000 3/48000 680.0 2.252 2.375 2.518 0.000 -0.359 -0.000 3/48000 690.0 2.218 2.339 2.481 0.000 -0.354 -0.000 3/48000 700.0 2.186 2.305 2.445 0.000 -0.349 -0.000 3/48000 710.0 2.154 2.271 2.409 0.000 -0.344 -0.000 3/48000 720.0 2.124 2.239 2.375 0.000 -0.339 -0.000 3/48000 730.0 2.094 2.207 2.342 0.000 -0.334 -0.000 3/48000 740.0 2.065 2.177 2.309 0.000 -0.329 -0.000 3/48000 750.0 2.037 2.147 2.278 0.000 -0.325 -0.000 3/48000 760.0 2.010 2.118 2.247 0.000 -0.320 -0.000 3/48000 770.0 1.983 2.090 2.217 0.000 -0.316 -0.000 3/48000 780.0 1.957 2.062 2.188 0.000 -0.312 -0.000 3/48000 790.0 1.932 2.035 2.160 0.000 -0.308 -0.000 3/48000 800.0 1.907 2.009 2.133 0.000 -0.304 -0.000 3/48000 810.0 1.883 1.984 2.106 0.000 -0.300 -0.000 3/48000 820.0 1.860 1.959 2.080 0.000 -0.296 -0.000 3/48000 830.0 1.837 1.935 2.054 0.000 -0.293 -0.000 3/48000 840.0 1.815 1.912 2.029 0.000 -0.289 -0.000 3/48000 850.0 1.793 1.889 2.005 0.000 -0.286 -0.000 3/48000 860.0 1.772 1.866 1.981 0.000 -0.282 -0.000 3/48000 870.0 1.751 1.844 1.958 0.000 -0.279 -0.000 3/48000 880.0 1.731 1.823 1.936 0.000 -0.276 -0.000 3/48000 890.0 1.711 1.802 1.913 0.000 -0.272 -0.000 3/48000 900.0 1.692 1.782 1.892 0.000 -0.269 -0.000 3/48000 910.0 1.673 1.762 1.871 0.000 -0.266 -0.000 3/48000 920.0 1.655 1.742 1.850 0.000 -0.263 -0.000 3/48000 930.0 1.637 1.723 1.830 0.000 -0.261 -0.000 3/48000 940.0 1.619 1.705 1.810 0.000 -0.258 -0.000 3/48000 950.0 1.602 1.686 1.791 0.000 -0.255 -0.000 3/48000 960.0 1.585 1.668 1.772 0.000 -0.252 -0.000 3/48000 970.0 1.568 1.651 1.753 0.000 -0.250 -0.000 3/48000 980.0 1.552 1.634 1.735 0.000 -0.247 -0.000 3/48000 990.0 1.536 1.617 1.718 0.000 -0.244 -0.000 3/48000 1000.0 1.521 1.601 1.700 0.000 -0.242 -0.000 3/48000 Thermal conductivity related properties were written into "kappa-m101010.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 08:56:25]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|