----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-09 01:18:03]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.708695505046850 -3.505625414999999 0.000000000000000 b 4.708695505046850 3.505625414999999 0.000000000000000 c -1.954674975436099 0.000000000000000 5.836365120456681 Atomic positions (fractional): *1 Li 0.33255477550228 0.93286569462248 0.27410986981682 6.941 *2 Li 0.66060514189516 0.61373432266994 0.49295405944483 6.941 3 Li 0.93286569462249 0.33255477550228 0.77410986981682 6.941 4 Li 0.61373432266994 0.66060514189516 0.99295405944483 6.941 5 Li 0.38626567733006 0.33939485810484 0.00704594055517 6.941 6 Li 0.06713430537752 0.66744522449772 0.22589013018318 6.941 7 Li 0.33939485810484 0.38626567733006 0.50704594055517 6.941 8 Li 0.66744522449772 0.06713430537752 0.72589013018318 6.941 *9 B 0.94582462594197 0.23823846542166 0.14639434739413 10.811 10 B 0.23823846542166 0.94582462594197 0.64639434739413 10.811 11 B 0.76176153457834 0.05417537405803 0.35360565260587 10.811 12 B 0.05417537405803 0.76176153457834 0.85360565260587 10.811 *13 O 0.68739518959077 0.84423600562904 0.31094589989555 15.999 14 O 0.84423600562904 0.68739518959077 0.81094589989555 15.999 *15 O 0.73260205541466 0.32457217127718 0.00899741580029 15.999 *16 O 0.95717691085098 0.04282308914902 0.25000000000000 15.999 17 O 0.32457217127718 0.73260205541466 0.50899741580029 15.999 18 O 0.67542782872282 0.26739794458534 0.49100258419971 15.999 19 O 0.04282308914902 0.95717691085098 0.75000000000000 15.999 20 O 0.26739794458534 0.67542782872282 0.99100258419971 15.999 21 O 0.15576399437096 0.31260481040923 0.18905410010445 15.999 22 O 0.31260481040923 0.15576399437096 0.68905410010445 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 9.417391010093700 0.000000000000000 0.000000000000000 b 0.000000000000000 7.011250829999999 0.000000000000000 c -1.954674975436099 0.000000000000000 5.836365120456681 Atomic positions (fractional): *1 Li 0.63271023506238 0.30015545956010 0.27410986981682 6.941 > 1 *2 Li 0.63716973228255 0.97656459038739 0.49295405944483 6.941 > 2 3 Li 0.63271023506238 0.69984454043990 0.77410986981682 6.941 > 3 4 Li 0.63716973228255 0.02343540961261 0.99295405944483 6.941 > 4 5 Li 0.36283026771745 0.97656459038739 0.00704594055517 6.941 > 5 6 Li 0.36728976493762 0.30015545956010 0.22589013018318 6.941 > 6 7 Li 0.36283026771745 0.02343540961261 0.50704594055517 6.941 > 7 8 Li 0.36728976493762 0.69984454043990 0.72589013018318 6.941 > 8 9 Li 0.13271023506238 0.80015545956010 0.27410986981682 6.941 > 1 10 Li 0.13716973228255 0.47656459038739 0.49295405944483 6.941 > 2 11 Li 0.13271023506238 0.19984454043990 0.77410986981682 6.941 > 3 12 Li 0.13716973228255 0.52343540961261 0.99295405944483 6.941 > 4 13 Li 0.86283026771745 0.47656459038739 0.00704594055517 6.941 > 5 14 Li 0.86728976493762 0.80015545956010 0.22589013018318 6.941 > 6 15 Li 0.86283026771745 0.52343540961261 0.50704594055517 6.941 > 7 16 Li 0.86728976493762 0.19984454043990 0.72589013018318 6.941 > 8 *17 B 0.59203154568181 0.64620691973985 0.14639434739413 10.811 > 9 18 B 0.59203154568181 0.35379308026015 0.64639434739413 10.811 > 10 19 B 0.40796845431819 0.64620691973985 0.35360565260587 10.811 > 11 20 B 0.40796845431819 0.35379308026015 0.85360565260587 10.811 > 12 21 B 0.09203154568181 0.14620691973985 0.14639434739413 10.811 > 9 22 B 0.09203154568181 0.85379308026015 0.64639434739413 10.811 > 10 23 B 0.90796845431819 0.14620691973985 0.35360565260587 10.811 > 11 24 B 0.90796845431819 0.85379308026015 0.85360565260587 10.811 > 12 *25 O 0.76581559760991 0.07842040801913 0.31094589989555 15.999 > 13 26 O 0.76581559760991 0.92157959198087 0.81094589989555 15.999 > 14 *27 O 0.52858711334592 0.79598505793126 0.00899741580029 15.999 > 15 *28 O 0.50000000000000 0.54282308914902 0.25000000000000 15.999 > 16 29 O 0.52858711334592 0.20401494206874 0.50899741580029 15.999 > 17 30 O 0.47141288665408 0.79598505793126 0.49100258419971 15.999 > 18 31 O 0.50000000000000 0.45717691085098 0.75000000000000 15.999 > 19 32 O 0.47141288665408 0.20401494206874 0.99100258419971 15.999 > 20 33 O 0.23418440239009 0.07842040801913 0.18905410010445 15.999 > 21 34 O 0.23418440239009 0.92157959198087 0.68905410010445 15.999 > 22 35 O 0.26581559760991 0.57842040801913 0.31094589989555 15.999 > 13 36 O 0.26581559760991 0.42157959198087 0.81094589989555 15.999 > 14 37 O 0.02858711334592 0.29598505793126 0.00899741580029 15.999 > 15 38 O 0.00000000000000 0.04282308914902 0.25000000000000 15.999 > 16 39 O 0.02858711334592 0.70401494206874 0.50899741580029 15.999 > 17 40 O 0.97141288665408 0.29598505793126 0.49100258419971 15.999 > 18 41 O 0.00000000000000 0.95717691085098 0.75000000000000 15.999 > 19 42 O 0.97141288665408 0.70401494206874 0.99100258419971 15.999 > 20 43 O 0.73418440239009 0.57842040801913 0.18905410010445 15.999 > 21 44 O 0.73418440239009 0.42157959198087 0.68905410010445 15.999 > 22 -------------------------------- super cell -------------------------------- Lattice vectors: a 9.417391010093700 0.000000000000000 0.000000000000000 b 0.000000000000000 7.011250829999999 0.000000000000000 c -3.909349950872198 0.000000000000000 11.672730240913362 Atomic positions (fractional): *1 Li 0.63271023506238 0.30015545956010 0.13705493490841 6.941 > 1 2 Li 0.63271023506238 0.30015545956010 0.63705493490841 6.941 > 1 *3 Li 0.63716973228255 0.97656459038739 0.24647702972241 6.941 > 2 4 Li 0.63716973228255 0.97656459038739 0.74647702972241 6.941 > 2 5 Li 0.63271023506238 0.69984454043990 0.38705493490841 6.941 > 3 6 Li 0.63271023506238 0.69984454043990 0.88705493490841 6.941 > 3 7 Li 0.63716973228255 0.02343540961261 0.49647702972241 6.941 > 4 8 Li 0.63716973228255 0.02343540961261 0.99647702972241 6.941 > 4 9 Li 0.36283026771745 0.97656459038739 0.00352297027759 6.941 > 5 10 Li 0.36283026771745 0.97656459038739 0.50352297027759 6.941 > 5 11 Li 0.36728976493762 0.30015545956010 0.11294506509159 6.941 > 6 12 Li 0.36728976493762 0.30015545956010 0.61294506509159 6.941 > 6 13 Li 0.36283026771745 0.02343540961261 0.25352297027759 6.941 > 7 14 Li 0.36283026771745 0.02343540961261 0.75352297027759 6.941 > 7 15 Li 0.36728976493762 0.69984454043990 0.36294506509159 6.941 > 8 16 Li 0.36728976493762 0.69984454043990 0.86294506509159 6.941 > 8 17 Li 0.13271023506238 0.80015545956010 0.13705493490841 6.941 > 1 18 Li 0.13271023506238 0.80015545956010 0.63705493490841 6.941 > 1 19 Li 0.13716973228255 0.47656459038739 0.24647702972241 6.941 > 2 20 Li 0.13716973228255 0.47656459038739 0.74647702972241 6.941 > 2 21 Li 0.13271023506238 0.19984454043990 0.38705493490841 6.941 > 3 22 Li 0.13271023506238 0.19984454043990 0.88705493490841 6.941 > 3 23 Li 0.13716973228255 0.52343540961261 0.49647702972241 6.941 > 4 24 Li 0.13716973228255 0.52343540961261 0.99647702972241 6.941 > 4 25 Li 0.86283026771745 0.47656459038739 0.00352297027759 6.941 > 5 26 Li 0.86283026771745 0.47656459038739 0.50352297027759 6.941 > 5 27 Li 0.86728976493762 0.80015545956010 0.11294506509159 6.941 > 6 28 Li 0.86728976493762 0.80015545956010 0.61294506509159 6.941 > 6 29 Li 0.86283026771745 0.52343540961261 0.25352297027759 6.941 > 7 30 Li 0.86283026771745 0.52343540961261 0.75352297027759 6.941 > 7 31 Li 0.86728976493762 0.19984454043990 0.36294506509159 6.941 > 8 32 Li 0.86728976493762 0.19984454043990 0.86294506509159 6.941 > 8 *33 B 0.59203154568181 0.64620691973985 0.07319717369707 10.811 > 9 34 B 0.59203154568181 0.64620691973985 0.57319717369707 10.811 > 9 35 B 0.59203154568181 0.35379308026015 0.32319717369707 10.811 > 10 36 B 0.59203154568181 0.35379308026015 0.82319717369707 10.811 > 10 37 B 0.40796845431819 0.64620691973985 0.17680282630293 10.811 > 11 38 B 0.40796845431819 0.64620691973985 0.67680282630293 10.811 > 11 39 B 0.40796845431819 0.35379308026015 0.42680282630293 10.811 > 12 40 B 0.40796845431819 0.35379308026015 0.92680282630293 10.811 > 12 41 B 0.09203154568181 0.14620691973985 0.07319717369707 10.811 > 9 42 B 0.09203154568181 0.14620691973985 0.57319717369707 10.811 > 9 43 B 0.09203154568181 0.85379308026015 0.32319717369707 10.811 > 10 44 B 0.09203154568181 0.85379308026015 0.82319717369707 10.811 > 10 45 B 0.90796845431819 0.14620691973985 0.17680282630293 10.811 > 11 46 B 0.90796845431819 0.14620691973985 0.67680282630293 10.811 > 11 47 B 0.90796845431819 0.85379308026015 0.42680282630293 10.811 > 12 48 B 0.90796845431819 0.85379308026015 0.92680282630293 10.811 > 12 *49 O 0.76581559760991 0.07842040801913 0.15547294994777 15.999 > 13 50 O 0.76581559760991 0.07842040801913 0.65547294994777 15.999 > 13 51 O 0.76581559760991 0.92157959198087 0.40547294994777 15.999 > 14 52 O 0.76581559760991 0.92157959198087 0.90547294994777 15.999 > 14 *53 O 0.52858711334592 0.79598505793126 0.00449870790015 15.999 > 15 54 O 0.52858711334592 0.79598505793126 0.50449870790015 15.999 > 15 *55 O 0.50000000000000 0.54282308914902 0.12500000000000 15.999 > 16 56 O 0.50000000000000 0.54282308914902 0.62500000000000 15.999 > 16 57 O 0.52858711334592 0.20401494206874 0.25449870790015 15.999 > 17 58 O 0.52858711334592 0.20401494206874 0.75449870790015 15.999 > 17 59 O 0.47141288665408 0.79598505793126 0.24550129209985 15.999 > 18 60 O 0.47141288665408 0.79598505793126 0.74550129209985 15.999 > 18 61 O 0.50000000000000 0.45717691085098 0.37500000000000 15.999 > 19 62 O 0.50000000000000 0.45717691085098 0.87500000000000 15.999 > 19 63 O 0.47141288665408 0.20401494206874 0.49550129209985 15.999 > 20 64 O 0.47141288665408 0.20401494206874 0.99550129209985 15.999 > 20 65 O 0.23418440239009 0.07842040801913 0.09452705005223 15.999 > 21 66 O 0.23418440239009 0.07842040801913 0.59452705005223 15.999 > 21 67 O 0.23418440239009 0.92157959198087 0.34452705005223 15.999 > 22 68 O 0.23418440239009 0.92157959198087 0.84452705005223 15.999 > 22 69 O 0.26581559760991 0.57842040801913 0.15547294994777 15.999 > 13 70 O 0.26581559760991 0.57842040801913 0.65547294994777 15.999 > 13 71 O 0.26581559760991 0.42157959198087 0.40547294994777 15.999 > 14 72 O 0.26581559760991 0.42157959198087 0.90547294994777 15.999 > 14 73 O 0.02858711334592 0.29598505793126 0.00449870790015 15.999 > 15 74 O 0.02858711334592 0.29598505793126 0.50449870790015 15.999 > 15 75 O 0.00000000000000 0.04282308914902 0.12500000000000 15.999 > 16 76 O 0.00000000000000 0.04282308914902 0.62500000000000 15.999 > 16 77 O 0.02858711334592 0.70401494206874 0.25449870790015 15.999 > 17 78 O 0.02858711334592 0.70401494206874 0.75449870790015 15.999 > 17 79 O 0.97141288665408 0.29598505793126 0.24550129209985 15.999 > 18 80 O 0.97141288665408 0.29598505793126 0.74550129209985 15.999 > 18 81 O 0.00000000000000 0.95717691085098 0.37500000000000 15.999 > 19 82 O 0.00000000000000 0.95717691085098 0.87500000000000 15.999 > 19 83 O 0.97141288665408 0.70401494206874 0.49550129209985 15.999 > 20 84 O 0.97141288665408 0.70401494206874 0.99550129209985 15.999 > 20 85 O 0.73418440239009 0.57842040801913 0.09452705005223 15.999 > 21 86 O 0.73418440239009 0.57842040801913 0.59452705005223 15.999 > 21 87 O 0.73418440239009 0.42157959198087 0.34452705005223 15.999 > 22 88 O 0.73418440239009 0.42157959198087 0.84452705005223 15.999 > 22 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.7661554 0.0000000 -0.0311310 0.0000000 2.6529060 0.0000000 -0.0311296 0.0000000 2.6512744 -------------------------- Born effective charges -------------------------- 1 Li 1.0100413 -0.1501964 0.0162390 -0.1068610 1.0269836 -0.0627279 0.0241110 -0.0326642 1.1054791 2 Li 1.1163344 0.0728445 0.0212887 0.0803668 1.1179229 -0.0413663 0.0163185 0.0334170 1.0089641 3 Li 1.0100413 0.1501964 0.0162390 0.1068610 1.0269836 0.0627279 0.0241110 0.0326642 1.1054791 4 Li 1.1163344 -0.0728445 0.0212887 -0.0803668 1.1179229 0.0413663 0.0163185 -0.0334170 1.0089641 5 Li 1.1163344 -0.0728445 0.0212887 -0.0803668 1.1179229 0.0413663 0.0163185 -0.0334170 1.0089641 6 Li 1.0100413 0.1501964 0.0162390 0.1068610 1.0269836 0.0627279 0.0241110 0.0326642 1.1054791 7 Li 1.1163344 0.0728445 0.0212887 0.0803668 1.1179229 -0.0413663 0.0163185 0.0334170 1.0089641 8 Li 1.0100413 -0.1501964 0.0162390 -0.1068610 1.0269836 -0.0627279 0.0241110 -0.0326642 1.1054791 9 B 2.5548645 -0.0311042 -0.1125047 -0.1157737 1.7223314 -0.6867663 -0.1863091 -0.7978900 1.4948168 10 B 2.5548645 0.0311042 -0.1125047 0.1157737 1.7223314 0.6867663 -0.1863091 0.7978900 1.4948168 11 B 2.5548645 0.0311042 -0.1125047 0.1157737 1.7223314 0.6867663 -0.1863091 0.7978900 1.4948168 12 B 2.5548645 -0.0311042 -0.1125047 -0.1157737 1.7223314 -0.6867663 -0.1863091 -0.7978900 1.4948168 13 O -2.1306567 -0.1990757 -0.1281289 -0.1996000 -1.3701808 -0.1281527 -0.1532006 -0.2101247 -1.3445232 14 O -2.1306567 0.1990757 -0.1281289 0.1996000 -1.3701808 0.1281527 -0.1532006 0.2101247 -1.3445232 15 O -1.4689239 0.1122948 -0.0960850 0.1828406 -1.8100897 0.3893831 -0.0982218 0.4269832 -1.5831588 16 O -2.1633190 0.0000000 0.5983816 0.0000000 -1.3739347 0.0000000 0.7946040 0.0000000 -1.3631560 17 O -1.4689239 -0.1122948 -0.0960850 -0.1828406 -1.8100897 -0.3893831 -0.0982218 -0.4269832 -1.5831588 18 O -1.4689239 -0.1122948 -0.0960850 -0.1828406 -1.8100897 -0.3893831 -0.0982218 -0.4269832 -1.5831588 19 O -2.1633190 0.0000000 0.5983816 0.0000000 -1.3739347 0.0000000 0.7946040 0.0000000 -1.3631560 20 O -1.4689239 0.1122948 -0.0960850 0.1828406 -1.8100897 0.3893831 -0.0982218 0.4269832 -1.5831588 21 O -2.1306567 0.1990757 -0.1281289 0.1996000 -1.3701808 0.1281527 -0.1532006 0.2101247 -1.3445232 22 O -2.1306567 -0.1990757 -0.1281289 -0.1996000 -1.3701808 -0.1281527 -0.1532006 -0.2101247 -1.3445232 ---------------------------------------------------------------------------- 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: 264/264 Permutation basis: 10398/10398 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2278 Number of blocks in projector: 2278 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: 486 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 482 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 482 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 276 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 276 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 276 Use standard eigh solver. Tree of FC basis block matrices: - (2278, 2229), data: False |-- (276, 270), data: True |-- (276, 270), data: True |-- (276, 270), data: True |-- (482, 472), data: True |-- (482, 472), data: True |-- (486, 475), data: True ----- Solver_atoms: 1 -- 88 / 88 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 720 - Time: 0.549 Solver_block: 200 / 720 - Time: 0.478 Solver_block: 300 / 720 - Time: 0.465 Solver_block: 400 / 720 - Time: 0.473 Solver_block: 500 / 720 - Time: 0.458 Solver_block: 600 / 720 - Time: 0.467 Solver_block: 700 / 720 - Time: 0.473 Solver_block: 720 / 720 - Time: 0.190 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 3.644 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 264/264 Permutation basis: 10398/10398 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2278 Number of blocks in projector: 2278 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: 486 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 482 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 482 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 276 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 276 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 276 Use standard eigh solver. Tree of FC basis block matrices: - (2278, 2229), data: False |-- (276, 270), data: True |-- (276, 270), data: True |-- (276, 270), data: True |-- (482, 472), data: True |-- (482, 472), data: True |-- (486, 475), 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 2026-01-09 01:18:31]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 01:18:32]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.708695505046850 -3.505625414999999 0.000000000000000 b 4.708695505046850 3.505625414999999 0.000000000000000 c -1.954674975436099 0.000000000000000 5.836365120456681 Atomic positions (fractional): 1 Li 0.33255477550228 0.93286569462248 0.27410986981682 6.941 2 Li 0.66060514189516 0.61373432266994 0.49295405944483 6.941 3 Li 0.93286569462249 0.33255477550228 0.77410986981682 6.941 4 Li 0.61373432266994 0.66060514189516 0.99295405944483 6.941 5 Li 0.38626567733006 0.33939485810484 0.00704594055517 6.941 6 Li 0.06713430537752 0.66744522449772 0.22589013018318 6.941 7 Li 0.33939485810484 0.38626567733006 0.50704594055517 6.941 8 Li 0.66744522449772 0.06713430537752 0.72589013018318 6.941 9 B 0.94582462594197 0.23823846542166 0.14639434739413 10.811 10 B 0.23823846542166 0.94582462594197 0.64639434739413 10.811 11 B 0.76176153457834 0.05417537405803 0.35360565260587 10.811 12 B 0.05417537405803 0.76176153457834 0.85360565260587 10.811 13 O 0.68739518959077 0.84423600562904 0.31094589989555 15.999 14 O 0.84423600562904 0.68739518959077 0.81094589989555 15.999 15 O 0.73260205541466 0.32457217127718 0.00899741580029 15.999 16 O 0.95717691085098 0.04282308914902 0.25000000000000 15.999 17 O 0.32457217127718 0.73260205541466 0.50899741580029 15.999 18 O 0.67542782872282 0.26739794458534 0.49100258419971 15.999 19 O 0.04282308914902 0.95717691085098 0.75000000000000 15.999 20 O 0.26739794458534 0.67542782872282 0.99100258419971 15.999 21 O 0.15576399437096 0.31260481040923 0.18905410010445 15.999 22 O 0.31260481040923 0.15576399437096 0.68905410010445 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.417391010093700 0.000000000000000 0.000000000000000 b 0.000000000000000 7.011250829999999 0.000000000000000 c -3.909349950872198 0.000000000000000 11.672730240913362 Atomic positions (fractional): 1 Li 0.63271023506238 0.30015545956010 0.13705493490841 6.941 > 1 2 Li 0.63271023506238 0.30015545956010 0.63705493490841 6.941 > 1 3 Li 0.63716973228255 0.97656459038739 0.24647702972241 6.941 > 3 4 Li 0.63716973228255 0.97656459038739 0.74647702972241 6.941 > 3 5 Li 0.63271023506238 0.69984454043990 0.38705493490841 6.941 > 5 6 Li 0.63271023506238 0.69984454043990 0.88705493490841 6.941 > 5 7 Li 0.63716973228255 0.02343540961261 0.49647702972241 6.941 > 7 8 Li 0.63716973228255 0.02343540961261 0.99647702972241 6.941 > 7 9 Li 0.36283026771745 0.97656459038739 0.00352297027759 6.941 > 9 10 Li 0.36283026771745 0.97656459038739 0.50352297027759 6.941 > 9 11 Li 0.36728976493762 0.30015545956010 0.11294506509159 6.941 > 11 12 Li 0.36728976493762 0.30015545956010 0.61294506509159 6.941 > 11 13 Li 0.36283026771745 0.02343540961261 0.25352297027759 6.941 > 13 14 Li 0.36283026771745 0.02343540961261 0.75352297027759 6.941 > 13 15 Li 0.36728976493762 0.69984454043990 0.36294506509159 6.941 > 15 16 Li 0.36728976493762 0.69984454043990 0.86294506509159 6.941 > 15 17 Li 0.13271023506238 0.80015545956010 0.13705493490841 6.941 > 1 18 Li 0.13271023506238 0.80015545956010 0.63705493490841 6.941 > 1 19 Li 0.13716973228255 0.47656459038739 0.24647702972241 6.941 > 3 20 Li 0.13716973228255 0.47656459038739 0.74647702972241 6.941 > 3 21 Li 0.13271023506238 0.19984454043990 0.38705493490841 6.941 > 5 22 Li 0.13271023506238 0.19984454043990 0.88705493490841 6.941 > 5 23 Li 0.13716973228255 0.52343540961261 0.49647702972241 6.941 > 7 24 Li 0.13716973228255 0.52343540961261 0.99647702972241 6.941 > 7 25 Li 0.86283026771745 0.47656459038739 0.00352297027759 6.941 > 9 26 Li 0.86283026771745 0.47656459038739 0.50352297027759 6.941 > 9 27 Li 0.86728976493762 0.80015545956010 0.11294506509159 6.941 > 11 28 Li 0.86728976493762 0.80015545956010 0.61294506509159 6.941 > 11 29 Li 0.86283026771745 0.52343540961261 0.25352297027759 6.941 > 13 30 Li 0.86283026771745 0.52343540961261 0.75352297027759 6.941 > 13 31 Li 0.86728976493762 0.19984454043990 0.36294506509159 6.941 > 15 32 Li 0.86728976493762 0.19984454043990 0.86294506509159 6.941 > 15 33 B 0.59203154568181 0.64620691973985 0.07319717369707 10.811 > 33 34 B 0.59203154568181 0.64620691973985 0.57319717369707 10.811 > 33 35 B 0.59203154568181 0.35379308026015 0.32319717369707 10.811 > 35 36 B 0.59203154568181 0.35379308026015 0.82319717369707 10.811 > 35 37 B 0.40796845431819 0.64620691973985 0.17680282630293 10.811 > 37 38 B 0.40796845431819 0.64620691973985 0.67680282630293 10.811 > 37 39 B 0.40796845431819 0.35379308026015 0.42680282630293 10.811 > 39 40 B 0.40796845431819 0.35379308026015 0.92680282630293 10.811 > 39 41 B 0.09203154568181 0.14620691973985 0.07319717369707 10.811 > 33 42 B 0.09203154568181 0.14620691973985 0.57319717369707 10.811 > 33 43 B 0.09203154568181 0.85379308026015 0.32319717369707 10.811 > 35 44 B 0.09203154568181 0.85379308026015 0.82319717369707 10.811 > 35 45 B 0.90796845431819 0.14620691973985 0.17680282630293 10.811 > 37 46 B 0.90796845431819 0.14620691973985 0.67680282630293 10.811 > 37 47 B 0.90796845431819 0.85379308026015 0.42680282630293 10.811 > 39 48 B 0.90796845431819 0.85379308026015 0.92680282630293 10.811 > 39 49 O 0.76581559760991 0.07842040801913 0.15547294994777 15.999 > 49 50 O 0.76581559760991 0.07842040801913 0.65547294994777 15.999 > 49 51 O 0.76581559760991 0.92157959198087 0.40547294994777 15.999 > 51 52 O 0.76581559760991 0.92157959198087 0.90547294994777 15.999 > 51 53 O 0.52858711334592 0.79598505793126 0.00449870790015 15.999 > 53 54 O 0.52858711334592 0.79598505793126 0.50449870790015 15.999 > 53 55 O 0.50000000000000 0.54282308914902 0.12500000000000 15.999 > 55 56 O 0.50000000000000 0.54282308914902 0.62500000000000 15.999 > 55 57 O 0.52858711334592 0.20401494206874 0.25449870790015 15.999 > 57 58 O 0.52858711334592 0.20401494206874 0.75449870790015 15.999 > 57 59 O 0.47141288665408 0.79598505793126 0.24550129209985 15.999 > 59 60 O 0.47141288665408 0.79598505793126 0.74550129209985 15.999 > 59 61 O 0.50000000000000 0.45717691085098 0.37500000000000 15.999 > 61 62 O 0.50000000000000 0.45717691085098 0.87500000000000 15.999 > 61 63 O 0.47141288665408 0.20401494206874 0.49550129209985 15.999 > 63 64 O 0.47141288665408 0.20401494206874 0.99550129209985 15.999 > 63 65 O 0.23418440239009 0.07842040801913 0.09452705005223 15.999 > 65 66 O 0.23418440239009 0.07842040801913 0.59452705005223 15.999 > 65 67 O 0.23418440239009 0.92157959198087 0.34452705005223 15.999 > 67 68 O 0.23418440239009 0.92157959198087 0.84452705005223 15.999 > 67 69 O 0.26581559760991 0.57842040801913 0.15547294994777 15.999 > 49 70 O 0.26581559760991 0.57842040801913 0.65547294994777 15.999 > 49 71 O 0.26581559760991 0.42157959198087 0.40547294994777 15.999 > 51 72 O 0.26581559760991 0.42157959198087 0.90547294994777 15.999 > 51 73 O 0.02858711334592 0.29598505793126 0.00449870790015 15.999 > 53 74 O 0.02858711334592 0.29598505793126 0.50449870790015 15.999 > 53 75 O 0.00000000000000 0.04282308914902 0.12500000000000 15.999 > 55 76 O 0.00000000000000 0.04282308914902 0.62500000000000 15.999 > 55 77 O 0.02858711334592 0.70401494206874 0.25449870790015 15.999 > 57 78 O 0.02858711334592 0.70401494206874 0.75449870790015 15.999 > 57 79 O 0.97141288665408 0.29598505793126 0.24550129209985 15.999 > 59 80 O 0.97141288665408 0.29598505793126 0.74550129209985 15.999 > 59 81 O 0.00000000000000 0.95717691085098 0.37500000000000 15.999 > 61 82 O 0.00000000000000 0.95717691085098 0.87500000000000 15.999 > 61 83 O 0.97141288665408 0.70401494206874 0.49550129209985 15.999 > 63 84 O 0.97141288665408 0.70401494206874 0.99550129209985 15.999 > 63 85 O 0.73418440239009 0.57842040801913 0.09452705005223 15.999 > 65 86 O 0.73418440239009 0.57842040801913 0.59452705005223 15.999 > 65 87 O 0.73418440239009 0.42157959198087 0.34452705005223 15.999 > 67 88 O 0.73418440239009 0.42157959198087 0.84452705005223 15.999 > 67 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.7661554 0.0000000 -0.0311310 0.0000000 2.6529060 0.0000000 -0.0311296 0.0000000 2.6512744 -------------------------- Born effective charges -------------------------- 1 Li 1.0100413 -0.1501964 0.0162390 -0.1068610 1.0269836 -0.0627279 0.0241110 -0.0326642 1.1054791 2 Li 1.1163344 0.0728445 0.0212887 0.0803668 1.1179229 -0.0413663 0.0163185 0.0334170 1.0089641 3 Li 1.0100413 0.1501964 0.0162390 0.1068610 1.0269836 0.0627279 0.0241110 0.0326642 1.1054791 4 Li 1.1163344 -0.0728445 0.0212887 -0.0803668 1.1179229 0.0413663 0.0163185 -0.0334170 1.0089641 5 Li 1.1163344 -0.0728445 0.0212887 -0.0803668 1.1179229 0.0413663 0.0163185 -0.0334170 1.0089641 6 Li 1.0100413 0.1501964 0.0162390 0.1068610 1.0269836 0.0627279 0.0241110 0.0326642 1.1054791 7 Li 1.1163344 0.0728445 0.0212887 0.0803668 1.1179229 -0.0413663 0.0163185 0.0334170 1.0089641 8 Li 1.0100413 -0.1501964 0.0162390 -0.1068610 1.0269836 -0.0627279 0.0241110 -0.0326642 1.1054791 9 B 2.5548645 -0.0311042 -0.1125047 -0.1157737 1.7223314 -0.6867663 -0.1863091 -0.7978900 1.4948168 10 B 2.5548645 0.0311042 -0.1125047 0.1157737 1.7223314 0.6867663 -0.1863091 0.7978900 1.4948168 11 B 2.5548645 0.0311042 -0.1125047 0.1157737 1.7223314 0.6867663 -0.1863091 0.7978900 1.4948168 12 B 2.5548645 -0.0311042 -0.1125047 -0.1157737 1.7223314 -0.6867663 -0.1863091 -0.7978900 1.4948168 13 O -2.1306567 -0.1990757 -0.1281289 -0.1996000 -1.3701808 -0.1281527 -0.1532006 -0.2101247 -1.3445232 14 O -2.1306567 0.1990757 -0.1281289 0.1996000 -1.3701808 0.1281527 -0.1532006 0.2101247 -1.3445232 15 O -1.4689239 0.1122948 -0.0960850 0.1828406 -1.8100897 0.3893831 -0.0982218 0.4269832 -1.5831588 16 O -2.1633190 0.0000000 0.5983816 0.0000000 -1.3739347 0.0000000 0.7946040 0.0000000 -1.3631560 17 O -1.4689239 -0.1122948 -0.0960850 -0.1828406 -1.8100897 -0.3893831 -0.0982218 -0.4269832 -1.5831588 18 O -1.4689239 -0.1122948 -0.0960850 -0.1828406 -1.8100897 -0.3893831 -0.0982218 -0.4269832 -1.5831588 19 O -2.1633190 0.0000000 0.5983816 0.0000000 -1.3739347 0.0000000 0.7946040 0.0000000 -1.3631560 20 O -1.4689239 0.1122948 -0.0960850 0.1828406 -1.8100897 0.3893831 -0.0982218 0.4269832 -1.5831588 21 O -2.1306567 0.1990757 -0.1281289 0.1996000 -1.3701808 0.1281527 -0.1532006 0.2101247 -1.3445232 22 O -2.1306567 -0.1990757 -0.1281289 -0.1996000 -1.3701808 -0.1281527 -0.1532006 -0.2101247 -1.3445232 ---------------------------------------------------------------------------- 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] [-0.0032 0.0000 0.0095] [ 0.0032 0.0000 -0.0095] Computing fc3[ 3, 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] [-0.0032 0.0000 0.0095] [ 0.0032 0.0000 -0.0095] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0032 0.0000 0.0095] [ 0.0032 0.0000 -0.0095] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0032 0.0000 0.0095] [ 0.0032 0.0000 -0.0095] Computing fc3[ 53, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0032 0.0000 0.0095] [ 0.0032 0.0000 -0.0095] Computing fc3[ 55, 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] [-0.0032 0.0000 0.0095] [ 0.0032 0.0000 -0.0095] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000003 (yyy) 0.00000003 (yyy) 0.00000003 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000001 (yz) 0.00000001 (yz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 01:18:50]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 01:18:50]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.708695505046850 -3.505625414999999 0.000000000000000 b 4.708695505046850 3.505625414999999 0.000000000000000 c -1.954674975436099 0.000000000000000 5.836365120456681 Atomic positions (fractional): 1 Li 0.33255477550228 0.93286569462248 0.27410986981682 6.941 2 Li 0.66060514189516 0.61373432266994 0.49295405944483 6.941 3 Li 0.93286569462249 0.33255477550228 0.77410986981682 6.941 4 Li 0.61373432266994 0.66060514189516 0.99295405944483 6.941 5 Li 0.38626567733006 0.33939485810484 0.00704594055517 6.941 6 Li 0.06713430537752 0.66744522449772 0.22589013018318 6.941 7 Li 0.33939485810484 0.38626567733006 0.50704594055517 6.941 8 Li 0.66744522449772 0.06713430537752 0.72589013018318 6.941 9 B 0.94582462594197 0.23823846542166 0.14639434739413 10.811 10 B 0.23823846542166 0.94582462594197 0.64639434739413 10.811 11 B 0.76176153457834 0.05417537405803 0.35360565260587 10.811 12 B 0.05417537405803 0.76176153457834 0.85360565260587 10.811 13 O 0.68739518959077 0.84423600562904 0.31094589989555 15.999 14 O 0.84423600562904 0.68739518959077 0.81094589989555 15.999 15 O 0.73260205541466 0.32457217127718 0.00899741580029 15.999 16 O 0.95717691085098 0.04282308914902 0.25000000000000 15.999 17 O 0.32457217127718 0.73260205541466 0.50899741580029 15.999 18 O 0.67542782872282 0.26739794458534 0.49100258419971 15.999 19 O 0.04282308914902 0.95717691085098 0.75000000000000 15.999 20 O 0.26739794458534 0.67542782872282 0.99100258419971 15.999 21 O 0.15576399437096 0.31260481040923 0.18905410010445 15.999 22 O 0.31260481040923 0.15576399437096 0.68905410010445 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.417391010093700 0.000000000000000 0.000000000000000 b 0.000000000000000 7.011250829999999 0.000000000000000 c -3.909349950872198 0.000000000000000 11.672730240913362 Atomic positions (fractional): 1 Li 0.63271023506238 0.30015545956010 0.13705493490841 6.941 > 1 2 Li 0.63271023506238 0.30015545956010 0.63705493490841 6.941 > 1 3 Li 0.63716973228255 0.97656459038739 0.24647702972241 6.941 > 3 4 Li 0.63716973228255 0.97656459038739 0.74647702972241 6.941 > 3 5 Li 0.63271023506238 0.69984454043990 0.38705493490841 6.941 > 5 6 Li 0.63271023506238 0.69984454043990 0.88705493490841 6.941 > 5 7 Li 0.63716973228255 0.02343540961261 0.49647702972241 6.941 > 7 8 Li 0.63716973228255 0.02343540961261 0.99647702972241 6.941 > 7 9 Li 0.36283026771745 0.97656459038739 0.00352297027759 6.941 > 9 10 Li 0.36283026771745 0.97656459038739 0.50352297027759 6.941 > 9 11 Li 0.36728976493762 0.30015545956010 0.11294506509159 6.941 > 11 12 Li 0.36728976493762 0.30015545956010 0.61294506509159 6.941 > 11 13 Li 0.36283026771745 0.02343540961261 0.25352297027759 6.941 > 13 14 Li 0.36283026771745 0.02343540961261 0.75352297027759 6.941 > 13 15 Li 0.36728976493762 0.69984454043990 0.36294506509159 6.941 > 15 16 Li 0.36728976493762 0.69984454043990 0.86294506509159 6.941 > 15 17 Li 0.13271023506238 0.80015545956010 0.13705493490841 6.941 > 1 18 Li 0.13271023506238 0.80015545956010 0.63705493490841 6.941 > 1 19 Li 0.13716973228255 0.47656459038739 0.24647702972241 6.941 > 3 20 Li 0.13716973228255 0.47656459038739 0.74647702972241 6.941 > 3 21 Li 0.13271023506238 0.19984454043990 0.38705493490841 6.941 > 5 22 Li 0.13271023506238 0.19984454043990 0.88705493490841 6.941 > 5 23 Li 0.13716973228255 0.52343540961261 0.49647702972241 6.941 > 7 24 Li 0.13716973228255 0.52343540961261 0.99647702972241 6.941 > 7 25 Li 0.86283026771745 0.47656459038739 0.00352297027759 6.941 > 9 26 Li 0.86283026771745 0.47656459038739 0.50352297027759 6.941 > 9 27 Li 0.86728976493762 0.80015545956010 0.11294506509159 6.941 > 11 28 Li 0.86728976493762 0.80015545956010 0.61294506509159 6.941 > 11 29 Li 0.86283026771745 0.52343540961261 0.25352297027759 6.941 > 13 30 Li 0.86283026771745 0.52343540961261 0.75352297027759 6.941 > 13 31 Li 0.86728976493762 0.19984454043990 0.36294506509159 6.941 > 15 32 Li 0.86728976493762 0.19984454043990 0.86294506509159 6.941 > 15 33 B 0.59203154568181 0.64620691973985 0.07319717369707 10.811 > 33 34 B 0.59203154568181 0.64620691973985 0.57319717369707 10.811 > 33 35 B 0.59203154568181 0.35379308026015 0.32319717369707 10.811 > 35 36 B 0.59203154568181 0.35379308026015 0.82319717369707 10.811 > 35 37 B 0.40796845431819 0.64620691973985 0.17680282630293 10.811 > 37 38 B 0.40796845431819 0.64620691973985 0.67680282630293 10.811 > 37 39 B 0.40796845431819 0.35379308026015 0.42680282630293 10.811 > 39 40 B 0.40796845431819 0.35379308026015 0.92680282630293 10.811 > 39 41 B 0.09203154568181 0.14620691973985 0.07319717369707 10.811 > 33 42 B 0.09203154568181 0.14620691973985 0.57319717369707 10.811 > 33 43 B 0.09203154568181 0.85379308026015 0.32319717369707 10.811 > 35 44 B 0.09203154568181 0.85379308026015 0.82319717369707 10.811 > 35 45 B 0.90796845431819 0.14620691973985 0.17680282630293 10.811 > 37 46 B 0.90796845431819 0.14620691973985 0.67680282630293 10.811 > 37 47 B 0.90796845431819 0.85379308026015 0.42680282630293 10.811 > 39 48 B 0.90796845431819 0.85379308026015 0.92680282630293 10.811 > 39 49 O 0.76581559760991 0.07842040801913 0.15547294994777 15.999 > 49 50 O 0.76581559760991 0.07842040801913 0.65547294994777 15.999 > 49 51 O 0.76581559760991 0.92157959198087 0.40547294994777 15.999 > 51 52 O 0.76581559760991 0.92157959198087 0.90547294994777 15.999 > 51 53 O 0.52858711334592 0.79598505793126 0.00449870790015 15.999 > 53 54 O 0.52858711334592 0.79598505793126 0.50449870790015 15.999 > 53 55 O 0.50000000000000 0.54282308914902 0.12500000000000 15.999 > 55 56 O 0.50000000000000 0.54282308914902 0.62500000000000 15.999 > 55 57 O 0.52858711334592 0.20401494206874 0.25449870790015 15.999 > 57 58 O 0.52858711334592 0.20401494206874 0.75449870790015 15.999 > 57 59 O 0.47141288665408 0.79598505793126 0.24550129209985 15.999 > 59 60 O 0.47141288665408 0.79598505793126 0.74550129209985 15.999 > 59 61 O 0.50000000000000 0.45717691085098 0.37500000000000 15.999 > 61 62 O 0.50000000000000 0.45717691085098 0.87500000000000 15.999 > 61 63 O 0.47141288665408 0.20401494206874 0.49550129209985 15.999 > 63 64 O 0.47141288665408 0.20401494206874 0.99550129209985 15.999 > 63 65 O 0.23418440239009 0.07842040801913 0.09452705005223 15.999 > 65 66 O 0.23418440239009 0.07842040801913 0.59452705005223 15.999 > 65 67 O 0.23418440239009 0.92157959198087 0.34452705005223 15.999 > 67 68 O 0.23418440239009 0.92157959198087 0.84452705005223 15.999 > 67 69 O 0.26581559760991 0.57842040801913 0.15547294994777 15.999 > 49 70 O 0.26581559760991 0.57842040801913 0.65547294994777 15.999 > 49 71 O 0.26581559760991 0.42157959198087 0.40547294994777 15.999 > 51 72 O 0.26581559760991 0.42157959198087 0.90547294994777 15.999 > 51 73 O 0.02858711334592 0.29598505793126 0.00449870790015 15.999 > 53 74 O 0.02858711334592 0.29598505793126 0.50449870790015 15.999 > 53 75 O 0.00000000000000 0.04282308914902 0.12500000000000 15.999 > 55 76 O 0.00000000000000 0.04282308914902 0.62500000000000 15.999 > 55 77 O 0.02858711334592 0.70401494206874 0.25449870790015 15.999 > 57 78 O 0.02858711334592 0.70401494206874 0.75449870790015 15.999 > 57 79 O 0.97141288665408 0.29598505793126 0.24550129209985 15.999 > 59 80 O 0.97141288665408 0.29598505793126 0.74550129209985 15.999 > 59 81 O 0.00000000000000 0.95717691085098 0.37500000000000 15.999 > 61 82 O 0.00000000000000 0.95717691085098 0.87500000000000 15.999 > 61 83 O 0.97141288665408 0.70401494206874 0.49550129209985 15.999 > 63 84 O 0.97141288665408 0.70401494206874 0.99550129209985 15.999 > 63 85 O 0.73418440239009 0.57842040801913 0.09452705005223 15.999 > 65 86 O 0.73418440239009 0.57842040801913 0.59452705005223 15.999 > 65 87 O 0.73418440239009 0.42157959198087 0.34452705005223 15.999 > 67 88 O 0.73418440239009 0.42157959198087 0.84452705005223 15.999 > 67 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.7661554 0.0000000 -0.0311310 0.0000000 2.6529060 0.0000000 -0.0311296 0.0000000 2.6512744 -------------------------- Born effective charges -------------------------- 1 Li 1.0100413 -0.1501964 0.0162390 -0.1068610 1.0269836 -0.0627279 0.0241110 -0.0326642 1.1054791 2 Li 1.1163344 0.0728445 0.0212887 0.0803668 1.1179229 -0.0413663 0.0163185 0.0334170 1.0089641 3 Li 1.0100413 0.1501964 0.0162390 0.1068610 1.0269836 0.0627279 0.0241110 0.0326642 1.1054791 4 Li 1.1163344 -0.0728445 0.0212887 -0.0803668 1.1179229 0.0413663 0.0163185 -0.0334170 1.0089641 5 Li 1.1163344 -0.0728445 0.0212887 -0.0803668 1.1179229 0.0413663 0.0163185 -0.0334170 1.0089641 6 Li 1.0100413 0.1501964 0.0162390 0.1068610 1.0269836 0.0627279 0.0241110 0.0326642 1.1054791 7 Li 1.1163344 0.0728445 0.0212887 0.0803668 1.1179229 -0.0413663 0.0163185 0.0334170 1.0089641 8 Li 1.0100413 -0.1501964 0.0162390 -0.1068610 1.0269836 -0.0627279 0.0241110 -0.0326642 1.1054791 9 B 2.5548645 -0.0311042 -0.1125047 -0.1157737 1.7223314 -0.6867663 -0.1863091 -0.7978900 1.4948168 10 B 2.5548645 0.0311042 -0.1125047 0.1157737 1.7223314 0.6867663 -0.1863091 0.7978900 1.4948168 11 B 2.5548645 0.0311042 -0.1125047 0.1157737 1.7223314 0.6867663 -0.1863091 0.7978900 1.4948168 12 B 2.5548645 -0.0311042 -0.1125047 -0.1157737 1.7223314 -0.6867663 -0.1863091 -0.7978900 1.4948168 13 O -2.1306567 -0.1990757 -0.1281289 -0.1996000 -1.3701808 -0.1281527 -0.1532006 -0.2101247 -1.3445232 14 O -2.1306567 0.1990757 -0.1281289 0.1996000 -1.3701808 0.1281527 -0.1532006 0.2101247 -1.3445232 15 O -1.4689239 0.1122948 -0.0960850 0.1828406 -1.8100897 0.3893831 -0.0982218 0.4269832 -1.5831588 16 O -2.1633190 0.0000000 0.5983816 0.0000000 -1.3739347 0.0000000 0.7946040 0.0000000 -1.3631560 17 O -1.4689239 -0.1122948 -0.0960850 -0.1828406 -1.8100897 -0.3893831 -0.0982218 -0.4269832 -1.5831588 18 O -1.4689239 -0.1122948 -0.0960850 -0.1828406 -1.8100897 -0.3893831 -0.0982218 -0.4269832 -1.5831588 19 O -2.1633190 0.0000000 0.5983816 0.0000000 -1.3739347 0.0000000 0.7946040 0.0000000 -1.3631560 20 O -1.4689239 0.1122948 -0.0960850 0.1828406 -1.8100897 0.3893831 -0.0982218 0.4269832 -1.5831588 21 O -2.1306567 0.1990757 -0.1281289 0.1996000 -1.3701808 0.1281527 -0.1532006 0.2101247 -1.3445232 22 O -2.1306567 -0.1990757 -0.1281289 -0.1996000 -1.3701808 -0.1281527 -0.1532006 -0.2101247 -1.3445232 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000003 (yyy) 0.00000003 (yyy) 0.00000003 (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 ... [ 9 9 9 ] 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: 0.72, Number of G-points: 303, Lambda: 0.12 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/205) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 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 3.804 ( 0.000 0.000 0.000) 0.000 4.458 ( 0.000 0.000 0.000) 0.000 4.704 ( 0.000 0.000 0.000) 0.000 5.262 ( 0.000 0.000 0.000) 0.000 5.758 ( 0.000 0.000 0.000) 0.000 6.192 ( 0.000 0.000 0.000) 0.000 6.231 ( 0.000 0.000 0.000) 0.000 6.302 ( 0.000 0.000 0.000) 0.000 6.520 ( 0.000 0.000 0.000) 0.000 7.269 ( 0.000 0.000 0.000) 0.000 7.390 ( 0.000 0.000 0.000) 0.000 7.912 ( 0.000 0.000 0.000) 0.000 7.988 ( 0.000 0.000 0.000) 0.000 8.009 ( 0.000 0.000 0.000) 0.000 8.240 ( 0.000 0.000 0.000) 0.000 8.439 ( 0.000 0.000 0.000) 0.000 8.517 ( 0.000 0.000 0.000) 0.000 9.178 ( 0.000 0.000 0.000) 0.000 9.202 ( 0.000 0.000 0.000) 0.000 9.521 ( 0.000 0.000 0.000) 0.000 9.571 ( 0.000 0.000 0.000) 0.000 9.785 ( 0.000 0.000 0.000) 0.000 10.493 ( 0.000 0.000 0.000) 0.000 10.529 ( 0.000 0.000 0.000) 0.000 10.709 ( 0.000 0.000 0.000) 0.000 11.551 ( 0.000 0.000 0.000) 0.000 11.660 ( 0.000 0.000 0.000) 0.000 11.886 ( 0.000 0.000 0.000) 0.000 11.958 ( 0.000 0.000 0.000) 0.000 12.391 ( 0.000 0.000 0.000) 0.000 12.503 ( 0.000 0.000 0.000) 0.000 12.945 ( 0.000 0.000 0.000) 0.000 13.154 ( 0.000 0.000 0.000) 0.000 13.548 ( 0.000 0.000 0.000) 0.000 13.763 ( 0.000 0.000 0.000) 0.000 14.480 ( 0.000 0.000 0.000) 0.000 14.634 ( 0.000 0.000 0.000) 0.000 14.970 ( 0.000 0.000 0.000) 0.000 15.255 ( 0.000 0.000 0.000) 0.000 15.340 ( 0.000 0.000 0.000) 0.000 15.366 ( 0.000 0.000 0.000) 0.000 15.977 ( 0.000 0.000 0.000) 0.000 16.354 ( 0.000 0.000 0.000) 0.000 17.937 ( 0.000 0.000 0.000) 0.000 18.311 ( 0.000 0.000 0.000) 0.000 18.382 ( 0.000 0.000 0.000) 0.000 18.874 ( 0.000 0.000 0.000) 0.000 19.845 ( 0.000 0.000 0.000) 0.000 21.212 ( 0.000 0.000 0.000) 0.000 21.368 ( 0.000 0.000 0.000) 0.000 21.551 ( 0.000 0.000 0.000) 0.000 24.981 ( 0.000 0.000 0.000) 0.000 25.315 ( 0.000 0.000 0.000) 0.000 28.842 ( 0.000 0.000 0.000) 0.000 29.115 ( 0.000 0.000 0.000) 0.000 33.918 ( 0.000 0.000 0.000) 0.000 34.046 ( 0.000 0.000 0.000) 0.000 37.408 ( 0.000 0.000 0.000) 0.000 37.901 ( 0.000 0.000 0.000) 0.000 40.666 ( 0.000 0.000 0.000) 0.000 41.023 ( 0.000 0.000 0.000) 0.000 41.064 ( 0.000 0.000 0.000) 0.000 41.811 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/205) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.856 ( 29.684 -32.080 -4.813) 43.971 1.109 ( 52.985 -28.626 3.145) 60.305 1.509 ( 34.968 -59.441 28.052) 74.451 3.839 ( 3.116 -2.519 -2.036) 4.495 4.418 ( -2.171 4.316 -0.813) 4.899 4.654 ( 3.921 9.495 4.867) 11.367 5.207 ( -2.637 4.488 -3.277) 6.151 5.819 ( -5.275 -6.058 1.627) 8.196 6.043 ( -0.945 10.241 -0.674) 10.306 6.204 ( 1.792 15.134 -4.841) 15.990 6.368 ( -3.180 -8.177 -3.938) 9.617 6.590 ( 5.540 -1.445 -2.947) 6.439 7.114 ( -2.616 12.348 3.952) 13.226 7.314 ( -2.537 4.823 -4.405) 7.008 7.867 ( -20.453 -4.728 -11.196) 23.792 7.975 ( 7.539 13.885 1.955) 15.920 8.196 ( -4.989 -12.043 7.254) 14.918 8.394 ( 5.314 4.919 -6.607) 9.802 8.527 ( 6.250 -6.387 -0.926) 8.984 8.640 ( 10.335 0.324 6.260) 12.088 9.145 ( 5.541 8.524 -2.585) 10.491 9.212 ( 1.116 -1.249 -2.145) 2.721 9.500 ( -3.233 4.304 -1.633) 5.626 9.748 ( -1.236 -5.870 -21.874) 22.681 10.214 ( -35.113 -14.457 31.250) 49.178 10.537 ( -0.454 1.953 -1.029) 2.254 10.685 ( -0.191 0.768 -3.268) 3.363 10.836 ( -3.026 -8.322 19.169) 21.115 11.613 ( -12.161 -4.922 -0.195) 13.121 11.617 ( 3.815 1.668 8.150) 9.152 11.819 ( -2.617 10.264 2.843) 10.967 12.111 ( -4.071 -7.369 -3.772) 9.225 12.476 ( 1.507 1.153 5.822) 6.123 12.847 ( 3.433 3.833 14.023) 14.937 13.136 ( 11.914 -1.616 -3.792) 12.607 13.179 ( 2.077 -2.048 0.109) 2.919 13.533 ( 1.602 3.044 -0.258) 3.450 13.782 ( 3.637 1.433 -3.072) 4.972 14.579 ( -2.848 6.921 -0.667) 7.514 14.720 ( 26.546 18.838 -5.501) 33.012 14.913 ( -3.643 -0.810 1.488) 4.018 15.245 ( 6.629 5.405 4.197) 9.527 15.526 ( -4.419 -12.446 1.443) 13.285 16.053 ( 7.097 -3.593 2.535) 8.349 16.357 ( -2.916 -2.145 11.606) 12.158 16.890 ( -11.806 -8.997 -26.056) 29.987 18.116 ( -15.785 -10.455 -9.864) 21.348 18.352 ( -3.904 1.217 1.205) 4.263 18.666 ( -3.285 7.085 -16.261) 18.039 19.065 ( 5.001 -7.768 -8.204) 12.356 20.065 ( 7.336 17.253 41.670) 45.693 21.235 ( 2.020 -1.428 -1.121) 2.716 21.556 ( 0.188 -0.447 -0.042) 0.487 21.821 ( -27.883 -19.357 5.358) 34.364 25.005 ( -0.580 -3.244 0.413) 3.322 25.323 ( -0.126 -0.136 -0.672) 0.697 28.855 ( 0.394 -0.590 -0.121) 0.720 29.113 ( 0.519 0.852 0.824) 1.294 34.084 ( 2.303 -2.051 3.236) 4.470 34.422 ( 70.637 33.390 -69.860) 104.809 37.648 ( -12.696 -9.545 -10.976) 19.308 37.915 ( 1.024 -1.477 -2.734) 3.272 40.623 ( 0.288 4.844 -3.401) 5.926 40.984 ( -0.885 6.991 5.840) 9.153 41.466 ( 27.606 11.727 12.870) 32.638 43.729 ( 3.134 5.815 9.910) 11.909 ======================= Grid point 2 (3/205) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.661 ( 26.500 -29.613 -5.379) 40.102 2.163 ( 48.609 -26.728 2.155) 55.515 2.860 ( 27.011 -47.477 25.526) 60.293 3.943 ( 5.747 -5.288 -2.278) 8.135 4.257 ( -1.801 9.569 -4.021) 10.535 4.560 ( 3.378 10.298 7.518) 13.190 5.152 ( -0.971 -1.203 0.182) 1.556 5.673 ( -18.041 6.237 2.385) 19.237 5.783 ( -2.297 22.019 -5.340) 22.773 6.090 ( 0.880 -2.077 4.368) 4.916 6.358 ( -2.742 0.893 -9.737) 10.155 6.647 ( 4.450 1.092 1.650) 4.870 6.982 ( -4.519 3.039 6.549) 8.518 7.221 ( 1.835 0.372 -12.650) 12.787 7.607 ( -14.582 2.702 -5.021) 15.657 7.861 ( -3.827 5.038 -2.246) 6.714 8.158 ( -0.786 18.300 -5.228) 19.049 8.411 ( -8.157 -15.258 6.115) 18.351 8.746 ( 5.035 -10.043 -0.538) 11.247 8.767 ( 6.082 -0.971 5.500) 8.258 9.078 ( 7.188 7.690 -0.996) 10.573 9.257 ( 3.031 -2.246 -5.509) 6.677 9.379 ( -2.686 4.850 -4.574) 7.187 9.747 ( -1.712 -6.194 -14.383) 15.753 10.163 ( -16.191 -5.258 16.269) 23.547 10.458 ( -3.142 3.247 -0.495) 4.546 10.654 ( -0.278 1.822 -1.319) 2.266 10.974 ( -4.197 -3.156 10.427) 11.674 11.545 ( -11.877 -5.323 0.046) 13.016 11.650 ( 0.004 7.683 3.539) 8.459 11.700 ( 6.900 1.623 7.392) 10.241 12.128 ( 1.932 0.948 -7.511) 7.813 12.344 ( -9.290 8.733 9.340) 15.805 13.029 ( 7.310 -5.956 7.171) 11.846 13.259 ( 3.938 -4.611 -1.208) 6.183 13.297 ( 3.560 -9.071 -4.505) 10.735 13.492 ( 3.090 4.816 -1.312) 5.870 13.828 ( 11.345 1.377 -3.963) 12.096 14.374 ( -5.034 9.726 -0.166) 10.952 14.713 ( 11.957 8.272 -3.346) 14.920 14.974 ( 1.816 -4.693 4.406) 6.689 15.251 ( -0.356 1.941 2.432) 3.132 15.626 ( -7.032 -9.017 1.742) 11.567 16.185 ( 0.001 -0.461 6.548) 6.564 16.467 ( 9.974 -4.322 5.216) 12.056 16.790 ( -4.945 -3.031 -15.104) 16.179 18.029 ( -9.391 -2.928 -11.424) 15.076 18.261 ( -7.111 2.637 1.347) 7.703 18.474 ( -1.960 7.003 -6.550) 9.787 19.178 ( 0.959 -4.176 -0.348) 4.298 20.044 ( 3.678 8.041 17.768) 19.847 21.286 ( 2.530 -1.978 -1.500) 3.544 21.565 ( -0.152 -0.790 -0.802) 1.136 21.822 ( -11.565 -7.624 4.645) 14.610 25.065 ( -1.315 -5.024 0.772) 5.250 25.320 ( 0.888 0.653 -1.089) 1.549 28.874 ( 0.198 -1.547 -0.494) 1.636 29.106 ( 0.791 1.520 1.380) 2.200 34.181 ( 3.441 -3.262 5.624) 7.356 34.459 ( 30.929 12.790 -30.870) 45.532 37.597 ( -6.765 -2.685 -4.672) 8.649 37.942 ( 1.308 -1.594 -3.463) 4.030 40.505 ( -0.217 7.313 -4.321) 8.497 40.917 ( -1.404 2.627 5.175) 5.971 41.660 ( 14.872 0.761 5.061) 15.728 43.708 ( 0.620 3.006 3.884) 4.951 ======================= Grid point 3 (4/205) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.358 ( 20.373 -25.467 -5.642) 33.097 3.092 ( 35.986 -25.346 0.625) 44.020 3.571 ( 11.564 2.308 9.277) 15.004 4.090 ( 3.811 -1.079 0.856) 4.052 4.217 ( 2.894 -7.462 5.180) 9.533 4.575 ( 11.547 -6.061 1.403) 13.116 5.121 ( -8.854 5.610 4.854) 11.551 5.289 ( -21.832 11.206 1.721) 24.600 5.458 ( 1.642 10.002 -1.958) 10.323 6.223 ( 1.874 -10.423 5.600) 11.979 6.283 ( -2.919 -2.472 -7.969) 8.840 6.671 ( 5.034 3.990 2.479) 6.885 6.892 ( -2.683 4.458 -3.032) 6.022 7.177 ( -4.636 1.318 -4.576) 6.646 7.503 ( -2.010 -4.102 -2.165) 5.055 7.680 ( -1.142 13.950 -0.650) 14.012 7.846 ( -3.974 8.801 -7.929) 12.494 8.505 ( -8.762 -2.859 1.758) 9.382 8.804 ( -4.029 -4.070 7.721) 9.613 8.984 ( 6.189 -7.907 1.557) 10.161 9.053 ( 5.972 6.723 1.731) 9.158 9.225 ( 1.702 4.971 -8.524) 10.013 9.315 ( -2.633 -3.550 -6.689) 8.017 9.815 ( 1.658 -8.391 -9.968) 13.135 10.126 ( -8.245 -2.287 8.878) 12.330 10.381 ( -3.032 2.370 2.242) 4.454 10.614 ( -0.491 1.938 -0.060) 2.000 10.871 ( -9.361 7.391 2.998) 12.298 11.492 ( -5.545 -1.168 0.907) 5.739 11.613 ( -2.009 -1.507 1.905) 3.152 11.789 ( 11.005 5.864 5.135) 13.486 12.074 ( -1.352 2.479 -2.930) 4.069 12.168 ( -7.239 2.300 4.508) 8.832 13.172 ( 2.987 -2.861 2.969) 5.091 13.361 ( 2.200 -3.806 -3.121) 5.392 13.402 ( 1.418 2.457 -2.960) 4.100 13.514 ( 2.792 -6.903 -2.110) 7.739 13.980 ( 16.428 0.141 -2.614) 16.635 14.212 ( -1.483 5.112 3.315) 6.270 14.720 ( 7.195 4.221 -0.571) 8.362 15.089 ( 2.750 -2.004 5.227) 6.237 15.192 ( -6.097 -0.885 0.317) 6.169 15.660 ( -11.869 -7.272 1.841) 14.041 16.116 ( -1.556 6.668 2.051) 7.148 16.716 ( 12.265 -6.027 -0.701) 13.684 16.790 ( 1.712 -3.890 -3.477) 5.491 17.915 ( -6.478 -0.545 -9.276) 11.327 18.118 ( -8.387 3.982 0.605) 9.304 18.354 ( -0.119 4.503 -2.480) 5.142 19.223 ( -1.122 -1.761 1.470) 2.554 20.041 ( 2.575 3.635 8.387) 9.497 21.338 ( 1.930 -1.664 -0.991) 2.734 21.568 ( -0.674 -0.797 -1.416) 1.759 21.826 ( -4.940 -3.022 3.704) 6.874 25.129 ( -1.759 -4.707 0.910) 5.107 25.315 ( 1.410 1.156 -1.157) 2.160 28.902 ( 0.144 -1.816 -0.677) 1.944 29.095 ( 0.701 1.688 1.414) 2.311 34.297 ( 2.780 -3.165 6.324) 7.599 34.495 ( 15.375 5.526 -16.460) 23.192 37.544 ( -3.913 -0.675 -2.530) 4.708 37.965 ( 0.979 -1.052 -2.689) 3.049 40.379 ( -0.394 5.629 -3.122) 6.448 40.896 ( -0.897 0.779 3.255) 3.465 41.817 ( 8.630 -0.983 2.340) 8.996 43.683 ( -0.141 1.722 1.643) 2.385 ======================= Grid point 4 (5/205) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.876 ( 10.891 -16.928 -3.913) 20.506 3.397 ( -7.960 7.513 2.626) 11.256 3.840 ( 27.431 -11.080 -2.069) 29.657 4.058 ( 5.862 8.997 1.925) 10.910 4.452 ( 12.183 -8.744 -0.612) 15.009 4.723 ( -16.969 -0.583 2.832) 17.213 4.826 ( -15.846 11.055 3.671) 19.666 5.024 ( 1.027 -1.321 1.187) 2.051 5.425 ( 1.573 1.211 0.283) 2.005 6.339 ( -1.050 -9.200 -2.884) 9.698 6.481 ( -0.668 -14.859 3.758) 15.341 6.646 ( 4.010 6.856 -1.292) 8.047 6.723 ( 0.773 13.357 -2.646) 13.638 7.153 ( 0.450 -4.005 4.427) 5.987 7.464 ( 0.409 6.168 -1.630) 6.393 7.549 ( -1.453 1.247 -0.633) 2.016 7.756 ( -0.189 -2.159 -4.636) 5.117 8.311 ( -7.551 8.169 -2.033) 11.309 8.872 ( -2.152 -3.838 4.417) 6.234 9.013 ( 1.097 3.108 1.220) 3.515 9.122 ( 0.792 -2.398 1.501) 2.938 9.199 ( 5.489 0.901 -3.862) 6.772 9.303 ( -3.641 -2.333 -3.698) 5.690 9.929 ( 1.914 -4.811 -5.023) 7.214 10.126 ( -1.900 -2.117 3.474) 4.490 10.326 ( -1.573 1.652 2.043) 3.062 10.585 ( -1.720 1.070 0.087) 2.027 10.659 ( -3.898 5.750 0.655) 6.978 11.469 ( -1.669 -0.680 0.705) 1.935 11.608 ( -2.421 -0.705 -0.205) 2.530 11.779 ( 4.615 5.734 -0.117) 7.361 12.073 ( -1.745 -1.978 9.096) 9.470 12.113 ( -0.022 0.395 -6.298) 6.310 13.239 ( -0.349 -2.931 1.028) 3.125 13.326 ( 0.885 4.185 -1.701) 4.604 13.426 ( 0.895 -1.461 -0.839) 1.908 13.623 ( 1.181 -3.694 -2.207) 4.462 14.051 ( 2.027 2.635 0.156) 3.328 14.269 ( 7.978 -1.513 1.568) 8.270 14.728 ( 1.036 1.088 0.056) 1.503 15.060 ( -4.247 0.903 1.244) 4.517 15.248 ( 4.837 -1.738 2.035) 5.528 15.583 ( -11.517 -2.352 -0.005) 11.754 16.038 ( 1.706 3.181 -0.457) 3.639 16.847 ( 2.829 -1.851 -1.401) 3.659 16.912 ( 4.238 -2.720 0.815) 5.101 17.855 ( -0.911 -1.363 -3.859) 4.193 17.966 ( -5.747 3.532 0.598) 6.772 18.302 ( 0.209 1.509 -0.767) 1.705 19.231 ( -0.757 -0.423 0.796) 1.177 20.049 ( 1.011 0.976 2.517) 2.883 21.371 ( 0.753 -0.662 -0.268) 1.038 21.566 ( -0.425 -0.340 -0.755) 0.931 21.829 ( -1.346 -0.734 1.434) 2.099 25.172 ( -0.964 -2.072 0.476) 2.334 25.309 ( 0.818 0.727 -0.567) 1.233 28.924 ( 0.054 -0.903 -0.372) 0.977 29.083 ( 0.283 0.834 0.656) 1.098 34.379 ( 0.866 -1.504 3.523) 3.927 34.512 ( 4.980 1.772 -6.185) 8.136 37.512 ( -1.320 -0.090 -0.858) 1.577 37.977 ( 0.352 -0.354 -1.005) 1.122 40.305 ( -0.162 2.041 -1.118) 2.333 40.891 ( -0.303 0.170 1.103) 1.157 41.905 ( 2.904 -0.512 0.694) 3.030 43.666 ( -0.138 0.579 0.452) 0.748 ======================= Grid point 10 (6/205) ======================= q-point: ( 0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.837 ( 25.346 0.000 36.011) 44.036 1.302 ( 45.932 0.000 23.087) 51.407 2.199 ( 85.078 0.000 9.824) 85.643 3.833 ( 3.113 0.000 -5.748) 6.537 4.443 ( -1.049 -0.000 2.392) 2.611 4.821 ( 7.030 0.000 7.345) 10.167 5.095 ( -17.479 -0.000 -4.156) 17.966 5.708 ( -9.018 -0.000 5.848) 10.748 6.151 ( -1.963 -0.000 -3.118) 3.684 6.202 ( 1.016 0.000 -2.486) 2.685 6.371 ( 3.115 0.000 -18.163) 18.428 6.556 ( 0.067 0.000 -2.218) 2.219 7.196 ( -6.275 -0.000 -2.952) 6.934 7.385 ( 0.090 0.000 -1.677) 1.680 7.527 ( -16.418 -0.000 -6.138) 17.528 7.976 ( -7.963 -0.000 3.624) 8.748 8.238 ( -11.959 -0.000 -13.712) 18.194 8.355 ( 1.559 0.000 -6.503) 6.687 8.577 ( -2.175 -0.000 -0.389) 2.210 8.598 ( 4.606 0.000 2.813) 5.397 9.285 ( 8.303 0.000 -6.250) 10.392 9.385 ( 12.361 0.000 -6.836) 14.125 9.445 ( -9.483 -0.000 -0.398) 9.492 9.463 ( -1.846 -0.000 0.765) 1.998 10.030 ( -10.116 -0.000 44.999) 46.122 10.595 ( 2.140 0.000 2.151) 3.034 10.680 ( -3.838 -0.000 0.047) 3.838 10.802 ( 1.577 0.000 12.792) 12.889 11.401 ( -13.823 -0.000 1.260) 13.880 11.691 ( 2.994 0.000 7.620) 8.187 11.845 ( -5.723 -0.000 2.473) 6.235 12.078 ( 8.346 0.000 -7.261) 11.062 12.627 ( 15.449 0.000 3.525) 15.846 12.769 ( -18.188 -0.000 13.847) 22.860 13.179 ( -3.592 -0.000 1.170) 3.778 13.211 ( 3.587 0.000 1.547) 3.906 13.585 ( 3.038 0.000 -0.328) 3.056 13.865 ( 11.819 0.000 -8.171) 14.369 14.639 ( -0.822 -0.000 2.538) 2.667 14.773 ( -10.928 -0.000 1.262) 11.001 15.190 ( -7.300 -0.000 -0.694) 7.333 15.209 ( -10.566 -0.000 -3.505) 11.132 15.466 ( 5.798 0.000 7.107) 9.172 16.189 ( 16.332 0.000 -0.730) 16.348 16.381 ( 8.412 0.000 17.949) 19.822 16.621 ( 14.619 0.000 -45.304) 47.604 17.868 ( -4.996 -0.000 -1.227) 5.144 18.299 ( -6.527 -0.000 -0.230) 6.531 18.800 ( -7.476 -0.000 3.836) 8.403 18.834 ( 5.843 0.000 -19.529) 20.384 20.430 ( -14.153 -0.000 40.736) 43.125 21.197 ( -1.146 -0.000 -0.086) 1.150 21.375 ( 0.257 0.000 1.051) 1.082 21.602 ( 1.538 0.000 6.378) 6.561 24.973 ( -0.850 -0.000 0.589) 1.034 25.331 ( 1.887 0.000 -1.313) 2.299 28.849 ( -0.285 -0.000 -0.446) 0.529 29.131 ( 0.893 0.000 0.907) 1.273 34.128 ( 4.454 0.000 6.334) 7.743 35.099 ( 31.086 0.000 -100.038) 104.757 37.416 ( 1.002 0.000 -0.650) 1.194 37.908 ( 1.860 0.000 -3.814) 4.243 40.616 ( -1.784 -0.000 -6.784) 7.014 41.150 ( 5.716 0.000 3.779) 6.852 41.715 ( -7.049 -0.000 -2.628) 7.523 43.900 ( -3.186 -0.000 13.975) 14.333 ======================= Grid point 11 (7/205) ======================= q-point: ( 0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.517 ( 24.759 -23.737 19.324) 39.369 2.134 ( 35.657 -25.956 18.987) 48.017 3.240 ( 68.435 -8.357 11.579) 69.909 3.882 ( 3.082 -5.915 -7.868) 10.315 4.397 ( 1.961 7.776 2.721) 8.468 4.718 ( -9.788 9.590 4.061) 14.292 5.070 ( 0.686 -7.838 4.854) 9.244 5.546 ( -19.123 4.727 8.173) 21.327 6.051 ( 0.387 7.090 -5.216) 8.810 6.126 ( -2.875 14.554 -8.381) 17.039 6.261 ( -3.112 -2.334 -8.839) 9.657 6.607 ( -0.614 -5.319 -8.123) 9.729 7.048 ( -4.837 3.242 4.254) 7.212 7.226 ( 0.026 7.539 -10.714) 13.100 7.462 ( -6.130 -1.890 -4.027) 7.574 7.890 ( -9.382 7.571 -3.710) 12.614 8.071 ( -8.476 -14.442 6.068) 17.811 8.321 ( -5.169 4.434 -8.648) 11.008 8.611 ( -4.316 -6.382 -0.004) 7.704 8.713 ( 3.339 -7.238 -0.267) 7.976 9.248 ( 0.053 5.299 -5.865) 7.904 9.344 ( 1.415 3.137 -4.382) 5.572 9.392 ( 4.503 4.610 3.145) 7.170 9.580 ( 2.807 -5.827 -7.327) 9.773 10.098 ( -4.613 0.220 27.230) 27.619 10.507 ( -2.345 6.279 -0.637) 6.733 10.693 ( 1.447 -0.741 -0.893) 1.855 10.892 ( -3.251 -3.212 9.110) 10.192 11.306 ( -10.499 -5.482 0.609) 11.859 11.722 ( -4.170 4.029 2.825) 6.449 11.814 ( 4.891 -1.568 7.362) 8.977 12.151 ( 6.808 -0.762 -9.567) 11.767 12.455 ( -13.997 13.044 14.599) 24.066 12.925 ( 6.416 -9.362 0.453) 11.359 13.188 ( -0.744 -5.915 -2.286) 6.385 13.279 ( 3.147 -2.055 3.608) 5.210 13.599 ( 4.040 3.165 -1.088) 5.246 13.996 ( 17.479 0.739 -8.330) 19.377 14.488 ( -4.242 10.000 3.002) 11.270 14.814 ( -5.990 -9.626 3.052) 11.741 14.916 ( -2.927 7.624 -4.335) 9.246 15.174 ( -13.413 -3.739 0.717) 13.943 15.559 ( 3.002 0.030 7.012) 7.628 16.346 ( 16.157 5.804 0.678) 17.181 16.575 ( 12.731 -1.706 7.405) 14.826 16.655 ( 6.816 -3.992 -24.388) 25.636 17.833 ( -6.891 -3.769 -4.829) 9.220 18.199 ( -8.761 1.170 0.164) 8.841 18.572 ( -3.501 9.661 -1.212) 10.347 18.987 ( -3.625 -12.164 -6.292) 14.167 20.313 ( -2.462 11.309 20.396) 23.451 21.249 ( -0.825 -4.968 -1.706) 5.317 21.446 ( -4.145 -7.119 1.010) 8.299 21.669 ( -0.146 -3.125 8.625) 9.175 24.987 ( -1.329 -2.855 0.834) 3.258 25.349 ( 2.871 0.563 -1.688) 3.377 28.850 ( -0.347 -0.981 -0.738) 1.276 29.139 ( 0.714 0.801 1.309) 1.693 34.228 ( 5.423 -1.074 8.533) 10.168 34.910 ( 21.616 16.513 -49.596) 56.566 37.468 ( -0.864 -3.798 -2.048) 4.401 37.925 ( 2.226 -1.033 -4.923) 5.501 40.541 ( -2.123 2.561 -9.357) 9.930 41.101 ( 4.543 12.787 6.338) 14.977 41.694 ( -2.813 -7.339 -1.828) 8.070 43.850 ( 0.920 7.334 8.984) 11.634 ======================= Grid point 12 (8/205) ======================= q-point: ( 0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.197 ( 18.856 -20.800 10.277) 29.897 2.935 ( 17.740 -23.458 9.717) 30.974 3.920 ( 11.789 -8.233 -0.204) 14.381 4.207 ( 24.432 -12.107 9.852) 28.993 4.300 ( 21.682 15.001 0.959) 26.382 4.531 ( -10.986 -1.067 1.390) 11.124 5.151 ( -7.313 5.079 8.273) 12.154 5.219 ( -14.666 7.940 4.079) 17.169 5.693 ( 1.149 20.842 -12.795) 24.483 6.001 ( -12.546 -3.993 -3.255) 13.562 6.253 ( 4.087 -3.246 -3.005) 6.022 6.663 ( -0.914 -7.710 -3.118) 8.366 6.990 ( 4.010 8.422 -0.800) 9.363 7.125 ( -4.133 1.758 -2.786) 5.285 7.426 ( 1.436 -3.751 -7.322) 8.352 7.697 ( -6.495 2.356 -5.457) 8.804 8.056 ( -4.618 14.968 -6.060) 16.795 8.274 ( -7.086 -14.246 9.281) 18.420 8.628 ( -9.256 -6.292 2.668) 11.506 8.885 ( 1.482 -9.914 -4.597) 11.028 9.164 ( -3.169 0.407 -2.962) 4.356 9.278 ( 1.026 4.485 -7.568) 8.857 9.372 ( 7.295 8.066 6.368) 12.603 9.692 ( 5.814 -6.327 -6.691) 10.891 10.116 ( -2.206 2.570 14.157) 14.556 10.404 ( -2.283 2.615 0.463) 3.502 10.696 ( 4.244 4.386 -0.986) 6.182 10.854 ( -7.713 2.383 4.952) 9.471 11.312 ( -6.348 -7.057 -1.855) 9.671 11.609 ( -6.544 1.931 3.130) 7.507 11.953 ( 6.257 -0.623 7.131) 9.507 12.147 ( -9.413 6.521 8.053) 13.999 12.190 ( 5.703 5.966 -6.908) 10.763 13.061 ( -0.994 -5.931 -4.458) 7.486 13.284 ( -0.496 -5.953 -4.618) 7.550 13.397 ( 3.287 -5.159 7.509) 9.685 13.577 ( 3.907 4.965 0.394) 6.330 14.174 ( 16.169 1.241 -7.205) 17.745 14.331 ( 1.139 7.465 5.163) 9.148 14.759 ( -5.697 1.215 -2.428) 6.311 14.954 ( -6.787 -11.341 2.412) 13.435 15.058 ( -12.598 -2.476 -0.941) 12.873 15.593 ( 2.741 2.610 7.509) 8.409 16.347 ( 11.970 12.105 -5.693) 17.951 16.751 ( 8.588 -4.033 -7.357) 12.006 16.792 ( 11.306 -3.495 3.223) 12.265 17.786 ( -4.876 -2.701 -5.567) 7.878 18.064 ( -9.368 2.121 0.660) 9.628 18.411 ( -3.463 5.437 0.491) 6.465 19.075 ( -5.408 -8.784 -4.811) 11.382 20.213 ( 1.134 8.508 11.319) 14.206 21.303 ( -0.520 -3.842 -2.064) 4.393 21.494 ( -3.255 -4.417 0.677) 5.528 21.744 ( -1.827 -3.487 7.377) 8.362 25.032 ( -1.899 -4.500 1.031) 4.992 25.367 ( 3.805 1.413 -1.818) 4.448 28.866 ( -0.420 -1.904 -0.980) 2.182 29.132 ( 0.186 1.481 1.472) 2.097 34.339 ( 4.440 -0.666 9.089) 10.137 34.751 ( 14.119 11.940 -25.399) 31.417 37.491 ( -0.263 -1.332 -1.281) 1.867 37.949 ( 1.860 -1.195 -4.489) 5.004 40.423 ( -1.844 4.096 -8.969) 10.031 40.996 ( 2.599 7.992 5.440) 10.011 41.788 ( -2.090 -7.367 -1.651) 7.834 43.788 ( 2.329 6.545 6.045) 9.209 ======================= Grid point 13 (9/205) ======================= q-point: ( 0.44 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.670 ( 4.141 -16.105 8.589) 18.716 3.288 ( -3.576 -8.828 4.127) 10.380 4.042 ( 4.109 7.042 2.688) 8.585 4.292 ( -2.255 7.321 5.101) 9.203 4.407 ( -8.375 -10.752 -3.735) 14.131 4.715 ( 28.320 5.926 8.036) 30.029 4.856 ( -11.955 10.721 -0.603) 16.069 5.097 ( 9.724 0.890 -4.313) 10.675 5.474 ( 0.167 6.246 -6.255) 8.841 5.957 ( -12.619 -14.760 -3.028) 19.654 6.394 ( 1.644 -5.588 3.972) 7.050 6.747 ( -1.191 3.577 -1.761) 4.161 6.895 ( 2.616 3.641 -4.600) 6.424 7.065 ( 0.788 -1.442 5.994) 6.215 7.494 ( 2.095 -0.655 -7.208) 7.534 7.651 ( 1.295 -5.844 -6.446) 8.796 7.764 ( -0.860 14.215 -0.183) 14.242 8.293 ( -8.119 2.813 0.131) 8.593 8.691 ( -6.819 -10.514 8.439) 15.109 8.966 ( -6.680 -8.128 -6.714) 12.481 9.148 ( 1.753 0.995 3.118) 3.713 9.199 ( 0.026 3.078 -3.545) 4.695 9.390 ( 10.098 4.599 2.103) 11.293 9.857 ( 6.762 -6.481 -3.516) 10.005 10.103 ( -1.247 -0.174 4.242) 4.425 10.368 ( 0.026 1.556 1.783) 2.367 10.656 ( 3.688 5.926 1.922) 7.239 10.727 ( -1.752 6.006 0.290) 6.263 11.346 ( -4.222 -5.941 -2.785) 7.802 11.542 ( -8.193 -2.612 3.933) 9.456 11.867 ( -8.051 6.761 6.165) 12.187 12.127 ( 5.356 1.309 8.408) 10.055 12.176 ( 8.855 3.668 -13.849) 16.842 13.097 ( -4.691 -5.661 -4.130) 8.432 13.313 ( -2.659 -2.791 -4.714) 6.090 13.512 ( 4.511 2.192 5.066) 7.129 13.578 ( 0.427 -2.156 6.931) 7.271 14.152 ( 0.619 6.654 -0.941) 6.749 14.339 ( 0.987 2.970 -0.955) 3.272 14.686 ( -6.821 -1.773 -2.121) 7.360 14.990 ( -3.724 -3.351 0.552) 5.040 15.050 ( -7.320 -10.643 -2.294) 13.119 15.649 ( 10.476 2.275 6.887) 12.742 16.257 ( 10.857 12.646 -5.963) 17.701 16.863 ( 4.831 -0.843 -2.199) 5.375 16.934 ( 4.020 -0.910 1.421) 4.360 17.796 ( 1.045 -4.049 -2.673) 4.963 17.941 ( -5.995 1.245 1.794) 6.381 18.314 ( -3.755 2.161 1.715) 4.660 19.114 ( -5.005 -6.868 -5.774) 10.274 20.147 ( 1.258 6.324 6.078) 8.861 21.339 ( -1.246 -2.834 -1.535) 3.455 21.525 ( -1.558 -2.817 1.358) 3.494 21.792 ( -1.828 -2.451 4.479) 5.423 25.087 ( -2.105 -4.772 1.075) 5.326 25.377 ( 4.287 2.584 -1.690) 5.283 28.890 ( -0.516 -2.274 -1.090) 2.574 29.109 ( -0.427 1.772 1.219) 2.193 34.408 ( 1.627 1.010 7.472) 7.713 34.646 ( 7.652 8.522 -12.837) 17.204 37.507 ( 1.483 -0.329 0.059) 1.520 37.968 ( 1.157 -0.810 -2.876) 3.204 40.318 ( -1.272 2.479 -6.409) 6.988 40.947 ( 1.987 4.016 2.636) 5.198 41.838 ( -4.964 -4.687 -1.903) 7.087 43.746 ( 2.873 5.172 4.338) 7.337 ======================= Grid point 14 (10/205) ======================= q-point: (-0.44 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.784 ( -24.087 -3.981 10.631) 26.628 3.305 ( -5.573 -0.198 4.685) 7.284 3.883 ( -12.890 17.400 1.332) 21.695 3.964 ( -1.100 1.371 0.446) 1.813 4.461 ( -12.955 9.536 -0.913) 16.112 4.711 ( 9.798 -12.134 -1.752) 15.694 5.090 ( 31.326 4.407 -2.366) 31.723 5.112 ( 6.486 5.498 -5.690) 10.231 5.385 ( -2.953 1.482 -5.768) 6.647 6.167 ( -6.353 -20.555 -0.500) 21.520 6.449 ( -8.831 -6.734 4.900) 12.138 6.593 ( -4.454 2.069 -2.071) 5.330 6.825 ( 3.364 17.565 -3.099) 18.151 7.052 ( -6.547 -3.822 -0.215) 7.584 7.533 ( 6.407 3.126 -0.955) 7.192 7.615 ( 3.214 4.508 1.566) 5.753 7.782 ( 4.196 -4.073 -0.076) 5.848 8.231 ( 0.579 -7.513 1.130) 7.619 8.768 ( -6.677 -5.299 4.803) 9.784 8.997 ( -3.928 -5.846 -6.332) 9.472 9.139 ( -1.759 2.187 -1.752) 3.309 9.165 ( 3.812 3.168 5.460) 7.374 9.445 ( 7.075 3.698 2.378) 8.330 9.968 ( 1.127 0.376 5.828) 5.948 10.152 ( 3.675 -3.534 -4.268) 6.649 10.364 ( 3.517 1.236 -0.476) 3.758 10.656 ( 6.367 0.277 0.450) 6.389 10.665 ( 4.820 4.335 0.323) 6.491 11.369 ( -5.845 -5.628 -3.238) 8.736 11.536 ( -8.198 -6.924 4.684) 11.708 11.743 ( -0.721 3.961 2.873) 4.946 12.160 ( 2.813 4.326 5.166) 7.302 12.178 ( 9.588 2.765 -12.800) 16.230 13.097 ( -8.767 -5.557 -4.291) 11.232 13.295 ( -2.887 -1.864 -2.480) 4.238 13.515 ( 2.476 4.484 6.803) 8.516 13.648 ( -1.899 -1.412 11.077) 11.327 14.038 ( -3.770 5.123 -4.014) 7.521 14.220 ( -5.176 3.932 -1.834) 6.754 14.594 ( -13.533 -3.639 -3.345) 14.407 15.006 ( -7.535 -4.787 -1.382) 9.033 15.167 ( 8.798 -3.954 -2.536) 9.974 15.826 ( 17.077 -0.138 3.812) 17.498 16.163 ( 9.236 11.499 -3.579) 15.177 16.862 ( -1.094 2.470 -0.159) 2.707 16.911 ( -4.437 3.826 -0.062) 5.860 17.877 ( 2.360 -2.750 2.395) 4.344 17.965 ( 4.717 -4.766 2.301) 7.089 18.269 ( -3.459 -0.967 2.751) 4.524 19.133 ( -4.529 -5.970 -7.789) 10.809 20.082 ( 0.069 5.041 2.150) 5.481 21.349 ( -2.030 -1.334 -0.726) 2.535 21.555 ( -0.817 -1.609 2.070) 2.746 21.824 ( -0.264 -2.045 1.636) 2.632 25.137 ( -1.657 -3.757 0.875) 4.198 25.370 ( 3.967 3.738 -1.259) 5.594 28.912 ( -0.578 -1.650 -0.831) 1.936 29.080 ( -0.870 1.238 0.491) 1.591 34.397 ( -1.718 3.195 3.681) 5.168 34.548 ( 1.635 6.925 -3.812) 8.073 37.543 ( 3.288 -0.338 1.453) 3.610 37.979 ( 0.427 -0.214 -0.893) 1.013 40.274 ( -0.468 -0.805 -3.374) 3.500 40.930 ( 2.330 2.185 0.091) 3.196 41.798 ( -9.306 -1.896 -2.539) 9.830 43.725 ( 3.033 3.843 3.087) 5.787 ======================= Grid point 15 (11/205) ======================= q-point: (-0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.332 ( -43.349 11.887 10.035) 46.056 2.991 ( -20.157 22.440 -0.181) 30.164 3.727 ( 13.004 5.552 3.658) 14.605 4.003 ( -2.984 -5.585 -1.569) 6.524 4.253 ( -5.324 0.165 -2.271) 5.791 4.683 ( -4.710 25.078 -4.173) 25.855 5.156 ( 14.134 -5.463 -6.292) 16.408 5.227 ( -7.718 -0.165 -2.943) 8.262 5.449 ( 17.047 -5.283 -1.870) 17.944 6.218 ( -6.924 -0.759 1.695) 7.169 6.422 ( -5.491 10.658 -4.566) 12.829 6.524 ( -5.117 -4.444 0.044) 6.778 6.778 ( 3.510 -19.247 -0.206) 19.566 7.138 ( 0.685 -4.666 3.640) 5.958 7.515 ( -2.151 -0.406 2.205) 3.107 7.626 ( 7.307 2.067 0.053) 7.594 7.908 ( 9.436 -1.914 5.840) 11.261 8.470 ( 0.244 -14.109 0.139) 14.112 8.754 ( -4.625 -0.272 -0.370) 4.648 8.958 ( -5.313 1.358 -4.930) 7.374 9.075 ( -0.205 3.833 -1.246) 4.036 9.188 ( 3.119 0.920 4.025) 5.174 9.442 ( 1.829 4.968 5.242) 7.450 9.932 ( -1.844 5.099 7.151) 8.974 10.240 ( 7.760 -0.810 -2.562) 8.213 10.419 ( 7.738 -0.259 -2.899) 8.267 10.654 ( 3.207 2.465 0.596) 4.088 10.841 ( 10.296 -7.685 0.127) 12.849 11.350 ( -11.068 -7.149 -6.229) 14.574 11.574 ( -4.411 -4.559 0.905) 6.408 11.766 ( 8.581 1.088 2.997) 9.155 12.114 ( -1.013 3.101 3.011) 4.439 12.231 ( 11.472 1.174 -7.303) 13.650 13.004 ( -15.329 -3.303 -6.235) 16.875 13.293 ( -5.773 -3.793 1.107) 6.996 13.490 ( 2.389 5.244 6.904) 8.993 13.649 ( -0.982 5.521 10.874) 12.234 13.843 ( -9.454 4.864 -6.475) 12.449 14.183 ( 3.263 -1.648 -0.822) 3.747 14.500 ( -12.276 -6.378 -3.319) 14.226 14.953 ( -10.266 -3.246 -2.851) 11.138 15.291 ( 8.253 1.391 -1.969) 8.598 15.983 ( 15.465 10.203 -1.055) 18.557 16.143 ( 9.561 0.416 -1.286) 9.656 16.687 ( -12.446 8.243 0.778) 14.948 16.847 ( 2.172 1.320 0.448) 2.581 17.998 ( 5.096 -3.816 8.635) 10.728 18.127 ( 5.693 -5.381 -0.427) 7.845 18.303 ( 0.794 -4.441 5.262) 6.931 19.126 ( -6.251 -5.144 -9.760) 12.680 20.006 ( -1.047 3.809 -1.279) 4.152 21.330 ( -2.334 0.268 0.195) 2.357 21.568 ( -1.065 -0.493 1.588) 1.975 21.873 ( 2.521 -2.128 0.026) 3.299 25.167 ( -0.611 -1.026 0.336) 1.241 25.345 ( 2.701 3.643 -0.488) 4.561 28.917 ( -0.524 0.140 -0.161) 0.566 29.061 ( -0.940 -0.410 -0.501) 1.142 34.306 ( -4.247 4.545 1.089) 6.315 34.424 ( -4.393 6.533 2.360) 8.219 37.606 ( 4.508 -0.781 2.437) 5.184 37.978 ( -0.151 0.487 0.714) 0.878 40.307 ( 0.409 -4.206 -0.690) 4.282 40.933 ( 3.654 1.403 -1.495) 4.190 41.660 ( -13.818 0.555 -3.580) 14.285 43.717 ( 2.578 2.689 1.814) 4.143 ======================= Grid point 16 (12/205) ======================= q-point: (-0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.570 ( -45.014 19.740 7.072) 49.658 2.289 ( -12.494 38.392 -2.156) 40.432 3.620 ( 9.379 51.059 -6.741) 52.349 3.936 ( -6.767 5.231 -1.957) 8.774 4.170 ( -3.559 -2.731 6.915) 8.243 4.320 ( -3.585 -8.655 -7.375) 11.923 5.135 ( -3.877 -1.297 1.095) 4.233 5.500 ( 6.097 -20.064 -1.053) 20.996 5.699 ( 7.884 -7.637 -0.807) 11.006 6.131 ( -0.385 4.260 -3.748) 5.687 6.362 ( -0.291 -3.727 5.095) 6.320 6.528 ( -4.060 -3.454 -3.180) 6.207 7.020 ( 7.296 0.651 -5.537) 9.183 7.190 ( -6.348 -5.481 9.322) 12.539 7.646 ( 2.307 -16.153 4.194) 16.848 7.738 ( 4.471 -6.512 -3.753) 8.745 8.109 ( 13.175 -1.787 11.341) 17.475 8.547 ( -13.591 -6.246 -7.432) 16.702 8.669 ( 5.294 9.376 -5.235) 11.972 8.808 ( -8.123 6.102 1.294) 10.242 9.003 ( -0.104 3.523 -0.775) 3.609 9.263 ( 0.763 -5.202 2.679) 5.901 9.388 ( -0.012 4.811 4.154) 6.357 9.866 ( -0.142 4.201 4.407) 6.090 10.342 ( 7.454 -1.442 -0.817) 7.636 10.507 ( 8.275 0.901 -0.959) 8.379 10.676 ( 1.083 -0.734 3.501) 3.738 11.015 ( 5.743 0.441 -4.557) 7.344 11.362 ( -6.548 -14.193 -5.284) 16.500 11.579 ( -2.158 -1.367 -2.243) 3.399 11.835 ( 9.555 7.286 1.455) 12.104 12.124 ( 0.386 -4.271 2.726) 5.081 12.342 ( 9.101 -0.951 -1.387) 9.255 12.811 ( -19.064 -2.602 -7.565) 20.674 13.276 ( -5.457 -1.855 2.416) 6.250 13.451 ( 0.473 8.181 4.947) 9.572 13.493 ( -0.225 10.251 -0.453) 10.263 13.723 ( -4.508 -1.257 0.587) 4.716 14.317 ( 6.224 -6.772 1.395) 9.303 14.485 ( -7.487 -6.803 -0.567) 10.132 14.861 ( -9.731 -2.750 -3.753) 10.786 15.288 ( 2.153 5.343 -1.329) 5.912 15.941 ( 12.904 13.686 0.200) 18.811 16.213 ( -0.272 3.365 -1.944) 3.895 16.419 ( -8.131 4.682 -2.962) 9.839 16.913 ( 6.099 -1.712 3.725) 7.349 18.153 ( 4.113 -3.333 9.381) 10.771 18.243 ( 2.024 -5.320 -4.529) 7.274 18.496 ( 10.671 -6.483 12.635) 17.764 19.056 ( -11.094 -3.712 -11.593) 16.470 19.931 ( -1.484 2.433 -4.119) 5.009 21.291 ( -1.835 1.537 0.615) 2.472 21.562 ( -0.871 0.069 0.382) 0.954 21.952 ( 4.777 -2.392 -0.284) 5.350 25.147 ( 0.308 3.395 -0.196) 3.414 25.326 ( 1.056 1.224 0.196) 1.629 28.897 ( -0.359 1.471 0.131) 1.520 29.067 ( -0.581 -1.615 -0.737) 1.868 34.173 ( -7.664 4.483 3.449) 9.526 34.259 ( -6.200 6.966 2.854) 9.752 37.689 ( 4.401 -1.546 2.556) 5.319 37.965 ( -0.345 1.176 1.336) 1.813 40.401 ( 0.584 -6.528 0.692) 6.591 40.967 ( 6.616 0.909 -1.370) 6.817 41.431 ( -16.862 3.061 -4.574) 17.737 43.710 ( 1.368 1.826 0.396) 2.316 ======================= Grid point 17 (13/205) ======================= q-point: (-0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.862 ( 0.000 26.977 0.000) 26.977 1.524 ( 0.000 45.878 0.000) 45.878 2.532 ( 0.000 75.974 0.000) 75.974 3.857 ( 0.000 2.390 0.000) 2.390 4.375 ( -0.000 -4.910 -0.000) 4.910 4.398 ( -0.000 -15.767 -0.000) 15.767 5.156 ( -0.000 -3.087 -0.000) 3.087 5.860 ( -0.000 -15.511 -0.000) 15.511 5.879 ( -0.000 -10.183 -0.000) 10.183 6.048 ( 0.000 2.862 0.000) 2.862 6.482 ( -0.000 -7.016 -0.000) 7.016 6.497 ( 0.000 2.186 0.000) 2.186 7.006 ( -0.000 -0.682 -0.000) 0.682 7.274 ( -0.000 -5.484 -0.000) 5.484 7.809 ( -0.000 -3.779 -0.000) 3.779 8.006 ( -0.000 -16.798 -0.000) 16.798 8.250 ( 0.000 6.348 0.000) 6.348 8.454 ( -0.000 -6.712 -0.000) 6.712 8.519 ( 0.000 12.991 0.000) 12.991 8.622 ( 0.000 9.483 0.000) 9.483 8.999 ( -0.000 -4.532 -0.000) 4.532 9.276 ( 0.000 4.717 0.000) 4.717 9.419 ( -0.000 -7.025 -0.000) 7.025 9.824 ( 0.000 2.482 0.000) 2.482 10.435 ( -0.000 -2.999 -0.000) 2.999 10.542 ( 0.000 1.412 0.000) 1.412 10.709 ( -0.000 -1.050 -0.000) 1.050 10.965 ( 0.000 7.257 0.000) 7.257 11.531 ( -0.000 -4.986 -0.000) 4.986 11.608 ( -0.000 -11.604 -0.000) 11.604 11.778 ( 0.000 6.853 0.000) 6.853 12.230 ( -0.000 -3.732 -0.000) 3.732 12.418 ( -0.000 -2.505 -0.000) 2.505 12.659 ( 0.000 1.015 0.000) 1.015 13.213 ( 0.000 7.471 0.000) 7.471 13.260 ( 0.000 10.057 0.000) 10.057 13.470 ( -0.000 -2.729 -0.000) 2.729 13.732 ( -0.000 -2.542 -0.000) 2.542 14.491 ( -0.000 -8.109 -0.000) 8.109 14.500 ( -0.000 -0.929 -0.000) 0.929 14.850 ( -0.000 -5.642 -0.000) 5.642 15.203 ( 0.000 4.602 0.000) 4.602 15.804 ( 0.000 15.789 0.000) 15.789 16.067 ( 0.000 5.498 0.000) 5.498 16.364 ( 0.000 0.315 0.000) 0.315 17.016 ( -0.000 -3.354 -0.000) 3.354 18.257 ( -0.000 -3.136 -0.000) 3.136 18.318 ( -0.000 -4.076 -0.000) 4.076 18.811 ( -0.000 -9.498 -0.000) 9.498 18.901 ( 0.000 1.163 0.000) 1.163 19.869 ( 0.000 1.925 0.000) 1.925 21.251 ( 0.000 1.978 0.000) 1.978 21.554 ( 0.000 0.186 0.000) 0.186 22.040 ( -0.000 -3.098 -0.000) 3.098 25.077 ( 0.000 5.021 0.000) 5.021 25.327 ( -0.000 -0.171 -0.000) 0.171 28.869 ( 0.000 1.538 0.000) 1.538 29.088 ( -0.000 -1.551 -0.000) 1.551 34.020 ( 0.000 5.913 0.000) 5.913 34.126 ( 0.000 5.188 0.000) 5.188 37.763 ( -0.000 -2.591 -0.000) 2.591 37.944 ( 0.000 1.625 0.000) 1.625 40.515 ( -0.000 -6.922 -0.000) 6.922 41.046 ( -0.000 -1.140 -0.000) 1.140 41.176 ( 0.000 7.269 0.000) 7.269 43.692 ( 0.000 1.275 0.000) 1.275 ======================= Grid point 20 (14/205) ======================= q-point: ( 0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.769 ( 29.733 0.000 33.221) 44.583 2.470 ( 37.417 0.000 15.435) 40.475 3.784 ( -2.123 -0.000 -12.939) 13.112 3.881 ( 35.898 0.000 7.037) 36.581 4.484 ( -9.229 -0.000 12.257) 15.343 4.745 ( 15.832 0.000 -5.473) 16.752 5.087 ( 5.841 0.000 11.719) 13.094 5.390 ( -23.994 -0.000 14.871) 28.229 5.993 ( -6.609 -0.000 -6.071) 8.974 6.192 ( -3.438 -0.000 -11.066) 11.588 6.266 ( 4.800 0.000 -8.153) 9.461 6.571 ( 9.409 0.000 -13.427) 16.395 6.891 ( -14.740 -0.000 -7.977) 16.760 7.310 ( -3.251 -0.000 -4.400) 5.471 7.377 ( 1.407 0.000 -4.909) 5.107 7.833 ( -4.959 -0.000 9.130) 10.390 7.866 ( -12.748 -0.000 -0.482) 12.757 8.182 ( -7.815 -0.000 -12.628) 14.851 8.541 ( -0.726 -0.000 -2.050) 2.175 8.688 ( 1.512 0.000 0.351) 1.553 9.186 ( -11.027 -0.000 -0.303) 11.031 9.368 ( 3.078 0.000 -7.226) 7.854 9.550 ( 5.110 0.000 9.184) 10.510 9.577 ( 8.075 0.000 -6.889) 10.614 10.184 ( -1.927 -0.000 26.568) 26.638 10.530 ( -6.547 -0.000 -2.361) 6.959 10.660 ( 2.594 0.000 3.220) 4.134 10.910 ( 2.337 0.000 -0.239) 2.349 11.158 ( -7.238 -0.000 1.712) 7.438 11.668 ( -9.947 -0.000 0.915) 9.989 11.912 ( 8.931 0.000 6.206) 10.875 12.191 ( 7.541 0.000 -12.481) 14.582 12.402 ( -20.202 -0.000 17.273) 26.580 13.005 ( 12.795 0.000 -1.073) 12.840 13.084 ( -4.006 -0.000 -2.074) 4.511 13.313 ( 3.181 0.000 4.546) 5.548 13.670 ( 4.254 0.000 -1.137) 4.403 14.185 ( 18.785 0.000 -9.084) 20.866 14.585 ( -5.922 -0.000 3.761) 7.016 14.609 ( -3.711 -0.000 1.692) 4.078 14.871 ( -15.410 -0.000 -0.957) 15.440 14.956 ( -10.715 -0.000 1.301) 10.794 15.657 ( 5.813 0.000 6.417) 8.658 16.617 ( 17.891 0.000 -0.254) 17.893 16.620 ( 9.750 0.000 -26.356) 28.102 16.755 ( 13.357 0.000 6.529) 14.867 17.722 ( -5.213 -0.000 -1.382) 5.393 18.096 ( -10.202 -0.000 0.562) 10.218 18.593 ( -13.012 -0.000 6.026) 14.340 18.814 ( 2.793 0.000 -10.445) 10.812 20.432 ( -4.160 -0.000 14.640) 15.220 21.160 ( -1.916 -0.000 0.004) 1.916 21.394 ( 0.451 0.000 1.649) 1.710 21.687 ( 0.212 0.000 8.065) 8.068 24.953 ( -1.252 -0.000 0.788) 1.479 25.387 ( 3.874 0.000 -1.877) 4.305 28.832 ( -0.682 -0.000 -0.853) 1.092 29.157 ( 0.269 0.000 1.250) 1.279 34.331 ( 6.429 0.000 10.300) 12.142 35.027 ( 10.270 0.000 -40.802) 42.074 37.453 ( 2.687 0.000 -0.596) 2.753 37.924 ( 2.590 0.000 -5.693) 6.254 40.490 ( -2.367 -0.000 -11.425) 11.667 41.368 ( 8.825 0.000 5.751) 10.534 41.457 ( -12.048 -0.000 -3.902) 12.664 43.945 ( -0.646 -0.000 8.074) 8.100 ======================= Grid point 21 (15/205) ======================= q-point: ( 0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.305 ( 24.599 -6.823 25.628) 36.172 2.938 ( 15.740 -7.624 6.471) 18.648 3.775 ( -1.004 -11.043 -12.049) 16.374 4.150 ( -3.814 -10.089 8.442) 13.697 4.419 ( -0.699 3.167 9.736) 10.262 4.971 ( 28.782 10.572 2.125) 30.735 5.079 ( -20.426 3.290 13.173) 24.527 5.222 ( -1.362 0.608 6.267) 6.442 5.890 ( -4.723 5.534 -4.037) 8.320 5.997 ( -0.841 16.650 -17.134) 23.907 6.269 ( 8.141 4.850 -2.992) 9.937 6.516 ( 2.997 -6.877 -2.882) 8.036 7.017 ( 3.979 -17.372 -9.277) 20.092 7.156 ( -4.661 9.091 -3.077) 10.670 7.346 ( -0.527 1.401 -10.294) 10.402 7.645 ( -8.265 5.614 -2.363) 10.267 8.010 ( -0.338 -12.525 10.618) 16.424 8.055 ( -9.649 -2.489 -8.803) 13.296 8.516 ( -3.343 0.604 0.899) 3.514 8.744 ( 0.017 -5.239 -4.019) 6.602 9.073 ( -7.482 -1.825 -0.980) 7.764 9.334 ( 0.524 3.448 -3.791) 5.151 9.606 ( 7.755 4.845 6.589) 11.271 9.675 ( 6.188 -3.239 -2.763) 7.511 10.229 ( -1.189 4.304 18.995) 19.513 10.408 ( -4.170 3.054 -0.862) 5.240 10.751 ( 2.759 -3.009 2.667) 4.877 10.883 ( 1.635 4.876 -2.382) 5.668 11.151 ( -3.036 -5.224 -0.000) 6.042 11.533 ( -10.867 1.365 0.602) 10.969 11.989 ( -5.365 -0.048 4.633) 7.088 12.203 ( 5.286 2.382 -6.800) 8.936 12.277 ( -0.247 2.834 8.107) 8.592 13.006 ( -1.131 0.592 -3.125) 3.376 13.164 ( 1.044 -5.342 -5.925) 8.046 13.405 ( 3.574 -2.918 10.075) 11.081 13.689 ( 3.554 3.016 -0.023) 4.661 14.292 ( 1.821 1.512 -5.959) 6.412 14.497 ( 4.938 5.617 3.342) 8.192 14.617 ( -12.824 -1.979 -3.127) 13.347 14.742 ( -2.327 -6.136 0.483) 6.580 14.888 ( -6.868 -2.851 2.303) 7.785 15.732 ( 6.249 2.029 6.437) 9.198 16.595 ( 10.475 5.948 -18.283) 21.895 16.816 ( 12.440 -1.203 -1.269) 12.563 16.916 ( 10.516 0.517 4.004) 11.265 17.689 ( -2.084 -2.155 -1.485) 3.345 17.972 ( -10.100 0.520 1.221) 10.187 18.419 ( -10.793 3.658 4.433) 12.228 18.870 ( -0.710 -6.743 -7.591) 10.178 20.383 ( -0.848 6.721 9.230) 11.449 21.188 ( -2.695 -5.535 -0.773) 6.205 21.426 ( 0.067 -2.245 1.963) 2.983 21.724 ( -1.051 -1.250 7.277) 7.458 24.961 ( -1.317 -2.417 0.784) 2.862 25.425 ( 4.460 0.579 -1.810) 4.848 28.829 ( -0.837 -1.155 -0.934) 1.705 29.155 ( -0.386 0.810 1.230) 1.522 34.441 ( 5.608 0.726 10.248) 11.705 34.930 ( 7.126 6.769 -25.175) 27.026 37.492 ( 3.021 -0.450 -0.271) 3.066 37.938 ( 2.286 -0.757 -5.302) 5.823 40.402 ( -2.084 1.770 -11.675) 11.991 41.177 ( -3.938 9.928 1.025) 10.729 41.606 ( 0.263 -9.397 1.136) 9.469 43.929 ( 0.725 4.568 6.332) 7.841 ======================= Grid point 22 (16/205) ======================= q-point: ( 0.44 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.638 ( 4.737 -0.313 18.209) 18.817 3.104 ( -7.345 -8.859 3.848) 12.135 3.964 ( -8.834 -17.492 -16.710) 25.753 4.192 ( 3.312 3.811 6.826) 8.490 4.486 ( 7.347 3.046 16.499) 18.316 4.782 ( -20.813 4.530 8.366) 22.884 5.172 ( 20.251 5.452 -8.437) 22.606 5.203 ( 5.374 0.775 4.229) 6.883 5.618 ( -2.081 11.928 -11.475) 16.682 5.739 ( 0.171 5.188 -2.585) 5.799 6.341 ( -1.799 -2.886 4.945) 6.002 6.761 ( 8.402 -4.060 3.858) 10.097 6.907 ( -8.373 9.245 -2.284) 12.680 7.190 ( 8.819 2.149 -1.140) 9.148 7.396 ( -1.097 -16.105 -15.107) 22.109 7.498 ( -1.477 0.429 -9.037) 9.167 7.904 ( -2.667 5.967 -4.588) 7.985 8.243 ( -1.884 -4.617 7.421) 8.940 8.498 ( -4.161 -7.108 5.940) 10.155 8.751 ( -6.097 -3.570 -6.273) 9.448 9.093 ( -1.834 -6.320 -1.127) 6.676 9.284 ( 3.534 3.814 0.122) 5.201 9.628 ( 8.742 7.703 5.861) 13.042 9.825 ( 6.774 -7.621 -2.626) 10.529 10.152 ( -2.355 6.607 5.309) 8.797 10.380 ( -0.939 -0.435 5.737) 5.830 10.790 ( 0.653 2.245 0.217) 2.348 10.828 ( 6.657 5.839 0.314) 8.860 11.218 ( -0.179 -4.952 -1.538) 5.189 11.388 ( -12.707 -0.946 1.584) 12.840 11.859 ( -10.871 2.473 5.950) 12.637 12.220 ( 5.330 0.603 -11.866) 13.022 12.318 ( 10.132 4.349 4.448) 11.889 12.974 ( -4.564 -1.634 -1.841) 5.185 13.193 ( -3.509 -3.891 -5.533) 7.620 13.540 ( 2.037 -3.850 10.804) 11.649 13.665 ( 1.871 4.452 2.883) 5.625 14.190 ( -7.347 2.464 -4.457) 8.940 14.395 ( -6.301 6.689 1.892) 9.382 14.491 ( -11.301 -2.385 -4.129) 12.265 14.845 ( -5.122 -4.650 5.370) 8.758 14.989 ( 14.948 -6.194 -5.675) 17.147 15.821 ( 8.805 0.433 6.360) 10.871 16.539 ( 10.896 9.299 -11.835) 18.582 16.915 ( 4.869 1.190 -3.049) 5.867 16.998 ( 3.443 2.129 4.054) 5.729 17.744 ( 2.936 -4.411 -0.419) 5.315 17.878 ( -5.887 -1.115 2.258) 6.403 18.278 ( -9.313 1.158 3.781) 10.118 18.926 ( -2.191 -6.156 -7.458) 9.916 20.296 ( 0.457 7.603 5.626) 9.469 21.240 ( -2.805 -5.295 -1.114) 6.094 21.476 ( -0.001 -2.843 2.102) 3.536 21.755 ( -1.834 -1.757 5.166) 5.757 25.000 ( -1.238 -3.952 0.744) 4.208 25.456 ( 4.421 1.472 -1.549) 4.911 28.841 ( -0.880 -2.089 -0.996) 2.476 29.133 ( -0.878 1.500 1.061) 2.037 34.503 ( 3.144 3.002 7.913) 9.028 34.808 ( 5.001 7.920 -13.448) 16.388 37.535 ( 3.384 -0.148 0.521) 3.427 37.957 ( 1.564 -0.940 -3.786) 4.203 40.306 ( -1.386 2.030 -9.160) 9.484 41.030 ( -2.965 4.126 0.082) 5.081 41.705 ( -1.936 -3.772 0.737) 4.304 43.886 ( 1.965 5.395 4.773) 7.467 ======================= Grid point 23 (17/205) ======================= q-point: (-0.44 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.547 ( -21.703 6.631 12.696) 26.003 3.165 ( -9.395 -9.437 6.076) 14.637 3.903 ( -5.518 -1.184 -2.870) 6.332 4.157 ( 4.640 16.684 -1.975) 17.429 4.443 ( -14.894 10.467 -0.973) 18.230 4.668 ( 11.682 -8.321 5.629) 15.408 5.261 ( 8.170 3.342 -6.702) 11.083 5.291 ( 1.495 -2.423 -3.627) 4.611 5.554 ( 11.976 0.656 -3.664) 12.541 5.826 ( 9.404 -9.023 1.848) 13.163 6.250 ( -17.212 1.598 5.295) 18.078 6.646 ( -1.608 10.353 -3.298) 10.984 6.922 ( -4.903 -6.266 5.445) 9.641 7.061 ( -1.408 11.517 -2.676) 11.907 7.549 ( -1.789 -7.781 -9.890) 12.711 7.667 ( 10.048 -8.687 -1.023) 13.322 7.796 ( 4.073 3.151 -0.830) 5.216 8.166 ( -3.699 3.575 0.218) 5.149 8.635 ( -4.280 -5.656 5.596) 9.035 8.779 ( -2.466 -11.324 -4.559) 12.454 9.141 ( -1.044 -1.742 -0.380) 2.066 9.296 ( 5.135 3.638 5.273) 8.210 9.618 ( 7.329 7.250 0.557) 10.324 10.034 ( 6.352 -3.887 3.265) 8.132 10.074 ( -1.978 -2.774 0.073) 3.408 10.397 ( 1.063 -0.170 1.045) 1.500 10.741 ( 3.068 4.543 -3.075) 6.285 10.855 ( 9.394 4.699 3.284) 11.005 11.202 ( -10.697 -1.434 1.197) 10.859 11.370 ( -1.243 -7.204 1.092) 7.392 11.759 ( -5.312 -0.208 2.456) 5.856 12.212 ( 3.472 1.469 -9.910) 10.602 12.376 ( 11.575 6.048 1.246) 13.119 12.919 ( -9.007 -1.378 -1.073) 9.175 13.174 ( -6.697 -3.707 -2.623) 8.092 13.620 ( -1.505 2.764 6.848) 7.536 13.655 ( 2.198 -1.778 8.646) 9.096 14.031 ( -7.977 3.344 -4.914) 9.948 14.239 ( -5.110 3.712 -1.071) 6.406 14.373 ( -8.400 -0.106 -3.884) 9.255 14.852 ( -5.914 -2.911 1.881) 6.855 15.243 ( 14.103 -4.285 -3.883) 15.243 15.980 ( 10.516 -2.882 4.318) 11.727 16.468 ( 11.506 11.467 -7.009) 17.692 16.893 ( 0.479 2.559 -3.077) 4.031 16.935 ( -5.788 6.319 3.666) 9.321 17.849 ( 2.207 -4.695 0.681) 5.233 17.940 ( 3.436 -6.131 4.439) 8.313 18.197 ( -7.078 -1.969 2.654) 7.811 18.953 ( -3.161 -5.028 -7.929) 9.906 20.197 ( 0.198 7.435 2.880) 7.976 21.277 ( -2.405 -3.696 -0.667) 4.460 21.526 ( -0.144 -2.245 2.013) 3.019 21.784 ( -1.218 -2.547 2.569) 3.817 25.058 ( -0.853 -4.434 0.600) 4.555 25.465 ( 3.590 2.781 -1.102) 4.673 28.865 ( -0.785 -2.501 -0.907) 2.774 29.098 ( -0.969 1.871 0.697) 2.220 34.477 ( 0.274 5.674 4.075) 6.991 34.687 ( 2.515 8.550 -5.295) 10.367 37.583 ( 3.491 -0.460 1.256) 3.738 37.973 ( 0.789 -0.686 -1.857) 2.131 40.247 ( -0.352 0.225 -5.162) 5.179 40.966 ( -1.397 0.665 -1.409) 2.093 41.687 ( -4.905 1.022 0.127) 5.012 43.846 ( 2.318 4.918 3.271) 6.345 ======================= Grid point 24 (18/205) ======================= q-point: (-0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.100 ( -27.112 14.099 5.955) 31.134 3.145 ( -6.095 7.364 3.635) 10.227 3.920 ( 1.503 2.517 5.095) 5.878 3.960 ( 5.275 5.429 -2.055) 7.844 4.158 ( -9.023 3.638 -4.062) 10.543 4.887 ( 4.490 -3.662 2.296) 6.232 5.196 ( -3.961 9.253 -8.992) 13.497 5.300 ( 9.011 5.367 -1.958) 10.670 5.672 ( 15.092 8.010 -0.632) 17.097 6.068 ( -8.301 -5.414 2.399) 10.197 6.216 ( -2.771 -25.503 3.706) 25.919 6.460 ( -5.473 7.272 -7.205) 11.608 6.634 ( -7.775 7.463 -0.210) 10.779 7.195 ( 9.167 -0.829 5.010) 10.480 7.508 ( -6.184 1.404 -1.425) 6.499 7.718 ( 3.451 2.163 -1.097) 4.218 7.984 ( 10.628 -6.331 1.455) 12.456 8.200 ( -5.361 -12.350 -0.732) 13.484 8.668 ( -3.824 -4.980 2.043) 6.603 8.880 ( -1.092 -3.435 -3.172) 4.801 9.125 ( 0.224 2.917 0.341) 2.945 9.306 ( 3.257 4.056 3.299) 6.160 9.567 ( 2.568 6.759 0.554) 7.251 10.005 ( -1.359 3.817 3.681) 5.474 10.242 ( 3.573 -6.118 -0.694) 7.119 10.459 ( 4.314 -4.448 -0.811) 6.249 10.714 ( 2.833 3.437 -1.561) 4.720 10.900 ( 4.712 -0.893 0.614) 4.835 11.120 ( -8.059 -2.425 -0.114) 8.417 11.510 ( 4.233 -4.181 2.405) 6.418 11.775 ( -1.576 -7.730 0.276) 7.894 12.165 ( 1.102 4.698 -4.497) 6.597 12.427 ( 13.063 5.487 0.339) 14.173 12.774 ( -14.758 0.985 -2.734) 15.041 13.150 ( -6.707 -4.466 0.469) 8.071 13.591 ( -0.290 1.959 4.904) 5.289 13.726 ( 2.490 1.546 6.686) 7.300 13.864 ( -4.671 6.184 -4.095) 8.766 14.168 ( -2.921 -2.812 -1.735) 4.410 14.295 ( -3.391 -1.035 -2.799) 4.517 14.815 ( -5.440 -0.808 -0.387) 5.513 15.390 ( 6.581 0.126 -1.714) 6.802 16.157 ( 7.246 -3.423 0.709) 8.045 16.400 ( 12.817 12.295 -3.251) 18.056 16.693 ( -12.423 10.605 2.817) 16.575 16.877 ( 1.749 -0.040 -1.613) 2.379 17.980 ( 2.560 -6.861 3.524) 8.127 18.083 ( 0.794 -4.456 1.779) 4.863 18.238 ( 0.650 -8.467 2.951) 8.990 18.944 ( -4.357 -3.146 -7.228) 9.007 20.090 ( -0.209 6.887 0.804) 6.937 21.295 ( -1.526 -1.679 -0.098) 2.270 21.553 ( -0.477 -0.883 1.174) 1.544 21.835 ( 0.181 -3.958 0.759) 4.034 25.120 ( -0.354 -3.742 0.323) 3.773 25.440 ( 2.020 4.129 -0.521) 4.626 28.892 ( -0.471 -2.037 -0.496) 2.149 29.061 ( -0.626 1.515 0.201) 1.651 34.374 ( -1.349 7.336 1.498) 7.608 34.545 ( 0.078 9.836 -1.039) 9.891 37.639 ( 2.576 -1.263 1.237) 3.125 37.981 ( 0.200 -0.158 -0.349) 0.432 40.254 ( 0.428 -2.556 -1.570) 3.030 40.959 ( 0.533 -1.205 -1.697) 2.149 41.569 ( -6.135 5.006 -0.507) 7.934 43.808 ( 1.614 4.125 1.635) 4.721 ======================= Grid point 25 (19/205) ======================= q-point: (-0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.639 ( 0.000 20.678 0.000) 20.678 2.792 ( 0.000 30.549 0.000) 30.549 3.898 ( 0.000 2.059 0.000) 2.059 3.994 ( -0.000 -6.690 -0.000) 6.690 4.169 ( -0.000 -6.765 -0.000) 6.765 4.626 ( 0.000 49.016 0.000) 49.016 5.034 ( -0.000 -6.890 -0.000) 6.890 5.332 ( -0.000 -4.851 -0.000) 4.851 5.674 ( -0.000 -0.300 -0.000) 0.300 6.126 ( -0.000 -4.181 -0.000) 4.181 6.316 ( -0.000 -0.017 -0.000) 0.017 6.454 ( -0.000 -2.827 -0.000) 2.827 6.826 ( -0.000 -28.773 -0.000) 28.773 7.179 ( 0.000 7.930 0.000) 7.930 7.469 ( -0.000 -3.328 -0.000) 3.328 7.732 ( -0.000 -0.972 -0.000) 0.972 8.245 ( -0.000 -8.309 -0.000) 8.309 8.258 ( -0.000 -6.404 -0.000) 6.404 8.736 ( -0.000 -4.405 -0.000) 4.405 8.840 ( 0.000 5.579 0.000) 5.579 9.074 ( 0.000 3.573 0.000) 3.573 9.257 ( 0.000 4.098 0.000) 4.098 9.484 ( 0.000 5.503 0.000) 5.503 9.938 ( 0.000 4.298 0.000) 4.298 10.331 ( -0.000 -3.475 -0.000) 3.475 10.596 ( -0.000 -6.215 -0.000) 6.215 10.639 ( 0.000 5.219 0.000) 5.219 11.067 ( -0.000 -13.672 -0.000) 13.672 11.078 ( 0.000 0.659 0.000) 0.659 11.556 ( 0.000 0.037 0.000) 0.037 11.964 ( -0.000 -12.267 -0.000) 12.267 12.048 ( 0.000 8.640 0.000) 8.640 12.494 ( 0.000 5.232 0.000) 5.232 12.592 ( -0.000 -1.462 -0.000) 1.462 13.181 ( -0.000 -4.607 -0.000) 4.607 13.571 ( 0.000 3.413 0.000) 3.413 13.681 ( 0.000 12.324 0.000) 12.324 13.702 ( 0.000 2.438 0.000) 2.438 14.279 ( -0.000 -10.969 -0.000) 10.969 14.295 ( -0.000 -2.789 -0.000) 2.789 14.774 ( 0.000 0.242 0.000) 0.242 15.386 ( 0.000 4.216 0.000) 4.216 16.228 ( 0.000 0.879 0.000) 0.879 16.315 ( 0.000 16.467 0.000) 16.467 16.411 ( 0.000 5.309 0.000) 5.309 16.914 ( -0.000 -2.507 -0.000) 2.507 18.128 ( -0.000 -7.559 -0.000) 7.559 18.140 ( -0.000 -3.744 -0.000) 3.744 18.446 ( -0.000 -12.368 -0.000) 12.368 18.914 ( -0.000 -0.527 -0.000) 0.527 19.988 ( 0.000 5.642 0.000) 5.642 21.296 ( 0.000 0.258 0.000) 0.258 21.558 ( -0.000 -0.084 -0.000) 0.084 21.911 ( -0.000 -4.667 -0.000) 4.667 25.162 ( -0.000 -1.389 -0.000) 1.389 25.382 ( 0.000 4.254 0.000) 4.254 28.907 ( -0.000 -0.165 -0.000) 0.165 29.045 ( -0.000 -0.173 -0.000) 0.173 34.244 ( 0.000 7.729 0.000) 7.729 34.379 ( 0.000 10.136 0.000) 10.136 37.686 ( -0.000 -2.071 -0.000) 2.071 37.979 ( 0.000 0.496 0.000) 0.496 40.316 ( -0.000 -4.941 -0.000) 4.941 40.993 ( -0.000 -2.104 -0.000) 2.104 41.415 ( 0.000 7.483 0.000) 7.483 43.763 ( 0.000 3.229 0.000) 3.229 ======================= Grid point 30 (20/205) ======================= q-point: ( 0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.680 ( 24.715 0.000 25.163) 35.270 2.967 ( -8.196 -0.000 -0.280) 8.201 3.539 ( -7.524 -0.000 -15.531) 17.258 4.146 ( 10.784 0.000 13.673) 17.414 4.532 ( 7.427 0.000 7.787) 10.761 4.832 ( -25.053 -0.000 15.505) 29.462 5.225 ( -2.994 -0.000 11.299) 11.689 5.320 ( 7.381 0.000 -1.100) 7.462 5.904 ( -6.291 -0.000 -7.764) 9.993 6.072 ( 10.982 0.000 2.469) 11.256 6.447 ( -11.980 -0.000 -13.355) 17.941 6.564 ( -0.487 -0.000 -24.949) 24.954 6.734 ( 29.784 0.000 0.420) 29.786 7.187 ( -0.904 -0.000 -2.438) 2.601 7.350 ( -2.997 -0.000 -0.938) 3.140 7.657 ( -2.134 -0.000 -2.086) 2.985 7.766 ( -13.054 -0.000 -6.610) 14.633 8.025 ( 6.062 0.000 3.909) 7.213 8.505 ( -0.898 -0.000 -2.103) 2.286 8.691 ( -0.719 -0.000 -1.838) 1.973 8.952 ( -8.588 -0.000 0.689) 8.615 9.359 ( 0.977 0.000 -0.985) 1.387 9.662 ( 3.943 0.000 -6.545) 7.641 9.793 ( 7.334 0.000 11.567) 13.696 10.330 ( -1.393 -0.000 20.309) 20.357 10.379 ( -4.572 -0.000 -3.358) 5.672 10.772 ( 3.410 0.000 3.171) 4.657 10.953 ( 6.238 0.000 -7.974) 10.124 11.091 ( -0.338 -0.000 3.406) 3.422 11.419 ( -10.351 -0.000 -0.818) 10.383 11.870 ( -15.148 -0.000 5.446) 16.097 12.244 ( 7.061 0.000 -15.838) 17.341 12.400 ( 7.414 0.000 12.647) 14.660 12.951 ( -6.560 -0.000 -0.031) 6.560 13.122 ( 2.101 0.000 -9.569) 9.796 13.466 ( 2.630 0.000 11.838) 12.127 13.746 ( 1.789 0.000 0.465) 1.848 14.208 ( -10.998 -0.000 -4.853) 12.020 14.435 ( -9.574 -0.000 -4.559) 10.604 14.582 ( -8.357 -0.000 3.711) 9.144 14.729 ( 5.493 0.000 6.967) 8.872 14.874 ( 11.463 0.000 -5.094) 12.544 15.832 ( 4.816 0.000 5.020) 6.957 16.679 ( 10.072 0.000 -17.661) 20.331 16.937 ( 8.432 0.000 -0.877) 8.478 17.049 ( 6.838 0.000 3.705) 7.777 17.666 ( 1.610 0.000 0.614) 1.723 17.864 ( -9.198 -0.000 1.905) 9.393 18.306 ( -14.273 -0.000 5.147) 15.172 18.811 ( 2.946 0.000 -7.422) 7.985 20.458 ( -0.851 -0.000 6.250) 6.308 21.111 ( -2.092 -0.000 -0.051) 2.093 21.422 ( 0.680 0.000 1.669) 1.803 21.727 ( -1.516 -0.000 6.239) 6.421 24.931 ( -0.961 -0.000 0.586) 1.125 25.475 ( 4.362 0.000 -1.521) 4.620 28.805 ( -0.968 -0.000 -0.785) 1.246 29.158 ( -0.844 -0.000 0.989) 1.301 34.555 ( 5.160 0.000 9.633) 10.928 34.952 ( 3.404 0.000 -18.310) 18.624 37.533 ( 3.913 0.000 0.125) 3.915 37.938 ( 2.069 0.000 -4.858) 5.281 40.347 ( -1.550 -0.000 -11.632) 11.734 41.128 ( -12.349 -0.000 -3.003) 12.709 41.618 ( 7.879 0.000 5.035) 9.350 43.989 ( -0.102 -0.000 4.864) 4.865 ======================= Grid point 31 (21/205) ======================= q-point: ( 0.44 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.764 ( -15.661 1.754 5.467) 16.680 2.966 ( 6.068 2.256 12.258) 13.862 3.521 ( -7.657 -14.596 -14.456) 21.924 4.388 ( 17.167 0.389 5.517) 18.036 4.632 ( -7.865 2.320 10.146) 13.045 4.678 ( 3.101 -0.957 15.793) 16.123 5.237 ( -0.526 0.544 7.896) 7.932 5.316 ( -4.253 -0.972 1.123) 4.505 5.672 ( -6.518 19.882 -16.949) 26.926 5.981 ( 6.449 5.050 -4.292) 9.248 6.289 ( -0.733 -1.182 4.071) 4.302 6.797 ( -4.027 -21.535 -14.556) 26.303 6.971 ( 11.099 10.732 6.541) 16.767 7.087 ( -1.009 4.420 -7.109) 8.431 7.296 ( -1.948 1.815 -1.881) 3.259 7.482 ( 0.344 1.730 -12.022) 12.151 7.857 ( 2.017 -8.864 -4.178) 10.005 8.167 ( 4.917 -6.667 8.560) 11.912 8.453 ( -2.878 2.865 0.813) 4.142 8.666 ( -3.087 0.711 -3.421) 4.662 8.933 ( -4.180 -7.884 -0.276) 8.927 9.373 ( 3.976 1.144 0.686) 4.194 9.727 ( 3.198 -5.965 -4.564) 8.163 9.883 ( 6.968 4.747 10.146) 13.192 10.245 ( -4.023 6.816 -0.682) 7.944 10.397 ( -0.554 -0.359 11.612) 11.631 10.817 ( 1.781 -0.601 -0.205) 1.890 10.981 ( 7.840 3.593 -1.498) 8.753 11.169 ( 3.923 -4.708 0.742) 6.173 11.269 ( -10.146 3.412 -1.046) 10.755 11.725 ( -14.594 -1.967 4.867) 15.509 12.252 ( 6.403 1.518 -13.250) 14.794 12.517 ( 8.949 2.089 5.933) 10.939 12.882 ( -7.309 -1.097 1.591) 7.560 13.101 ( -1.235 -0.761 -7.937) 8.068 13.542 ( -1.246 -2.514 11.319) 11.661 13.736 ( -0.896 2.376 1.645) 3.026 14.061 ( -9.985 -0.161 -4.999) 11.168 14.316 ( -6.142 0.965 -4.191) 7.498 14.475 ( -4.985 3.887 2.014) 6.634 14.782 ( -1.908 -1.385 6.493) 6.908 15.080 ( 16.937 -4.169 -5.936) 18.425 15.910 ( 4.516 -1.301 4.130) 6.256 16.709 ( 9.828 3.501 -12.467) 16.257 16.983 ( 2.986 2.385 -1.913) 4.274 17.088 ( 0.585 2.761 4.167) 5.032 17.730 ( 3.915 -2.551 1.331) 4.859 17.797 ( -4.441 -2.085 2.287) 5.413 18.166 ( -11.793 -0.321 3.197) 12.222 18.835 ( 1.690 -2.089 -5.780) 6.374 20.425 ( -0.046 5.462 3.779) 6.641 21.127 ( -1.977 -4.351 -0.248) 4.785 21.450 ( 0.561 -1.737 1.424) 2.315 21.734 ( -1.637 -0.664 4.281) 4.631 24.942 ( -0.675 -2.240 0.434) 2.380 25.513 ( 3.530 0.536 -1.103) 3.737 28.801 ( -0.845 -1.164 -0.646) 1.577 29.144 ( -0.950 0.816 0.725) 1.447 34.620 ( 3.235 2.670 6.801) 7.990 34.894 ( 2.150 3.694 -10.292) 11.145 37.578 ( 3.447 0.014 0.487) 3.481 37.947 ( 1.393 -0.629 -3.366) 3.697 40.281 ( -0.880 1.082 -8.788) 8.898 40.982 ( -8.503 0.366 -1.830) 8.705 41.713 ( 4.314 0.495 3.235) 5.415 43.981 ( 0.376 2.747 3.324) 4.329 ======================= Grid point 32 (22/205) ======================= q-point: ( 0.56 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.556 ( -13.368 9.435 7.625) 18.051 2.955 ( -4.205 -2.556 3.366) 5.962 3.664 ( -3.380 -16.685 -8.141) 18.870 4.454 ( -3.906 7.808 0.963) 8.783 4.539 ( 8.736 15.338 5.327) 18.437 4.767 ( 4.593 3.802 10.225) 11.836 5.218 ( -3.002 -0.258 -7.204) 7.808 5.329 ( 7.842 -3.702 -11.018) 14.021 5.404 ( -7.885 -9.159 5.878) 13.439 6.049 ( 4.795 12.245 2.259) 13.343 6.265 ( 3.793 0.576 4.712) 6.076 6.806 ( -1.839 1.000 4.172) 4.667 6.834 ( -4.335 14.346 -4.049) 15.524 7.079 ( -6.670 -8.429 -1.662) 10.876 7.261 ( -1.025 -6.510 -11.258) 13.045 7.619 ( 7.114 -11.648 -2.848) 13.942 7.896 ( 2.676 5.065 -1.132) 5.839 8.253 ( -0.588 7.902 1.505) 8.065 8.513 ( 0.627 -13.332 5.505) 14.438 8.604 ( -2.512 -1.239 -4.097) 4.963 9.043 ( -1.218 -8.163 -0.309) 8.259 9.415 ( 4.163 1.448 1.836) 4.775 9.839 ( 6.127 6.592 1.532) 9.129 9.912 ( 0.804 -7.234 -0.294) 7.284 10.115 ( -2.109 3.235 1.445) 4.123 10.415 ( -0.147 1.127 3.066) 3.270 10.836 ( 4.132 2.404 -0.741) 4.837 11.023 ( 4.057 4.591 1.935) 6.425 11.088 ( -8.146 1.132 1.571) 8.373 11.306 ( 6.903 -5.468 -1.688) 8.966 11.628 ( -11.426 -3.074 1.438) 11.920 12.253 ( 4.689 1.766 -6.796) 8.443 12.598 ( 10.042 3.310 0.926) 10.614 12.812 ( -8.555 0.004 2.469) 8.904 13.052 ( -4.022 -0.599 -4.099) 5.774 13.613 ( -1.884 -4.761 7.152) 8.796 13.679 ( -2.498 2.322 2.330) 4.130 13.945 ( -5.192 1.418 -3.977) 6.692 14.229 ( -1.401 3.051 -2.301) 4.070 14.369 ( -2.616 3.904 -0.169) 4.702 14.792 ( -1.820 -0.530 2.588) 3.208 15.299 ( 9.397 -4.973 -2.975) 11.040 16.020 ( 3.916 -4.197 2.507) 6.263 16.701 ( 8.332 6.208 -6.910) 12.479 16.937 ( 0.589 3.770 -2.166) 4.388 16.999 ( -4.917 7.290 4.289) 9.784 17.795 ( 0.477 -4.025 0.382) 4.071 17.895 ( 3.691 -6.650 3.604) 8.416 18.074 ( -7.835 -1.970 0.442) 8.091 18.860 ( 0.089 -2.026 -3.815) 4.321 20.330 ( 0.092 7.550 1.705) 7.741 21.182 ( -1.310 -4.918 -0.226) 5.094 21.495 ( 0.250 -2.459 0.959) 2.651 21.746 ( -0.978 -1.465 1.876) 2.574 24.986 ( -0.330 -3.840 0.258) 3.862 25.528 ( 2.000 1.419 -0.582) 2.520 28.817 ( -0.512 -2.064 -0.433) 2.170 29.118 ( -0.620 1.514 0.389) 1.682 34.595 ( 0.977 5.853 2.704) 6.521 34.811 ( 1.223 6.066 -3.586) 7.152 37.616 ( 2.131 -0.269 0.588) 2.227 37.962 ( 0.605 -0.857 -1.473) 1.808 40.233 ( -0.198 0.726 -4.072) 4.141 40.912 ( -3.843 -1.424 -1.309) 4.302 41.717 ( 0.707 3.842 1.415) 4.155 43.945 ( 0.696 3.874 1.752) 4.308 ======================= Grid point 33 (23/205) ======================= q-point: (-0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.230 ( 0.000 18.723 0.000) 18.723 3.060 ( -0.000 -10.232 -0.000) 10.232 3.878 ( -0.000 -12.974 -0.000) 12.974 4.188 ( 0.000 23.605 0.000) 23.605 4.265 ( 0.000 13.810 0.000) 13.810 4.852 ( -0.000 -3.899 -0.000) 3.899 5.213 ( -0.000 -0.657 -0.000) 0.657 5.493 ( 0.000 3.735 0.000) 3.735 5.587 ( -0.000 -21.271 -0.000) 21.271 5.853 ( -0.000 -1.608 -0.000) 1.608 6.274 ( 0.000 13.253 0.000) 13.253 6.542 ( 0.000 11.997 0.000) 11.997 6.712 ( 0.000 8.362 0.000) 8.362 7.250 ( -0.000 -7.776 -0.000) 7.776 7.332 ( -0.000 -10.751 -0.000) 10.751 7.799 ( 0.000 4.995 0.000) 4.995 7.890 ( -0.000 -13.533 -0.000) 13.533 8.108 ( 0.000 6.434 0.000) 6.434 8.587 ( -0.000 -2.269 -0.000) 2.269 8.759 ( -0.000 -11.212 -0.000) 11.212 9.129 ( -0.000 -3.013 -0.000) 3.013 9.401 ( 0.000 4.133 0.000) 4.133 9.718 ( 0.000 9.566 0.000) 9.566 10.037 ( -0.000 -1.195 -0.000) 1.195 10.135 ( -0.000 -8.012 -0.000) 8.012 10.416 ( -0.000 -1.740 -0.000) 1.740 10.825 ( 0.000 4.830 0.000) 4.830 10.898 ( 0.000 3.438 0.000) 3.438 11.088 ( 0.000 0.405 0.000) 0.405 11.529 ( -0.000 -12.768 -0.000) 12.768 11.557 ( -0.000 -0.506 -0.000) 0.506 12.233 ( 0.000 3.044 0.000) 3.044 12.663 ( 0.000 3.591 0.000) 3.591 12.666 ( 0.000 5.040 0.000) 5.040 13.040 ( -0.000 -3.238 -0.000) 3.238 13.621 ( 0.000 2.104 0.000) 2.104 13.741 ( -0.000 -8.215 -0.000) 8.215 13.854 ( 0.000 4.410 0.000) 4.410 14.155 ( 0.000 4.233 0.000) 4.233 14.302 ( 0.000 2.471 0.000) 2.471 14.785 ( 0.000 0.180 0.000) 0.180 15.411 ( -0.000 -2.617 -0.000) 2.617 16.129 ( -0.000 -5.091 -0.000) 5.091 16.644 ( 0.000 7.111 0.000) 7.111 16.799 ( 0.000 12.865 0.000) 12.865 16.891 ( 0.000 1.637 0.000) 1.637 17.889 ( -0.000 -6.620 -0.000) 6.620 18.043 ( -0.000 -2.209 -0.000) 2.209 18.081 ( -0.000 -10.129 -0.000) 10.129 18.877 ( -0.000 -1.540 -0.000) 1.540 20.210 ( 0.000 7.862 0.000) 7.862 21.243 ( -0.000 -3.642 -0.000) 3.642 21.533 ( -0.000 -1.768 -0.000) 1.768 21.779 ( -0.000 -3.012 -0.000) 3.012 25.052 ( -0.000 -4.409 -0.000) 4.409 25.507 ( 0.000 2.753 0.000) 2.753 28.850 ( -0.000 -2.513 -0.000) 2.513 29.087 ( 0.000 1.908 0.000) 1.908 34.494 ( 0.000 7.631 0.000) 7.631 34.695 ( 0.000 8.637 0.000) 8.637 37.639 ( -0.000 -0.862 -0.000) 0.862 37.975 ( -0.000 -0.661 -0.000) 0.661 40.225 ( -0.000 -0.818 -0.000) 0.818 40.920 ( -0.000 -2.358 -0.000) 2.358 41.636 ( 0.000 6.204 0.000) 6.204 43.888 ( 0.000 4.287 0.000) 4.287 ======================= Grid point 40 (24/205) ======================= q-point: ( 0.44 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.539 ( -15.030 -0.000 -0.945) 15.060 3.161 ( 5.648 0.000 4.751) 7.381 3.285 ( -5.616 -0.000 -3.493) 6.614 4.582 ( 10.950 0.000 3.874) 11.615 4.623 ( -2.312 -0.000 9.034) 9.325 4.803 ( 10.973 0.000 0.241) 10.975 5.179 ( -12.222 -0.000 7.725) 14.459 5.349 ( 5.577 0.000 22.162) 22.853 5.884 ( 3.712 0.000 -2.219) 4.325 5.886 ( -14.457 -0.000 -30.748) 33.977 6.095 ( -7.088 -0.000 -8.520) 11.083 6.694 ( 15.165 0.000 11.267) 18.892 7.158 ( -0.173 -0.000 -5.602) 5.604 7.194 ( -0.999 -0.000 -7.271) 7.339 7.247 ( 0.025 0.000 5.018) 5.018 7.339 ( -12.428 -0.000 -7.316) 14.421 7.858 ( 14.471 0.000 -1.873) 14.591 8.209 ( 3.944 0.000 3.692) 5.402 8.467 ( -1.353 -0.000 -0.470) 1.432 8.637 ( -1.830 -0.000 -1.387) 2.296 8.797 ( -4.483 -0.000 0.279) 4.491 9.422 ( 2.779 0.000 0.520) 2.827 9.679 ( 1.077 0.000 -2.877) 3.072 10.041 ( 5.885 0.000 10.134) 11.719 10.237 ( -4.578 -0.000 -5.999) 7.546 10.440 ( -0.063 -0.000 10.015) 10.015 10.813 ( 0.777 0.000 -2.427) 2.548 11.142 ( 11.604 0.000 -2.669) 11.907 11.151 ( 1.633 0.000 2.880) 3.311 11.218 ( -4.974 -0.000 -0.628) 5.014 11.545 ( -13.783 -0.000 3.186) 14.146 12.292 ( 4.710 0.000 -8.323) 9.564 12.615 ( 3.321 0.000 2.122) 3.941 12.816 ( -3.841 -0.000 2.727) 4.710 13.059 ( -0.823 -0.000 -5.555) 5.615 13.522 ( -4.123 -0.000 7.717) 8.749 13.739 ( -1.927 -0.000 0.740) 2.065 13.964 ( -3.574 -0.000 -3.386) 4.923 14.277 ( -0.662 -0.000 -2.471) 2.558 14.451 ( -4.381 -0.000 1.072) 4.510 14.784 ( -0.443 -0.000 3.865) 3.890 15.191 ( 10.140 0.000 -3.515) 10.732 15.943 ( 1.863 0.000 1.990) 2.726 16.797 ( 7.260 0.000 -7.992) 10.797 17.028 ( 1.286 0.000 -0.568) 1.406 17.111 ( -2.426 -0.000 2.910) 3.788 17.739 ( -2.392 -0.000 1.213) 2.682 17.769 ( 4.111 0.000 2.015) 4.578 18.048 ( -8.211 -0.000 1.018) 8.274 18.826 ( 1.503 0.000 -3.011) 3.366 20.481 ( -0.062 -0.000 1.823) 1.824 21.072 ( -0.968 -0.000 -0.043) 0.969 21.446 ( 0.378 0.000 0.727) 0.820 21.727 ( -0.994 -0.000 2.351) 2.552 24.919 ( -0.321 -0.000 0.206) 0.381 25.547 ( 1.967 0.000 -0.569) 2.047 28.782 ( -0.498 -0.000 -0.317) 0.590 29.143 ( -0.614 -0.000 0.369) 0.717 34.697 ( 1.888 0.000 3.944) 4.373 34.906 ( 0.754 0.000 -5.298) 5.351 37.614 ( 2.084 0.000 0.313) 2.108 37.945 ( 0.772 0.000 -1.882) 2.034 40.254 ( -0.375 -0.000 -5.291) 5.304 40.887 ( -5.557 -0.000 -0.881) 5.626 41.783 ( 3.158 0.000 1.988) 3.732 44.013 ( -0.037 -0.000 1.644) 1.644 ======================= Grid point 41 (25/205) ======================= q-point: (-0.44 -0.56 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.487 ( -0.000 -4.426 -0.000) 4.426 3.080 ( 0.000 12.948 0.000) 12.948 3.360 ( -0.000 -13.908 -0.000) 13.908 4.552 ( 0.000 7.317 0.000) 7.317 4.685 ( -0.000 -2.790 -0.000) 2.790 4.991 ( -0.000 -4.645 -0.000) 4.645 5.123 ( -0.000 -2.131 -0.000) 2.131 5.323 ( 0.000 20.857 0.000) 20.857 5.398 ( 0.000 8.068 0.000) 8.068 6.114 ( -0.000 -19.444 -0.000) 19.444 6.231 ( -0.000 -4.087 -0.000) 4.087 6.763 ( 0.000 1.660 0.000) 1.660 7.010 ( 0.000 10.883 0.000) 10.883 7.018 ( 0.000 8.738 0.000) 8.738 7.245 ( 0.000 2.173 0.000) 2.173 7.440 ( -0.000 -13.784 -0.000) 13.784 7.973 ( 0.000 0.200 0.000) 0.200 8.310 ( -0.000 -10.055 -0.000) 10.055 8.385 ( 0.000 7.084 0.000) 7.084 8.603 ( 0.000 2.021 0.000) 2.021 8.877 ( -0.000 -10.542 -0.000) 10.542 9.446 ( -0.000 -0.501 -0.000) 0.501 9.743 ( -0.000 -7.651 -0.000) 7.651 10.083 ( 0.000 10.023 0.000) 10.023 10.118 ( 0.000 0.763 0.000) 0.763 10.448 ( 0.000 1.540 0.000) 1.540 10.847 ( -0.000 -3.363 -0.000) 3.363 11.113 ( 0.000 3.581 0.000) 3.581 11.117 ( 0.000 7.297 0.000) 7.297 11.287 ( -0.000 -4.437 -0.000) 4.437 11.486 ( -0.000 -3.713 -0.000) 3.713 12.295 ( 0.000 1.129 0.000) 1.129 12.654 ( -0.000 -2.148 -0.000) 2.148 12.788 ( 0.000 1.823 0.000) 1.823 13.031 ( 0.000 1.177 0.000) 1.177 13.534 ( -0.000 -3.314 -0.000) 3.314 13.708 ( 0.000 2.306 0.000) 2.306 13.933 ( 0.000 0.835 0.000) 0.835 14.260 ( 0.000 1.588 0.000) 1.588 14.402 ( 0.000 2.633 0.000) 2.633 14.789 ( 0.000 0.096 0.000) 0.096 15.278 ( -0.000 -3.809 -0.000) 3.809 15.983 ( -0.000 -3.029 -0.000) 3.029 16.806 ( 0.000 2.740 0.000) 2.740 17.001 ( 0.000 3.665 0.000) 3.665 17.070 ( 0.000 3.815 0.000) 3.815 17.746 ( -0.000 -2.214 -0.000) 2.214 17.839 ( -0.000 -4.432 -0.000) 4.432 18.001 ( -0.000 -0.571 -0.000) 0.571 18.835 ( -0.000 -0.812 -0.000) 0.812 20.439 ( 0.000 5.277 0.000) 5.277 21.101 ( -0.000 -3.967 -0.000) 3.967 21.464 ( -0.000 -1.712 -0.000) 1.712 21.729 ( -0.000 -0.506 -0.000) 0.506 24.936 ( -0.000 -2.237 -0.000) 2.237 25.554 ( 0.000 0.516 0.000) 0.516 28.787 ( -0.000 -1.126 -0.000) 1.126 29.133 ( 0.000 0.815 0.000) 0.815 34.686 ( 0.000 3.675 0.000) 3.675 34.879 ( 0.000 2.761 0.000) 2.761 37.627 ( -0.000 -0.052 -0.000) 0.052 37.951 ( -0.000 -0.601 -0.000) 0.601 40.235 ( 0.000 0.681 0.000) 0.681 40.861 ( -0.000 -1.097 -0.000) 1.097 41.784 ( 0.000 2.655 0.000) 2.655 43.999 ( 0.000 2.111 0.000) 2.111 ======================= Grid point 83 (26/205) ======================= q-point: ( 0.00 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.810 ( 15.072 0.000 42.842) 45.416 0.926 ( -7.056 -0.000 48.403) 48.915 1.083 ( 14.887 0.000 56.613) 58.538 3.838 ( -5.153 -0.000 3.544) 6.254 4.452 ( 1.515 0.000 -0.099) 1.518 4.801 ( 2.508 0.000 9.871) 10.184 5.319 ( -8.786 -0.000 2.558) 9.151 5.747 ( 2.467 0.000 -1.555) 2.917 6.080 ( 5.563 0.000 -14.890) 15.895 6.147 ( -0.702 -0.000 -4.606) 4.659 6.348 ( -9.515 -0.000 0.822) 9.550 6.507 ( 1.284 0.000 -1.217) 1.769 7.108 ( -1.216 -0.000 -13.247) 13.303 7.490 ( -0.164 -0.000 4.944) 4.947 7.833 ( -18.545 -0.000 -15.556) 24.206 7.947 ( 10.172 0.000 -3.989) 10.927 7.976 ( 7.461 0.000 -6.324) 9.781 8.267 ( 9.988 0.000 7.591) 12.545 8.463 ( 0.754 0.000 2.402) 2.517 8.555 ( -1.070 -0.000 1.327) 1.705 9.173 ( -6.843 -0.000 -1.468) 6.998 9.219 ( 1.471 0.000 1.325) 1.979 9.509 ( -0.547 -0.000 -0.264) 0.607 9.577 ( -0.583 -0.000 0.777) 0.972 10.508 ( 2.517 0.000 2.382) 3.465 10.547 ( -0.215 -0.000 2.175) 2.185 10.702 ( 1.756 0.000 -0.710) 1.894 11.491 ( -2.606 -0.000 1.964) 3.263 11.679 ( 1.882 0.000 1.963) 2.720 11.883 ( 1.982 0.000 -0.543) 2.055 11.986 ( -8.227 -0.000 2.258) 8.531 12.393 ( 3.890 0.000 0.435) 3.914 12.472 ( -10.000 -0.000 -2.160) 10.231 12.942 ( -9.516 -0.000 -0.486) 9.529 13.084 ( 2.427 0.000 -5.941) 6.417 13.546 ( 6.079 0.000 0.514) 6.101 13.825 ( -8.070 -0.000 5.604) 9.825 14.157 ( 90.005 0.000 -13.949) 91.079 14.577 ( -78.031 -0.000 1.274) 78.041 14.788 ( 26.179 0.000 10.768) 28.307 14.970 ( -4.234 -0.000 -0.564) 4.271 15.260 ( 2.246 0.000 0.461) 2.292 15.308 ( 9.168 0.000 -2.338) 9.462 15.385 ( -0.745 -0.000 2.086) 2.215 16.044 ( -3.419 -0.000 6.566) 7.403 17.013 ( -37.459 -0.000 0.564) 37.463 17.927 ( -0.621 -0.000 -0.944) 1.130 18.234 ( 5.931 0.000 -6.399) 8.725 18.443 ( -1.742 -0.000 3.600) 4.000 18.872 ( 3.269 0.000 -0.349) 3.287 20.932 ( 45.289 0.000 0.624) 45.294 21.199 ( 0.270 0.000 -1.325) 1.352 21.371 ( 0.778 0.000 0.366) 0.860 21.545 ( 0.346 0.000 -0.582) 0.677 24.990 ( 0.247 0.000 0.960) 0.992 25.307 ( -0.838 -0.000 -0.909) 1.236 28.853 ( -0.530 -0.000 1.041) 1.168 29.108 ( 1.022 0.000 -0.683) 1.229 34.073 ( 4.539 0.000 2.761) 5.313 35.003 (-195.631 -0.000 -3.383) 195.661 37.425 ( -1.141 -0.000 1.704) 2.051 37.886 ( -1.310 -0.000 -1.533) 2.016 40.674 ( -5.864 -0.000 0.765) 5.914 41.040 ( 3.273 0.000 -2.440) 4.082 41.805 ( -2.243 -0.000 -0.584) 2.318 41.927 ( 126.431 0.000 -0.425) 126.431 ======================= Grid point 84 (27/205) ======================= q-point: ( 0.11 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.073 ( 20.884 -9.414 29.335) 37.220 1.472 ( 34.892 -20.837 30.199) 50.632 2.257 ( 35.023 -45.352 44.337) 72.451 3.822 ( -1.903 -2.586 0.504) 3.249 4.400 ( -0.596 7.794 -0.148) 7.818 4.819 ( 4.509 9.250 10.639) 14.801 5.185 ( -5.393 2.284 0.185) 5.860 5.832 ( -3.547 -6.016 -1.929) 7.245 5.973 ( 0.678 8.111 -4.675) 9.386 6.150 ( -1.790 5.768 -5.011) 7.847 6.230 ( -1.792 -1.426 -5.323) 5.795 6.553 ( 0.554 -2.932 -1.905) 3.540 6.975 ( 2.106 4.739 -13.003) 13.999 7.354 ( -8.159 11.713 4.749) 15.044 7.638 ( -16.272 -6.781 -13.880) 22.437 7.926 ( 3.824 7.963 -4.284) 9.817 8.117 ( 5.147 -6.598 -13.628) 15.992 8.365 ( -1.424 -1.487 4.185) 4.664 8.530 ( 3.419 -5.157 0.593) 6.216 8.673 ( 7.257 -6.846 3.760) 10.662 9.032 ( -2.343 5.549 -8.621) 10.517 9.211 ( 3.113 4.084 -0.397) 5.151 9.459 ( -4.944 4.947 0.417) 7.007 9.579 ( -0.490 -2.536 -0.027) 2.583 10.503 ( -3.688 0.264 4.442) 5.779 10.537 ( -0.003 4.116 1.522) 4.389 10.706 ( -0.976 0.460 1.200) 1.614 11.399 ( -13.197 5.995 15.756) 21.409 11.640 ( -12.104 -3.534 2.630) 12.880 11.814 ( -1.578 8.332 4.715) 9.703 11.864 ( -1.126 7.553 4.791) 9.015 12.081 ( -16.514 0.363 -0.308) 16.521 12.613 ( 4.319 -7.465 5.861) 10.427 12.934 ( -2.589 -7.299 -3.783) 8.619 13.115 ( 5.721 -0.359 -5.467) 7.921 13.415 ( -1.166 31.834 23.547) 39.614 13.572 ( 2.479 3.565 5.111) 6.706 13.813 ( -6.526 1.780 6.580) 9.437 14.449 ( 12.198 7.008 -8.856) 16.623 14.721 ( 3.173 11.636 2.121) 12.246 14.966 ( -2.458 -4.188 3.839) 6.190 15.317 ( 8.746 6.640 3.406) 11.497 15.530 ( -2.423 -11.116 -0.937) 11.416 16.053 ( 17.319 -14.096 -12.732) 25.705 16.191 ( 3.224 -20.273 -8.465) 22.205 16.748 ( -21.150 -1.946 8.822) 22.999 17.931 ( -7.710 -3.011 -7.022) 10.854 18.281 ( 1.790 0.972 -10.080) 10.284 18.450 ( 3.403 2.903 -1.472) 4.709 18.983 ( 2.471 -9.543 -1.041) 9.912 20.657 ( -0.033 27.386 17.227) 32.353 21.208 ( 0.896 -1.490 -1.771) 2.482 21.536 ( -2.762 -3.236 -1.957) 4.683 21.745 ( 1.904 -12.579 -8.020) 15.039 25.022 ( -0.176 -3.140 1.276) 3.394 25.301 ( -0.348 -0.313 -1.581) 1.649 28.860 ( -0.347 -0.813 0.709) 1.133 29.131 ( 0.908 -0.523 0.418) 1.128 33.965 ( -11.158 -2.565 6.436) 13.134 34.176 ( 6.062 -2.152 6.298) 9.002 37.512 ( -5.261 -8.197 -3.029) 10.200 37.875 ( -0.588 -0.798 -2.294) 2.499 40.569 ( -5.703 3.560 -2.125) 7.051 41.049 ( 3.196 3.920 1.424) 5.254 41.625 ( 11.595 9.514 4.255) 15.590 43.224 ( 43.493 -13.454 -34.991) 57.419 ======================= Grid point 85 (28/205) ======================= q-point: ( 0.22 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.710 ( 28.399 -18.987 12.970) 36.540 2.374 ( 38.992 -22.978 18.651) 48.951 3.441 ( 22.022 -33.418 31.873) 51.163 3.898 ( 3.199 -7.834 -2.029) 8.702 4.245 ( 2.918 7.990 3.518) 9.205 4.648 ( -1.162 15.506 -1.453) 15.617 5.209 ( 5.026 -1.474 6.877) 8.645 5.690 ( -6.691 14.146 -3.949) 16.139 5.721 ( -16.447 6.383 3.395) 17.966 6.137 ( 1.054 -2.185 -5.349) 5.873 6.225 ( -2.256 -4.022 1.056) 4.731 6.608 ( 2.133 -4.285 -4.434) 6.525 6.937 ( 0.070 1.589 -13.845) 13.936 7.101 ( -4.993 4.573 3.843) 7.786 7.501 ( -11.342 -1.506 -6.587) 13.202 7.805 ( -5.399 4.778 -2.375) 7.591 8.001 ( 1.257 15.976 -12.002) 20.022 8.464 ( -0.625 -8.328 -0.561) 8.370 8.714 ( 4.826 -10.779 -2.614) 12.096 8.812 ( 0.773 -3.546 1.786) 4.045 8.952 ( 3.923 1.022 -12.045) 12.708 9.209 ( 7.569 3.134 -1.469) 8.323 9.303 ( -4.976 6.180 0.292) 7.939 9.610 ( -1.479 -3.987 -1.274) 4.440 10.401 ( -6.540 5.933 5.072) 10.183 10.496 ( -4.197 -0.454 5.493) 6.928 10.678 ( -2.019 1.359 2.894) 3.781 11.178 ( -14.080 7.311 7.665) 17.619 11.555 ( -14.067 -4.569 1.025) 14.826 11.706 ( 0.378 5.835 2.275) 6.274 11.853 ( 8.417 4.063 7.456) 11.956 11.988 ( -1.384 1.082 -6.795) 7.019 12.593 ( -7.624 10.483 14.402) 19.376 13.040 ( -0.456 -9.414 -3.440) 10.033 13.195 ( 3.941 -5.507 -7.618) 10.193 13.322 ( 11.000 3.305 6.508) 13.201 13.529 ( 1.143 6.015 5.903) 8.505 13.847 ( 4.580 -3.017 5.775) 7.964 14.376 ( 1.082 7.516 0.396) 7.603 14.663 ( 7.707 4.538 -1.790) 9.121 15.064 ( -0.320 -7.096 4.958) 8.663 15.290 ( -2.041 3.363 1.570) 4.236 15.644 ( -1.784 -7.091 0.292) 7.318 16.291 ( 3.251 -1.917 4.638) 5.979 16.455 ( -3.468 -15.577 -18.399) 24.356 16.603 ( 3.390 2.567 8.349) 9.369 17.832 ( -5.714 0.490 -8.412) 10.181 18.192 ( -3.317 3.164 -7.927) 9.157 18.399 ( 0.348 4.882 -1.244) 5.050 19.143 ( -0.754 -8.612 -1.686) 8.808 20.387 ( -1.933 14.504 15.529) 21.336 21.254 ( 2.397 -2.576 -1.948) 4.022 21.540 ( -1.447 -1.393 -1.712) 2.639 21.837 ( -0.733 -3.420 -2.544) 4.325 25.086 ( -0.928 -4.704 1.386) 4.990 25.294 ( 0.212 0.183 -1.653) 1.677 28.876 ( -0.590 -1.631 0.666) 1.858 29.141 ( 0.515 0.825 1.815) 2.060 34.079 ( 12.795 -3.388 -8.500) 15.731 34.325 ( 6.421 -3.131 8.629) 11.202 37.530 ( -4.301 -3.226 -1.877) 5.695 37.883 ( 0.070 -1.914 -3.047) 3.599 40.432 ( -4.813 3.895 -3.018) 6.888 41.019 ( 0.748 4.008 5.129) 6.552 41.697 ( 8.339 -0.719 -1.143) 8.448 43.511 ( 17.198 0.855 -19.551) 26.052 ======================= Grid point 86 (29/205) ======================= q-point: ( 0.33 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.374 ( 24.017 -19.265 8.401) 31.914 3.211 ( 32.285 -20.625 11.256) 39.930 3.743 ( 4.643 12.750 9.465) 16.545 4.012 ( 5.271 -1.861 -5.513) 7.851 4.373 ( 2.104 12.823 -5.506) 14.113 4.624 ( 10.938 -21.711 14.180) 28.144 5.222 ( -9.587 5.995 5.450) 12.552 5.381 ( -18.953 7.969 8.094) 22.096 5.469 ( -6.086 3.201 2.839) 7.439 6.166 ( -0.573 -6.959 -4.321) 8.211 6.328 ( -1.864 -10.840 4.868) 12.028 6.687 ( 7.655 4.146 -1.178) 8.785 6.781 ( -3.384 2.005 -6.383) 7.498 7.154 ( 2.262 -3.623 1.184) 4.432 7.399 ( -6.251 -3.891 -7.304) 10.371 7.611 ( -3.249 8.865 -6.451) 11.435 7.738 ( 0.152 11.600 -3.597) 12.146 8.453 ( -6.424 4.506 -5.962) 9.855 8.832 ( 3.551 -0.112 -7.726) 8.504 8.923 ( 1.913 -7.846 -9.836) 12.726 9.016 ( 5.777 -6.736 -1.917) 9.079 9.130 ( 1.749 8.208 0.310) 8.398 9.285 ( 1.283 -1.156 3.558) 3.955 9.695 ( 1.505 -8.059 -3.326) 8.847 10.268 ( -7.486 1.877 5.019) 9.207 10.465 ( -4.648 1.199 6.472) 8.058 10.645 ( -1.382 1.760 3.522) 4.173 10.888 ( -10.609 11.421 -1.552) 15.666 11.474 ( -9.483 -3.264 -1.690) 10.171 11.657 ( -0.276 2.091 2.152) 3.013 11.840 ( 8.900 11.554 -2.647) 14.823 11.998 ( 2.028 -1.779 0.548) 2.753 12.386 ( -12.155 4.903 13.328) 18.693 13.152 ( -2.863 -8.354 -2.770) 9.256 13.284 ( 1.014 -4.299 -6.706) 8.029 13.430 ( 9.613 2.655 4.537) 10.956 13.511 ( 6.865 3.513 3.960) 8.669 14.002 ( 6.631 -2.790 3.315) 7.921 14.315 ( 2.354 3.122 7.736) 8.668 14.697 ( 5.936 1.567 -1.728) 6.378 15.185 ( -9.028 1.446 0.005) 9.143 15.198 ( 1.715 -5.683 4.861) 7.673 15.697 ( -7.729 -4.472 2.023) 9.156 16.140 ( -9.706 6.176 -0.166) 11.506 16.630 ( 8.836 -7.216 -5.847) 12.819 16.787 ( 9.912 -5.386 1.425) 11.371 17.746 ( -1.656 -0.116 -8.084) 8.253 18.060 ( -4.773 3.712 -5.824) 8.395 18.318 ( 0.353 4.346 -1.499) 4.611 19.218 ( -4.360 -5.567 -1.002) 7.142 20.244 ( -1.240 8.666 11.351) 14.335 21.321 ( 2.195 -2.816 -0.981) 3.703 21.536 ( -0.328 -0.433 -1.881) 1.958 21.847 ( 0.125 0.458 -1.355) 1.436 25.148 ( -1.077 -3.656 0.942) 3.926 25.291 ( 0.446 -0.121 -1.337) 1.415 28.901 ( -0.653 -2.084 0.618) 2.270 29.132 ( 0.131 1.715 2.273) 2.850 34.226 ( 10.273 -1.417 -8.276) 13.268 34.481 ( 4.321 -3.728 9.539) 11.115 37.518 ( -2.352 -1.119 -0.083) 2.606 37.910 ( 0.626 -2.467 -3.005) 3.938 40.326 ( -3.744 1.482 -2.208) 4.592 40.984 ( -1.057 2.873 5.636) 6.413 41.797 ( 5.398 -2.426 -4.446) 7.402 43.562 ( 9.661 3.186 -12.835) 16.378 ======================= Grid point 87 (30/205) ======================= q-point: ( 0.44 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.921 ( 17.197 -13.350 8.695) 23.443 3.529 ( -5.927 13.484 10.943) 18.350 3.820 ( 14.282 -9.321 -1.909) 17.161 4.035 ( 15.768 6.091 -0.960) 16.931 4.385 ( 16.483 -2.394 -8.331) 18.623 4.779 ( -10.934 5.891 4.134) 13.090 4.944 ( -31.468 4.509 9.140) 33.078 5.125 ( -7.157 -1.206 7.511) 10.445 5.439 ( -4.259 -1.872 1.290) 4.828 6.347 ( -1.326 -15.985 2.606) 16.250 6.548 ( 2.037 -12.210 2.869) 12.707 6.602 ( 5.233 10.908 -2.312) 12.317 6.707 ( -2.119 6.637 1.255) 7.079 7.196 ( -2.671 4.394 -1.206) 5.282 7.376 ( 0.008 -4.469 -7.001) 8.306 7.520 ( 3.328 7.509 -1.521) 8.353 7.670 ( 4.195 -8.392 -3.188) 9.909 8.241 ( -3.214 5.220 -4.958) 7.884 8.803 ( 4.393 5.157 -11.181) 13.073 8.960 ( 1.726 0.657 -8.712) 8.905 9.071 ( 0.188 -1.106 -0.232) 1.146 9.202 ( 0.505 -6.695 0.192) 6.717 9.340 ( 3.939 -0.596 6.219) 7.386 9.850 ( 4.863 -7.525 -3.990) 9.808 10.214 ( -5.101 -0.311 5.464) 7.481 10.401 ( -3.992 3.079 5.503) 7.464 10.575 ( -2.361 7.165 -2.680) 8.006 10.655 ( -3.055 1.888 1.548) 3.911 11.422 ( -4.045 -1.529 -4.223) 6.044 11.629 ( 1.666 3.126 1.318) 3.779 11.789 ( 9.565 6.357 -0.633) 11.502 11.979 ( -6.357 0.448 -3.440) 7.242 12.296 ( -7.787 -1.460 10.569) 13.208 13.205 ( -4.867 -5.281 -3.574) 8.021 13.307 ( -1.659 -3.014 0.321) 3.455 13.519 ( 6.597 3.191 8.710) 11.383 13.589 ( 11.756 1.882 -0.271) 11.908 14.050 ( 0.033 1.080 -0.270) 1.114 14.387 ( 1.215 -1.307 9.860) 10.020 14.716 ( 0.426 0.167 -1.308) 1.386 15.058 ( -7.640 0.455 -1.366) 7.774 15.291 ( -3.075 -3.052 2.246) 4.880 15.606 ( -3.955 4.023 2.349) 6.111 16.033 ( -1.803 -0.622 -0.138) 1.912 16.773 ( 4.327 -2.837 -4.799) 7.057 16.950 ( 4.249 -2.707 1.689) 5.314 17.752 ( 4.178 -2.629 -6.569) 8.217 17.937 ( -2.067 2.987 -3.485) 5.034 18.277 ( 2.424 1.758 -1.916) 3.555 19.220 ( -6.204 -3.517 -1.337) 7.255 20.155 ( -1.450 5.833 7.737) 9.797 21.376 ( 0.239 -1.980 0.589) 2.079 21.538 ( 2.040 0.167 -2.011) 2.869 21.820 ( 0.877 2.657 -2.189) 3.553 25.174 ( 0.425 0.040 -0.183) 0.465 25.301 ( -0.754 -1.734 -0.297) 1.914 28.928 ( -0.699 -1.782 0.773) 2.064 29.110 ( -0.388 1.828 1.974) 2.718 34.292 ( 5.132 0.993 -6.258) 8.155 34.615 ( -0.044 -5.065 10.312) 11.489 37.519 ( 0.025 -0.501 1.593) 1.670 37.949 ( 0.623 -2.510 -1.851) 3.180 40.286 ( -2.732 -2.155 -0.712) 3.551 40.947 ( -1.796 2.169 4.617) 5.408 41.851 ( 1.306 -1.744 -6.132) 6.507 43.559 ( 7.116 3.409 -11.109) 13.626 ======================= Grid point 88 (31/205) ======================= q-point: (-0.44 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.051 ( -4.565 21.961 13.412) 26.134 3.401 ( 6.919 -1.054 1.691) 7.200 3.866 ( -3.435 6.812 -2.941) 8.176 4.032 ( -27.805 -4.714 5.385) 28.711 4.495 ( -1.853 13.213 4.080) 13.952 4.685 ( 6.759 0.928 -1.312) 6.947 4.734 ( 7.777 -11.567 -3.923) 14.480 5.065 ( -6.219 -0.416 2.850) 6.854 5.440 ( -6.995 -6.179 1.907) 9.527 6.382 ( 6.041 17.984 -2.989) 19.205 6.489 ( -7.015 3.492 8.514) 11.571 6.654 ( -7.948 -2.211 -1.655) 8.415 6.760 ( -1.129 -14.935 1.085) 15.017 7.071 ( 4.179 -3.613 -2.541) 6.081 7.451 ( 2.771 -3.670 -3.406) 5.723 7.502 ( 3.800 -0.223 -5.189) 6.436 7.837 ( 3.399 -4.281 4.185) 6.884 8.315 ( 9.880 -6.444 -1.568) 11.900 8.689 ( 4.447 8.428 -13.187) 16.269 8.945 ( 0.721 -1.311 -6.068) 6.249 9.060 ( -2.541 1.046 -2.246) 3.549 9.264 ( -4.333 -5.563 1.178) 7.150 9.431 ( 5.562 1.514 7.266) 9.275 9.992 ( 8.356 -0.532 -4.781) 9.642 10.109 ( -4.728 6.572 6.512) 10.390 10.329 ( -1.704 1.782 2.375) 3.423 10.598 ( 8.055 -5.381 0.227) 9.689 10.640 ( -1.641 -1.811 1.968) 3.137 11.395 ( -1.104 -1.596 -5.529) 5.859 11.624 ( 5.978 4.476 -0.186) 7.470 11.814 ( -5.011 0.765 2.075) 5.477 11.887 ( 4.486 -0.381 -6.447) 7.863 12.277 ( -7.377 -2.270 8.115) 11.200 13.175 ( -5.890 -1.205 -4.382) 7.440 13.376 ( -1.571 -6.451 3.953) 7.728 13.533 ( 2.689 5.743 7.617) 9.911 13.662 ( 7.955 7.175 3.183) 11.175 14.047 ( -0.705 -3.759 -0.012) 3.824 14.336 ( -16.549 0.840 7.719) 18.280 14.715 ( -2.771 -2.346 -1.223) 3.831 15.013 ( 1.406 -0.484 -3.525) 3.826 15.218 ( -8.097 0.459 -1.117) 8.187 15.606 ( 14.841 7.961 2.263) 16.993 16.050 ( -4.778 -5.238 0.751) 7.129 16.800 ( 0.551 -0.344 -4.204) 4.254 16.943 ( -6.422 3.112 2.051) 7.425 17.861 ( 7.725 -4.629 -4.433) 10.038 17.936 ( 7.514 -0.240 -1.528) 7.672 18.306 ( 3.848 -1.247 -0.473) 4.073 19.182 ( -6.339 -2.572 -3.678) 7.767 20.076 ( -2.469 4.498 5.129) 7.255 21.388 ( -1.890 -0.421 1.464) 2.428 21.563 ( 3.735 0.501 -1.099) 3.926 21.770 ( 2.515 4.376 -4.317) 6.641 25.159 ( 1.861 3.222 -0.783) 3.802 25.319 ( -1.831 -2.341 0.428) 3.003 28.941 ( -0.795 -0.273 1.384) 1.619 29.087 ( -0.790 0.661 1.001) 1.436 34.270 ( 1.111 3.209 -5.175) 6.190 34.729 ( -6.641 -8.843 13.164) 17.193 37.548 ( 2.414 -0.228 2.754) 3.670 37.987 ( -0.101 -2.216 0.123) 2.222 40.323 ( -1.865 -5.854 0.724) 6.187 40.910 ( -1.639 1.833 3.126) 3.977 41.828 ( -3.973 -0.491 -6.986) 8.052 43.536 ( 6.348 3.726 -12.874) 14.830 ======================= Grid point 89 (32/205) ======================= q-point: (-0.33 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.499 ( -16.907 32.439 5.806) 37.038 3.158 ( -14.870 37.342 5.088) 40.514 3.480 ( -36.832 1.569 5.772) 37.315 4.002 ( -0.943 -3.674 -4.033) 5.536 4.303 ( -3.227 4.239 9.141) 10.580 4.534 ( -14.512 4.867 -0.969) 15.337 5.043 ( 13.661 -6.183 -3.164) 15.325 5.263 ( 20.186 -8.675 -1.600) 22.029 5.522 ( -7.667 -17.249 3.265) 19.156 6.121 ( -1.627 10.358 -4.897) 11.572 6.467 ( -0.195 -1.051 9.928) 9.986 6.575 ( -5.845 -2.006 -7.139) 9.442 6.898 ( -1.364 -3.122 -1.257) 3.631 7.321 ( 9.964 -7.468 9.487) 15.654 7.473 ( 3.971 2.279 -4.585) 6.479 7.624 ( 1.921 -14.510 -7.087) 16.263 8.015 ( 6.142 -8.493 8.988) 13.807 8.381 ( 10.559 12.313 -10.582) 19.367 8.631 ( 0.867 -2.360 -8.695) 9.052 8.937 ( -4.560 3.634 -2.775) 6.458 8.985 ( -2.537 -3.465 -4.169) 5.985 9.322 ( -2.126 -5.942 1.333) 6.450 9.439 ( 0.452 4.917 3.490) 6.047 9.896 ( -0.156 7.666 -6.878) 10.301 10.152 ( 9.998 4.382 15.374) 18.855 10.359 ( 2.945 -4.043 -0.176) 5.005 10.667 ( 1.146 -1.872 5.008) 5.468 10.831 ( 10.225 -4.921 1.527) 11.450 11.411 ( -1.240 -5.732 -6.608) 8.835 11.578 ( 2.337 5.832 -3.161) 7.034 11.720 ( -3.573 2.094 -0.901) 4.238 12.028 ( 12.931 -2.990 -1.158) 13.322 12.267 ( -6.999 -3.453 6.990) 10.477 13.069 ( -8.995 1.199 -5.881) 10.814 13.436 ( -4.515 6.360 1.686) 7.980 13.484 ( -0.232 -3.082 4.539) 5.491 13.573 ( -0.082 9.355 6.965) 11.664 14.110 ( -21.460 -2.005 9.498) 23.554 14.186 ( 5.443 -5.961 1.110) 8.148 14.717 ( -8.339 -7.802 -0.802) 11.448 15.001 ( -1.212 2.502 -4.071) 4.930 15.178 ( 3.023 -0.025 -1.024) 3.192 15.633 ( 13.594 11.168 -0.824) 17.612 16.077 ( -3.238 -3.888 -1.868) 5.394 16.691 ( -11.269 7.472 -2.168) 13.693 16.868 ( -0.588 -3.261 3.465) 4.794 18.033 ( 9.163 -5.432 -5.934) 12.193 18.064 ( 11.816 -0.048 3.101) 12.216 18.402 ( 5.612 -3.690 2.059) 7.025 19.123 ( -6.543 -2.265 -8.407) 10.891 19.996 ( -3.029 3.657 4.301) 6.407 21.363 ( -2.747 0.745 1.700) 3.316 21.586 ( 1.256 0.785 0.319) 1.515 21.715 ( 7.942 6.960 -7.311) 12.844 25.115 ( 2.045 4.756 -0.579) 5.209 25.332 ( -1.862 -1.712 0.555) 2.590 28.927 ( -0.973 1.447 1.911) 2.587 29.083 ( -0.718 -0.895 0.107) 1.152 34.189 ( -0.778 4.306 -4.420) 6.220 34.863 ( -16.427 -18.000 19.814) 31.408 37.601 ( 4.673 0.284 3.028) 5.576 38.014 ( -1.559 -1.753 2.482) 3.415 40.428 ( -1.326 -8.811 1.529) 9.040 40.877 ( -0.660 1.771 1.579) 2.463 41.717 ( -10.133 0.342 -7.672) 12.714 43.477 ( 6.391 5.892 -19.127) 21.010 ======================= Grid point 90 (33/205) ======================= q-point: (-0.22 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.711 ( -20.295 39.150 -4.141) 44.292 2.272 ( -28.182 42.251 11.331) 52.036 2.710 ( -44.510 34.192 15.467) 58.220 3.985 ( -6.273 0.278 2.163) 6.641 4.334 ( 0.485 -3.151 1.463) 3.508 4.486 ( -5.111 -12.575 3.226) 13.952 5.180 ( 5.547 -0.466 2.414) 6.067 5.614 ( 19.735 -5.384 -4.118) 20.867 5.843 ( -1.992 -22.179 -0.035) 22.268 6.018 ( 0.622 -1.333 -2.971) 3.315 6.460 ( -2.662 3.612 -8.276) 9.414 6.595 ( -3.523 -8.783 5.717) 11.056 6.875 ( 1.994 1.889 -5.585) 6.224 7.365 ( -3.343 -0.523 2.883) 4.446 7.709 ( 15.021 -6.860 5.403) 17.375 7.839 ( 4.672 -10.065 -4.725) 12.061 8.171 ( 7.491 11.369 -6.763) 15.202 8.334 ( 4.929 -8.288 2.943) 10.082 8.562 ( -8.508 1.993 -13.717) 16.264 8.759 ( -5.454 8.812 0.792) 10.393 9.044 ( -2.370 -8.358 -2.649) 9.083 9.331 ( -4.027 3.436 -0.752) 5.347 9.416 ( 1.285 -4.269 0.006) 4.459 9.750 ( 0.416 7.782 -7.791) 11.020 10.285 ( 10.180 1.956 16.526) 19.508 10.482 ( 4.869 -3.833 1.545) 6.386 10.732 ( 1.295 0.519 -0.078) 1.398 10.982 ( 12.140 1.693 21.924) 25.118 11.528 ( 0.687 -12.052 -6.250) 13.593 11.545 ( 4.514 2.167 -1.211) 5.151 11.650 ( 3.874 5.534 1.147) 6.852 12.242 ( 12.123 -5.100 -2.204) 13.335 12.258 ( -4.971 -0.668 5.245) 7.257 12.868 ( -11.155 5.772 -7.608) 14.684 13.222 ( -6.868 6.951 -3.723) 10.457 13.464 ( -4.333 6.260 10.279) 12.791 13.544 ( -2.961 -3.527 3.992) 6.095 13.945 ( -15.706 -2.762 6.821) 17.345 14.407 ( 6.482 -8.846 3.972) 11.663 14.774 ( -10.922 -12.939 2.415) 17.104 14.911 ( -1.649 3.364 -1.614) 4.080 15.200 ( -0.881 -0.327 -2.725) 2.882 15.576 ( 11.262 12.631 -3.312) 17.244 16.055 ( 0.273 3.373 -6.587) 7.406 16.412 ( -12.862 6.532 -0.798) 14.448 16.993 ( 2.825 -7.096 6.142) 9.801 18.151 ( 8.911 1.236 -4.546) 10.079 18.220 ( 8.627 -1.793 1.253) 8.900 18.579 ( 10.407 -4.774 3.271) 11.908 19.013 ( -10.180 -1.232 -16.473) 19.404 19.941 ( -0.646 2.505 9.007) 9.371 21.314 ( -3.386 1.623 1.476) 4.035 21.563 ( -1.095 1.385 -1.466) 2.295 21.686 ( 15.015 10.605 -7.799) 19.968 25.057 ( 1.444 4.747 -0.021) 4.961 25.334 ( -1.416 -0.803 0.319) 1.658 28.896 ( -1.102 1.625 1.739) 2.623 29.094 ( -0.127 -1.031 -0.076) 1.042 34.098 ( -0.392 3.880 -2.992) 4.916 35.114 ( -33.738 -40.370 31.199) 61.167 37.670 ( 6.979 1.139 1.961) 7.338 38.024 ( -3.916 -1.775 4.649) 6.333 40.569 ( -2.112 -10.168 1.545) 10.499 40.855 ( 2.039 2.083 -0.214) 2.923 41.518 ( -17.364 0.206 -8.840) 19.485 43.305 ( 7.362 15.498 -33.752) 37.862 ======================= Grid point 91 (34/205) ======================= q-point: (-0.11 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.798 ( -10.608 44.172 -0.716) 45.433 1.337 ( -16.060 47.415 25.571) 56.214 1.698 ( -51.440 30.200 38.050) 70.753 3.902 ( -7.355 0.694 4.647) 8.727 4.401 ( 2.279 -2.967 -1.523) 4.040 4.677 ( -0.694 -10.060 6.922) 12.231 5.281 ( 0.982 -5.848 3.553) 6.912 5.790 ( 10.218 7.462 -1.684) 12.765 5.970 ( 1.342 -8.317 -8.339) 11.854 6.244 ( -2.731 -17.896 -1.035) 18.133 6.298 ( -0.388 8.231 -10.517) 13.361 6.621 ( -5.941 1.909 -1.813) 6.498 6.977 ( 4.125 -13.501 -7.198) 15.846 7.400 ( -0.698 -5.151 3.708) 6.385 7.876 ( -4.453 -6.812 -4.740) 9.418 8.008 ( 9.665 12.384 -2.855) 15.966 8.075 ( 13.658 0.334 4.635) 14.427 8.252 ( -14.294 8.819 -19.587) 25.802 8.508 ( 1.432 -1.271 2.318) 3.007 8.570 ( -4.782 4.130 1.039) 6.404 9.153 ( -1.870 -7.501 0.617) 7.755 9.234 ( -5.709 0.114 -0.333) 5.720 9.515 ( 3.745 -3.599 0.326) 5.204 9.598 ( -1.536 6.553 -5.659) 8.794 10.426 ( 5.979 -0.807 7.709) 9.789 10.563 ( 0.794 0.826 1.729) 2.074 10.681 ( 0.332 0.402 -2.772) 2.821 11.470 ( 16.277 -12.015 31.414) 37.365 11.531 ( 4.756 -0.908 1.056) 4.956 11.736 ( 22.785 -3.231 26.655) 35.215 11.762 ( 6.688 -11.404 -2.111) 13.388 12.226 ( 9.735 5.660 8.410) 14.055 12.422 ( 4.216 -2.244 0.218) 4.781 12.651 ( 0.434 -0.065 -6.921) 6.935 13.086 ( -4.771 -0.608 -5.256) 7.124 13.330 ( -13.284 1.566 9.279) 16.279 13.567 ( -1.381 -1.304 4.340) 4.737 13.883 ( -9.281 -3.682 6.371) 11.844 14.564 ( -2.405 -5.570 0.581) 6.095 14.849 ( -21.030 -16.175 5.007) 26.999 14.925 ( 2.924 -4.124 3.393) 6.088 15.162 ( -1.860 -1.997 -4.185) 4.996 15.473 ( 9.643 14.517 -4.147) 17.915 15.907 ( 1.765 13.367 -13.562) 19.123 16.194 ( -6.361 8.461 0.311) 10.590 17.169 ( -2.293 -10.238 2.823) 10.865 18.167 ( 11.892 11.186 -5.278) 17.158 18.300 ( 2.081 0.487 -9.000) 9.250 18.643 ( -20.957 3.636 -20.058) 29.236 18.828 ( 5.438 1.522 -2.606) 6.219 20.099 ( 18.439 -8.266 28.045) 34.566 21.249 ( -2.655 2.213 0.177) 3.461 21.524 ( 4.257 4.699 -4.399) 7.717 21.631 ( 13.648 15.661 -7.291) 22.016 25.007 ( 0.681 2.999 0.557) 3.125 25.326 ( -1.001 0.121 -0.355) 1.069 28.868 ( -1.181 0.900 1.316) 1.984 29.107 ( 0.748 0.023 -0.408) 0.853 34.049 ( 1.747 2.179 -0.513) 2.840 35.657 ( -82.366 -96.507 28.339) 130.003 37.722 ( 4.974 3.988 -5.508) 8.425 37.996 ( -12.492 -2.569 0.242) 12.756 40.675 ( -5.506 -6.778 1.949) 8.947 40.884 ( 13.240 3.082 -0.045) 13.594 41.231 ( -20.446 2.066 -6.801) 21.647 42.738 ( 13.392 55.945 -51.108) 76.949 ======================= Grid point 93 (35/205) ======================= q-point: ( 0.11 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.588 ( 21.855 0.000 41.123) 46.570 1.671 ( 41.301 0.000 21.732) 46.670 2.745 ( 62.507 0.000 39.740) 74.070 3.760 ( -3.571 -0.000 -1.747) 3.976 4.480 ( 1.880 0.000 2.298) 2.969 5.041 ( 8.735 0.000 15.143) 17.482 5.060 ( -14.850 -0.000 -1.102) 14.891 5.749 ( -0.669 -0.000 -4.009) 4.064 6.057 ( 0.485 0.000 -4.851) 4.875 6.120 ( 0.973 0.000 -6.098) 6.175 6.174 ( -6.229 -0.000 -3.212) 7.008 6.463 ( -8.318 -0.000 -5.971) 10.239 6.971 ( -4.063 -0.000 -14.977) 15.518 7.319 ( -8.490 -0.000 -15.813) 17.948 7.424 ( -5.874 -0.000 0.822) 5.931 8.015 ( -0.593 -0.000 -5.498) 5.530 8.025 ( -0.313 -0.000 -4.126) 4.138 8.270 ( -9.450 -0.000 2.769) 9.848 8.558 ( 1.131 0.000 -0.478) 1.228 8.640 ( 2.709 0.000 0.231) 2.719 9.049 ( 5.269 0.000 -13.484) 14.477 9.312 ( 6.800 0.000 -3.109) 7.477 9.459 ( -10.017 -0.000 1.610) 10.146 9.557 ( 2.852 0.000 5.914) 6.566 10.475 ( -3.109 -0.000 7.575) 8.188 10.632 ( 2.576 0.000 3.035) 3.981 10.669 ( -4.903 -0.000 -0.957) 4.996 11.339 ( -23.196 -0.000 23.594) 33.087 11.452 ( -14.509 -0.000 3.504) 14.926 11.849 ( -5.496 -0.000 8.018) 9.721 11.874 ( -5.606 -0.000 -0.948) 5.686 11.956 ( 3.509 0.000 -4.131) 5.420 12.659 ( 13.765 0.000 -0.975) 13.800 12.843 ( -3.032 -0.000 -1.525) 3.394 13.213 ( 10.789 0.000 -0.806) 10.819 13.490 ( -24.380 -0.000 18.926) 30.864 13.654 ( -4.054 -0.000 11.449) 12.145 13.787 ( 3.841 0.000 0.628) 3.892 14.653 ( 6.348 0.000 -2.933) 6.993 14.785 ( -8.061 -0.000 -1.006) 8.124 15.066 ( -6.629 -0.000 -9.656) 11.712 15.180 ( -6.432 -0.000 0.157) 6.434 15.590 ( 8.423 0.000 5.914) 10.292 15.901 ( 24.826 0.000 -24.542) 34.909 16.211 ( 13.358 0.000 2.838) 13.657 16.693 ( -1.661 -0.000 13.866) 13.965 17.840 ( -5.407 -0.000 -1.482) 5.606 18.261 ( -3.233 -0.000 -4.833) 5.815 18.541 ( 7.885 0.000 -10.146) 12.849 18.863 ( -4.803 -0.000 2.597) 5.460 20.848 ( -17.677 -0.000 7.583) 19.235 21.181 ( -0.647 -0.000 -1.640) 1.763 21.400 ( 0.839 0.000 1.421) 1.650 21.722 ( 5.815 0.000 3.353) 6.712 24.997 ( -0.790 -0.000 1.835) 1.998 25.298 ( 1.323 0.000 -2.140) 2.516 28.849 ( -0.752 -0.000 0.516) 0.912 29.141 ( 1.669 0.000 0.057) 1.670 34.040 ( 23.836 0.000 -18.293) 30.046 34.279 ( 8.071 0.000 9.567) 12.517 37.423 ( 0.178 0.000 1.430) 1.441 37.852 ( -0.394 -0.000 -2.804) 2.831 40.504 ( -6.690 -0.000 -4.911) 8.299 41.181 ( 9.005 0.000 0.000) 9.005 41.657 ( -8.517 -0.000 -3.566) 9.233 43.554 ( 35.397 0.000 -28.488) 45.437 ======================= Grid point 94 (36/205) ======================= q-point: ( 0.22 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.978 ( 30.365 -1.326 26.920) 40.601 2.472 ( 30.354 -22.942 20.841) 43.382 3.676 ( 35.407 -8.293 22.275) 42.645 3.776 ( 12.310 -11.105 3.767) 17.001 4.451 ( 5.482 9.778 3.603) 11.775 4.794 ( -11.241 8.402 1.960) 14.170 5.254 ( 4.833 -3.975 13.241) 14.645 5.651 ( -7.786 7.414 1.479) 10.852 5.853 ( -5.162 17.691 -10.556) 21.238 6.078 ( -12.002 -1.626 -1.715) 12.232 6.128 ( 1.066 -1.584 -2.734) 3.335 6.420 ( -3.299 -10.822 -10.175) 15.216 6.894 ( -0.897 -6.637 -13.135) 14.744 7.166 ( -3.862 9.313 -2.818) 10.468 7.327 ( -5.280 -0.768 -8.469) 10.009 7.853 ( -7.227 9.964 0.062) 12.309 8.028 ( -3.531 -1.893 -12.181) 12.823 8.285 ( -6.738 -11.284 7.412) 15.088 8.591 ( 0.567 -6.484 -3.119) 7.218 8.704 ( -3.162 -5.263 -1.373) 6.291 9.044 ( 11.027 5.634 -12.795) 17.806 9.293 ( -7.620 3.692 0.054) 8.467 9.382 ( 8.127 1.442 -2.586) 8.650 9.609 ( 2.732 1.733 5.305) 6.213 10.467 ( -4.655 5.903 10.003) 12.513 10.498 ( -3.112 4.050 0.504) 5.132 10.697 ( 1.005 -0.417 2.137) 2.398 11.129 ( -15.344 4.001 11.541) 19.612 11.338 ( -11.782 -3.308 2.568) 12.504 11.759 ( -5.809 3.176 0.556) 6.644 11.937 ( 5.360 -2.487 3.196) 6.718 11.982 ( 1.533 -1.717 -5.815) 6.254 12.702 ( -7.522 8.336 7.933) 13.747 12.866 ( 2.365 -6.983 -4.434) 8.604 13.214 ( -3.648 3.919 5.382) 7.592 13.427 ( 4.122 -3.875 9.072) 10.691 13.650 ( 1.330 3.709 7.403) 8.386 13.903 ( 11.569 -2.738 -0.506) 11.900 14.541 ( -0.732 9.528 2.017) 9.766 14.809 ( 2.415 6.292 -6.817) 9.587 14.862 ( -8.619 -9.164 1.861) 12.717 15.186 ( -12.221 -4.705 0.636) 13.111 15.686 ( 6.508 1.493 6.183) 9.100 16.121 ( 6.715 -8.220 -19.531) 22.229 16.425 ( 16.588 -2.987 -0.636) 16.867 16.744 ( 6.946 2.221 8.700) 11.352 17.759 ( -5.355 0.677 -2.877) 6.116 18.165 ( -5.749 2.655 -4.103) 7.545 18.493 ( 2.334 6.989 -6.054) 9.536 18.924 ( -6.203 -11.514 -0.637) 13.095 20.594 ( -8.088 11.271 9.402) 16.759 21.210 ( -0.336 -4.054 -2.345) 4.695 21.454 ( -1.324 -4.113 0.279) 4.330 21.805 ( 2.083 -1.753 4.146) 4.960 25.015 ( -1.465 -2.841 2.092) 3.821 25.309 ( 2.552 0.424 -2.485) 3.587 28.848 ( -0.965 -0.953 0.539) 1.459 29.159 ( 0.916 0.090 0.682) 1.146 34.236 ( 22.494 1.478 -20.526) 30.488 34.423 ( 7.678 -0.605 11.671) 13.983 37.457 ( 0.202 -2.124 0.943) 2.333 37.848 ( 0.482 -1.111 -3.505) 3.708 40.391 ( -5.846 1.577 -6.287) 8.729 41.187 ( 4.845 9.617 3.020) 11.184 41.625 ( -3.922 -8.198 -5.296) 10.518 43.720 ( 17.225 4.982 -16.685) 24.493 ======================= Grid point 95 (37/205) ======================= q-point: ( 0.33 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.492 ( 25.573 -8.109 19.744) 33.310 3.152 ( 12.213 -19.162 15.046) 27.252 3.838 ( 0.164 -11.770 -6.634) 13.511 4.369 ( 25.886 18.751 6.281) 32.575 4.478 ( 1.701 -9.734 -0.629) 9.902 4.618 ( 10.719 1.247 19.976) 22.704 5.178 ( -14.359 11.318 -3.453) 18.606 5.388 ( -13.677 13.674 10.934) 22.217 5.526 ( -2.188 8.100 -2.856) 8.864 5.935 ( -14.488 -3.991 -2.715) 15.271 6.247 ( 8.054 -8.245 2.123) 11.720 6.615 ( 5.686 -12.409 -1.424) 13.724 6.950 ( 5.300 10.576 -4.379) 12.614 7.073 ( 1.891 -10.801 -4.476) 11.844 7.216 ( -9.139 -1.864 -10.480) 14.029 7.604 ( -8.780 6.746 -5.370) 12.306 7.897 ( -2.692 6.243 -8.897) 11.197 8.399 ( -4.894 -3.171 3.956) 7.047 8.699 ( -6.739 -7.694 3.561) 10.830 8.747 ( 1.017 -8.970 -10.543) 13.880 9.061 ( 8.730 1.695 -9.285) 12.857 9.176 ( -4.119 0.815 0.589) 4.240 9.438 ( 10.281 6.339 -1.186) 12.136 9.650 ( 5.277 -1.568 1.898) 5.823 10.282 ( -5.329 6.845 3.804) 9.473 10.478 ( -2.193 1.776 6.428) 7.020 10.711 ( 2.696 2.503 2.964) 4.724 10.920 ( -8.925 7.938 0.977) 11.984 11.297 ( -7.238 -4.750 0.595) 8.678 11.664 ( -5.913 0.349 2.340) 6.369 11.929 ( 0.774 1.252 -12.136) 12.225 12.075 ( 3.566 -0.302 3.924) 5.311 12.433 ( -11.118 11.835 13.871) 21.356 12.971 ( -0.644 -6.784 -4.616) 8.231 13.208 ( -1.020 -3.578 -2.148) 4.296 13.575 ( 5.598 -1.182 10.161) 11.661 13.653 ( 5.044 3.402 7.004) 9.277 14.082 ( 10.643 -0.642 -2.409) 10.931 14.444 ( 2.514 5.371 6.744) 8.980 14.713 ( -4.826 0.667 -2.533) 5.491 14.932 ( -11.312 -10.983 -3.044) 16.058 15.099 ( -10.132 -2.176 3.411) 10.910 15.738 ( 4.905 3.510 7.632) 9.728 16.155 ( 4.924 2.242 -12.309) 13.446 16.655 ( 13.245 -3.492 -3.271) 14.083 16.865 ( 9.732 -0.889 3.680) 10.442 17.698 ( -1.387 -0.673 -3.651) 3.963 18.030 ( -6.051 2.981 -4.012) 7.848 18.388 ( 0.244 5.186 -3.063) 6.028 19.003 ( -8.569 -9.736 -2.199) 13.154 20.404 ( -3.255 9.177 8.368) 12.839 21.267 ( -0.536 -4.596 -1.820) 4.972 21.494 ( -0.654 -2.751 -0.318) 2.845 21.849 ( -0.035 -0.486 2.963) 3.003 25.061 ( -2.130 -4.383 2.042) 5.283 25.324 ( 3.719 1.163 -2.593) 4.681 28.861 ( -1.039 -1.858 0.512) 2.190 29.160 ( -0.135 0.949 1.329) 1.639 34.354 ( 15.191 2.957 -13.685) 20.659 34.554 ( 5.327 -0.040 11.257) 12.454 37.493 ( 0.950 -1.117 1.571) 2.149 37.871 ( 1.284 -2.100 -3.747) 4.483 40.283 ( -4.177 1.179 -5.573) 7.063 41.085 ( -0.105 7.207 3.820) 8.158 41.711 ( -0.708 -7.221 -6.117) 9.490 43.730 ( 10.589 6.543 -10.419) 16.232 ======================= Grid point 96 (38/205) ======================= q-point: ( 0.44 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.945 ( 12.334 -9.531 19.320) 24.824 3.451 ( -6.784 -9.578 12.847) 17.401 3.947 ( 2.337 2.873 -10.592) 11.221 4.353 ( -16.780 -2.714 -4.034) 17.471 4.396 ( 15.942 9.298 4.517) 19.000 4.804 ( -14.249 11.355 -2.078) 18.338 4.925 ( 20.583 8.271 12.951) 25.687 5.132 ( -2.826 4.906 8.369) 10.104 5.377 ( -5.653 3.057 -5.113) 8.213 5.931 ( -11.047 -17.162 0.417) 20.414 6.506 ( 6.361 -7.143 7.644) 12.244 6.728 ( -5.759 3.162 -1.500) 6.739 6.846 ( 6.462 9.136 -0.210) 11.193 7.181 ( -1.011 -3.396 5.024) 6.148 7.259 ( 2.006 -5.797 -16.196) 17.319 7.511 ( 3.072 -11.713 -5.779) 13.417 7.734 ( -0.037 9.087 -3.249) 9.650 8.262 ( -5.577 7.241 -3.024) 9.627 8.782 ( -3.630 -9.653 -6.121) 11.992 8.814 ( -2.801 -3.906 -3.735) 6.087 9.085 ( 1.350 -0.212 -4.487) 4.690 9.215 ( 5.030 -1.417 1.973) 5.586 9.423 ( 7.539 5.969 0.056) 9.616 9.816 ( 9.775 -6.915 -1.722) 12.096 10.192 ( -2.950 1.156 6.467) 7.201 10.432 ( -2.329 2.568 4.382) 5.588 10.685 ( -3.436 8.795 -4.499) 10.459 10.720 ( 5.283 5.425 4.806) 8.969 11.306 ( -3.937 -4.073 -1.372) 5.828 11.632 ( -5.843 -3.392 5.129) 8.483 11.864 ( -0.833 1.384 -12.774) 12.876 12.007 ( -2.389 7.524 2.678) 8.336 12.300 ( -0.433 3.727 9.168) 9.906 13.029 ( -4.036 -5.817 -3.319) 7.819 13.243 ( -1.632 -3.707 -1.682) 4.386 13.664 ( 3.877 2.166 10.422) 11.329 13.733 ( 6.695 -0.581 8.769) 11.048 14.091 ( -0.283 4.284 -4.185) 5.995 14.415 ( -5.118 4.572 7.310) 10.026 14.640 ( -9.799 -2.859 -2.054) 10.413 14.940 ( -2.433 -5.131 -4.071) 6.987 15.071 ( -9.097 -6.536 2.372) 11.450 15.788 ( 10.140 3.993 7.621) 13.298 16.124 ( 8.252 6.139 -7.633) 12.808 16.779 ( 4.940 -0.430 -5.000) 7.042 16.989 ( 5.139 -0.319 2.489) 5.719 17.735 ( 4.338 -3.182 -3.832) 6.605 17.927 ( -2.102 0.466 -2.843) 3.566 18.322 ( 0.572 2.359 -1.321) 2.764 19.017 ( -9.748 -7.393 -3.567) 12.744 20.274 ( -2.002 7.499 6.903) 10.387 21.319 ( -1.622 -3.923 -0.704) 4.303 21.532 ( 0.835 -2.184 -0.503) 2.391 21.848 ( -0.701 0.852 1.095) 1.554 25.114 ( -2.326 -4.463 1.697) 5.311 25.337 ( 4.403 2.093 -2.394) 5.432 28.885 ( -1.067 -2.374 0.565) 2.663 29.138 ( -1.017 1.675 1.615) 2.539 34.393 ( 8.599 4.491 -7.668) 12.366 34.629 ( 1.177 0.663 9.692) 9.786 37.533 ( 2.359 -0.573 2.725) 3.649 37.911 ( 1.454 -2.416 -3.056) 4.158 40.223 ( -2.230 -0.881 -3.319) 4.095 40.998 ( -1.631 4.018 2.441) 4.976 41.759 ( -2.509 -3.799 -5.908) 7.459 43.699 ( 8.094 6.255 -8.740) 13.454 ======================= Grid point 97 (39/205) ======================= q-point: (-0.44 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.113 ( -23.361 -2.925 22.942) 32.873 3.450 ( -6.651 8.567 8.840) 13.992 3.808 ( 0.151 -0.359 -9.313) 9.321 4.015 ( -15.261 12.528 6.609) 20.821 4.438 ( -14.868 7.626 -0.062) 16.710 4.663 ( 14.127 -10.775 -4.684) 18.374 5.020 ( 9.050 14.976 1.011) 17.527 5.167 ( 22.878 3.200 5.677) 23.788 5.284 ( -6.689 -1.975 -4.766) 8.447 6.184 ( -7.284 -23.195 1.583) 24.364 6.542 ( -9.587 1.709 -4.219) 10.613 6.587 ( -9.259 -0.631 9.544) 13.312 6.759 ( -0.855 18.285 -4.233) 18.788 7.037 ( 5.280 -3.843 0.163) 6.533 7.461 ( 7.726 -4.457 -6.724) 11.170 7.594 ( 2.965 7.230 -3.445) 8.540 7.791 ( 5.393 -9.472 1.881) 11.061 8.231 ( 1.657 -10.089 -1.236) 10.298 8.792 ( 0.506 3.801 -3.790) 5.392 8.833 ( -4.310 -7.303 -10.193) 13.259 9.069 ( 0.101 1.268 -3.582) 3.801 9.234 ( 3.384 5.125 1.557) 6.335 9.481 ( 4.284 -1.925 1.024) 4.807 10.032 ( 8.102 -4.766 -6.424) 11.385 10.168 ( -1.837 2.017 10.946) 11.281 10.398 ( 0.355 3.264 4.009) 5.182 10.581 ( 4.412 -1.462 -5.011) 6.835 10.744 ( 8.527 4.175 6.163) 11.319 11.297 ( -5.043 -2.263 -3.939) 6.788 11.655 ( -10.852 -5.432 5.134) 13.177 11.754 ( 3.148 4.002 -1.919) 5.441 11.984 ( 8.054 0.068 -5.115) 9.541 12.268 ( -0.266 4.254 5.901) 7.279 13.016 ( -8.773 -3.338 -4.239) 10.299 13.290 ( -2.080 -4.967 2.148) 5.797 13.676 ( 1.058 5.062 8.446) 9.904 13.866 ( 5.327 0.348 11.956) 13.094 13.955 ( -8.410 2.888 -3.272) 9.475 14.247 ( -9.255 5.135 3.537) 11.160 14.525 ( -15.744 -4.292 -2.954) 16.584 14.966 ( -4.173 -2.196 -3.269) 5.738 15.142 ( 5.416 -4.509 0.034) 7.047 15.908 ( 14.464 3.667 4.629) 15.623 16.095 ( 8.222 6.538 -3.392) 11.039 16.788 ( 1.510 -0.036 -5.070) 5.290 16.952 ( -5.967 6.134 1.913) 8.769 17.848 ( 6.432 -5.242 -4.437) 9.410 17.986 ( 7.414 -4.156 -1.381) 8.611 18.320 ( 0.617 -1.138 2.039) 2.415 18.987 ( -9.378 -5.668 -6.197) 12.589 20.164 ( -2.288 6.543 6.086) 9.225 21.343 ( -2.514 -2.282 0.117) 3.397 21.574 ( 0.898 -1.609 -0.101) 1.845 21.826 ( 0.626 1.222 -1.405) 1.964 25.157 ( -1.708 -3.098 1.097) 3.704 25.340 ( 4.091 2.819 -1.763) 5.272 28.913 ( -1.013 -2.163 0.887) 2.547 29.100 ( -1.487 1.759 1.525) 2.763 34.358 ( 3.829 6.084 -4.121) 8.286 34.638 ( -4.639 0.311 9.268) 10.369 37.589 ( 3.432 -0.635 3.266) 4.780 37.952 ( 0.887 -2.125 -1.685) 2.853 40.236 ( -0.296 -3.549 -0.451) 3.590 40.939 ( -1.221 2.116 0.500) 2.494 41.718 ( -6.412 -0.353 -5.220) 8.276 43.656 ( 6.984 5.818 -10.047) 13.549 ======================= Grid point 98 (40/205) ======================= q-point: (-0.33 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.669 ( -47.450 12.164 23.542) 54.348 2.991 ( -21.882 26.032 -0.180) 34.008 3.848 ( 13.992 12.059 7.950) 20.110 3.917 ( 1.258 -6.031 -3.790) 7.233 4.219 ( -11.901 -2.852 -2.639) 12.519 4.691 ( -3.261 28.514 5.740) 29.268 5.076 ( 16.895 -13.005 -1.302) 21.360 5.203 ( -8.386 -2.830 -0.764) 8.884 5.435 ( 18.470 -1.828 -0.482) 18.567 6.195 ( -10.648 7.979 -6.074) 14.626 6.395 ( -4.685 -6.452 2.777) 8.443 6.501 ( -3.613 2.721 -1.163) 4.670 6.778 ( 1.530 -14.812 0.093) 14.891 7.235 ( 2.672 -9.029 4.726) 10.535 7.498 ( -1.734 0.786 -3.077) 3.619 7.565 ( 8.945 0.498 -5.321) 10.420 8.016 ( 9.825 -8.037 5.321) 13.764 8.430 ( -4.091 -10.919 -4.115) 12.365 8.669 ( 5.566 11.857 -8.544) 15.639 8.848 ( -4.904 -5.348 -6.149) 9.510 9.021 ( 0.987 3.834 -2.969) 4.948 9.214 ( 0.479 -0.690 -0.625) 1.047 9.500 ( -1.304 3.509 -0.207) 3.750 9.978 ( -1.458 5.653 -3.460) 6.786 10.288 ( 4.516 -2.900 5.560) 7.727 10.400 ( 7.076 1.041 0.813) 7.199 10.686 ( 3.219 -3.319 1.341) 4.814 10.921 ( 13.753 -5.887 10.148) 18.077 11.228 ( -8.731 -2.997 -4.915) 10.458 11.582 ( -3.739 0.525 -0.816) 3.863 11.839 ( 9.359 1.275 4.956) 10.666 12.078 ( 1.855 -4.565 -3.778) 6.209 12.250 ( 6.599 2.873 5.748) 9.211 12.889 ( -14.947 -1.050 -5.367) 15.916 13.335 ( -7.253 -4.374 2.990) 8.982 13.585 ( -1.614 7.188 -0.179) 7.369 13.750 ( -3.524 10.119 4.429) 11.595 13.908 ( -11.819 -0.538 10.538) 15.843 14.199 ( 5.403 -2.355 2.955) 6.593 14.445 ( -11.589 -8.317 -1.743) 14.371 14.903 ( -8.829 -1.720 -2.725) 9.398 15.259 ( 7.983 1.124 -1.131) 8.140 15.970 ( 13.128 10.689 -0.532) 16.937 16.132 ( 10.178 1.876 0.115) 10.350 16.688 ( -11.983 10.374 -0.624) 15.862 16.830 ( 1.906 -3.021 -1.973) 4.080 18.005 ( 6.315 -6.558 -6.104) 10.961 18.159 ( 8.285 -4.110 0.561) 9.266 18.402 ( 2.508 -5.975 4.650) 7.976 18.926 ( -7.992 -3.369 -8.852) 12.393 20.065 ( -2.415 5.309 6.833) 8.983 21.335 ( -2.845 -0.572 0.424) 2.933 21.588 ( -1.052 0.007 0.399) 1.125 21.829 ( 4.377 0.411 -4.348) 6.183 25.174 ( -0.326 0.022 0.367) 0.491 25.332 ( 2.517 2.300 -0.809) 3.504 28.930 ( -0.979 -0.537 1.531) 1.895 29.069 ( -1.190 0.395 1.183) 1.724 34.271 ( 1.408 6.727 -2.109) 7.189 34.586 ( -12.770 -1.702 11.203) 17.072 37.656 ( 3.480 -1.049 2.511) 4.417 37.980 ( -0.413 -1.367 -0.340) 1.468 40.320 ( 0.935 -5.823 2.231) 6.305 40.910 ( 1.312 1.120 -1.280) 2.148 41.580 ( -10.294 2.829 -3.989) 11.397 43.594 ( 6.489 6.222 -14.147) 16.762 ======================= Grid point 99 (41/205) ======================= q-point: (-0.22 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.926 ( -51.731 17.199 27.371) 61.001 2.251 ( -10.345 40.188 -1.398) 41.522 3.655 ( 14.451 54.540 11.033) 57.490 3.918 ( -5.073 -0.229 -0.119) 5.079 4.170 ( -8.438 -7.316 -6.210) 12.778 4.359 ( -0.085 -3.014 10.884) 11.294 5.169 ( -5.512 -3.222 1.488) 6.556 5.512 ( 8.079 -20.614 2.371) 22.267 5.656 ( 9.809 -6.219 -4.274) 12.376 6.058 ( 2.596 1.957 -4.441) 5.503 6.404 ( -5.064 1.460 -4.032) 6.635 6.487 ( -0.879 -5.756 3.306) 6.696 6.926 ( 4.921 0.411 -3.932) 6.312 7.327 ( -7.031 -1.033 4.109) 8.209 7.560 ( 0.127 -15.830 -11.165) 19.372 7.750 ( 7.963 -10.651 3.867) 13.849 8.296 ( 9.977 -4.995 6.554) 12.940 8.332 ( -11.279 1.345 -11.372) 16.073 8.550 ( 7.800 10.965 -7.566) 15.438 8.820 ( -4.638 1.602 0.330) 4.918 8.963 ( 1.095 2.198 -2.819) 3.739 9.271 ( -1.564 -6.751 -1.541) 7.099 9.367 ( -3.355 5.427 -5.352) 8.328 9.854 ( -1.175 7.291 -3.586) 8.209 10.369 ( 2.151 -2.257 2.054) 3.733 10.522 ( 8.798 -1.959 1.455) 9.130 10.720 ( -4.197 0.368 -0.819) 4.292 11.234 ( 9.570 -4.619 24.661) 26.854 11.277 ( 0.541 -14.848 -3.036) 15.164 11.552 ( 0.071 0.340 -0.797) 0.869 11.891 ( 8.613 7.991 4.724) 12.663 12.159 ( -1.648 -8.109 1.334) 8.382 12.365 ( 10.216 1.438 1.894) 10.489 12.692 ( -13.766 -1.057 -3.937) 14.357 13.231 ( -7.752 3.923 -5.795) 10.443 13.478 ( -2.913 3.755 0.095) 4.754 13.584 ( -4.731 7.016 7.194) 11.107 13.813 ( -7.209 0.497 7.398) 10.341 14.364 ( 3.813 -6.395 3.380) 8.177 14.495 ( -6.162 -9.893 1.449) 11.745 14.824 ( -5.946 -2.119 0.150) 6.314 15.269 ( 3.772 5.552 -0.556) 6.735 15.930 ( 13.049 13.299 -1.551) 18.697 16.182 ( 5.007 6.522 -1.428) 8.345 16.386 ( -8.695 6.665 -0.258) 10.959 16.929 ( 1.984 -5.996 -1.673) 6.534 18.128 ( 2.171 -5.336 -7.419) 9.392 18.284 ( 3.552 -2.849 2.019) 4.981 18.551 ( -5.111 -8.623 -8.755) 13.309 18.874 ( 4.675 0.585 -1.071) 4.831 20.017 ( -0.404 1.718 11.331) 11.468 21.299 ( -2.840 0.982 0.260) 3.016 21.565 ( -1.087 0.803 -0.146) 1.360 21.873 ( 7.014 0.302 -7.266) 10.103 25.146 ( 0.697 3.749 0.110) 3.814 25.325 ( 0.610 0.669 -0.340) 0.967 28.914 ( -1.083 1.471 1.681) 2.483 29.076 ( -0.042 -1.410 1.373) 1.969 34.178 ( 1.136 5.754 -0.069) 5.866 34.475 ( -24.387 -5.064 14.954) 29.052 37.716 ( 1.540 -1.558 0.094) 2.193 37.976 ( -2.387 -0.125 -0.305) 2.409 40.442 ( -0.474 -6.888 3.623) 7.797 40.939 ( 7.392 0.232 -1.984) 7.657 41.371 ( -10.331 5.762 -0.847) 11.860 43.488 ( 7.429 8.975 -21.636) 24.573 ======================= Grid point 100 (42/205) ======================= q-point: (-0.11 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.251 ( -24.677 20.768 32.230) 45.596 1.570 ( 9.833 41.152 9.435) 43.350 2.825 ( 10.743 66.997 27.362) 73.162 3.870 ( -2.008 1.375 1.212) 2.719 4.268 ( -2.883 -11.866 -4.226) 12.922 4.565 ( 3.994 -10.535 10.101) 15.132 5.178 ( -4.064 -3.919 1.129) 5.758 5.819 ( 0.858 -10.678 -5.756) 12.161 5.878 ( 0.334 -12.798 0.936) 12.836 6.073 ( 5.316 2.878 2.244) 6.448 6.297 ( -1.796 1.097 -12.727) 12.900 6.560 ( -0.566 -2.319 1.616) 2.883 6.940 ( 5.782 1.437 -6.555) 8.858 7.288 ( -7.787 -5.483 2.452) 9.834 7.732 ( 1.679 -9.026 -6.534) 11.268 7.986 ( -9.687 -0.581 -4.336) 10.629 8.092 ( -3.911 -8.541 -9.739) 13.531 8.401 ( 8.072 11.219 -8.390) 16.168 8.560 ( 11.843 -0.912 5.353) 13.028 8.676 ( -1.353 10.617 4.239) 11.511 8.987 ( -2.250 -5.854 -1.234) 6.392 9.210 ( -2.862 2.972 -4.743) 6.287 9.398 ( -1.921 -8.605 -1.684) 8.977 9.689 ( -1.818 7.822 -5.840) 9.930 10.438 ( 0.860 -3.620 1.031) 3.861 10.586 ( -3.518 2.069 1.593) 4.381 10.677 ( 2.250 -1.347 0.289) 2.638 11.403 ( -10.178 -4.418 15.885) 19.376 11.584 ( 5.577 -16.495 0.754) 17.429 11.644 ( 7.172 -4.347 10.670) 13.571 11.833 ( -6.333 4.026 7.018) 10.275 12.244 ( -13.951 -3.894 -0.940) 14.515 12.475 ( 10.523 -11.398 7.941) 17.427 12.724 ( 21.134 0.741 7.202) 22.339 13.072 ( 0.220 5.583 -8.769) 10.397 13.300 ( -8.201 9.273 -0.858) 12.409 13.527 ( -3.662 -1.929 5.792) 7.119 13.796 ( -2.786 -1.736 6.595) 7.367 14.423 ( -5.574 -1.957 -2.403) 6.378 14.583 ( -3.448 -7.725 4.062) 9.384 14.909 ( 5.994 -5.085 5.809) 9.774 15.209 ( 3.082 4.794 0.759) 5.749 15.779 ( -0.066 15.127 -2.544) 15.339 16.069 ( 5.132 7.288 -0.933) 8.962 16.328 ( 7.544 5.555 -2.503) 9.697 16.983 ( -10.210 -4.556 -3.176) 11.623 18.141 ( -8.430 -2.551 -9.660) 13.072 18.347 ( 1.577 0.770 -15.764) 15.861 18.409 ( -10.558 -1.408 -3.264) 11.140 19.007 ( 12.816 3.386 1.571) 13.349 20.171 ( 6.873 -11.118 21.289) 24.981 21.246 ( -1.662 1.910 -0.580) 2.597 21.550 ( 0.484 0.303 -0.469) 0.739 21.895 ( 5.534 3.324 -12.078) 13.695 25.083 ( 0.451 4.858 0.591) 4.914 25.318 ( -0.539 0.133 -0.909) 1.065 28.882 ( -0.784 1.655 1.255) 2.220 29.111 ( 0.828 -1.191 1.529) 2.107 34.125 ( -0.615 2.622 3.617) 4.509 34.269 ( -33.087 -3.842 16.370) 37.115 37.706 ( -5.389 1.044 -4.704) 7.229 37.922 ( -2.681 1.867 -2.085) 3.875 40.536 ( -3.510 -6.514 2.038) 7.676 41.025 ( 0.666 -0.547 -1.622) 1.837 41.275 ( 14.627 2.422 8.524) 17.102 43.310 ( 15.335 16.335 -31.744) 38.854 ======================= Grid point 103 (43/205) ======================= q-point: ( 0.22 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.458 ( 24.058 0.000 37.687) 44.711 2.705 ( 30.887 0.000 12.272) 33.235 3.582 ( -8.177 -0.000 -7.941) 11.398 4.184 ( 19.157 0.000 18.827) 26.859 4.681 ( -0.922 -0.000 5.798) 5.870 4.755 ( 16.129 0.000 10.478) 19.234 5.332 ( 0.881 0.000 11.439) 11.473 5.675 ( -12.957 -0.000 13.706) 18.861 5.922 ( -5.433 -0.000 0.605) 5.466 5.986 ( -5.108 -0.000 -8.770) 10.149 6.154 ( 9.935 0.000 -8.141) 12.845 6.187 ( 4.042 0.000 -24.101) 24.438 6.643 ( -13.108 -0.000 -10.969) 17.092 7.174 ( -1.237 -0.000 -8.320) 8.411 7.308 ( -1.417 -0.000 -4.885) 5.087 7.883 ( -6.893 -0.000 -17.587) 18.890 7.901 ( -9.435 -0.000 4.563) 10.481 8.086 ( -5.307 -0.000 13.722) 14.712 8.516 ( -1.874 -0.000 -0.697) 2.000 8.635 ( 1.057 0.000 -7.210) 7.287 9.199 ( -10.954 -0.000 0.633) 10.972 9.201 ( 10.633 0.000 -7.737) 13.150 9.451 ( 6.817 0.000 -5.733) 8.907 9.722 ( 6.912 0.000 7.715) 10.358 10.494 ( -7.602 -0.000 -1.177) 7.693 10.506 ( -0.880 -0.000 5.326) 5.398 10.719 ( 3.631 0.000 3.059) 4.748 11.048 ( -12.059 -0.000 14.278) 18.690 11.208 ( -7.499 -0.000 3.115) 8.120 11.669 ( -10.777 -0.000 -0.988) 10.822 11.950 ( 2.238 0.000 -12.231) 12.434 11.998 ( 5.233 0.000 2.481) 5.791 12.678 ( -11.554 -0.000 10.812) 15.824 12.879 ( 8.147 0.000 -10.121) 12.993 13.164 ( -12.008 -0.000 9.292) 15.183 13.500 ( 7.060 0.000 12.858) 14.668 13.732 ( 1.852 0.000 8.279) 8.483 14.050 ( 18.048 0.000 -4.982) 18.723 14.593 ( -6.774 -0.000 -2.897) 7.368 14.650 ( -8.671 -0.000 2.765) 9.101 14.833 ( -6.833 -0.000 -2.941) 7.439 15.015 ( -7.780 -0.000 4.375) 8.926 15.797 ( 4.807 0.000 8.508) 9.772 16.125 ( 14.722 0.000 -22.969) 27.282 16.604 ( 17.008 0.000 -1.534) 17.077 16.886 ( 8.867 0.000 6.069) 10.745 17.694 ( -4.630 -0.000 -1.426) 4.844 18.095 ( -8.026 -0.000 -1.077) 8.098 18.596 ( 4.939 0.000 -11.920) 12.903 18.692 ( -11.694 -0.000 4.371) 12.484 20.614 ( -7.452 -0.000 5.328) 9.161 21.147 ( -1.204 -0.000 -1.520) 1.939 21.428 ( 0.446 0.000 1.748) 1.804 21.833 ( 0.603 0.000 5.728) 5.759 24.983 ( -1.696 -0.000 2.395) 2.935 25.342 ( 4.033 0.000 -2.826) 4.925 28.830 ( -1.207 -0.000 0.554) 1.328 29.172 ( 0.584 0.000 0.291) 0.652 34.423 ( 20.065 0.000 -21.803) 29.630 34.558 ( 6.647 0.000 13.531) 15.075 37.467 ( 2.471 0.000 2.167) 3.286 37.835 ( 1.321 0.000 -3.989) 4.202 40.310 ( -4.925 -0.000 -7.386) 8.878 41.376 ( -11.776 -0.000 -4.590) 12.639 41.427 ( 10.672 0.000 0.841) 10.705 43.865 ( 10.276 0.000 -13.043) 16.605 ======================= Grid point 104 (44/205) ======================= q-point: ( 0.33 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.841 ( 21.506 1.822 28.065) 35.405 3.098 ( 6.985 -9.216 12.863) 17.297 3.557 ( -6.020 -12.174 -8.637) 16.095 4.286 ( -7.511 -4.261 1.935) 8.850 4.737 ( 2.257 -1.832 24.375) 24.548 5.001 ( 24.353 12.281 -1.030) 27.294 5.235 ( -13.232 5.461 1.214) 14.366 5.457 ( -12.230 9.821 16.470) 22.744 5.671 ( -2.664 17.793 -13.888) 22.728 5.852 ( -1.800 7.921 -0.889) 8.172 6.234 ( 11.891 -8.639 2.626) 14.931 6.524 ( 17.751 -13.266 -1.489) 22.210 6.692 ( -5.175 -24.204 -15.997) 29.471 7.092 ( -3.949 4.171 -4.244) 7.141 7.196 ( 2.107 9.134 -7.317) 11.892 7.576 ( -13.322 9.170 -7.909) 18.004 7.839 ( -5.302 -2.189 -7.503) 9.444 8.249 ( -1.704 -11.560 10.770) 15.891 8.545 ( -3.288 -4.989 2.476) 6.468 8.633 ( 1.077 -2.000 -8.711) 9.003 9.063 ( -6.989 1.192 -0.489) 7.106 9.250 ( 7.226 3.553 -3.835) 8.919 9.536 ( 7.087 -3.401 -6.167) 9.992 9.802 ( 8.467 5.461 7.390) 12.495 10.341 ( -5.535 6.416 -0.588) 8.494 10.497 ( -2.229 0.703 2.027) 3.094 10.782 ( 4.415 0.585 1.565) 4.721 10.960 ( -4.944 4.386 10.237) 12.185 11.183 ( -3.009 -2.706 3.387) 5.277 11.538 ( -12.187 -1.368 0.005) 12.263 11.919 ( 3.706 1.393 -14.569) 15.098 12.043 ( -4.549 -3.089 -0.200) 5.502 12.552 ( -5.310 7.988 13.204) 16.320 12.916 ( 3.614 -0.949 -7.402) 8.291 13.110 ( -5.961 -3.635 2.262) 7.339 13.640 ( 3.894 -1.993 13.464) 14.157 13.772 ( 2.089 1.722 8.427) 8.851 14.186 ( 4.773 1.457 -4.917) 7.006 14.543 ( -8.614 -1.868 0.549) 8.832 14.567 ( 0.143 -0.054 -1.928) 1.934 14.732 ( -4.885 -0.702 0.580) 4.969 14.973 ( -7.427 -1.927 5.035) 9.177 15.871 ( 4.436 1.192 8.258) 9.449 16.220 ( 13.845 -0.187 -19.000) 23.510 16.778 ( 12.636 0.178 -2.884) 12.962 17.001 ( 9.047 1.301 3.717) 9.867 17.663 ( -0.181 -1.206 -1.302) 1.784 17.977 ( -7.859 1.861 -0.814) 8.117 18.457 ( -3.700 6.358 -1.830) 7.581 18.736 ( -5.731 -9.720 -4.745) 12.241 20.510 ( -3.759 5.935 4.416) 8.298 21.166 ( -1.695 -4.509 -1.620) 5.083 21.455 ( 0.186 -1.890 1.113) 2.202 21.852 ( -1.517 -0.185 5.077) 5.302 24.991 ( -1.936 -2.395 2.409) 3.909 25.380 ( 4.976 0.576 -2.879) 5.777 28.826 ( -1.263 -1.076 0.591) 1.761 29.171 ( -0.412 0.461 0.471) 0.777 34.529 ( 14.427 3.120 -14.809) 20.909 34.669 ( 4.265 0.852 11.871) 12.643 37.516 ( 3.144 -0.417 2.851) 4.265 37.849 ( 2.177 -1.172 -4.086) 4.776 40.229 ( -2.873 0.539 -6.405) 7.040 41.166 ( -7.643 5.514 -1.772) 9.590 41.601 ( 5.467 -5.173 -1.641) 7.703 43.881 ( 6.712 3.943 -10.022) 12.690 ======================= Grid point 105 (45/205) ======================= q-point: ( 0.44 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.070 ( 0.372 1.259 25.029) 25.063 3.271 ( -8.021 -8.391 13.308) 17.659 3.673 ( -9.776 -16.188 -12.310) 22.564 4.258 ( 1.763 2.254 0.587) 2.921 4.716 ( -3.748 21.065 -13.538) 25.319 4.865 ( -2.388 5.966 17.683) 18.814 5.130 ( -1.989 -2.956 8.109) 8.857 5.296 ( -4.135 5.466 1.184) 6.955 5.496 ( 11.450 8.210 1.772) 14.200 5.744 ( 5.303 4.108 2.498) 7.158 6.475 ( -1.002 -5.776 9.326) 11.016 6.752 ( -0.991 8.269 -4.726) 9.576 6.937 ( -0.610 -8.396 -2.858) 8.890 7.043 ( 3.627 -13.161 -15.068) 20.332 7.188 ( 6.545 0.672 0.271) 6.585 7.331 ( -1.288 -5.829 -5.847) 8.355 7.789 ( 0.113 1.382 -6.980) 7.116 8.325 ( -3.404 5.900 2.063) 7.117 8.566 ( -3.753 -7.569 -4.731) 9.683 8.679 ( -3.786 -6.044 3.074) 7.766 9.046 ( 0.106 -4.451 -3.526) 5.679 9.282 ( 7.437 1.262 -0.246) 7.548 9.639 ( 8.770 2.980 -5.046) 10.547 9.830 ( 6.172 0.783 1.869) 6.496 10.219 ( -2.952 2.661 4.457) 5.972 10.449 ( -2.731 1.647 -0.157) 3.193 10.767 ( 0.693 6.006 -1.725) 6.287 10.916 ( 6.570 5.728 7.763) 11.673 11.221 ( -0.832 -2.692 0.879) 2.952 11.439 ( -13.976 -5.288 3.545) 15.358 11.883 ( 1.645 3.015 -7.710) 8.440 11.990 ( -4.609 -1.695 -4.081) 6.386 12.457 ( 3.537 7.619 6.985) 10.925 12.935 ( -0.732 -1.198 -3.039) 3.348 13.125 ( -5.272 -5.544 -0.248) 7.655 13.755 ( 2.448 -1.645 11.532) 11.903 13.790 ( -1.744 1.196 8.531) 8.789 14.111 ( -5.828 2.250 -3.053) 6.954 14.377 ( -14.382 0.529 -2.759) 14.654 14.511 ( -6.436 5.544 5.631) 10.192 14.883 ( 9.698 -5.939 -5.143) 12.481 14.946 ( -1.538 -3.518 4.628) 6.014 15.950 ( 6.020 0.017 7.123) 9.326 16.292 ( 13.326 3.474 -13.219) 19.089 16.843 ( 5.151 3.061 -3.854) 7.124 17.076 ( 4.577 2.257 2.956) 5.898 17.726 ( 4.539 -3.176 -1.575) 5.759 17.882 ( -3.301 -0.838 -1.634) 3.777 18.337 ( -5.478 1.971 1.492) 6.010 18.782 ( -4.649 -6.916 -6.503) 10.571 20.388 ( -2.302 7.034 4.053) 8.438 21.217 ( -2.056 -5.154 -1.292) 5.698 21.497 ( 0.355 -2.695 0.244) 2.729 21.843 ( -2.736 0.132 3.404) 4.369 25.028 ( -1.934 -3.850 2.155) 4.817 25.414 ( 5.245 1.399 -2.713) 6.069 28.838 ( -1.170 -2.000 0.709) 2.423 29.151 ( -1.257 1.137 0.774) 1.863 34.552 ( 8.576 5.614 -6.766) 12.282 34.715 ( 1.579 2.732 7.688) 8.310 37.573 ( 3.220 -0.371 3.523) 4.787 37.887 ( 2.468 -1.810 -3.489) 4.641 40.185 ( -0.388 -0.144 -3.481) 3.506 41.017 ( -5.682 2.729 -1.267) 6.429 41.689 ( 1.737 -1.397 -2.166) 3.108 43.840 ( 5.380 5.196 -9.137) 11.807 ======================= Grid point 106 (46/205) ======================= q-point: (-0.44 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.888 ( -32.525 7.710 20.913) 39.430 3.342 ( -14.782 -9.187 11.375) 20.792 3.752 ( 1.892 -8.055 -9.750) 12.788 4.145 ( 4.284 19.364 0.901) 19.853 4.404 ( -10.509 5.802 -3.622) 12.539 4.795 ( 7.130 2.988 5.249) 9.344 5.201 ( 1.651 1.935 2.022) 3.249 5.238 ( 6.945 1.398 -1.507) 7.243 5.540 ( 5.165 -0.768 2.177) 5.657 5.920 ( 16.969 -3.575 7.580) 18.926 6.360 ( -20.498 -0.671 4.275) 20.950 6.572 ( -3.784 9.322 -4.087) 10.859 6.901 ( -12.218 9.874 -5.351) 16.596 7.122 ( 12.865 -1.470 7.006) 14.722 7.304 ( -0.263 -18.492 -14.499) 23.500 7.684 ( 6.860 -3.052 0.904) 7.562 7.759 ( 7.982 -4.737 -0.523) 9.296 8.142 ( -2.887 4.834 -2.953) 6.358 8.617 ( -3.080 -5.871 -6.953) 9.608 8.768 ( -2.584 -7.369 2.953) 8.349 9.084 ( 2.393 0.530 -5.434) 5.961 9.356 ( 3.956 1.511 0.672) 4.288 9.590 ( 7.321 8.149 -3.131) 11.393 9.976 ( 4.326 -7.762 -5.885) 10.658 10.201 ( -2.558 -0.180 8.657) 9.028 10.419 ( -0.375 -1.333 1.351) 1.935 10.668 ( 4.788 6.678 -3.270) 8.844 10.936 ( 5.573 4.987 4.847) 8.911 11.208 ( -5.527 0.432 -1.548) 5.755 11.455 ( -4.555 -9.402 6.354) 12.228 11.787 ( -6.686 0.638 0.738) 6.757 12.038 ( 10.034 -0.559 -5.505) 11.459 12.426 ( 6.685 6.573 2.627) 9.736 12.886 ( -6.944 1.028 -2.679) 7.513 13.154 ( -6.696 -6.587 1.451) 9.504 13.731 ( -8.116 1.699 2.683) 8.716 13.837 ( 1.103 -0.298 9.455) 9.524 13.997 ( -9.555 0.482 1.274) 9.652 14.221 ( -4.400 2.834 1.620) 5.479 14.361 ( -6.948 4.191 2.442) 8.474 14.868 ( -5.726 -0.510 -0.793) 5.803 15.185 ( 13.721 -5.427 -1.747) 14.859 16.068 ( 6.864 -1.836 4.710) 8.525 16.323 ( 13.154 6.821 -7.931) 16.806 16.815 ( 2.969 2.955 -4.000) 5.792 17.007 ( -5.558 7.957 2.697) 10.073 17.816 ( 3.623 -4.253 -3.421) 6.551 17.966 ( 5.760 -7.112 -2.509) 9.489 18.273 ( -7.607 -2.008 4.840) 9.237 18.804 ( -1.587 -4.241 -6.826) 8.192 20.265 ( -2.437 6.945 4.098) 8.424 21.262 ( -2.094 -3.994 -0.869) 4.592 21.545 ( 0.065 -2.610 -0.134) 2.615 21.819 ( -2.246 -0.260 0.996) 2.470 25.080 ( -1.560 -4.233 1.681) 4.814 25.432 ( 4.615 2.570 -2.261) 5.746 28.866 ( -0.866 -2.543 1.066) 2.890 29.115 ( -1.586 1.661 0.994) 2.502 34.502 ( 3.510 7.417 -1.486) 8.339 34.681 ( -1.012 4.871 4.544) 6.738 37.628 ( 2.425 -0.596 3.353) 4.181 37.931 ( 2.033 -1.679 -2.414) 3.575 40.201 ( 1.650 -1.729 0.425) 2.428 40.934 ( -2.711 0.622 -1.823) 3.326 41.669 ( -2.285 2.460 -1.760) 3.791 43.776 ( 4.610 5.368 -10.266) 12.468 ======================= Grid point 107 (47/205) ======================= q-point: (-0.33 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.370 ( -38.196 11.590 20.652) 44.942 3.202 ( -10.959 11.913 2.114) 16.324 3.830 ( 2.715 -1.945 -6.230) 7.069 4.068 ( 6.330 -0.810 6.555) 9.148 4.105 ( -9.805 10.852 -2.130) 14.780 4.925 ( 0.582 -7.762 -0.461) 7.797 5.173 ( 6.095 14.007 8.827) 17.643 5.306 ( 14.401 5.645 2.129) 15.614 5.643 ( 7.021 0.232 -2.367) 7.413 6.082 ( -9.332 1.360 -2.581) 9.778 6.299 ( 6.518 -3.417 0.513) 7.377 6.393 ( -11.448 -9.848 6.523) 16.449 6.621 ( -4.476 5.388 -1.953) 7.272 7.279 ( 5.664 1.858 3.169) 6.751 7.430 ( -5.277 -4.786 -5.876) 9.235 7.653 ( 5.655 3.038 -5.252) 8.294 8.014 ( 10.994 -8.530 2.117) 14.076 8.175 ( -6.052 -10.455 -2.111) 12.264 8.646 ( -3.635 -6.050 -4.530) 8.387 8.828 ( 2.917 0.790 -2.439) 3.884 9.056 ( 2.167 2.460 -7.116) 7.835 9.294 ( 0.452 6.067 -3.068) 6.814 9.558 ( 1.759 5.153 -1.648) 5.689 10.001 ( -1.816 1.794 -4.796) 5.433 10.267 ( 0.605 -4.899 2.724) 5.638 10.488 ( 3.676 -2.834 3.525) 5.828 10.684 ( 5.934 0.046 -1.336) 6.083 10.940 ( -2.127 -2.040 2.353) 3.771 11.141 ( -2.725 -1.393 3.672) 4.781 11.570 ( 1.442 -0.440 2.391) 2.827 11.802 ( -3.640 -11.370 2.843) 12.272 12.125 ( 8.410 4.117 1.124) 9.431 12.449 ( 11.884 4.337 1.342) 12.722 12.716 ( -12.699 3.280 -2.649) 13.381 13.166 ( -8.761 -5.339 1.106) 10.319 13.609 ( -5.130 2.735 -2.151) 6.198 13.801 ( -5.754 4.717 -0.340) 7.448 13.917 ( -3.983 1.096 8.720) 9.649 14.204 ( -1.982 -2.507 6.680) 7.406 14.284 ( 0.434 0.445 1.384) 1.517 14.802 ( -4.386 0.097 -0.906) 4.480 15.360 ( 8.279 -0.512 -1.254) 8.389 16.183 ( 5.464 -1.019 1.644) 5.796 16.338 ( 13.386 7.663 -3.059) 15.725 16.736 ( -11.882 13.051 1.753) 17.736 16.817 ( 3.949 -0.246 -4.501) 5.993 17.926 ( 2.199 -6.602 -5.917) 9.134 18.145 ( 5.204 -6.891 -3.437) 9.294 18.260 ( -9.563 -6.876 4.028) 12.448 18.846 ( 4.562 -2.204 -2.521) 5.660 20.148 ( -2.714 5.903 5.136) 8.282 21.286 ( -1.564 -2.077 -0.811) 2.724 21.568 ( -1.225 -1.027 0.183) 1.609 21.821 ( 0.006 -2.097 -2.151) 3.004 25.133 ( -1.023 -3.464 1.067) 3.766 25.420 ( 3.053 3.804 -1.562) 5.122 28.904 ( -0.423 -2.226 1.700) 2.833 29.075 ( -1.251 1.438 1.114) 2.208 34.398 ( -0.120 7.796 1.066) 7.870 34.576 ( -3.264 7.108 3.863) 8.724 37.670 ( 0.483 -1.068 1.914) 2.245 37.962 ( 0.981 -0.827 -1.557) 2.018 40.273 ( 1.616 -3.376 3.655) 5.232 40.923 ( 2.057 -0.911 -2.057) 3.048 41.556 ( -4.293 5.523 -0.557) 7.017 43.695 ( 3.840 5.438 -13.074) 14.671 ======================= Grid point 108 (48/205) ======================= q-point: (-0.22 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.882 ( -16.677 16.901 23.466) 33.383 2.784 ( -0.154 29.966 -0.312) 29.968 3.876 ( -0.749 1.367 -2.234) 2.724 3.925 ( -3.726 -5.666 -4.278) 8.019 4.219 ( 3.262 -7.010 2.120) 8.017 4.769 ( -0.507 41.539 13.960) 43.825 5.057 ( 4.425 -1.273 2.560) 5.269 5.422 ( 1.949 -4.387 8.625) 9.871 5.644 ( 1.372 -1.633 -2.316) 3.148 6.086 ( 7.608 -5.383 -6.056) 11.115 6.314 ( -3.869 -0.485 2.220) 4.487 6.466 ( 1.525 0.048 0.652) 1.659 6.818 ( 1.814 -21.948 -0.206) 22.024 7.225 ( -7.427 2.824 3.689) 8.761 7.384 ( 1.080 -0.866 -7.676) 7.799 7.705 ( 2.140 -3.602 -2.880) 5.084 8.127 ( -13.706 -1.463 -7.501) 15.693 8.329 ( 10.352 -10.658 2.537) 15.073 8.695 ( -2.057 -6.615 -3.935) 7.967 8.797 ( 7.623 8.332 -4.987) 12.346 9.019 ( 1.399 2.081 -4.988) 5.583 9.214 ( -1.152 1.405 -3.537) 3.976 9.425 ( -1.528 8.439 -4.458) 9.666 9.908 ( -3.024 4.643 -3.487) 6.547 10.337 ( -0.243 -3.084 0.744) 3.182 10.604 ( 4.861 -3.115 1.123) 5.881 10.665 ( -4.598 2.860 1.437) 5.603 11.068 ( 1.848 -12.787 1.911) 13.060 11.222 ( -3.037 -6.836 10.572) 12.951 11.573 ( 0.324 -0.800 1.977) 2.157 11.947 ( -7.476 -7.942 -0.891) 10.944 12.117 ( 4.122 5.797 5.574) 9.037 12.439 ( -4.916 4.182 -4.117) 7.656 12.673 ( 13.404 -1.921 7.294) 15.381 13.148 ( -1.981 -2.172 -3.506) 4.575 13.502 ( -3.433 3.568 -4.100) 6.428 13.635 ( -6.298 5.740 -2.186) 8.797 13.867 ( -0.480 6.114 11.959) 13.440 14.281 ( -4.123 -6.032 0.441) 7.320 14.354 ( 3.969 -5.189 4.682) 8.037 14.796 ( 3.429 -1.301 2.806) 4.618 15.388 ( 2.100 3.944 0.265) 4.476 16.229 ( 6.469 4.676 -0.938) 8.037 16.319 ( -5.476 13.054 1.361) 14.222 16.428 ( 1.926 4.706 1.647) 5.345 16.853 ( 0.554 -1.958 -6.403) 6.719 17.996 ( -3.646 -5.922 -8.222) 10.768 18.251 ( 0.210 -4.187 1.687) 4.519 18.269 ( -8.763 -7.510 -9.758) 15.114 18.995 ( 12.204 -3.003 4.949) 13.507 20.074 ( -1.831 2.429 8.442) 8.973 21.286 ( -0.336 0.054 -1.075) 1.127 21.558 ( -1.184 0.005 -0.038) 1.185 21.861 ( 1.184 -3.192 -4.855) 5.930 25.166 ( -0.502 -1.236 0.471) 1.415 25.374 ( 0.783 4.080 -0.850) 4.240 28.926 ( -0.449 0.119 1.838) 1.895 29.064 ( -0.068 -0.725 1.705) 1.854 34.270 ( -3.242 6.734 2.534) 7.892 34.424 ( -2.412 8.916 4.351) 10.210 37.682 ( -2.585 -1.239 -0.394) 2.893 37.963 ( -0.175 0.622 -1.698) 1.817 40.355 ( -1.150 -4.233 4.051) 5.971 40.987 ( 4.024 -1.743 -0.574) 4.423 41.434 ( 2.088 5.978 1.876) 6.604 43.591 ( 3.808 5.687 -17.030) 18.354 ======================= Grid point 109 (49/205) ======================= q-point: (-0.11 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.693 ( 18.787 20.391 18.396) 33.274 2.371 ( 18.451 32.166 7.848) 37.904 3.784 ( -6.258 13.510 6.189) 16.124 3.964 ( -0.322 1.991 -1.193) 2.343 4.184 ( 14.510 27.857 12.313) 33.736 4.425 ( -1.776 -12.682 2.642) 13.075 5.139 ( 4.707 -0.714 1.977) 5.155 5.549 ( -6.622 -12.669 2.779) 14.563 5.723 ( -3.994 -7.065 3.469) 8.826 6.222 ( 3.801 3.011 5.829) 7.582 6.245 ( -0.270 1.409 -7.402) 7.540 6.537 ( 5.173 -4.199 -2.486) 7.111 7.011 ( 1.671 -0.616 -8.397) 8.584 7.109 ( -9.041 -0.662 3.206) 9.616 7.535 ( 2.407 -13.432 -6.188) 14.983 7.759 ( -7.867 -11.530 -1.823) 14.077 7.909 ( -10.581 2.592 -8.812) 14.012 8.542 ( 6.121 -0.741 -7.373) 9.611 8.752 ( 3.181 -1.112 2.455) 4.169 8.776 ( 8.754 4.295 -1.831) 9.922 8.967 ( 2.403 3.808 -4.779) 6.566 9.181 ( -3.712 -1.787 -4.546) 6.135 9.292 ( -0.374 2.574 -3.212) 4.133 9.753 ( -3.313 7.311 -4.598) 9.250 10.374 ( -2.386 -3.128 1.706) 4.288 10.561 ( -6.513 1.351 3.237) 7.397 10.681 ( -0.232 -0.515 2.476) 2.540 11.183 ( -16.114 -10.044 8.473) 20.793 11.459 ( 11.096 -12.097 4.163) 16.935 11.653 ( 1.706 -4.831 5.661) 7.635 11.821 ( -12.172 4.503 -0.286) 12.982 12.059 ( -6.578 0.371 -3.353) 7.393 12.444 ( 1.230 -5.550 8.236) 10.008 12.962 ( 18.177 -3.931 8.092) 20.282 13.166 ( 8.902 2.770 -7.234) 11.800 13.367 ( -2.823 7.195 -7.558) 10.810 13.484 ( -5.568 1.602 3.122) 6.582 13.836 ( 1.317 4.000 10.370) 11.192 14.304 ( -4.119 -4.679 -0.010) 6.234 14.513 ( 5.711 -4.746 1.951) 7.677 14.959 ( 10.166 -4.737 6.353) 12.890 15.316 ( -1.137 5.088 1.529) 5.433 15.927 ( -10.888 15.197 -1.290) 18.740 16.257 ( 5.251 3.173 2.598) 6.662 16.490 ( 8.847 1.980 4.127) 9.961 16.780 ( -10.723 1.478 -10.084) 14.794 17.946 ( -8.696 -2.366 -11.767) 14.821 18.221 ( -4.329 -3.195 -11.490) 12.687 18.326 ( -0.741 -4.657 2.088) 5.157 19.177 ( 8.503 0.754 2.130) 8.798 20.140 ( 0.967 -6.686 14.922) 16.380 21.272 ( 1.509 1.837 -1.510) 2.816 21.551 ( -0.018 -0.240 -0.706) 0.746 21.887 ( -0.169 -1.256 -6.325) 6.450 25.154 ( -0.151 2.822 0.480) 2.867 25.317 ( -1.073 1.854 -0.773) 2.277 28.907 ( -0.532 1.787 1.132) 2.182 29.102 ( 0.636 -1.923 2.476) 3.199 34.128 ( -2.317 6.879 1.110) 7.343 34.316 ( 3.292 6.967 5.674) 9.569 37.636 ( -5.618 0.406 -2.529) 6.174 37.928 ( -0.363 1.973 -2.543) 3.239 40.410 ( -3.193 -4.644 1.485) 5.828 41.003 ( -3.050 0.219 2.505) 3.953 41.514 ( 16.567 0.253 3.537) 16.943 43.489 ( 7.573 5.051 -20.340) 22.284 ======================= Grid point 113 (50/205) ======================= q-point: ( 0.33 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.060 ( -12.088 -0.000 10.546) 16.042 3.105 ( 3.080 0.000 9.163) 9.667 3.418 ( 3.444 0.000 12.336) 12.808 4.255 ( 7.234 0.000 -0.884) 7.288 4.816 ( 0.491 0.000 19.292) 19.298 5.030 ( -21.849 -0.000 2.897) 22.040 5.316 ( 10.245 0.000 0.076) 10.245 5.545 ( -2.633 -0.000 21.381) 21.543 5.777 ( -4.537 -0.000 -9.034) 10.109 5.862 ( -9.525 -0.000 -22.797) 24.707 6.244 ( -7.465 -0.000 -5.177) 9.084 6.362 ( 20.524 0.000 6.222) 21.447 6.741 ( 28.574 0.000 2.960) 28.726 7.091 ( 0.433 0.000 -7.207) 7.220 7.288 ( 3.518 0.000 -6.737) 7.600 7.471 ( -12.385 -0.000 -21.022) 24.399 7.671 ( -9.219 -0.000 3.458) 9.847 8.204 ( 2.381 0.000 10.705) 10.966 8.497 ( -0.429 -0.000 1.368) 1.433 8.611 ( 2.133 0.000 -6.645) 6.979 8.975 ( -8.582 -0.000 1.329) 8.684 9.341 ( 4.700 0.000 -1.020) 4.810 9.547 ( 5.464 0.000 -5.462) 7.726 9.989 ( 8.849 0.000 8.283) 12.120 10.318 ( -6.608 -0.000 -2.594) 7.099 10.455 ( -2.563 -0.000 -6.879) 7.341 10.867 ( 6.642 0.000 1.792) 6.880 11.000 ( -3.102 -0.000 17.511) 17.784 11.159 ( -0.011 -0.000 3.316) 3.316 11.389 ( -10.473 -0.000 -2.386) 10.742 11.905 ( -12.220 -0.000 -1.630) 12.328 11.943 ( 8.561 0.000 -15.036) 17.302 12.643 ( -0.815 -0.000 12.530) 12.556 12.906 ( 2.493 0.000 -12.166) 12.418 13.011 ( -6.928 -0.000 5.471) 8.828 13.717 ( 2.016 0.000 13.601) 13.750 13.820 ( -1.199 -0.000 6.164) 6.279 14.126 ( -10.699 -0.000 -3.884) 11.382 14.392 ( -9.657 -0.000 0.910) 9.700 14.661 ( -9.424 -0.000 4.749) 10.553 14.712 ( 20.590 0.000 -6.061) 21.464 14.911 ( -4.777 -0.000 6.066) 7.721 15.943 ( 1.981 0.000 6.756) 7.040 16.325 ( 16.271 0.000 -18.139) 24.367 16.906 ( 9.158 0.000 -2.597) 9.520 17.122 ( 6.516 0.000 3.219) 7.267 17.661 ( 3.074 0.000 -1.193) 3.298 17.897 ( -8.119 -0.000 1.265) 8.217 18.400 ( -15.459 -0.000 4.787) 16.183 18.627 ( 6.210 0.000 -11.578) 13.138 20.531 ( -2.845 -0.000 1.838) 3.387 21.103 ( -1.497 -0.000 -1.035) 1.819 21.446 ( 0.147 0.000 0.938) 0.950 21.844 ( -3.107 -0.000 5.101) 5.973 24.960 ( -1.767 -0.000 2.492) 3.055 25.434 ( 5.241 0.000 -2.783) 5.934 28.805 ( -1.233 -0.000 0.720) 1.428 29.168 ( -0.892 -0.000 0.071) 0.895 34.659 ( 12.050 0.000 -12.140) 17.105 34.755 ( 1.070 0.000 11.262) 11.313 37.567 ( 3.504 0.000 3.584) 5.012 37.855 ( 2.964 0.000 -3.842) 4.853 40.189 ( -0.456 -0.000 -4.881) 4.902 41.074 ( -10.430 -0.000 -2.484) 10.722 41.657 ( 7.957 0.000 -0.590) 7.978 43.933 ( 3.962 0.000 -9.943) 10.703 ======================= Grid point 114 (51/205) ======================= q-point: ( 0.44 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.923 ( -23.572 -5.149 11.475) 26.718 3.156 ( -4.151 -6.530 0.147) 7.739 3.501 ( -0.953 2.783 18.483) 18.716 4.384 ( 14.512 0.634 -2.940) 14.820 4.752 ( -11.870 6.178 -4.429) 14.095 4.958 ( -3.094 -8.670 10.562) 14.011 5.229 ( 0.073 22.730 -4.754) 23.222 5.334 ( -8.985 8.128 -4.165) 12.812 5.610 ( -0.965 1.669 18.733) 18.832 5.943 ( 7.744 -7.058 -3.074) 10.920 6.350 ( -4.723 -12.035 2.952) 13.261 6.653 ( 11.322 -7.009 -0.329) 13.320 6.928 ( 3.243 10.000 -7.390) 12.850 7.007 ( -2.288 5.151 -7.038) 9.016 7.255 ( -1.645 1.458 -3.857) 4.439 7.293 ( 9.715 -3.683 -2.812) 10.764 7.749 ( 6.623 -6.472 -5.755) 10.903 8.303 ( -0.648 -6.008 4.589) 7.588 8.473 ( -3.965 3.246 0.575) 5.156 8.620 ( 0.720 -0.467 -0.346) 0.926 8.937 ( -3.186 -5.873 0.549) 6.704 9.378 ( 4.622 1.101 -0.423) 4.771 9.640 ( 5.932 -5.707 -4.858) 9.558 10.030 ( 5.042 9.679 2.608) 11.220 10.211 ( -5.396 0.923 1.112) 5.587 10.404 ( -2.594 -1.178 -8.079) 8.566 10.887 ( 2.967 5.490 2.086) 6.580 11.081 ( 5.707 -0.174 13.392) 14.558 11.189 ( -0.349 -1.980 0.069) 2.012 11.247 ( -10.269 0.997 -0.432) 10.327 11.764 ( -14.510 -2.828 -0.799) 14.804 12.024 ( 14.280 0.135 -9.693) 17.260 12.625 ( 1.760 5.314 4.953) 7.475 12.905 ( 0.303 -1.408 -7.564) 7.699 12.973 ( -7.512 -2.983 4.079) 9.053 13.761 ( -4.789 0.136 7.648) 9.024 13.802 ( -4.688 -0.744 6.345) 7.923 13.990 ( -8.420 0.144 -2.211) 8.707 14.312 ( -2.923 1.750 4.884) 5.955 14.532 ( -8.330 4.227 4.079) 10.193 14.858 ( -2.799 -0.382 -0.527) 2.874 14.996 ( 16.867 -4.468 -0.962) 17.476 15.994 ( 1.004 -1.787 4.606) 5.042 16.444 ( 15.641 1.232 -14.151) 21.128 16.949 ( 4.529 3.570 -1.612) 5.988 17.168 ( 1.583 2.445 3.444) 4.511 17.730 ( 5.000 -2.521 -1.462) 5.787 17.818 ( -4.595 -0.712 0.125) 4.652 18.241 ( -13.609 -0.451 4.445) 14.324 18.684 ( 5.656 -2.560 -9.644) 11.470 20.467 ( -2.095 4.624 0.936) 5.162 21.117 ( -1.371 -3.875 -0.999) 4.230 21.463 ( -0.032 -1.748 0.117) 1.752 21.818 ( -3.965 0.061 3.910) 5.569 24.968 ( -1.572 -2.169 2.315) 3.540 25.478 ( 4.681 0.543 -2.516) 5.342 28.804 ( -0.961 -1.124 0.918) 1.741 29.151 ( -1.208 0.585 0.023) 1.342 34.704 ( 6.435 4.612 -3.406) 8.619 34.786 ( 0.761 0.980 4.364) 4.537 37.619 ( 2.434 -0.083 3.829) 4.538 37.886 ( 3.228 -0.894 -2.984) 4.486 40.186 ( 2.254 0.149 -1.294) 2.604 40.954 ( -7.083 0.502 -0.800) 7.146 41.723 ( 4.184 0.898 -1.963) 4.708 43.911 ( 2.991 2.528 -10.327) 11.044 ======================= Grid point 115 (52/205) ======================= q-point: ( 0.56 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.704 ( -24.783 3.864 6.485) 25.907 3.128 ( -11.760 -0.367 13.613) 17.993 3.616 ( 4.616 -11.043 4.475) 12.778 4.395 ( -4.409 8.321 -10.020) 13.750 4.572 ( 10.530 14.205 1.879) 17.782 4.827 ( -8.871 7.713 -4.332) 12.528 5.136 ( 1.117 -12.868 -0.553) 12.928 5.277 ( 1.085 -1.128 5.056) 5.292 5.642 ( 2.129 2.563 17.355) 17.672 6.064 ( -4.512 5.085 0.371) 6.808 6.338 ( 3.522 1.695 0.811) 3.992 6.687 ( -4.004 10.448 -9.613) 14.751 6.841 ( -1.067 1.068 0.761) 1.691 6.954 ( 0.909 -9.358 -10.551) 14.132 7.258 ( 7.667 -1.569 8.728) 11.722 7.620 ( 7.850 -15.878 2.573) 17.899 7.832 ( 6.386 4.240 -4.940) 9.119 8.267 ( -2.113 11.542 0.079) 11.735 8.458 ( -1.235 -10.269 -8.092) 13.133 8.642 ( -1.716 -3.128 5.253) 6.350 9.047 ( 0.325 -6.406 0.119) 6.415 9.407 ( 2.444 0.915 -2.414) 3.554 9.784 ( 7.483 1.224 -6.754) 10.154 9.896 ( -0.284 1.927 -2.466) 3.142 10.170 ( -5.070 -0.475 4.112) 6.545 10.380 ( -1.053 -2.060 -3.361) 4.080 10.835 ( 5.189 6.421 -0.217) 8.258 11.037 ( -4.576 6.142 -0.057) 7.659 11.148 ( -5.411 0.400 -0.300) 5.435 11.352 ( 7.242 -8.748 8.827) 14.384 11.642 ( -12.963 -2.446 0.046) 13.192 12.181 ( 14.529 0.511 -0.581) 14.550 12.602 ( 6.286 4.226 -0.422) 7.586 12.843 ( -6.263 3.196 -1.913) 7.287 12.970 ( -5.363 -5.799 -0.463) 7.913 13.685 ( -4.362 2.301 0.367) 4.945 13.757 ( -13.530 -4.301 2.447) 14.407 13.934 ( 1.081 2.267 4.737) 5.361 14.301 ( 0.976 3.001 9.798) 10.294 14.383 ( -5.075 4.869 1.477) 7.187 14.808 ( -4.150 0.213 -1.035) 4.282 15.252 ( 12.314 -5.253 -1.712) 13.497 16.063 ( -0.079 -4.367 2.002) 4.805 16.533 ( 13.971 3.789 -9.661) 17.404 16.913 ( 3.144 5.086 -0.629) 6.013 17.084 ( -5.056 7.732 3.911) 10.032 17.775 ( 0.108 -2.248 -2.138) 3.104 17.886 ( 2.770 -7.306 -4.040) 8.796 18.139 ( -10.399 -2.299 5.507) 11.990 18.761 ( 6.168 -2.594 -6.260) 9.163 20.354 ( -2.302 6.428 0.996) 6.900 21.170 ( -0.800 -4.681 -1.167) 4.890 21.497 ( -0.381 -2.741 -0.623) 2.836 21.785 ( -3.534 -0.279 1.928) 4.035 25.007 ( -1.251 -3.668 1.877) 4.306 25.503 ( 3.334 1.369 -2.068) 4.155 28.825 ( -0.450 -2.119 1.322) 2.538 29.123 ( -1.131 1.198 0.148) 1.654 34.640 ( -0.747 6.818 1.921) 7.123 34.778 ( 3.115 4.373 0.151) 5.371 37.652 ( 0.373 -0.163 3.186) 3.212 37.929 ( 2.820 -1.062 -1.837) 3.529 40.226 ( 3.790 -0.027 3.275) 5.009 40.897 ( -2.181 -0.611 -0.096) 2.267 41.703 ( 0.066 3.493 -2.631) 4.373 43.848 ( 2.502 3.912 -11.597) 12.492 ======================= Grid point 116 (53/205) ======================= q-point: (-0.33 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.330 ( -13.875 13.177 9.360) 21.302 3.110 ( -7.415 -5.663 6.098) 11.146 3.825 ( 4.487 -2.852 -3.469) 6.348 4.209 ( 3.335 7.175 -1.878) 8.132 4.281 ( -3.909 20.577 2.332) 21.075 4.810 ( -1.570 -6.825 -0.870) 7.057 5.328 ( 3.043 -3.811 7.175) 8.676 5.425 ( -3.593 -11.822 -1.823) 12.490 5.692 ( 19.448 9.132 4.522) 21.957 5.929 ( -16.544 -11.839 9.568) 22.482 6.215 ( -11.568 12.018 -3.863) 17.122 6.580 ( 15.051 8.113 2.515) 17.282 6.704 ( -1.318 8.680 -0.586) 8.799 7.087 ( -4.790 -11.408 -8.572) 15.052 7.461 ( 9.469 -1.106 5.453) 10.983 7.762 ( 1.975 6.528 -3.758) 7.787 7.919 ( -1.821 -13.674 2.406) 14.003 8.098 ( 2.121 5.988 -0.256) 6.358 8.538 ( -0.215 -4.741 -6.269) 7.863 8.753 ( 1.010 -9.168 0.504) 9.238 9.094 ( 1.281 0.739 -3.797) 4.075 9.340 ( -3.398 4.816 -5.369) 7.973 9.683 ( 1.130 8.033 -3.089) 8.681 9.966 ( 1.128 -2.080 -7.377) 7.747 10.170 ( -3.708 -6.338 3.200) 8.010 10.426 ( -1.147 -5.442 1.169) 5.684 10.810 ( 3.556 4.956 -1.374) 6.252 10.927 ( 0.524 2.895 2.440) 3.822 11.080 ( -5.041 -1.225 -0.004) 5.188 11.540 ( -10.808 -2.686 0.828) 11.168 11.620 ( 6.425 -8.970 5.022) 12.123 12.296 ( 6.625 3.188 6.055) 9.525 12.607 ( -2.222 4.750 -5.589) 7.664 12.692 ( 2.446 3.300 3.287) 5.261 13.026 ( 1.287 -4.623 -1.408) 5.001 13.595 ( -3.804 3.037 -2.319) 5.392 13.691 ( -7.549 -3.371 -2.799) 8.728 13.960 ( 3.089 0.849 8.948) 9.504 14.236 ( -2.736 4.764 5.006) 7.432 14.344 ( 1.978 2.108 5.557) 6.264 14.770 ( -0.854 -0.758 -0.871) 1.436 15.409 ( 3.759 -2.531 -0.194) 4.536 16.131 ( -3.369 -5.784 0.162) 6.696 16.582 ( 11.768 5.284 -5.281) 13.939 16.822 ( -7.458 11.685 0.535) 13.873 16.901 ( 2.756 5.821 1.573) 6.630 17.815 ( -0.951 -4.587 -5.850) 7.495 17.997 ( -3.340 -8.631 -6.113) 11.091 18.127 ( -2.419 -3.451 4.972) 6.518 18.878 ( 8.022 -3.747 -0.191) 8.856 20.227 ( -2.753 6.248 1.904) 7.088 21.230 ( 0.514 -3.578 -1.492) 3.910 21.527 ( -1.219 -2.206 -0.684) 2.611 21.770 ( -1.731 -1.802 -0.770) 2.614 25.064 ( -0.909 -4.156 1.222) 4.426 25.493 ( 1.382 2.634 -1.429) 3.300 28.869 ( 0.149 -2.690 1.971) 3.338 29.091 ( -0.685 1.551 0.341) 1.729 34.505 ( -3.449 7.344 1.135) 8.193 34.717 ( 2.803 8.313 2.029) 9.004 37.656 ( -2.089 -0.323 1.668) 2.692 37.965 ( 1.890 -0.401 -1.033) 2.190 40.288 ( 2.423 -0.125 6.417) 6.860 40.925 ( 2.959 -1.955 0.670) 3.609 41.613 ( -0.814 4.977 -2.347) 5.562 43.755 ( 1.727 4.726 -13.683) 14.579 ======================= Grid point 117 (54/205) ======================= q-point: (-0.22 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.164 ( 11.712 9.695 11.992) 19.364 3.099 ( 2.666 7.008 -0.108) 7.498 3.832 ( -0.713 -0.530 -2.612) 2.759 3.956 ( -2.212 11.713 -2.246) 12.130 4.203 ( 5.429 3.202 -1.673) 6.521 4.923 ( -0.657 -5.374 5.628) 7.810 5.352 ( -10.044 -0.462 1.219) 10.129 5.419 ( 3.081 7.285 13.926) 16.016 5.698 ( -13.322 13.639 3.766) 19.434 6.004 ( 18.045 -10.589 -3.714) 21.250 6.238 ( -4.483 -18.090 5.410) 19.407 6.545 ( 1.596 1.406 1.694) 2.719 6.674 ( 13.110 10.418 4.173) 17.258 7.108 ( -9.570 -5.778 -3.608) 11.747 7.482 ( 5.995 7.645 -3.540) 10.340 7.683 ( -1.346 2.766 -4.671) 5.593 7.935 ( -9.999 -1.548 -4.403) 11.034 8.216 ( 2.459 -11.560 0.960) 11.858 8.593 ( 2.020 -4.593 -5.470) 7.423 8.908 ( 5.165 -3.916 -1.583) 6.672 9.058 ( 3.416 2.873 -6.727) 8.073 9.193 ( -4.573 3.336 -4.747) 7.388 9.536 ( -2.237 8.320 -2.992) 9.120 9.922 ( -1.043 2.977 -4.617) 5.592 10.265 ( -1.575 -6.257 1.263) 6.574 10.499 ( -5.015 -5.989 2.366) 8.162 10.734 ( -0.130 3.948 0.309) 3.962 10.922 ( -8.938 -1.521 2.888) 9.515 11.146 ( 7.341 -6.995 3.230) 10.642 11.504 ( -4.601 -4.510 1.223) 6.558 11.769 ( -2.886 -5.189 -0.522) 5.960 12.236 ( -5.612 7.823 1.391) 9.727 12.445 ( -2.797 3.378 2.242) 4.926 12.850 ( 15.344 -2.804 6.600) 16.936 13.134 ( 8.180 -2.770 -1.876) 8.838 13.485 ( -3.557 2.864 -6.354) 7.825 13.614 ( -5.767 2.638 -2.252) 6.730 14.015 ( 2.968 3.782 9.518) 10.663 14.206 ( 0.397 -0.248 2.239) 2.288 14.379 ( 5.098 -1.445 4.749) 7.115 14.834 ( 5.978 -3.339 2.457) 7.275 15.420 ( -4.101 0.675 1.291) 4.352 16.159 ( -9.270 -6.551 0.764) 11.377 16.456 ( -12.043 15.845 2.434) 20.050 16.628 ( 12.060 6.535 -3.924) 14.267 16.875 ( 2.871 4.067 -1.809) 5.297 17.831 ( -2.978 -3.926 -9.244) 10.476 18.047 ( -4.782 -7.413 -6.042) 10.692 18.192 ( 0.171 -3.631 0.989) 3.768 19.072 ( 9.259 -5.742 5.101) 12.030 20.123 ( -2.531 3.775 4.334) 6.280 21.282 ( 2.442 -1.581 -1.671) 3.355 21.533 ( -1.353 -1.149 -0.760) 1.931 21.795 ( -0.188 -3.347 -3.186) 4.625 25.121 ( -0.498 -3.519 0.436) 3.581 25.439 ( -0.766 4.048 -0.662) 4.173 28.920 ( 0.246 -1.755 2.262) 2.873 29.069 ( 0.077 0.665 0.896) 1.118 34.352 ( -2.781 6.916 -0.506) 7.472 34.606 ( 2.189 10.415 4.744) 11.653 37.627 ( -4.079 -0.314 0.004) 4.091 37.974 ( 0.888 0.836 -1.119) 1.655 40.328 ( -0.333 -0.299 5.962) 5.978 40.993 ( 0.787 -1.103 2.107) 2.505 41.567 ( 7.159 2.565 -0.800) 7.646 43.637 ( 1.325 4.701 -15.782) 16.520 ======================= Grid point 118 (55/205) ======================= q-point: (-0.11 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.320 ( 28.775 12.885 8.641) 32.691 3.028 ( 22.320 14.585 4.350) 27.016 3.725 ( -8.560 2.523 3.748) 9.679 3.955 ( 4.395 -4.199 -5.092) 7.929 4.233 ( 3.296 -3.864 -7.061) 8.698 4.854 ( -1.382 18.330 13.117) 22.582 5.238 ( -4.360 1.473 2.966) 5.475 5.360 ( -1.162 0.219 8.463) 8.545 5.549 ( -14.951 -4.453 9.965) 18.511 6.226 ( 2.353 1.614 2.937) 4.095 6.402 ( 13.224 -2.625 -6.304) 14.883 6.567 ( 3.335 8.431 3.695) 9.790 6.788 ( -5.959 -14.280 0.758) 15.492 7.104 ( 2.271 -3.680 -0.212) 4.329 7.440 ( 4.030 -0.704 -4.301) 5.936 7.561 ( -8.080 2.629 -5.559) 10.154 7.791 ( -8.544 1.087 -6.918) 11.047 8.411 ( -3.238 -12.523 -6.259) 14.370 8.708 ( 6.836 -6.308 -5.132) 10.623 8.952 ( 6.848 2.425 -9.272) 11.779 9.056 ( 5.803 3.674 -1.510) 7.032 9.111 ( -3.659 0.790 -0.040) 3.744 9.364 ( -2.708 7.154 -2.448) 8.031 9.826 ( 0.043 6.464 -3.492) 7.348 10.308 ( -4.058 -1.815 3.067) 5.401 10.495 ( -6.561 -1.746 3.712) 7.738 10.687 ( -3.971 3.057 3.962) 6.388 10.843 ( -14.321 -10.290 0.409) 17.639 11.432 ( 10.550 -10.242 1.951) 14.833 11.580 ( 0.950 -7.430 1.602) 7.660 11.717 ( -8.491 1.475 -1.778) 8.800 12.058 ( -2.866 4.965 -2.248) 6.158 12.410 ( -5.055 0.102 9.514) 10.774 13.121 ( 13.856 -3.402 5.927) 15.449 13.287 ( 11.354 -1.631 -0.180) 11.472 13.377 ( -1.645 3.083 -7.726) 8.479 13.471 ( -4.929 4.117 -2.834) 7.020 13.995 ( 2.802 5.654 7.642) 9.910 14.233 ( 0.745 -1.446 4.998) 5.256 14.550 ( 10.293 -3.874 1.727) 11.133 15.024 ( 10.175 -5.551 4.673) 12.497 15.326 ( -7.948 2.073 1.638) 8.375 16.009 ( -17.223 10.992 1.424) 20.481 16.178 ( -9.715 -2.504 2.158) 10.262 16.654 ( 8.726 5.050 -2.837) 10.473 16.811 ( 4.185 7.156 -3.026) 8.825 17.800 ( -2.557 -1.492 -10.762) 11.162 18.069 ( -4.442 -5.225 -6.596) 9.515 18.253 ( 0.143 -3.862 0.021) 3.865 19.249 ( 3.970 -2.032 3.111) 5.438 20.113 ( -0.984 -2.693 9.187) 9.624 21.319 ( 3.495 0.852 -1.192) 3.790 21.535 ( -0.212 -1.009 -1.557) 1.868 21.832 ( 0.048 -2.754 -3.869) 4.750 25.162 ( 0.226 -1.540 -0.176) 1.567 25.349 ( -2.187 4.327 -0.084) 4.849 28.931 ( -0.289 1.104 1.242) 1.687 29.089 ( 0.565 -1.674 2.225) 2.842 34.235 ( 1.991 5.530 -3.154) 6.670 34.503 ( 2.825 8.428 7.224) 11.454 37.574 ( -4.435 0.272 -0.808) 4.516 37.952 ( 0.412 2.014 -1.992) 2.863 40.340 ( -2.194 -0.981 2.575) 3.522 40.980 ( -3.702 0.288 3.771) 5.293 41.693 ( 13.281 -0.725 -0.433) 13.308 43.538 ( 3.800 2.450 -15.957) 16.585 ======================= Grid point 123 (56/205) ======================= q-point: ( 0.44 0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.678 ( -17.990 -0.000 14.705) 23.235 3.055 ( 1.217 0.000 -4.572) 4.732 3.586 ( -8.577 -0.000 23.016) 24.563 4.562 ( 14.657 0.000 -2.774) 14.917 4.667 ( -10.722 -0.000 -6.847) 12.722 4.814 ( -4.459 -0.000 -3.762) 5.834 5.232 ( -14.136 -0.000 -2.406) 14.339 5.328 ( -13.490 -0.000 -18.746) 23.096 5.821 ( 9.490 0.000 1.651) 9.633 5.885 ( 12.473 0.000 28.256) 30.886 6.182 ( -2.040 -0.000 12.538) 12.703 6.823 ( -2.899 -0.000 -6.825) 7.415 7.022 ( 12.129 0.000 -1.253) 12.194 7.058 ( 2.951 0.000 -5.395) 6.149 7.177 ( 1.565 0.000 -9.608) 9.734 7.303 ( -0.992 -0.000 1.374) 1.694 7.822 ( 14.954 0.000 -1.537) 15.032 8.250 ( -2.134 -0.000 -0.066) 2.135 8.493 ( -1.583 -0.000 3.267) 3.631 8.643 ( 1.500 0.000 2.155) 2.626 8.825 ( -4.776 -0.000 2.496) 5.388 9.421 ( 2.140 0.000 -0.886) 2.316 9.640 ( 5.051 0.000 -1.834) 5.374 10.108 ( -7.233 -0.000 -7.252) 10.242 10.218 ( 3.659 0.000 8.168) 8.951 10.303 ( -2.939 -0.000 -14.332) 14.630 10.964 ( -1.571 -0.000 6.102) 6.301 11.143 ( -1.736 -0.000 -3.283) 3.713 11.196 ( 8.621 0.000 10.668) 13.716 11.206 ( -3.448 -0.000 -1.299) 3.684 11.549 ( -14.760 -0.000 -2.064) 14.904 12.189 ( 16.671 0.000 -2.495) 16.856 12.677 ( -2.131 -0.000 4.813) 5.264 12.860 ( 3.850 0.000 -13.042) 13.599 12.895 ( -7.717 -0.000 5.143) 9.274 13.682 ( -11.886 -0.000 6.358) 13.479 13.746 ( -3.588 -0.000 -0.421) 3.613 13.967 ( 0.613 0.000 4.269) 4.312 14.344 ( 0.645 0.000 9.012) 9.035 14.482 ( -7.380 -0.000 2.670) 7.848 14.812 ( -4.095 -0.000 -1.365) 4.316 15.141 ( 13.524 0.000 -1.294) 13.586 15.984 ( -1.594 -0.000 2.337) 2.829 16.587 ( 15.309 0.000 -12.350) 19.669 17.020 ( 2.495 0.000 -0.238) 2.506 17.205 ( -1.945 -0.000 5.207) 5.558 17.753 ( 3.432 0.000 -3.305) 4.765 17.761 ( -3.970 -0.000 1.072) 4.112 18.097 ( -10.866 -0.000 3.812) 11.516 18.714 ( 7.605 0.000 -8.417) 11.344 20.481 ( -1.843 -0.000 -1.450) 2.345 21.069 ( -0.615 -0.000 -0.660) 0.902 21.446 ( -0.396 -0.000 -0.398) 0.561 21.783 ( -4.313 -0.000 3.074) 5.297 24.942 ( -1.317 -0.000 2.245) 2.603 25.521 ( 3.309 0.000 -2.130) 3.936 28.790 ( -0.520 -0.000 1.142) 1.255 29.142 ( -0.890 -0.000 -0.441) 0.993 34.773 ( -4.509 -0.000 4.047) 6.059 34.831 ( 8.111 0.000 -2.677) 8.541 37.652 ( 0.504 0.000 3.651) 3.686 37.909 ( 3.405 0.000 -1.707) 3.809 40.233 ( 4.880 0.000 2.950) 5.702 40.888 ( -4.242 -0.000 1.277) 4.430 41.761 ( 2.004 0.000 -4.057) 4.525 43.915 ( 2.033 0.000 -11.619) 11.795 ======================= Grid point 124 (57/205) ======================= q-point: (-0.44 -0.56 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.582 ( -5.365 2.447 9.254) 10.973 3.085 ( -5.278 0.697 3.286) 6.256 3.571 ( -0.334 -4.543 18.776) 19.321 4.418 ( -5.839 5.959 -16.919) 18.864 4.632 ( -5.770 -3.176 -4.055) 7.735 4.882 ( -13.113 12.267 -9.690) 20.404 4.983 ( 9.160 -12.913 -3.968) 16.322 5.231 ( -4.179 -4.960 -0.391) 6.497 5.830 ( 2.783 18.987 24.753) 31.321 6.060 ( 3.301 -14.058 2.644) 14.680 6.305 ( -6.033 10.789 -2.990) 12.718 6.745 ( 5.419 -6.894 0.559) 8.787 6.910 ( 4.587 4.824 -4.932) 8.285 7.088 ( 7.190 14.629 4.746) 16.978 7.295 ( 1.788 -5.841 0.264) 6.114 7.464 ( 7.628 -13.318 4.433) 15.975 7.932 ( 3.338 0.858 -3.577) 4.968 8.246 ( -4.980 -5.849 -5.419) 9.401 8.408 ( -0.845 8.010 2.101) 8.324 8.656 ( 1.025 1.012 4.945) 5.150 8.908 ( -0.779 -10.186 2.735) 10.576 9.422 ( -0.488 0.757 -2.581) 2.733 9.746 ( 4.646 -6.193 -0.881) 7.792 9.950 ( -7.129 4.707 -8.367) 11.958 10.156 ( -1.569 4.147 -5.632) 7.167 10.309 ( -0.537 -2.402 -2.097) 3.234 10.929 ( -2.719 2.474 2.135) 4.251 11.092 ( -2.044 2.262 -2.888) 4.199 11.120 ( 0.174 5.601 -0.859) 5.669 11.373 ( 3.360 -4.063 10.760) 11.982 11.439 ( -6.419 -5.502 -4.753) 9.699 12.359 ( 10.199 1.193 6.025) 11.906 12.672 ( -1.127 -0.030 1.898) 2.208 12.799 ( -6.632 1.993 0.465) 6.941 12.904 ( 8.939 -2.272 -10.253) 13.791 13.580 ( -9.922 -1.304 3.003) 10.448 13.705 ( 0.056 2.402 0.410) 2.437 14.002 ( 2.301 0.763 6.658) 7.086 14.373 ( -3.546 2.277 9.365) 10.269 14.409 ( 0.747 1.808 2.088) 2.861 14.753 ( -3.989 -0.260 -3.553) 5.348 15.283 ( 4.990 -3.574 0.496) 6.158 15.982 ( -3.494 -2.751 -0.045) 4.448 16.696 ( 12.247 1.794 -9.027) 15.319 17.011 ( 1.054 3.367 0.770) 3.611 17.153 ( -4.208 4.909 6.318) 9.040 17.734 ( -1.449 -0.759 -1.217) 2.039 17.781 ( -1.694 -4.076 -4.403) 6.235 18.042 ( -2.860 -1.677 3.053) 4.506 18.786 ( 6.846 -1.679 -5.010) 8.648 20.413 ( -2.093 4.297 -2.420) 5.358 21.095 ( 0.349 -3.606 -0.955) 3.747 21.451 ( -0.723 -1.708 -0.961) 2.089 21.745 ( -3.688 -0.191 1.437) 3.963 24.954 ( -1.026 -2.113 1.903) 3.023 25.538 ( 1.456 0.505 -1.628) 2.242 28.802 ( 0.052 -1.226 1.498) 1.937 29.128 ( -0.391 0.630 -0.611) 0.960 34.688 ( -5.796 3.462 0.302) 6.758 34.899 ( 6.665 2.852 1.806) 7.471 37.656 ( -1.803 0.157 2.931) 3.445 37.948 ( 2.924 -0.426 -0.187) 2.961 40.314 ( 5.596 0.960 8.031) 9.835 40.878 ( 0.784 -0.829 2.038) 2.336 41.729 ( -1.289 2.033 -5.695) 6.183 43.871 ( 1.628 2.137 -13.237) 13.507 ======================= Grid point 125 (58/205) ======================= q-point: (-0.33 -0.56 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.480 ( 2.409 10.721 0.849) 11.021 3.004 ( -4.288 -3.005 7.992) 9.555 3.849 ( 8.737 -5.275 8.645) 13.375 4.320 ( 7.574 -1.904 -8.940) 11.871 4.485 ( -11.535 13.616 -2.799) 18.063 4.570 ( -13.485 -7.377 -8.258) 17.449 5.277 ( -1.679 -10.458 0.109) 10.593 5.358 ( 14.227 -6.260 2.128) 15.688 5.663 ( -11.027 5.243 16.389) 20.438 5.981 ( -4.253 11.377 -2.353) 12.372 6.236 ( -1.450 1.012 2.171) 2.800 6.673 ( 3.749 1.730 -7.381) 8.457 6.893 ( 2.660 15.182 3.491) 15.804 7.153 ( 13.111 3.258 3.882) 14.056 7.473 ( 2.129 -12.836 9.352) 16.024 7.702 ( -2.687 -8.162 4.218) 9.572 7.870 ( 0.582 6.096 -3.597) 7.102 8.211 ( -3.889 1.843 -2.868) 5.172 8.369 ( 0.919 -6.024 -8.233) 10.242 8.699 ( 3.040 -1.794 6.047) 7.002 9.054 ( 0.549 -5.979 -0.019) 6.004 9.347 ( -3.520 3.973 -4.492) 6.954 9.749 ( -6.833 5.560 -6.478) 10.935 9.906 ( 4.115 -7.489 -4.592) 9.701 10.063 ( -4.270 0.875 -2.552) 5.051 10.329 ( -1.220 -3.245 -1.763) 3.889 10.856 ( -3.098 2.592 0.416) 4.061 10.994 ( -5.580 3.113 -1.541) 6.573 11.099 ( 9.360 3.980 1.766) 10.323 11.367 ( -9.205 -4.314 3.081) 10.622 11.593 ( 6.544 -5.749 -1.110) 8.781 12.412 ( -1.216 3.288 8.067) 8.796 12.559 ( -9.808 2.863 -2.560) 10.533 12.808 ( 8.539 -0.252 2.952) 9.039 13.050 ( 12.011 -2.577 -4.352) 13.033 13.513 ( -6.037 -1.743 -2.803) 6.880 13.675 ( 1.038 3.384 2.365) 4.258 14.056 ( 5.326 0.957 6.964) 8.819 14.302 ( -0.320 4.029 2.984) 5.023 14.422 ( 1.055 2.334 5.737) 6.282 14.730 ( -0.197 -2.898 -2.716) 3.977 15.355 ( -4.887 -4.139 2.672) 6.939 15.973 ( -7.446 -4.181 -2.280) 8.838 16.738 ( 5.917 3.923 -3.478) 7.906 16.927 ( -2.261 8.085 -1.152) 8.474 17.037 ( -0.383 6.470 6.290) 9.032 17.738 ( 0.754 -1.758 -5.518) 5.840 17.814 ( -3.798 -6.283 -3.638) 8.194 18.089 ( 2.361 -2.711 1.180) 3.783 18.899 ( 6.376 -4.356 0.162) 7.723 20.291 ( -2.773 5.852 -2.080) 6.802 21.173 ( 2.081 -4.742 -1.582) 5.415 21.470 ( -1.172 -2.436 -1.206) 2.959 21.721 ( -2.142 -1.181 -0.668) 2.536 24.996 ( -0.674 -3.577 1.287) 3.861 25.524 ( -0.531 1.366 -1.019) 1.785 28.841 ( 0.551 -2.322 2.050) 3.146 29.109 ( 0.088 1.203 -0.548) 1.325 34.545 ( -5.912 4.823 -2.233) 7.950 34.904 ( 5.085 7.324 5.679) 10.571 37.628 ( -3.622 0.342 1.829) 4.072 37.984 ( 1.968 -0.082 0.856) 2.147 40.378 ( 3.272 2.706 10.821) 11.624 40.945 ( 4.556 -1.559 2.284) 5.330 41.647 ( -0.997 2.108 -5.757) 6.211 43.781 ( 0.831 3.934 -15.209) 15.732 ======================= Grid point 126 (59/205) ======================= q-point: (-0.22 -0.56 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.448 ( 12.366 1.365 2.681) 12.727 3.140 ( 6.309 -6.160 3.602) 9.525 3.886 ( 4.269 6.231 -2.203) 7.868 4.139 ( -3.557 15.392 -3.500) 16.181 4.400 ( 8.939 6.307 -7.988) 13.545 4.666 ( -7.687 -18.461 4.390) 20.474 5.373 ( -2.570 9.839 3.810) 10.859 5.382 ( -9.919 -8.307 5.888) 14.215 5.667 ( -10.452 1.813 8.342) 13.495 5.884 ( -5.266 -12.917 8.620) 16.398 6.179 ( 12.321 1.809 -2.538) 12.709 6.716 ( 4.650 12.353 4.168) 13.842 6.819 ( 4.469 -10.054 -3.124) 11.438 7.115 ( 2.807 12.420 1.857) 12.868 7.646 ( 0.214 1.713 -0.456) 1.785 7.689 ( -1.388 5.397 -0.535) 5.598 7.779 ( -6.426 -3.234 -1.452) 7.339 8.154 ( 1.512 1.498 -0.570) 2.204 8.483 ( 2.021 -9.256 -9.908) 13.709 8.859 ( 6.536 -7.779 3.761) 10.834 9.088 ( 1.071 1.253 -7.178) 7.365 9.216 ( -1.796 4.854 -0.362) 5.189 9.572 ( -6.927 4.371 -4.050) 9.137 9.949 ( 1.264 2.231 -6.736) 7.207 10.094 ( -4.206 -10.544 2.430) 11.609 10.371 ( -1.906 -4.526 -1.211) 5.058 10.757 ( -5.173 4.335 -0.580) 6.774 10.859 ( -7.845 4.635 3.498) 9.760 11.215 ( 11.755 -1.365 2.400) 12.075 11.382 ( -2.303 -5.772 1.071) 6.307 11.695 ( 1.629 -2.137 -3.596) 4.489 12.240 ( -10.438 5.452 -4.454) 12.590 12.485 ( -2.966 2.532 8.541) 9.389 12.977 ( 10.974 -3.838 6.330) 13.237 13.209 ( 10.273 -2.321 -0.003) 10.532 13.458 ( -1.817 0.219 -7.327) 7.552 13.609 ( -3.581 4.887 2.107) 6.414 14.126 ( 3.727 2.705 3.198) 5.607 14.281 ( 4.277 3.206 4.959) 7.291 14.457 ( 8.128 -0.885 3.248) 8.797 14.833 ( 5.408 -6.319 1.144) 8.396 15.318 ( -12.005 -2.638 3.713) 12.840 15.908 ( -13.916 -4.747 -3.171) 15.041 16.581 ( -9.689 14.245 4.768) 17.875 16.808 ( 5.850 4.719 -6.880) 10.190 16.990 ( 1.805 4.568 4.096) 6.395 17.757 ( 2.899 -0.934 -7.948) 8.511 17.862 ( -3.581 -6.939 -3.802) 8.685 18.166 ( 3.552 -1.989 -0.875) 4.164 19.078 ( 6.040 -7.039 4.558) 10.335 20.164 ( -3.197 4.521 -0.226) 5.542 21.274 ( 4.290 -3.812 -1.570) 5.950 21.486 ( -1.237 -2.095 -1.412) 2.813 21.731 ( -0.483 -2.785 -2.707) 3.913 25.057 ( -0.081 -4.082 0.445) 4.107 25.473 ( -2.277 2.708 -0.324) 3.553 28.898 ( 0.556 -2.597 2.477) 3.632 29.089 ( 0.377 1.289 -0.187) 1.356 34.397 ( -4.060 4.461 -3.690) 7.071 34.830 ( 2.528 11.018 8.609) 14.209 37.581 ( -4.066 0.369 0.896) 4.180 37.998 ( 0.944 0.907 0.819) 1.544 40.388 ( 0.655 3.752 9.112) 9.876 40.994 ( -0.888 0.475 1.992) 2.232 41.656 ( 7.446 -1.635 -3.196) 8.267 43.653 ( 0.162 4.438 -16.588) 17.172 ======================= Grid point 127 (60/205) ======================= q-point: (-0.11 0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.732 ( 20.902 -5.284 5.207) 22.179 3.299 ( 7.922 -2.187 3.949) 9.118 3.856 ( 6.534 3.748 -2.724) 8.010 3.930 ( 5.160 9.356 0.058) 10.685 4.361 ( 11.223 8.526 -10.785) 17.747 4.781 ( -13.074 -10.325 2.915) 16.913 5.190 ( -21.571 -1.230 9.491) 23.599 5.271 ( -13.830 5.370 8.621) 17.159 5.513 ( -3.081 4.506 8.089) 9.759 6.218 ( 3.432 -17.891 3.898) 18.630 6.388 ( 10.568 -7.266 -0.817) 12.851 6.652 ( 3.704 3.964 4.053) 6.772 6.871 ( -3.057 18.165 0.750) 18.436 7.037 ( 5.939 -10.426 -0.572) 12.012 7.495 ( -2.904 9.245 -5.058) 10.931 7.545 ( -4.645 2.950 -5.333) 7.663 7.761 ( 0.487 3.777 -2.044) 4.322 8.192 ( 0.387 -4.570 -3.015) 5.489 8.637 ( 6.070 -9.313 -8.972) 14.285 8.990 ( 1.819 2.820 -10.513) 11.035 9.062 ( 2.708 -3.551 -0.006) 4.465 9.199 ( 5.092 1.596 5.204) 7.454 9.404 ( -5.953 5.367 -2.255) 8.326 9.911 ( 1.954 3.022 -2.501) 4.382 10.210 ( -4.246 -7.619 2.080) 8.967 10.398 ( -4.143 -2.806 1.712) 5.288 10.606 ( -9.234 1.595 -1.151) 9.441 10.711 ( -5.231 4.281 3.799) 7.754 11.399 ( 5.597 -5.608 -0.756) 7.959 11.497 ( 4.515 -6.548 -0.320) 7.960 11.691 ( 0.853 1.481 -1.207) 2.093 12.064 ( -4.890 2.270 -4.856) 7.256 12.404 ( -7.921 3.763 9.768) 13.127 13.194 ( 5.876 -4.941 5.687) 9.554 13.367 ( 6.793 -2.427 4.511) 8.508 13.433 ( 5.624 3.502 -5.610) 8.681 13.468 ( -3.323 2.955 -2.807) 5.259 14.078 ( -1.455 3.150 0.646) 3.529 14.333 ( 6.480 2.802 9.004) 11.441 14.631 ( 10.337 -2.513 0.457) 10.648 15.044 ( 6.673 -7.104 2.755) 10.128 15.225 ( -8.436 -2.443 3.419) 9.424 15.764 ( -20.039 -3.713 -2.764) 20.567 16.228 ( -9.766 14.290 3.149) 17.592 16.790 ( 4.583 3.183 -4.987) 7.484 16.957 ( 2.806 4.236 2.177) 5.528 17.765 ( 3.822 1.023 -8.139) 9.050 17.911 ( -2.784 -5.650 -3.952) 7.435 18.226 ( 3.296 -1.331 -1.749) 3.961 19.243 ( 1.479 -3.929 3.240) 5.303 20.098 ( -2.387 -0.305 4.055) 4.716 21.363 ( 3.731 -0.771 0.233) 3.817 21.505 ( 0.813 -2.017 -2.555) 3.355 21.771 ( 0.536 -3.580 -3.619) 5.119 25.124 ( 1.020 -3.625 -0.467) 3.795 25.385 ( -3.230 3.943 0.328) 5.108 28.940 ( -0.106 -0.653 1.842) 1.957 29.084 ( 0.314 -0.261 0.970) 1.052 34.297 ( -0.065 2.481 -4.726) 5.338 34.703 ( 0.163 10.497 10.065) 14.544 37.537 ( -2.631 0.363 0.779) 2.767 37.984 ( 0.394 1.961 -0.307) 2.024 40.351 ( -1.460 3.453 4.243) 5.662 40.953 ( -4.061 0.353 3.127) 5.137 41.798 ( 9.327 -2.185 -2.828) 9.988 43.544 ( 2.258 1.840 -15.287) 15.562 ======================= Grid point 133 (61/205) ======================= q-point: (-0.44 -0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.712 ( 10.055 0.000 16.290) 19.144 3.007 ( -11.897 -0.000 -5.042) 12.921 3.587 ( 0.393 0.000 21.171) 21.175 4.321 ( -1.042 -0.000 -21.150) 21.175 4.380 ( -18.316 -0.000 -15.633) 24.080 4.794 ( -15.821 -0.000 -7.498) 17.508 5.068 ( 19.309 0.000 3.476) 19.619 5.107 ( -0.578 -0.000 -2.787) 2.846 5.962 ( -2.137 -0.000 7.252) 7.560 6.268 ( -6.435 -0.000 -1.606) 6.632 6.373 ( 10.037 0.000 16.405) 19.232 6.654 ( 9.556 0.000 16.608) 19.161 7.097 ( 1.834 0.000 -9.036) 9.220 7.133 ( 2.197 0.000 -11.544) 11.752 7.292 ( -3.587 -0.000 7.005) 7.870 7.517 ( 15.422 0.000 9.530) 18.128 7.875 ( -9.236 -0.000 -0.451) 9.247 8.139 ( -5.294 -0.000 -3.196) 6.184 8.502 ( 0.887 0.000 2.819) 2.955 8.682 ( -0.087 -0.000 2.898) 2.899 8.823 ( 2.432 0.000 3.226) 4.040 9.403 ( -2.181 -0.000 -1.693) 2.761 9.745 ( 2.944 0.000 2.817) 4.074 9.844 ( -8.704 -0.000 -10.135) 13.359 10.104 ( -2.773 -0.000 -17.366) 17.585 10.331 ( 2.695 0.000 3.755) 4.622 10.897 ( -6.666 -0.000 1.169) 6.767 11.059 ( -1.545 -0.000 -5.838) 6.039 11.229 ( 5.811 0.000 0.337) 5.821 11.250 ( -9.608 -0.000 3.325) 10.167 11.468 ( 10.190 0.000 -0.271) 10.194 12.480 ( 2.269 0.000 10.459) 10.702 12.586 ( -12.431 -0.000 -1.274) 12.496 12.810 ( 4.763 0.000 2.703) 5.477 12.991 ( 14.937 0.000 -11.152) 18.641 13.486 ( -6.988 -0.000 2.850) 7.546 13.748 ( 2.270 0.000 2.143) 3.122 14.073 ( 4.478 0.000 7.386) 8.637 14.380 ( -1.536 -0.000 4.173) 4.447 14.465 ( 2.526 0.000 5.560) 6.107 14.680 ( -3.882 -0.000 -6.741) 7.779 15.262 ( -5.055 -0.000 3.670) 6.246 15.908 ( -4.915 -0.000 -1.712) 5.205 16.800 ( 7.859 0.000 -6.452) 10.168 17.042 ( -0.957 -0.000 1.058) 1.427 17.174 ( -4.117 -0.000 7.658) 8.695 17.698 ( -3.059 -0.000 -4.451) 5.401 17.721 ( 0.822 0.000 -0.421) 0.924 18.041 ( 3.606 0.000 -0.488) 3.639 18.826 ( 5.098 0.000 -2.800) 5.816 20.410 ( -2.073 -0.000 -5.222) 5.618 21.068 ( 1.083 0.000 -0.908) 1.413 21.423 ( -0.903 -0.000 -1.062) 1.395 21.706 ( -3.120 -0.000 0.098) 3.121 24.933 ( -0.731 -0.000 1.711) 1.860 25.542 ( -0.494 -0.000 -1.082) 1.189 28.801 ( 0.503 0.000 1.702) 1.775 29.129 ( 0.289 0.000 -1.102) 1.139 34.627 ( -7.581 -0.000 -3.249) 8.248 35.025 ( 7.508 0.000 6.697) 10.061 37.637 ( -3.515 -0.000 2.592) 4.367 37.980 ( 2.320 0.000 1.869) 2.979 40.434 ( 5.175 0.000 13.442) 14.404 40.917 ( 5.836 0.000 2.323) 6.281 41.683 ( -4.192 -0.000 -8.432) 9.416 43.850 ( 1.388 0.000 -15.335) 15.398 ======================= Grid point 134 (62/205) ======================= q-point: (-0.33 -0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.637 ( -14.701 9.039 -5.754) 18.191 2.955 ( 5.078 -3.156 9.485) 11.212 3.869 ( 9.008 -14.355 20.339) 26.474 4.131 ( -18.620 -6.136 -18.655) 27.062 4.349 ( 12.059 -3.916 -16.329) 20.673 4.525 ( -10.074 8.150 -4.080) 13.585 5.130 ( 0.144 -3.348 -2.667) 4.283 5.373 ( 10.329 -7.420 8.053) 15.053 5.864 ( -5.077 13.448 3.170) 14.720 6.128 ( -1.622 5.517 4.894) 7.552 6.295 ( 5.907 12.825 8.205) 16.331 6.823 ( -5.323 12.466 -5.712) 14.709 7.088 ( 1.495 0.439 10.688) 10.801 7.212 ( -0.964 -18.593 5.402) 19.386 7.310 ( 5.322 -0.173 0.505) 5.349 7.659 ( -0.304 1.360 5.591) 5.762 7.857 ( -0.840 -8.998 -4.520) 10.104 8.061 ( -3.139 1.336 -0.498) 3.447 8.441 ( 2.320 6.692 -0.642) 7.112 8.748 ( 2.691 -2.495 5.506) 6.617 8.947 ( 3.272 -8.186 0.912) 8.863 9.354 ( -1.822 2.566 -1.555) 3.511 9.677 ( -8.619 2.692 -10.247) 13.657 9.820 ( 0.364 -4.636 3.140) 5.611 10.005 ( -2.392 0.069 -16.755) 16.925 10.346 ( 2.748 3.139 2.537) 4.883 10.822 ( -5.489 -0.838 -0.741) 5.601 10.998 ( -1.814 3.720 -1.249) 4.323 11.212 ( -5.849 -4.381 3.023) 7.908 11.285 ( 9.227 3.364 0.804) 9.854 11.610 ( 10.533 -2.529 -4.891) 11.886 12.376 ( -14.440 2.873 -5.338) 15.660 12.518 ( -3.022 0.060 10.164) 10.604 12.914 ( 8.312 -0.708 5.106) 9.781 13.134 ( 10.364 -2.316 -5.390) 11.909 13.427 ( -4.866 -0.456 0.842) 4.959 13.758 ( 0.793 3.134 3.821) 5.005 14.173 ( 8.223 0.375 6.059) 10.221 14.388 ( 4.784 2.642 1.241) 5.604 14.488 ( 1.188 2.116 3.754) 4.470 14.653 ( -0.051 -4.369 -5.252) 6.832 15.195 ( -13.864 -3.404 6.073) 15.514 15.836 ( -7.061 -0.462 -3.620) 7.949 16.827 ( 2.485 2.203 -1.981) 3.867 16.987 ( -4.314 4.231 -0.411) 6.056 17.118 ( -4.590 3.393 7.471) 9.402 17.680 ( -1.252 -3.185 -3.937) 5.216 17.753 ( 4.667 -0.031 -1.375) 4.865 18.112 ( 7.442 -1.215 -2.764) 8.031 18.897 ( 3.742 -3.368 0.635) 5.074 20.324 ( -2.727 4.107 -6.329) 8.022 21.119 ( 2.437 -4.333 -1.552) 5.208 21.420 ( -1.013 -1.466 -1.014) 2.050 21.677 ( -2.062 -0.730 -1.514) 2.661 24.950 ( -0.332 -2.055 1.251) 2.429 25.519 ( -2.140 0.513 -0.504) 2.258 28.827 ( 0.755 -1.356 2.046) 2.568 29.125 ( 0.623 0.651 -1.269) 1.556 34.501 ( -7.629 1.824 -5.447) 9.550 35.111 ( 7.140 5.324 11.616) 14.637 37.596 ( -4.312 0.392 2.142) 4.830 38.012 ( 1.248 0.092 3.443) 3.663 40.517 ( 2.556 2.955 15.736) 16.214 41.018 ( 8.233 0.905 1.857) 8.488 41.597 ( -3.567 -1.593 -8.872) 9.694 43.777 ( 0.727 2.558 -17.994) 18.189 ======================= Grid point 135 (63/205) ======================= q-point: (-0.22 -0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.428 ( -9.965 -7.981 -3.060) 13.128 3.113 ( 1.464 -7.501 3.884) 8.573 3.987 ( -6.133 -3.234 -14.536) 16.105 4.223 ( 7.239 -8.141 4.131) 11.651 4.283 ( -2.762 6.768 -0.661) 7.339 4.632 ( 16.674 -8.014 -3.729) 18.872 5.125 ( -11.274 -2.220 -2.030) 11.669 5.355 ( -20.900 4.598 10.316) 23.756 5.775 ( 12.549 4.035 5.578) 14.314 5.930 ( -4.709 18.148 12.981) 22.804 6.263 ( 4.650 -1.504 -2.458) 5.471 6.719 ( -2.696 -6.251 0.608) 6.835 6.986 ( 4.352 11.019 4.382) 12.632 7.202 ( -8.764 4.121 -0.165) 9.686 7.571 ( -2.086 -6.429 1.021) 6.836 7.637 ( 1.663 -2.220 7.159) 7.678 7.929 ( 5.740 8.431 -5.278) 11.484 8.071 ( 0.246 -9.583 -6.247) 11.442 8.421 ( 6.014 0.186 -2.144) 6.388 8.876 ( 6.250 -4.581 6.887) 10.367 9.085 ( 3.188 -2.357 -2.187) 4.528 9.279 ( 0.368 4.320 -0.241) 4.342 9.496 ( -8.705 1.990 -6.743) 11.189 9.910 ( -3.634 -7.238 4.262) 9.152 9.923 ( -0.813 -0.934 -14.524) 14.577 10.347 ( 2.639 1.397 1.447) 3.318 10.770 ( -3.073 1.803 -1.197) 3.758 10.881 ( -5.607 6.719 4.708) 9.937 11.259 ( -0.442 -5.908 1.119) 6.029 11.373 ( 10.609 0.995 -0.208) 10.657 11.724 ( 9.294 0.484 -6.564) 11.389 12.136 ( -12.693 2.333 -8.233) 15.308 12.505 ( -5.567 1.325 10.269) 11.756 13.048 ( 5.961 -2.735 6.265) 9.070 13.267 ( 6.248 -4.317 -0.229) 7.598 13.394 ( -2.558 -1.259 -1.283) 3.127 13.684 ( -2.872 6.504 4.098) 8.206 14.227 ( 2.607 5.042 -1.549) 5.884 14.416 ( 6.511 2.309 5.265) 8.686 14.562 ( 11.299 -1.534 1.222) 11.468 14.772 ( 4.273 -8.525 -0.474) 9.548 15.103 ( -15.666 -4.890 6.363) 17.602 15.709 ( -11.050 0.944 -5.420) 12.344 16.710 ( -9.306 13.025 5.798) 17.025 16.848 ( -1.888 1.072 -6.968) 7.298 17.047 ( -5.072 1.817 5.956) 8.031 17.735 ( 1.671 -4.793 -2.471) 5.646 17.807 ( 7.711 1.478 -3.726) 8.691 18.210 ( 8.126 -0.228 -3.307) 8.776 19.038 ( 3.955 -7.235 3.758) 9.061 20.186 ( -3.876 4.722 -5.145) 7.987 21.244 ( 4.901 -6.253 -1.619) 8.108 21.434 ( -0.835 -2.117 -1.274) 2.608 21.672 ( -0.942 -2.140 -3.082) 3.868 24.998 ( 0.339 -3.579 0.526) 3.633 25.471 ( -3.263 1.429 0.048) 3.562 28.874 ( 0.559 -2.325 2.402) 3.390 29.112 ( 0.506 1.155 -1.074) 1.657 34.365 ( -5.952 1.685 -6.164) 8.733 35.093 ( 3.602 12.210 15.244) 19.860 37.548 ( -3.454 0.369 1.805) 3.914 38.028 ( 0.154 0.818 3.676) 3.769 40.523 ( 0.789 6.023 12.952) 14.306 41.014 ( -1.621 4.331 -1.194) 4.776 41.658 ( 6.372 -6.680 -4.087) 10.096 43.649 ( -0.218 3.964 -19.963) 20.354 ======================= Grid point 136 (64/205) ======================= q-point: (-0.11 -0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.643 ( 0.427 -22.546 5.969) 23.327 3.257 ( -3.237 -12.100 -0.735) 12.547 3.921 ( 1.078 4.893 -7.736) 9.217 4.198 ( 6.772 0.171 -2.847) 7.348 4.477 ( 12.494 -1.694 1.141) 12.660 4.633 ( -18.999 8.012 -1.554) 20.678 4.904 ( -15.142 0.514 7.040) 16.706 5.183 ( -12.391 -0.821 4.289) 13.138 5.628 ( -4.177 12.378 8.342) 15.500 6.028 ( 9.476 -12.265 3.496) 15.889 6.377 ( 3.614 -5.194 3.070) 7.032 6.782 ( -6.372 -1.636 -0.202) 6.582 6.962 ( 7.352 4.467 -1.913) 8.813 7.012 ( -3.605 5.131 5.645) 8.437 7.524 ( -2.660 0.936 -3.497) 4.492 7.643 ( -0.953 12.342 -6.718) 14.085 7.823 ( 5.280 4.266 5.387) 8.666 8.227 ( 7.796 -5.061 -7.340) 11.843 8.536 ( 7.801 -5.234 -6.464) 11.403 9.020 ( 1.150 0.664 -5.352) 5.514 9.071 ( 2.601 1.984 -0.662) 3.338 9.278 ( 4.589 -1.334 5.678) 7.421 9.378 ( -5.591 1.235 0.244) 5.731 9.919 ( 2.004 -3.020 -5.402) 6.505 10.011 ( -4.232 -9.320 2.737) 10.596 10.356 ( -0.196 0.910 0.058) 0.933 10.661 ( -0.089 9.061 1.632) 9.207 10.727 ( -5.388 3.994 2.249) 7.074 11.376 ( 3.460 -4.061 -0.959) 5.421 11.486 ( 6.977 -3.042 -2.157) 7.911 11.772 ( 7.980 3.057 -2.460) 8.893 11.970 ( -8.166 -0.709 -7.875) 11.367 12.406 ( -9.274 4.219 9.144) 13.690 13.179 ( 1.125 -4.275 3.028) 5.359 13.402 ( 2.598 -2.899 4.729) 6.125 13.442 ( 4.304 -5.832 -1.115) 7.333 13.539 ( -2.731 7.290 3.013) 8.348 14.129 ( -0.208 5.839 -2.088) 6.205 14.450 ( -3.468 1.916 9.066) 9.894 14.700 ( 6.459 -0.475 -1.001) 6.553 14.965 ( 0.564 -6.930 -0.579) 6.977 15.135 ( 4.755 -8.194 5.610) 11.010 15.527 ( -11.089 0.270 -6.021) 12.621 16.340 ( -13.653 14.912 2.690) 20.396 16.816 ( -0.351 -0.204 -4.344) 4.363 16.984 ( -6.263 -0.102 3.729) 7.290 17.833 ( 4.097 -2.360 0.865) 4.806 17.853 ( 9.448 2.249 -7.159) 12.065 18.274 ( 6.080 1.186 -2.334) 6.619 19.197 ( 1.237 -4.978 2.053) 5.525 20.073 ( -3.971 0.995 -0.602) 4.138 21.376 ( 1.956 -2.529 1.942) 3.741 21.477 ( 4.015 -3.598 -3.522) 6.440 21.700 ( 0.207 -3.961 -4.467) 5.973 25.073 ( 1.484 -4.367 -0.365) 4.627 25.398 ( -3.644 2.644 0.516) 4.531 28.924 ( -0.131 -2.025 2.313) 3.077 29.094 ( 0.007 0.969 -0.348) 1.030 34.275 ( -2.740 -0.211 -5.858) 6.471 34.933 ( -3.041 15.014 15.769) 21.984 37.528 ( -0.585 0.037 2.045) 2.127 38.018 ( -0.410 1.740 2.302) 2.914 40.445 ( -1.342 7.723 5.811) 9.758 40.922 ( -4.087 0.859 1.131) 4.327 41.820 ( 5.117 -3.984 -3.891) 7.563 43.528 ( 1.701 1.268 -18.159) 18.283 ======================= Grid point 143 (65/205) ======================= q-point: (-0.33 -0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.288 ( -36.162 -0.000 -14.296) 38.885 3.003 ( -12.136 -0.000 0.109) 12.137 3.855 ( 1.544 0.000 -12.573) 12.668 3.895 ( 5.629 0.000 20.767) 21.516 4.461 ( -9.189 -0.000 -0.166) 9.191 4.521 ( 26.945 0.000 -15.453) 31.061 5.096 ( -0.826 -0.000 -2.942) 3.056 5.421 ( -6.260 -0.000 9.963) 11.766 6.013 ( -4.870 -0.000 -2.255) 5.367 6.088 ( 12.989 0.000 9.682) 16.201 6.654 ( -26.849 -0.000 -6.380) 27.597 6.708 ( 3.873 0.000 12.304) 12.899 6.903 ( -5.560 -0.000 3.021) 6.328 7.226 ( 8.525 0.000 5.336) 10.058 7.376 ( 8.844 0.000 1.978) 9.062 7.712 ( -2.461 -0.000 2.784) 3.716 7.713 ( -1.251 -0.000 -4.751) 4.913 8.125 ( 6.462 0.000 8.934) 11.026 8.564 ( 1.561 0.000 3.354) 3.700 8.692 ( 0.317 0.000 -1.324) 1.362 8.960 ( 7.549 0.000 1.948) 7.796 9.370 ( 0.999 0.000 -0.718) 1.230 9.571 ( -6.169 -0.000 -10.684) 12.337 9.796 ( -2.947 -0.000 7.650) 8.198 9.902 ( -1.261 -0.000 -21.481) 21.518 10.436 ( 4.282 0.000 2.381) 4.900 10.725 ( -5.961 -0.000 -1.935) 6.268 11.038 ( 2.746 0.000 -2.001) 3.398 11.119 ( -6.575 -0.000 6.775) 9.441 11.422 ( 9.565 0.000 -0.514) 9.579 11.725 ( 15.435 0.000 -7.749) 17.271 12.185 ( -15.456 -0.000 -9.612) 18.201 12.511 ( -5.754 -0.000 10.924) 12.347 13.026 ( 7.064 0.000 7.676) 10.431 13.151 ( 0.156 0.000 -7.048) 7.050 13.393 ( -2.944 -0.000 5.360) 6.116 13.798 ( -1.855 -0.000 5.240) 5.558 14.300 ( 8.660 0.000 3.471) 9.330 14.509 ( 11.024 0.000 -1.836) 11.176 14.553 ( 2.179 0.000 5.543) 5.956 14.570 ( 0.609 0.000 -7.544) 7.569 15.004 ( -16.816 -0.000 7.684) 18.488 15.746 ( -6.432 -0.000 -4.228) 7.697 16.838 ( -1.865 -0.000 -3.457) 3.928 16.948 ( -8.932 -0.000 0.554) 8.949 17.101 ( -7.706 -0.000 10.244) 12.819 17.643 ( 1.477 0.000 -1.547) 2.139 17.838 ( 9.209 0.000 -0.321) 9.215 18.202 ( 11.776 0.000 -5.875) 13.160 18.902 ( 1.770 0.000 1.987) 2.661 20.294 ( -2.834 -0.000 -10.009) 10.402 21.099 ( 2.253 0.000 -1.780) 2.872 21.395 ( -0.841 -0.000 -0.522) 0.990 21.640 ( -1.761 -0.000 -2.455) 3.021 24.936 ( 0.033 0.000 1.040) 1.040 25.490 ( -3.176 -0.000 0.004) 3.176 28.833 ( 0.740 0.000 2.112) 2.238 29.132 ( 0.690 0.000 -1.680) 1.816 34.394 ( -8.036 -0.000 -7.212) 10.798 35.320 ( 9.630 0.000 18.830) 21.150 37.556 ( -4.395 -0.000 2.315) 4.967 38.040 ( 0.001 0.000 5.851) 5.851 40.627 ( 0.423 0.000 17.561) 17.566 41.185 ( 13.676 0.000 3.014) 14.005 41.458 ( -7.307 -0.000 -11.791) 13.872 43.727 ( 0.411 0.000 -22.653) 22.657 ======================= Grid point 144 (66/205) ======================= q-point: (-0.22 -0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.945 ( -28.710 -17.874 -10.180) 35.318 2.749 ( -32.353 -12.572 -14.740) 37.710 3.885 ( 7.875 2.038 0.714) 8.166 4.213 ( 5.435 -15.191 13.002) 20.721 4.332 ( -4.506 4.972 2.680) 7.225 4.789 ( 24.192 1.304 -12.530) 27.276 4.992 ( -19.145 7.052 0.390) 20.406 5.216 ( -18.625 -0.612 6.424) 19.711 5.970 ( 5.457 3.960 3.298) 7.506 6.252 ( -3.387 12.915 -3.571) 13.822 6.336 ( 6.305 7.479 16.658) 19.318 6.581 ( -1.025 -0.761 1.158) 1.723 7.048 ( -7.943 -9.070 -3.640) 12.595 7.224 ( 4.148 7.223 3.277) 8.951 7.504 ( -0.416 -1.067 3.383) 3.572 7.705 ( 7.101 0.832 4.040) 8.212 7.800 ( 4.938 -9.819 -7.834) 13.497 8.230 ( 8.820 5.462 7.234) 12.647 8.505 ( 3.368 3.529 -0.013) 4.878 8.814 ( -1.527 -9.879 3.293) 10.525 9.105 ( 9.376 -3.401 2.143) 10.201 9.345 ( 0.388 3.190 -4.601) 5.612 9.442 ( -3.475 4.877 -6.324) 8.709 9.788 ( -5.167 -4.512 -2.735) 7.385 9.841 ( 0.276 -1.122 -7.494) 7.583 10.449 ( 3.677 4.569 2.043) 6.210 10.704 ( -2.586 -3.896 -1.881) 5.040 10.971 ( -4.157 7.483 5.870) 10.380 11.166 ( 1.611 -6.636 0.916) 6.889 11.514 ( 9.211 2.135 -1.592) 9.588 11.867 ( 13.068 1.757 -7.420) 15.130 11.973 ( -9.214 0.915 -11.840) 15.030 12.472 ( -8.178 -0.087 9.372) 12.439 13.066 ( -3.101 -0.779 -0.314) 3.213 13.201 ( 2.278 -6.905 3.218) 7.951 13.377 ( -3.290 0.363 5.892) 6.758 13.749 ( -4.435 4.042 5.327) 8.024 14.340 ( 4.202 5.818 -3.692) 8.071 14.495 ( -5.601 1.600 5.911) 8.299 14.669 ( 4.361 -8.046 -4.209) 10.074 14.691 ( 11.969 -1.221 3.188) 12.447 14.926 ( -2.098 -4.070 5.167) 6.904 15.620 ( -7.845 3.360 -5.605) 10.210 16.738 ( -14.558 4.947 -5.138) 16.211 16.792 ( -7.242 0.835 0.389) 7.300 17.023 ( -7.200 3.981 11.876) 14.447 17.713 ( 5.625 -3.933 0.441) 6.878 17.941 ( 10.784 1.992 -1.486) 11.067 18.319 ( 11.940 1.142 -5.642) 13.255 18.982 ( 2.588 -6.006 3.394) 7.369 20.177 ( -4.205 3.812 -10.703) 12.115 21.181 ( 4.010 -6.885 -2.211) 8.268 21.394 ( -0.604 -1.246 -0.480) 1.465 21.619 ( -1.403 -1.155 -3.141) 3.629 24.960 ( 0.545 -2.161 0.598) 2.308 25.446 ( -3.598 0.572 0.392) 3.665 28.860 ( 0.400 -1.310 2.242) 2.627 29.127 ( 0.329 0.644 -1.670) 1.820 34.273 ( -6.768 0.002 -7.365) 10.002 35.435 ( 8.238 12.084 25.365) 29.280 37.520 ( -3.044 -0.402 2.368) 3.877 38.054 ( -1.244 0.549 6.951) 7.083 40.666 ( -0.435 3.454 15.734) 16.114 41.109 ( -2.134 12.779 -6.554) 14.519 41.567 ( 6.881 -12.335 -2.392) 14.325 43.603 ( -0.861 2.301 -27.978) 28.085 ======================= Grid point 145 (67/205) ======================= q-point: (-0.11 -0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.137 ( -13.263 -32.874 4.435) 35.725 2.692 ( -22.981 -33.945 -16.033) 44.016 3.905 ( -10.435 -1.244 -0.180) 10.510 4.203 ( -23.176 -1.744 9.573) 25.136 4.338 ( -19.116 7.075 4.092) 20.790 4.564 ( -0.750 -0.702 5.089) 5.191 4.978 ( 15.488 3.754 -8.259) 17.950 5.187 ( 6.192 1.799 0.543) 6.471 5.894 ( -1.479 21.978 5.357) 22.670 6.024 ( 2.390 -0.297 0.023) 2.408 6.383 ( 3.468 -1.221 9.436) 10.127 6.669 ( 0.025 -1.586 -3.413) 3.764 6.973 ( -7.559 0.275 -1.915) 7.803 7.237 ( 12.079 6.271 7.920) 15.747 7.465 ( -3.499 -0.307 -1.609) 3.863 7.771 ( 4.991 4.780 0.050) 6.911 8.016 ( 9.660 -5.749 -10.671) 15.500 8.186 ( 6.136 6.730 3.013) 9.593 8.587 ( 7.704 -2.048 -2.300) 8.297 8.926 ( -5.594 -7.214 -0.125) 9.130 9.172 ( -0.492 9.221 -6.929) 11.545 9.308 ( 4.154 -3.819 3.754) 6.777 9.360 ( 0.501 0.378 0.635) 0.893 9.821 ( 1.462 -5.759 -14.023) 15.230 9.909 ( 0.984 -6.051 16.232) 17.351 10.414 ( 1.487 4.506 0.704) 4.797 10.723 ( -2.453 0.750 -0.085) 2.567 10.817 ( 0.888 6.570 3.488) 7.491 11.338 ( 6.260 -7.589 0.438) 9.848 11.544 ( 4.945 3.386 -3.961) 7.184 11.804 ( -8.803 -1.351 -7.747) 11.803 11.963 ( 13.389 5.587 -6.234) 15.790 12.383 ( -9.373 2.209 7.784) 12.383 13.084 ( -3.901 -6.750 -2.675) 8.242 13.365 ( -3.889 -3.171 3.780) 6.282 13.375 ( 2.772 -7.825 6.561) 10.581 13.624 ( -4.739 6.612 4.448) 9.271 14.248 ( 2.814 7.433 -3.030) 8.506 14.351 ( -18.881 1.737 10.748) 21.795 14.803 ( 7.059 2.784 1.510) 7.737 14.872 ( 6.129 -9.389 -4.155) 11.957 15.117 ( 8.549 -5.940 4.254) 11.245 15.450 ( -2.321 1.780 -7.506) 8.056 16.365 ( -18.424 11.234 -2.421) 21.714 16.728 ( -9.012 -4.242 -2.655) 10.308 16.928 ( -4.748 3.552 8.507) 10.370 17.884 ( 10.126 -3.989 2.499) 11.166 18.010 ( 10.588 4.028 -3.713) 11.921 18.383 ( 7.841 3.280 -2.279) 8.800 19.136 ( 2.205 -5.724 -0.099) 6.135 20.030 ( -5.301 1.843 -5.170) 7.631 21.345 ( 0.976 -4.550 1.947) 5.044 21.450 ( 6.707 -6.356 -4.232) 10.163 21.620 ( -1.094 -2.885 -4.173) 5.190 25.022 ( 1.403 -4.056 -0.050) 4.292 25.390 ( -3.429 1.453 0.606) 3.773 28.897 ( -0.289 -1.986 2.244) 3.010 29.107 ( -0.216 1.089 -1.088) 1.554 34.192 ( -4.052 -1.674 -6.249) 7.634 35.271 ( -4.443 24.388 26.300) 36.142 37.533 ( 1.406 -1.415 2.795) 3.434 38.045 ( -1.877 1.412 5.645) 6.114 40.600 ( -1.808 10.222 7.667) 12.905 40.899 ( -4.004 3.094 -2.936) 5.850 41.768 ( 1.367 -5.127 -3.804) 6.529 43.464 ( 0.860 -1.009 -27.322) 27.354 ======================= Grid point 153 (68/205) ======================= q-point: (-0.22 -0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.286 ( -36.679 -0.000 -13.901) 39.225 2.076 ( -43.846 -0.000 -23.938) 49.955 3.968 ( -35.292 -0.000 12.350) 37.390 4.056 ( -4.264 -0.000 14.861) 15.460 4.315 ( 0.562 0.000 -2.069) 2.144 4.896 ( -11.596 -0.000 9.754) 15.153 4.915 ( -2.774 -0.000 -6.625) 7.182 5.144 ( 23.140 0.000 -9.604) 25.054 6.098 ( 7.013 0.000 3.101) 7.668 6.248 ( -2.756 -0.000 -0.531) 2.807 6.579 ( 4.952 0.000 16.390) 17.122 6.679 ( -10.269 -0.000 -1.121) 10.330 6.847 ( 13.149 0.000 -10.150) 16.611 7.292 ( 3.734 0.000 -3.628) 5.206 7.526 ( -2.711 -0.000 8.116) 8.557 7.790 ( 7.335 0.000 2.308) 7.690 7.873 ( 15.306 0.000 -0.685) 15.322 8.382 ( 6.146 0.000 7.958) 10.055 8.597 ( -1.498 -0.000 3.690) 3.982 8.644 ( -3.286 -0.000 -4.021) 5.193 9.209 ( 10.796 0.000 0.565) 10.810 9.334 ( -0.623 -0.000 -8.070) 8.094 9.497 ( 1.453 0.000 1.435) 2.042 9.620 ( -6.343 -0.000 -13.369) 14.798 9.837 ( -0.193 -0.000 8.342) 8.345 10.565 ( 5.187 0.000 0.610) 5.223 10.615 ( -2.299 -0.000 -1.428) 2.707 10.986 ( -9.410 -0.000 6.838) 11.632 11.158 ( 7.430 0.000 1.975) 7.688 11.636 ( 9.016 0.000 -2.518) 9.361 11.776 ( -10.242 -0.000 -7.665) 12.792 12.097 ( 20.952 0.000 -13.293) 24.813 12.394 ( -9.956 -0.000 7.562) 12.503 12.927 ( -12.230 -0.000 -5.387) 13.364 13.219 ( 3.188 0.000 10.870) 11.328 13.338 ( -7.045 -0.000 4.269) 8.237 13.738 ( -6.271 -0.000 5.102) 8.084 14.380 ( -18.329 -0.000 9.819) 20.793 14.480 ( 9.942 0.000 -5.125) 11.185 14.586 ( 1.230 0.000 -0.541) 1.344 14.879 ( 16.555 0.000 0.115) 16.555 14.963 ( 9.727 0.000 1.775) 9.888 15.542 ( -7.341 -0.000 -6.013) 9.489 16.580 ( -15.076 -0.000 -9.282) 17.704 16.630 ( -17.270 -0.000 1.533) 17.338 17.091 ( -2.170 -0.000 17.780) 17.912 17.740 ( 6.100 0.000 0.244) 6.105 18.084 ( 10.533 0.000 -0.681) 10.555 18.469 ( 14.157 0.000 -6.761) 15.689 18.962 ( 1.767 0.000 3.709) 4.109 20.105 ( -5.036 -0.000 -15.240) 16.050 21.141 ( 2.605 0.000 -2.254) 3.444 21.376 ( -0.664 -0.000 0.155) 0.682 21.582 ( -1.366 -0.000 -2.530) 2.875 24.951 ( 0.683 0.000 0.551) 0.877 25.411 ( -3.412 -0.000 0.587) 3.462 28.861 ( 0.078 0.000 2.099) 2.101 29.126 ( -0.029 -0.000 -1.892) 1.892 34.166 ( -5.851 -0.000 -7.049) 9.161 35.834 ( 17.035 0.000 38.110) 41.744 37.484 ( -3.123 -0.000 2.476) 3.985 38.070 ( -2.658 -0.000 10.015) 10.361 40.735 ( -1.821 -0.000 13.914) 14.032 41.194 ( -5.996 -0.000 -12.826) 14.158 41.529 ( 11.794 0.000 4.000) 12.453 43.453 ( -4.400 -0.000 -43.245) 43.469 ======================= Grid point 154 (69/205) ======================= q-point: (-0.11 -0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.353 ( -16.089 -46.840 4.662) 49.745 1.679 ( -38.279 -31.083 -25.778) 55.642 3.325 ( -75.227 -2.944 17.563) 77.306 4.038 ( -7.057 -0.371 7.919) 10.614 4.347 ( 1.929 0.185 -0.913) 2.142 4.702 ( -0.381 11.946 2.644) 12.241 5.062 ( 8.101 -3.964 2.485) 9.355 5.393 ( 23.024 -0.694 -6.562) 23.951 6.054 ( -0.781 5.595 -3.233) 6.509 6.260 ( -1.424 16.213 2.913) 16.534 6.391 ( -0.413 -1.873 -0.056) 1.919 6.726 ( -1.099 0.333 4.848) 4.983 6.896 ( 4.178 5.462 -9.044) 11.361 7.440 ( 0.124 3.427 9.469) 10.070 7.480 ( 12.538 -2.733 0.001) 12.833 7.925 ( 7.010 -0.511 -1.388) 7.165 7.960 ( 8.672 1.301 -5.452) 10.326 8.431 ( 3.935 7.973 2.986) 9.379 8.572 ( 1.194 -5.730 -5.667) 8.147 8.705 ( -7.207 -8.881 -0.385) 11.444 9.247 ( -4.199 5.210 -6.936) 9.637 9.353 ( 0.344 -2.189 -4.171) 4.723 9.359 ( 5.352 4.829 2.120) 7.514 9.679 ( 0.067 -7.660 -9.401) 12.127 9.963 ( 8.082 -4.665 28.960) 30.427 10.517 ( 1.492 5.227 0.373) 5.448 10.690 ( 1.715 -4.013 -1.944) 4.777 10.885 ( -4.242 2.865 9.290) 10.607 11.323 ( 10.142 -5.912 2.600) 12.023 11.654 ( -2.943 0.355 -4.557) 5.436 11.683 ( 2.727 4.258 -5.827) 7.716 12.218 ( 16.381 7.628 -9.853) 20.582 12.311 ( -8.994 -0.888 6.125) 10.917 12.846 ( -9.894 -10.122 -4.911) 14.982 13.263 ( -7.821 -1.066 0.632) 7.919 13.335 ( 1.446 -4.864 11.502) 12.571 13.652 ( -6.430 3.050 3.605) 7.977 14.171 ( -18.329 2.932 8.441) 20.391 14.460 ( 6.293 8.573 1.469) 10.736 14.761 ( 5.942 -10.203 -2.054) 11.984 14.977 ( 7.584 7.013 2.146) 10.550 15.162 ( 9.946 -4.300 -0.168) 10.837 15.416 ( -2.674 0.356 -8.138) 8.573 16.254 ( -19.954 6.883 -8.003) 22.575 16.488 ( -15.377 -5.140 -0.699) 16.228 17.059 ( 0.281 8.671 14.234) 16.669 17.914 ( 9.610 -8.923 1.921) 13.254 18.175 ( 9.238 2.633 -2.057) 9.823 18.549 ( 10.214 5.344 -2.764) 11.855 19.062 ( 1.964 -6.065 -3.592) 7.317 19.961 ( -6.185 1.208 -8.023) 10.202 21.262 ( 2.880 -8.926 -1.196) 9.455 21.400 ( 3.447 -5.127 -2.681) 6.735 21.566 ( -1.082 -0.780 -1.488) 1.999 24.983 ( 1.013 -2.547 0.310) 2.758 25.371 ( -2.872 0.590 0.547) 2.982 28.876 ( -0.481 -1.066 1.928) 2.255 29.113 ( -0.273 0.551 -1.462) 1.586 34.095 ( -3.415 -1.533 -5.426) 6.592 35.888 ( 4.784 39.033 43.097) 58.342 37.524 ( 2.975 -5.222 3.218) 6.818 38.066 ( -3.406 1.385 10.465) 11.092 40.740 ( -2.600 3.851 11.043) 11.981 40.935 ( -3.984 12.012 -11.138) 16.859 41.690 ( -0.770 -1.740 -2.454) 3.105 43.229 ( -5.684 -9.564 -52.372) 53.541 ======================= Grid point 163 (70/205) ======================= q-point: (-0.11 -0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.504 ( -21.123 -0.000 14.275) 25.494 0.821 ( -43.325 -0.000 -16.103) 46.220 2.410 ( -85.998 -0.000 26.054) 89.858 3.969 ( -9.036 -0.000 8.228) 12.221 4.386 ( 4.151 0.000 -2.222) 4.708 4.775 ( -4.211 -0.000 2.561) 4.928 5.217 ( 14.516 0.000 7.830) 16.493 5.577 ( 16.366 0.000 -7.506) 18.005 6.107 ( -1.545 -0.000 -8.737) 8.873 6.215 ( -1.675 -0.000 -1.320) 2.133 6.536 ( -1.615 -0.000 -3.467) 3.824 6.578 ( -4.238 -0.000 -2.679) 5.014 7.129 ( 10.978 0.000 -6.656) 12.838 7.483 ( -4.102 -0.000 3.386) 5.319 7.628 ( 20.429 0.000 6.780) 21.525 7.957 ( 5.897 0.000 0.603) 5.927 8.089 ( 0.177 0.000 -19.442) 19.443 8.347 ( -10.933 -0.000 -8.761) 14.010 8.536 ( -5.555 -0.000 1.753) 5.825 8.570 ( 0.646 0.000 -0.610) 0.888 9.222 ( -3.014 -0.000 -4.613) 5.511 9.295 ( -2.203 -0.000 0.162) 2.209 9.519 ( -0.452 -0.000 1.912) 1.965 9.539 ( 2.800 0.000 -2.557) 3.791 10.200 ( 15.317 0.000 36.489) 39.573 10.568 ( -2.148 -0.000 0.300) 2.169 10.658 ( 3.052 0.000 -2.331) 3.840 11.033 ( 18.518 0.000 39.487) 43.613 11.419 ( 12.390 0.000 3.229) 12.804 11.572 ( -3.644 -0.000 -4.727) 5.968 11.795 ( 6.281 0.000 -2.869) 6.906 12.202 ( -9.780 -0.000 4.709) 10.854 12.486 ( 19.959 0.000 -12.841) 23.733 12.562 ( -14.383 -0.000 -2.070) 14.531 13.169 ( -6.005 -0.000 -2.277) 6.422 13.348 ( -1.629 -0.000 13.898) 13.994 13.607 ( -5.777 -0.000 1.194) 5.899 14.043 ( -15.026 -0.000 9.084) 17.558 14.605 ( 1.114 0.000 0.055) 1.116 14.772 ( 14.301 0.000 1.757) 14.408 15.197 ( 7.323 0.000 0.043) 7.323 15.213 ( 10.664 0.000 -2.573) 10.970 15.320 ( -6.022 -0.000 -8.158) 10.140 16.020 ( -24.686 -0.000 -17.901) 30.493 16.243 ( -15.830 -0.000 4.918) 16.577 17.253 ( 4.702 0.000 13.831) 14.608 17.880 ( 4.695 0.000 -0.137) 4.697 18.280 ( 6.558 0.000 -3.382) 7.379 18.724 ( 10.394 0.000 -4.030) 11.148 18.943 ( -8.352 -0.000 -18.679) 20.461 19.902 ( 0.590 0.000 9.503) 9.521 21.183 ( 2.033 0.000 -1.663) 2.627 21.365 ( -0.309 -0.000 0.056) 0.314 21.551 ( -0.144 -0.000 0.061) 0.156 24.973 ( 0.743 0.000 0.526) 0.910 25.346 ( -2.288 -0.000 0.235) 2.300 28.867 ( -0.789 -0.000 1.520) 1.713 29.108 ( -0.132 -0.000 -1.517) 1.523 34.036 ( -1.142 -0.000 -3.377) 3.565 36.892 ( 44.995 0.000 46.288) 64.553 37.445 ( -1.911 -0.000 2.261) 2.960 38.109 ( -1.585 -0.000 19.892) 19.955 40.756 ( -3.794 -0.000 7.620) 8.512 40.997 ( -2.005 -0.000 -14.554) 14.692 41.762 ( 5.256 0.000 2.501) 5.821 42.411 ( -54.608 -0.000 -107.027) 120.153 ======================= Grid point 164 (71/205) ======================= q-point: ( 0.00 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.635 ( 13.702 0.000 43.829) 45.921 1.838 ( -9.280 -0.000 47.371) 48.272 2.149 ( 14.620 0.000 55.119) 57.025 3.937 ( -9.105 -0.000 6.659) 11.280 4.463 ( 2.010 0.000 0.855) 2.184 5.048 ( 5.017 0.000 14.397) 15.246 5.256 ( -8.062 -0.000 -11.561) 14.095 5.619 ( -1.569 -0.000 -17.478) 17.549 5.768 ( 17.206 0.000 -11.698) 20.806 6.036 ( -0.288 -0.000 -6.023) 6.030 6.401 ( -6.979 -0.000 4.164) 8.127 6.488 ( 1.714 0.000 -0.180) 1.724 6.887 ( -0.708 -0.000 -8.059) 8.090 7.398 ( -16.897 -0.000 -26.592) 31.506 7.563 ( -2.561 -0.000 2.522) 3.594 7.841 ( 6.361 0.000 -5.655) 8.511 7.899 ( 0.214 0.000 -3.715) 3.721 8.385 ( 3.789 0.000 0.201) 3.794 8.518 ( -1.015 -0.000 2.843) 3.019 8.565 ( 7.587 0.000 2.415) 7.962 9.129 ( -15.042 -0.000 -1.597) 15.127 9.237 ( 0.363 0.000 0.633) 0.729 9.525 ( 3.326 0.000 1.228) 3.546 9.599 ( -0.114 -0.000 1.069) 1.075 10.547 ( -0.085 -0.000 1.564) 1.566 10.640 ( 0.590 0.000 7.893) 7.915 10.686 ( 2.652 0.000 -0.959) 2.820 11.541 ( 3.459 0.000 3.182) 4.700 11.729 ( 2.136 0.000 2.930) 3.626 11.849 ( 3.310 0.000 -3.735) 4.990 11.996 ( -10.360 -0.000 -2.181) 10.587 12.396 ( -2.183 -0.000 -5.903) 6.294 12.435 ( 3.914 0.000 4.869) 6.247 12.923 ( -15.715 -0.000 -1.431) 15.780 12.984 ( -0.264 -0.000 -3.596) 3.606 13.574 ( 22.302 0.000 0.527) 22.309 13.918 ( 21.556 0.000 -8.281) 23.092 13.946 ( -9.318 -0.000 6.775) 11.520 14.580 ( -26.294 -0.000 -1.490) 26.336 14.908 ( -5.855 -0.000 -6.578) 8.806 14.973 ( 10.227 0.000 8.312) 13.179 15.269 ( 3.442 0.000 0.318) 3.457 15.301 ( 12.828 0.000 2.249) 13.023 15.441 ( -2.609 -0.000 3.489) 4.357 16.208 ( -5.378 -0.000 10.289) 11.610 17.016 ( -8.853 -0.000 -0.706) 8.881 17.906 ( -0.582 -0.000 -1.162) 1.300 18.107 ( 0.928 0.000 -6.629) 6.694 18.506 ( -4.911 -0.000 3.179) 5.850 18.856 ( 5.911 0.000 -1.456) 6.087 20.949 ( 18.992 0.000 1.180) 19.029 21.164 ( 0.367 0.000 -2.323) 2.352 21.382 ( 1.167 0.000 0.812) 1.422 21.528 ( 0.488 0.000 -1.166) 1.263 25.018 ( 0.547 0.000 1.915) 1.991 25.280 ( -1.453 -0.000 -1.829) 2.336 28.881 ( -1.438 -0.000 1.884) 2.370 29.089 ( 1.832 0.000 -1.336) 2.267 34.150 ( 9.464 0.000 5.324) 10.859 34.910 ( -90.098 -0.000 -6.288) 90.317 37.472 ( -1.820 -0.000 3.116) 3.609 37.844 ( -1.900 -0.000 -2.809) 3.391 40.694 ( -10.761 -0.000 1.392) 10.851 40.978 ( 6.707 0.000 -3.895) 7.756 41.793 ( -5.510 -0.000 -0.512) 5.533 41.913 ( 64.497 0.000 -1.153) 64.507 ======================= Grid point 165 (72/205) ======================= q-point: ( 0.11 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.783 ( 5.326 3.051 41.732) 42.181 2.141 ( 22.045 -11.743 38.400) 45.809 3.116 ( 31.546 -35.190 44.940) 65.215 3.865 ( -6.550 -0.725 4.083) 7.753 4.415 ( 2.139 9.367 0.978) 9.658 4.874 ( -5.021 17.943 -10.536) 21.405 5.269 ( 5.364 -2.925 11.926) 13.400 5.627 ( 3.589 -5.203 -19.608) 20.601 5.904 ( 2.839 -2.592 -4.638) 6.024 5.992 ( 1.353 3.370 -6.581) 7.516 6.240 ( -6.554 4.373 2.200) 8.180 6.524 ( -0.524 -1.696 -0.433) 1.827 6.805 ( -3.393 1.564 -2.726) 4.625 7.276 ( -12.904 -14.811 -21.976) 29.476 7.392 ( -8.624 9.098 -2.952) 12.879 7.863 ( 6.629 6.015 -7.395) 11.611 7.902 ( 1.177 1.711 -2.783) 3.472 8.367 ( 1.738 1.639 -4.624) 5.205 8.539 ( 1.833 -3.722 0.217) 4.154 8.744 ( -0.617 -9.224 0.294) 9.249 8.940 ( -7.758 3.929 3.325) 9.310 9.181 ( 0.821 5.867 -2.130) 6.296 9.505 ( -3.341 7.162 2.527) 8.297 9.586 ( 2.227 -0.515 -0.063) 2.287 10.561 ( -0.845 -1.206 1.791) 2.319 10.593 ( -0.977 6.668 3.715) 7.695 10.741 ( 0.839 -1.653 3.667) 4.109 11.556 ( -3.247 5.467 4.303) 7.678 11.691 ( -11.647 -1.982 1.606) 11.923 11.804 ( 0.135 4.105 -1.038) 4.236 11.914 ( 2.142 2.674 -3.025) 4.571 12.087 ( -20.571 7.347 1.787) 21.917 12.650 ( 6.206 -10.013 -1.668) 11.897 12.868 ( -0.021 -5.598 -2.482) 6.124 13.023 ( 7.176 -0.251 -2.586) 7.632 13.671 ( 0.969 26.815 3.315) 27.036 13.706 ( 6.648 4.047 7.762) 10.992 13.948 ( -4.446 0.636 6.464) 7.871 14.377 ( -0.451 0.591 1.854) 1.997 14.724 ( -2.534 7.600 -2.471) 8.384 15.059 ( -3.041 -5.215 5.930) 8.462 15.377 ( 6.961 6.303 2.766) 9.790 15.492 ( -2.264 -12.038 -3.045) 12.621 15.740 ( 14.472 -23.092 -11.575) 29.608 16.266 ( 0.285 -5.546 7.459) 9.299 16.898 ( -7.795 5.176 5.716) 10.965 17.844 ( -4.484 3.410 -2.853) 6.315 18.091 ( 1.809 1.258 -8.969) 9.235 18.461 ( -3.452 1.073 1.506) 3.916 18.968 ( 3.117 -7.607 -1.176) 8.304 20.856 ( -1.207 15.649 6.223) 16.884 21.165 ( -0.139 -1.547 -2.745) 3.154 21.490 ( -2.606 -5.252 -2.405) 6.337 21.627 ( 10.991 -4.648 -4.308) 12.688 25.054 ( 0.271 -2.782 2.156) 3.530 25.265 ( -0.747 -0.518 -2.204) 2.384 28.883 ( -1.097 -1.033 1.671) 2.250 29.125 ( 2.046 -1.613 -0.948) 2.773 34.148 ( -31.011 1.182 8.459) 32.166 34.322 ( 9.651 -1.928 8.917) 13.280 37.503 ( -2.759 -3.997 1.539) 5.095 37.823 ( -0.844 -0.660 -3.058) 3.240 40.545 ( -10.196 2.516 -0.345) 10.507 41.052 ( 7.105 0.286 -0.817) 7.157 41.657 ( -0.423 4.618 -0.271) 4.645 42.705 ( 42.650 -11.090 -20.436) 48.576 ======================= Grid point 166 (73/205) ======================= q-point: ( 0.22 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.135 ( 18.412 -9.441 29.683) 36.183 2.822 ( 30.985 -15.032 27.230) 43.903 3.835 ( -1.154 -3.006 2.589) 4.132 4.018 ( 9.943 -9.072 19.541) 23.728 4.288 ( 4.548 7.779 -11.610) 14.696 4.580 ( 6.768 1.888 8.530) 11.052 5.418 ( 6.719 2.949 13.228) 15.127 5.600 ( -0.686 6.186 -6.387) 8.918 5.807 ( -19.782 -3.458 1.771) 20.160 5.950 ( 5.231 -0.210 -8.652) 10.112 6.284 ( 2.338 -8.177 0.140) 8.506 6.533 ( -2.882 -2.912 -0.639) 4.146 6.768 ( -0.818 0.990 -3.452) 3.683 7.120 ( -7.499 2.021 -1.012) 7.832 7.325 ( -8.431 -9.552 -12.774) 18.041 7.704 ( -3.485 9.709 -15.714) 18.797 7.823 ( 1.619 9.051 2.617) 9.560 8.389 ( 7.056 -0.480 -8.133) 10.778 8.634 ( -5.626 -1.866 -3.543) 6.905 8.760 ( 2.979 -4.579 -5.762) 7.940 8.867 ( -5.088 1.209 3.037) 6.048 9.166 ( 9.158 2.930 -2.934) 10.053 9.354 ( -3.931 4.711 2.961) 6.813 9.611 ( 0.476 -0.984 0.268) 1.125 10.457 ( -5.760 5.457 2.045) 8.193 10.577 ( -0.610 0.322 2.265) 2.367 10.769 ( -0.795 0.311 6.326) 6.383 11.262 ( -18.110 12.238 3.218) 22.092 11.568 ( -14.031 -1.385 -0.553) 14.110 11.727 ( -0.992 3.744 0.251) 3.881 11.846 ( -0.915 4.550 -6.244) 7.780 11.993 ( 4.562 -0.264 5.409) 7.081 12.740 ( -4.239 1.223 -1.739) 4.742 12.996 ( 1.084 -9.011 -0.775) 9.109 13.099 ( 10.136 4.658 0.284) 11.159 13.421 ( 6.275 6.865 3.504) 9.939 13.677 ( 2.306 7.870 8.241) 11.626 14.006 ( -0.372 -4.261 9.810) 10.702 14.409 ( 5.697 1.619 3.344) 6.801 14.633 ( 2.658 2.749 -1.847) 4.247 15.162 ( -5.092 -9.759 5.350) 12.238 15.309 ( -3.331 3.866 0.468) 5.125 15.642 ( 3.001 -6.383 -0.519) 7.073 16.133 ( 2.004 -17.891 -14.872) 23.351 16.371 ( 1.504 -2.115 3.953) 4.729 16.755 ( 1.489 6.822 6.965) 9.863 17.708 ( -3.568 4.634 -5.030) 7.714 18.027 ( -1.039 2.553 -8.257) 8.705 18.391 ( -3.849 2.890 0.198) 4.818 19.116 ( -0.340 -8.485 -1.442) 8.613 20.623 ( -5.381 11.623 9.604) 16.009 21.209 ( 2.859 -2.992 -2.871) 5.037 21.506 ( -1.300 -1.594 -1.683) 2.658 21.759 ( 6.230 -1.212 -4.859) 7.993 25.117 ( -0.458 -3.781 1.897) 4.255 25.259 ( -0.284 -0.611 -1.994) 2.105 28.898 ( -1.133 -1.760 1.645) 2.662 29.162 ( 1.100 -0.619 0.285) 1.294 34.037 ( -2.571 -4.601 1.693) 5.536 34.514 ( 9.813 -1.770 11.131) 14.944 37.528 ( -2.347 -2.321 1.556) 3.649 37.824 ( -0.168 -1.831 -3.084) 3.590 40.396 ( -8.504 1.534 -0.689) 8.669 41.108 ( 3.225 1.727 4.163) 5.542 41.626 ( 0.758 -1.475 -5.858) 6.089 43.106 ( 25.678 -1.406 -21.153) 33.298 ======================= Grid point 167 (74/205) ======================= q-point: ( 0.33 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.672 ( 21.401 -13.761 21.867) 33.549 3.480 ( 25.922 -11.464 14.869) 32.007 3.865 ( -0.460 -1.233 -4.096) 4.302 3.998 ( 9.098 14.261 9.239) 19.275 4.096 ( 7.015 8.246 -14.067) 17.751 4.974 ( 2.818 -8.541 16.397) 18.701 5.307 ( -14.218 5.641 2.451) 15.491 5.474 ( -4.183 4.826 2.589) 6.892 5.626 ( -21.608 -1.629 10.832) 24.226 6.102 ( 8.067 -9.516 -2.986) 12.828 6.400 ( -4.195 -8.341 2.183) 9.589 6.626 ( 9.663 -4.628 -3.430) 11.249 6.678 ( -0.471 3.527 -4.932) 6.082 7.228 ( 5.460 -7.454 6.906) 11.535 7.284 ( -10.031 -5.806 -4.140) 12.307 7.444 ( -4.610 5.693 -10.904) 13.136 7.686 ( 0.783 10.181 -1.919) 10.390 8.338 ( -3.051 13.398 -4.935) 14.600 8.529 ( 5.109 -2.769 -18.022) 18.936 8.780 ( -1.725 0.460 -7.219) 7.437 8.989 ( 6.927 -9.533 -1.527) 11.882 9.132 ( 4.906 8.073 -0.475) 9.459 9.373 ( -1.086 -5.377 3.754) 6.647 9.655 ( 1.590 -3.995 -1.444) 4.536 10.338 ( -5.373 1.071 2.681) 6.100 10.534 ( -1.869 4.338 -0.183) 4.727 10.769 ( -2.308 0.990 6.069) 6.568 10.878 ( -15.142 11.707 5.230) 19.842 11.431 ( -8.451 0.319 -3.177) 9.035 11.680 ( -1.180 2.568 -0.832) 2.946 11.737 ( 0.718 3.235 -4.960) 5.965 12.058 ( 4.020 3.293 3.644) 6.347 12.569 ( -9.298 5.878 3.755) 11.623 13.108 ( -4.719 -7.568 -0.875) 8.961 13.200 ( 7.970 -4.388 -0.780) 9.132 13.508 ( 11.848 2.270 4.086) 12.737 13.648 ( 6.819 5.675 8.874) 12.548 14.068 ( -0.703 -0.321 3.474) 3.559 14.498 ( 5.777 -0.629 10.663) 12.144 14.656 ( 4.781 0.276 -2.575) 5.437 15.159 ( -12.755 -1.410 -1.820) 12.961 15.302 ( -1.031 -5.056 5.181) 7.312 15.732 ( -2.523 -2.551 1.536) 3.903 16.091 ( -12.152 0.973 -4.928) 13.149 16.546 ( 10.731 -6.582 -2.782) 12.893 16.816 ( 8.861 -1.586 1.530) 9.131 17.607 ( 0.882 2.357 -6.634) 7.095 17.933 ( -2.212 2.941 -6.749) 7.687 18.292 ( -2.967 3.520 -1.131) 4.741 19.200 ( -4.396 -6.062 -0.933) 7.546 20.445 ( -4.592 8.294 9.492) 13.416 21.293 ( 3.687 -3.634 -2.031) 5.561 21.504 ( -0.313 -0.213 -1.254) 1.310 21.790 ( 3.718 2.083 -4.136) 5.939 25.163 ( -0.265 -1.550 0.552) 1.667 25.268 ( -0.557 -2.069 -0.876) 2.315 28.923 ( -1.101 -2.150 1.600) 2.897 29.170 ( 0.066 0.875 1.477) 1.718 34.131 ( 4.293 -3.966 -2.199) 6.245 34.683 ( 5.968 -2.091 11.268) 12.922 37.543 ( -0.730 -1.041 2.651) 2.940 37.854 ( 0.662 -3.088 -2.718) 4.167 40.302 ( -6.437 -1.196 -0.207) 6.550 41.104 ( -2.132 2.062 6.937) 7.545 41.657 ( 2.766 -3.040 -9.872) 10.693 43.252 ( 16.539 3.146 -18.441) 24.970 ======================= Grid point 168 (75/205) ======================= q-point: ( 0.44 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.191 ( 18.589 -10.204 18.757) 28.311 3.630 ( 0.953 9.772 -8.087) 12.721 3.863 ( -6.610 6.151 13.593) 16.318 4.100 ( 20.190 -5.106 4.082) 21.222 4.218 ( 24.999 -0.796 -3.422) 25.244 4.847 ( -7.540 13.708 1.303) 15.700 5.106 ( -30.197 -3.274 7.314) 31.242 5.264 ( -15.121 4.184 6.695) 17.058 5.500 ( -13.609 -4.301 4.994) 15.121 6.345 ( 3.916 -10.525 -5.131) 12.346 6.525 ( 3.492 -4.166 -1.265) 5.581 6.646 ( -0.256 -4.572 -2.210) 5.085 6.775 ( 6.218 3.009 9.604) 11.831 7.108 ( -10.231 10.477 -4.636) 15.360 7.253 ( -2.303 -7.278 -4.671) 8.949 7.485 ( 1.843 10.378 -3.210) 11.018 7.687 ( 8.635 -12.526 5.123) 16.053 8.128 ( 2.909 2.736 -6.875) 7.951 8.541 ( 5.426 4.608 -14.101) 15.796 8.744 ( 2.063 -2.515 -13.153) 13.549 9.077 ( 1.400 2.615 0.920) 3.106 9.181 ( 3.286 -5.185 -2.581) 6.659 9.458 ( 0.312 -4.179 4.729) 6.318 9.756 ( 5.545 -4.265 -6.042) 9.244 10.326 ( -2.316 1.997 6.243) 6.952 10.421 ( 1.010 1.227 -4.637) 4.902 10.568 ( -8.809 8.693 3.414) 12.838 10.771 ( -3.681 0.604 10.322) 10.975 11.343 ( -3.130 0.445 -3.375) 4.624 11.594 ( 1.859 4.289 -6.311) 7.854 11.767 ( 3.045 -2.765 0.697) 4.172 11.979 ( -3.129 7.348 1.747) 8.175 12.442 ( -7.157 0.276 3.738) 8.079 13.143 ( -4.820 -4.366 -1.786) 6.744 13.348 ( -0.497 -7.609 3.692) 8.472 13.632 ( 13.018 4.373 4.454) 14.437 13.712 ( 9.860 3.892 10.838) 15.160 14.044 ( -2.386 0.647 -0.177) 2.478 14.605 ( -1.796 -1.172 11.852) 12.045 14.682 ( 2.616 0.427 -1.961) 3.298 15.011 ( -11.527 -0.597 -3.498) 12.061 15.324 ( -12.038 -3.543 1.062) 12.593 15.667 ( 5.124 8.613 3.796) 10.717 16.027 ( -4.392 -5.260 -0.564) 6.875 16.687 ( 3.245 -2.556 -3.879) 5.666 16.959 ( 6.014 -2.839 -0.904) 6.712 17.616 ( 6.414 -1.441 -7.469) 9.950 17.844 ( 0.301 2.449 -5.988) 6.476 18.233 ( 1.710 1.198 -2.301) 3.107 19.200 ( -7.716 -3.527 -0.544) 8.501 20.318 ( -3.631 6.503 8.850) 11.567 21.381 ( 2.012 -3.300 -0.517) 3.899 21.500 ( 1.965 0.945 -1.440) 2.614 21.758 ( 2.291 4.179 -3.947) 6.188 25.166 ( 1.158 1.469 -0.631) 1.975 25.298 ( -1.622 -3.188 0.042) 3.577 28.951 ( -0.953 -2.014 1.550) 2.714 29.150 ( -0.747 1.851 2.054) 2.864 34.207 ( 3.378 -0.410 -2.774) 4.390 34.819 ( 0.761 -5.082 10.470) 11.663 37.568 ( 1.129 -0.367 3.393) 3.594 37.913 ( 0.966 -4.046 -1.612) 4.461 40.283 ( -4.188 -4.166 0.383) 5.920 41.058 ( -5.234 1.306 6.779) 8.664 41.687 ( 1.789 -1.880 -10.406) 10.725 43.276 ( 11.633 5.559 -17.702) 21.899 ======================= Grid point 169 (76/205) ======================= q-point: (-0.44 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.244 ( -14.039 27.629 0.509) 30.996 3.530 ( 16.280 5.279 17.869) 24.743 3.792 ( 2.766 0.055 -3.435) 4.410 4.222 ( -21.305 3.792 11.883) 24.688 4.579 ( 22.572 -10.533 2.820) 25.068 4.662 ( -10.625 0.230 -1.162) 10.691 4.781 ( -10.197 5.076 11.329) 16.065 5.109 ( -8.735 0.426 2.847) 9.197 5.470 ( -12.589 -9.980 -0.112) 16.065 6.312 ( 4.941 16.885 -4.032) 18.049 6.510 ( -16.339 2.596 -8.098) 18.420 6.695 ( 4.822 6.223 4.287) 8.964 6.757 ( -7.959 -17.671 -0.693) 19.393 7.113 ( 7.760 -9.976 6.320) 14.130 7.339 ( 2.487 -1.318 -5.889) 6.527 7.396 ( 5.552 0.766 -4.668) 7.294 7.917 ( 5.490 -7.811 3.869) 10.302 8.233 ( 13.171 3.877 -7.742) 15.763 8.460 ( 1.365 -0.482 -8.585) 8.706 8.789 ( 3.258 -3.927 -10.315) 11.508 9.046 ( -2.360 1.993 1.030) 3.256 9.235 ( -2.642 -4.848 -4.183) 6.927 9.528 ( 0.707 0.579 2.554) 2.713 9.813 ( 6.362 3.346 -11.087) 13.213 10.263 ( 2.108 0.577 5.483) 5.902 10.398 ( -2.937 5.309 4.921) 7.812 10.587 ( 7.160 -9.197 0.199) 11.657 10.776 ( 1.379 0.073 9.859) 9.955 11.309 ( -2.587 -1.429 -2.533) 3.892 11.543 ( 4.070 4.079 -7.488) 9.449 11.813 ( -3.414 2.689 1.755) 4.687 11.899 ( 7.228 0.057 2.683) 7.710 12.385 ( -6.881 -1.645 2.464) 7.492 13.111 ( -7.751 -1.596 -1.525) 8.059 13.473 ( -1.545 -7.353 5.870) 9.535 13.627 ( 0.789 8.272 2.620) 8.713 13.797 ( 7.106 7.203 9.135) 13.631 14.073 ( 4.344 -4.731 3.581) 7.353 14.504 ( -20.243 -0.452 7.600) 21.627 14.705 ( -4.157 -2.098 1.910) 5.033 14.927 ( -0.673 -0.843 -5.500) 5.605 15.204 ( -7.600 0.343 -0.398) 7.618 15.662 ( 14.544 11.139 3.478) 18.647 16.061 ( -6.627 -5.922 0.242) 8.890 16.717 ( 0.874 -1.131 -4.242) 4.476 16.967 ( -5.743 1.757 0.398) 6.019 17.723 ( 9.539 -3.364 -9.102) 13.607 17.872 ( 9.114 -2.576 -5.746) 11.078 18.281 ( 7.090 -1.408 -1.914) 7.477 19.130 ( -10.044 -1.390 -1.142) 10.204 20.220 ( -2.894 5.395 9.156) 11.014 21.421 ( -2.470 -1.630 1.718) 3.421 21.522 ( 6.594 1.524 -3.005) 7.405 21.685 ( 1.462 5.683 -4.155) 7.190 25.145 ( 2.009 3.197 -0.642) 3.830 25.324 ( -1.954 -2.633 0.068) 3.280 28.972 ( -0.817 -0.991 1.752) 2.172 29.116 ( -1.121 1.777 1.860) 2.807 34.198 ( 1.161 3.254 -2.472) 4.248 34.964 ( -5.383 -12.061 10.760) 17.036 37.606 ( 2.626 0.144 2.978) 3.973 37.987 ( 0.141 -4.580 0.039) 4.582 40.334 ( -1.645 -6.222 0.454) 6.452 41.001 ( -6.521 0.208 5.829) 8.748 41.663 ( -1.888 0.155 -9.331) 9.521 43.211 ( 8.648 8.550 -19.890) 23.313 ======================= Grid point 170 (77/205) ======================= q-point: (-0.33 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.500 ( -19.169 38.353 -3.997) 43.063 3.345 ( 3.706 43.134 16.611) 46.370 3.804 ( -31.480 -2.902 22.645) 38.887 3.962 ( -10.286 -7.556 1.289) 12.828 4.438 ( -19.022 -2.569 1.366) 19.244 4.636 ( -8.919 7.760 13.501) 17.946 5.014 ( 18.438 -4.200 0.769) 18.926 5.222 ( 16.381 -8.944 -2.579) 18.841 5.530 ( -11.209 -17.978 -3.611) 21.492 6.053 ( -0.404 10.240 -1.597) 10.371 6.361 ( -5.796 -0.409 -11.377) 12.774 6.698 ( 0.641 0.462 10.663) 10.692 6.828 ( -4.248 -0.990 -7.011) 8.257 7.360 ( 0.229 -5.408 -8.564) 10.131 7.402 ( 5.842 -10.897 -8.936) 15.256 7.547 ( 11.710 -7.311 10.488) 17.337 8.122 ( 13.058 6.920 -4.714) 15.512 8.204 ( 5.599 -3.636 -0.124) 6.677 8.484 ( -3.975 -1.848 -7.215) 8.443 8.861 ( 1.712 -5.608 -5.443) 8.000 8.954 ( -3.797 4.828 1.493) 6.321 9.289 ( -1.952 -7.668 -4.565) 9.135 9.429 ( -4.746 6.590 -3.545) 8.862 9.752 ( 5.262 7.703 -7.504) 11.972 10.362 ( 4.204 -3.971 -0.120) 5.784 10.398 ( 1.177 -2.454 9.231) 9.624 10.711 ( 1.544 -0.867 0.429) 1.822 11.013 ( 19.789 -6.931 11.591) 23.958 11.306 ( -3.559 -5.226 -2.269) 6.717 11.516 ( 4.913 2.246 -0.978) 5.490 11.746 ( 3.069 6.517 2.702) 7.694 12.038 ( 10.709 -2.006 1.295) 10.972 12.352 ( -5.813 -2.289 1.232) 6.368 12.992 ( -11.646 1.447 -1.461) 11.826 13.424 ( -9.399 9.611 -1.683) 13.547 13.573 ( -3.358 -5.160 4.650) 7.716 13.751 ( 1.191 7.422 9.697) 12.269 14.219 ( -5.496 0.188 4.587) 7.161 14.335 ( -9.545 -7.953 10.430) 16.222 14.703 ( -8.841 -9.029 0.191) 12.638 14.928 ( 1.077 0.341 -3.558) 3.732 15.164 ( 2.119 1.481 -0.221) 2.595 15.631 ( 11.791 13.911 0.615) 18.246 16.044 ( -4.839 -0.710 -1.718) 5.184 16.646 ( -7.955 5.690 -2.467) 10.087 16.914 ( -3.161 -6.068 1.477) 7.000 17.863 ( 10.878 -3.795 -10.547) 15.620 18.034 ( 10.560 -3.526 -7.073) 13.190 18.420 ( 11.454 -2.561 -0.217) 11.739 18.999 ( -11.818 0.691 -2.639) 12.129 20.162 ( -0.912 3.507 11.477) 12.035 21.401 ( -3.948 0.129 2.070) 4.460 21.563 ( 10.443 5.629 -5.849) 13.227 21.589 ( -0.954 3.663 -2.284) 4.420 25.109 ( 2.038 4.150 -0.069) 4.624 25.336 ( -1.785 -1.613 -0.164) 2.411 28.970 ( -1.155 1.029 2.403) 2.858 29.092 ( -0.465 0.490 0.750) 1.009 34.130 ( 0.582 4.855 -1.937) 5.259 35.177 ( -14.042 -24.088 11.923) 30.325 37.645 ( 3.615 0.748 1.447) 3.965 38.052 ( -2.467 -4.756 1.115) 5.472 40.437 ( 1.645 -6.565 -0.116) 6.769 40.946 ( -7.200 -0.911 4.729) 8.662 41.560 ( -6.638 2.278 -7.409) 10.206 43.035 ( 6.688 14.768 -24.666) 29.517 ======================= Grid point 171 (78/205) ======================= q-point: (-0.22 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.632 ( -13.252 41.936 1.774) 44.016 2.634 ( -11.058 45.563 26.339) 53.777 3.265 ( -46.926 20.141 36.620) 62.839 4.031 ( -4.692 -4.967 3.083) 7.496 4.331 ( -8.657 -5.563 -0.588) 10.307 4.655 ( -2.239 -9.941 11.695) 15.512 5.181 ( 9.799 -0.672 -4.868) 10.962 5.503 ( 11.114 -4.997 -7.701) 14.415 5.789 ( 1.008 -18.430 -4.095) 18.907 5.984 ( 3.640 0.457 -0.859) 3.768 6.231 ( -5.253 2.101 -11.249) 12.591 6.690 ( -6.766 1.775 -3.345) 7.754 6.788 ( 5.771 0.454 2.087) 6.153 7.387 ( -1.097 -3.350 0.840) 3.623 7.615 ( 0.150 -15.146 -12.263) 19.489 7.876 ( 13.588 -7.356 4.137) 15.996 8.034 ( 11.170 11.950 -4.404) 16.940 8.286 ( -12.348 6.002 -14.534) 19.994 8.428 ( 4.082 -5.880 3.903) 8.153 8.796 ( -5.264 8.141 3.714) 10.381 9.010 ( 1.777 -10.135 -0.841) 10.324 9.273 ( -5.059 1.580 -3.804) 6.523 9.387 ( 1.649 -6.492 -3.201) 7.424 9.642 ( 1.557 7.297 -5.099) 9.037 10.472 ( -0.523 -3.196 3.625) 4.861 10.505 ( 5.394 -4.881 3.734) 8.177 10.688 ( -1.260 3.264 -1.901) 3.982 11.408 ( 4.602 -13.718 -5.128) 15.351 11.448 ( 15.977 -2.045 7.648) 17.830 11.603 ( 4.088 -1.588 9.510) 10.472 11.761 ( 22.110 1.863 14.962) 26.762 12.214 ( 13.162 -1.827 -1.056) 13.330 12.310 ( -3.750 0.289 -0.071) 3.762 12.777 ( -14.190 5.731 -1.607) 15.388 13.156 ( -11.638 4.933 -2.652) 12.915 13.554 ( -10.482 -0.706 0.600) 10.523 13.709 ( 0.324 3.459 11.005) 11.540 14.075 ( -15.981 -2.685 7.253) 17.754 14.506 ( 1.907 -7.313 4.626) 8.861 14.791 ( -7.374 -12.812 0.031) 14.782 14.928 ( 0.782 -1.132 3.130) 3.419 15.158 ( 0.690 2.293 -1.228) 2.691 15.517 ( 10.618 15.870 -2.388) 19.244 15.944 ( -1.703 7.466 -5.075) 9.186 16.429 ( -11.420 4.297 2.364) 12.429 17.036 ( -0.307 -9.050 -1.135) 9.126 17.998 ( 9.835 -1.888 -9.876) 14.065 18.115 ( 4.195 0.439 -11.577) 12.321 18.602 ( 9.687 -2.069 0.123) 9.907 18.819 ( -9.254 3.297 -2.044) 10.034 20.214 ( 5.360 -1.507 15.870) 16.818 21.337 ( -4.062 2.769 0.353) 4.928 21.488 ( 6.086 7.799 -5.097) 11.128 21.592 ( 4.044 2.262 -2.394) 5.216 25.064 ( 1.474 4.103 0.715) 4.418 25.332 ( -1.624 -0.577 -0.617) 1.831 28.938 ( -1.691 1.777 2.574) 3.556 29.091 ( 0.805 0.334 -0.456) 0.983 34.065 ( 2.344 4.220 -0.642) 4.870 35.490 ( -30.334 -42.152 7.976) 52.541 37.670 ( 3.562 2.074 -1.141) 4.277 38.065 ( -8.687 -3.911 -1.353) 9.623 40.578 ( 6.533 -5.181 0.490) 8.353 40.894 ( -6.783 -1.162 2.458) 7.308 41.385 ( -9.104 4.636 -3.264) 10.725 42.683 ( 6.296 26.609 -27.203) 38.571 ======================= Grid point 172 (79/205) ======================= q-point: (-0.11 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.179 ( 12.548 11.242 35.513) 39.307 1.984 ( -4.862 36.681 39.562) 54.170 2.527 ( -41.234 23.818 46.305) 66.421 4.010 ( -9.992 -2.081 6.523) 12.113 4.389 ( 0.744 -5.576 -0.109) 5.627 4.870 ( 1.258 -9.818 11.537) 15.201 5.276 ( 0.863 -5.612 -6.240) 8.436 5.627 ( 12.710 -1.394 -19.518) 23.333 5.806 ( 0.921 10.161 -4.825) 11.286 6.064 ( -2.583 -2.433 -9.622) 10.256 6.258 ( 1.991 -13.112 1.448) 13.341 6.571 ( -2.569 4.512 -2.070) 5.590 6.866 ( 0.881 -4.537 -4.034) 6.134 7.470 ( 1.182 -5.562 4.283) 7.119 7.768 ( -0.200 -9.229 -8.573) 12.598 7.810 ( -6.946 13.081 -22.511) 26.947 7.962 ( -8.588 3.022 -4.379) 10.102 8.219 ( 16.018 -2.407 7.124) 17.695 8.518 ( 2.934 0.571 -3.026) 4.253 8.614 ( -3.905 7.651 5.393) 10.142 9.170 ( -1.309 -7.409 0.841) 7.570 9.234 ( -6.960 -4.508 -0.060) 8.292 9.507 ( 6.141 -1.983 -1.264) 6.576 9.543 ( -1.974 0.692 -1.474) 2.559 10.529 ( 0.190 -2.090 3.853) 4.388 10.608 ( -1.986 0.243 3.476) 4.011 10.644 ( 5.016 -0.517 -0.242) 5.049 11.511 ( 1.239 0.349 0.838) 1.536 11.662 ( 8.456 1.572 4.662) 9.783 11.692 ( 6.996 -10.680 -4.687) 13.600 12.113 ( -6.700 -1.337 1.956) 7.107 12.359 ( 12.320 0.097 2.456) 12.563 12.488 ( -5.311 6.832 -0.478) 8.667 12.666 ( 43.547 -16.195 11.832) 47.944 13.006 ( -8.103 -1.433 -2.410) 8.575 13.382 ( -14.785 -0.059 -2.171) 14.944 13.731 ( 0.540 -1.064 10.071) 10.141 14.008 ( -10.847 -4.037 6.911) 13.481 14.602 ( -6.032 -8.572 1.443) 10.580 14.886 ( -11.590 -10.976 -0.905) 15.988 15.020 ( -0.520 -2.251 5.388) 5.862 15.115 ( 5.544 1.710 0.041) 5.802 15.388 ( 12.914 15.425 -3.327) 20.391 15.702 ( -4.180 16.458 -6.655) 18.238 16.285 ( -8.321 2.483 7.621) 11.554 17.110 ( -5.435 -4.163 -6.583) 9.498 17.976 ( 1.275 7.546 -9.206) 11.972 18.109 ( 0.716 -2.729 -7.489) 8.002 18.578 ( -10.133 0.238 3.394) 10.689 18.802 ( 10.915 3.446 -1.847) 11.594 20.509 ( 18.151 -10.624 15.277) 25.994 21.233 ( -1.320 5.025 -2.019) 5.574 21.435 ( 6.393 7.068 -2.910) 9.965 21.566 ( -0.491 2.493 -1.876) 3.158 25.026 ( 0.813 2.668 1.410) 3.126 25.310 ( -1.729 0.237 -1.311) 2.183 28.902 ( -1.835 1.106 2.230) 3.093 29.089 ( 1.481 1.198 -1.377) 2.351 34.062 ( 5.812 2.182 1.829) 6.471 35.678 ( -71.767 -46.227 -14.022) 86.510 37.604 ( -2.540 8.314 -3.627) 9.420 37.932 ( -11.512 1.060 -4.423) 12.378 40.745 ( -2.843 -5.956 4.703) 8.104 40.885 ( 10.728 0.263 -3.054) 11.157 41.274 ( 9.551 2.145 8.950) 13.264 42.181 ( 9.089 33.588 -14.973) 37.881 ======================= Grid point 174 (80/205) ======================= q-point: ( 0.11 0.11 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.201 ( 21.853 0.000 32.938) 39.528 2.379 ( 19.845 0.000 41.780) 46.253 3.532 ( 47.610 0.000 40.615) 62.580 3.766 ( -10.058 -0.000 2.126) 10.280 4.534 ( 2.926 0.000 2.046) 3.570 4.965 ( -5.075 -0.000 -9.791) 11.028 5.311 ( 6.964 0.000 2.505) 7.400 5.551 ( 7.743 0.000 -6.489) 10.103 5.955 ( 4.030 0.000 -7.843) 8.818 5.998 ( -0.621 -0.000 -6.685) 6.714 6.140 ( -14.347 -0.000 -1.679) 14.445 6.413 ( -13.698 -0.000 1.726) 13.806 6.795 ( -5.215 -0.000 -0.669) 5.257 6.973 ( 3.068 0.000 -18.418) 18.672 7.357 ( -8.452 -0.000 -7.468) 11.278 7.820 ( -3.705 -0.000 -15.233) 15.677 8.021 ( 4.396 0.000 5.099) 6.733 8.370 ( 0.525 0.000 0.005) 0.525 8.534 ( -10.614 -0.000 -5.869) 12.128 8.550 ( -0.049 -0.000 -0.665) 0.667 8.968 ( 2.420 0.000 5.247) 5.778 9.226 ( 1.024 0.000 -5.063) 5.165 9.508 ( -7.810 -0.000 2.501) 8.201 9.635 ( 5.178 0.000 1.637) 5.430 10.553 ( -0.581 -0.000 1.696) 1.793 10.651 ( -4.877 -0.000 -0.829) 4.947 10.734 ( 1.038 0.000 7.704) 7.774 11.509 ( -14.628 -0.000 1.766) 14.734 11.588 ( -12.591 -0.000 6.545) 14.190 11.789 ( -2.696 -0.000 -5.613) 6.227 11.929 ( -2.727 -0.000 -1.465) 3.095 11.952 ( -8.212 -0.000 2.574) 8.606 12.590 ( 5.499 0.000 -4.990) 7.426 12.820 ( 1.561 0.000 -0.599) 1.672 13.220 ( 20.698 0.000 1.996) 20.794 13.719 ( -12.038 -0.000 10.446) 15.939 13.876 ( -1.562 -0.000 7.893) 8.046 13.914 ( -9.324 -0.000 6.567) 11.404 14.507 ( 17.452 0.000 -7.809) 19.119 14.710 ( -6.480 -0.000 -6.956) 9.506 14.992 ( -11.348 -0.000 2.119) 11.544 15.206 ( -5.211 -0.000 2.330) 5.708 15.617 ( 12.745 0.000 -9.160) 15.695 15.690 ( 13.693 0.000 4.555) 14.431 16.291 ( 6.411 0.000 5.386) 8.373 16.913 ( -3.522 -0.000 9.149) 9.803 17.818 ( -5.698 -0.000 -0.762) 5.749 18.101 ( 2.848 0.000 -10.757) 11.127 18.440 ( -1.821 -0.000 -1.873) 2.612 18.894 ( -2.414 -0.000 0.579) 2.482 20.908 ( -11.972 -0.000 0.980) 12.012 21.134 ( -0.517 -0.000 -3.278) 3.318 21.429 ( 1.419 0.000 1.650) 2.177 21.722 ( 10.825 0.000 -2.419) 11.092 25.042 ( -0.340 -0.000 2.874) 2.894 25.251 ( 0.758 0.000 -2.752) 2.855 28.869 ( -1.015 -0.000 1.495) 1.807 29.133 ( 2.303 0.000 -0.924) 2.481 33.960 ( -3.742 -0.000 2.792) 4.669 34.493 ( 12.118 0.000 13.006) 17.777 37.471 ( -0.091 -0.000 3.600) 3.601 37.796 ( -0.764 -0.000 -3.058) 3.152 40.434 ( -10.294 -0.000 -2.362) 10.562 41.164 ( 10.597 0.000 -1.534) 10.708 41.580 ( -10.166 -0.000 -4.463) 11.102 43.079 ( 38.950 0.000 -21.235) 44.363 ======================= Grid point 175 (81/205) ======================= q-point: ( 0.22 0.11 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.511 ( 26.948 5.306 29.329) 40.182 2.980 ( 21.135 -16.985 31.406) 41.491 3.683 ( -10.240 -5.812 -1.981) 11.940 4.240 ( 27.544 -5.827 16.814) 32.793 4.481 ( 8.036 11.115 -1.706) 13.821 4.827 ( 10.796 10.185 6.543) 16.220 5.416 ( -10.097 -6.399 -3.493) 12.454 5.669 ( 9.630 4.088 4.477) 11.380 5.698 ( -7.917 11.279 -3.970) 14.341 5.992 ( 0.954 0.967 -2.272) 2.647 6.154 ( 1.254 -12.051 -6.730) 13.860 6.272 ( -18.166 -6.642 2.445) 19.496 6.781 ( -1.869 -5.981 3.624) 7.239 7.022 ( 1.969 -1.494 -9.915) 10.219 7.164 ( -5.278 4.708 -9.769) 12.060 7.667 ( -7.860 2.970 -18.546) 20.361 7.982 ( -3.156 8.181 6.255) 10.771 8.388 ( 4.511 -0.769 -11.453) 12.333 8.460 ( -8.434 -8.137 3.525) 12.238 8.649 ( 0.331 -10.546 -2.344) 10.808 8.951 ( 3.662 9.092 1.941) 9.992 9.234 ( 2.037 -1.772 -4.912) 5.605 9.392 ( -4.389 4.463 2.226) 6.644 9.679 ( 5.739 3.485 1.183) 6.818 10.481 ( -6.120 5.942 -1.079) 8.599 10.582 ( -2.328 -0.203 2.492) 3.417 10.783 ( -0.503 -0.892 6.025) 6.112 11.282 ( -14.321 11.704 5.977) 19.437 11.391 ( -11.548 -0.563 2.430) 11.814 11.727 ( -3.527 0.456 -3.619) 5.073 11.840 ( -5.725 1.943 -5.684) 8.298 12.025 ( 3.548 -5.418 2.244) 6.854 12.659 ( 2.350 -2.604 -8.796) 9.469 12.862 ( -1.363 -4.045 2.874) 5.146 13.379 ( -1.337 11.550 9.513) 15.023 13.550 ( 8.513 0.170 4.122) 9.460 13.839 ( -1.118 5.230 10.085) 11.416 13.989 ( 3.086 -4.941 8.838) 10.585 14.548 ( 3.729 4.766 -1.662) 6.275 14.672 ( 4.625 0.902 -6.953) 8.399 14.905 ( -12.490 -7.510 3.724) 15.042 15.205 ( -8.556 -3.998 1.361) 9.542 15.721 ( 11.071 -0.879 -6.468) 12.852 15.909 ( 5.096 -7.077 0.823) 8.760 16.425 ( 10.621 -2.069 0.148) 10.822 16.892 ( 1.970 3.996 6.563) 7.932 17.720 ( -4.718 2.874 -1.409) 5.701 18.037 ( -0.413 4.191 -8.887) 9.834 18.392 ( -1.650 2.270 -3.904) 4.808 18.928 ( -5.894 -8.795 0.406) 10.595 20.712 ( -9.020 7.167 4.021) 12.203 21.155 ( 0.073 -4.194 -3.532) 5.484 21.464 ( 0.183 -1.657 0.862) 1.876 21.820 ( 6.656 0.125 -2.021) 6.957 25.065 ( -1.167 -2.415 3.144) 4.133 25.257 ( 2.064 0.100 -2.969) 3.617 28.869 ( -1.226 -0.966 1.603) 2.238 29.161 ( 1.341 -0.830 -0.511) 1.658 34.030 ( 10.341 -1.839 -3.943) 11.219 34.679 ( 9.555 0.578 15.079) 17.861 37.504 ( 0.951 -1.068 3.932) 4.184 37.786 ( -0.073 -1.094 -2.984) 3.179 40.305 ( -8.217 0.602 -2.712) 8.674 41.226 ( 4.606 5.429 1.309) 7.239 41.502 ( -4.290 -6.078 -7.242) 10.383 43.352 ( 24.432 2.322 -20.440) 31.939 ======================= Grid point 176 (82/205) ======================= q-point: ( 0.33 0.11 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.921 ( 26.028 -2.837 24.603) 35.928 3.495 ( 4.215 -12.057 16.119) 20.566 3.725 ( -2.353 -11.065 -2.039) 11.495 4.238 ( 5.166 6.495 -18.180) 19.984 4.527 ( 18.418 15.846 9.777) 26.189 5.020 ( 6.272 0.035 8.352) 10.445 5.191 ( -13.364 4.539 12.907) 19.126 5.482 ( -9.574 5.598 0.570) 11.105 5.601 ( -3.774 13.043 5.853) 14.786 5.942 ( -15.365 -3.690 4.769) 16.505 6.336 ( 12.456 -9.143 4.900) 16.210 6.477 ( 10.246 -19.107 -12.510) 25.031 6.815 ( 1.327 8.435 -8.355) 11.946 7.038 ( -4.665 -10.158 1.468) 11.274 7.140 ( 0.437 -9.346 3.390) 9.952 7.415 ( -9.047 6.133 -14.692) 18.311 7.807 ( -4.671 7.621 -0.272) 8.942 8.430 ( -2.342 2.211 -12.101) 12.522 8.467 ( 1.943 -3.111 -4.082) 5.488 8.759 ( -3.053 -1.027 1.490) 3.549 8.936 ( 9.951 -2.909 -3.994) 11.110 9.213 ( -6.695 -1.481 2.166) 7.191 9.362 ( 8.777 3.258 -5.113) 10.667 9.691 ( 5.765 2.789 0.843) 6.459 10.330 ( -3.943 3.343 1.531) 5.391 10.553 ( -4.048 1.134 1.061) 4.336 10.784 ( -2.245 1.885 2.596) 3.916 10.978 ( -5.815 13.197 8.494) 16.737 11.312 ( -6.366 -1.734 0.225) 6.602 11.685 ( -0.581 0.604 -3.956) 4.044 11.709 ( -6.705 0.179 -6.725) 9.498 12.123 ( -0.224 -1.973 1.046) 2.245 12.581 ( -5.389 6.710 -0.838) 8.647 12.937 ( -2.685 -6.381 3.309) 7.673 13.228 ( -2.526 1.680 3.638) 4.737 13.749 ( 16.809 2.302 6.475) 18.160 13.816 ( 2.867 3.318 10.388) 11.276 14.078 ( -0.170 0.171 1.858) 1.873 14.577 ( 3.177 -1.228 5.556) 6.517 14.667 ( -1.596 -0.662 -1.631) 2.376 14.885 ( -13.987 -7.438 -0.653) 15.855 15.154 ( -8.901 -2.597 2.303) 9.554 15.833 ( 9.721 0.406 -2.249) 9.986 15.989 ( 0.066 -0.320 0.052) 0.331 16.594 ( 11.205 -2.584 -3.583) 12.044 16.919 ( 7.414 1.532 1.781) 7.777 17.639 ( 0.441 2.144 -2.838) 3.584 17.925 ( -2.341 3.307 -6.414) 7.586 18.310 ( -0.970 3.204 -4.511) 5.617 18.988 ( -9.407 -9.213 0.272) 13.170 20.534 ( -5.660 6.782 5.429) 10.368 21.226 ( -0.055 -5.820 -2.764) 6.443 21.490 ( 0.302 -1.198 0.086) 1.239 21.855 ( 3.399 1.791 -2.006) 4.334 25.108 ( -1.849 -3.512 2.814) 4.866 25.271 ( 3.172 0.553 -2.847) 4.298 28.883 ( -1.318 -1.831 1.709) 2.830 29.177 ( -0.138 -0.159 0.353) 0.411 34.175 ( 12.058 -1.035 -5.610) 13.340 34.801 ( 4.429 1.966 14.057) 14.869 37.552 ( 2.107 -0.616 4.580) 5.079 37.808 ( 0.941 -2.414 -2.688) 3.733 40.214 ( -5.103 -0.541 -1.587) 5.371 41.141 ( -4.331 4.290 2.039) 6.428 41.575 ( 3.030 -5.222 -7.588) 9.697 43.448 ( 15.535 4.863 -18.159) 24.388 ======================= Grid point 177 (83/205) ======================= q-point: ( 0.44 0.11 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.364 ( 18.928 -6.069 23.008) 30.406 3.593 ( -3.605 -3.911 -8.882) 10.353 3.866 ( -7.335 -3.132 12.627) 14.935 4.187 ( 0.639 -2.354 -9.408) 9.719 4.497 ( -4.650 2.993 4.298) 7.004 4.854 ( -2.337 14.771 7.140) 16.572 5.176 ( 13.118 13.018 11.115) 21.566 5.246 ( -9.717 8.935 -3.419) 13.637 5.354 ( -10.265 4.828 9.481) 14.784 5.970 ( -9.567 -17.084 2.919) 19.796 6.577 ( -3.394 2.264 -6.879) 7.998 6.719 ( 16.022 -4.335 3.826) 17.033 6.836 ( 6.329 -4.453 -5.390) 9.430 7.016 ( -8.607 -5.064 -1.191) 10.057 7.147 ( -6.105 2.369 -7.440) 9.912 7.555 ( 9.945 -15.906 9.042) 20.824 7.656 ( -1.308 5.125 -3.905) 6.575 8.177 ( -4.921 10.153 -6.217) 12.882 8.560 ( 1.109 -7.447 -12.115) 14.264 8.723 ( 6.971 6.982 -7.684) 12.506 9.049 ( -4.430 -5.335 -0.917) 6.995 9.243 ( 5.407 -0.122 0.753) 5.461 9.386 ( 5.141 0.304 -2.869) 5.895 9.768 ( 7.127 -3.376 -3.494) 8.626 10.332 ( 1.766 -2.694 6.272) 7.050 10.449 ( -4.092 4.242 -3.526) 6.868 10.644 ( -4.517 8.882 2.291) 10.225 10.867 ( 3.502 5.858 10.663) 12.660 11.280 ( -3.847 -1.291 -1.497) 4.325 11.600 ( -1.425 -0.684 -13.493) 13.585 11.723 ( 0.405 -3.037 4.194) 5.194 12.063 ( -5.430 4.742 2.108) 7.511 12.429 ( -3.055 4.783 2.578) 6.233 12.996 ( -4.887 -4.661 1.388) 6.895 13.262 ( -0.601 -5.042 3.195) 5.999 13.849 ( 5.795 4.404 7.542) 10.482 13.928 ( 10.043 0.449 11.942) 15.610 14.017 ( -3.230 2.491 -3.378) 5.296 14.520 ( -14.721 0.341 0.357) 14.729 14.680 ( -7.868 0.625 9.127) 12.067 14.857 ( -1.006 -4.726 -4.369) 6.514 15.109 ( -7.977 -4.452 1.425) 9.245 15.916 ( 10.072 3.625 2.043) 10.898 16.001 ( 5.865 1.684 -1.417) 6.264 16.687 ( 3.877 0.116 -4.556) 5.983 17.008 ( 6.307 0.096 -0.667) 6.343 17.648 ( 5.636 -0.427 -5.240) 7.707 17.848 ( -0.140 0.697 -5.136) 5.185 18.265 ( 3.052 0.897 -4.146) 5.226 18.991 ( -12.208 -7.069 0.686) 14.124 20.401 ( -4.060 5.841 6.248) 9.468 21.302 ( -1.466 -5.583 -1.456) 5.953 21.516 ( 1.385 -1.159 -0.784) 1.969 21.834 ( 1.618 3.293 -2.321) 4.341 25.150 ( -1.805 -3.141 1.999) 4.137 25.290 ( 3.729 0.981 -2.388) 4.536 28.909 ( -1.208 -2.372 1.812) 3.220 29.166 ( -1.320 0.852 1.185) 1.968 34.279 ( 9.209 1.757 -4.198) 10.272 34.836 ( -1.332 1.732 11.227) 11.437 37.606 ( 2.917 -0.040 4.599) 5.447 37.860 ( 1.442 -3.329 -1.878) 4.085 40.196 ( -1.616 -2.506 0.456) 3.016 41.032 ( -6.254 2.067 1.064) 6.672 41.639 ( 2.056 -1.921 -5.976) 6.605 43.441 ( 10.683 6.223 -17.520) 21.443 ======================= Grid point 178 (84/205) ======================= q-point: (-0.44 0.11 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.475 ( -9.014 10.989 -6.633) 15.685 3.624 ( -20.372 5.221 27.468) 34.595 3.736 ( 2.934 -5.492 4.334) 7.587 4.129 ( -21.942 -3.720 2.830) 22.434 4.469 ( -20.098 9.759 2.245) 22.455 4.592 ( 23.341 -0.630 1.642) 23.408 5.113 ( 3.400 6.579 3.586) 8.228 5.225 ( -4.500 0.520 2.209) 5.039 5.276 ( 21.820 9.810 5.376) 24.521 6.189 ( -6.009 -17.021 -2.302) 18.197 6.430 ( -13.225 -1.281 -6.148) 14.640 6.649 ( -4.030 14.394 -7.298) 16.634 6.801 ( -8.251 5.545 12.067) 15.634 7.067 ( 11.928 -8.127 0.494) 14.442 7.327 ( 6.730 -6.860 -4.605) 10.657 7.514 ( 4.036 6.663 -3.530) 8.552 7.845 ( 3.702 -8.114 3.198) 9.475 8.191 ( 2.285 -12.824 -2.427) 13.250 8.607 ( 2.691 3.863 -12.210) 13.086 8.647 ( 4.793 0.485 -10.646) 11.685 9.034 ( -5.817 -1.819 -1.328) 6.238 9.225 ( 3.224 5.968 -1.996) 7.070 9.492 ( 2.118 -4.156 0.392) 4.681 9.868 ( 5.297 -0.676 -10.203) 11.516 10.320 ( -0.726 2.013 3.403) 4.020 10.492 ( -0.500 7.737 3.409) 8.470 10.516 ( 5.173 -8.550 0.889) 10.032 10.915 ( 8.499 1.671 10.452) 13.574 11.237 ( -4.282 -0.816 -1.616) 4.649 11.567 ( 0.065 -0.677 -8.800) 8.826 11.825 ( 4.357 -3.291 6.010) 8.121 11.971 ( 0.775 1.712 1.542) 2.431 12.355 ( -1.150 3.145 2.054) 3.928 12.966 ( -9.704 -1.859 0.055) 9.881 13.366 ( -2.166 -6.818 5.448) 8.992 13.754 ( -5.748 8.582 -0.757) 10.357 13.955 ( -2.064 1.821 3.761) 4.660 14.109 ( 8.800 -1.592 12.191) 15.119 14.299 ( -17.341 1.546 0.565) 17.419 14.539 ( -15.387 -0.306 5.760) 16.432 14.891 ( -1.403 -1.267 -3.769) 4.216 15.158 ( 3.529 -3.483 1.187) 5.098 15.966 ( 9.860 5.974 -0.903) 11.564 16.063 ( 9.532 2.305 2.063) 10.021 16.692 ( 1.398 -0.557 -4.787) 5.018 16.968 ( -5.209 6.371 -0.163) 8.231 17.734 ( 7.338 -3.501 -7.193) 10.856 17.893 ( 7.511 -4.012 -7.943) 11.645 18.331 ( 7.208 -2.550 -0.815) 7.689 18.935 ( -13.148 -4.594 0.789) 13.950 20.299 ( -3.422 4.875 7.706) 9.739 21.346 ( -3.265 -3.731 -0.203) 4.962 21.554 ( 1.995 -1.489 -1.738) 3.036 21.779 ( 1.501 4.236 -3.249) 5.546 25.177 ( -0.771 -1.412 1.015) 1.902 25.307 ( 3.176 1.100 -1.582) 3.715 28.942 ( -0.855 -2.303 2.034) 3.189 29.132 ( -1.905 1.491 1.684) 2.947 34.298 ( 5.697 5.210 -2.083) 7.996 34.820 ( -7.268 -1.478 9.138) 11.769 37.655 ( 2.916 0.215 3.208) 4.340 37.924 ( 0.730 -3.490 -0.921) 3.683 40.259 ( 1.847 -4.353 2.792) 5.492 40.940 ( -5.753 0.724 -0.297) 5.806 41.628 ( -1.484 1.408 -3.536) 4.085 43.368 ( 7.866 7.717 -19.222) 22.157 ======================= Grid point 179 (85/205) ======================= q-point: (-0.33 0.11 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.920 ( -10.550 35.037 -1.198) 36.611 3.230 ( -55.677 3.152 28.523) 62.637 3.834 ( 2.135 -2.942 -2.058) 4.177 4.092 ( 5.806 7.872 13.630) 16.777 4.143 ( -12.940 -4.422 -4.295) 14.333 4.859 ( 6.655 19.827 9.029) 22.780 5.123 ( -0.419 -13.481 1.690) 13.593 5.181 ( 9.677 0.621 3.149) 10.195 5.413 ( 16.237 4.645 -1.155) 16.928 6.070 ( -12.645 4.176 -5.247) 14.313 6.360 ( 2.741 1.160 -4.381) 5.297 6.567 ( -7.738 -5.560 1.709) 9.680 6.790 ( 0.114 -7.350 3.565) 8.170 7.190 ( 2.477 -1.616 -8.681) 9.171 7.443 ( 4.580 3.408 -4.404) 7.210 7.546 ( 4.150 -9.986 6.067) 12.400 8.115 ( 9.234 -11.816 5.302) 15.906 8.318 ( -7.937 -4.368 -7.373) 11.681 8.477 ( 11.829 12.461 -10.678) 20.229 8.716 ( -2.408 -9.705 -7.955) 12.777 8.978 ( -3.207 0.794 -2.133) 3.932 9.181 ( 1.224 0.879 -2.211) 2.675 9.445 ( -5.163 6.358 -4.831) 9.509 9.860 ( 3.255 2.680 -7.744) 8.817 10.361 ( 0.323 -3.318 1.817) 3.797 10.435 ( 5.463 3.197 2.850) 6.942 10.702 ( 3.954 -5.182 0.866) 6.576 11.033 ( -0.268 -5.807 -1.500) 6.003 11.320 ( 11.048 -6.144 13.942) 18.820 11.549 ( 0.344 0.367 -1.684) 1.758 11.945 ( 10.716 3.804 5.395) 12.586 12.034 ( 1.136 -6.811 -1.100) 6.993 12.335 ( 3.851 1.776 1.860) 4.631 12.832 ( -14.444 0.191 0.201) 14.447 13.374 ( -13.638 0.850 0.193) 13.666 13.559 ( -2.428 4.591 -0.129) 5.195 13.855 ( -8.739 4.273 4.381) 10.669 14.088 ( -10.973 2.428 8.086) 13.845 14.306 ( 5.975 -3.461 6.563) 9.526 14.456 ( -9.580 -6.848 3.495) 12.284 14.861 ( -4.614 -1.876 -0.325) 4.991 15.252 ( 7.010 1.112 0.253) 7.102 15.948 ( 10.448 10.238 -2.172) 14.789 16.145 ( 11.110 4.404 1.209) 12.012 16.659 ( -6.071 7.763 -2.601) 10.193 16.790 ( -5.220 -2.755 -1.543) 6.100 17.858 ( 6.982 -5.024 -8.763) 12.280 18.033 ( 7.269 -5.284 -12.150) 15.113 18.485 ( 5.607 -4.855 3.608) 8.248 18.852 ( -7.641 -1.531 0.699) 7.824 20.237 ( -2.210 2.659 10.465) 11.021 21.343 ( -4.299 -1.619 0.168) 4.597 21.580 ( -0.012 -0.378 -1.280) 1.335 21.726 ( 4.320 3.842 -5.838) 8.216 25.181 ( 0.635 1.329 0.374) 1.519 25.316 ( 1.584 0.716 -0.837) 1.929 28.970 ( -0.762 -0.775 2.470) 2.699 29.097 ( -1.288 0.790 1.555) 2.168 34.248 ( 3.975 6.957 -0.306) 8.018 34.788 ( -15.401 -6.672 9.075) 19.081 37.691 ( 2.020 0.114 1.011) 2.261 37.968 ( -1.609 -2.647 -0.987) 3.251 40.392 ( 3.988 -5.617 5.139) 8.595 40.876 ( -2.627 0.164 -2.093) 3.363 41.537 ( -4.580 4.244 -0.040) 6.244 43.226 ( 6.518 10.632 -22.977) 26.143 ======================= Grid point 180 (86/205) ======================= q-point: (-0.22 0.11 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.229 ( -2.563 39.828 4.738) 40.191 2.578 ( -49.208 12.299 35.372) 61.838 3.871 ( 0.687 5.491 2.386) 6.026 4.016 ( 2.344 7.723 8.588) 11.785 4.112 ( -0.920 13.923 8.129) 16.148 4.560 ( -4.903 1.646 8.780) 10.190 5.146 ( -3.677 -4.954 -3.261) 6.978 5.508 ( 9.910 -1.736 -11.421) 15.220 5.619 ( 15.023 -13.762 8.751) 22.174 5.975 ( -1.778 -3.599 -3.167) 5.114 6.298 ( 4.118 9.765 -5.733) 12.049 6.566 ( -8.341 -5.322 1.459) 10.002 6.891 ( 3.884 1.554 1.807) 4.557 7.317 ( 5.035 -14.324 -11.291) 18.922 7.362 ( -5.995 0.296 -0.434) 6.018 7.824 ( 3.104 -12.298 2.766) 12.982 8.125 ( -13.679 4.712 -9.851) 17.503 8.308 ( 5.047 5.584 -8.345) 11.238 8.467 ( 12.878 -1.158 1.737) 13.046 8.823 ( -2.723 -7.647 -0.434) 8.129 8.914 ( -1.605 2.111 -1.967) 3.302 9.217 ( -2.653 -3.766 -3.360) 5.702 9.249 ( -2.040 2.812 -6.343) 7.232 9.767 ( -0.221 7.515 -5.309) 9.204 10.414 ( -0.953 -3.594 2.596) 4.535 10.549 ( 9.474 -2.736 2.054) 10.072 10.704 ( -3.596 2.661 -0.511) 4.502 11.225 ( 6.797 -14.326 -2.109) 15.996 11.541 ( -1.246 0.073 0.813) 1.490 11.667 ( 8.149 -8.688 15.256) 19.356 12.011 ( 5.403 2.172 6.337) 8.606 12.191 ( 6.407 -9.935 2.596) 12.103 12.357 ( -0.489 1.539 -2.264) 2.781 12.688 ( -1.916 2.019 2.183) 3.538 13.121 ( -10.415 6.489 -4.359) 13.022 13.458 ( -8.545 3.070 -2.469) 9.410 13.729 ( -9.016 0.452 8.633) 12.491 13.987 ( -3.775 3.759 10.385) 11.672 14.406 ( -3.369 -5.089 -0.082) 6.104 14.534 ( -3.972 -9.482 2.346) 10.545 14.888 ( 0.786 -4.023 7.099) 8.197 15.275 ( 5.092 5.168 1.320) 7.374 15.874 ( 10.938 13.922 -4.320) 18.225 16.150 ( 8.135 11.570 -2.372) 14.341 16.411 ( -7.166 6.026 2.675) 9.737 16.861 ( -3.002 -9.199 -5.122) 10.949 17.972 ( 2.513 -5.391 -8.529) 10.398 18.083 ( 1.112 -1.569 -16.503) 16.615 18.542 ( -10.478 -3.155 6.206) 12.580 18.894 ( 12.680 0.683 0.344) 12.703 20.276 ( 1.683 -3.111 14.323) 14.754 21.299 ( -4.688 0.344 -0.423) 4.720 21.556 ( -0.640 1.452 -0.737) 1.749 21.713 ( 6.380 3.107 -8.581) 11.135 25.152 ( 1.182 3.770 0.533) 3.986 25.314 ( -0.074 0.357 -0.823) 0.900 28.956 ( -1.636 1.685 2.604) 3.506 29.101 ( 0.902 -0.635 0.878) 1.410 34.195 ( 4.796 5.993 1.713) 7.865 34.722 ( -28.095 -11.673 9.546) 31.885 37.700 ( -0.445 0.351 -1.304) 1.422 37.948 ( -4.554 -0.225 -2.676) 5.286 40.540 ( -1.020 -6.176 6.540) 9.053 40.883 ( 7.275 -0.119 -3.764) 8.191 41.415 ( -2.747 5.193 5.216) 7.856 43.000 ( 7.943 15.894 -26.983) 32.308 ======================= Grid point 181 (87/205) ======================= q-point: (-0.11 0.11 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.761 ( 4.349 24.459 24.611) 34.970 2.099 ( -14.757 14.554 40.499) 45.495 3.452 ( 12.352 52.699 36.081) 65.050 3.908 ( -4.502 -0.745 3.331) 5.649 4.215 ( -0.655 -13.721 -2.046) 13.888 4.688 ( -3.612 -14.853 -1.686) 15.379 5.194 ( 1.130 -2.685 3.544) 4.588 5.607 ( 8.222 -4.421 -17.907) 20.194 5.889 ( 2.093 -5.537 0.439) 5.935 6.106 ( -1.937 7.598 -6.740) 10.340 6.123 ( 8.426 -2.713 3.558) 9.541 6.542 ( -3.475 -1.510 -2.980) 4.820 6.865 ( -0.724 3.779 0.580) 3.892 7.343 ( -8.013 -7.818 2.150) 11.399 7.601 ( 7.983 -13.852 -6.686) 17.330 7.767 ( -14.668 11.586 -18.959) 26.624 7.930 ( -2.910 -2.055 -6.895) 7.761 8.289 ( 6.310 -1.708 -3.112) 7.240 8.604 ( 5.483 4.483 0.221) 7.086 8.787 ( 4.347 6.190 6.177) 9.766 8.954 ( -7.342 -8.691 -2.012) 11.553 9.133 ( -3.443 -1.424 -3.320) 4.990 9.368 ( 0.144 -10.599 -1.152) 10.663 9.626 ( -0.405 6.021 -2.009) 6.360 10.487 ( -0.034 -4.844 3.814) 6.166 10.609 ( -3.006 2.266 0.918) 3.875 10.698 ( 5.256 -1.416 2.142) 5.850 11.526 ( -3.740 -2.006 2.354) 4.853 11.554 ( 10.405 -13.162 -1.983) 16.895 11.801 ( 2.467 2.450 5.290) 6.330 11.973 ( -13.756 -1.884 3.167) 14.241 12.218 ( -19.813 -4.750 0.685) 20.386 12.584 ( 12.508 -8.915 1.434) 15.427 12.813 ( 19.362 -0.908 -6.224) 20.358 13.025 ( 9.767 -3.992 7.756) 13.095 13.248 ( -10.917 4.460 -3.076) 12.188 13.683 ( -7.640 -2.208 10.118) 12.869 13.957 ( -1.366 1.873 9.893) 10.161 14.401 ( -7.154 -3.486 -0.615) 7.982 14.638 ( -3.745 -8.054 1.461) 9.002 15.048 ( 6.261 -3.939 8.228) 11.064 15.244 ( 4.379 4.756 3.337) 7.275 15.708 ( 1.727 13.464 -4.826) 14.407 15.981 ( 8.767 16.806 -7.953) 20.556 16.339 ( 2.199 5.683 4.039) 7.311 16.910 ( -9.636 -7.940 -4.251) 13.190 17.923 ( -9.620 -0.594 -10.032) 13.912 18.078 ( 3.263 -1.712 -9.424) 10.119 18.486 ( -7.136 -1.513 5.247) 8.985 19.003 ( 10.948 5.250 -1.636) 12.252 20.514 ( 6.834 -12.742 14.590) 20.541 21.226 ( -3.551 1.766 -1.649) 4.295 21.537 ( 0.717 0.580 -0.939) 1.316 21.677 ( 5.759 6.516 -9.673) 13.007 25.100 ( 0.786 4.360 1.285) 4.612 25.295 ( -1.105 0.554 -1.521) 1.960 28.915 ( -1.622 1.897 2.153) 3.297 29.124 ( 1.940 0.540 -0.242) 2.028 34.202 ( 6.627 3.033 4.838) 8.747 34.526 ( -40.870 -9.479 8.670) 42.841 37.632 ( -5.101 3.630 -2.411) 6.709 37.870 ( -2.678 1.624 -3.268) 4.526 40.588 ( -8.060 -4.918 3.325) 10.010 40.987 ( 7.783 0.154 -2.435) 8.157 41.449 ( 11.452 -2.080 9.093) 14.771 42.732 ( 17.803 21.055 -26.672) 38.362 ======================= Grid point 184 (88/205) ======================= q-point: ( 0.22 0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.006 ( 22.992 0.000 19.590) 30.206 3.157 ( 14.558 0.000 33.070) 36.133 3.490 ( -7.687 -0.000 -0.393) 7.697 4.328 ( -5.123 -0.000 -4.737) 6.977 4.852 ( 26.510 0.000 8.898) 27.963 5.112 ( 7.462 0.000 27.647) 28.636 5.249 ( -3.838 -0.000 -24.494) 24.793 5.715 ( -5.828 -0.000 -20.653) 21.460 5.825 ( -1.265 -0.000 -0.226) 1.285 5.969 ( 10.452 0.000 11.289) 15.384 5.993 ( 3.904 0.000 -4.781) 6.172 6.093 ( -11.221 -0.000 14.445) 18.292 6.672 ( -5.951 -0.000 12.620) 13.953 7.014 ( 2.220 0.000 -8.196) 8.491 7.154 ( -1.870 -0.000 -11.161) 11.317 7.485 ( -10.218 -0.000 -23.329) 25.469 8.015 ( -10.247 -0.000 6.175) 11.964 8.309 ( -1.454 -0.000 0.207) 1.469 8.422 ( 2.136 0.000 -5.354) 5.764 8.516 ( -0.219 -0.000 0.870) 0.897 9.133 ( 8.650 0.000 0.257) 8.654 9.160 ( -4.774 -0.000 -4.687) 6.690 9.400 ( -0.195 -0.000 0.366) 0.414 9.809 ( 9.271 0.000 0.594) 9.290 10.483 ( -5.207 -0.000 -4.836) 7.107 10.489 ( -7.800 -0.000 0.833) 7.844 10.801 ( 1.141 0.000 5.370) 5.490 11.265 ( -6.543 -0.000 2.548) 7.021 11.328 ( -8.362 -0.000 13.705) 16.055 11.627 ( -9.448 -0.000 -3.375) 10.033 11.740 ( -5.563 -0.000 -9.618) 11.111 11.998 ( 0.777 0.000 -2.425) 2.546 12.664 ( 6.303 0.000 -11.779) 13.359 12.846 ( -0.976 -0.000 7.791) 7.852 13.350 ( -17.371 -0.000 8.741) 19.446 13.747 ( 13.285 0.000 11.504) 17.574 13.951 ( -1.103 -0.000 12.616) 12.664 14.007 ( 10.728 0.000 1.352) 10.813 14.490 ( -6.546 -0.000 -7.488) 9.946 14.685 ( -11.172 -0.000 -1.649) 11.293 14.814 ( 4.333 0.000 4.385) 6.164 15.099 ( -5.555 -0.000 4.046) 6.872 15.769 ( 11.009 0.000 -14.736) 18.394 15.984 ( 5.228 0.000 11.069) 12.242 16.549 ( 14.118 0.000 -4.299) 14.758 16.982 ( 4.910 0.000 4.044) 6.362 17.673 ( -4.742 -0.000 -0.703) 4.794 18.035 ( -2.692 -0.000 -5.994) 6.570 18.388 ( 1.279 0.000 -8.865) 8.957 18.759 ( -9.834 -0.000 2.630) 10.180 20.678 ( -7.905 -0.000 2.237) 8.215 21.096 ( -0.339 -0.000 -4.049) 4.063 21.462 ( 0.161 0.000 1.978) 1.985 21.880 ( 3.707 0.000 -0.603) 3.756 25.043 ( -1.742 -0.000 3.857) 4.232 25.281 ( 3.896 0.000 -3.473) 5.219 28.852 ( -1.454 -0.000 1.750) 2.275 29.167 ( 0.928 0.000 -0.861) 1.266 34.158 ( 16.095 0.000 -7.772) 17.873 34.845 ( 5.943 0.000 16.614) 17.645 37.539 ( 2.884 0.000 5.465) 6.179 37.769 ( 0.747 0.000 -2.943) 3.036 40.213 ( -5.753 -0.000 -2.697) 6.354 41.286 ( -10.701 -0.000 -4.677) 11.679 41.415 ( 10.871 0.000 -1.765) 11.013 43.536 ( 16.640 0.000 -20.259) 26.216 ======================= Grid point 185 (89/205) ======================= q-point: ( 0.33 0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.273 ( 10.910 -0.079 14.885) 18.455 3.299 ( -5.885 -10.027 2.274) 11.847 3.660 ( 8.574 -3.262 25.411) 27.016 4.234 ( -3.262 -0.695 -7.151) 7.890 4.798 ( -7.702 17.857 -17.955) 26.469 5.195 ( 9.698 -0.781 -2.592) 10.068 5.269 ( -0.444 -2.030 26.940) 27.020 5.484 ( -10.220 9.695 -5.076) 14.973 5.803 ( -1.502 9.752 9.937) 14.004 5.874 ( -2.665 8.718 8.450) 12.431 6.185 ( 10.188 -19.285 -16.094) 27.106 6.392 ( 15.635 -10.548 12.811) 22.800 6.793 ( -0.207 -4.083 7.788) 8.796 7.009 ( 0.086 -5.410 -1.628) 5.651 7.021 ( 1.100 5.146 -9.038) 10.458 7.287 ( -8.968 -0.502 -19.351) 21.334 7.821 ( -11.327 5.787 2.382) 12.941 8.392 ( 6.890 -0.867 -16.174) 17.602 8.421 ( -1.586 -3.951 7.587) 8.700 8.613 ( -2.226 -8.784 4.411) 10.078 9.036 ( -3.431 4.229 -2.446) 5.970 9.213 ( 6.402 2.148 -0.367) 6.762 9.428 ( 5.152 -1.343 -4.738) 7.128 9.872 ( 9.209 6.757 -0.892) 11.457 10.338 ( -4.106 2.763 -0.385) 4.964 10.461 ( -7.434 -3.308 -2.099) 8.403 10.824 ( 1.575 2.396 2.737) 3.964 11.167 ( -2.030 8.844 8.979) 12.765 11.259 ( -3.052 2.259 4.042) 5.546 11.535 ( -12.308 -4.337 -1.105) 13.096 11.670 ( 2.593 -0.154 -9.719) 10.060 12.005 ( -6.452 -5.473 -3.672) 9.223 12.641 ( 1.303 5.024 -7.170) 8.851 12.885 ( -0.831 -1.848 8.409) 8.649 13.200 ( -8.497 0.757 6.029) 10.446 13.896 ( 2.332 -0.427 12.514) 12.736 13.954 ( 0.140 1.268 9.074) 9.163 14.108 ( 3.417 2.055 -3.124) 5.066 14.471 ( -4.843 -3.210 -5.939) 8.308 14.594 ( -1.182 -5.215 3.143) 6.203 14.803 ( -4.552 3.740 7.210) 9.311 15.057 ( -6.106 -0.305 3.622) 7.106 15.888 ( 13.677 -2.531 -14.111) 19.814 16.062 ( 1.970 0.431 10.068) 10.268 16.699 ( 13.016 0.089 -5.406) 14.095 17.047 ( 7.709 2.300 1.144) 8.126 17.640 ( -0.322 -0.856 -0.967) 1.331 17.934 ( -3.834 4.058 -4.051) 6.898 18.340 ( 2.003 3.303 -8.530) 9.364 18.718 ( -11.901 -8.480 1.701) 14.712 20.571 ( -5.326 4.042 2.383) 7.098 21.116 ( -0.679 -4.721 -3.954) 6.195 21.476 ( -0.231 -0.915 1.424) 1.709 21.898 ( 0.777 0.894 -0.223) 1.206 25.052 ( -2.199 -2.005 3.943) 4.940 25.317 ( 5.061 0.441 -3.607) 6.230 28.850 ( -1.502 -1.060 1.896) 2.641 29.170 ( -0.283 -0.210 -0.609) 0.703 34.316 ( 15.709 0.623 -7.607) 17.465 34.928 ( 0.507 2.351 14.622) 14.819 37.604 ( 3.497 -0.094 6.354) 7.253 37.784 ( 1.947 -1.322 -2.652) 3.546 40.160 ( -2.001 -0.236 -0.940) 2.224 41.125 ( -8.172 2.895 -2.092) 8.919 41.551 ( 7.564 -2.761 -3.337) 8.716 43.593 ( 10.776 2.820 -19.361) 22.337 ======================= Grid point 186 (90/205) ======================= q-point: ( 0.44 0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.346 ( -10.458 -11.263 -9.875) 18.269 3.481 ( -6.261 -8.455 16.702) 19.739 3.783 ( -1.990 4.337 26.068) 26.502 4.242 ( 7.503 1.933 -1.636) 7.919 4.386 ( -8.660 8.661 -14.953) 19.329 5.123 ( -16.807 11.650 -1.940) 20.541 5.245 ( 1.346 2.643 1.207) 3.202 5.359 ( -3.262 0.217 16.737) 17.053 5.652 ( 6.818 14.886 9.278) 18.819 5.871 ( 14.647 4.341 12.237) 19.573 6.564 ( -2.909 -20.018 -11.358) 23.199 6.576 ( -4.861 7.331 -15.048) 17.430 6.727 ( 4.213 -7.216 5.496) 10.001 6.946 ( -1.378 -3.521 -4.229) 5.673 7.143 ( 2.115 5.900 -3.548) 7.203 7.425 ( 11.899 -20.372 11.510) 26.251 7.671 ( -2.104 2.304 -3.932) 5.020 8.314 ( -1.570 12.878 -6.991) 14.737 8.425 ( -2.543 -3.496 -3.698) 5.689 8.759 ( -1.175 -7.311 2.984) 7.984 8.970 ( 1.404 0.355 -4.282) 4.520 9.277 ( 6.698 -0.718 -0.297) 6.743 9.499 ( 7.789 0.470 -8.336) 11.418 9.822 ( 4.147 5.291 -2.750) 7.263 10.337 ( 1.423 -2.189 5.584) 6.164 10.396 ( -7.090 -0.969 -2.885) 7.716 10.758 ( 0.280 7.661 1.126) 7.749 11.069 ( 3.015 7.840 7.015) 10.944 11.216 ( -3.571 -0.531 -1.659) 3.973 11.460 ( -6.370 -3.497 -3.582) 8.101 11.751 ( 8.902 -2.180 -0.663) 9.189 11.971 ( -9.601 -4.115 -0.948) 10.489 12.523 ( 0.555 7.036 -1.861) 7.299 12.918 ( -3.280 -1.312 3.584) 5.033 13.182 ( -3.873 -3.741 5.512) 7.706 13.882 ( -10.022 0.127 0.642) 10.043 13.976 ( 1.556 2.180 10.051) 10.402 14.090 ( -4.827 -2.273 0.507) 5.359 14.358 ( -4.796 3.442 0.732) 5.949 14.663 ( -10.582 5.884 9.925) 15.656 14.801 ( 6.733 -6.590 -2.014) 9.634 15.022 ( -0.769 -1.920 3.291) 3.887 16.021 ( 11.237 -0.735 -8.185) 13.921 16.124 ( 5.211 0.033 4.362) 6.796 16.770 ( 7.304 4.089 -3.782) 9.186 17.099 ( 5.821 2.481 -0.588) 6.355 17.681 ( 4.331 -1.243 -3.098) 5.468 17.829 ( -2.072 1.119 -3.572) 4.278 18.301 ( 3.291 1.178 -5.176) 6.245 18.721 ( -11.772 -8.533 0.285) 14.542 20.456 ( -4.094 4.721 3.251) 7.044 21.178 ( -1.489 -6.048 -3.307) 7.052 21.498 ( -0.050 -1.667 0.335) 1.701 21.872 ( -1.135 1.807 -0.393) 2.170 25.082 ( -2.296 -3.161 3.501) 5.246 25.355 ( 5.543 1.088 -3.479) 6.634 28.866 ( -1.269 -2.035 2.083) 3.177 29.159 ( -1.407 0.221 0.027) 1.424 34.433 ( 12.616 3.051 -4.961) 13.896 34.901 ( -4.312 4.164 10.482) 12.075 37.665 ( 2.837 0.334 5.784) 6.451 37.832 ( 2.621 -2.221 -1.870) 3.912 40.173 ( 2.033 -1.229 2.039) 3.131 40.994 ( -5.961 2.406 -0.645) 6.461 41.634 ( 3.505 -0.884 -3.245) 4.858 43.563 ( 7.371 4.561 -19.231) 21.094 ======================= Grid point 187 (91/205) ======================= q-point: (-0.44 0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.160 ( -34.153 -2.998 2.471) 34.373 3.582 ( -14.267 -6.636 11.562) 19.526 3.715 ( -3.781 5.603 12.381) 14.106 4.151 ( 5.401 9.834 -1.333) 11.299 4.337 ( -1.418 3.712 -2.242) 4.563 4.806 ( -5.343 1.041 -2.820) 6.131 5.226 ( 6.027 5.311 -0.686) 8.062 5.380 ( 7.205 4.426 15.497) 17.655 5.599 ( 2.053 2.165 2.938) 4.187 6.095 ( 19.981 2.937 9.390) 22.272 6.306 ( -9.122 4.934 -8.506) 13.413 6.557 ( -17.373 -3.094 1.178) 17.686 6.807 ( -5.243 3.965 -4.432) 7.928 7.068 ( -0.052 -16.914 -5.980) 17.940 7.256 ( 13.113 -2.246 5.053) 14.232 7.619 ( 3.203 4.446 -5.103) 7.488 7.860 ( 9.171 -9.875 8.429) 15.896 8.062 ( -1.062 5.247 -4.935) 7.281 8.455 ( -1.189 -5.965 -9.624) 11.385 8.806 ( -1.600 -0.737 0.322) 1.791 8.954 ( 3.310 3.779 -7.482) 9.012 9.327 ( 0.755 2.497 -3.214) 4.140 9.526 ( 7.378 2.018 -2.927) 8.190 9.838 ( 2.332 -2.777 -8.548) 9.286 10.316 ( -4.862 -0.104 1.848) 5.202 10.452 ( 2.115 -5.963 3.559) 7.260 10.652 ( 3.917 7.864 1.142) 8.860 11.027 ( -1.414 2.654 2.897) 4.176 11.171 ( -3.149 -1.971 -0.229) 3.722 11.508 ( 3.626 -4.234 -1.767) 5.847 11.822 ( -5.152 -2.417 4.064) 6.993 12.022 ( 11.438 -2.055 1.923) 11.779 12.443 ( 3.338 4.876 -1.803) 6.178 12.862 ( -7.672 1.502 1.906) 8.047 13.227 ( -8.114 -6.243 5.583) 11.661 13.720 ( -9.917 2.936 -2.009) 10.536 13.932 ( -11.753 1.067 -2.216) 12.007 14.064 ( -4.367 -3.071 8.050) 9.659 14.326 ( 4.795 3.603 4.747) 7.649 14.473 ( -9.854 6.257 10.010) 15.377 14.838 ( -3.469 -0.298 -0.419) 3.507 15.179 ( 10.403 -5.050 0.764) 11.589 16.116 ( 8.259 0.115 -3.707) 9.054 16.214 ( 8.775 0.649 0.583) 8.818 16.743 ( 4.898 5.294 -3.530) 8.029 17.034 ( -3.899 8.357 0.173) 9.223 17.732 ( 3.860 -1.948 -5.186) 6.752 17.859 ( 4.163 -4.865 -7.741) 10.046 18.344 ( 1.013 -3.279 1.713) 3.836 18.724 ( -5.710 -6.213 -1.080) 8.507 20.353 ( -3.973 4.215 5.156) 7.755 21.234 ( -2.373 -5.074 -2.674) 6.207 21.530 ( 0.194 -2.206 -0.838) 2.368 21.818 ( -1.666 2.184 -1.133) 2.971 25.122 ( -1.958 -3.398 2.731) 4.779 25.381 ( 5.092 2.010 -3.044) 6.264 28.901 ( -0.692 -2.691 2.429) 3.691 29.132 ( -1.963 0.831 0.714) 2.248 34.470 ( 8.411 6.383 -1.444) 10.657 34.796 ( -7.205 4.143 6.551) 10.582 37.701 ( 1.258 0.589 3.843) 4.087 37.891 ( 2.113 -2.144 -1.374) 3.309 40.261 ( 4.944 -2.461 5.514) 7.804 40.906 ( -2.655 1.701 -0.682) 3.226 41.633 ( -0.945 1.677 -1.616) 2.514 43.476 ( 5.342 5.896 -20.565) 22.050 ======================= Grid point 188 (92/205) ======================= q-point: (-0.33 0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.777 ( -37.862 0.686 18.026) 41.940 3.273 ( -13.787 20.630 8.465) 26.218 3.769 ( 1.529 -4.484 -0.177) 4.741 4.052 ( -8.467 12.042 -2.838) 14.991 4.146 ( 0.349 -1.088 0.803) 1.397 4.918 ( 1.053 -8.225 -0.335) 8.299 5.337 ( 23.727 -0.779 -1.197) 23.770 5.433 ( 9.049 11.055 13.400) 19.587 5.635 ( -1.193 2.034 6.555) 6.966 5.973 ( -10.769 7.815 -6.249) 14.700 6.340 ( 11.160 1.196 3.270) 11.691 6.540 ( -0.318 -1.888 -4.056) 4.485 6.610 ( -11.292 -3.843 11.633) 16.662 7.289 ( 5.402 4.238 -2.408) 7.276 7.338 ( -6.927 -12.834 -2.174) 14.745 7.549 ( 4.840 5.175 -4.705) 8.506 8.044 ( 3.533 -6.551 -1.680) 7.630 8.142 ( -0.129 -7.797 0.921) 7.852 8.512 ( -0.168 -7.255 -9.201) 11.718 8.746 ( 5.803 9.363 -7.265) 13.196 8.912 ( -0.533 -1.410 -6.065) 6.250 9.235 ( -1.640 4.323 -2.306) 5.167 9.507 ( 0.348 7.188 -3.791) 8.134 9.855 ( 1.189 -1.782 -9.365) 9.607 10.313 ( -1.556 -2.773 1.968) 3.739 10.564 ( 2.570 -0.505 4.029) 4.805 10.665 ( 5.936 -2.444 -0.917) 6.485 10.954 ( -3.210 -0.298 -0.337) 3.241 11.276 ( -1.826 -10.368 8.868) 13.765 11.578 ( 2.465 -0.104 -1.179) 2.735 11.871 ( -3.581 -8.592 4.282) 10.246 12.190 ( 13.776 3.831 4.068) 14.867 12.427 ( 3.902 2.810 -4.351) 6.485 12.738 ( -5.416 2.701 5.521) 8.192 13.181 ( -14.209 -3.276 0.385) 14.587 13.571 ( -6.330 3.913 -1.892) 7.679 13.761 ( -9.511 0.702 -1.177) 9.609 14.110 ( -0.411 -0.139 9.931) 9.940 14.291 ( -5.490 0.417 1.298) 5.657 14.391 ( 0.339 2.048 7.255) 7.546 14.818 ( -0.899 -0.854 4.711) 4.872 15.346 ( 8.393 -0.994 -0.291) 8.457 16.181 ( 8.894 3.091 -3.055) 9.899 16.314 ( 8.829 0.299 1.548) 8.969 16.710 ( 3.233 2.510 -6.636) 7.797 16.764 ( -10.180 13.897 1.247) 17.272 17.800 ( 1.539 -4.784 -6.940) 8.569 17.954 ( 3.090 -5.399 -12.842) 14.269 18.394 ( -8.593 -5.422 7.870) 12.852 18.822 ( 9.151 -4.802 -0.946) 10.378 20.278 ( -3.740 2.342 8.305) 9.405 21.259 ( -2.584 -3.004 -2.483) 4.676 21.557 ( -0.468 -1.534 -1.106) 1.948 21.767 ( -0.287 1.339 -3.140) 3.426 25.160 ( -1.460 -2.653 1.829) 3.538 25.383 ( 3.604 3.064 -2.324) 5.270 28.949 ( -0.175 -2.319 2.846) 3.676 29.098 ( -1.581 0.825 1.196) 2.147 34.424 ( 3.701 8.032 1.699) 9.005 34.663 ( -8.145 3.938 4.543) 10.124 37.706 ( -0.984 0.423 1.683) 1.995 37.928 ( 0.682 -0.924 -1.956) 2.268 40.389 ( 3.313 -3.008 8.217) 9.357 40.887 ( 4.008 0.510 -1.579) 4.338 41.558 ( -3.511 3.539 1.146) 5.115 43.341 ( 4.416 7.430 -23.108) 24.671 ======================= Grid point 189 (93/205) ======================= q-point: (-0.22 0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.433 ( -23.902 8.674 31.833) 40.741 2.810 ( 1.926 28.101 3.982) 28.447 3.817 ( -1.062 -0.086 -3.863) 4.007 3.886 ( -2.289 -3.123 0.603) 3.918 4.190 ( -4.304 -8.205 -5.756) 10.908 5.024 ( 0.708 1.897 7.313) 7.588 5.205 ( 8.026 34.544 16.936) 39.301 5.510 ( -3.843 -3.014 -5.134) 7.087 5.709 ( 17.227 -5.851 11.821) 21.696 5.921 ( 5.830 -2.710 -7.242) 9.684 6.385 ( -6.779 -2.984 2.551) 7.834 6.464 ( 5.244 5.361 -0.965) 7.561 6.845 ( 2.691 -13.819 4.000) 14.636 7.235 ( 2.620 3.060 -6.502) 7.649 7.282 ( -9.667 0.787 1.888) 9.881 7.659 ( 0.081 -9.897 -0.517) 9.911 7.963 ( -13.887 1.094 -10.001) 17.149 8.328 ( 3.898 -6.961 -3.400) 8.672 8.605 ( -1.679 -8.347 -5.422) 10.094 8.651 ( 9.648 6.081 -9.731) 14.992 8.920 ( 1.682 0.149 -4.515) 4.820 9.165 ( -2.385 1.263 -1.179) 2.945 9.339 ( 0.915 8.951 -4.320) 9.981 9.817 ( -1.379 3.370 -5.709) 6.772 10.363 ( -0.144 -3.398 2.121) 4.008 10.639 ( 5.945 -1.341 2.668) 6.653 10.669 ( -4.680 1.021 -1.186) 4.935 11.105 ( 7.719 -12.243 1.203) 14.523 11.402 ( -11.073 -8.346 7.560) 15.793 11.633 ( 0.671 -5.798 3.967) 7.057 11.948 ( -8.989 -5.823 1.409) 10.802 12.207 ( -4.970 6.540 2.851) 8.695 12.372 ( 7.212 1.043 -2.152) 7.598 12.831 ( 16.165 -1.415 6.647) 17.536 13.064 ( -4.949 1.238 -3.657) 6.277 13.408 ( -7.356 3.953 -5.085) 9.777 13.669 ( -7.117 1.418 5.459) 9.080 14.099 ( -0.442 5.311 11.735) 12.888 14.283 ( -3.418 -3.827 -0.619) 5.168 14.429 ( 1.879 -3.993 2.719) 5.184 14.901 ( 4.889 -3.368 8.330) 10.229 15.399 ( 3.307 2.923 0.996) 4.525 16.173 ( 7.499 11.596 -4.477) 14.517 16.380 ( -2.237 7.310 4.408) 8.824 16.470 ( 1.718 3.817 2.632) 4.945 16.676 ( -1.994 -0.723 -11.901) 12.088 17.825 ( -6.244 -4.601 -9.170) 12.011 17.995 ( 1.478 -3.756 -12.687) 13.314 18.392 ( -9.109 -4.405 7.800) 12.776 19.041 ( 14.151 -3.121 -0.244) 14.493 20.280 ( -1.987 -2.576 12.410) 12.829 21.252 ( -1.459 -0.627 -2.797) 3.216 21.553 ( -1.253 0.047 -0.525) 1.359 21.750 ( 1.897 -0.058 -6.004) 6.297 25.180 ( -0.973 -0.791 1.011) 1.611 25.351 ( 1.334 3.566 -1.522) 4.100 28.970 ( -1.118 0.650 2.597) 2.901 29.098 ( 0.514 -1.264 1.634) 2.129 34.333 ( -2.674 5.546 4.015) 7.350 34.518 ( -5.117 6.067 4.652) 9.200 37.676 ( -3.627 0.450 -0.050) 3.655 37.917 ( -0.419 1.068 -2.996) 3.208 40.464 ( -3.226 -2.283 7.102) 8.128 40.975 ( 9.294 -0.795 -0.724) 9.357 41.488 ( 0.722 2.680 3.994) 4.864 43.171 ( 6.031 8.972 -25.512) 27.708 ======================= Grid point 190 (94/205) ======================= q-point: (-0.11 0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.167 ( -0.975 19.902 28.830) 35.046 2.625 ( 22.933 17.686 19.107) 34.695 3.823 ( 1.184 -1.849 -0.927) 2.384 3.966 ( -3.231 -7.815 2.407) 8.793 4.244 ( -4.287 -8.007 -11.845) 14.926 4.660 ( 7.266 33.539 24.353) 42.080 5.239 ( 7.939 -2.733 8.509) 11.954 5.535 ( -1.078 -5.320 -4.840) 7.272 5.866 ( -0.057 -0.574 8.705) 8.725 6.051 ( 3.394 -0.492 -10.657) 11.195 6.359 ( 3.757 7.255 6.749) 10.597 6.454 ( 2.693 -3.738 -4.476) 6.423 6.906 ( -7.010 4.217 -2.467) 8.545 7.144 ( -5.619 -2.946 0.954) 6.416 7.434 ( 6.436 -13.459 -4.425) 15.561 7.669 ( -13.334 0.388 -9.102) 16.149 7.776 ( -6.156 -2.857 -4.372) 8.072 8.357 ( 4.655 1.893 -9.211) 10.492 8.675 ( -3.314 -7.636 -9.195) 12.404 8.755 ( 6.244 -3.905 -2.027) 7.639 8.884 ( 2.170 4.275 -2.123) 5.243 9.099 ( -1.314 0.602 -4.536) 4.761 9.302 ( 3.265 0.221 3.446) 4.753 9.693 ( -2.156 6.075 -2.710) 6.993 10.422 ( -1.695 -3.547 3.390) 5.191 10.595 ( -3.980 0.103 -0.119) 3.983 10.736 ( 2.931 -0.974 3.493) 4.662 11.288 ( -16.784 -10.781 3.047) 20.179 11.502 ( 7.510 -10.298 0.533) 12.756 11.758 ( -2.340 -7.936 3.308) 8.911 11.830 ( -14.434 2.422 2.468) 14.843 12.023 ( -7.243 2.946 -0.102) 7.820 12.579 ( 9.673 -9.320 4.623) 14.206 12.987 ( 7.101 5.380 -9.941) 13.350 13.133 ( 17.670 -4.439 7.059) 19.538 13.238 ( -4.731 6.481 -4.126) 9.022 13.598 ( -7.236 -1.728 8.069) 10.975 14.050 ( -1.721 4.686 11.023) 12.101 14.321 ( 1.515 -2.685 2.014) 3.682 14.545 ( 3.185 -4.200 1.135) 5.392 15.092 ( 8.525 -5.601 7.219) 12.496 15.352 ( -1.911 4.576 2.532) 5.568 15.889 ( -6.526 16.499 -2.650) 17.939 16.296 ( 9.456 9.014 -0.187) 13.065 16.503 ( 1.310 8.154 -7.853) 11.396 16.618 ( -6.614 -9.523 0.078) 11.595 17.745 ( -8.046 -2.728 -8.593) 12.084 18.023 ( 0.517 -3.156 -9.103) 9.649 18.389 ( -6.020 -3.486 4.231) 8.142 19.177 ( 7.727 3.031 -1.710) 8.475 20.423 ( -0.470 -9.820 14.079) 17.172 21.229 ( 1.283 1.619 -3.092) 3.718 21.535 ( -0.881 0.169 -1.010) 1.350 21.750 ( 3.254 0.853 -7.112) 7.868 25.166 ( -0.348 2.106 0.847) 2.297 25.298 ( -0.756 2.453 -1.221) 2.843 28.937 ( -1.390 2.050 1.994) 3.180 29.141 ( 1.323 -1.115 1.310) 2.170 34.192 ( -11.026 4.180 4.576) 12.648 34.441 ( 5.932 5.916 6.935) 10.876 37.606 ( -4.824 1.665 -0.409) 5.119 37.871 ( -0.266 2.192 -3.300) 3.971 40.455 ( -6.811 -1.951 3.147) 7.753 41.056 ( 2.949 0.309 2.763) 4.053 41.559 ( 8.923 -1.280 1.452) 9.131 43.038 ( 14.027 8.116 -24.944) 29.746 ======================= Grid point 194 (95/205) ======================= q-point: ( 0.33 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.084 ( -7.303 -0.000 -3.708) 8.190 3.348 ( -11.424 -0.000 18.247) 21.528 3.898 ( 8.533 0.000 27.574) 28.864 4.202 ( 6.045 0.000 -3.401) 6.936 4.826 ( -12.345 -0.000 -21.333) 24.648 4.978 ( -9.638 -0.000 -7.384) 12.141 5.384 ( -0.749 -0.000 -3.635) 3.711 5.621 ( 7.729 0.000 9.584) 12.312 5.649 ( -18.192 -0.000 2.647) 18.384 5.981 ( 1.781 0.000 22.631) 22.701 6.265 ( 10.388 0.000 5.340) 11.680 6.555 ( 19.632 0.000 11.508) 22.756 6.883 ( 9.347 0.000 8.066) 12.346 6.935 ( -3.271 -0.000 -8.730) 9.323 7.018 ( -8.006 -0.000 -25.066) 26.313 7.117 ( 9.258 0.000 -7.274) 11.774 7.742 ( -10.403 -0.000 2.809) 10.776 8.354 ( -5.173 -0.000 0.268) 5.180 8.467 ( 12.335 0.000 -3.678) 12.872 8.563 ( 0.669 0.000 5.659) 5.699 8.987 ( -6.885 -0.000 -0.526) 6.905 9.315 ( 5.993 0.000 -1.853) 6.273 9.454 ( 5.237 0.000 -4.284) 6.766 10.043 ( 8.214 0.000 -4.055) 9.161 10.292 ( -5.579 -0.000 -7.168) 9.083 10.331 ( -6.019 -0.000 5.024) 7.841 10.894 ( 4.050 0.000 1.368) 4.274 11.194 ( -4.070 -0.000 -0.454) 4.095 11.328 ( -9.596 -0.000 -4.007) 10.399 11.353 ( -2.171 -0.000 16.621) 16.763 11.702 ( 11.749 0.000 -9.528) 15.127 11.828 ( -10.751 -0.000 -5.437) 12.047 12.675 ( 2.475 0.000 -11.935) 12.188 12.878 ( -5.399 -0.000 12.227) 13.366 13.137 ( -6.131 -0.000 7.495) 9.683 13.910 ( -8.954 -0.000 1.998) 9.174 13.956 ( -1.473 -0.000 9.458) 9.572 14.066 ( -7.463 -0.000 -0.805) 7.506 14.487 ( -4.960 -0.000 8.121) 9.516 14.585 ( 18.634 0.000 -7.002) 19.906 14.784 ( -9.822 -0.000 9.117) 13.401 15.015 ( -3.841 -0.000 4.544) 5.950 16.008 ( 18.757 0.000 -14.973) 24.000 16.090 ( -2.547 -0.000 8.539) 8.911 16.839 ( 12.147 0.000 -4.174) 12.844 17.164 ( 7.168 0.000 1.227) 7.272 17.629 ( 1.858 0.000 -1.761) 2.560 17.902 ( -5.637 -0.000 -1.116) 5.747 18.388 ( 6.771 0.000 -12.838) 14.514 18.488 ( -14.892 -0.000 4.396) 15.527 20.550 ( -4.588 -0.000 0.756) 4.650 21.054 ( -0.210 -0.000 -4.596) 4.601 21.469 ( -0.830 -0.000 1.763) 1.948 21.900 ( -1.732 -0.000 0.603) 1.834 25.026 ( -2.351 -0.000 4.373) 4.965 25.371 ( 5.706 0.000 -3.822) 6.868 28.832 ( -1.441 -0.000 2.052) 2.507 29.159 ( -0.783 -0.000 -1.043) 1.304 34.483 ( 15.695 0.000 -6.890) 17.141 34.980 ( -4.431 -0.000 12.179) 12.960 37.671 ( 2.973 0.000 7.360) 7.938 37.794 ( 3.313 0.000 -2.409) 4.096 40.158 ( 2.157 0.000 1.397) 2.570 41.047 ( -7.293 -0.000 0.185) 7.295 41.608 ( 6.741 0.000 -4.211) 7.949 43.639 ( 6.957 0.000 -20.167) 21.333 ======================= Grid point 195 (96/205) ======================= q-point: ( 0.44 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.034 ( -12.360 -2.289 -0.882) 12.601 3.287 ( -12.933 -8.614 15.329) 21.827 3.965 ( -5.747 6.938 23.466) 25.136 4.289 ( 4.824 3.835 -9.393) 11.234 4.505 ( 3.346 6.111 -8.795) 11.220 4.974 ( -11.656 -11.065 -7.859) 17.890 5.153 ( -11.707 12.226 -6.551) 18.151 5.433 ( -9.629 -0.078 10.774) 14.450 5.946 ( 6.293 -13.620 8.975) 17.483 6.024 ( 5.975 11.802 20.182) 24.131 6.431 ( 3.878 -0.517 3.267) 5.098 6.566 ( -0.128 8.745 -11.909) 14.775 6.774 ( -1.553 4.765 -10.138) 11.309 6.899 ( 9.131 2.034 2.811) 9.769 7.171 ( 5.214 -12.409 -6.955) 15.151 7.326 ( 10.207 -8.956 5.526) 14.660 7.699 ( 5.652 0.408 1.522) 5.867 8.296 ( -4.618 -1.566 -5.432) 7.300 8.496 ( -0.711 8.804 2.897) 9.296 8.670 ( 3.273 -5.261 4.703) 7.779 8.943 ( -0.847 -3.366 -0.346) 3.488 9.349 ( 3.799 1.197 -2.661) 4.790 9.526 ( 7.250 -2.340 -7.142) 10.443 9.967 ( -0.210 8.939 -6.064) 10.804 10.250 ( -7.259 -3.901 -4.146) 9.224 10.336 ( 0.173 -1.957 6.647) 6.931 10.890 ( 2.878 5.865 -0.569) 6.558 11.132 ( -4.383 -0.383 -5.027) 6.681 11.179 ( -5.532 4.342 -2.352) 7.415 11.396 ( -0.915 -1.601 9.505) 9.682 11.725 ( -11.022 -4.483 -0.559) 11.912 11.903 ( 20.416 -3.139 -3.458) 20.944 12.610 ( 1.214 4.389 -7.856) 9.080 12.861 ( -5.951 -1.609 6.103) 8.675 13.106 ( -7.668 -1.122 8.397) 11.426 13.784 ( -8.174 1.567 -1.454) 8.448 13.892 ( -13.519 -1.940 -1.324) 13.722 14.051 ( 0.953 0.749 9.027) 9.107 14.453 ( 0.518 3.507 6.305) 7.234 14.664 ( -9.897 4.204 10.069) 14.731 14.776 ( 4.381 -3.738 -4.300) 7.187 15.039 ( 6.625 -2.065 3.426) 7.739 16.077 ( -1.278 -0.497 2.871) 3.181 16.197 ( 16.053 -1.702 -10.350) 19.176 16.922 ( 7.716 3.495 -1.149) 8.548 17.209 ( 3.997 3.469 0.807) 5.354 17.681 ( 3.935 -2.933 -3.084) 5.796 17.810 ( -4.528 2.320 -0.992) 5.184 18.309 ( -7.347 1.046 0.880) 7.473 18.500 ( 1.981 -6.561 -7.646) 10.268 20.476 ( -4.125 2.839 0.457) 5.028 21.069 ( -0.272 -3.988 -4.659) 6.138 21.472 ( -1.006 -1.081 1.346) 1.998 21.865 ( -3.351 0.748 0.745) 3.513 25.030 ( -2.345 -1.803 4.184) 5.124 25.419 ( 5.441 0.462 -3.739) 6.618 28.834 ( -1.053 -1.202 2.245) 2.756 29.143 ( -1.274 0.041 -0.922) 1.573 34.618 ( 13.695 2.535 -4.090) 14.515 34.922 ( -7.958 2.583 7.877) 11.491 37.721 ( 1.017 0.444 6.629) 6.721 37.840 ( 4.155 -0.929 -1.654) 4.567 40.224 ( 6.329 -0.292 4.832) 7.968 40.969 ( -4.521 1.608 2.938) 5.626 41.650 ( 2.714 -0.159 -5.343) 5.995 43.608 ( 4.769 2.245 -20.925) 21.578 ======================= Grid point 196 (97/205) ======================= q-point: (-0.44 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.802 ( -23.059 2.633 4.691) 23.678 3.386 ( -9.519 -6.197 11.202) 15.953 3.827 ( -3.877 7.061 14.833) 16.879 4.156 ( -1.078 0.417 -9.672) 9.741 4.672 ( 14.229 5.134 6.942) 16.644 4.702 ( -13.265 9.565 -7.540) 18.009 5.057 ( -5.278 -12.408 -8.066) 15.712 5.456 ( -3.463 -6.624 11.678) 13.865 5.897 ( 5.036 19.584 -0.054) 20.221 6.139 ( -14.292 -6.528 11.904) 19.712 6.320 ( 3.721 -4.491 1.963) 6.154 6.513 ( 2.675 8.033 -8.076) 11.701 6.819 ( 13.794 -0.539 -2.139) 13.969 6.880 ( -1.696 5.407 2.761) 6.304 7.402 ( 10.224 -4.867 3.947) 11.992 7.625 ( 6.057 -12.633 -5.043) 14.890 7.802 ( 5.568 -1.058 4.923) 7.507 8.245 ( -0.362 6.816 -4.825) 8.359 8.308 ( -3.619 1.616 -4.073) 5.683 8.749 ( -0.771 -1.640 6.147) 6.408 9.023 ( 2.729 -1.278 -3.194) 4.391 9.340 ( -0.009 1.761 -4.065) 4.430 9.616 ( 7.879 -0.924 -9.276) 12.206 9.818 ( -1.786 3.947 -5.767) 7.213 10.216 ( -6.585 -4.019 1.047) 7.785 10.391 ( -2.065 -3.607 3.831) 5.653 10.822 ( 4.428 6.431 -0.949) 7.865 11.028 ( -3.922 3.547 -1.954) 5.638 11.092 ( -4.076 -1.408 -2.353) 4.913 11.483 ( 1.007 -5.372 -0.999) 5.556 11.687 ( -8.327 -3.949 8.003) 12.206 12.206 ( 22.353 -1.769 1.648) 22.483 12.541 ( 3.347 3.930 -6.637) 8.408 12.828 ( -4.158 1.092 4.166) 5.987 13.035 ( -14.070 -3.513 4.941) 15.320 13.680 ( -4.269 2.890 -0.586) 5.189 13.744 ( -11.195 -0.798 -1.500) 11.323 14.088 ( 0.786 0.494 8.793) 8.842 14.402 ( -3.095 4.108 1.147) 5.270 14.538 ( -4.108 5.250 9.637) 11.718 14.787 ( -3.757 -1.593 2.228) 4.649 15.237 ( 11.721 -4.757 -0.005) 12.650 16.094 ( -3.031 -3.889 1.209) 5.076 16.354 ( 15.304 0.716 -8.785) 17.660 16.907 ( 4.872 6.855 0.019) 8.410 17.136 ( -1.954 8.368 1.299) 8.691 17.725 ( -0.446 0.560 -2.995) 3.080 17.784 ( 1.181 -4.928 -5.820) 7.717 18.243 ( -9.544 -3.705 4.958) 11.375 18.634 ( 8.972 -6.063 -6.759) 12.765 20.378 ( -4.414 3.404 1.834) 5.868 21.121 ( -0.332 -5.004 -4.633) 6.827 21.490 ( -0.880 -2.032 0.526) 2.276 21.809 ( -3.759 1.084 0.324) 3.926 25.058 ( -2.130 -3.040 3.494) 5.098 25.451 ( 4.329 1.148 -3.379) 5.610 28.864 ( -0.350 -2.364 2.613) 3.541 29.121 ( -1.422 0.369 -0.442) 1.534 34.667 ( 5.583 6.641 0.862) 8.719 34.806 ( -3.938 3.576 2.474) 5.866 37.730 ( -1.423 0.911 4.719) 5.012 37.899 ( 3.997 -0.786 -1.207) 4.248 40.345 ( 8.293 -0.158 8.627) 11.968 40.922 ( -0.490 1.620 3.237) 3.653 41.629 ( -1.689 0.961 -4.622) 5.014 43.520 ( 3.417 4.011 -22.235) 22.851 ======================= Grid point 197 (98/205) ======================= q-point: (-0.33 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.538 ( -15.657 3.071 12.094) 20.021 3.310 ( -12.931 1.857 13.765) 18.977 3.801 ( 4.026 2.811 2.046) 5.320 4.138 ( 1.663 5.499 -4.924) 7.567 4.262 ( -5.975 16.668 -3.857) 18.122 4.851 ( -0.147 -9.132 2.097) 9.370 5.238 ( 3.812 -10.833 -9.854) 15.132 5.627 ( -1.116 -10.164 15.377) 18.467 5.681 ( 6.270 7.487 -3.776) 10.470 6.161 ( -0.336 18.420 5.300) 19.170 6.222 ( -11.826 -15.241 11.608) 22.514 6.628 ( 10.062 1.901 3.401) 10.790 6.702 ( 0.247 6.999 0.806) 7.049 6.996 ( 3.097 -5.990 -0.604) 6.770 7.493 ( 6.613 7.465 -1.704) 10.117 7.674 ( 2.553 6.031 -5.234) 8.383 7.921 ( -5.708 -5.950 -2.797) 8.707 8.152 ( 5.003 2.058 6.026) 8.098 8.341 ( -0.932 -9.386 -13.480) 16.452 8.797 ( 1.515 -1.950 3.894) 4.611 8.970 ( 1.844 6.624 -9.352) 11.607 9.260 ( -2.359 3.652 -1.834) 4.719 9.611 ( -0.176 6.278 -4.690) 7.838 9.782 ( 2.038 -4.038 -10.862) 11.766 10.238 ( -3.617 -4.663 3.753) 6.994 10.453 ( -4.098 -7.764 1.327) 8.879 10.783 ( 3.510 5.021 -1.097) 6.224 10.953 ( 0.855 1.657 -0.087) 1.867 11.123 ( -2.290 -6.337 4.540) 8.125 11.518 ( -5.351 -4.268 -3.373) 7.631 11.736 ( -3.751 -5.558 7.005) 9.697 12.417 ( 7.876 4.262 4.274) 9.923 12.479 ( 0.837 4.265 -5.807) 7.253 12.801 ( 5.052 0.440 6.675) 8.383 12.995 ( -3.609 -4.826 -0.597) 6.056 13.530 ( -8.229 3.642 -3.682) 9.723 13.701 ( -1.435 0.331 3.450) 3.751 14.125 ( 0.119 -0.763 7.072) 7.114 14.301 ( -1.846 3.848 3.079) 5.263 14.451 ( -2.290 3.884 1.987) 4.927 14.817 ( 0.049 -2.720 7.814) 8.274 15.404 ( 5.826 -2.441 -0.276) 6.322 16.133 ( -5.399 -6.775 -0.007) 8.663 16.469 ( 13.475 2.303 -6.372) 15.083 16.807 ( -2.533 10.147 -1.338) 10.544 16.937 ( 0.556 12.506 1.327) 12.588 17.703 ( -3.061 -2.194 -5.529) 6.690 17.849 ( 0.388 -5.115 -8.671) 10.075 18.233 ( -7.957 -5.056 5.968) 11.157 18.854 ( 12.859 -7.413 -2.622) 15.073 20.289 ( -4.816 2.165 4.870) 7.184 21.176 ( 0.481 -4.008 -4.657) 6.164 21.515 ( -1.001 -2.182 -0.031) 2.401 21.754 ( -2.672 0.551 -0.998) 2.906 25.099 ( -1.862 -3.414 2.467) 4.606 25.453 ( 2.524 2.238 -2.716) 4.331 28.919 ( 0.276 -2.939 3.055) 4.248 29.097 ( -1.066 0.618 0.191) 1.247 34.538 ( -6.944 6.615 2.432) 9.894 34.757 ( 6.180 7.536 1.811) 9.913 37.698 ( -3.594 1.056 2.703) 4.619 37.940 ( 3.081 0.431 -1.499) 3.453 40.456 ( 4.069 1.530 10.649) 11.502 40.951 ( 5.737 -0.401 2.214) 6.163 41.561 ( -2.865 1.504 -2.420) 4.040 43.389 ( 2.662 5.316 -23.916) 24.644 ======================= Grid point 198 (99/205) ======================= q-point: (-0.22 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.495 ( 2.705 0.884 20.807) 21.000 3.174 ( 1.321 11.672 8.412) 14.448 3.812 ( 1.181 0.109 -0.589) 1.324 3.930 ( -0.803 9.228 1.294) 9.353 4.083 ( -0.857 5.044 -9.887) 11.132 5.016 ( -0.078 -9.498 1.845) 9.676 5.284 ( -5.760 -4.451 -6.803) 9.964 5.724 ( 0.978 12.214 11.409) 16.742 5.817 ( -6.533 -7.128 10.710) 14.429 5.962 ( 17.115 2.389 0.746) 17.297 6.375 ( -7.102 -2.811 8.279) 11.264 6.597 ( 8.163 -2.856 4.358) 9.684 6.752 ( 6.568 5.662 3.920) 9.516 7.078 ( -8.148 -7.071 0.759) 10.815 7.405 ( 5.754 8.291 -3.812) 10.788 7.577 ( -1.177 3.488 -4.937) 6.158 7.805 ( -9.360 2.514 -8.695) 13.021 8.216 ( -2.737 -4.364 -2.247) 5.620 8.456 ( 1.630 -9.191 -8.646) 12.724 8.796 ( 3.584 7.190 -10.705) 13.384 8.925 ( 5.038 -2.743 -3.220) 6.578 9.196 ( 0.442 3.463 3.300) 4.803 9.446 ( -2.168 7.196 -6.320) 9.820 9.820 ( 1.791 -0.235 -6.436) 6.685 10.302 ( -1.395 -5.148 2.998) 6.119 10.518 ( -6.393 -6.496 -0.669) 9.139 10.735 ( 0.797 2.283 0.477) 2.465 10.987 ( -5.166 -4.536 2.574) 7.341 11.239 ( 2.045 -6.006 6.080) 8.788 11.527 ( -4.079 -5.890 0.674) 7.196 11.769 ( -7.116 -4.277 1.299) 8.404 12.217 ( -11.633 7.207 -2.362) 13.887 12.500 ( 5.975 2.405 3.029) 7.117 13.013 ( 16.784 -4.026 5.190) 18.023 13.069 ( 7.600 -0.560 -0.978) 7.683 13.376 ( -4.630 3.716 -3.839) 7.070 13.650 ( -5.872 3.471 4.738) 8.305 14.151 ( -2.719 0.040 3.075) 4.105 14.285 ( 3.802 1.912 6.485) 7.757 14.439 ( 4.738 -1.558 1.810) 5.306 14.932 ( 4.562 -4.455 7.673) 9.976 15.439 ( -2.175 0.670 0.872) 2.437 16.171 ( -10.994 -9.580 -0.072) 14.583 16.465 ( -5.264 17.091 -2.661) 18.080 16.571 ( 5.637 3.102 -0.797) 6.483 16.816 ( 7.563 10.599 -3.936) 13.603 17.663 ( -4.710 -2.063 -7.962) 9.477 17.893 ( -0.259 -4.896 -8.777) 10.053 18.253 ( -5.834 -4.724 4.587) 8.797 19.115 ( 11.522 -6.370 -0.610) 13.180 20.253 ( -4.206 -1.472 9.078) 10.113 21.225 ( 2.839 -2.151 -4.522) 5.756 21.526 ( -1.617 -1.046 0.122) 1.930 21.730 ( -0.416 -0.987 -3.289) 3.459 25.137 ( -1.512 -2.847 1.264) 3.463 25.416 ( 0.434 3.546 -1.751) 3.979 28.969 ( -0.297 -1.057 2.705) 2.920 29.091 ( 0.192 -0.810 1.279) 1.526 34.360 ( -7.282 5.657 1.367) 9.322 34.702 ( 6.228 9.971 4.758) 12.683 37.640 ( -4.568 1.004 1.344) 4.866 37.942 ( 1.867 2.072 -2.144) 3.518 40.464 ( -2.236 2.805 7.785) 8.572 41.049 ( 4.032 -0.859 3.853) 5.642 41.543 ( 4.479 -0.319 -1.230) 4.656 43.242 ( 3.971 5.293 -24.607) 25.481 ======================= Grid point 199 (100/205) ======================= q-point: (-0.11 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.623 ( 14.323 12.230 21.700) 28.733 3.170 ( 24.444 6.361 10.594) 27.390 3.846 ( 3.422 -1.265 -3.567) 5.103 3.873 ( -2.057 0.104 8.394) 8.643 4.001 ( 0.669 -3.067 -14.791) 15.120 5.065 ( -8.997 -0.049 5.408) 10.497 5.296 ( 0.257 -2.434 3.993) 4.684 5.516 ( -1.613 9.882 9.124) 13.547 5.819 ( -15.924 -1.838 16.565) 23.051 6.138 ( 11.362 4.249 -15.061) 19.338 6.427 ( 10.475 -3.258 11.362) 15.794 6.600 ( 2.156 12.496 0.012) 12.680 6.780 ( -9.847 -3.035 -2.979) 10.726 7.133 ( 5.862 -5.859 3.393) 8.956 7.395 ( 4.393 -1.202 -0.421) 4.574 7.469 ( -8.568 1.949 -2.884) 9.248 7.645 ( -7.387 -0.441 -7.295) 10.391 8.239 ( -3.905 -8.466 -11.292) 14.643 8.559 ( 2.243 -2.601 -9.938) 10.515 8.733 ( 5.495 -1.943 -11.368) 12.775 9.010 ( 6.240 0.876 -2.442) 6.758 9.122 ( 0.589 7.637 -1.575) 7.820 9.371 ( 1.656 0.676 3.597) 4.017 9.763 ( 0.051 5.911 -4.163) 7.230 10.364 ( -2.678 -2.519 3.401) 5.008 10.505 ( -4.853 -3.524 -2.726) 6.588 10.753 ( -0.918 -2.417 2.098) 3.329 10.920 ( -19.499 -5.705 7.926) 21.808 11.418 ( 3.947 -7.795 -2.664) 9.135 11.613 ( -1.917 -8.092 1.259) 8.411 11.723 ( -5.977 0.036 2.449) 6.460 12.029 ( -3.313 2.702 -0.948) 4.379 12.550 ( -1.076 -2.469 4.403) 5.161 13.144 ( 12.190 4.058 -7.626) 14.940 13.248 ( 2.213 1.158 2.840) 3.782 13.333 ( 12.508 -0.278 3.046) 12.876 13.535 ( -6.516 0.777 6.939) 9.551 14.096 ( -3.531 1.687 3.032) 4.951 14.378 ( 7.129 -0.421 9.087) 11.558 14.568 ( 7.596 -2.108 0.573) 7.904 15.121 ( 7.467 -6.093 4.905) 10.814 15.360 ( -6.942 2.274 2.442) 7.702 16.022 ( -18.138 10.733 -0.646) 21.086 16.203 ( -10.176 -3.186 -0.479) 10.674 16.578 ( 6.985 6.970 -4.632) 10.901 16.759 ( 10.808 7.027 -1.630) 12.994 17.613 ( -1.925 -1.359 -8.502) 8.822 17.926 ( -1.200 -4.259 -7.747) 8.921 18.275 ( -4.503 -4.018 2.089) 6.386 19.262 ( 3.752 -0.073 -1.297) 3.971 20.320 ( -3.128 -6.764 11.710) 13.880 21.275 ( 5.527 0.349 -3.510) 6.557 21.516 ( -1.492 -0.356 -0.399) 1.585 21.745 ( 1.651 -1.836 -4.776) 5.376 25.161 ( -0.654 -1.509 0.158) 1.652 25.342 ( -1.241 4.263 -0.659) 4.489 28.961 ( -1.002 1.618 1.778) 2.604 29.133 ( 0.689 -2.098 2.120) 3.061 34.209 ( -3.450 5.346 0.206) 6.366 34.652 ( 6.004 7.628 7.916) 12.526 37.579 ( -3.523 1.063 1.312) 3.907 37.906 ( 0.988 3.102 -2.616) 4.176 40.396 ( -5.531 2.218 3.201) 6.765 41.083 ( -1.757 -0.244 7.043) 7.263 41.638 ( 8.421 -0.739 -5.201) 9.925 43.161 ( 9.971 2.133 -22.165) 24.397 ======================= Grid point 204 (101/205) ======================= q-point: ( 0.44 0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.036 ( 2.925 0.000 1.728) 3.398 3.044 ( -17.406 -0.000 21.798) 27.895 4.002 ( -7.696 -0.000 10.391) 12.931 4.393 ( -19.281 -0.000 -6.186) 20.249 4.486 ( 14.812 0.000 -10.295) 18.038 4.633 ( -12.964 -0.000 -8.729) 15.629 5.148 ( -7.985 -0.000 -3.896) 8.885 5.256 ( -12.189 -0.000 6.785) 13.950 6.022 ( 10.786 0.000 16.787) 19.954 6.321 ( 2.842 0.000 4.438) 5.270 6.408 ( -3.461 -0.000 8.340) 9.029 6.584 ( 2.588 0.000 -1.148) 2.831 6.851 ( 5.053 0.000 -15.632) 16.429 6.917 ( 3.177 0.000 -9.596) 10.108 7.224 ( 18.535 0.000 9.009) 20.608 7.351 ( 4.855 0.000 4.703) 6.759 7.813 ( 9.564 0.000 1.050) 9.621 8.210 ( -5.034 -0.000 -3.513) 6.139 8.585 ( -3.087 -0.000 5.714) 6.494 8.703 ( 5.452 0.000 3.449) 6.451 8.881 ( -2.035 -0.000 3.140) 3.742 9.374 ( 1.411 0.000 -4.258) 4.486 9.567 ( 7.484 0.000 -6.236) 9.741 9.968 ( -7.683 -0.000 -7.250) 10.563 10.118 ( -5.800 -0.000 -3.231) 6.639 10.348 ( 0.089 0.000 5.196) 5.197 10.971 ( 1.616 0.000 -2.193) 2.724 11.047 ( -3.538 -0.000 -6.317) 7.241 11.165 ( -1.755 -0.000 -2.754) 3.266 11.328 ( -8.361 -0.000 -3.934) 9.240 11.607 ( -5.201 -0.000 11.797) 12.893 12.162 ( 27.444 0.000 -1.885) 27.509 12.620 ( 1.565 0.000 -10.791) 10.904 12.810 ( -4.423 -0.000 9.145) 10.158 12.999 ( -14.403 -0.000 5.633) 15.466 13.734 ( -1.462 -0.000 -0.438) 1.526 13.739 ( -10.850 -0.000 0.413) 10.858 14.102 ( 1.173 0.000 8.112) 8.197 14.481 ( -3.462 -0.000 3.238) 4.740 14.648 ( -6.829 -0.000 15.398) 16.844 14.733 ( -2.963 -0.000 -6.443) 7.092 15.142 ( 11.619 0.000 0.982) 11.660 16.034 ( -5.486 -0.000 2.864) 6.189 16.354 ( 18.318 0.000 -11.825) 21.803 17.023 ( 4.526 0.000 0.788) 4.594 17.283 ( 1.351 0.000 2.715) 3.033 17.677 ( 2.143 0.000 -3.855) 4.411 17.778 ( -4.228 -0.000 0.494) 4.256 18.174 ( -12.853 -0.000 3.982) 13.455 18.520 ( 12.117 0.000 -11.474) 16.687 20.447 ( -4.298 -0.000 -1.547) 4.568 21.019 ( 0.701 0.000 -5.206) 5.253 21.455 ( -1.471 -0.000 1.929) 2.425 21.827 ( -4.592 -0.000 1.139) 4.731 25.004 ( -2.342 -0.000 4.257) 4.859 25.466 ( 4.387 0.000 -3.624) 5.690 28.824 ( -0.570 -0.000 2.385) 2.452 29.125 ( -0.994 -0.000 -1.398) 1.715 34.792 ( 13.899 0.000 -1.827) 14.019 34.853 ( -10.906 -0.000 4.380) 11.753 37.748 ( -1.575 -0.000 6.203) 6.399 37.885 ( 5.248 0.000 -0.781) 5.305 40.348 ( 10.390 0.000 8.294) 13.294 40.958 ( -2.902 -0.000 6.991) 7.570 41.638 ( -0.207 -0.000 -8.553) 8.556 43.586 ( 3.293 0.000 -22.399) 22.639 ======================= Grid point 205 (102/205) ======================= q-point: (-0.44 -0.56 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.798 ( -5.773 13.354 12.320) 19.064 3.230 ( -6.511 -7.836 10.776) 14.829 3.935 ( -0.441 3.717 5.159) 6.374 4.092 ( -7.290 -1.196 -1.115) 7.471 4.491 ( -21.590 -11.248 -13.503) 27.838 4.659 ( -2.033 0.834 -9.035) 9.298 5.034 ( 6.483 -0.337 8.673) 10.833 5.296 ( -2.339 -7.934 6.425) 10.473 6.073 ( -10.584 15.826 -14.613) 24.001 6.216 ( -4.032 2.786 9.570) 10.752 6.246 ( 8.793 2.370 14.252) 16.913 6.677 ( 6.209 11.844 -4.647) 14.157 6.939 ( 13.253 -4.487 2.544) 14.221 7.133 ( 7.469 -10.194 -4.462) 13.402 7.270 ( 6.252 0.367 3.644) 7.246 7.582 ( 8.496 -6.160 5.653) 11.920 7.885 ( 2.174 0.652 0.047) 2.270 8.138 ( -4.791 -0.375 -5.310) 7.162 8.457 ( -2.835 10.286 2.939) 11.067 8.779 ( 1.785 -0.862 7.773) 8.022 8.954 ( -0.534 -6.817 1.599) 7.023 9.349 ( -0.498 1.659 -4.804) 5.107 9.635 ( 6.384 -1.120 -10.065) 11.971 9.807 ( -8.118 3.011 -6.452) 10.798 10.075 ( -6.087 -3.896 1.211) 7.328 10.352 ( -1.316 0.573 2.650) 3.014 10.916 ( -1.310 3.395 -2.248) 4.277 11.000 ( -2.959 -0.435 -5.493) 6.254 11.102 ( 3.052 4.162 -1.157) 5.289 11.304 ( -5.339 -8.024 -8.054) 12.560 11.625 ( -3.811 -1.681 12.568) 13.241 12.480 ( 22.552 0.702 3.754) 22.873 12.589 ( 2.644 2.197 -9.962) 10.539 12.822 ( -13.645 -3.781 1.499) 14.238 12.845 ( 0.699 0.586 6.944) 7.003 13.613 ( -8.909 1.516 0.494) 9.050 13.740 ( 2.999 1.564 3.171) 4.636 14.143 ( 1.653 0.732 6.858) 7.093 14.416 ( -4.110 2.621 1.157) 5.010 14.586 ( -4.914 4.171 2.821) 7.036 14.712 ( -4.165 -3.804 6.142) 8.339 15.293 ( 7.831 -3.073 0.433) 8.424 15.986 ( -6.724 -2.173 0.583) 7.090 16.509 ( 15.373 0.431 -10.083) 18.390 17.034 ( 1.416 3.711 1.784) 4.354 17.249 ( -0.793 5.827 2.994) 6.599 17.690 ( -3.050 -1.965 -3.004) 4.711 17.725 ( -0.724 0.667 -1.284) 1.618 18.094 ( -7.058 -3.265 2.430) 8.148 18.656 ( 12.221 -3.826 -8.242) 15.229 20.368 ( -4.773 2.023 -1.646) 5.439 21.039 ( 1.337 -3.352 -5.519) 6.594 21.454 ( -1.488 -1.179 1.946) 2.719 21.771 ( -4.756 0.349 0.954) 4.863 25.008 ( -2.176 -1.754 3.755) 4.681 25.492 ( 2.758 0.437 -3.244) 4.281 28.842 ( 0.088 -1.429 2.666) 3.026 29.109 ( -0.613 0.143 -1.373) 1.510 34.702 ( -11.266 3.007 1.271) 11.730 34.932 ( 12.870 2.935 1.208) 13.256 37.732 ( -3.723 0.737 4.768) 6.094 37.948 ( 5.253 0.101 0.222) 5.259 40.516 ( 11.644 1.392 12.017) 16.790 40.959 ( -0.152 0.644 7.512) 7.541 41.578 ( -3.538 -0.101 -9.621) 10.251 43.510 ( 2.156 2.082 -24.084) 24.269 ======================= Grid point 206 (103/205) ======================= q-point: (-0.33 -0.56 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.604 ( -1.672 9.370 11.942) 15.271 3.215 ( -8.870 -2.719 12.504) 15.570 3.916 ( 4.870 3.542 -0.319) 6.030 4.236 ( 3.599 0.284 -3.307) 4.897 4.387 ( -12.835 0.898 -4.492) 13.628 4.424 ( -9.081 -10.463 -8.025) 16.010 5.317 ( 3.085 -13.478 6.928) 15.465 5.461 ( 10.775 -0.812 5.979) 12.350 5.720 ( -6.459 2.889 -5.581) 9.012 6.119 ( -0.427 6.563 10.733) 12.587 6.315 ( -9.747 3.709 5.311) 11.703 6.622 ( 8.820 0.253 4.180) 9.764 6.956 ( 7.874 13.215 1.892) 15.499 7.192 ( 7.461 6.770 0.664) 10.097 7.556 ( 2.656 -11.851 -2.801) 12.464 7.708 ( 3.439 -1.563 -5.419) 6.606 7.835 ( -2.730 5.026 3.866) 6.904 8.087 ( -6.439 -6.601 -10.009) 13.609 8.309 ( 1.466 7.276 2.648) 7.880 8.843 ( 3.485 0.181 8.970) 9.625 9.003 ( -0.515 0.390 -5.977) 6.011 9.286 ( -0.991 2.517 -1.241) 2.976 9.618 ( -6.198 1.452 -7.053) 9.501 9.702 ( 1.830 -2.528 -12.836) 13.210 10.110 ( -5.114 -6.684 5.393) 9.996 10.342 ( -1.375 -0.861 1.596) 2.275 10.848 ( -2.237 2.818 -0.961) 3.724 10.958 ( -0.836 -0.078 -1.956) 2.129 11.143 ( 8.554 0.449 2.477) 8.916 11.330 ( -5.729 -6.933 -6.239) 10.946 11.654 ( -3.713 -2.519 6.574) 7.959 12.422 ( -14.265 5.669 -5.233) 16.218 12.592 ( 2.637 2.069 3.131) 4.586 12.895 ( 14.036 -3.386 0.314) 14.442 12.987 ( 10.582 -3.594 5.521) 12.465 13.488 ( -5.911 2.937 -0.615) 6.629 13.757 ( 1.832 3.231 5.706) 6.809 14.164 ( 1.499 1.746 3.097) 3.859 14.358 ( 0.851 1.972 3.386) 4.009 14.472 ( -2.725 2.816 -1.686) 4.266 14.782 ( -1.174 -4.999 8.991) 10.354 15.395 ( -0.532 -3.087 1.442) 3.448 15.939 ( -10.305 -4.307 -1.153) 11.228 16.617 ( 11.337 1.322 -7.907) 13.885 16.932 ( -3.753 9.524 1.097) 10.295 17.134 ( 1.130 8.785 2.667) 9.250 17.638 ( -2.419 0.414 -3.969) 4.667 17.743 ( -0.834 -3.474 -3.940) 5.319 18.111 ( -2.364 -4.154 1.182) 4.923 18.865 ( 11.459 -7.627 -3.694) 14.253 20.272 ( -5.410 1.819 0.698) 5.750 21.106 ( 2.738 -4.672 -5.783) 7.923 21.470 ( -1.392 -1.937 1.672) 2.913 21.718 ( -3.779 0.056 0.073) 3.780 25.035 ( -1.863 -2.942 2.787) 4.460 25.489 ( 0.875 1.178 -2.630) 3.012 28.891 ( 0.567 -2.639 3.050) 4.073 29.095 ( -0.215 0.366 -0.923) 1.016 34.517 ( -10.419 3.809 -0.609) 11.110 35.004 ( 11.576 7.849 4.258) 14.620 37.679 ( -4.821 1.302 3.282) 5.976 37.997 ( 4.280 1.293 0.521) 4.501 40.618 ( 5.156 5.963 13.037) 15.235 41.013 ( 3.884 -1.076 5.499) 6.818 41.513 ( -1.937 -1.686 -7.413) 7.845 43.384 ( 1.086 3.518 -25.736) 25.998 ======================= Grid point 207 (104/205) ======================= q-point: (-0.22 -0.56 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.638 ( 7.605 -3.305 16.386) 18.365 3.283 ( 2.899 -3.560 10.358) 11.330 3.871 ( -3.245 4.786 0.392) 5.796 4.087 ( -0.931 12.922 -0.954) 12.991 4.183 ( 4.005 2.112 -12.182) 12.996 4.662 ( -3.213 -14.527 -6.391) 16.193 5.380 ( 6.742 8.218 -1.767) 10.775 5.571 ( -13.400 -14.909 12.841) 23.806 5.864 ( -4.989 3.356 11.517) 12.992 6.087 ( 2.490 -11.012 5.049) 12.368 6.163 ( -1.426 2.450 6.226) 6.841 6.773 ( 6.281 -0.210 3.245) 7.073 6.855 ( 4.383 6.049 4.725) 8.839 7.120 ( 1.739 8.605 -1.051) 8.841 7.560 ( -1.970 4.912 -6.902) 8.698 7.597 ( -3.817 9.038 -8.097) 12.721 7.786 ( -0.192 2.674 1.870) 3.269 8.098 ( -5.045 -5.365 -8.435) 11.198 8.321 ( 5.321 -4.067 -3.672) 7.638 8.890 ( 1.174 6.295 -9.062) 11.096 8.955 ( 6.513 -1.117 3.058) 7.281 9.268 ( 1.582 0.711 4.416) 4.744 9.469 ( -4.837 4.365 -6.765) 9.392 9.760 ( 1.496 -6.602 -11.515) 13.358 10.189 ( -4.208 -6.786 6.865) 10.530 10.364 ( -1.825 -3.750 0.271) 4.179 10.741 ( -5.094 4.319 -1.229) 6.791 10.942 ( -3.215 2.078 4.247) 5.718 11.269 ( 7.576 -1.511 2.725) 8.192 11.366 ( -2.939 -7.625 -2.848) 8.654 11.673 ( -1.454 -2.177 2.237) 3.444 12.142 ( -13.673 3.919 -5.162) 15.131 12.583 ( 0.127 2.398 1.257) 2.711 13.124 ( 10.985 -4.409 2.374) 12.073 13.194 ( 12.904 -1.878 5.642) 14.208 13.394 ( -0.358 2.961 -0.063) 2.983 13.690 ( -3.993 6.536 5.700) 9.548 14.141 ( -1.678 1.882 -1.044) 2.729 14.389 ( 6.133 0.779 2.720) 6.754 14.499 ( 7.762 -1.658 4.150) 8.956 14.916 ( 3.019 -6.895 6.838) 10.169 15.379 ( -8.627 -0.991 2.682) 9.088 15.858 ( -16.791 -6.187 -2.241) 18.034 16.647 ( -8.860 16.014 1.000) 18.329 16.678 ( 7.132 1.530 -5.167) 8.939 17.037 ( 3.903 8.236 0.344) 9.121 17.605 ( 1.655 0.464 -7.094) 7.299 17.775 ( -0.839 -4.187 -5.103) 6.654 18.159 ( -0.301 -3.190 0.155) 3.208 19.112 ( 8.467 -8.280 -1.024) 11.887 20.207 ( -5.219 -0.791 5.056) 7.309 21.205 ( 5.644 -4.480 -5.548) 9.095 21.488 ( -1.706 -1.554 1.583) 2.798 21.688 ( -1.887 -1.167 -1.684) 2.786 25.075 ( -1.253 -3.297 1.502) 3.834 25.453 ( -0.916 2.336 -1.763) 3.067 28.952 ( 0.253 -2.365 2.951) 3.791 29.089 ( 0.207 -0.083 0.119) 0.253 34.347 ( -7.554 3.320 -1.467) 8.381 34.984 ( 8.229 12.038 6.964) 16.160 37.613 ( -4.232 1.256 2.392) 5.021 38.006 ( 2.721 2.962 -0.017) 4.022 40.558 ( -1.812 7.987 7.376) 11.021 41.071 ( -1.884 -0.629 6.981) 7.258 41.571 ( 7.795 -3.724 -5.168) 10.066 43.241 ( 1.810 2.766 -25.635) 25.848 ======================= Grid point 208 (105/205) ======================= q-point: (-0.11 -0.56 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.964 ( 16.970 -5.778 18.234) 25.571 3.423 ( 5.832 -3.369 7.252) 9.897 3.797 ( -0.925 -1.741 -2.532) 3.209 3.973 ( 10.074 5.344 1.107) 11.457 4.164 ( 13.307 11.976 -4.436) 18.444 4.750 ( -10.729 -13.441 -5.762) 18.138 5.346 ( -2.233 3.398 5.703) 7.004 5.483 ( -29.147 1.141 13.233) 32.031 5.690 ( -11.213 2.936 9.407) 14.928 6.205 ( 5.782 -5.085 -5.319) 9.358 6.474 ( 9.036 -15.692 6.145) 19.122 6.751 ( 3.638 9.057 7.295) 12.185 6.826 ( -1.691 12.065 -3.532) 12.684 7.060 ( -1.871 -4.455 1.474) 5.052 7.358 ( -1.049 3.803 -7.932) 8.859 7.439 ( -6.849 2.133 -4.605) 8.524 7.750 ( 6.848 8.372 1.748) 10.956 8.089 ( 1.396 -1.903 -8.875) 9.183 8.457 ( 3.629 -7.300 -8.315) 11.645 8.771 ( 3.856 4.449 -12.032) 13.395 9.050 ( 3.687 -0.487 -0.633) 3.773 9.280 ( 2.247 7.641 -1.327) 8.075 9.388 ( 2.519 -2.529 3.814) 5.224 9.806 ( 1.338 -0.473 -8.545) 8.662 10.267 ( -3.846 -6.237 4.092) 8.393 10.411 ( -1.203 -3.354 0.783) 3.648 10.602 ( -8.784 1.031 -0.532) 8.860 10.838 ( -7.986 3.794 8.710) 12.411 11.351 ( 0.591 -2.434 -2.923) 3.850 11.485 ( 2.474 -7.367 -1.340) 7.886 11.719 ( 3.249 -0.776 3.599) 4.910 11.977 ( -6.554 -0.724 -4.174) 7.803 12.525 ( -5.074 1.984 2.487) 5.989 13.220 ( 0.344 0.444 -3.752) 3.794 13.392 ( 13.059 0.387 5.065) 14.012 13.461 ( 8.210 -1.528 5.061) 9.765 13.544 ( -3.235 4.574 7.911) 9.694 14.078 ( -2.953 1.144 -0.618) 3.227 14.505 ( 9.302 -0.311 6.627) 11.425 14.636 ( 6.074 -1.114 2.036) 6.503 15.093 ( -0.089 -5.263 1.610) 5.505 15.305 ( -3.434 -2.426 5.421) 6.860 15.712 ( -21.892 -5.783 -3.059) 22.849 16.278 ( -9.751 15.020 1.979) 18.017 16.700 ( 4.381 2.098 -4.231) 6.441 16.969 ( 5.247 6.484 -1.016) 8.402 17.601 ( 5.208 1.425 -8.371) 9.961 17.814 ( -0.147 -3.998 -5.969) 7.186 18.201 ( 0.645 -1.997 -0.819) 2.253 19.259 ( 0.565 -2.713 -1.174) 3.010 20.228 ( -3.814 -4.929 8.996) 10.944 21.329 ( 8.149 -2.326 -3.907) 9.331 21.488 ( -1.868 -0.718 0.961) 2.220 21.700 ( 0.180 -2.920 -3.513) 4.572 25.121 ( 0.008 -2.951 0.111) 2.953 25.382 ( -2.171 3.502 -0.657) 4.172 28.976 ( -0.577 0.416 1.815) 1.949 29.113 ( 0.161 -1.927 1.832) 2.664 34.234 ( -2.800 2.100 -1.909) 3.987 34.891 ( 3.816 11.512 9.015) 15.112 37.569 ( -1.821 0.775 2.486) 3.178 37.971 ( 1.403 4.037 -0.933) 4.375 40.417 ( -4.749 6.413 2.331) 8.314 41.068 ( -4.699 -0.687 9.137) 10.298 41.689 ( 6.934 -1.114 -8.487) 11.016 43.179 ( 6.909 -1.395 -21.781) 22.893 ======================= Grid point 214 (106/205) ======================= q-point: (-0.44 -0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.976 ( -19.610 -0.000 0.971) 19.635 3.106 ( 6.017 0.000 23.379) 24.141 3.937 ( 4.589 0.000 -15.649) 16.308 3.997 ( -24.084 -0.000 -24.153) 34.109 4.044 ( -2.417 -0.000 25.220) 25.336 4.641 ( -3.707 -0.000 -3.891) 5.374 5.166 ( -3.616 -0.000 7.159) 8.021 5.241 ( 15.721 0.000 10.539) 18.927 6.080 ( -6.267 -0.000 -12.380) 13.876 6.129 ( -5.547 -0.000 9.038) 10.604 6.608 ( 10.858 0.000 4.515) 11.760 6.812 ( 3.487 0.000 -17.145) 17.496 6.952 ( 6.769 0.000 -3.532) 7.636 7.051 ( 15.464 0.000 14.840) 21.433 7.411 ( -8.248 -0.000 4.901) 9.595 7.651 ( 9.486 0.000 4.062) 10.319 7.852 ( -5.217 -0.000 -0.878) 5.291 8.111 ( -0.315 -0.000 1.090) 1.135 8.558 ( -0.798 -0.000 2.756) 2.869 8.731 ( -4.033 -0.000 1.864) 4.442 8.928 ( 1.432 0.000 7.898) 8.027 9.338 ( -0.368 -0.000 -5.474) 5.486 9.658 ( 4.384 0.000 -10.992) 11.834 9.681 ( -10.894 -0.000 -6.518) 12.695 9.984 ( -5.206 -0.000 4.176) 6.674 10.379 ( 1.862 0.000 1.280) 2.259 10.882 ( -7.565 -0.000 -1.450) 7.703 10.951 ( 0.630 0.000 -5.144) 5.182 11.133 ( 0.846 0.000 -10.317) 10.352 11.227 ( 6.403 0.000 -0.677) 6.439 11.613 ( -3.418 -0.000 9.828) 10.405 12.556 ( -21.044 -0.000 -1.835) 21.124 12.604 ( 2.201 0.000 -4.061) 4.619 12.798 ( 23.525 0.000 -1.388) 23.566 12.935 ( 7.182 0.000 10.213) 12.485 13.542 ( -6.463 -0.000 1.980) 6.760 13.819 ( 4.527 0.000 5.051) 6.783 14.202 ( 3.073 0.000 4.204) 5.207 14.400 ( -1.946 -0.000 0.330) 1.973 14.552 ( -5.679 -0.000 -5.389) 7.829 14.664 ( -3.189 -0.000 12.325) 12.730 15.323 ( 0.084 0.000 2.593) 2.594 15.882 ( -8.060 -0.000 -0.903) 8.110 16.638 ( 11.977 0.000 -9.522) 15.301 17.073 ( -1.312 -0.000 2.363) 2.703 17.291 ( -2.528 -0.000 3.306) 4.162 17.629 ( -2.542 -0.000 -2.369) 3.475 17.732 ( 0.616 0.000 1.468) 1.592 18.018 ( -0.973 -0.000 -1.740) 1.994 18.730 ( 10.730 0.000 -6.846) 12.728 20.314 ( -5.179 -0.000 -3.769) 6.405 21.009 ( 2.114 0.000 -5.755) 6.131 21.436 ( -1.646 -0.000 2.842) 3.284 21.720 ( -4.805 -0.000 0.996) 4.907 24.983 ( -1.991 -0.000 3.511) 4.036 25.505 ( 0.975 0.000 -2.830) 2.993 28.845 ( 0.517 0.000 2.786) 2.833 29.101 ( 0.084 0.000 -1.852) 1.854 34.580 ( -12.279 -0.000 -1.470) 12.367 35.137 ( 15.127 0.000 4.423) 15.761 37.704 ( -4.953 -0.000 4.168) 6.473 38.018 ( 5.291 0.000 2.106) 5.694 40.738 ( 12.694 0.000 16.551) 20.858 40.997 ( 1.036 0.000 7.990) 8.057 41.470 ( -6.076 -0.000 -13.578) 14.876 43.444 ( 0.699 0.000 -26.636) 26.645 ======================= Grid point 215 (107/205) ======================= q-point: (-0.33 -0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.622 ( -26.442 1.188 4.613) 26.867 3.214 ( -3.019 0.758 14.892) 15.214 3.735 ( -17.757 -9.700 -21.135) 29.259 4.050 ( 15.019 -0.155 -8.025) 17.029 4.292 ( 10.553 -14.058 16.910) 24.391 4.503 ( -5.285 8.657 2.861) 10.538 5.156 ( -3.529 -2.617 5.933) 7.383 5.570 ( 12.534 -8.419 10.042) 18.134 5.841 ( 0.915 14.226 -4.562) 14.967 6.198 ( -1.501 -5.215 3.579) 6.501 6.374 ( -1.292 18.492 -1.783) 18.623 6.898 ( 3.585 12.905 12.817) 18.538 7.029 ( -1.186 -11.338 -11.660) 16.307 7.257 ( -7.370 2.405 -2.761) 8.230 7.378 ( 9.678 -11.246 1.485) 14.911 7.703 ( -1.011 0.064 -0.844) 1.318 7.787 ( -6.703 -0.863 0.342) 6.767 8.108 ( 5.998 6.951 4.257) 10.120 8.439 ( 0.500 7.908 0.930) 7.978 8.848 ( 0.102 -10.049 1.903) 10.228 8.983 ( 2.954 -0.497 5.140) 5.949 9.298 ( -0.642 1.349 -4.643) 4.877 9.505 ( -8.612 2.240 -7.599) 11.701 9.647 ( 0.005 -0.611 -12.398) 12.413 9.988 ( -3.782 -4.036 7.434) 9.267 10.387 ( 2.835 2.804 1.426) 4.235 10.805 ( -6.060 -1.521 -0.589) 6.276 10.967 ( 3.676 -0.082 -1.248) 3.883 11.158 ( 1.916 -3.861 -7.456) 8.612 11.291 ( 7.767 1.758 -0.554) 7.983 11.625 ( -0.411 -0.784 5.284) 5.357 12.265 ( -19.731 3.200 -5.399) 20.705 12.614 ( 0.507 -0.490 -2.989) 3.071 13.026 ( 11.052 -1.313 3.179) 11.575 13.101 ( 10.584 -2.809 9.169) 14.282 13.480 ( -2.462 1.940 2.723) 4.152 13.861 ( 1.666 3.239 6.494) 7.446 14.221 ( 1.534 2.140 -3.241) 4.176 14.404 ( 3.684 0.065 -0.614) 3.735 14.489 ( 1.640 0.984 1.567) 2.472 14.715 ( -2.092 -4.767 8.947) 10.351 15.305 ( -9.305 -2.425 5.195) 10.929 15.775 ( -9.768 -0.083 -2.678) 10.128 16.709 ( 6.609 0.541 -8.211) 10.554 17.006 ( -5.454 5.388 1.922) 7.904 17.233 ( -3.201 3.705 2.701) 5.592 17.604 ( -0.190 -0.334 -3.291) 3.313 17.748 ( 4.340 2.049 0.273) 4.807 18.057 ( 3.780 -3.172 -2.956) 5.752 18.863 ( 8.586 -5.218 -3.914) 10.782 20.224 ( -5.778 1.053 -2.757) 6.488 21.048 ( 3.281 -3.897 -6.014) 7.882 21.438 ( -1.570 -1.105 3.066) 3.617 21.671 ( -3.999 -0.157 0.506) 4.034 24.988 ( -1.575 -1.675 2.794) 3.618 25.493 ( -0.660 0.460 -2.257) 2.396 28.876 ( 0.694 -1.556 3.020) 3.467 29.096 ( 0.424 0.154 -1.794) 1.850 34.420 ( -11.107 1.204 -2.960) 11.557 35.301 ( 15.784 6.132 7.566) 18.546 37.651 ( -5.092 0.835 3.447) 6.206 38.078 ( 4.294 1.311 3.312) 5.579 40.854 ( 3.792 8.297 17.212) 19.480 41.060 ( 3.065 0.590 3.785) 4.906 41.397 ( -0.987 -6.450 -10.659) 12.498 43.316 ( -1.345 1.481 -29.583) 29.651 ======================= Grid point 216 (108/205) ======================= q-point: (-0.22 -0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.527 ( -13.304 -16.382 12.831) 24.698 3.184 ( -21.239 -13.332 0.417) 25.080 3.709 ( 3.862 -3.873 -10.578) 11.909 4.229 ( 17.731 -1.034 -2.412) 17.924 4.312 ( 1.489 12.234 6.668) 14.012 4.648 ( 9.664 -3.425 -0.258) 10.256 5.202 ( -12.777 -10.451 11.790) 20.285 5.539 ( -8.809 8.111 5.922) 13.359 5.874 ( -5.805 4.975 4.784) 9.018 6.050 ( 3.485 1.227 2.732) 4.595 6.325 ( 8.544 5.538 6.156) 11.898 6.751 ( -11.218 -1.782 0.957) 11.399 7.055 ( 4.870 5.470 2.867) 7.865 7.173 ( -2.970 2.674 -2.743) 4.847 7.491 ( -2.294 -0.979 -6.682) 7.132 7.669 ( 0.289 4.050 -10.833) 11.569 7.773 ( -2.462 -5.664 -1.590) 6.378 8.063 ( 7.561 8.495 3.263) 11.831 8.406 ( 6.461 2.720 0.341) 7.019 8.950 ( 2.049 0.787 -4.642) 5.135 9.046 ( 5.187 1.026 3.045) 6.102 9.273 ( -0.588 -2.276 -0.836) 2.495 9.394 ( -5.498 -2.555 -4.153) 7.349 9.625 ( 1.545 -3.278 -12.678) 13.185 10.071 ( -2.169 -6.113 10.355) 12.218 10.378 ( 2.233 2.791 1.035) 3.722 10.751 ( -3.513 1.592 -0.859) 3.951 10.975 ( -1.681 4.716 4.189) 6.528 11.219 ( 1.646 -6.265 -4.346) 7.800 11.370 ( 7.626 0.684 -0.328) 7.664 11.678 ( 4.954 -1.036 2.149) 5.498 11.988 ( -14.809 1.474 -7.042) 16.464 12.590 ( -3.128 0.850 -1.758) 3.687 13.144 ( 0.943 -3.474 2.449) 4.354 13.313 ( 9.683 -4.269 9.025) 13.908 13.456 ( 1.679 2.210 4.849) 5.587 13.788 ( -3.470 7.327 5.983) 10.076 14.160 ( -0.020 3.421 -4.953) 6.020 14.486 ( 10.723 -0.731 -2.244) 10.980 14.590 ( 7.375 -1.656 6.864) 10.210 14.844 ( 1.653 -8.431 6.206) 10.598 15.228 ( -13.809 -3.228 6.563) 15.626 15.616 ( -13.765 0.995 -4.219) 14.431 16.703 ( -4.350 2.680 -6.959) 8.633 16.784 ( -5.333 10.179 1.617) 11.605 17.137 ( -4.132 3.957 2.496) 6.242 17.623 ( 5.868 -0.559 -7.491) 9.532 17.775 ( 6.387 2.207 -1.101) 6.847 18.149 ( 6.095 -1.802 -3.171) 7.103 19.055 ( 5.798 -8.423 -1.878) 10.397 20.145 ( -5.696 -0.584 1.913) 6.037 21.164 ( 6.263 -6.701 -6.139) 11.037 21.453 ( -1.742 -1.489 2.950) 3.735 21.639 ( -2.655 -0.915 -0.638) 2.879 25.020 ( -0.793 -2.875 1.699) 3.432 25.457 ( -1.944 1.254 -1.574) 2.798 28.928 ( 0.308 -2.405 3.076) 3.917 29.092 ( 0.383 0.141 -1.079) 1.154 34.274 ( -8.196 0.700 -3.347) 8.881 35.343 ( 11.880 14.472 10.036) 21.243 37.596 ( -3.554 0.837 2.939) 4.687 38.094 ( 2.514 3.407 3.096) 5.245 40.721 ( -2.698 12.561 3.758) 13.386 41.049 ( -5.193 -0.356 8.347) 9.837 41.565 ( 9.338 -7.206 -4.923) 12.781 43.158 ( -1.679 -0.177 -30.157) 30.204 ======================= Grid point 217 (109/205) ======================= q-point: (-0.11 -0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.876 ( -1.897 -26.686 16.360) 31.359 3.215 ( -13.970 -20.174 -3.032) 24.725 3.780 ( 6.299 1.130 -5.480) 8.426 4.262 ( 11.610 6.453 9.136) 16.122 4.469 ( 18.717 -1.377 -0.549) 18.776 4.597 ( -1.261 10.179 -2.523) 10.562 5.123 ( -33.473 -2.711 13.968) 36.372 5.297 ( -18.823 3.141 8.529) 20.903 5.724 ( -1.198 7.546 1.137) 7.724 6.082 ( -4.648 -5.406 2.555) 7.573 6.466 ( 13.016 -5.651 2.600) 14.426 6.683 ( -12.369 -3.816 -7.902) 15.166 7.017 ( -2.410 6.184 5.185) 8.422 7.112 ( 6.935 5.772 5.138) 10.383 7.417 ( -1.891 2.849 -5.833) 6.762 7.456 ( 1.689 12.781 -11.542) 17.304 7.889 ( 7.339 -2.715 -1.849) 8.040 8.068 ( 6.381 -0.314 -4.760) 7.967 8.462 ( 6.857 1.339 -1.966) 7.258 8.859 ( 2.935 6.901 -9.725) 12.281 9.062 ( -2.335 -0.444 -0.039) 2.377 9.356 ( -1.514 2.440 -3.363) 4.422 9.399 ( 5.891 -5.623 5.038) 9.576 9.705 ( 3.651 -7.993 -11.853) 14.755 10.195 ( 0.721 -3.653 11.993) 12.558 10.360 ( -0.538 0.436 0.561) 0.891 10.663 ( 1.734 7.224 -0.945) 7.489 10.834 ( -7.916 4.840 6.474) 11.314 11.328 ( 2.776 -1.714 -1.596) 3.632 11.439 ( 4.559 -3.271 -3.481) 6.603 11.785 ( 7.427 -1.059 2.763) 7.995 11.840 ( -7.494 -2.340 -5.069) 9.345 12.501 ( -6.438 2.539 0.646) 6.951 13.179 ( -3.568 -2.268 -1.122) 4.374 13.496 ( 2.489 -2.388 5.303) 6.326 13.531 ( 6.968 -3.711 8.224) 11.400 13.642 ( -2.509 6.150 6.998) 9.648 14.097 ( 1.725 3.888 -0.923) 4.352 14.636 ( 9.416 0.036 4.148) 10.290 14.658 ( -3.110 -0.314 2.821) 4.210 14.973 ( -6.212 -4.314 0.825) 7.608 15.255 ( 2.141 -6.453 6.821) 9.631 15.422 ( -11.127 -2.840 -4.733) 12.421 16.364 ( -15.621 12.867 0.052) 20.238 16.733 ( 1.315 0.657 -4.175) 4.427 17.037 ( -5.265 2.345 1.536) 5.965 17.682 ( 9.868 1.208 -10.033) 14.125 17.820 ( 7.994 1.985 -2.591) 8.634 18.224 ( 6.514 0.167 -2.881) 7.125 19.188 ( -1.562 -4.431 -2.260) 5.214 20.144 ( -3.846 -4.047 7.567) 9.404 21.350 ( 9.774 -6.534 -5.203) 12.857 21.459 ( -2.248 -0.822 2.477) 3.444 21.636 ( -1.326 -2.533 -2.307) 3.674 25.073 ( 0.597 -3.510 0.399) 3.583 25.396 ( -2.659 2.288 -0.728) 3.582 28.971 ( -0.462 -1.310 2.389) 2.764 29.096 ( -0.080 -0.744 0.529) 0.916 34.191 ( -3.854 -1.047 -3.016) 5.005 35.199 ( 2.382 18.538 11.165) 21.772 37.576 ( -0.157 0.120 2.842) 2.849 38.056 ( 0.763 4.785 1.619) 5.108 40.496 ( -4.404 9.593 -0.632) 10.575 41.032 ( -5.773 -0.612 10.536) 12.029 41.693 ( 3.510 -1.729 -9.216) 10.012 43.099 ( 3.849 -5.697 -25.009) 25.937 ======================= Grid point 224 (110/205) ======================= q-point: (-0.33 -0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.182 ( -40.829 -0.000 3.780) 41.003 2.848 ( -39.577 -0.000 -15.805) 42.616 3.795 ( 18.440 0.000 6.070) 19.413 4.226 ( 12.626 0.000 -0.091) 12.626 4.340 ( 16.318 0.000 9.494) 18.879 4.555 ( -2.121 -0.000 10.206) 10.424 5.112 ( -5.163 -0.000 5.294) 7.395 5.668 ( -1.986 -0.000 14.328) 14.465 5.971 ( 2.762 0.000 -3.866) 4.751 6.168 ( 6.302 0.000 -3.403) 7.162 6.532 ( -11.126 -0.000 -3.075) 11.543 6.755 ( 1.212 0.000 -11.489) 11.552 6.899 ( -18.364 -0.000 4.340) 18.870 7.293 ( -2.596 -0.000 -1.743) 3.127 7.427 ( 17.979 0.000 3.926) 18.403 7.686 ( 0.503 0.000 0.248) 0.561 7.753 ( -3.063 -0.000 2.125) 3.728 8.285 ( 8.327 0.000 7.086) 10.933 8.600 ( 3.310 0.000 -0.093) 3.311 8.661 ( -0.918 -0.000 -1.320) 1.608 9.042 ( 3.299 0.000 6.603) 7.381 9.260 ( -2.328 -0.000 -10.246) 10.507 9.461 ( -1.975 -0.000 -1.311) 2.370 9.559 ( -3.391 -0.000 -14.355) 14.750 9.968 ( -0.535 -0.000 10.794) 10.807 10.460 ( 3.892 0.000 -0.071) 3.892 10.705 ( -6.044 -0.000 -0.043) 6.044 11.022 ( 6.501 0.000 0.522) 6.522 11.153 ( 2.855 0.000 -2.634) 3.885 11.395 ( 8.377 0.000 -2.488) 8.738 11.663 ( 5.477 0.000 1.514) 5.682 12.034 ( -19.024 -0.000 -6.148) 19.993 12.584 ( -2.243 -0.000 -4.621) 5.137 13.086 ( -1.542 -0.000 3.006) 3.379 13.224 ( 7.612 0.000 12.355) 14.512 13.506 ( 0.056 0.000 5.180) 5.180 13.920 ( -1.786 -0.000 6.995) 7.219 14.228 ( 2.640 0.000 -10.531) 10.857 14.468 ( 8.110 0.000 -1.648) 8.275 14.560 ( 6.242 0.000 5.770) 8.500 14.687 ( -0.273 -0.000 7.584) 7.589 15.158 ( -15.667 -0.000 8.225) 17.695 15.666 ( -8.086 -0.000 -4.245) 9.133 16.712 ( -1.542 -0.000 -7.889) 8.038 16.972 ( -9.412 -0.000 2.320) 9.693 17.230 ( -2.513 -0.000 1.437) 2.895 17.610 ( 3.040 0.000 -2.006) 3.642 17.852 ( 7.822 0.000 0.816) 7.865 18.089 ( 9.486 0.000 -5.513) 10.971 18.887 ( 5.676 0.000 -3.269) 6.551 20.148 ( -6.151 -0.000 -3.285) 6.973 21.027 ( 3.256 0.000 -5.762) 6.618 21.423 ( -1.634 -0.000 3.609) 3.962 21.627 ( -3.455 -0.000 0.575) 3.502 24.969 ( -1.118 -0.000 2.455) 2.697 25.474 ( -1.793 -0.000 -1.757) 2.510 28.883 ( 0.567 0.000 3.065) 3.117 29.095 ( 0.586 0.000 -2.202) 2.278 34.285 ( -10.240 -0.000 -4.139) 11.045 35.611 ( 20.748 0.000 10.654) 23.323 37.612 ( -4.836 -0.000 3.365) 5.892 38.155 ( 3.520 0.000 5.903) 6.873 40.995 ( -3.926 -0.000 19.458) 19.850 41.177 ( -7.490 -0.000 -17.230) 18.788 41.258 ( 15.576 0.000 6.204) 16.766 43.157 ( -5.760 -0.000 -35.649) 36.111 ======================= Grid point 225 (111/205) ======================= q-point: (-0.22 -0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.966 ( -28.318 -26.412 12.481) 40.685 2.416 ( -42.450 -17.426 -17.687) 49.179 3.921 ( 12.491 8.320 4.135) 15.567 4.390 ( 6.939 -4.928 3.238) 9.106 4.544 ( 6.343 6.472 11.079) 14.313 4.648 ( 11.612 -5.696 4.167) 13.589 5.066 ( -9.931 1.592 9.239) 13.657 5.435 ( -34.888 2.903 15.411) 38.250 5.923 ( 2.114 7.841 -9.339) 12.376 6.200 ( 11.357 1.968 -1.930) 11.687 6.528 ( -16.175 4.927 -4.699) 17.549 6.553 ( 11.476 2.074 3.078) 12.062 6.931 ( -6.626 -10.617 -7.454) 14.566 7.242 ( 1.449 -0.137 -0.312) 1.488 7.547 ( 5.124 6.018 2.543) 8.303 7.694 ( 6.021 1.676 -5.102) 8.068 7.758 ( 3.340 1.683 0.940) 3.856 8.329 ( 7.011 8.345 3.588) 11.474 8.517 ( 3.335 3.343 0.736) 4.779 8.845 ( -2.505 -12.048 -0.538) 12.318 9.124 ( 6.067 0.679 -2.305) 6.525 9.201 ( 0.217 -1.265 -5.656) 5.799 9.348 ( -2.296 4.450 -5.746) 7.622 9.561 ( 1.658 -4.331 -6.741) 8.182 10.062 ( 4.316 -2.745 16.635) 17.404 10.465 ( 2.781 3.743 -0.557) 4.696 10.681 ( -3.300 -3.387 -0.515) 4.756 11.089 ( 0.133 6.464 5.551) 8.521 11.170 ( 4.993 -3.987 0.065) 6.390 11.468 ( 7.143 1.774 -3.033) 7.960 11.762 ( 8.268 -1.109 -3.539) 9.061 11.808 ( -10.321 0.946 -4.849) 11.443 12.525 ( -5.644 -0.755 -4.174) 7.060 13.059 ( -7.549 -3.141 3.394) 8.853 13.378 ( 5.794 -3.387 12.010) 13.758 13.489 ( -5.116 0.808 4.798) 7.060 13.861 ( -5.429 4.801 5.796) 9.280 14.225 ( 6.717 3.182 -6.728) 10.025 14.585 ( 9.859 -2.833 -3.122) 10.723 14.651 ( -0.008 -0.690 8.658) 8.685 14.779 ( 4.155 -4.277 5.322) 7.993 15.051 ( -8.304 -3.912 7.547) 11.883 15.512 ( -9.782 4.180 -5.719) 12.078 16.603 ( -12.227 1.151 -7.464) 14.372 16.815 ( -10.993 3.777 1.837) 11.769 17.166 ( -2.129 5.786 2.382) 6.610 17.673 ( 8.292 -1.603 -4.774) 9.701 17.922 ( 9.307 3.183 -1.386) 9.934 18.215 ( 11.572 -1.021 -5.191) 12.724 18.979 ( 3.148 -6.078 -3.347) 7.619 20.073 ( -5.581 -0.654 1.623) 5.848 21.099 ( 5.081 -6.291 -5.830) 9.969 21.425 ( -1.862 -0.871 3.448) 4.014 21.597 ( -2.436 -0.420 0.239) 2.484 24.982 ( -0.408 -1.735 1.771) 2.513 25.438 ( -2.483 0.533 -1.265) 2.837 28.911 ( 0.044 -1.400 3.067) 3.372 29.092 ( 0.370 0.031 -1.941) 1.976 34.163 ( -7.670 -0.525 -4.192) 8.757 35.808 ( 20.233 14.310 12.408) 27.715 37.574 ( -3.219 -0.204 3.128) 4.493 38.192 ( 1.932 3.045 6.796) 7.693 40.887 ( -5.007 13.233 -8.641) 16.579 41.015 ( -5.733 -0.351 12.195) 13.480 41.545 ( 10.310 -7.514 0.965) 12.794 42.929 ( -9.528 -3.983 -39.591) 40.916 ======================= Grid point 226 (112/205) ======================= q-point: (-0.11 -0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.256 ( -28.503 -30.029 -3.691) 41.566 2.502 ( -8.204 -48.912 9.733) 50.541 3.914 ( 4.114 5.786 2.405) 7.496 4.417 ( -15.641 5.201 3.441) 16.838 4.566 ( -19.121 -0.807 23.913) 30.628 4.669 ( -5.797 3.822 5.418) 8.807 4.891 ( 3.163 0.971 1.165) 3.508 5.237 ( -0.179 4.124 4.298) 5.959 5.869 ( 7.413 4.961 -5.056) 10.253 6.023 ( -11.581 12.451 -2.535) 17.192 6.467 ( -3.717 -6.325 -5.413) 9.117 6.593 ( 6.810 3.677 -0.827) 7.783 6.918 ( -9.013 -4.304 -4.487) 10.950 7.346 ( 11.076 1.931 2.645) 11.551 7.480 ( 2.582 5.906 5.455) 8.444 7.651 ( 4.600 11.904 -11.748) 17.346 7.840 ( 10.433 -7.985 -6.883) 14.832 8.271 ( 5.966 10.051 4.550) 12.542 8.528 ( 1.429 -0.101 -3.942) 4.194 8.917 ( -5.418 -4.525 0.192) 7.061 9.009 ( -0.546 8.258 -8.150) 11.615 9.327 ( 3.865 -5.560 -2.619) 7.261 9.354 ( 1.108 -4.896 -0.943) 5.107 9.624 ( 4.129 -3.507 -7.699) 9.414 10.275 ( 9.727 -2.039 19.841) 22.191 10.418 ( 1.337 4.905 -0.509) 5.110 10.702 ( -0.673 -1.859 -0.997) 2.214 10.947 ( 1.778 9.332 7.231) 11.939 11.349 ( 8.401 -4.530 2.446) 9.853 11.455 ( 1.291 4.320 -5.243) 6.915 11.688 ( -5.745 -3.140 -4.002) 7.673 11.909 ( 12.226 0.198 -0.038) 12.228 12.448 ( -6.427 0.157 -1.158) 6.532 13.048 ( -8.229 -5.458 0.563) 9.891 13.426 ( -8.741 -2.780 2.183) 9.429 13.559 ( 4.601 -5.603 10.785) 12.996 13.717 ( -5.947 6.323 4.837) 9.937 14.223 ( 5.546 4.501 0.841) 7.192 14.564 ( -16.095 2.597 10.032) 19.143 14.764 ( 11.045 -2.094 -2.339) 11.482 14.878 ( 0.927 -2.080 2.690) 3.524 15.208 ( 0.967 -4.018 4.689) 6.250 15.309 ( 0.173 -2.500 -6.691) 7.145 16.298 ( -20.218 6.906 -3.989) 21.734 16.687 ( -7.852 -1.613 -1.689) 8.192 17.042 ( -3.049 6.697 3.347) 8.084 17.793 ( 12.793 0.096 -9.561) 15.971 17.976 ( 10.064 3.088 -2.534) 10.828 18.326 ( 10.880 1.225 -3.507) 11.496 19.067 ( -3.605 -5.186 -5.022) 8.069 20.078 ( -2.396 -3.242 9.129) 9.979 21.301 ( 8.996 -10.767 -6.314) 15.386 21.428 ( -2.241 -0.949 2.777) 3.693 21.585 ( -1.407 -0.919 -0.473) 1.746 25.029 ( 0.755 -3.293 0.835) 3.480 25.389 ( -2.674 1.255 -0.736) 3.044 28.947 ( -0.761 -1.895 2.802) 3.467 29.089 ( 0.060 -0.147 -0.825) 0.840 34.101 ( -3.750 -2.411 -3.347) 5.575 35.656 ( 3.977 29.427 12.680) 32.289 37.586 ( 1.245 -1.361 2.479) 3.090 38.150 ( -0.841 5.665 4.515) 7.292 40.597 ( -3.968 10.612 -6.517) 13.070 41.001 ( -6.312 0.042 12.196) 13.733 41.647 ( -1.735 -0.648 -8.753) 8.947 42.857 ( -1.142 -14.387 -32.069) 35.167 ======================= Grid point 234 (113/205) ======================= q-point: (-0.22 -0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.349 ( -33.403 -0.000 20.012) 38.939 1.690 ( -43.476 -0.000 -12.699) 45.293 4.112 ( -3.031 -0.000 3.819) 4.876 4.312 ( -7.278 -0.000 10.875) 13.086 4.579 ( -33.058 -0.000 26.425) 42.321 4.788 ( 13.615 0.000 -7.127) 15.368 5.089 ( -12.055 -0.000 9.683) 15.462 5.103 ( 4.743 0.000 6.288) 7.876 6.031 ( 2.773 0.000 -10.981) 11.326 6.212 ( 1.832 0.000 -2.955) 3.477 6.572 ( 1.846 0.000 -15.911) 16.017 6.597 ( -8.774 -0.000 -5.823) 10.531 6.759 ( 8.607 0.000 0.581) 8.627 7.310 ( 12.326 0.000 6.802) 14.078 7.609 ( -3.509 -0.000 0.543) 3.551 7.787 ( 6.909 0.000 -4.857) 8.446 7.872 ( 8.295 0.000 0.875) 8.341 8.446 ( 0.876 0.000 -2.649) 2.790 8.555 ( -6.700 -0.000 -4.192) 7.904 8.680 ( -0.421 -0.000 5.522) 5.538 9.175 ( 4.216 0.000 -3.136) 5.255 9.215 ( 5.314 0.000 -3.675) 6.460 9.389 ( 1.117 0.000 -8.607) 8.679 9.494 ( 2.893 0.000 -1.486) 3.253 10.222 ( 12.107 0.000 24.624) 27.439 10.540 ( 3.754 0.000 -3.121) 4.882 10.607 ( -2.111 -0.000 0.631) 2.203 11.156 ( -2.309 -0.000 10.542) 10.791 11.233 ( 8.828 0.000 5.651) 10.482 11.568 ( 8.493 0.000 -4.774) 9.742 11.640 ( -7.829 -0.000 -6.157) 9.960 11.917 ( 15.286 0.000 -5.488) 16.241 12.415 ( -7.572 -0.000 -5.396) 9.298 12.923 ( -12.912 -0.000 5.544) 14.052 13.405 ( -11.107 -0.000 1.942) 11.275 13.455 ( 3.855 0.000 12.916) 13.479 13.836 ( -8.731 -0.000 4.644) 9.890 14.340 ( 8.046 0.000 -5.313) 9.641 14.600 ( 1.790 0.000 2.038) 2.712 14.623 ( -7.992 -0.000 11.594) 14.082 14.884 ( 13.091 0.000 0.856) 13.119 15.017 ( 4.727 0.000 3.717) 6.014 15.419 ( -9.034 -0.000 -7.017) 11.439 16.402 ( -18.243 -0.000 -9.076) 20.376 16.690 ( -15.649 -0.000 5.005) 16.430 17.246 ( 2.554 0.000 -1.096) 2.779 17.722 ( 7.035 0.000 -2.344) 7.416 18.042 ( 8.466 0.000 -4.805) 9.734 18.349 ( 14.908 0.000 -5.469) 15.880 18.925 ( -0.839 -0.000 -5.616) 5.679 20.026 ( -3.007 -0.000 7.317) 7.911 21.072 ( 4.081 0.000 -4.808) 6.306 21.409 ( -2.019 -0.000 3.157) 3.747 21.572 ( -1.555 -0.000 0.726) 1.716 24.972 ( -0.017 -0.000 1.619) 1.619 25.407 ( -2.661 -0.000 -1.010) 2.846 28.910 ( -0.469 -0.000 2.953) 2.990 29.087 ( 0.173 0.000 -2.247) 2.254 34.061 ( -5.381 -0.000 -3.936) 6.667 36.304 ( 30.286 0.000 10.055) 31.912 37.540 ( -3.409 -0.000 3.243) 4.705 38.278 ( 1.821 0.000 9.504) 9.677 40.881 ( -4.966 -0.000 -19.179) 19.811 40.997 ( -6.325 -0.000 12.668) 14.159 41.631 ( 10.050 0.000 7.656) 12.634 42.490 ( -25.249 -0.000 -50.380) 56.353 ======================= Grid point 235 (114/205) ======================= q-point: (-0.11 -0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.339 ( -34.161 -27.695 -4.694) 44.228 1.695 ( -7.283 -49.266 28.853) 57.556 3.767 ( -60.981 -1.525 25.450) 66.096 4.179 ( -10.786 5.944 7.770) 14.561 4.412 ( -7.765 -3.540 7.493) 11.356 4.801 ( -0.054 7.832 6.331) 10.071 5.076 ( 14.696 5.157 -1.726) 15.669 5.349 ( 14.284 -5.433 1.817) 15.390 5.931 ( -1.281 2.957 -9.440) 9.975 6.222 ( -2.781 19.653 -8.877) 21.743 6.278 ( -3.698 -6.005 -6.015) 9.269 6.683 ( -2.423 -7.932 -9.939) 12.945 6.790 ( 5.654 6.821 -1.365) 8.964 7.486 ( -0.579 5.859 1.748) 6.141 7.623 ( 16.947 -5.862 9.755) 20.414 7.822 ( 7.227 5.375 -10.327) 13.703 7.875 ( 3.111 3.263 -3.570) 5.751 8.388 ( -9.411 -4.406 -11.786) 15.712 8.468 ( 1.172 4.222 0.380) 4.398 8.737 ( -6.274 -6.766 4.238) 10.154 9.154 ( 0.095 6.828 -2.466) 7.260 9.311 ( 9.540 -3.218 -1.930) 10.251 9.319 ( 1.091 3.182 -2.926) 4.458 9.586 ( 1.735 -3.865 -3.874) 5.740 10.454 ( 6.159 0.265 15.859) 17.015 10.520 ( 3.563 4.260 1.428) 5.734 10.647 ( 0.285 -3.504 -1.376) 3.775 11.217 ( 17.420 6.921 20.089) 27.476 11.419 ( 12.819 -4.211 9.245) 16.357 11.561 ( -0.843 3.175 -5.055) 6.029 11.592 ( 3.193 2.312 -3.152) 5.047 12.074 ( 15.505 0.981 -5.516) 16.487 12.342 ( -5.741 -3.208 -3.182) 7.306 12.826 ( -14.143 -6.039 3.473) 15.765 13.270 ( -12.202 -0.436 -0.035) 12.210 13.573 ( 2.671 -3.318 12.314) 13.029 13.712 ( -9.813 2.605 2.235) 10.396 14.278 ( -10.281 3.889 3.605) 11.568 14.566 ( 0.323 5.273 7.624) 9.276 14.757 ( 7.461 -7.500 2.364) 10.840 15.000 ( 9.024 4.700 0.566) 10.191 15.183 ( 5.599 -6.447 2.512) 8.901 15.246 ( -4.724 1.546 -9.693) 10.893 16.093 ( -22.383 2.023 -7.873) 23.813 16.527 ( -14.369 -0.830 4.252) 15.008 17.177 ( 0.886 8.624 -0.893) 8.715 17.866 ( 10.302 -5.589 -6.161) 13.241 18.095 ( 7.020 1.560 -7.140) 10.134 18.487 ( 13.811 1.775 -3.455) 14.347 18.897 ( -7.770 -4.608 -7.201) 11.552 20.088 ( 3.750 -1.135 15.277) 15.771 21.191 ( 5.947 -10.026 -5.143) 12.741 21.401 ( -1.822 -0.714 2.222) 2.961 21.566 ( -0.366 -0.431 0.552) 0.790 24.997 ( 0.620 -2.117 1.222) 2.521 25.369 ( -2.527 0.467 -0.828) 2.700 28.921 ( -1.187 -1.134 2.719) 3.176 29.083 ( 0.251 -0.336 -1.705) 1.756 34.019 ( -1.675 -1.869 -2.664) 3.660 36.333 ( 11.078 38.585 4.417) 40.386 37.570 ( 1.775 -4.468 1.732) 5.110 38.250 ( -3.643 7.381 4.754) 9.506 40.669 ( -2.811 7.898 -13.441) 15.841 40.970 ( -7.455 -0.305 10.937) 13.240 41.577 ( -12.154 6.935 -10.517) 17.505 42.308 ( -9.250 -30.825 -32.346) 45.629 ======================= Grid point 244 (115/205) ======================= q-point: (-0.11 -0.11 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.056 ( -2.314 -0.000 36.388) 36.462 1.134 ( -4.198 -0.000 41.860) 42.070 3.029 ( -73.824 -0.000 36.590) 82.394 4.134 ( -12.405 -0.000 8.848) 15.237 4.392 ( 2.680 0.000 2.471) 3.645 4.896 ( 0.530 0.000 8.595) 8.612 5.327 ( 7.723 0.000 1.486) 7.864 5.414 ( 18.848 0.000 -10.085) 21.376 5.851 ( -6.248 -0.000 -15.351) 16.574 6.145 ( -3.822 -0.000 -6.119) 7.215 6.462 ( 0.769 0.000 -3.815) 3.891 6.465 ( -1.258 -0.000 -4.867) 5.027 6.933 ( 6.482 0.000 -10.923) 12.701 7.510 ( -2.735 -0.000 1.830) 3.291 7.739 ( 6.810 0.000 -2.337) 7.200 7.901 ( -2.013 -0.000 -7.164) 7.442 7.983 ( 17.452 0.000 4.776) 18.093 8.118 ( -15.885 -0.000 -11.281) 19.483 8.509 ( 1.910 0.000 -5.758) 6.066 8.613 ( -7.942 -0.000 5.999) 9.953 9.194 ( 1.933 0.000 -0.262) 1.951 9.340 ( 0.966 0.000 3.770) 3.892 9.492 ( -1.021 -0.000 -4.299) 4.418 9.503 ( 7.312 0.000 -1.232) 7.415 10.526 ( -0.104 -0.000 5.779) 5.780 10.601 ( 4.324 0.000 -3.238) 5.402 10.615 ( -2.312 -0.000 6.558) 6.953 11.506 ( -0.172 -0.000 -1.533) 1.542 11.510 ( 10.114 0.000 5.727) 11.623 11.724 ( 8.238 0.000 -4.920) 9.596 11.885 ( 48.388 0.000 35.005) 59.722 12.210 ( -5.895 -0.000 -3.886) 7.061 12.277 ( 23.577 0.000 -9.590) 25.453 12.598 ( -17.118 -0.000 5.873) 18.098 13.139 ( -9.843 -0.000 -0.656) 9.865 13.564 ( -12.817 -0.000 3.014) 13.167 13.656 ( 2.276 0.000 8.002) 8.319 14.184 ( -13.989 -0.000 5.755) 15.126 14.663 ( 2.378 0.000 5.374) 5.876 14.847 ( 14.802 0.000 5.648) 15.843 15.127 ( 3.941 0.000 -5.431) 6.710 15.129 ( -3.231 -0.000 -9.214) 9.764 15.224 ( 2.635 0.000 0.350) 2.658 15.766 ( -26.625 -0.000 -8.007) 27.803 16.376 ( -14.397 -0.000 9.013) 16.985 17.235 ( -1.949 -0.000 -9.748) 9.941 17.860 ( 5.174 0.000 -1.910) 5.516 18.143 ( 3.903 0.000 -8.887) 9.706 18.650 ( 12.725 0.000 -3.662) 13.242 18.709 ( -12.352 -0.000 -2.620) 12.627 20.282 ( 17.440 0.000 19.800) 26.385 21.136 ( 3.567 0.000 -3.131) 4.746 21.381 ( -1.622 -0.000 1.625) 2.296 21.561 ( -0.383 -0.000 0.393) 0.549 24.992 ( 0.566 0.000 1.390) 1.500 25.339 ( -2.392 -0.000 -1.070) 2.621 28.905 ( -1.651 -0.000 2.410) 2.921 29.075 ( 0.481 0.000 -1.904) 1.964 33.996 ( 1.950 0.000 -0.864) 2.133 36.862 ( -0.005 -0.000 -30.070) 30.070 37.498 ( -2.465 -0.000 3.166) 4.013 38.209 ( -20.789 -0.000 -10.922) 23.484 40.671 ( 5.387 0.000 -8.587) 10.137 40.896 ( -8.772 -0.000 6.794) 11.095 41.341 ( -26.990 -0.000 -16.523) 31.646 41.823 ( 1.955 0.000 4.362) 4.780 ======================= Grid point 245 (116/205) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.475 ( 12.004 0.000 44.214) 45.815 2.724 ( -11.971 -0.000 45.456) 47.006 3.169 ( 13.153 0.000 51.413) 53.069 4.085 ( -10.834 -0.000 8.688) 13.887 4.454 ( 3.177 0.000 -2.918) 4.314 4.866 ( -6.306 -0.000 -27.578) 28.290 4.997 ( 8.999 0.000 -28.381) 29.774 5.466 ( 4.752 0.000 11.738) 12.663 5.528 ( 9.626 0.000 -17.711) 20.158 5.952 ( -0.911 -0.000 -2.867) 3.008 6.457 ( -8.530 -0.000 1.678) 8.693 6.523 ( 2.733 0.000 4.308) 5.101 6.830 ( 2.554 0.000 0.593) 2.622 6.922 ( -13.946 -0.000 -21.084) 25.279 7.506 ( -7.566 -0.000 -8.461) 11.350 7.769 ( -4.324 -0.000 -10.970) 11.791 7.862 ( 12.431 0.000 9.050) 15.376 8.307 ( -1.365 -0.000 -4.334) 4.544 8.551 ( -3.667 -0.000 0.414) 3.690 8.621 ( 5.600 0.000 0.614) 5.634 9.156 ( -7.515 -0.000 4.524) 8.772 9.257 ( -2.845 -0.000 1.746) 3.338 9.532 ( 3.642 0.000 -0.696) 3.708 9.597 ( 1.041 0.000 -1.623) 1.928 10.574 ( 0.106 0.000 1.407) 1.411 10.666 ( 2.616 0.000 -1.171) 2.866 10.840 ( -0.906 -0.000 12.786) 12.818 11.608 ( 5.263 0.000 3.761) 6.469 11.692 ( 3.445 0.000 -11.491) 11.996 11.785 ( 4.421 0.000 0.571) 4.458 11.942 ( -11.907 -0.000 -1.243) 11.972 12.257 ( 0.821 0.000 -8.148) 8.189 12.581 ( 3.307 0.000 9.660) 10.211 12.894 ( -17.424 -0.000 -1.593) 17.496 12.959 ( -4.763 -0.000 0.861) 4.840 13.450 ( 30.620 0.000 -12.014) 32.893 13.958 ( -0.206 -0.000 10.474) 10.476 14.081 ( -7.437 -0.000 7.466) 10.538 14.514 ( -8.261 -0.000 -5.358) 9.846 14.731 ( -4.112 -0.000 -11.491) 12.205 15.104 ( 1.288 0.000 5.531) 5.679 15.264 ( 7.024 0.000 -0.789) 7.068 15.380 ( 8.142 0.000 5.164) 9.641 15.501 ( -4.866 -0.000 2.337) 5.398 16.422 ( -7.277 -0.000 11.912) 13.959 16.970 ( 3.459 0.000 -4.404) 5.600 17.888 ( 0.221 0.000 -0.547) 0.590 17.993 ( -1.646 -0.000 -5.015) 5.278 18.571 ( -7.162 -0.000 3.778) 8.097 18.812 ( 7.689 0.000 -3.124) 8.299 20.976 ( 9.223 0.000 1.706) 9.379 21.114 ( -0.047 -0.000 -2.785) 2.786 21.402 ( 1.084 0.000 1.327) 1.714 21.501 ( 0.318 0.000 -1.655) 1.685 25.062 ( 0.918 0.000 2.738) 2.888 25.237 ( -1.715 -0.000 -2.655) 3.160 28.923 ( -2.027 -0.000 2.394) 3.137 29.058 ( 2.316 0.000 -1.913) 3.004 34.273 ( 15.304 0.000 7.437) 17.016 34.769 ( -53.149 -0.000 -8.297) 53.793 37.540 ( -1.746 -0.000 4.035) 4.397 37.781 ( -1.488 -0.000 -3.720) 4.007 40.726 ( -13.767 -0.000 1.932) 13.902 40.900 ( 10.107 0.000 -4.106) 10.909 41.791 ( -10.727 -0.000 0.355) 10.733 41.883 ( 42.202 0.000 -1.902) 42.245 ======================= Grid point 246 (117/205) ======================= q-point: ( 0.11 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.598 ( 0.531 8.283 43.087) 43.879 2.893 ( 12.577 -6.319 39.782) 42.198 3.909 ( 18.541 -20.289 31.374) 41.710 3.978 ( -8.814 -1.812 9.368) 12.990 4.312 ( -2.584 16.531 -16.731) 23.661 4.606 ( 6.958 8.032 -6.381) 12.395 5.108 ( 12.946 -10.227 -29.946) 34.190 5.587 ( 8.262 1.441 15.226) 17.383 5.693 ( 7.540 -11.186 -19.435) 23.658 5.896 ( -2.160 2.877 -5.046) 6.198 6.293 ( -10.536 2.850 4.951) 11.985 6.573 ( 1.994 -0.866 6.065) 6.443 6.790 ( -9.143 -5.087 -6.711) 12.430 6.913 ( -0.284 -8.713 -8.970) 12.508 7.301 ( -11.384 6.691 -4.310) 13.890 7.620 ( -4.593 4.649 -15.257) 16.598 7.999 ( 7.778 4.906 9.280) 13.064 8.250 ( -2.393 1.090 -6.033) 6.581 8.538 ( 1.736 -3.177 -0.269) 3.631 8.716 ( -4.170 -6.980 -2.116) 8.402 9.082 ( -1.357 5.072 8.327) 9.844 9.153 ( -5.143 6.819 -0.407) 8.551 9.507 ( -0.899 7.154 -2.110) 7.513 9.580 ( 2.205 -0.240 -0.763) 2.345 10.576 ( -2.268 0.456 -0.033) 2.314 10.639 ( -0.221 3.312 0.915) 3.443 10.879 ( 0.188 0.585 10.403) 10.421 11.565 ( -2.938 7.032 -6.395) 9.948 11.681 ( -2.328 0.842 0.597) 2.546 11.795 ( -5.688 -0.187 -4.986) 7.566 11.849 ( -2.192 0.039 2.962) 3.685 12.115 ( -16.426 0.991 -0.070) 16.456 12.604 ( 1.768 -0.319 -1.495) 2.337 12.854 ( 2.174 -5.269 1.026) 5.791 13.014 ( 10.973 -0.526 0.788) 11.014 13.545 ( 15.206 15.573 -11.027) 24.399 13.921 ( -3.593 4.860 12.291) 13.696 14.122 ( -2.010 -5.525 11.337) 12.771 14.412 ( 0.100 2.317 -0.218) 2.329 14.626 ( -3.322 1.288 -7.475) 8.281 15.174 ( -3.500 -6.967 5.236) 9.391 15.410 ( 8.167 1.419 -0.319) 8.296 15.428 ( -8.673 -9.352 -2.422) 12.983 15.612 ( 13.746 -8.524 -2.848) 16.423 16.424 ( -2.988 -2.133 8.818) 9.552 16.948 ( 2.508 6.817 -0.623) 7.290 17.806 ( -4.785 6.097 -1.324) 7.862 17.952 ( -1.061 0.314 -5.355) 5.468 18.504 ( -7.505 -0.131 3.018) 8.091 18.929 ( 4.862 -6.525 -2.939) 8.652 20.942 ( -3.304 7.342 3.295) 8.699 21.103 ( -0.327 -1.408 -3.656) 3.932 21.460 ( 0.053 -2.721 -0.675) 2.804 21.561 ( 8.871 -1.833 -2.978) 9.535 25.103 ( 0.698 -2.216 2.881) 3.701 25.218 ( -1.021 -0.881 -2.684) 3.003 28.921 ( -1.629 -1.204 2.279) 3.049 29.097 ( 2.716 -1.890 -1.868) 3.800 34.248 ( -28.164 0.615 2.139) 28.252 34.513 ( 16.658 -0.497 11.277) 20.122 37.557 ( -1.505 -1.782 3.834) 4.488 37.762 ( -0.440 -0.670 -3.328) 3.423 40.557 ( -13.166 1.337 1.575) 13.327 41.023 ( 10.529 -1.686 -2.093) 10.866 41.635 ( -9.852 1.544 -1.631) 10.105 42.392 ( 35.191 -4.973 -13.450) 38.001 ======================= Grid point 247 (118/205) ======================= q-point: ( 0.22 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.768 ( 9.764 -2.634 35.374) 36.791 3.367 ( 23.533 -5.362 28.168) 37.094 3.778 ( -8.999 7.463 -23.967) 26.666 3.922 ( 1.071 6.266 -2.950) 7.008 4.320 ( 7.120 6.741 12.419) 15.823 4.923 ( 14.660 -16.280 16.705) 27.550 5.351 ( 17.450 -7.150 -16.852) 25.291 5.612 ( -15.107 3.660 -11.803) 19.517 5.687 ( 3.622 1.749 10.865) 11.585 5.999 ( 7.357 -7.565 0.643) 10.572 6.221 ( -3.735 -4.483 -0.324) 5.843 6.618 ( -13.633 -4.685 4.107) 14.989 6.707 ( 1.693 4.545 -1.056) 4.964 7.022 ( -0.337 -11.273 -17.442) 20.771 7.162 ( -2.530 -5.629 6.689) 9.101 7.415 ( -4.199 6.747 -12.598) 14.895 7.914 ( -2.977 10.849 4.240) 12.023 8.233 ( 0.736 -2.187 -5.106) 5.603 8.627 ( -7.724 9.538 1.308) 12.343 8.679 ( 5.544 -6.385 -3.151) 9.024 8.915 ( -7.031 7.564 1.959) 10.511 9.108 ( 8.596 3.088 -2.941) 9.596 9.387 ( -3.626 1.823 0.759) 4.129 9.602 ( 1.960 -0.024 -1.556) 2.503 10.465 ( -7.174 3.780 -1.418) 8.232 10.613 ( 0.244 2.617 1.931) 3.262 10.892 ( -1.220 1.656 6.414) 6.735 11.333 ( -11.302 10.078 1.728) 15.241 11.518 ( -11.670 3.347 -2.176) 12.334 11.717 ( -5.465 1.016 -3.089) 6.360 11.765 ( -6.911 1.433 0.105) 7.059 12.075 ( 3.054 -1.173 3.098) 4.506 12.619 ( -3.363 -2.713 -7.610) 8.751 13.003 ( 5.727 -7.232 1.075) 9.287 13.146 ( 14.315 8.551 2.059) 16.801 13.440 ( 9.006 4.694 -1.033) 10.208 13.852 ( 0.462 6.803 10.431) 12.462 14.187 ( -3.108 -0.003 8.304) 8.867 14.484 ( 7.631 -3.880 3.897) 9.406 14.581 ( 1.572 0.212 -3.505) 3.847 15.262 ( -13.029 -7.499 3.966) 15.548 15.312 ( -1.676 -0.653 0.620) 1.902 15.620 ( 4.838 -8.128 -1.963) 9.660 15.894 ( 8.826 -10.183 -10.117) 16.851 16.445 ( -1.217 -0.213 3.799) 3.995 16.853 ( 3.503 7.636 3.144) 8.970 17.628 ( -4.376 6.944 -3.263) 8.833 17.899 ( -1.648 1.831 -5.021) 5.593 18.410 ( -8.586 1.298 1.929) 8.895 19.078 ( 1.760 -7.773 -2.630) 8.392 20.763 ( -7.985 7.100 5.063) 11.824 21.151 ( 3.547 -3.251 -2.818) 5.576 21.482 ( 0.055 -0.945 -0.733) 1.198 21.668 ( 7.286 -0.345 -4.568) 8.607 25.154 ( -0.335 -1.998 1.599) 2.581 25.223 ( -0.271 -2.072 -1.432) 2.534 28.936 ( -1.508 -1.834 2.222) 3.252 29.152 ( 2.035 -1.800 -1.263) 2.996 34.081 ( -8.424 -3.776 2.064) 9.459 34.744 ( 13.941 1.098 12.895) 19.022 37.583 ( -0.665 -1.206 4.034) 4.263 37.770 ( 0.423 -1.939 -2.436) 3.142 40.406 ( -11.079 -0.014 1.694) 11.208 41.169 ( 8.302 -1.958 1.749) 8.707 41.501 ( -8.575 -0.663 -6.166) 10.583 42.732 ( 25.796 -0.610 -17.942) 31.428 ======================= Grid point 248 (119/205) ======================= q-point: ( 0.33 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.154 ( 16.456 -9.186 27.037) 32.957 3.451 ( -1.199 1.657 -20.489) 20.591 3.875 ( 9.329 -2.517 2.896) 10.088 3.957 ( 25.724 0.489 10.696) 27.863 4.326 ( 5.499 9.286 18.671) 21.565 5.133 ( -2.176 12.705 -1.254) 12.951 5.325 ( -17.319 -9.324 0.519) 19.676 5.525 ( -0.072 0.492 -0.095) 0.507 5.708 ( -12.365 -4.205 -1.967) 13.207 6.039 ( 9.236 4.112 -3.311) 10.638 6.422 ( 7.181 -8.924 -8.533) 14.283 6.505 ( -11.639 -4.040 4.793) 13.220 6.747 ( 1.094 -9.339 7.186) 11.835 7.161 ( 3.705 -9.246 -9.447) 13.729 7.202 ( -7.239 4.436 -10.415) 13.437 7.451 ( 9.566 -13.810 13.445) 21.517 7.683 ( -6.192 11.699 1.771) 13.354 8.220 ( -5.419 6.795 -11.442) 14.368 8.323 ( 2.902 11.327 1.726) 11.819 8.636 ( -3.019 7.333 -7.488) 10.907 8.956 ( 6.149 -7.844 -1.952) 10.156 9.125 ( 6.838 5.522 0.116) 8.790 9.404 ( -4.353 -8.583 -0.178) 9.625 9.618 ( 2.981 0.596 -3.065) 4.317 10.339 ( -4.371 0.709 -2.787) 5.233 10.539 ( -2.365 6.305 2.520) 7.190 10.824 ( -6.117 4.840 2.144) 8.089 11.078 ( -8.262 7.447 9.648) 14.724 11.367 ( -6.048 1.107 -1.541) 6.339 11.574 ( -8.588 2.818 -7.465) 11.722 11.732 ( -0.094 -1.928 1.939) 2.736 12.112 ( 2.671 4.235 1.869) 5.344 12.529 ( -5.861 1.859 -5.874) 8.503 13.141 ( 0.413 0.400 2.711) 2.771 13.222 ( 7.755 -8.076 2.245) 11.419 13.580 ( 14.436 0.415 3.241) 14.801 13.831 ( 6.611 5.454 10.086) 13.236 14.137 ( -3.719 3.214 3.830) 6.231 14.599 ( 4.040 -0.347 -3.405) 5.295 14.680 ( 8.060 -3.310 7.363) 11.408 15.127 ( -14.180 -0.201 -1.139) 14.227 15.382 ( -8.250 -7.909 2.579) 11.716 15.750 ( 2.681 -1.411 0.208) 3.037 15.974 ( -2.282 -2.077 -6.370) 7.078 16.516 ( 6.881 -4.462 -0.573) 8.221 16.844 ( 5.047 1.728 1.528) 5.549 17.494 ( 0.532 4.110 -4.950) 6.456 17.819 ( -1.680 3.239 -4.990) 6.182 18.285 ( -7.609 2.263 0.543) 7.957 19.177 ( -1.926 -5.614 -1.522) 6.127 20.595 ( -6.656 5.689 5.886) 10.551 21.249 ( 4.692 -3.757 -2.162) 6.388 21.491 ( 0.075 -0.418 -0.096) 0.436 21.704 ( 4.634 2.131 -4.574) 6.851 25.164 ( -0.130 0.128 -0.495) 0.528 25.263 ( -0.734 -3.317 0.403) 3.421 28.959 ( -1.294 -1.973 2.007) 3.098 29.184 ( 0.727 -0.403 -0.037) 0.832 34.116 ( 0.154 -4.337 0.011) 4.339 34.899 ( 7.861 1.354 11.144) 13.705 37.610 ( 0.498 -0.265 3.969) 4.009 37.817 ( 1.419 -3.430 -0.801) 3.797 40.317 ( -7.992 -2.226 1.745) 8.478 41.246 ( -5.144 -1.098 7.817) 9.422 41.442 ( 3.204 -1.973 -11.978) 12.555 42.895 ( 17.877 2.996 -18.327) 25.777 ======================= Grid point 249 (120/205) ======================= q-point: (-0.56 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.411 ( -0.075 -2.252 -10.728) 10.962 3.585 ( 13.911 -7.857 17.845) 23.952 3.962 ( 13.932 9.389 -1.357) 16.855 4.262 ( -7.227 -0.859 15.886) 17.474 4.376 ( 30.747 2.313 13.416) 33.626 4.829 ( -1.628 14.644 -1.526) 14.813 5.207 ( -23.311 -3.295 2.964) 23.729 5.388 ( -19.508 -1.102 3.073) 19.779 5.580 ( -17.723 -2.041 4.531) 18.406 6.156 ( 12.812 -3.509 -12.864) 18.492 6.448 ( -0.762 -1.143 -11.069) 11.154 6.559 ( 3.317 -5.394 -0.229) 6.336 6.920 ( -16.345 5.351 0.387) 17.203 7.117 ( 11.427 -10.672 6.085) 16.778 7.299 ( 1.172 -5.008 5.297) 7.383 7.378 ( -8.407 12.333 -2.729) 15.173 7.812 ( 4.986 -3.966 5.674) 8.531 8.001 ( 9.493 1.968 -4.481) 10.680 8.330 ( 2.908 0.888 -6.988) 7.621 8.488 ( 0.525 0.150 -12.920) 12.932 9.101 ( 3.271 -3.331 -5.593) 7.285 9.118 ( 1.881 2.215 3.415) 4.484 9.508 ( -2.140 -8.226 0.934) 8.551 9.623 ( 5.261 2.649 -7.525) 9.556 10.329 ( 0.081 -0.938 -3.625) 3.746 10.431 ( -0.222 2.437 3.365) 4.161 10.645 ( -5.843 6.871 5.044) 10.334 10.970 ( -3.583 3.816 7.924) 9.497 11.321 ( -3.621 -0.745 1.579) 4.020 11.430 ( -2.031 1.144 -9.160) 9.452 11.810 ( 2.644 -4.116 3.060) 5.770 12.007 ( -0.861 9.098 0.898) 9.183 12.433 ( -4.622 0.142 -3.753) 5.956 13.154 ( -2.795 -1.695 2.233) 3.959 13.432 ( 1.155 -9.474 4.834) 10.699 13.725 ( 9.905 3.686 4.091) 11.333 13.902 ( 10.103 4.217 8.059) 13.594 14.070 ( -1.010 0.780 4.159) 4.351 14.622 ( 1.172 0.491 -3.274) 3.512 14.817 ( 2.843 -1.391 6.534) 7.260 14.946 ( -14.468 0.136 -0.798) 14.491 15.323 ( -16.118 -3.187 -1.413) 16.491 15.742 ( 10.345 9.489 3.823) 14.549 16.010 ( -4.820 -8.326 -1.137) 9.687 16.632 ( 1.892 -2.253 -1.857) 3.479 16.918 ( 5.965 -2.162 -2.992) 7.015 17.484 ( 5.726 -0.252 -5.890) 8.219 17.725 ( -0.154 3.319 -5.951) 6.815 18.202 ( -1.053 0.575 -0.886) 1.492 19.197 ( -5.353 -2.660 0.009) 5.977 20.473 ( -4.537 4.655 6.956) 9.520 21.348 ( 4.551 -2.636 -2.470) 5.811 21.497 ( -0.086 -0.090 0.920) 0.928 21.681 ( 2.514 3.837 -3.992) 6.081 25.153 ( 0.866 1.389 -0.701) 1.781 25.302 ( -1.363 -2.838 0.287) 3.161 28.982 ( -0.847 -1.671 1.616) 2.474 29.182 ( -0.466 1.067 1.145) 1.633 34.176 ( 1.657 -1.076 -0.733) 2.107 34.997 ( 1.754 -2.806 8.014) 8.671 37.633 ( 1.278 0.411 2.959) 3.249 37.899 ( 1.604 -4.492 0.482) 4.794 40.300 ( -4.207 -3.780 1.407) 5.828 41.180 ( -12.013 -2.297 4.430) 13.008 41.500 ( 7.204 -0.062 -7.230) 10.207 42.925 ( 11.699 6.086 -18.005) 22.318 ======================= Grid point 250 (121/205) ======================= q-point: (-0.44 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.176 ( -12.961 24.954 -4.197) 28.431 3.735 ( 3.031 0.161 -2.247) 3.776 3.988 ( 14.840 6.952 26.228) 30.926 4.409 ( 1.750 5.551 5.044) 7.702 4.636 ( -5.421 0.594 -0.846) 5.518 4.669 ( -2.578 -12.845 10.048) 16.510 5.009 ( -2.830 3.091 5.770) 7.131 5.256 ( -13.843 -4.820 9.805) 17.635 5.413 ( -19.056 -4.877 -0.945) 19.693 6.210 ( 3.396 6.580 -6.363) 9.763 6.394 ( -12.643 9.694 -3.229) 16.255 6.535 ( 6.629 -4.396 -14.310) 16.372 6.830 ( 0.858 -7.118 3.309) 7.896 7.090 ( -6.142 5.747 -8.983) 12.307 7.323 ( -0.898 -2.572 4.293) 5.084 7.482 ( 9.686 -6.044 11.915) 16.502 7.940 ( 13.069 -0.837 -4.169) 13.744 8.101 ( 7.768 2.397 -1.360) 8.243 8.349 ( -1.007 -6.715 -4.765) 8.296 8.560 ( 5.033 -8.468 -13.121) 16.407 9.094 ( -5.333 0.476 -0.197) 5.358 9.126 ( 0.689 -1.722 -2.672) 3.253 9.524 ( -2.607 4.926 -3.517) 6.590 9.631 ( 6.091 0.524 -6.455) 8.891 10.300 ( 1.498 1.816 -0.114) 2.357 10.459 ( -1.051 -3.139 0.249) 3.320 10.652 ( 4.303 -4.406 6.555) 8.994 10.930 ( 4.135 2.779 5.446) 7.381 11.271 ( -3.731 -0.947 -4.371) 5.825 11.456 ( 5.946 -1.551 1.432) 6.310 11.864 ( 0.936 6.720 2.472) 7.221 11.941 ( 5.103 -2.778 2.008) 6.147 12.370 ( -4.155 -0.472 -3.114) 5.214 13.125 ( -7.357 -0.678 2.470) 7.790 13.584 ( -0.642 -6.113 5.234) 8.073 13.652 ( -6.047 7.640 0.043) 9.744 13.941 ( 5.043 5.490 5.985) 9.560 14.195 ( 9.367 -3.790 8.022) 12.902 14.548 ( -13.937 -2.124 -1.155) 14.145 14.798 ( -8.214 -1.762 -4.449) 9.506 14.865 ( -1.815 0.577 9.759) 9.943 15.195 ( -5.505 0.280 -0.802) 5.570 15.731 ( 11.247 11.233 3.479) 16.272 16.055 ( -6.988 -5.655 -0.968) 9.041 16.646 ( -0.089 -0.404 -2.995) 3.023 16.957 ( -2.869 -0.657 -1.516) 3.311 17.540 ( 7.562 -0.594 -9.256) 11.967 17.742 ( 6.966 -3.903 -6.821) 10.502 18.245 ( 7.919 -1.295 -1.736) 8.210 19.138 ( -8.063 0.321 1.547) 8.217 20.397 ( -2.373 3.548 8.794) 9.775 21.411 ( 3.526 -0.377 -3.581) 5.040 21.498 ( 0.425 0.903 1.579) 1.868 21.618 ( 0.477 4.211 -2.993) 5.188 25.136 ( 1.636 2.409 -0.275) 2.926 25.323 ( -1.449 -1.903 -0.222) 2.402 29.002 ( -0.279 -0.874 1.242) 1.544 29.152 ( -1.235 2.001 1.783) 2.950 34.170 ( 0.928 3.210 -0.637) 3.402 35.118 ( -3.944 -11.273 5.215) 13.032 37.651 ( 1.687 0.747 1.661) 2.483 37.989 ( 0.048 -4.961 -0.021) 4.961 40.343 ( 0.380 -3.828 0.512) 3.881 41.094 ( -12.947 -3.795 2.767) 13.772 41.527 ( 4.139 2.672 -3.474) 6.028 42.836 ( 6.604 9.911 -17.955) 21.546 ======================= Grid point 251 (122/205) ======================= q-point: (-0.33 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.466 ( -14.680 36.921 2.669) 39.822 3.688 ( 6.330 24.938 13.940) 29.263 4.053 ( -3.313 5.210 15.386) 16.578 4.232 ( -13.406 -3.026 9.581) 16.753 4.448 ( -32.929 -10.426 6.464) 35.140 4.850 ( 0.014 -0.955 5.538) 5.620 5.059 ( -11.346 5.257 -0.627) 12.520 5.245 ( 10.758 -1.788 5.539) 12.231 5.411 ( -2.371 -18.460 -1.584) 18.679 6.050 ( 5.462 12.027 -0.836) 13.236 6.180 ( -9.439 -0.502 -5.563) 10.968 6.617 ( 3.292 -0.644 -12.823) 13.254 6.863 ( 0.916 3.648 3.879) 5.404 7.097 ( 2.806 -12.609 -12.093) 17.695 7.390 ( 1.706 -3.587 4.276) 5.836 7.715 ( 7.340 -5.123 2.904) 9.410 7.974 ( 14.725 8.957 -4.928) 17.926 8.211 ( -0.313 -1.895 -5.776) 6.087 8.394 ( -3.106 -6.039 0.404) 6.803 8.744 ( 6.870 -10.729 -6.476) 14.292 9.006 ( -5.462 1.679 1.483) 5.903 9.176 ( -0.809 -6.588 -4.900) 8.250 9.345 ( -7.054 6.025 -4.347) 10.245 9.618 ( 6.312 6.923 -6.227) 11.249 10.341 ( 4.596 -2.807 -2.037) 5.758 10.545 ( -1.676 -6.833 6.819) 9.798 10.723 ( -0.112 1.188 0.968) 1.537 11.082 ( 8.192 -7.983 -0.832) 11.468 11.310 ( 11.017 -1.951 0.179) 11.189 11.601 ( 9.286 -3.270 6.296) 11.686 11.806 ( 6.826 6.657 3.408) 10.125 12.067 ( 7.426 -2.618 1.991) 8.122 12.325 ( -2.672 -0.007 -2.729) 3.819 13.015 ( -12.876 1.106 3.217) 13.318 13.388 ( -11.915 9.098 -2.062) 15.133 13.644 ( -6.848 -2.907 2.470) 7.839 13.916 ( 1.802 4.869 7.414) 9.051 14.322 ( -5.748 -0.709 5.347) 7.882 14.455 ( -7.231 -6.833 1.165) 10.017 14.733 ( -10.418 -6.872 0.720) 12.501 14.924 ( 5.301 -0.734 6.489) 8.411 15.168 ( 3.324 2.769 0.356) 4.341 15.654 ( 6.838 13.269 1.801) 15.036 16.005 ( -5.783 1.428 -2.532) 6.473 16.597 ( -4.238 2.797 -2.598) 5.704 16.928 ( -5.838 -5.346 0.040) 7.916 17.647 ( 11.780 -3.337 -11.384) 16.718 17.869 ( 5.486 -4.343 -8.082) 10.690 18.399 ( 14.434 -1.643 -1.785) 14.637 19.014 ( -9.688 3.025 2.987) 10.580 20.386 ( 0.833 1.143 11.231) 11.320 21.396 ( 1.604 4.343 -4.619) 6.540 21.485 ( 1.541 3.172 0.874) 3.633 21.562 ( -0.691 0.591 -1.419) 1.686 25.112 ( 1.827 3.155 0.486) 3.678 25.326 ( -1.370 -0.881 -0.815) 1.821 29.009 ( -0.209 0.523 1.440) 1.546 29.110 ( -1.079 2.071 1.177) 2.615 34.110 ( 1.583 5.153 -0.255) 5.397 35.301 ( -11.912 -21.341 1.384) 24.480 37.661 ( 1.730 1.116 0.459) 2.110 38.039 ( -4.038 -4.270 -2.786) 6.504 40.433 ( 6.464 -2.571 -0.372) 6.966 41.014 ( -13.796 -4.585 2.115) 14.691 41.486 ( 1.309 5.358 -0.147) 5.518 42.624 ( 2.498 14.749 -16.774) 22.475 ======================= Grid point 252 (123/205) ======================= q-point: (-0.22 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.871 ( -1.751 25.289 22.805) 34.097 3.217 ( -5.648 37.884 33.279) 50.740 3.946 ( -34.260 6.912 26.071) 43.603 4.142 ( -4.005 0.705 13.587) 14.182 4.299 ( -15.528 -9.640 -2.389) 18.433 4.803 ( -11.596 -10.958 -4.633) 16.614 4.988 ( 11.039 4.362 -8.000) 14.314 5.324 ( -0.850 -4.566 -9.498) 10.572 5.774 ( 8.107 -9.355 1.898) 12.524 5.957 ( 6.749 7.951 -1.306) 10.511 6.096 ( -4.053 -4.217 -2.690) 6.438 6.580 ( -0.304 0.745 -4.466) 4.538 6.855 ( 4.576 4.409 1.653) 6.566 7.318 ( 4.921 -13.893 -12.564) 19.367 7.489 ( -1.501 -5.818 3.501) 6.953 7.729 ( 1.739 8.323 -14.776) 17.048 8.024 ( -11.894 4.002 -13.300) 18.286 8.106 ( 13.612 -2.585 7.043) 15.543 8.470 ( 2.614 0.233 1.539) 3.042 8.894 ( -7.226 6.747 5.087) 11.118 8.999 ( 4.347 -13.382 -1.159) 14.118 9.203 ( -2.114 -2.311 -3.710) 4.856 9.303 ( 0.235 -9.148 -4.088) 10.023 9.550 ( 4.140 5.836 -3.978) 8.187 10.451 ( 5.730 -3.899 -2.245) 7.285 10.659 ( -1.020 0.707 4.817) 4.975 10.681 ( -1.709 -3.836 5.709) 7.087 11.306 ( 5.876 -12.265 -5.430) 14.644 11.495 ( 8.794 -0.819 1.833) 9.020 11.707 ( 7.533 4.637 3.008) 9.343 11.997 ( 19.943 -5.135 1.109) 20.623 12.213 ( 8.216 -1.216 -0.614) 8.328 12.315 ( 10.811 -0.074 4.429) 11.684 12.804 ( -19.122 3.009 4.217) 19.811 13.129 ( -11.782 3.507 -0.380) 12.299 13.535 ( -13.996 0.248 -2.312) 14.188 13.906 ( 1.167 3.168 9.522) 10.103 14.226 ( -13.377 -1.741 8.126) 15.748 14.516 ( -2.956 -6.518 -3.808) 8.108 14.777 ( -7.383 -10.373 -2.410) 12.958 15.032 ( 7.178 0.889 7.919) 10.725 15.171 ( 5.089 3.847 2.472) 6.842 15.500 ( 4.066 13.947 0.694) 14.544 15.855 ( -4.258 8.260 -4.412) 10.287 16.491 ( -7.411 0.018 3.686) 8.277 16.971 ( -3.683 -6.176 -4.835) 8.665 17.798 ( 10.593 -2.755 -9.880) 14.746 17.927 ( 1.334 -2.761 -7.020) 7.660 18.587 ( 14.376 -0.076 -1.956) 14.509 18.851 ( -8.641 4.797 3.787) 10.584 20.488 ( 6.261 -3.252 12.562) 14.408 21.292 ( 1.352 7.614 -4.798) 9.101 21.449 ( -0.011 2.511 1.040) 2.718 21.556 ( -0.121 -0.115 -1.667) 1.675 25.084 ( 1.463 3.256 1.390) 3.830 25.311 ( -1.567 0.087 -1.571) 2.220 28.988 ( -1.488 1.704 2.505) 3.376 29.077 ( 0.555 1.785 -0.892) 2.071 34.069 ( 4.903 4.337 0.872) 6.603 35.474 ( -27.124 -28.118 -7.608) 39.802 37.653 ( 0.804 2.303 -0.327) 2.462 37.982 ( -9.591 -0.861 -6.435) 11.582 40.585 ( 14.216 -1.691 -0.809) 14.339 40.927 ( -13.614 -3.894 2.353) 14.354 41.408 ( 2.808 7.176 3.879) 8.627 42.316 ( -0.146 17.592 -11.351) 20.937 ======================= Grid point 253 (124/205) ======================= q-point: (-0.11 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.959 ( 15.330 -7.704 43.950) 47.180 2.780 ( -1.747 27.302 43.063) 51.019 3.410 ( -31.458 21.112 45.238) 59.006 4.143 ( -10.186 -4.267 7.144) 13.153 4.366 ( -0.211 -8.477 -3.212) 9.067 4.880 ( -8.342 -16.360 -20.326) 27.394 5.004 ( 13.014 3.899 -21.779) 25.669 5.367 ( 2.628 -2.084 3.662) 4.966 5.679 ( 1.731 13.969 -10.098) 17.323 5.965 ( -1.386 -0.893 -1.373) 2.146 6.310 ( 5.925 -12.383 4.627) 14.486 6.554 ( -1.624 0.923 0.266) 1.887 6.831 ( 2.356 3.530 -0.246) 4.251 7.299 ( -10.681 11.572 -25.460) 29.937 7.540 ( -2.740 -8.375 -11.111) 14.181 7.647 ( 5.617 -4.669 6.452) 9.746 7.859 ( -3.618 0.714 -7.719) 8.555 8.300 ( 2.781 -3.363 1.230) 4.534 8.496 ( 7.859 2.078 1.929) 8.355 8.702 ( -4.299 8.311 2.533) 9.694 9.173 ( -5.488 -8.798 -1.393) 10.463 9.241 ( -2.057 -3.320 2.164) 4.465 9.469 ( 5.609 -6.010 -2.660) 8.640 9.526 ( 2.770 -0.391 -0.534) 2.847 10.562 ( 2.914 -1.941 0.450) 3.530 10.616 ( 1.673 0.799 -0.225) 1.868 10.785 ( -1.296 -3.099 11.822) 12.290 11.544 ( 6.482 -2.183 0.617) 6.868 11.563 ( 5.547 -7.121 -6.946) 11.390 11.752 ( 6.005 2.647 4.339) 7.867 12.060 ( -3.674 1.538 -4.643) 6.118 12.288 ( 13.578 7.714 -7.931) 17.515 12.536 ( -11.463 -3.970 4.768) 13.034 12.839 ( 25.099 -12.872 5.733) 28.784 12.999 ( -5.951 0.008 1.047) 6.042 13.314 ( -15.168 2.263 -4.248) 15.913 13.916 ( 0.268 1.189 10.134) 10.207 14.148 ( -9.971 -1.496 7.665) 12.666 14.555 ( -6.246 -7.620 -6.240) 11.662 14.800 ( -6.732 -4.607 -7.951) 11.391 15.134 ( 6.842 0.877 5.798) 9.011 15.157 ( 4.567 6.736 4.246) 9.179 15.377 ( 6.889 8.378 1.457) 10.944 15.629 ( -6.463 8.761 -1.872) 11.046 16.459 ( -7.522 -2.027 10.261) 12.883 16.967 ( -1.738 -1.570 -7.972) 8.309 17.865 ( 3.046 -0.360 -3.487) 4.644 17.983 ( 2.023 -3.761 -5.718) 7.137 18.655 ( -5.780 1.237 3.948) 7.109 18.756 ( 9.166 4.475 -2.615) 10.530 20.731 ( 12.237 -7.120 9.047) 16.802 21.175 ( 1.022 6.140 -3.678) 7.230 21.419 ( 0.875 2.480 0.712) 2.724 21.532 ( -2.111 0.515 -1.749) 2.790 25.060 ( 1.000 2.223 2.189) 3.276 25.276 ( -1.925 0.581 -2.300) 3.055 28.950 ( -2.309 1.286 2.683) 3.766 29.057 ( 1.720 1.643 -1.956) 3.079 34.114 ( 10.213 2.008 3.418) 10.955 35.356 ( -51.181 -18.013 -17.641) 57.054 37.590 ( -2.197 4.167 1.383) 4.909 37.843 ( -6.215 0.950 -4.950) 8.001 40.785 ( 14.463 -0.731 -4.574) 15.187 40.843 ( -12.599 -3.270 3.429) 13.461 41.449 ( 19.532 2.498 7.977) 21.245 42.017 ( -2.002 13.996 -3.557) 14.579 ======================= Grid point 255 (125/205) ======================= q-point: ( 0.11 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.875 ( 6.873 0.000 36.733) 37.370 3.171 ( 17.363 0.000 41.088) 44.606 3.812 ( -17.868 -0.000 1.005) 17.896 4.148 ( 17.250 0.000 7.693) 18.888 4.444 ( 10.391 0.000 -1.691) 10.528 4.846 ( 18.698 0.000 3.083) 18.950 4.882 ( 4.020 0.000 -31.848) 32.100 5.700 ( 11.736 0.000 -13.066) 17.562 5.780 ( 15.596 0.000 8.553) 17.787 5.846 ( -7.029 -0.000 -9.340) 11.689 6.182 ( -14.281 -0.000 8.391) 16.564 6.476 ( -9.538 -0.000 2.958) 9.986 6.738 ( 7.757 0.000 -2.746) 8.228 6.871 ( -0.109 -0.000 1.711) 1.715 7.216 ( -11.671 -0.000 -2.407) 11.917 7.472 ( -10.345 -0.000 -20.191) 22.687 8.169 ( 4.734 0.000 9.430) 10.552 8.189 ( -4.170 -0.000 -11.692) 12.413 8.521 ( -0.414 -0.000 -2.550) 2.583 8.598 ( -3.805 -0.000 6.385) 7.433 9.127 ( -2.714 -0.000 9.531) 9.909 9.148 ( -3.632 -0.000 -2.663) 4.503 9.532 ( -5.083 -0.000 -0.061) 5.084 9.608 ( 5.147 0.000 -4.441) 6.798 10.557 ( -3.092 -0.000 -0.850) 3.206 10.637 ( -3.644 -0.000 -0.763) 3.723 10.914 ( -2.012 -0.000 10.771) 10.958 11.487 ( -10.636 -0.000 -4.780) 11.661 11.683 ( -8.005 -0.000 4.829) 9.349 11.697 ( -5.413 -0.000 -4.154) 6.823 11.867 ( -1.151 -0.000 -3.966) 4.130 11.958 ( -5.548 -0.000 -1.745) 5.816 12.528 ( -8.002 -0.000 -0.785) 8.041 12.819 ( 5.495 0.000 0.457) 5.514 13.282 ( 24.499 0.000 4.107) 24.841 13.733 ( -2.164 -0.000 -11.448) 11.650 14.053 ( 4.292 0.000 14.211) 14.845 14.061 ( -1.318 -0.000 11.053) 11.132 14.456 ( 5.915 0.000 -0.097) 5.916 14.535 ( -5.053 -0.000 -10.890) 12.005 15.072 ( -8.806 -0.000 4.722) 9.992 15.249 ( -4.192 -0.000 1.677) 4.515 15.473 ( 4.634 0.000 -6.616) 8.078 15.757 ( 17.975 0.000 2.149) 18.103 16.415 ( -1.079 -0.000 7.727) 7.802 17.030 ( 0.069 0.000 2.673) 2.674 17.815 ( -5.867 -0.000 0.521) 5.891 17.901 ( 0.065 0.000 -9.315) 9.315 18.433 ( -6.433 -0.000 0.798) 6.482 18.884 ( -0.024 -0.000 -1.489) 1.489 20.923 ( -9.488 -0.000 1.019) 9.543 21.056 ( -1.368 -0.000 -4.982) 5.167 21.463 ( 1.921 0.000 1.898) 2.701 21.655 ( 10.866 0.000 -4.151) 11.632 25.104 ( 0.278 0.000 3.660) 3.670 25.195 ( 0.303 0.000 -3.135) 3.149 28.904 ( -1.186 -0.000 2.143) 2.449 29.106 ( 2.686 0.000 -1.847) 3.259 34.020 ( -10.804 -0.000 2.403) 11.068 34.776 ( 16.771 0.000 16.732) 23.690 37.559 ( 0.644 0.000 5.500) 5.537 37.738 ( -0.362 -0.000 -2.979) 3.001 40.417 ( -12.362 -0.000 0.611) 12.377 41.131 ( 11.256 0.000 -1.763) 11.393 41.489 ( -12.002 -0.000 -5.017) 13.008 42.719 ( 32.089 0.000 -17.243) 36.429 ======================= Grid point 256 (126/205) ======================= q-point: ( 0.22 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.090 ( 16.093 4.357 30.773) 34.999 3.562 ( -10.274 -2.015 2.941) 10.874 3.651 ( 11.075 -7.506 19.290) 23.475 4.018 ( 2.098 10.381 -21.716) 24.161 4.661 ( 18.730 7.597 10.294) 22.682 4.909 ( 4.882 -10.510 -11.418) 16.268 5.293 ( 21.738 -14.036 1.743) 25.934 5.550 ( -8.705 10.508 -7.047) 15.358 5.796 ( 2.040 3.656 0.153) 4.189 6.062 ( -8.193 -4.702 7.425) 12.016 6.095 ( 14.548 -3.759 7.340) 16.722 6.398 ( -11.752 -1.521 6.868) 13.696 6.811 ( 0.554 7.351 -8.695) 11.399 6.890 ( 6.075 -6.185 -5.882) 10.477 7.072 ( -5.313 -2.838 8.566) 10.472 7.311 ( -9.071 -2.584 -14.823) 17.570 8.014 ( -3.687 7.577 -10.609) 13.548 8.188 ( -5.758 0.358 1.570) 5.979 8.548 ( -2.710 -3.352 0.560) 4.347 8.667 ( 2.247 -7.729 5.867) 9.960 9.008 ( -3.070 10.212 2.718) 11.004 9.168 ( 1.725 -1.800 -1.219) 2.775 9.415 ( -4.565 6.041 -0.305) 7.578 9.645 ( 5.620 1.389 -4.621) 7.407 10.446 ( -6.784 4.382 -2.587) 8.480 10.608 ( -3.800 -1.664 0.775) 4.220 10.910 ( -3.421 1.315 7.384) 8.244 11.350 ( -7.623 2.749 -1.069) 8.174 11.456 ( -10.011 9.898 5.946) 15.282 11.648 ( -5.479 0.450 -4.608) 7.173 11.743 ( -6.584 2.337 -3.464) 7.798 12.033 ( 0.454 -7.884 -1.291) 8.001 12.490 ( -1.925 -3.272 -7.931) 8.793 12.930 ( 4.364 -4.353 4.158) 7.436 13.491 ( -0.852 11.856 0.562) 11.899 13.598 ( 16.755 0.769 1.817) 16.870 14.024 ( 1.203 6.191 9.671) 11.546 14.191 ( -1.227 -1.659 11.181) 11.369 14.482 ( -0.619 -6.052 -4.504) 7.569 14.563 ( 7.178 -1.405 -3.843) 8.263 15.016 ( -10.709 -3.767 7.011) 13.342 15.226 ( -5.898 -2.004 0.496) 6.249 15.555 ( 6.222 -6.176 -8.868) 12.470 15.984 ( 16.537 0.175 3.418) 16.887 16.443 ( 0.689 -1.133 2.540) 2.866 16.988 ( -0.258 5.028 3.416) 6.084 17.693 ( -3.237 5.864 -2.102) 7.020 17.866 ( -0.892 0.569 -7.504) 7.579 18.345 ( -6.529 1.362 -1.114) 6.762 18.927 ( -3.644 -7.641 -0.586) 8.486 20.767 ( -8.727 4.825 1.872) 10.146 21.075 ( -0.582 -5.609 -4.746) 7.370 21.488 ( 1.052 0.019 1.598) 1.913 21.751 ( 8.355 0.688 -4.757) 9.639 25.131 ( -0.460 -1.426 3.516) 3.822 25.199 ( 1.458 -0.648 -2.875) 3.288 28.907 ( -1.229 -0.965 2.238) 2.730 29.140 ( 1.813 -1.475 -1.689) 2.884 34.003 ( 2.801 -2.078 -0.143) 3.491 34.996 ( 11.083 2.750 18.229) 21.511 37.604 ( 2.311 -0.111 6.363) 6.771 37.737 ( 0.331 -1.462 -1.985) 2.488 40.288 ( -9.237 -0.042 0.922) 9.283 41.244 ( 4.280 0.973 0.700) 4.445 41.361 ( -4.190 -2.664 -7.323) 8.847 42.962 ( 22.908 1.141 -20.359) 30.669 ======================= Grid point 257 (127/205) ======================= q-point: ( 0.33 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.288 ( 1.341 -0.853 -9.686) 9.816 3.475 ( 13.306 -1.923 12.227) 18.173 3.873 ( 2.471 -0.273 -3.587) 4.364 4.125 ( 11.079 -9.298 19.810) 24.528 4.707 ( 1.695 6.658 7.660) 10.290 5.006 ( -1.479 -1.337 -4.981) 5.366 5.316 ( -1.113 7.223 -6.429) 9.734 5.607 ( 7.373 1.823 0.574) 7.617 5.652 ( -4.107 13.962 10.649) 18.034 5.994 ( -11.806 -5.455 -0.880) 13.035 6.329 ( -5.011 -4.923 8.394) 10.945 6.485 ( 21.556 -5.141 -1.989) 22.250 6.621 ( -4.253 -1.039 -6.951) 8.215 7.062 ( 2.234 -8.267 0.845) 8.605 7.100 ( -8.703 0.476 -12.691) 15.396 7.376 ( 5.687 -14.747 16.579) 22.906 7.789 ( -4.255 10.582 -5.117) 12.500 8.126 ( -3.301 -2.622 -11.114) 11.886 8.515 ( -3.154 5.738 3.516) 7.431 8.771 ( -2.401 12.734 0.650) 12.975 8.878 ( 6.301 -7.092 -2.665) 9.853 9.225 ( -0.519 -5.435 -1.242) 5.599 9.291 ( 1.882 5.342 -1.436) 5.843 9.662 ( 4.864 1.906 -4.043) 6.606 10.315 ( -2.664 1.968 -2.929) 4.421 10.571 ( -4.971 1.149 2.247) 5.575 10.842 ( -4.236 4.534 3.968) 7.365 11.181 ( -4.492 9.524 9.026) 13.869 11.298 ( -5.056 0.459 -0.594) 5.111 11.486 ( -8.102 3.068 -10.545) 13.647 11.716 ( 0.069 -2.393 1.633) 2.898 12.122 ( -2.925 -4.549 -0.839) 5.473 12.464 ( -1.751 0.630 -8.669) 8.867 13.062 ( -0.245 -4.608 8.066) 9.292 13.295 ( -2.131 4.761 2.158) 5.645 13.823 ( 19.026 2.686 2.015) 19.320 14.002 ( 2.701 2.816 6.804) 7.844 14.152 ( -5.673 3.201 6.453) 9.169 14.575 ( -5.250 -5.199 -3.484) 8.169 14.680 ( 5.469 -6.385 1.359) 8.517 14.954 ( -8.359 0.281 6.835) 10.801 15.187 ( -8.027 -2.336 1.187) 8.444 15.699 ( 4.375 -7.441 -8.034) 11.792 16.104 ( 9.260 6.892 7.531) 13.783 16.521 ( 6.583 -3.673 -3.636) 8.369 16.938 ( 3.336 3.635 0.653) 4.976 17.576 ( 1.919 5.525 -4.090) 7.137 17.812 ( -1.547 1.190 -4.714) 5.103 18.237 ( -5.110 1.846 -2.837) 6.129 18.999 ( -7.382 -8.833 0.600) 11.527 20.613 ( -6.232 4.344 2.799) 8.096 21.160 ( -0.605 -7.610 -3.929) 8.586 21.502 ( 0.781 0.121 1.186) 1.425 21.788 ( 5.397 2.423 -4.649) 7.524 25.159 ( -0.241 -1.215 1.746) 2.140 25.224 ( 1.497 -1.253 -1.312) 2.351 28.922 ( -1.263 -1.706 2.280) 3.116 29.172 ( 0.266 -1.367 -0.935) 1.678 34.109 ( 8.268 -2.284 -2.102) 8.831 35.079 ( 3.153 5.365 15.029) 16.267 37.652 ( 2.739 0.781 4.685) 5.482 37.783 ( 1.630 -2.942 1.199) 3.571 40.220 ( -4.767 -1.271 1.987) 5.318 41.161 ( -8.811 1.121 0.015) 8.882 41.451 ( 8.375 -2.931 -4.683) 10.034 43.069 ( 15.175 3.108 -20.997) 26.092 ======================= Grid point 258 (128/205) ======================= q-point: ( 0.44 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.290 ( 1.613 -7.119 -16.316) 17.874 3.809 ( 18.709 1.894 18.465) 26.354 3.970 ( 0.072 -14.531 -4.171) 15.118 4.278 ( -9.264 6.084 17.519) 20.730 4.539 ( -20.004 -3.830 1.326) 20.410 5.047 ( 18.080 14.572 11.035) 25.709 5.095 ( -13.332 2.947 -7.603) 15.627 5.429 ( 5.421 17.484 10.230) 20.970 5.514 ( -6.742 9.027 7.334) 13.443 5.967 ( -5.248 -9.916 -4.421) 12.058 6.361 ( -4.025 -1.219 -12.344) 13.041 6.647 ( 13.069 -8.716 -0.936) 15.736 6.827 ( -5.350 4.472 -5.128) 8.656 7.008 ( 5.636 -13.882 -0.216) 14.984 7.194 ( -5.546 -7.169 11.149) 14.368 7.531 ( 0.636 9.343 -5.898) 11.067 7.808 ( 6.380 -10.527 13.205) 18.053 8.024 ( -2.949 3.812 -8.863) 10.088 8.392 ( -0.248 1.794 -5.007) 5.325 8.573 ( 6.756 13.775 -7.180) 16.939 8.996 ( -2.916 -5.874 -4.655) 8.042 9.241 ( 2.858 3.820 -0.211) 4.775 9.365 ( 3.764 -7.674 0.904) 8.595 9.672 ( 3.830 0.788 -6.880) 7.914 10.304 ( 2.170 -1.152 -4.517) 5.142 10.496 ( -2.118 2.633 5.367) 6.342 10.707 ( -3.982 7.022 3.367) 8.746 11.069 ( 0.045 5.599 7.424) 9.299 11.260 ( -4.879 -0.671 0.436) 4.944 11.364 ( -0.055 -2.141 -10.288) 10.508 11.798 ( 3.710 -3.317 3.526) 6.099 12.085 ( -5.106 2.333 0.316) 5.623 12.386 ( -1.616 1.797 -5.696) 6.187 13.088 ( -6.102 -0.907 6.675) 9.089 13.344 ( 1.863 -6.129 5.168) 8.231 13.913 ( 1.606 6.980 -1.662) 7.353 13.997 ( -0.102 -0.894 1.896) 2.099 14.149 ( 7.631 0.620 10.463) 12.965 14.480 ( -17.823 -2.746 -3.418) 18.354 14.783 ( -1.090 -0.674 -2.102) 2.462 14.919 ( -2.453 1.721 13.320) 13.653 15.121 ( -6.784 -3.220 -0.227) 7.513 15.819 ( 4.373 -4.732 -6.871) 9.419 16.115 ( 9.944 8.084 8.002) 15.108 16.610 ( 2.436 -1.108 -3.464) 4.377 16.966 ( 6.247 0.646 -3.237) 7.065 17.543 ( 5.474 1.872 -5.457) 7.953 17.747 ( -0.605 2.684 -4.932) 5.648 18.190 ( 1.815 -1.363 -3.190) 3.915 19.025 ( -10.658 -7.015 2.374) 12.978 20.506 ( -4.216 3.279 4.522) 6.998 21.254 ( -1.885 -7.481 -3.578) 8.504 21.515 ( 0.970 0.018 0.773) 1.240 21.770 ( 3.291 3.988 -4.151) 6.630 25.178 ( 0.820 -0.248 0.320) 0.914 25.258 ( 1.017 -1.436 -0.283) 1.782 28.948 ( -0.969 -2.117 2.185) 3.193 29.179 ( -1.150 -0.398 0.161) 1.228 34.222 ( 8.424 0.120 -2.171) 8.700 35.042 ( -3.421 4.388 10.214) 11.631 37.681 ( 2.558 1.156 2.272) 3.611 37.862 ( 1.493 -3.110 2.781) 4.431 40.235 ( 0.207 -2.638 3.328) 4.252 41.044 ( -8.688 0.605 0.675) 8.735 41.557 ( 6.095 -0.949 -2.290) 6.580 43.065 ( 9.418 5.043 -21.075) 23.628 ======================= Grid point 259 (129/205) ======================= q-point: (-0.44 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.325 ( -4.257 2.971 -6.169) 8.062 3.777 ( -3.421 11.629 -0.718) 12.143 4.110 ( -9.004 -8.767 2.296) 12.776 4.203 ( -23.803 -1.951 24.880) 34.488 4.423 ( -10.328 -8.649 -4.776) 14.293 4.824 ( 3.411 13.302 16.524) 21.485 5.025 ( -4.696 1.078 -7.991) 9.331 5.308 ( 8.493 12.337 1.095) 15.018 5.488 ( 16.987 6.653 16.088) 24.324 6.106 ( -1.364 -7.232 -4.063) 8.407 6.298 ( -7.201 -8.983 -9.443) 14.890 6.535 ( -8.388 12.875 -2.278) 15.534 6.961 ( 19.851 -0.846 -2.406) 20.014 7.055 ( -14.985 4.524 6.059) 16.785 7.297 ( 3.634 -5.100 0.327) 6.271 7.512 ( 4.134 -2.834 1.989) 5.392 7.917 ( 4.392 -8.524 4.420) 10.559 8.153 ( 1.352 -9.606 -1.321) 9.790 8.374 ( 1.857 3.054 -12.052) 12.571 8.440 ( 8.483 5.353 -10.410) 14.456 8.983 ( -6.537 -2.475 -3.804) 7.958 9.201 ( 2.540 4.920 0.349) 5.549 9.493 ( -1.701 -1.314 -0.741) 2.274 9.667 ( 4.610 -0.657 -9.977) 11.010 10.328 ( 1.206 -1.176 -0.929) 1.924 10.491 ( 4.222 3.884 -0.688) 5.778 10.631 ( -1.362 -1.958 7.088) 7.478 11.027 ( -1.190 2.309 0.063) 2.598 11.268 ( 7.277 -1.424 3.228) 8.087 11.445 ( 3.070 -6.423 -2.028) 7.402 11.918 ( 5.036 -3.048 3.265) 6.731 11.995 ( -0.138 3.343 0.401) 3.370 12.336 ( -0.281 0.964 -2.870) 3.040 13.025 ( -9.947 0.068 5.162) 11.207 13.482 ( -2.829 -6.430 6.322) 9.450 13.710 ( -8.350 8.183 -2.825) 12.028 14.014 ( -4.357 0.591 0.662) 4.446 14.283 ( 2.329 -2.684 5.706) 6.722 14.293 ( -10.768 -1.120 -0.635) 10.844 14.677 ( -12.737 2.294 5.161) 13.933 14.908 ( 0.225 1.111 8.665) 8.739 15.176 ( 4.171 -2.719 0.671) 5.024 15.889 ( 5.543 0.526 -5.887) 8.103 16.149 ( 11.109 7.301 5.406) 14.350 16.612 ( -0.629 -0.771 -3.450) 3.590 16.948 ( -2.899 4.737 -1.856) 5.856 17.583 ( 7.055 -0.577 -8.369) 10.962 17.731 ( 4.362 -2.209 -7.624) 9.058 18.303 ( 10.340 -4.253 -1.892) 11.339 18.990 ( -12.547 -4.431 4.197) 13.953 20.445 ( -2.625 2.185 7.241) 8.006 21.314 ( -3.868 -5.944 -3.545) 7.928 21.532 ( 1.368 -0.194 -0.018) 1.382 21.711 ( 2.121 5.287 -3.710) 6.798 25.189 ( 1.703 0.901 -0.062) 1.928 25.288 ( 0.690 -1.022 -0.183) 1.246 28.982 ( -0.265 -1.976 2.000) 2.824 29.160 ( -2.037 0.691 1.112) 2.421 34.272 ( 6.642 4.152 -0.980) 7.894 34.970 ( -8.734 -0.751 6.386) 10.846 37.696 ( 2.183 1.287 0.881) 2.683 37.926 ( -0.441 -2.823 0.931) 3.005 40.331 ( 5.321 -3.385 4.307) 7.636 40.943 ( -8.075 0.246 1.373) 8.195 41.600 ( 2.575 1.562 0.518) 3.056 42.967 ( 5.136 7.511 -21.667) 23.500 ======================= Grid point 260 (130/205) ======================= q-point: (-0.33 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.914 ( -7.371 30.867 2.096) 31.804 3.681 ( -26.650 -9.003 8.867) 29.494 3.899 ( -19.864 2.661 12.229) 23.477 4.083 ( -16.150 3.461 3.349) 16.853 4.283 ( -8.532 -4.114 2.282) 9.744 4.987 ( 9.662 -1.368 -4.118) 10.591 5.067 ( 11.954 -2.194 6.050) 13.577 5.224 ( 7.534 10.957 -2.432) 13.518 5.593 ( 12.737 11.478 19.334) 25.842 6.023 ( -11.434 -0.446 0.186) 11.444 6.297 ( 3.967 9.274 -1.434) 10.188 6.440 ( -1.080 -11.731 -11.343) 16.353 6.895 ( -3.019 -0.650 0.152) 3.092 7.082 ( 7.966 3.597 2.813) 9.182 7.403 ( 3.115 0.572 0.724) 3.249 7.655 ( 0.623 -11.551 3.675) 12.138 8.154 ( -8.605 0.974 -9.752) 13.041 8.210 ( 3.530 -12.942 3.352) 13.827 8.266 ( 12.241 9.942 -11.252) 19.373 8.552 ( 1.760 -13.771 -8.701) 16.384 8.920 ( -5.090 -1.162 -3.388) 6.224 9.172 ( 2.520 2.284 1.979) 3.935 9.335 ( -7.488 8.007 -6.388) 12.688 9.714 ( 3.619 0.668 -6.969) 7.881 10.362 ( 2.676 -1.403 -1.130) 3.226 10.513 ( 4.697 -0.545 4.847) 6.771 10.721 ( 0.614 -2.933 1.009) 3.162 10.998 ( -0.648 -4.182 -1.164) 4.389 11.471 ( 14.501 -1.329 0.857) 14.587 11.610 ( 3.393 -10.279 7.531) 13.186 11.997 ( 8.588 3.170 -0.526) 9.170 12.035 ( 3.872 -4.808 0.798) 6.225 12.329 ( 1.705 0.286 -0.864) 1.933 12.888 ( -13.000 2.337 4.486) 13.949 13.356 ( -16.305 6.228 -1.077) 17.487 13.571 ( -5.988 2.208 0.132) 6.384 13.917 ( -9.132 -2.518 2.828) 9.886 14.228 ( -4.024 0.827 5.856) 7.154 14.357 ( -1.525 -3.098 -0.828) 3.551 14.547 ( -9.687 -2.360 4.350) 10.878 14.973 ( 1.594 -1.952 12.985) 13.227 15.261 ( 6.749 0.719 0.475) 6.804 15.880 ( 7.749 7.943 -5.057) 12.195 16.167 ( 11.477 9.611 0.607) 14.982 16.589 ( -2.811 1.436 -4.243) 5.288 16.783 ( -10.451 0.956 0.505) 10.507 17.676 ( 9.511 -3.429 -10.261) 14.405 17.808 ( 2.353 -4.629 -9.212) 10.574 18.520 ( 13.545 -4.377 -0.038) 14.235 18.912 ( -10.897 -1.545 4.829) 12.019 20.441 ( -0.398 0.003 10.487) 10.494 21.319 ( -5.697 -3.529 -3.431) 7.529 21.550 ( 0.985 -0.325 -1.130) 1.534 21.632 ( 2.703 6.019 -3.791) 7.609 25.187 ( 2.084 2.254 0.209) 3.077 25.302 ( 0.101 -0.323 -0.517) 0.618 29.015 ( 0.193 -0.755 2.002) 2.149 29.124 ( -1.819 1.185 1.201) 2.481 34.253 ( 6.074 6.702 0.574) 9.063 34.912 ( -15.622 -7.031 3.815) 17.551 37.698 ( 1.290 1.235 -0.041) 1.787 37.938 ( -3.390 -1.628 -2.268) 4.392 40.496 ( 9.661 -3.676 4.782) 11.389 40.857 ( -6.776 0.111 1.294) 6.899 41.580 ( 0.154 3.559 4.172) 5.486 42.779 ( 2.613 10.780 -22.504) 25.089 ======================= Grid point 261 (131/205) ======================= q-point: (-0.22 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.415 ( 4.385 29.169 15.330) 33.243 3.272 ( -44.470 6.704 35.713) 57.427 3.881 ( -4.478 -5.461 -0.385) 7.072 3.988 ( -2.875 -8.173 -2.893) 9.135 4.284 ( -6.633 -6.781 -9.083) 13.133 4.821 ( 2.036 37.969 26.231) 46.193 5.148 ( 9.728 -1.614 1.037) 9.915 5.210 ( 4.935 -2.063 -15.357) 16.262 5.830 ( 16.391 -6.078 10.463) 20.373 5.945 ( -7.182 -3.997 -0.973) 8.277 6.206 ( 6.871 11.319 -1.992) 13.390 6.508 ( -2.857 -4.485 -4.859) 7.204 6.969 ( 3.987 -0.185 1.880) 4.412 7.143 ( 3.738 -6.478 -5.399) 9.224 7.397 ( -5.006 -3.149 3.620) 6.934 7.803 ( 1.650 -0.545 -4.806) 5.110 7.881 ( -14.887 7.196 -15.743) 22.831 8.203 ( 5.417 1.683 -0.669) 5.711 8.491 ( 7.509 -8.405 -0.269) 11.274 8.769 ( -3.246 -16.199 -6.178) 17.639 8.894 ( -3.124 -1.487 0.043) 3.460 9.107 ( -4.733 4.678 -7.260) 9.848 9.223 ( 3.718 -2.464 3.784) 5.849 9.661 ( 1.329 5.085 -5.574) 7.661 10.439 ( 3.228 -3.896 -0.052) 5.060 10.641 ( 4.330 -3.698 6.834) 8.895 10.695 ( -2.225 1.724 0.357) 2.837 11.179 ( 7.805 -11.409 -3.194) 14.188 11.571 ( 2.411 0.008 2.649) 3.582 11.847 ( 4.175 -4.122 4.528) 7.411 12.068 ( 3.404 -0.003 0.590) 3.455 12.212 ( 12.852 -7.543 -1.852) 15.017 12.358 ( -5.053 -7.179 2.780) 9.209 12.688 ( -6.621 7.797 -2.597) 10.553 13.106 ( -6.542 4.565 2.486) 8.356 13.403 ( -11.707 3.244 -2.894) 12.488 13.903 ( -7.521 -2.850 9.065) 12.119 14.187 ( -0.828 3.806 9.756) 10.505 14.357 ( -5.396 -4.336 -4.321) 8.160 14.568 ( -3.696 -7.204 1.036) 8.163 15.084 ( 1.017 -3.250 12.589) 13.041 15.318 ( 6.891 2.982 3.079) 8.115 15.774 ( 7.591 14.082 -5.773) 17.008 16.076 ( 7.394 16.002 -5.622) 18.503 16.473 ( -3.388 3.226 3.241) 5.691 16.759 ( -7.532 -9.479 -4.701) 12.988 17.814 ( 8.435 -4.530 -9.527) 13.507 17.831 ( -3.645 -3.658 -7.448) 9.063 18.670 ( -3.204 -1.559 6.036) 7.009 18.877 ( 7.004 1.289 -1.401) 7.258 20.535 ( 3.363 -4.269 12.577) 13.701 21.265 ( -6.369 -0.658 -3.731) 7.411 21.539 ( -0.088 1.792 -0.943) 2.027 21.577 ( 4.409 3.873 -4.978) 7.696 25.167 ( 1.767 3.444 0.945) 3.985 25.294 ( -0.803 0.477 -1.214) 1.531 29.009 ( -1.632 1.719 2.794) 3.664 29.105 ( 1.047 0.713 -0.456) 1.347 34.238 ( 8.306 5.739 2.681) 10.445 34.823 ( -25.877 -10.051 1.304) 27.791 37.681 ( -0.758 1.545 -0.406) 1.769 37.879 ( -4.803 0.765 -4.414) 6.568 40.678 ( 1.178 -4.464 7.122) 8.487 40.811 ( 4.676 0.851 -2.939) 5.588 41.552 ( 1.596 3.215 8.611) 9.329 42.524 ( 3.740 14.005 -22.071) 26.405 ======================= Grid point 262 (132/205) ======================= q-point: (-0.11 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.319 ( 13.757 8.538 33.312) 37.038 2.891 ( -21.865 8.010 41.217) 47.340 3.932 ( -2.118 -3.505 6.698) 7.851 4.113 ( 1.534 1.558 -2.886) 3.621 4.184 ( -2.674 7.848 14.583) 16.775 4.505 ( -0.032 1.560 -3.516) 3.846 5.149 ( 14.229 5.585 -26.346) 30.459 5.390 ( 7.138 -5.083 12.339) 15.134 5.885 ( 1.681 3.213 -3.160) 4.810 5.950 ( -1.303 8.294 -10.395) 13.362 6.249 ( 5.179 -4.881 10.179) 12.420 6.509 ( -1.042 -1.585 1.234) 2.263 6.917 ( -2.782 4.716 2.064) 5.852 7.284 ( -3.524 -1.367 -18.816) 19.192 7.334 ( -8.966 6.131 -10.733) 15.270 7.547 ( -3.798 -7.766 -4.310) 9.660 7.848 ( 2.117 -2.165 1.403) 3.337 8.257 ( 0.188 -2.025 -0.885) 2.218 8.599 ( 2.854 4.036 -0.332) 4.954 8.829 ( -0.697 2.271 -3.499) 4.229 8.941 ( -2.674 -10.739 1.622) 11.186 9.089 ( -5.376 -8.751 -1.429) 10.369 9.365 ( 3.888 -7.476 1.288) 8.525 9.588 ( 1.272 3.150 -2.405) 4.163 10.549 ( 2.403 -4.757 2.018) 5.698 10.615 ( -3.435 1.024 -0.410) 3.608 10.796 ( 3.394 -2.718 8.740) 9.762 11.437 ( 6.182 -11.049 -8.154) 15.060 11.610 ( 2.785 -1.190 4.413) 5.352 11.862 ( -1.423 2.589 -0.499) 2.996 11.998 ( -10.682 3.253 3.416) 11.677 12.283 ( -21.713 -5.905 4.573) 22.961 12.538 ( 15.801 2.233 -6.408) 17.197 12.655 ( 9.351 -10.697 -6.881) 15.786 13.136 ( 6.375 1.731 2.827) 7.185 13.211 ( -3.500 -0.955 -1.069) 3.783 13.888 ( -8.333 -2.999 10.929) 14.067 14.166 ( 0.347 4.672 11.658) 12.564 14.366 ( -2.644 -5.280 -3.673) 6.955 14.632 ( -3.352 -5.163 -2.276) 6.563 15.205 ( 4.100 -2.480 7.854) 9.201 15.341 ( 3.214 4.869 6.639) 8.838 15.599 ( 4.029 11.169 -6.516) 13.544 15.814 ( 3.057 19.414 -8.872) 21.562 16.451 ( -0.750 1.563 6.993) 7.204 16.823 ( -3.067 -9.324 -4.989) 11.011 17.799 ( -6.042 -3.792 -3.450) 7.923 17.927 ( 3.634 -3.867 -6.752) 8.588 18.598 ( -10.000 0.699 6.434) 11.911 18.948 ( 11.132 5.096 -4.094) 12.909 20.747 ( 5.640 -8.755 10.365) 14.693 21.174 ( -4.838 1.303 -4.093) 6.470 21.515 ( -0.302 0.847 -1.345) 1.617 21.541 ( 5.195 5.059 -4.554) 8.563 25.131 ( 1.097 3.614 1.921) 4.237 25.260 ( -1.450 1.102 -2.061) 2.750 28.962 ( -2.255 2.135 2.691) 4.109 29.105 ( 2.545 1.774 -1.643) 3.511 34.309 ( 11.690 2.299 6.282) 13.469 34.600 ( -33.379 -5.852 -0.206) 33.889 37.619 ( -3.271 2.931 0.912) 4.486 37.801 ( -1.714 1.300 -3.918) 4.470 40.662 ( -11.796 -2.651 4.407) 12.869 40.929 ( 12.726 1.005 -3.695) 13.289 41.616 ( 3.305 -2.202 8.643) 9.512 42.305 ( 15.151 14.379 -18.570) 27.949 ======================= Grid point 265 (133/205) ======================= q-point: ( 0.22 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.300 ( -17.515 -0.000 -11.085) 20.728 3.428 ( 14.317 0.000 23.497) 27.515 3.894 ( 16.486 0.000 31.721) 35.749 4.057 ( 2.868 0.000 -23.336) 23.511 4.708 ( -0.178 -0.000 -24.360) 24.361 4.973 ( 12.714 0.000 4.255) 13.407 5.333 ( -7.769 -0.000 -15.673) 17.492 5.639 ( 15.200 0.000 19.818) 24.976 5.845 ( 3.950 0.000 2.626) 4.743 6.055 ( -3.075 -0.000 15.534) 15.835 6.275 ( 12.935 0.000 14.866) 19.705 6.332 ( -1.884 -0.000 8.306) 8.517 6.841 ( 0.077 0.000 -12.582) 12.582 6.844 ( -2.422 -0.000 -13.887) 14.097 7.061 ( -2.480 -0.000 17.593) 17.767 7.086 ( -8.116 -0.000 -10.956) 13.635 7.997 ( 4.419 0.000 -19.088) 19.593 8.088 ( -14.348 -0.000 0.455) 14.355 8.552 ( 4.479 0.000 2.506) 5.133 8.588 ( -5.390 -0.000 10.563) 11.859 9.076 ( -2.422 -0.000 -2.783) 3.690 9.170 ( 3.228 0.000 2.692) 4.204 9.419 ( -3.642 -0.000 0.810) 3.731 9.725 ( 9.670 0.000 -9.340) 13.444 10.386 ( -7.782 -0.000 -4.339) 8.910 10.528 ( -5.452 -0.000 2.992) 6.219 10.918 ( -2.316 -0.000 6.907) 7.285 11.292 ( -4.083 -0.000 -0.104) 4.085 11.546 ( -3.727 -0.000 -5.451) 6.603 11.567 ( -3.513 -0.000 11.314) 11.847 11.583 ( -16.150 -0.000 -6.378) 17.364 11.916 ( -2.402 -0.000 -5.552) 6.050 12.448 ( 3.981 0.000 -10.694) 11.411 12.991 ( 5.901 0.000 7.612) 9.631 13.460 ( -13.266 -0.000 2.070) 13.426 13.870 ( 19.860 0.000 2.244) 19.986 14.140 ( 0.216 0.000 10.328) 10.330 14.161 ( -6.174 -0.000 8.818) 10.765 14.329 ( -5.000 -0.000 -8.241) 9.639 14.636 ( 3.175 0.000 -0.902) 3.300 14.973 ( 0.202 0.000 9.829) 9.831 15.157 ( -4.432 -0.000 1.779) 4.776 15.536 ( 6.971 0.000 -10.454) 12.565 16.204 ( 12.099 0.000 10.581) 16.073 16.455 ( 5.116 0.000 -3.981) 6.482 17.043 ( 1.494 0.000 2.389) 2.818 17.672 ( -5.349 -0.000 0.689) 5.394 17.860 ( 2.868 0.000 -11.393) 11.748 18.279 ( -5.489 -0.000 -3.067) 6.288 18.795 ( -7.329 -0.000 1.233) 7.432 20.719 ( -8.083 -0.000 2.435) 8.442 20.986 ( -0.379 -0.000 -7.505) 7.515 21.504 ( 0.217 0.000 2.373) 2.383 21.826 ( 6.019 0.000 -4.611) 7.583 25.126 ( -1.274 -0.000 4.768) 4.935 25.211 ( 3.467 0.000 -3.822) 5.161 28.893 ( -1.370 -0.000 2.463) 2.819 29.139 ( 1.197 0.000 -1.973) 2.308 34.069 ( 10.946 0.000 -2.748) 11.286 35.188 ( 3.565 0.000 19.317) 19.643 37.677 ( 4.255 0.000 9.011) 9.965 37.722 ( 0.933 0.000 -2.014) 2.219 40.205 ( -5.265 -0.000 1.646) 5.516 41.209 ( -7.847 -0.000 -2.997) 8.400 41.371 ( 9.720 0.000 -2.609) 10.064 43.120 ( 16.462 0.000 -23.112) 28.376 ======================= Grid point 266 (134/205) ======================= q-point: ( 0.33 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.121 ( -8.015 -3.950 -15.817) 18.166 3.613 ( 4.363 -0.517 11.907) 12.692 4.024 ( 13.935 3.576 -7.458) 16.205 4.202 ( 6.159 -5.333 22.120) 23.572 4.554 ( -14.423 5.356 -3.510) 15.781 5.083 ( -5.126 -12.988 -11.856) 18.317 5.198 ( -0.454 3.808 -11.611) 12.228 5.811 ( -3.467 6.151 14.412) 16.049 5.917 ( 9.116 1.959 12.252) 15.396 6.023 ( 15.243 12.928 8.992) 21.917 6.255 ( -8.272 1.793 15.047) 17.264 6.572 ( -6.528 8.326 -19.468) 22.157 6.646 ( 19.557 -8.248 9.445) 23.231 6.907 ( -3.311 -6.457 -18.948) 20.290 6.946 ( -8.985 -2.703 2.660) 9.753 7.273 ( 4.449 -13.023 19.861) 24.163 7.844 ( -11.597 6.680 -1.051) 13.424 8.057 ( 11.800 -1.087 -17.098) 20.803 8.549 ( -2.827 0.896 5.625) 6.358 8.704 ( 0.258 -7.907 4.740) 9.223 8.975 ( -3.476 5.871 -3.642) 7.734 9.216 ( 4.287 0.689 0.493) 4.370 9.361 ( 1.045 3.023 -2.490) 4.053 9.772 ( 8.728 4.104 -8.975) 13.175 10.289 ( -3.282 -0.026 -3.017) 4.459 10.503 ( -5.426 -1.929 5.025) 7.643 10.893 ( -1.742 3.481 4.622) 6.043 11.227 ( -5.685 1.203 -2.436) 6.301 11.311 ( -8.710 6.856 -2.186) 11.298 11.433 ( -1.221 5.341 -3.557) 6.532 11.659 ( 0.303 -6.013 4.195) 7.338 11.930 ( -6.611 -8.418 -2.659) 11.029 12.450 ( 3.189 0.794 -10.948) 11.431 13.082 ( 0.983 0.167 10.650) 10.696 13.307 ( -6.924 2.349 4.466) 8.568 14.005 ( -5.586 1.519 -1.675) 6.027 14.056 ( 4.177 1.605 0.753) 4.537 14.175 ( -2.893 1.061 10.852) 11.281 14.346 ( -0.776 -4.909 -6.728) 8.364 14.675 ( 0.719 -3.719 5.439) 6.628 14.985 ( -1.556 3.338 9.796) 10.465 15.113 ( -5.156 0.492 2.961) 5.966 15.649 ( 11.757 -4.595 -10.763) 16.589 16.281 ( -2.105 1.859 12.264) 12.582 16.581 ( 15.930 -0.771 -6.409) 17.188 17.053 ( 5.563 4.083 -0.147) 6.902 17.628 ( -1.036 0.534 -0.514) 1.274 17.816 ( 1.415 3.015 -7.812) 8.492 18.199 ( -2.639 1.145 -5.579) 6.277 18.761 ( -10.739 -7.321 2.348) 13.207 20.612 ( -5.939 3.140 2.022) 7.015 21.008 ( -0.867 -6.322 -7.265) 9.669 21.513 ( -0.207 -0.027 2.403) 2.412 21.853 ( 3.200 1.264 -4.176) 5.411 25.137 ( -1.822 -1.199 4.781) 5.255 25.245 ( 4.597 -0.009 -3.890) 6.022 28.894 ( -1.441 -0.995 2.629) 3.159 29.148 ( -0.050 -0.950 -1.758) 1.999 34.212 ( 14.024 -0.335 -3.988) 14.583 35.217 ( -4.326 4.149 15.520) 16.637 37.720 ( 2.816 1.210 1.287) 3.324 37.784 ( 2.997 -1.829 7.060) 7.884 40.186 ( -0.120 -0.578 3.379) 3.430 41.108 ( -5.167 2.435 1.014) 5.801 41.484 ( 7.143 -2.629 -3.411) 8.341 43.171 ( 10.820 1.706 -24.342) 26.693 ======================= Grid point 267 (135/205) ======================= q-point: ( 0.44 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.105 ( -1.887 -7.423 -14.166) 16.104 3.679 ( -8.341 -8.274 3.511) 12.262 4.197 ( -7.692 -4.355 -1.413) 8.951 4.230 ( 13.354 9.165 5.032) 16.960 4.360 ( -8.909 3.222 22.393) 24.314 4.951 ( -14.801 5.769 -11.129) 19.396 5.205 ( -6.247 -9.100 -6.314) 12.717 5.662 ( -1.326 9.335 9.213) 13.183 5.849 ( 5.577 19.314 15.051) 25.113 6.114 ( 18.134 11.567 7.391) 22.744 6.240 ( 0.563 -0.231 -14.628) 14.641 6.478 ( -2.157 -14.756 5.058) 15.748 6.722 ( -13.390 1.199 -4.919) 14.315 7.023 ( 2.513 -10.858 8.425) 13.971 7.063 ( 13.516 -4.405 -4.586) 14.937 7.534 ( -3.958 -5.111 -0.713) 6.503 7.766 ( 5.059 -6.692 13.040) 15.506 8.089 ( 6.574 4.976 -12.545) 15.012 8.425 ( -6.560 9.443 0.263) 11.501 8.793 ( 3.342 1.544 0.941) 3.800 8.885 ( 0.737 0.132 -3.996) 4.066 9.263 ( 2.700 -1.084 -1.600) 3.320 9.369 ( 5.494 -1.453 -4.108) 7.013 9.732 ( 3.575 5.193 -6.950) 9.384 10.288 ( 0.393 -1.937 -3.369) 3.906 10.496 ( -2.812 -1.140 6.594) 7.259 10.798 ( -2.092 6.867 2.356) 7.556 11.098 ( -6.356 1.675 -5.938) 8.858 11.195 ( -4.894 -1.317 0.876) 5.144 11.372 ( 5.629 3.075 -2.731) 6.972 11.816 ( 7.899 -5.221 3.718) 10.172 11.956 ( -8.271 -6.106 1.002) 10.330 12.406 ( 1.958 2.979 -8.578) 9.289 13.052 ( -7.090 1.867 8.469) 11.201 13.315 ( -0.111 -2.662 8.156) 8.581 13.847 ( -11.861 1.526 -3.319) 12.411 14.027 ( -9.356 -0.801 -3.184) 9.916 14.189 ( -2.580 -0.871 7.840) 8.299 14.349 ( 4.825 3.141 -2.811) 6.407 14.749 ( -4.609 -0.724 1.924) 5.046 14.962 ( -3.407 0.664 14.903) 15.302 15.068 ( 1.018 -0.610 1.658) 2.039 15.828 ( 13.666 -3.113 -9.772) 17.086 16.269 ( -2.621 0.085 8.334) 8.737 16.704 ( 11.401 4.888 -2.840) 12.725 17.062 ( 6.651 3.418 -2.851) 8.003 17.613 ( 3.233 2.002 -3.949) 5.482 17.758 ( -0.831 2.127 -3.606) 4.268 18.183 ( 4.883 -2.036 -6.142) 8.107 18.763 ( -13.237 -8.917 3.344) 16.307 20.516 ( -4.327 2.393 3.008) 5.787 21.081 ( -2.068 -7.878 -6.829) 10.629 21.522 ( -0.207 -0.273 2.114) 2.142 21.832 ( 1.052 2.418 -3.559) 4.430 25.157 ( -1.911 -1.844 4.164) 4.939 25.285 ( 5.019 0.310 -3.651) 6.214 28.913 ( -1.095 -1.949 2.688) 3.496 29.150 ( -1.310 -0.966 -1.013) 1.917 34.356 ( 13.518 1.440 -3.417) 14.018 35.100 ( -9.258 6.058 10.239) 15.074 37.741 ( 3.140 1.289 0.616) 3.449 37.861 ( 1.016 -1.279 6.046) 6.263 40.250 ( 5.018 -1.552 5.559) 7.648 41.016 ( -3.682 3.842 3.571) 6.408 41.580 ( 3.545 -2.514 -1.969) 4.771 43.135 ( 6.654 3.421 -24.907) 26.007 ======================= Grid point 268 (136/205) ======================= q-point: (-0.44 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.109 ( -14.834 -7.335 -3.016) 16.821 3.717 ( -11.165 -8.504 5.434) 15.050 4.003 ( -8.546 7.238 -1.090) 11.252 4.203 ( -12.426 5.917 13.714) 19.430 4.307 ( 1.014 12.498 1.541) 12.633 4.760 ( -0.840 -5.165 -1.172) 5.363 5.139 ( -5.869 1.094 -9.415) 11.149 5.634 ( -0.237 5.186 0.502) 5.215 5.737 ( 11.759 4.051 20.048) 23.592 6.082 ( -1.234 6.306 -7.391) 9.794 6.272 ( 17.142 5.613 2.999) 18.285 6.582 ( -2.755 3.775 3.268) 5.703 6.785 ( -6.613 -17.780 4.624) 19.525 7.083 ( -4.286 -7.194 3.839) 9.212 7.287 ( 10.116 1.434 -1.749) 10.365 7.530 ( 1.360 0.713 -4.131) 4.407 7.965 ( 0.100 1.465 -5.639) 5.827 8.040 ( 7.791 -3.300 10.020) 13.115 8.265 ( -4.045 -1.573 -9.463) 10.411 8.729 ( 8.215 12.882 -8.687) 17.575 8.880 ( -3.242 -1.141 1.127) 3.617 9.266 ( 0.107 1.618 -2.376) 2.877 9.489 ( 5.493 -2.859 -1.030) 6.278 9.650 ( -0.013 2.153 -11.116) 11.323 10.309 ( -0.066 -1.907 -0.740) 2.047 10.542 ( 0.490 -3.769 4.088) 5.582 10.680 ( 0.662 6.719 1.556) 6.928 10.994 ( -4.637 1.081 -4.110) 6.291 11.244 ( -2.525 -8.999 5.259) 10.724 11.437 ( 8.074 -1.615 -4.066) 9.183 11.930 ( -4.029 -1.851 6.251) 7.663 12.043 ( 13.490 -3.122 -0.402) 13.852 12.359 ( 2.139 2.233 -5.799) 6.572 12.962 ( -7.694 2.355 7.223) 10.813 13.347 ( -11.912 -3.586 6.528) 14.049 13.685 ( -6.515 2.933 -1.592) 7.320 13.861 ( -14.802 -0.857 -3.899) 15.331 14.214 ( 0.598 -0.752 6.609) 6.678 14.334 ( 0.730 2.412 -3.630) 4.419 14.615 ( -10.382 4.152 3.682) 11.772 14.971 ( -1.298 0.997 14.381) 14.474 15.197 ( 8.239 -4.239 0.735) 9.294 15.980 ( 13.521 -0.168 -8.047) 15.735 16.295 ( -0.515 -2.299 5.468) 5.954 16.682 ( 6.517 8.787 -2.761) 11.283 17.015 ( -1.252 7.415 -1.983) 7.777 17.622 ( 5.013 0.151 -6.298) 8.051 17.716 ( 0.850 -0.157 -6.265) 6.325 18.335 ( 10.511 -6.362 -2.142) 12.472 18.756 ( -12.309 -7.837 3.695) 15.053 20.460 ( -3.500 0.949 6.000) 7.011 21.142 ( -3.194 -7.043 -6.965) 10.407 21.534 ( -0.031 -0.553 1.474) 1.575 21.778 ( -0.176 3.285 -3.055) 4.489 25.181 ( -1.651 -1.918 3.325) 4.178 25.320 ( 4.654 0.960 -3.271) 5.768 28.952 ( -0.258 -2.579 2.704) 3.745 29.138 ( -2.088 -0.368 -0.083) 2.122 34.445 ( 11.186 4.791 -1.437) 12.254 34.916 ( -11.560 4.868 5.950) 13.883 37.750 ( 2.174 1.994 0.919) 3.090 37.895 ( -0.774 -0.947 1.914) 2.271 40.392 ( 8.812 -2.431 7.527) 11.841 40.929 ( -2.353 4.197 3.594) 6.006 41.625 ( -0.373 -0.871 1.354) 1.652 43.026 ( 3.774 5.388 -25.706) 26.534 ======================= Grid point 269 (137/205) ======================= q-point: (-0.33 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.988 ( -19.404 -4.560 7.302) 21.228 3.528 ( -17.678 18.685 11.719) 28.266 3.806 ( -3.652 3.951 2.515) 5.939 4.022 ( -10.790 3.140 0.149) 11.238 4.134 ( -6.224 2.349 1.801) 6.892 4.892 ( 5.637 -6.275 -1.619) 8.589 5.160 ( 9.221 -6.038 -15.874) 19.325 5.605 ( 2.184 -2.406 3.739) 4.954 5.882 ( 2.963 16.963 5.695) 18.137 5.995 ( 6.789 -3.972 18.248) 19.871 6.372 ( 9.477 4.459 -0.250) 10.476 6.468 ( 1.577 11.045 -0.061) 11.157 6.834 ( -5.123 -4.633 9.336) 11.614 7.254 ( 4.437 7.119 1.039) 8.452 7.365 ( -6.311 -22.363 4.240) 23.620 7.479 ( 2.765 5.056 -2.720) 6.372 7.923 ( -7.441 -2.490 -9.542) 12.354 8.180 ( 2.916 -1.441 -2.389) 4.036 8.319 ( 2.052 -11.540 -7.834) 14.098 8.557 ( 6.806 13.445 -11.394) 18.892 8.860 ( -1.413 -0.136 0.592) 1.538 9.228 ( -0.190 2.169 1.974) 2.939 9.400 ( -1.898 9.415 -7.732) 12.330 9.686 ( 2.610 -4.325 -7.631) 9.152 10.345 ( 0.428 -2.325 1.421) 2.758 10.635 ( -2.578 -6.231 -1.261) 6.860 10.642 ( 6.358 3.909 3.170) 8.109 10.948 ( 0.461 -1.827 -0.134) 1.889 11.420 ( -4.416 -13.130 5.449) 14.886 11.549 ( 4.643 -4.460 -1.334) 6.575 11.964 ( -1.784 -4.186 5.116) 6.847 12.238 ( 17.825 3.109 0.743) 18.109 12.323 ( -0.846 1.608 -5.243) 5.549 12.859 ( -5.068 3.819 5.202) 8.205 13.195 ( -16.293 -0.341 1.688) 16.383 13.521 ( -10.498 4.297 -3.216) 11.791 13.799 ( -2.711 -2.793 4.734) 6.129 14.266 ( -5.658 -1.654 -1.759) 6.151 14.275 ( 3.857 1.235 4.245) 5.867 14.468 ( -6.749 1.846 2.547) 7.446 15.019 ( -0.405 -0.662 14.731) 14.751 15.344 ( 8.044 -1.492 -0.119) 8.182 16.085 ( 13.301 3.763 -6.040) 15.085 16.372 ( 2.044 -4.016 3.395) 5.642 16.576 ( 2.983 9.129 -6.764) 11.746 16.782 ( -8.987 12.369 0.491) 15.297 17.674 ( 3.103 -2.967 -6.244) 7.578 17.725 ( 1.651 -2.704 -9.945) 10.438 18.533 ( -0.991 -6.668 5.986) 9.015 18.797 ( 3.177 -6.178 -1.299) 7.068 20.456 ( -2.618 -1.203 10.082) 10.486 21.170 ( -3.506 -4.970 -7.068) 9.325 21.547 ( -0.068 -0.436 0.506) 0.671 21.708 ( -0.021 3.517 -3.090) 4.682 25.201 ( -1.411 -1.326 2.423) 3.102 25.334 ( 3.418 1.899 -2.706) 4.755 29.004 ( 0.351 -2.144 2.713) 3.475 29.115 ( -1.812 0.153 0.492) 1.884 34.457 ( 7.876 7.484 1.549) 10.974 34.735 ( -12.020 2.576 2.910) 12.633 37.733 ( -0.380 2.096 1.160) 2.426 37.889 ( -1.177 0.119 -2.047) 2.365 40.566 ( 6.129 -2.372 9.531) 11.577 40.872 ( 3.146 3.222 0.389) 4.520 41.618 ( -2.907 0.541 5.720) 6.439 42.857 ( 2.869 7.503 -26.674) 27.857 ======================= Grid point 270 (138/205) ======================= q-point: (-0.22 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.916 ( 3.135 6.724 12.868) 14.854 3.056 ( -20.873 15.833 26.114) 36.991 3.722 ( -2.789 -1.506 -6.637) 7.355 3.923 ( -5.133 0.059 -3.439) 6.179 4.052 ( -4.058 -2.759 0.022) 4.907 5.133 ( 9.180 -9.969 6.404) 14.989 5.253 ( 7.255 -1.321 -20.077) 21.388 5.553 ( -3.655 22.745 12.385) 26.155 5.764 ( 5.460 -0.677 0.600) 5.535 6.100 ( 8.528 7.284 18.166) 21.349 6.362 ( 0.981 0.035 -2.881) 3.043 6.463 ( 9.544 2.660 2.860) 10.313 6.954 ( 3.089 -6.540 4.847) 8.706 7.139 ( -7.407 6.461 -5.501) 11.263 7.334 ( -2.551 2.021 5.350) 6.262 7.700 ( -0.879 -11.104 3.781) 11.763 7.748 ( -14.845 1.625 -11.449) 18.817 8.208 ( -2.848 -6.213 -7.600) 10.221 8.424 ( 5.524 4.375 -12.137) 14.034 8.509 ( 1.659 -12.094 -6.168) 13.677 8.871 ( 2.375 -0.194 -0.456) 2.426 9.126 ( -4.239 7.765 -4.596) 9.969 9.308 ( 5.614 1.362 2.667) 6.363 9.695 ( 0.505 1.568 -7.017) 7.208 10.412 ( 1.553 -3.577 2.761) 4.778 10.622 ( -6.266 -1.292 -3.566) 7.324 10.718 ( 5.808 -1.181 5.796) 8.290 11.090 ( 6.003 -9.472 -3.042) 11.620 11.524 ( -6.965 -6.258 5.801) 11.015 11.695 ( -2.213 -10.096 1.923) 10.513 12.010 ( -10.459 -5.627 4.992) 12.883 12.214 ( -8.443 3.817 -1.323) 9.359 12.372 ( 15.747 3.026 1.741) 16.129 12.782 ( 5.643 4.056 -9.513) 11.781 13.118 ( 1.522 0.128 6.804) 6.973 13.336 ( -7.051 3.760 -2.538) 8.384 13.809 ( -7.204 -1.400 8.611) 11.313 14.231 ( -3.954 -2.603 -3.281) 5.760 14.308 ( 3.802 2.907 8.108) 9.415 14.466 ( 0.926 -4.256 1.416) 4.580 15.096 ( 0.794 -2.510 11.391) 11.691 15.425 ( 4.230 0.888 1.427) 4.552 16.080 ( 9.313 13.736 -4.661) 17.237 16.399 ( 2.220 13.914 -12.091) 18.567 16.483 ( -6.868 -6.358 1.804) 9.532 16.521 ( -0.060 3.603 2.386) 4.322 17.677 ( -6.768 -3.675 -5.797) 9.640 17.790 ( 5.197 -4.136 -8.852) 11.066 18.551 ( -11.996 -4.070 8.768) 15.406 18.992 ( 14.259 -3.044 -4.633) 15.299 20.526 ( -1.275 -4.949 13.178) 14.134 21.165 ( -2.055 -2.146 -6.693) 7.322 21.543 ( -0.698 0.539 -0.209) 0.906 21.653 ( 1.763 2.590 -3.998) 5.079 25.205 ( -1.359 -0.085 1.554) 2.066 25.317 ( 1.621 2.776 -1.958) 3.764 29.021 ( -1.700 0.840 2.727) 3.321 29.117 ( 1.294 -0.875 0.198) 1.574 34.418 ( -0.928 4.705 4.768) 6.763 34.579 ( -5.197 4.174 1.428) 6.817 37.685 ( -3.113 1.768 1.161) 3.764 37.852 ( -0.293 1.730 -3.693) 4.088 40.614 ( -6.785 0.015 8.274) 10.700 40.951 ( 13.988 0.596 -2.136) 14.162 41.603 ( -3.024 0.190 8.688) 9.201 42.670 ( 6.571 8.642 -26.188) 28.349 ======================= Grid point 271 (139/205) ======================= q-point: (-0.11 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.729 ( 0.040 16.477 29.715) 33.977 3.071 ( 14.487 2.157 25.853) 29.714 3.760 ( -0.425 -9.028 -12.757) 15.634 3.863 ( -5.799 -5.602 -9.839) 12.721 4.140 ( 1.425 -6.386 7.321) 9.819 5.097 ( 1.950 23.718 13.518) 27.370 5.316 ( 12.580 5.677 -8.624) 16.275 5.463 ( 11.766 -4.214 9.492) 15.694 5.749 ( -5.700 -2.985 -11.931) 13.555 6.138 ( 0.809 8.482 7.859) 11.592 6.314 ( 0.849 4.806 -2.866) 5.660 6.567 ( 8.122 0.971 11.435) 14.059 6.843 ( -15.584 1.143 -6.311) 16.852 7.183 ( 6.041 -3.376 1.508) 7.082 7.311 ( -1.307 0.823 -10.744) 10.855 7.430 ( -10.600 8.966 -10.542) 17.432 7.779 ( -4.144 -6.579 5.369) 9.449 8.266 ( 1.509 0.334 -0.926) 1.801 8.475 ( -6.999 -17.753 -10.151) 21.615 8.695 ( 2.836 -7.128 -4.255) 8.773 8.870 ( 1.009 1.988 0.101) 2.232 9.011 ( 1.968 -0.016 -4.190) 4.629 9.383 ( 4.304 0.914 4.427) 6.241 9.625 ( -0.268 2.937 -4.695) 5.545 10.492 ( -2.553 -3.157 3.309) 5.238 10.559 ( -3.397 -2.564 -2.735) 5.059 10.826 ( 2.795 -2.298 6.010) 7.015 11.273 ( -2.056 -10.620 -5.721) 12.237 11.542 ( -8.117 -5.394 5.519) 11.200 11.763 ( -6.440 -4.205 -1.511) 7.838 11.922 ( -15.425 1.233 5.763) 16.513 12.051 ( -6.159 -0.551 2.654) 6.729 12.606 ( 11.166 -7.995 -2.198) 13.908 12.782 ( 15.505 4.993 -9.462) 18.838 13.203 ( -2.338 6.119 -0.368) 6.560 13.246 ( 11.473 -1.921 4.260) 12.389 13.776 ( -8.099 -3.241 10.288) 13.488 14.202 ( -5.175 -1.212 3.651) 6.448 14.395 ( 9.836 1.303 5.974) 11.581 14.549 ( 1.370 -2.861 -0.802) 3.272 15.218 ( 3.798 -4.799 5.679) 8.349 15.423 ( -2.241 2.919 5.034) 6.236 15.831 ( -1.380 17.593 -3.239) 17.942 16.122 ( 2.883 16.465 -15.566) 22.841 16.446 ( -5.158 -3.104 2.084) 6.370 16.667 ( 6.461 -6.184 2.485) 9.283 17.627 ( -7.845 -4.412 -3.775) 9.760 17.872 ( 1.910 -4.105 -6.683) 8.072 18.488 ( -11.102 -1.958 5.978) 12.760 19.119 ( 9.004 2.952 -4.333) 10.419 20.668 ( -2.799 -8.303 11.554) 14.501 21.150 ( 2.287 0.666 -5.128) 5.654 21.515 ( -1.138 1.207 -0.979) 1.926 21.636 ( 4.157 1.730 -4.653) 6.474 25.185 ( -1.061 1.319 1.031) 1.982 25.273 ( 0.017 2.990 -1.281) 3.253 28.981 ( -2.090 2.087 2.448) 3.836 29.148 ( 2.317 0.288 -0.561) 2.401 34.273 ( -14.756 2.767 3.394) 15.392 34.569 ( 11.363 3.708 6.523) 13.617 37.622 ( -3.292 1.800 1.977) 4.241 37.808 ( 0.550 2.226 -3.232) 3.963 40.527 ( -10.528 0.266 4.269) 11.364 41.085 ( 11.192 1.569 -0.519) 11.314 41.593 ( -5.185 -0.713 3.014) 6.039 42.589 ( 17.830 5.980 -21.448) 28.525 ======================= Grid point 275 (140/205) ======================= q-point: ( 0.33 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.972 ( -1.045 -0.000 -10.051) 10.105 3.640 ( -7.696 -0.000 6.803) 10.272 4.155 ( 9.477 0.000 -0.779) 9.509 4.162 ( -7.622 -0.000 -4.942) 9.084 4.688 ( 4.503 0.000 16.223) 16.836 4.709 ( -10.455 -0.000 -13.456) 17.040 5.196 ( -3.367 -0.000 -8.705) 9.333 5.801 ( -15.520 -0.000 10.190) 18.567 6.033 ( 4.494 0.000 22.243) 22.693 6.297 ( -2.597 -0.000 -0.138) 2.600 6.419 ( 15.442 0.000 9.761) 18.268 6.511 ( -2.829 -0.000 -12.192) 12.516 6.730 ( 1.405 0.000 -14.943) 15.009 6.791 ( -10.764 -0.000 1.552) 10.875 6.859 ( 20.068 0.000 7.027) 21.262 7.283 ( 3.424 0.000 15.117) 15.500 7.771 ( -5.370 -0.000 1.489) 5.573 8.169 ( 11.346 0.000 -12.332) 16.757 8.538 ( 1.397 0.000 4.765) 4.965 8.700 ( 2.725 0.000 7.948) 8.402 8.940 ( -5.098 -0.000 -4.496) 6.797 9.268 ( 3.377 0.000 -3.063) 4.559 9.393 ( 1.657 0.000 -1.649) 2.338 9.879 ( 7.934 0.000 -11.630) 14.078 10.225 ( -4.183 -0.000 0.080) 4.184 10.458 ( -3.664 -0.000 6.818) 7.740 10.928 ( -0.319 -0.000 2.550) 2.570 11.109 ( -9.207 -0.000 -8.520) 12.544 11.246 ( -7.711 -0.000 -4.328) 8.842 11.525 ( -8.847 -0.000 -2.098) 9.093 11.598 ( 13.689 0.000 -1.656) 13.789 11.804 ( -2.476 -0.000 6.831) 7.266 12.456 ( 3.458 0.000 -11.022) 11.552 13.100 ( -7.459 -0.000 10.624) 12.981 13.290 ( -1.775 -0.000 8.533) 8.716 13.899 ( -14.714 -0.000 -2.540) 14.932 13.953 ( -8.127 -0.000 -4.505) 9.292 14.201 ( -1.864 -0.000 9.218) 9.405 14.451 ( 16.233 0.000 -7.089) 17.714 14.634 ( -3.999 -0.000 6.502) 7.634 15.015 ( -7.093 -0.000 13.801) 15.517 15.077 ( -2.616 -0.000 1.749) 3.147 15.761 ( 18.988 0.000 -10.846) 21.867 16.253 ( -8.051 -0.000 7.853) 11.247 16.773 ( 16.841 0.000 -1.498) 16.907 17.173 ( 7.474 0.000 -0.077) 7.475 17.608 ( -0.296 -0.000 -0.069) 0.304 17.834 ( 0.398 0.000 -6.530) 6.542 18.172 ( 2.218 0.000 -8.897) 9.169 18.566 ( -13.447 -0.000 3.824) 13.980 20.575 ( -6.159 -0.000 2.123) 6.515 20.918 ( 0.469 0.000 -9.623) 9.634 21.518 ( -0.810 -0.000 3.237) 3.337 21.870 ( 0.686 0.000 -3.518) 3.584 25.122 ( -2.453 -0.000 5.631) 6.142 25.290 ( 5.659 0.000 -4.582) 7.281 28.879 ( -1.461 -0.000 2.875) 3.225 29.129 ( -0.595 -0.000 -2.164) 2.245 34.377 ( 16.436 0.000 -4.592) 17.066 35.215 ( -10.913 -0.000 12.350) 16.480 37.762 ( 3.672 0.000 -1.081) 3.828 37.842 ( 1.594 0.000 10.289) 10.412 40.228 ( 5.074 0.000 5.398) 7.409 41.108 ( -2.034 -0.000 7.091) 7.377 41.510 ( 4.141 0.000 -5.737) 7.075 43.190 ( 7.275 0.000 -26.499) 27.479 ======================= Grid point 276 (141/205) ======================= q-point: ( 0.44 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.981 ( 1.883 -0.877 -5.291) 5.684 3.533 ( -11.334 -0.606 7.629) 13.676 3.991 ( -10.792 -0.268 -7.706) 13.264 4.273 ( -3.870 -5.828 -3.821) 7.971 4.615 ( 10.217 2.858 10.137) 14.674 4.817 ( -8.129 -2.807 4.935) 9.916 5.032 ( -7.262 7.501 -5.114) 11.625 5.658 ( -16.594 -4.543 12.930) 21.522 6.037 ( -8.351 12.782 -20.092) 25.235 6.223 ( 5.746 -5.315 14.200) 16.214 6.452 ( 0.196 5.764 2.841) 6.429 6.492 ( 5.880 6.620 -0.346) 8.861 6.708 ( 9.137 1.399 6.671) 11.399 6.877 ( 2.443 -9.426 -6.194) 11.540 7.107 ( 9.737 -3.422 2.871) 10.712 7.436 ( 6.023 -5.867 4.336) 9.461 7.813 ( 5.716 -2.229 10.076) 11.797 8.159 ( 0.150 2.954 -7.723) 8.270 8.541 ( -0.458 9.989 1.106) 10.061 8.782 ( 2.756 -4.972 6.225) 8.430 8.916 ( 3.152 -1.001 -2.104) 3.920 9.277 ( 1.891 0.197 -4.754) 5.120 9.406 ( 4.435 0.828 -4.025) 6.046 9.833 ( 0.987 6.188 -8.345) 10.435 10.217 ( -3.320 -3.326 1.283) 4.871 10.456 ( -3.605 -1.847 4.574) 6.110 10.883 ( -0.558 5.055 -0.320) 5.096 11.010 ( -3.837 -0.923 -6.499) 7.603 11.122 ( -5.649 1.626 -3.423) 6.802 11.397 ( -6.938 -2.043 -6.313) 9.601 11.824 ( 4.542 -3.241 4.516) 7.178 11.875 ( 12.100 -4.934 3.772) 13.601 12.441 ( 3.369 1.842 -8.529) 9.354 13.026 ( -7.688 1.399 9.478) 12.284 13.282 ( -10.060 -0.598 9.909) 14.133 13.739 ( -5.986 1.000 -2.902) 6.727 13.836 ( -11.060 -0.631 -4.026) 11.787 14.212 ( -0.994 0.270 6.972) 7.047 14.482 ( 3.905 6.186 -3.698) 8.197 14.666 ( -3.861 -3.026 -1.212) 5.053 14.975 ( -5.917 0.209 15.705) 16.784 15.094 ( 4.180 -1.405 2.159) 4.910 15.957 ( 18.468 -0.487 -9.457) 20.754 16.200 ( -7.286 -2.357 4.701) 8.985 16.918 ( 11.037 3.485 1.195) 11.635 17.203 ( 5.678 5.376 -1.140) 7.902 17.633 ( 1.752 -1.429 -1.724) 2.843 17.774 ( -1.807 3.177 -2.830) 4.623 18.204 ( 8.567 -1.063 -8.982) 12.458 18.480 ( -13.785 -7.532 3.213) 16.034 20.499 ( -5.497 1.279 2.214) 6.062 20.930 ( 0.270 -4.891 -9.655) 10.826 21.522 ( -1.010 -0.195 3.625) 3.768 21.845 ( -1.187 1.026 -2.774) 3.187 25.123 ( -2.741 -1.186 5.511) 6.268 25.338 ( 5.656 0.204 -4.685) 7.347 28.885 ( -1.022 -1.230 3.005) 3.404 29.116 ( -1.181 -0.649 -1.968) 2.385 34.546 ( 16.362 1.591 -3.695) 16.850 35.074 ( -14.117 3.365 8.024) 16.583 37.804 ( 4.553 0.968 -0.055) 4.655 37.880 ( -1.230 -0.065 7.534) 7.634 40.347 ( 9.753 -0.578 7.488) 12.310 41.091 ( -0.748 4.716 10.238) 11.297 41.541 ( 0.081 -3.328 -5.233) 6.202 43.139 ( 4.740 1.773 -27.695) 28.154 ======================= Grid point 277 (142/205) ======================= q-point: (-0.44 -0.67 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.909 ( -10.294 3.130 6.859) 12.760 3.530 ( -5.015 -6.617 5.088) 9.738 3.897 ( -6.345 -2.045 -5.304) 8.519 4.230 ( -5.267 1.370 6.945) 8.823 4.563 ( -9.501 17.342 -4.281) 20.232 4.764 ( -8.483 -6.872 0.774) 10.944 4.928 ( 10.269 0.864 -0.342) 10.310 5.662 ( -10.950 3.787 -10.609) 15.710 5.736 ( -1.973 -7.101 10.165) 12.556 6.276 ( -4.785 0.056 -3.220) 5.768 6.468 ( 9.274 9.558 12.316) 18.140 6.537 ( 5.995 -7.692 10.317) 14.197 6.791 ( 1.299 2.230 -1.176) 2.836 6.981 ( 9.782 3.643 6.933) 12.531 7.328 ( 7.597 -13.966 -9.584) 18.564 7.548 ( 4.990 3.306 -2.432) 6.461 7.927 ( -0.274 0.956 5.330) 5.422 8.095 ( -2.254 -2.338 -7.620) 8.283 8.331 ( 1.509 12.475 4.458) 13.333 8.884 ( 1.944 0.552 8.080) 8.328 8.917 ( 2.742 5.528 -7.501) 9.713 9.273 ( 0.613 0.427 -2.663) 2.766 9.473 ( 5.543 -4.726 -5.482) 9.116 9.680 ( -2.943 7.194 -8.484) 11.506 10.249 ( -2.385 -4.196 2.513) 5.442 10.454 ( -5.589 -3.318 1.762) 6.735 10.805 ( 2.729 5.016 -0.784) 5.763 10.959 ( -1.880 0.773 -3.349) 3.917 11.096 ( -2.293 -5.257 1.146) 5.849 11.381 ( -4.097 -6.598 -7.016) 10.467 11.870 ( -4.138 -2.146 9.217) 10.328 12.184 ( 20.016 -4.929 -4.786) 21.162 12.428 ( 7.043 3.572 -3.214) 8.526 12.963 ( -5.295 2.471 7.573) 9.565 13.136 ( -18.908 -1.779 5.920) 19.893 13.651 ( -8.614 3.473 -2.850) 9.715 13.746 ( 1.000 -0.584 2.229) 2.512 14.221 ( -1.782 -0.154 4.348) 4.702 14.396 ( 0.541 5.122 -2.332) 5.653 14.567 ( -8.288 2.998 -1.652) 8.967 14.993 ( -4.224 -1.581 14.908) 15.576 15.241 ( 9.762 -4.083 0.070) 10.582 16.093 ( 5.408 -0.916 -2.429) 5.999 16.226 ( 4.193 -3.657 -3.197) 6.416 16.918 ( 5.779 9.191 1.208) 10.923 17.131 ( 0.633 8.396 -1.597) 8.570 17.655 ( 2.703 0.784 -4.260) 5.106 17.697 ( -2.249 1.252 -2.942) 3.909 18.313 ( -0.472 -5.671 1.590) 5.909 18.526 ( 0.897 -9.829 -3.530) 10.482 20.437 ( -5.230 -0.033 4.601) 6.966 20.983 ( 0.049 -6.016 -9.605) 11.334 21.530 ( -0.930 -0.477 3.447) 3.602 21.792 ( -2.181 1.762 -2.142) 3.528 25.137 ( -2.775 -2.043 4.763) 5.879 25.376 ( 4.806 0.659 -4.412) 6.558 28.920 ( -0.154 -2.452 3.127) 3.977 29.104 ( -1.479 -0.718 -1.338) 2.119 34.666 ( 13.344 5.044 -1.081) 14.306 34.867 ( -12.938 4.281 3.889) 14.172 37.813 ( -0.076 2.657 3.219) 4.175 37.892 ( 1.251 -0.002 1.012) 1.609 40.523 ( 11.863 -0.613 9.236) 15.047 41.027 ( 0.086 6.437 6.986) 9.500 41.567 ( -3.661 -3.751 0.167) 5.244 43.029 ( 2.932 3.589 -28.604) 28.977 ======================= Grid point 278 (143/205) ======================= q-point: (-0.33 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.800 ( -7.652 -0.008 15.701) 17.466 3.521 ( -10.565 0.250 5.386) 11.861 3.909 ( 2.435 -3.396 3.869) 5.695 4.078 ( -5.478 18.970 4.687) 20.293 4.186 ( -4.639 11.927 -3.285) 13.212 4.767 ( -12.085 -17.714 -10.946) 24.076 5.078 ( 12.934 0.975 -5.383) 14.043 5.517 ( 4.862 -0.102 -11.367) 12.364 5.991 ( 1.456 -11.427 19.207) 22.397 6.225 ( 0.075 4.895 5.193) 7.137 6.475 ( -4.423 -1.162 9.861) 10.870 6.671 ( 7.134 9.409 0.883) 11.840 6.802 ( 1.795 -6.344 9.931) 11.920 7.058 ( 1.766 -1.605 6.577) 6.996 7.435 ( 4.059 10.213 -3.804) 11.630 7.550 ( 3.760 -3.344 -8.478) 9.859 7.838 ( -4.857 4.677 -5.098) 8.453 8.063 ( -3.933 -6.125 -13.903) 15.693 8.288 ( 2.913 3.194 7.000) 8.227 8.760 ( 1.351 10.670 -11.325) 15.618 8.902 ( 2.449 2.921 6.707) 7.715 9.272 ( 1.549 0.678 2.706) 3.191 9.474 ( -4.062 8.211 -10.311) 13.792 9.602 ( 3.092 -6.647 -7.207) 10.280 10.309 ( -0.615 -3.705 3.646) 5.234 10.462 ( -5.984 -6.244 -0.617) 8.670 10.781 ( 3.366 3.735 1.168) 5.162 10.934 ( 0.632 -0.893 -1.725) 2.042 11.218 ( -0.227 -9.075 4.624) 10.188 11.433 ( -3.791 -8.532 -4.875) 10.533 11.875 ( -7.540 -2.658 7.424) 10.910 12.314 ( 1.622 1.531 -7.918) 8.226 12.538 ( 14.675 4.594 5.171) 16.224 12.822 ( -7.747 -0.263 -3.732) 8.603 13.097 ( 1.699 -1.386 9.732) 9.975 13.468 ( -7.488 4.656 -3.153) 9.364 13.798 ( 1.263 0.384 6.391) 6.526 14.187 ( -4.155 0.150 -1.267) 4.346 14.370 ( 3.781 1.755 3.738) 5.600 14.432 ( -4.194 1.843 -1.604) 4.854 15.036 ( -2.882 -2.103 12.862) 13.348 15.397 ( 6.482 -2.640 -0.663) 7.030 16.130 ( -5.813 -5.735 -0.151) 8.168 16.344 ( 11.539 -0.228 -6.672) 13.332 16.793 ( 0.942 11.916 0.274) 11.957 16.936 ( -0.857 13.799 -1.457) 13.902 17.614 ( -3.848 0.475 -3.625) 5.308 17.694 ( 2.795 -1.749 -7.058) 7.790 18.356 ( -11.192 -7.479 6.959) 15.153 18.774 ( 14.453 -9.654 -5.702) 18.292 20.418 ( -5.301 -2.233 8.642) 10.382 21.042 ( 1.193 -5.196 -9.272) 10.695 21.540 ( -0.801 -0.503 2.651) 2.815 21.727 ( -2.052 1.979 -1.958) 3.459 25.157 ( -2.759 -2.270 3.568) 5.050 25.391 ( 3.280 1.501 -3.727) 5.187 28.979 ( 0.396 -2.869 3.141) 4.273 29.094 ( -1.060 -0.545 -0.549) 1.312 34.597 ( -9.829 5.857 3.622) 12.001 34.772 ( 9.370 6.609 -0.469) 11.476 37.755 ( -4.079 2.572 3.117) 5.742 37.908 ( 3.421 1.771 -1.841) 4.269 40.661 ( 3.679 2.458 10.121) 11.045 40.994 ( 7.326 2.841 1.086) 7.932 41.575 ( -5.292 -2.502 6.096) 8.451 42.878 ( 2.691 4.795 -28.932) 29.450 ======================= Grid point 279 (144/205) ======================= q-point: (-0.22 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.899 ( 4.639 -5.303 20.712) 21.877 3.393 ( 0.404 11.616 11.980) 16.692 3.754 ( -0.020 10.741 -6.476) 12.542 3.887 ( -3.625 9.271 -6.003) 11.624 4.068 ( 0.831 -0.495 11.947) 11.986 4.922 ( -9.901 -19.911 -11.559) 25.062 5.208 ( 9.862 -4.853 0.407) 10.999 5.626 ( 16.700 0.111 -14.180) 21.908 6.036 ( -7.370 14.243 5.901) 17.088 6.179 ( -7.824 -3.642 18.003) 19.964 6.501 ( 6.259 0.565 1.102) 6.380 6.699 ( 11.227 6.832 9.299) 16.099 6.856 ( -7.194 -2.448 6.239) 9.832 7.127 ( -5.295 -1.168 2.969) 6.182 7.331 ( -0.965 -1.464 -3.701) 4.096 7.552 ( 1.137 0.593 2.961) 3.227 7.655 ( -4.049 6.345 -5.145) 9.117 8.063 ( -5.638 -2.334 -13.727) 15.022 8.328 ( 1.299 -7.052 -4.097) 8.258 8.567 ( 2.417 9.682 -11.873) 15.510 8.930 ( 5.188 1.414 2.964) 6.140 9.226 ( -0.825 9.942 -4.782) 11.064 9.359 ( 2.485 -2.314 1.549) 3.732 9.676 ( 1.810 -2.510 -8.477) 9.024 10.374 ( -0.991 -3.813 4.080) 5.672 10.484 ( -5.090 -3.941 -2.226) 6.812 10.761 ( -2.022 -0.685 1.925) 2.874 10.993 ( 1.258 -4.381 -1.718) 4.870 11.360 ( -2.330 -6.516 6.113) 9.233 11.527 ( -3.325 -9.746 -0.420) 10.306 11.834 ( -9.321 -2.368 5.270) 10.966 12.175 ( -11.594 4.740 -1.747) 12.647 12.530 ( 2.147 1.753 -1.107) 2.985 12.919 ( 17.376 1.593 -5.085) 18.175 13.225 ( 10.330 -0.392 8.440) 13.345 13.337 ( -1.062 3.394 -0.838) 3.654 13.769 ( -6.165 2.622 7.500) 10.057 14.148 ( -3.194 -1.284 -2.609) 4.320 14.380 ( 1.987 -1.494 2.406) 3.459 14.492 ( 8.873 -0.803 3.937) 9.741 15.099 ( -0.330 -3.092 8.989) 9.512 15.458 ( -0.106 -0.310 1.107) 1.155 16.127 ( -14.029 -8.427 -5.137) 17.152 16.381 ( 6.698 11.563 -4.445) 14.083 16.580 ( -3.552 7.745 0.536) 8.537 16.754 ( 8.969 12.329 -1.819) 15.355 17.541 ( -5.536 -0.667 -4.590) 7.222 17.738 ( 1.886 -3.623 -7.058) 8.154 18.357 ( -11.169 -6.076 6.208) 14.150 19.058 ( 13.027 -6.647 -5.007) 15.458 20.455 ( -5.143 -5.087 11.684) 13.742 21.107 ( 4.260 -3.448 -7.682) 9.437 21.542 ( -1.011 0.230 1.583) 1.892 21.675 ( -0.630 1.170 -2.567) 2.890 25.169 ( -2.625 -1.774 2.061) 3.780 25.374 ( 1.456 2.598 -2.541) 3.915 29.017 ( -1.147 -0.390 2.282) 2.584 29.111 ( 1.145 -1.872 0.658) 2.291 34.399 ( -10.685 4.508 2.533) 11.870 34.772 ( 10.543 8.687 2.399) 13.870 37.677 ( -4.387 1.934 2.421) 5.370 37.897 ( 2.940 3.284 -2.421) 5.029 40.601 ( -6.707 4.578 6.078) 10.143 41.110 ( 11.838 0.157 0.847) 11.869 41.572 ( -4.891 -1.211 6.354) 8.110 42.744 ( 6.638 3.815 -26.510) 27.593 ======================= Grid point 280 (145/205) ======================= q-point: (-0.11 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.087 ( 7.273 9.287 25.513) 28.108 3.404 ( 18.611 1.113 11.066) 21.681 3.670 ( 6.593 4.587 -13.766) 15.938 3.768 ( 3.979 -3.352 -2.978) 5.995 4.161 ( 2.141 -1.172 17.320) 17.491 5.024 ( -11.209 -14.862 -7.530) 20.080 5.426 ( 4.522 -3.855 8.981) 10.769 5.697 ( -7.060 12.823 8.956) 17.161 5.760 ( 18.957 4.533 -23.576) 30.590 6.085 ( -21.173 0.196 8.146) 22.687 6.524 ( 8.344 8.811 -7.510) 14.271 6.685 ( -11.227 3.235 0.826) 11.713 6.756 ( 5.437 6.432 15.243) 17.415 7.180 ( 3.813 -4.839 -1.141) 6.266 7.319 ( -7.565 -1.652 -8.283) 11.339 7.511 ( 8.416 12.999 6.413) 16.761 7.607 ( -9.821 -6.473 5.483) 12.978 8.024 ( -4.142 -13.573 -9.708) 17.194 8.367 ( -0.118 4.291 -8.864) 9.849 8.536 ( 3.329 -8.835 -9.682) 13.523 8.992 ( 6.504 1.461 1.108) 6.758 9.053 ( 1.461 7.156 -4.661) 8.664 9.460 ( 4.079 -1.191 4.582) 6.249 9.646 ( -0.057 3.007 -8.113) 8.652 10.422 ( -6.155 0.183 -3.959) 7.321 10.449 ( -1.798 -5.205 4.412) 7.056 10.791 ( -4.316 -5.857 1.791) 7.492 11.046 ( -6.454 -5.816 2.704) 9.099 11.400 ( -5.518 -2.944 2.920) 6.902 11.614 ( -5.902 -6.540 -1.303) 8.905 11.793 ( -6.479 0.175 4.487) 7.883 12.019 ( -2.683 -1.414 -0.170) 3.037 12.554 ( -0.748 -2.667 -3.857) 4.749 13.032 ( 14.826 4.053 -2.926) 15.646 13.307 ( 3.845 6.015 2.566) 7.586 13.410 ( 14.189 -0.184 4.232) 14.808 13.700 ( -4.614 -1.239 9.953) 11.041 14.126 ( -3.799 -2.242 0.447) 4.434 14.499 ( 6.960 -3.782 1.649) 8.091 14.609 ( 8.282 2.044 4.497) 9.643 15.188 ( -0.563 -3.733 2.133) 4.337 15.442 ( -2.269 0.382 6.342) 6.746 15.945 ( -18.822 3.261 -8.948) 21.094 16.153 ( -4.151 10.202 -3.085) 11.438 16.516 ( 7.416 6.318 -1.463) 9.852 16.756 ( 9.006 2.391 1.000) 9.371 17.485 ( -3.439 -1.822 -4.758) 6.147 17.789 ( -0.020 -4.428 -6.299) 7.700 18.332 ( -9.749 -3.854 3.854) 11.169 19.211 ( 5.778 -0.310 -3.811) 6.929 20.535 ( -5.702 -6.823 10.296) 13.604 21.194 ( 7.834 -1.142 -4.528) 9.120 21.518 ( -1.441 1.260 0.564) 1.995 21.662 ( 1.749 -0.468 -3.759) 4.172 25.168 ( -1.801 -0.913 0.491) 2.078 25.326 ( -0.126 3.459 -0.948) 3.589 28.996 ( -1.538 1.484 1.875) 2.844 29.161 ( 1.462 -1.410 0.752) 2.166 34.229 ( -6.912 4.645 1.489) 8.459 34.790 ( 9.625 5.248 6.376) 12.682 37.620 ( -2.449 1.150 2.830) 3.915 37.860 ( 2.027 3.742 -1.957) 4.684 40.456 ( -9.012 3.467 2.989) 10.108 41.223 ( 6.191 1.076 5.350) 8.253 41.525 ( -4.857 0.684 -4.398) 6.588 42.743 ( 14.566 -0.046 -20.535) 25.177 ======================= Grid point 285 (146/205) ======================= q-point: (-0.56 -0.56 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.059 ( 8.284 0.000 -1.092) 8.356 3.423 ( -11.550 -0.000 15.575) 19.391 3.837 ( -9.377 -0.000 -9.183) 13.125 4.093 ( -5.285 -0.000 -24.422) 24.987 4.672 ( -1.458 -0.000 9.767) 9.875 4.753 ( -18.427 -0.000 27.446) 33.058 5.102 ( 5.664 0.000 -1.566) 5.877 5.443 ( -14.175 -0.000 11.184) 18.055 5.995 ( -3.980 -0.000 -23.652) 23.984 6.343 ( 9.280 0.000 2.605) 9.639 6.410 ( -7.542 -0.000 3.393) 8.270 6.553 ( 1.062 0.000 -13.100) 13.143 6.755 ( 1.818 0.000 -6.102) 6.367 6.862 ( 12.324 0.000 13.908) 18.583 7.375 ( 17.303 0.000 6.502) 18.484 7.478 ( 7.572 0.000 7.822) 10.887 7.887 ( 3.491 0.000 7.170) 7.974 8.142 ( -2.508 -0.000 -3.056) 3.953 8.665 ( -5.299 -0.000 1.556) 5.522 8.757 ( 7.141 0.000 1.851) 7.376 8.959 ( 4.308 0.000 5.730) 7.169 9.269 ( 0.441 0.000 -6.074) 6.090 9.454 ( 4.558 0.000 -4.106) 6.134 9.830 ( -5.197 -0.000 -7.495) 9.121 10.153 ( -4.254 -0.000 5.157) 6.685 10.405 ( -3.607 -0.000 0.455) 3.636 10.927 ( -3.087 -0.000 -5.638) 6.428 10.928 ( -0.112 -0.000 -1.765) 1.768 11.104 ( 1.052 0.000 -3.698) 3.844 11.184 ( -12.538 -0.000 -8.392) 15.088 11.839 ( -3.942 -0.000 10.651) 11.357 12.073 ( 24.759 0.000 -7.180) 25.780 12.491 ( 7.359 0.000 -2.856) 7.893 13.002 ( -4.784 -0.000 9.246) 10.411 13.112 ( -21.105 -0.000 6.950) 22.220 13.714 ( -8.166 -0.000 -3.029) 8.709 13.742 ( 4.396 0.000 1.644) 4.694 14.225 ( -0.908 -0.000 3.896) 4.001 14.531 ( -6.717 -0.000 2.408) 7.135 14.589 ( 0.020 0.000 -7.934) 7.934 14.955 ( -7.331 -0.000 15.297) 16.963 15.161 ( 8.915 0.000 0.526) 8.930 16.094 ( -8.864 -0.000 3.551) 9.549 16.146 ( 18.924 0.000 -9.651) 21.243 17.059 ( 6.308 0.000 3.146) 7.049 17.306 ( 2.843 0.000 -0.134) 2.846 17.627 ( 1.293 0.000 -1.052) 1.667 17.771 ( -2.242 -0.000 -1.412) 2.649 18.247 ( -15.154 -0.000 3.882) 15.643 18.298 ( 14.432 0.000 -11.300) 18.329 20.444 ( -6.426 -0.000 1.670) 6.639 20.867 ( 2.112 0.000 -10.408) 10.620 21.522 ( -1.452 -0.000 4.718) 4.936 21.819 ( -2.720 -0.000 -1.951) 3.347 25.101 ( -3.180 -0.000 5.769) 6.588 25.384 ( 5.044 0.000 -4.932) 7.054 28.877 ( -0.576 -0.000 3.164) 3.216 29.089 ( -0.928 -0.000 -2.382) 2.556 34.749 ( 17.647 0.000 -2.878) 17.880 34.943 ( -16.419 -0.000 5.093) 17.191 37.876 ( -4.259 -0.000 6.866) 8.080 37.879 ( 6.442 0.000 0.024) 6.442 40.515 ( 13.706 0.000 8.708) 16.238 41.191 ( -0.513 -0.000 18.059) 18.066 41.451 ( -3.745 -0.000 -10.604) 11.246 43.087 ( 3.183 0.000 -29.442) 29.614 ======================= Grid point 286 (147/205) ======================= q-point: (-0.44 -0.56 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.014 ( -1.551 10.433 9.602) 14.264 3.427 ( -3.816 -1.735 8.764) 9.715 3.779 ( -1.040 -4.212 -6.405) 7.736 4.010 ( -11.465 -16.017 -20.912) 28.728 4.516 ( -16.538 7.775 16.288) 24.479 4.680 ( -8.628 5.593 10.807) 14.917 5.228 ( 16.038 -1.508 9.405) 18.653 5.437 ( -6.197 -7.759 8.055) 12.786 5.736 ( -2.780 12.333 -17.862) 21.883 6.246 ( -1.363 2.212 -4.463) 5.164 6.500 ( -6.182 -4.391 10.024) 12.569 6.666 ( 12.739 0.435 0.888) 12.777 6.809 ( 5.213 -7.336 -13.549) 16.265 7.077 ( 12.187 -6.212 0.104) 13.679 7.395 ( 6.465 11.768 7.155) 15.214 7.644 ( 5.004 -0.518 0.768) 5.089 7.941 ( -2.760 -2.589 4.470) 5.857 8.070 ( -0.516 6.043 -1.031) 6.152 8.524 ( -1.484 8.983 4.301) 10.069 8.887 ( -0.761 -6.232 -0.896) 6.342 9.002 ( 3.057 3.665 6.941) 8.423 9.260 ( 0.221 -1.356 -3.850) 4.088 9.467 ( 2.519 0.997 -6.143) 6.714 9.685 ( -7.396 3.991 -6.590) 10.679 10.158 ( -3.964 -3.826 5.940) 8.101 10.376 ( -1.975 -0.321 -0.234) 2.015 10.868 ( 0.231 1.185 -2.503) 2.779 10.915 ( -1.997 -0.298 -3.110) 3.708 11.059 ( -0.831 -2.754 -3.516) 4.543 11.169 ( -1.453 -5.248 -5.321) 7.614 11.820 ( -6.567 -0.863 8.008) 10.393 12.297 ( 14.441 -1.444 -12.956) 19.454 12.630 ( 17.967 1.463 5.591) 18.873 12.819 ( -22.874 0.046 -0.822) 22.889 13.064 ( 2.077 -0.448 13.458) 13.624 13.595 ( -6.715 2.561 -2.718) 7.684 13.821 ( 6.406 0.734 5.394) 8.407 14.212 ( -2.228 0.616 -0.902) 2.482 14.445 ( -3.793 2.182 1.795) 4.730 14.520 ( -3.633 2.693 -3.599) 5.780 14.949 ( -6.368 -2.598 13.068) 14.767 15.294 ( 8.561 -2.669 -0.507) 8.982 16.010 ( -9.484 -1.718 2.030) 9.850 16.324 ( 15.895 -0.596 -9.158) 18.354 17.082 ( 1.619 4.845 3.198) 6.027 17.262 ( 0.355 6.675 -1.219) 6.794 17.649 ( -0.539 -1.696 -1.174) 2.132 17.708 ( -1.470 4.062 -0.871) 4.407 18.140 ( -11.320 -5.065 2.686) 12.689 18.488 ( 15.355 -6.076 -8.985) 18.799 20.376 ( -6.584 -0.477 2.961) 7.235 20.886 ( 2.811 -3.467 -10.102) 11.044 21.526 ( -1.556 -0.285 5.104) 5.344 21.770 ( -3.432 0.683 -1.256) 3.718 25.094 ( -3.303 -1.223 5.241) 6.314 25.416 ( 3.740 0.243 -4.712) 6.020 28.900 ( 0.145 -1.541 3.303) 3.648 29.075 ( -0.610 -0.476 -2.227) 2.358 34.741 ( -15.701 2.601 2.813) 16.162 34.931 ( 17.345 2.801 -1.388) 17.624 37.827 ( -5.551 1.472 4.907) 7.553 37.955 ( 6.735 0.899 0.322) 6.803 40.720 ( 14.692 0.877 9.014) 17.259 41.164 ( -1.745 7.406 8.309) 11.266 41.427 ( -5.688 -6.579 0.317) 8.703 42.981 ( 1.432 1.684 -30.728) 30.807 ======================= Grid point 287 (148/205) ======================= q-point: (-0.33 -0.56 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.907 ( -1.240 5.170 18.798) 19.536 3.420 ( -4.275 -1.070 7.829) 8.984 3.862 ( 2.922 -9.330 -10.517) 14.359 4.059 ( -26.167 -14.604 -5.495) 30.466 4.330 ( 7.694 8.407 -1.283) 11.468 4.452 ( -4.012 13.154 9.455) 16.689 5.348 ( 9.484 12.246 -7.957) 17.414 5.566 ( 9.987 -4.785 0.701) 11.097 5.743 ( -1.423 -20.312 14.493) 24.993 6.236 ( 0.781 1.057 4.262) 4.460 6.413 ( -14.064 1.084 2.470) 14.321 6.798 ( 10.330 3.525 11.018) 15.509 6.929 ( 10.057 -0.226 -4.656) 11.085 7.211 ( -4.667 9.426 1.762) 10.665 7.368 ( 4.718 -13.147 -14.056) 19.816 7.603 ( 0.898 7.370 -5.194) 9.061 7.904 ( -6.813 0.612 -2.970) 7.457 7.953 ( 3.103 9.343 1.674) 9.986 8.408 ( -2.176 6.217 7.252) 9.797 8.843 ( -1.686 5.030 -9.775) 11.122 9.033 ( 3.921 3.213 10.409) 11.578 9.276 ( -0.228 -1.785 -1.262) 2.198 9.473 ( -2.398 -6.143 -8.024) 10.386 9.505 ( -3.558 6.155 -6.827) 9.856 10.228 ( -2.323 -6.421 6.624) 9.513 10.363 ( -1.093 -0.185 0.350) 1.163 10.829 ( -3.101 3.015 -1.013) 4.442 10.930 ( 4.117 -2.274 -0.731) 4.760 11.169 ( 3.247 -8.627 -1.170) 9.292 11.214 ( -0.776 -4.632 -3.471) 5.840 11.783 ( -6.877 -1.237 6.445) 9.506 12.307 ( -6.696 3.643 -6.384) 9.943 12.563 ( -9.642 -0.776 -5.048) 10.911 12.914 ( 21.022 -0.535 4.116) 21.428 13.195 ( 8.459 -1.226 12.166) 14.869 13.467 ( -3.154 4.168 -2.018) 5.603 13.879 ( 2.479 3.212 7.017) 8.105 14.145 ( -3.506 0.834 -5.148) 6.285 14.373 ( -3.392 1.295 -0.888) 3.738 14.492 ( 5.848 0.951 3.869) 7.076 14.984 ( -4.840 -4.197 10.442) 12.250 15.407 ( 2.703 -2.555 -0.208) 3.726 15.929 ( -12.668 -3.618 0.130) 13.175 16.464 ( 12.275 -0.332 -7.782) 14.537 16.961 ( -3.470 10.633 1.907) 11.347 17.127 ( 1.241 9.390 -2.787) 9.873 17.594 ( -4.072 3.162 -1.144) 5.281 17.673 ( 1.264 -0.078 -2.982) 3.239 18.140 ( -7.489 -6.834 2.088) 10.352 18.766 ( 14.452 -9.796 -6.297) 18.560 20.338 ( -6.525 -2.373 6.439) 9.470 20.958 ( 4.323 -5.128 -9.291) 11.459 21.534 ( -1.456 -0.465 4.646) 4.891 21.712 ( -3.253 0.951 -0.958) 3.522 25.101 ( -3.164 -2.026 4.091) 5.554 25.425 ( 2.068 0.749 -4.065) 4.622 28.952 ( 0.521 -2.640 3.288) 4.249 29.072 ( -0.114 -0.753 -1.536) 1.715 34.525 ( -13.930 3.047 1.459) 14.334 35.050 ( 16.375 7.495 0.437) 18.015 37.745 ( -5.716 2.126 3.469) 7.017 38.002 ( 6.022 2.942 -0.105) 6.703 40.805 ( 1.118 7.481 5.622) 9.425 41.115 ( 6.843 0.749 0.645) 6.914 41.483 ( -4.611 -4.707 10.111) 12.068 42.836 ( 0.583 2.004 -30.811) 30.882 ======================= Grid point 288 (149/205) ======================= q-point: (-0.22 -0.56 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.020 ( 7.238 -5.181 21.781) 23.530 3.475 ( 4.343 -2.487 7.208) 8.775 3.765 ( -21.731 -2.179 -9.915) 23.986 4.108 ( 4.705 1.156 4.547) 6.645 4.163 ( 10.175 13.227 9.508) 19.206 4.482 ( -0.223 -9.687 -9.602) 13.642 5.314 ( 12.169 2.269 -4.939) 13.327 5.755 ( 4.128 -5.738 1.293) 7.186 6.064 ( -17.707 7.615 2.892) 19.491 6.084 ( 2.288 -6.900 8.478) 11.168 6.373 ( -3.720 -7.223 8.335) 11.639 6.839 ( -3.877 3.548 1.570) 5.485 6.940 ( 5.995 6.933 5.550) 10.715 7.103 ( 2.461 -1.304 -1.101) 2.995 7.401 ( -4.648 11.108 -8.085) 14.504 7.465 ( -5.265 -3.547 -5.109) 8.149 7.813 ( -1.662 0.391 -5.211) 5.483 7.897 ( 4.455 3.325 -3.203) 6.416 8.333 ( 1.072 4.089 2.727) 5.031 8.682 ( 1.024 8.557 -11.066) 14.026 9.053 ( 4.243 3.767 6.277) 8.461 9.301 ( -0.839 0.241 -7.705) 7.755 9.366 ( 1.412 2.460 2.110) 3.535 9.557 ( -0.340 -8.850 -9.077) 12.681 10.322 ( -1.762 -1.844 4.851) 5.481 10.380 ( -0.503 -5.389 2.997) 6.187 10.707 ( -6.089 4.180 -2.254) 7.722 10.996 ( 1.428 0.088 1.142) 1.830 11.286 ( -1.184 -7.262 -1.031) 7.430 11.342 ( 2.824 -6.580 1.514) 7.318 11.764 ( -2.720 -0.988 6.518) 7.132 12.057 ( -16.072 2.770 -3.461) 16.672 12.529 ( 0.499 -0.672 -6.286) 6.342 13.126 ( 11.250 1.181 1.366) 11.394 13.379 ( 11.790 -1.532 8.187) 14.435 13.420 ( 6.168 2.792 3.490) 7.617 13.809 ( -4.357 6.259 6.367) 9.935 14.086 ( -2.842 -0.275 -4.413) 5.256 14.385 ( 5.111 -2.383 -0.832) 5.701 14.620 ( 10.340 -0.910 6.121) 12.051 15.051 ( -1.924 -5.024 6.388) 8.352 15.426 ( -4.376 -1.066 2.470) 5.136 15.811 ( -18.007 -4.646 -2.949) 18.829 16.554 ( 6.716 1.859 -5.155) 8.667 16.689 ( -7.323 13.454 0.812) 15.339 17.000 ( 4.672 9.194 -3.636) 10.935 17.505 ( -1.300 2.391 -3.328) 4.299 17.681 ( 0.788 -1.239 -4.383) 4.623 18.175 ( -5.182 -5.602 1.566) 7.791 19.051 ( 10.332 -8.988 -4.797) 14.511 20.352 ( -5.804 -4.561 9.605) 12.114 21.078 ( 7.295 -5.591 -7.272) 11.720 21.539 ( -1.444 -0.115 3.523) 3.809 21.662 ( -2.242 0.497 -1.342) 2.660 25.114 ( -2.609 -2.176 2.504) 4.220 25.407 ( 0.363 1.580 -2.949) 3.365 29.002 ( -0.330 -1.434 2.085) 2.552 29.093 ( 0.865 -1.977 0.345) 2.186 34.341 ( -10.258 2.436 0.738) 10.569 35.077 ( 12.635 11.365 2.540) 17.183 37.665 ( -4.245 1.737 2.834) 5.391 37.999 ( 4.276 4.761 -0.629) 6.430 40.634 ( -7.325 7.726 0.717) 10.670 41.229 ( 6.508 -0.668 5.003) 8.236 41.525 ( -2.483 -1.118 4.511) 5.269 42.728 ( 3.918 -0.884 -26.612) 26.913 ======================= Grid point 289 (150/205) ======================= q-point: (-0.11 -0.56 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.372 ( 16.778 -6.536 21.593) 28.116 3.501 ( -8.264 1.885 0.842) 8.518 3.690 ( 3.734 -8.663 -6.868) 11.669 4.044 ( 22.049 12.364 10.139) 27.237 4.281 ( 6.104 4.376 11.976) 14.136 4.612 ( -4.134 -15.972 -6.843) 17.861 5.429 ( -1.433 -0.698 2.985) 3.384 5.698 ( -21.326 8.529 4.616) 23.428 5.803 ( -14.984 -5.557 3.817) 16.431 6.063 ( 10.549 10.243 -8.740) 17.105 6.477 ( -4.355 -7.170 -5.182) 9.861 6.694 ( -5.107 3.685 -5.484) 8.351 7.017 ( 2.183 -1.002 1.532) 2.848 7.077 ( -2.893 7.130 14.001) 15.976 7.239 ( 2.789 -1.676 -5.644) 6.515 7.425 ( -9.435 -2.575 4.492) 10.762 7.791 ( 3.170 1.336 -3.234) 4.721 7.896 ( 7.725 2.763 -4.243) 9.236 8.341 ( 3.054 -0.382 -4.576) 5.515 8.539 ( 4.052 6.154 -11.895) 13.992 9.073 ( 2.862 1.803 3.521) 4.882 9.180 ( 1.438 6.719 -6.906) 9.742 9.473 ( 4.793 -4.963 1.838) 7.141 9.626 ( 0.282 -2.298 -8.541) 8.849 10.321 ( -2.957 -2.543 0.813) 3.984 10.462 ( 1.856 3.331 3.376) 5.093 10.592 ( -8.414 -5.218 1.277) 9.982 10.974 ( -5.041 -0.278 4.017) 6.452 11.346 ( -1.199 -0.526 3.196) 3.454 11.436 ( -3.142 -5.807 -3.643) 7.540 11.804 ( 2.663 0.015 5.012) 5.676 11.914 ( -5.823 -3.913 -2.199) 7.352 12.499 ( -2.897 0.184 -4.518) 5.370 13.173 ( 3.248 1.754 -0.756) 3.768 13.504 ( 8.745 4.541 5.526) 11.298 13.570 ( 9.579 -0.255 5.947) 11.278 13.718 ( 1.217 0.664 9.362) 9.464 14.058 ( -1.524 -1.092 -0.892) 2.076 14.523 ( 8.460 -3.836 -2.228) 9.553 14.755 ( 6.908 1.127 7.252) 10.079 15.094 ( -7.368 -2.148 -0.956) 7.734 15.436 ( 0.154 -3.372 8.021) 8.702 15.631 ( -19.454 -4.722 -5.966) 20.889 16.301 ( -9.760 14.950 0.413) 17.859 16.633 ( 4.097 0.918 -2.934) 5.122 16.925 ( 6.124 6.365 -3.150) 9.378 17.468 ( 3.063 1.534 -5.247) 6.266 17.698 ( 0.338 -2.612 -5.636) 6.221 18.199 ( -3.380 -3.186 0.668) 4.693 19.216 ( 2.527 -3.477 -2.961) 5.220 20.412 ( -4.872 -5.617 9.509) 12.071 21.241 ( 9.870 -4.283 -4.542) 11.678 21.524 ( -1.931 1.086 2.418) 3.280 21.642 ( -0.404 -1.263 -2.660) 2.972 25.129 ( -1.223 -1.875 0.756) 2.363 25.362 ( -0.975 2.469 -1.381) 2.993 29.005 ( -0.791 0.602 1.246) 1.594 29.147 ( 0.583 -2.446 1.555) 2.956 34.219 ( -4.971 1.644 0.194) 5.239 35.028 ( 7.036 10.182 5.096) 13.384 37.623 ( -1.409 0.635 2.875) 3.265 37.955 ( 2.526 5.254 -0.568) 5.857 40.440 ( -7.320 5.482 0.271) 9.149 41.288 ( -4.186 0.978 12.956) 13.651 41.487 ( 1.611 1.222 -11.928) 12.099 42.771 ( 10.122 -4.995 -19.501) 22.532 ======================= Grid point 295 (151/205) ======================= q-point: (-0.44 -0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.025 ( -18.143 -0.000 4.591) 18.715 3.504 ( -24.094 -0.000 -8.676) 25.609 3.549 ( 6.169 0.000 4.096) 7.405 3.751 ( 8.863 0.000 -3.718) 9.611 4.534 ( -9.685 -0.000 24.430) 26.280 4.688 ( -1.261 -0.000 8.855) 8.944 5.336 ( -5.140 -0.000 10.020) 11.261 5.402 ( 14.753 0.000 5.747) 15.833 5.831 ( 1.901 0.000 -14.731) 14.854 6.224 ( -0.420 -0.000 -2.401) 2.438 6.505 ( 4.838 0.000 -11.541) 12.514 6.555 ( -0.872 -0.000 -4.717) 4.797 6.937 ( 20.226 0.000 -1.234) 20.263 7.182 ( 7.680 0.000 -2.020) 7.941 7.487 ( -14.596 -0.000 3.481) 15.005 7.696 ( 4.833 0.000 1.556) 5.078 7.887 ( -4.970 -0.000 4.910) 6.986 8.173 ( 5.793 0.000 3.921) 6.995 8.612 ( -2.730 -0.000 3.227) 4.227 8.740 ( -6.587 -0.000 -1.202) 6.696 9.104 ( 2.264 0.000 9.201) 9.476 9.217 ( -1.280 -0.000 -5.981) 6.117 9.482 ( 0.037 0.000 -5.845) 5.845 9.585 ( -9.319 -0.000 -4.309) 10.267 10.107 ( -3.055 -0.000 7.365) 7.973 10.382 ( 2.198 0.000 -0.806) 2.341 10.869 ( -6.174 -0.000 0.357) 6.184 10.875 ( 3.458 0.000 -2.585) 4.318 10.957 ( 2.249 0.000 -7.081) 7.430 11.194 ( 6.406 0.000 -3.083) 7.109 11.761 ( -6.243 -0.000 5.709) 8.460 12.383 ( 9.901 0.000 -13.101) 16.421 12.521 ( -24.819 -0.000 -1.701) 24.877 12.910 ( 20.635 0.000 7.623) 21.998 13.172 ( 7.068 0.000 13.835) 15.535 13.544 ( -3.797 -0.000 -2.049) 4.314 13.933 ( 6.488 0.000 6.822) 9.415 14.160 ( -4.700 -0.000 -8.013) 9.290 14.413 ( -3.498 -0.000 0.997) 3.637 14.531 ( 1.081 0.000 2.378) 2.612 14.890 ( -6.881 -0.000 10.800) 12.805 15.352 ( 4.341 0.000 0.203) 4.346 15.879 ( -11.204 -0.000 0.765) 11.230 16.456 ( 12.981 0.000 -9.316) 15.978 17.135 ( -1.806 -0.000 4.090) 4.471 17.298 ( -2.862 -0.000 -2.009) 3.497 17.614 ( -2.581 -0.000 0.801) 2.702 17.749 ( 1.590 0.000 -0.562) 1.686 17.988 ( -5.790 -0.000 -0.960) 5.869 18.585 ( 14.483 0.000 -7.971) 16.532 20.302 ( -6.771 -0.000 3.004) 7.407 20.859 ( 3.823 0.000 -9.436) 10.181 21.525 ( -1.921 -0.000 6.006) 6.306 21.728 ( -3.909 -0.000 -0.529) 3.945 25.065 ( -3.368 -0.000 4.999) 6.028 25.435 ( 2.269 0.000 -4.526) 5.063 28.904 ( 0.553 0.000 3.420) 3.464 29.058 ( 0.092 0.000 -2.581) 2.583 34.576 ( -15.916 -0.000 0.992) 15.947 35.178 ( 20.154 0.000 -0.190) 20.155 37.785 ( -6.257 -0.000 4.036) 7.446 38.054 ( 7.549 0.000 1.366) 7.671 40.950 ( 15.926 0.000 6.901) 17.357 41.187 ( -9.005 -0.000 -15.439) 17.873 41.330 ( -2.280 -0.000 25.576) 25.677 42.868 ( -1.502 -0.000 -32.904) 32.938 ======================= Grid point 296 (152/205) ======================= q-point: (-0.33 -0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.804 ( -24.514 -5.865 13.473) 28.580 3.204 ( -36.672 -17.742 -16.154) 43.824 3.640 ( 15.495 10.684 11.947) 22.293 3.961 ( 14.287 -4.868 -0.476) 15.101 4.545 ( 5.300 3.027 7.465) 9.642 4.654 ( -0.739 8.962 13.474) 16.199 5.372 ( -4.710 -6.856 15.516) 17.605 5.610 ( 4.256 4.606 -7.671) 9.908 5.761 ( 17.150 -1.741 -2.310) 17.392 6.252 ( -10.260 -2.020 1.624) 10.582 6.358 ( 6.109 7.092 1.026) 9.416 6.786 ( 2.759 -16.532 -11.727) 20.456 7.119 ( 14.160 8.357 3.695) 16.852 7.142 ( -17.695 2.279 -5.290) 18.609 7.305 ( 3.412 -0.580 -5.865) 6.810 7.650 ( -5.331 5.581 -3.910) 8.652 7.844 ( -4.915 1.463 3.812) 6.390 8.204 ( 7.580 8.098 4.234) 11.873 8.492 ( -2.743 6.029 5.111) 8.366 8.780 ( -0.973 -6.280 -7.171) 9.582 9.134 ( -0.254 0.752 5.649) 5.705 9.197 ( -2.992 -3.334 -3.313) 5.572 9.369 ( -5.198 4.328 -5.383) 8.644 9.510 ( -2.219 -0.058 -3.213) 3.905 10.154 ( 0.113 -3.841 9.645) 10.382 10.394 ( 2.258 1.756 -0.899) 2.998 10.806 ( -5.765 -0.470 0.528) 5.809 10.962 ( 8.066 -1.789 0.689) 8.291 11.025 ( 4.409 -4.483 -4.783) 7.900 11.259 ( 7.223 -0.386 -2.836) 7.770 11.729 ( -3.306 -0.907 4.499) 5.656 12.187 ( -20.890 4.429 -2.508) 21.501 12.456 ( 2.736 -3.297 -10.585) 11.419 13.137 ( 10.841 0.070 7.181) 13.004 13.331 ( 8.934 -1.091 12.615) 15.497 13.511 ( 3.138 2.090 0.629) 3.822 13.985 ( 0.104 3.873 4.373) 5.842 14.073 ( -2.387 -1.092 -8.192) 8.602 14.383 ( 1.620 1.502 -0.436) 2.252 14.588 ( 6.475 -0.462 5.783) 8.694 14.890 ( -5.168 -4.115 8.631) 10.869 15.378 ( -3.221 -1.408 2.079) 4.084 15.741 ( -13.375 -0.346 -0.758) 13.401 16.548 ( 7.917 -0.329 -8.241) 11.433 17.053 ( -6.292 6.847 2.744) 9.696 17.213 ( -2.370 3.549 -3.849) 5.746 17.570 ( -3.853 1.382 -0.286) 4.103 17.739 ( 4.562 3.689 -1.411) 6.034 18.005 ( 0.845 -4.723 -2.259) 5.303 18.764 ( 11.531 -6.427 -5.985) 14.494 20.253 ( -6.110 -1.589 5.940) 8.668 20.904 ( 4.911 -3.904 -8.501) 10.566 21.527 ( -2.091 -0.315 5.937) 6.302 21.678 ( -3.633 0.328 -0.161) 3.651 25.055 ( -3.019 -1.156 4.132) 5.246 25.433 ( 0.759 0.282 -3.972) 4.054 28.938 ( 0.643 -1.529 3.418) 3.799 29.056 ( 0.502 -0.547 -2.293) 2.411 34.391 ( -13.890 0.790 -0.034) 13.912 35.381 ( 20.782 5.915 0.774) 21.621 37.717 ( -5.674 1.148 3.271) 6.649 38.127 ( 6.774 2.566 1.484) 7.394 40.919 ( -6.454 8.923 -8.703) 14.036 41.177 ( 7.288 -2.971 0.902) 7.922 41.447 ( -0.104 -2.927 22.297) 22.488 42.698 ( -4.451 -0.694 -33.829) 34.128 ======================= Grid point 297 (153/205) ======================= q-point: (-0.22 -0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.833 ( -15.865 -19.659 11.972) 27.955 3.087 ( -33.410 -26.992 -1.345) 42.972 3.710 ( 15.644 8.771 8.425) 19.815 4.195 ( 14.481 -3.469 0.466) 14.897 4.531 ( 1.689 9.659 7.456) 12.318 4.594 ( 15.828 10.667 3.193) 19.352 5.493 ( 8.334 6.435 -8.765) 13.700 5.515 ( -14.051 -10.746 18.462) 25.569 5.957 ( -17.061 6.051 -1.168) 18.140 6.121 ( 10.288 -8.101 5.654) 14.263 6.406 ( 3.148 6.125 2.392) 7.290 6.715 ( -25.969 1.501 -3.239) 26.213 7.004 ( -1.177 -8.710 -8.132) 11.974 7.173 ( 9.480 4.752 0.722) 10.629 7.383 ( 6.497 0.164 -4.791) 8.074 7.444 ( -3.951 6.695 -9.574) 12.333 7.732 ( -4.232 3.993 -1.567) 6.026 8.157 ( 7.323 10.214 4.369) 13.306 8.440 ( 2.926 4.061 3.755) 6.258 8.776 ( 3.813 5.101 -11.217) 12.898 9.121 ( -5.005 -1.896 1.891) 5.676 9.248 ( 1.397 -3.695 -0.286) 3.961 9.300 ( -1.412 -5.481 -5.532) 7.915 9.480 ( 1.275 1.193 -3.565) 3.970 10.296 ( 3.448 -4.646 12.536) 13.807 10.375 ( 1.411 2.153 -1.118) 2.806 10.734 ( -2.802 3.354 -1.016) 4.487 10.997 ( -1.502 2.589 -1.663) 3.424 11.183 ( 7.233 -6.688 1.139) 9.917 11.357 ( 5.791 -1.320 -0.848) 5.999 11.766 ( 2.025 -2.685 5.207) 6.199 11.886 ( -16.269 2.849 -2.356) 16.684 12.477 ( -0.618 -2.305 -8.565) 8.892 13.204 ( -0.615 0.307 3.452) 3.520 13.509 ( 9.320 -2.284 9.397) 13.430 13.558 ( 4.367 1.176 6.056) 7.559 13.877 ( -3.758 5.946 1.589) 7.211 14.064 ( 2.744 0.409 -2.936) 4.039 14.436 ( 8.823 -0.822 -2.031) 9.091 14.736 ( 8.497 -2.170 6.956) 11.193 14.960 ( -1.741 -5.866 5.219) 8.043 15.339 ( -8.800 -2.240 4.679) 10.215 15.555 ( -17.085 0.490 -1.978) 17.206 16.579 ( -0.703 -0.370 -5.577) 5.633 16.798 ( -9.124 12.070 -0.386) 15.136 17.121 ( 0.062 4.580 -4.066) 6.125 17.507 ( -0.047 1.489 -3.657) 3.949 17.740 ( 6.549 3.898 -2.484) 8.016 18.091 ( 3.677 -3.404 -2.627) 5.657 18.988 ( 6.992 -9.283 -4.422) 12.434 20.262 ( -4.521 -3.533 9.508) 11.105 21.035 ( 7.425 -7.277 -6.863) 12.458 21.530 ( -2.228 -0.394 4.890) 5.388 21.634 ( -2.829 0.294 -0.308) 2.861 25.063 ( -2.148 -1.943 2.780) 4.014 25.412 ( -0.570 0.798 -3.063) 3.216 28.984 ( 0.074 -1.714 2.453) 2.993 29.073 ( 0.677 -1.580 -0.703) 1.857 34.238 ( -10.155 0.032 -0.490) 10.167 35.455 ( 16.255 13.841 1.676) 21.416 37.652 ( -3.724 1.105 2.834) 4.808 38.134 ( 4.416 5.474 0.701) 7.068 40.658 ( -8.054 7.883 -7.328) 13.443 41.277 ( 0.457 -1.735 8.248) 8.441 41.535 ( 0.724 1.588 5.527) 5.796 42.580 ( -1.676 -6.561 -27.701) 28.517 ======================= Grid point 298 (154/205) ======================= q-point: (-0.11 -0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.984 ( -24.175 -28.427 -5.308) 37.693 3.390 ( 2.985 -24.999 20.529) 32.486 3.779 ( 10.206 5.907 6.783) 13.604 4.428 ( 7.529 -5.242 -5.045) 10.469 4.440 ( 9.011 6.968 6.881) 13.308 4.650 ( 20.391 12.922 11.272) 26.642 5.311 ( -25.290 2.143 4.084) 25.707 5.542 ( -24.986 4.424 15.367) 29.665 5.678 ( 0.949 2.532 -5.627) 6.243 6.129 ( -19.449 0.043 3.024) 19.683 6.407 ( 15.689 -1.888 -7.353) 17.429 6.519 ( -12.485 -4.193 -9.702) 16.358 7.005 ( -7.417 -0.502 -5.118) 9.025 7.153 ( 3.669 7.574 -10.903) 13.774 7.345 ( -0.852 0.304 5.864) 5.933 7.414 ( 8.675 6.833 8.499) 13.935 7.735 ( 7.248 -6.884 -9.860) 14.041 8.101 ( 6.613 8.968 4.130) 11.883 8.431 ( 4.052 3.968 -1.591) 5.890 8.661 ( 4.884 8.080 -11.083) 14.560 9.107 ( -3.865 -1.228 4.824) 6.302 9.242 ( -0.071 4.969 -7.894) 9.327 9.417 ( 3.290 -7.533 -3.536) 8.949 9.536 ( 3.170 -6.957 -4.996) 9.133 10.309 ( -0.321 2.995 -0.459) 3.047 10.486 ( 2.350 -2.585 11.972) 12.471 10.635 ( 4.799 7.645 -1.537) 9.156 10.909 ( -5.718 0.463 1.536) 5.939 11.345 ( 2.248 -2.867 -5.149) 6.308 11.380 ( 1.635 1.606 5.242) 5.721 11.764 ( -4.181 -4.780 -1.684) 6.570 11.876 ( 5.584 -1.186 5.425) 7.876 12.444 ( -3.347 -0.091 -5.716) 6.624 13.185 ( -3.445 -0.006 1.493) 3.755 13.587 ( -2.999 -2.654 3.076) 5.050 13.678 ( 4.537 0.965 6.574) 8.046 13.777 ( 0.606 0.500 6.682) 6.728 14.114 ( 8.629 2.397 3.324) 9.552 14.565 ( 8.750 -2.090 -4.524) 10.070 14.846 ( 0.888 0.097 9.469) 9.511 14.967 ( -9.715 0.786 -1.909) 9.932 15.332 ( -17.468 -0.571 -1.789) 17.569 15.412 ( 5.466 -9.843 6.574) 13.038 16.353 ( -16.448 10.348 -0.881) 19.452 16.656 ( 1.237 0.838 -4.016) 4.285 17.032 ( -0.880 4.353 -2.349) 5.024 17.503 ( 5.356 0.538 -7.683) 9.381 17.744 ( 7.539 4.371 -4.640) 9.873 18.173 ( 5.480 -1.300 -2.178) 6.038 19.142 ( -0.482 -5.954 -2.136) 6.344 20.324 ( -2.847 -4.360 10.277) 11.521 21.244 ( 10.072 -8.031 -5.140) 13.870 21.521 ( -2.725 0.289 3.658) 4.571 21.603 ( -1.766 -0.579 -1.374) 2.311 25.089 ( -0.500 -2.369 1.186) 2.697 25.372 ( -1.452 1.466 -1.748) 2.704 29.005 ( -0.294 -0.392 1.066) 1.173 29.115 ( -0.024 -2.582 1.408) 2.941 34.158 ( -4.985 -1.637 -0.592) 5.280 35.337 ( 5.715 17.599 3.197) 18.778 37.628 ( -0.552 0.041 2.411) 2.474 38.073 ( 1.599 6.366 -0.104) 6.565 40.449 ( -5.085 5.446 -3.495) 8.230 41.279 ( -10.108 2.639 13.633) 17.175 41.484 ( 2.411 0.416 -12.145) 12.389 42.662 ( 5.160 -10.936 -18.491) 22.094 ======================= Grid point 305 (155/205) ======================= q-point: (-0.33 -0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.424 ( -34.827 -0.000 20.660) 40.494 2.543 ( -39.057 -0.000 -12.558) 41.026 3.978 ( 12.582 0.000 10.376) 16.309 4.121 ( 20.707 0.000 -4.058) 21.101 4.602 ( -0.190 -0.000 10.450) 10.452 4.824 ( 5.653 0.000 17.106) 18.016 5.333 ( -4.726 -0.000 18.040) 18.649 5.780 ( 3.608 0.000 -16.959) 17.338 5.816 ( 18.849 0.000 -4.941) 19.485 6.106 ( -19.237 -0.000 4.387) 19.731 6.516 ( 0.067 0.000 -0.436) 0.441 6.615 ( 5.714 0.000 -2.749) 6.341 6.859 ( -24.962 -0.000 -5.623) 25.587 7.208 ( 1.294 0.000 -5.156) 5.316 7.463 ( 15.613 0.000 -2.952) 15.890 7.627 ( -3.974 -0.000 -7.306) 8.317 7.842 ( -2.088 -0.000 7.082) 7.383 8.348 ( 4.423 0.000 -1.867) 4.801 8.576 ( 3.233 0.000 -1.353) 3.505 8.661 ( -0.457 -0.000 1.545) 1.611 9.070 ( -2.822 -0.000 -8.418) 8.879 9.175 ( -1.691 -0.000 5.358) 5.619 9.361 ( -5.310 -0.000 -5.078) 7.347 9.448 ( -0.636 -0.000 -0.690) 0.938 10.210 ( 6.581 0.000 14.191) 15.643 10.432 ( 2.444 0.000 -2.771) 3.694 10.722 ( -6.223 -0.000 1.662) 6.441 11.060 ( 10.539 0.000 3.288) 11.040 11.095 ( 9.870 0.000 -2.003) 10.071 11.323 ( 7.220 0.000 -4.944) 8.750 11.703 ( -1.637 -0.000 0.386) 1.682 11.978 ( -18.354 -0.000 1.376) 18.406 12.410 ( 0.323 0.000 -11.154) 11.159 13.207 ( -2.521 -0.000 7.182) 7.612 13.468 ( 7.262 0.000 12.596) 14.539 13.584 ( 1.493 0.000 3.245) 3.572 13.996 ( 5.333 0.000 -12.595) 13.677 14.054 ( -3.102 -0.000 6.961) 7.621 14.446 ( 7.231 0.000 -0.929) 7.290 14.683 ( 7.048 0.000 5.841) 9.154 14.836 ( -2.725 -0.000 7.916) 8.372 15.297 ( -11.014 -0.000 5.660) 12.383 15.589 ( -11.659 -0.000 -3.421) 12.151 16.562 ( -0.348 -0.000 -7.482) 7.490 17.042 ( -8.982 -0.000 4.792) 10.180 17.172 ( -2.999 -0.000 -6.600) 7.250 17.566 ( 0.937 0.000 -2.398) 2.574 17.823 ( 5.332 0.000 -4.234) 6.809 18.011 ( 8.162 0.000 -2.309) 8.483 18.800 ( 7.512 0.000 -5.069) 9.062 20.203 ( -4.504 -0.000 8.584) 9.694 20.895 ( 4.917 0.000 -7.639) 9.085 21.521 ( -2.667 -0.000 6.280) 6.823 21.640 ( -3.242 -0.000 0.286) 3.255 25.028 ( -2.502 -0.000 3.696) 4.463 25.423 ( -0.354 -0.000 -3.576) 3.593 28.947 ( 0.448 0.000 3.548) 3.576 29.049 ( 0.666 0.000 -2.624) 2.707 34.237 ( -12.229 -0.000 -0.891) 12.261 35.709 ( 24.721 0.000 -0.171) 24.721 37.675 ( -5.033 -0.000 3.026) 5.873 38.238 ( 6.434 0.000 1.876) 6.702 40.834 ( -8.776 -0.000 -17.696) 19.753 41.221 ( 1.352 0.000 5.230) 5.402 41.564 ( 5.591 0.000 24.934) 25.553 42.446 ( -11.955 -0.000 -36.995) 38.879 ======================= Grid point 306 (156/205) ======================= q-point: (-0.22 -0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.179 ( -37.770 -16.089 -4.764) 41.330 2.375 ( -22.346 -27.608 28.475) 45.523 4.046 ( 8.144 8.748 8.057) 14.414 4.335 ( 15.153 -1.434 -5.076) 16.045 4.647 ( 1.921 0.938 3.723) 4.293 4.935 ( 10.458 5.499 17.150) 20.826 5.347 ( -11.053 0.114 17.603) 20.786 5.672 ( 8.490 6.821 -10.997) 15.477 5.746 ( -37.477 1.744 9.246) 38.640 6.109 ( 10.531 -7.789 -4.413) 13.822 6.393 ( -21.868 3.103 -7.277) 23.255 6.539 ( 2.152 4.441 -3.565) 6.088 6.787 ( -4.041 -8.906 -7.778) 12.496 7.290 ( 11.991 -0.849 5.306) 13.140 7.503 ( 4.339 5.567 -11.509) 13.501 7.542 ( 5.358 5.227 -6.866) 10.158 7.802 ( -0.440 5.627 2.458) 6.157 8.329 ( 1.737 3.268 -5.925) 6.985 8.547 ( 0.302 4.549 3.890) 5.993 8.799 ( 5.778 -8.845 -3.698) 11.193 9.015 ( 1.279 4.741 -4.906) 6.941 9.197 ( -2.628 -4.095 1.851) 5.206 9.259 ( -0.172 1.022 -1.846) 2.117 9.480 ( 1.387 -1.501 -3.586) 4.128 10.402 ( 9.924 -0.169 13.102) 16.437 10.430 ( 4.760 1.142 1.374) 5.084 10.686 ( -4.050 -2.105 0.962) 4.665 11.115 ( 5.091 8.806 -0.733) 10.199 11.232 ( 10.756 -2.713 3.901) 11.759 11.407 ( 6.700 -1.094 -2.609) 7.273 11.669 ( -8.172 -2.585 -4.679) 9.765 11.847 ( -0.266 0.989 6.838) 6.914 12.375 ( -2.859 -3.062 -9.847) 10.701 13.173 ( -7.507 -0.319 6.971) 10.250 13.536 ( -9.038 -0.421 -0.501) 9.061 13.603 ( 5.648 -1.807 11.010) 12.505 13.949 ( -4.526 5.871 3.170) 8.062 14.128 ( 12.022 -1.885 -2.361) 12.396 14.539 ( 9.558 0.353 -2.141) 9.802 14.803 ( 4.586 -2.231 6.562) 8.310 14.893 ( 0.859 -3.832 6.491) 7.586 15.194 ( -11.028 -2.814 6.735) 13.225 15.408 ( -12.534 3.277 -4.764) 13.804 16.474 ( -11.841 -0.622 -5.666) 13.142 16.856 ( -9.941 8.837 1.547) 13.390 17.130 ( -0.841 0.598 -4.998) 5.103 17.564 ( 6.164 2.654 -5.470) 8.658 17.858 ( 6.467 1.513 -5.176) 8.420 18.132 ( 10.927 -0.971 -3.061) 11.389 18.901 ( 2.988 -6.467 -3.810) 8.079 20.222 ( -1.704 -1.750 12.238) 12.479 20.979 ( 6.315 -6.122 -6.463) 10.914 21.513 ( -3.159 -0.302 5.544) 6.388 21.606 ( -2.391 0.189 0.291) 2.416 25.026 ( -1.577 -1.200 2.825) 3.451 25.398 ( -1.210 0.315 -2.943) 3.197 28.972 ( -0.182 -1.040 3.076) 3.252 29.054 ( 0.533 -1.009 -1.902) 2.218 34.112 ( -8.758 -0.867 -1.183) 8.880 35.899 ( 21.892 12.679 -2.220) 25.396 37.632 ( -3.402 0.119 2.794) 4.404 38.269 ( 3.670 4.687 0.200) 5.956 40.628 ( -6.977 4.789 -13.998) 16.357 41.252 ( -3.747 -2.764 7.652) 8.957 41.640 ( -0.529 8.008 7.493) 10.980 42.246 ( -10.077 -13.188 -26.660) 31.404 ======================= Grid point 307 (157/205) ======================= q-point: (-0.11 -0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.155 ( -27.901 -30.943 0.666) 41.670 2.940 ( -1.186 -42.131 28.560) 50.913 4.021 ( 5.567 7.548 8.798) 12.860 4.409 ( -3.026 1.551 -5.745) 6.676 4.686 ( 11.236 3.761 4.001) 12.506 4.990 ( -10.438 5.388 6.132) 13.250 5.128 ( -18.039 2.965 25.416) 31.308 5.329 ( -22.615 5.013 6.488) 24.056 5.764 ( 8.976 1.786 -5.611) 10.735 5.910 ( -16.188 7.510 -6.954) 19.152 6.298 ( -6.604 -4.371 -9.771) 12.577 6.533 ( 9.130 -0.355 -5.313) 10.569 6.824 ( -4.804 -6.097 -4.861) 9.159 7.339 ( 6.622 12.596 -16.928) 22.115 7.421 ( 2.277 5.549 3.855) 7.130 7.638 ( 15.051 -2.480 7.756) 17.113 7.736 ( 4.544 1.387 -4.940) 6.854 8.271 ( 1.107 2.851 -6.550) 7.229 8.487 ( -2.731 2.533 1.486) 4.010 8.847 ( 8.131 11.220 -6.685) 15.385 8.990 ( -5.069 -5.628 4.802) 8.969 9.255 ( 0.817 -4.587 -4.538) 6.504 9.326 ( 1.252 -2.849 -0.798) 3.212 9.483 ( 3.904 -1.108 -7.531) 8.554 10.374 ( 2.071 4.069 -3.239) 5.598 10.612 ( 5.327 3.855 14.419) 15.848 10.693 ( -1.062 -2.770 -0.167) 2.971 11.027 ( 12.570 9.723 2.003) 16.017 11.340 ( 1.706 2.493 -5.322) 6.120 11.486 ( 8.766 0.769 8.027) 11.911 11.647 ( -0.893 -5.727 -0.080) 5.797 11.951 ( 7.964 -2.067 4.566) 9.410 12.362 ( -2.857 -2.914 -6.753) 7.891 13.108 ( -9.762 -1.445 4.991) 11.059 13.432 ( -11.505 -3.573 -1.894) 12.195 13.748 ( 3.787 -2.220 8.401) 9.478 13.798 ( -6.469 3.322 4.063) 8.330 14.278 ( 9.120 0.712 4.423) 10.161 14.607 ( 1.525 1.263 -3.885) 4.361 14.861 ( -3.354 -0.863 9.622) 10.226 14.921 ( -1.284 3.540 1.407) 4.020 15.165 ( -9.086 0.721 -4.998) 10.395 15.337 ( 5.656 -11.310 6.074) 14.029 16.231 ( -20.715 3.474 -2.693) 21.176 16.655 ( -5.109 3.100 -2.148) 6.350 17.061 ( -2.742 4.254 -1.133) 5.187 17.598 ( 11.248 2.739 -9.705) 15.106 17.881 ( 6.767 2.901 -6.186) 9.616 18.263 ( 12.423 0.168 -2.887) 12.756 19.007 ( -3.352 -7.080 -1.198) 7.925 20.301 ( 0.664 -2.082 12.693) 12.880 21.183 ( 8.639 -10.584 -5.557) 14.749 21.498 ( -3.659 -0.275 4.272) 5.632 21.579 ( -1.473 0.338 -0.472) 1.583 25.053 ( -0.054 -2.348 1.665) 2.879 25.363 ( -1.651 0.667 -1.992) 2.672 28.994 ( -0.537 -1.084 1.769) 2.143 29.079 ( -0.073 -2.090 0.042) 2.091 34.062 ( -3.813 -2.899 -0.941) 4.882 35.748 ( 5.263 25.255 -2.230) 25.894 37.626 ( -0.100 -0.951 1.877) 2.106 38.178 ( -1.688 6.810 -2.242) 7.366 40.461 ( -1.551 3.534 -6.564) 7.615 41.241 ( -11.889 2.218 10.645) 16.112 41.447 ( -3.404 1.356 -11.231) 11.814 42.399 ( 0.419 -17.866 -13.279) 22.264 ======================= Grid point 315 (158/205) ======================= q-point: (-0.22 -0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.711 ( -24.805 -0.000 15.726) 29.370 1.927 ( -23.496 -0.000 37.369) 44.142 4.200 ( 1.287 0.000 4.878) 5.045 4.409 ( 2.141 0.000 -2.566) 3.342 4.715 ( 7.562 0.000 1.957) 7.812 5.125 ( -13.777 -0.000 25.260) 28.773 5.232 ( -36.618 -0.000 6.893) 37.261 5.325 ( -7.123 -0.000 13.005) 14.828 5.752 ( 3.601 0.000 -13.911) 14.370 6.151 ( 7.390 0.000 -2.810) 7.906 6.275 ( -2.914 -0.000 -13.048) 13.369 6.472 ( -8.382 -0.000 -7.267) 11.093 6.702 ( 4.653 0.000 -4.131) 6.222 7.523 ( 18.107 0.000 13.285) 22.458 7.571 ( 8.754 0.000 -16.882) 19.017 7.582 ( 0.420 0.000 -3.090) 3.118 7.828 ( -1.672 -0.000 -6.882) 7.082 8.267 ( -6.353 -0.000 -14.853) 16.155 8.521 ( -8.611 -0.000 0.306) 8.616 8.832 ( 7.481 0.000 10.107) 12.575 9.108 ( -2.630 -0.000 -3.596) 4.455 9.177 ( 11.487 0.000 -1.292) 11.560 9.278 ( 4.573 0.000 -3.078) 5.512 9.460 ( 0.749 0.000 -1.708) 1.865 10.460 ( 3.158 0.000 -4.727) 5.685 10.582 ( 1.531 0.000 5.799) 5.997 10.694 ( 8.882 0.000 14.755) 17.222 11.336 ( 13.800 0.000 6.517) 15.262 11.348 ( 10.056 0.000 4.169) 10.886 11.461 ( 8.079 0.000 -4.476) 9.236 11.550 ( -3.155 -0.000 -3.211) 4.501 11.904 ( 5.457 0.000 4.627) 7.155 12.257 ( -4.745 -0.000 -9.839) 10.923 13.078 ( -13.318 -0.000 9.296) 16.241 13.398 ( -11.102 -0.000 -2.637) 11.411 13.684 ( 3.630 0.000 10.924) 11.511 13.904 ( -11.863 -0.000 2.453) 12.114 14.272 ( 13.334 0.000 -1.746) 13.448 14.633 ( 6.225 0.000 -0.070) 6.226 14.817 ( -3.631 -0.000 7.702) 8.515 14.937 ( 6.494 0.000 5.349) 8.413 15.093 ( -3.362 -0.000 3.906) 5.154 15.284 ( -9.825 -0.000 -6.336) 11.691 16.253 ( -20.093 -0.000 -6.024) 20.977 16.821 ( -13.302 -0.000 8.470) 15.770 17.106 ( 2.117 0.000 -12.021) 12.206 17.652 ( 7.993 0.000 -4.556) 9.200 17.909 ( 6.258 0.000 -7.834) 10.027 18.271 ( 14.146 0.000 -2.633) 14.389 18.843 ( -1.376 -0.000 -2.427) 2.790 20.272 ( 2.914 0.000 15.671) 15.939 20.969 ( 5.825 0.000 -5.714) 8.160 21.490 ( -3.926 -0.000 5.206) 6.520 21.586 ( -1.524 -0.000 0.388) 1.572 25.012 ( -0.896 -0.000 2.579) 2.730 25.372 ( -1.687 -0.000 -2.701) 3.185 28.971 ( -0.908 -0.000 3.345) 3.466 29.042 ( 0.405 0.000 -2.450) 2.484 34.013 ( -5.376 -0.000 -1.253) 5.521 36.273 ( 22.943 0.000 -10.926) 25.412 37.601 ( -3.273 -0.000 2.993) 4.436 38.331 ( -0.518 -0.000 -4.953) 4.980 40.540 ( -3.903 -0.000 -14.317) 14.840 41.184 ( -7.312 -0.000 6.682) 9.905 41.722 ( -23.911 -0.000 -29.414) 37.907 41.855 ( 3.413 0.000 16.157) 16.513 ======================= Grid point 316 (159/205) ======================= q-point: (-0.11 -0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.580 ( -14.115 -7.726 27.813) 32.133 2.357 ( -1.475 -43.034 38.690) 57.888 4.150 ( -12.524 0.826 12.512) 17.722 4.327 ( -14.341 4.957 3.407) 15.551 4.647 ( -42.391 -0.040 18.692) 46.329 4.830 ( 10.260 -1.665 -3.305) 10.907 5.094 ( -5.342 10.572 3.245) 12.281 5.365 ( 2.319 -1.625 -2.450) 3.745 5.756 ( -0.153 -5.457 -6.342) 8.368 6.022 ( -2.077 13.858 -7.885) 16.079 6.188 ( 0.915 3.427 -4.079) 5.406 6.520 ( 3.015 -6.660 -5.464) 9.127 6.755 ( 4.653 -1.301 -1.908) 5.195 7.498 ( 1.258 6.785 -11.518) 13.427 7.552 ( 4.807 3.257 -5.852) 8.243 7.727 ( -2.122 1.333 -10.536) 10.830 7.866 ( 20.892 -0.310 11.785) 23.989 8.139 ( -9.559 -3.747 -14.447) 17.724 8.458 ( -3.718 -1.498 -0.431) 4.032 8.881 ( -8.929 -3.621 9.950) 13.851 9.133 ( 3.779 5.741 -0.311) 6.880 9.187 ( 11.825 4.461 -7.254) 14.572 9.355 ( 3.804 -0.010 3.144) 4.935 9.486 ( 2.377 -1.304 -6.719) 7.245 10.457 ( 4.529 3.293 -3.314) 6.507 10.615 ( -1.347 -3.675 0.568) 3.955 10.771 ( -2.041 4.862 12.570) 13.631 11.403 ( 13.449 6.434 3.664) 15.352 11.432 ( 7.757 8.319 -7.551) 13.652 11.564 ( 2.396 -4.741 1.423) 5.499 11.724 ( 27.895 1.169 10.921) 29.980 12.034 ( 10.408 -2.718 3.643) 11.358 12.229 ( -2.057 -6.149 -7.350) 9.801 12.944 ( -17.042 -2.073 7.635) 18.789 13.258 ( -11.253 0.371 -1.050) 11.308 13.729 ( -13.789 2.072 -0.459) 13.951 13.786 ( 2.917 -2.409 10.235) 10.912 14.345 ( -2.984 0.813 3.620) 4.761 14.641 ( -0.221 4.749 -1.118) 4.884 14.861 ( 5.003 -3.883 6.555) 9.115 15.022 ( 1.400 5.256 0.360) 5.451 15.066 ( -2.774 -1.600 -5.772) 6.601 15.250 ( 3.613 -7.913 3.980) 9.566 15.978 ( -21.981 -1.117 -3.802) 22.335 16.632 ( -11.427 5.750 5.976) 14.119 17.076 ( -0.688 0.912 -7.893) 7.975 17.731 ( 10.358 0.795 -6.890) 12.466 17.945 ( 5.207 1.053 -7.146) 8.904 18.425 ( 14.746 0.503 -3.007) 15.058 18.846 ( -5.854 -5.422 0.424) 7.991 20.390 ( 6.677 1.096 14.965) 16.423 21.093 ( 6.841 -8.607 -4.906) 12.040 21.462 ( -4.212 -0.307 4.027) 5.835 21.570 ( -0.874 0.293 -0.279) 0.963 25.029 ( 0.128 -1.610 2.055) 2.614 25.339 ( -1.903 0.088 -2.250) 2.948 28.975 ( -1.471 -0.870 2.734) 3.225 29.049 ( 0.361 -1.404 -1.666) 2.208 33.990 ( -0.370 -2.079 -0.564) 2.185 36.181 ( 0.547 25.511 -16.980) 30.651 37.603 ( -0.749 -2.471 1.915) 3.215 38.186 ( -10.583 4.265 -9.584) 14.901 40.486 ( 5.437 0.862 -5.553) 7.819 41.135 ( -12.519 -1.092 5.296) 13.637 41.345 ( -10.014 0.722 -9.635) 13.916 42.074 ( -1.370 -15.879 2.341) 16.109 ======================= Grid point 325 (160/205) ======================= q-point: (-0.11 -0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.909 ( 17.220 0.000 49.151) 52.080 1.971 ( -1.332 -0.000 45.102) 45.122 3.741 ( -57.123 -0.000 36.663) 67.877 4.285 ( -10.701 -0.000 5.592) 12.074 4.445 ( -4.562 -0.000 2.371) 5.142 4.901 ( 11.567 0.000 -14.663) 18.676 5.197 ( -3.134 -0.000 -16.239) 16.539 5.307 ( 1.596 0.000 5.124) 5.367 5.622 ( -5.487 -0.000 -8.515) 10.130 6.022 ( -3.794 -0.000 -4.612) 5.972 6.410 ( 4.329 0.000 -0.709) 4.387 6.430 ( 8.183 0.000 1.207) 8.272 6.791 ( 3.536 0.000 -4.349) 5.605 7.424 ( -7.409 -0.000 -24.809) 25.891 7.591 ( 2.093 0.000 7.020) 7.326 7.693 ( -1.152 -0.000 -14.608) 14.654 7.947 ( -6.978 -0.000 -10.233) 12.386 8.177 ( 19.630 0.000 11.792) 22.899 8.402 ( 0.423 0.000 -3.600) 3.625 8.736 ( -12.593 -0.000 5.538) 13.757 9.202 ( 5.443 0.000 1.810) 5.736 9.371 ( -4.782 -0.000 -6.807) 8.319 9.414 ( 5.412 0.000 2.557) 5.986 9.484 ( 9.670 0.000 -1.329) 9.761 10.549 ( 6.613 0.000 -2.033) 6.919 10.569 ( -0.821 -0.000 1.110) 1.381 10.810 ( -5.141 -0.000 12.359) 13.386 11.501 ( 2.073 0.000 0.941) 2.276 11.558 ( 9.579 0.000 -6.721) 11.702 11.661 ( 7.429 0.000 4.079) 8.475 12.085 ( 15.316 0.000 -8.509) 17.521 12.096 ( -2.289 -0.000 -7.257) 7.609 12.354 ( 45.602 0.000 14.302) 47.792 12.736 ( -18.767 -0.000 7.214) 20.106 13.151 ( -9.985 -0.000 2.396) 10.269 13.536 ( -19.240 -0.000 -3.404) 19.539 13.839 ( 2.680 0.000 9.861) 10.218 14.279 ( -11.216 -0.000 4.731) 12.173 14.704 ( 0.016 0.000 -4.049) 4.049 14.894 ( 4.234 0.000 -8.971) 9.920 14.992 ( 1.531 0.000 2.854) 3.238 15.090 ( 0.079 0.000 3.388) 3.389 15.254 ( 4.487 0.000 2.281) 5.034 15.698 ( -18.122 -0.000 -0.168) 18.123 16.580 ( -13.332 -0.000 12.040) 17.964 17.017 ( -0.884 -0.000 -11.989) 12.022 17.813 ( 6.830 0.000 -2.799) 7.382 17.997 ( 5.031 0.000 -6.335) 8.090 18.583 ( 13.395 0.000 -3.418) 13.825 18.725 ( -7.616 -0.000 2.536) 8.027 20.589 ( 13.376 0.000 12.933) 18.606 21.070 ( 5.275 0.000 -3.622) 6.399 21.425 ( -3.800 -0.000 2.980) 4.829 21.557 ( -1.521 -0.000 -0.737) 1.690 25.026 ( 0.398 0.000 2.228) 2.263 25.305 ( -2.156 -0.000 -2.411) 3.234 28.956 ( -2.250 -0.000 2.855) 3.635 29.036 ( 0.890 0.000 -2.159) 2.336 33.998 ( 4.894 0.000 0.888) 4.974 36.186 ( -28.017 -0.000 -35.174) 44.969 37.561 ( -2.380 -0.000 3.381) 4.135 37.990 ( -15.709 -0.000 -10.043) 18.645 40.614 ( 17.102 0.000 -2.416) 17.272 41.004 ( -11.431 -0.000 4.373) 12.239 41.229 ( 0.539 0.000 0.677) 0.865 41.943 ( -4.412 -0.000 8.398) 9.487 ======================= Grid point 326 (161/205) ======================= q-point: ( 0.00 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.303 ( 10.373 0.000 42.087) 43.346 3.562 ( -14.754 -0.000 42.314) 44.812 3.928 ( 1.571 0.000 0.393) 1.620 4.248 ( -0.294 -0.000 4.039) 4.050 4.327 ( -1.154 -0.000 10.921) 10.981 4.348 ( 1.251 0.000 -33.186) 33.210 4.440 ( 10.259 0.000 -9.585) 14.040 4.999 ( -1.154 -0.000 -35.789) 35.807 5.729 ( 6.199 0.000 11.735) 13.271 5.888 ( -3.985 -0.000 -5.121) 6.489 6.507 ( -6.001 -0.000 4.210) 7.331 6.619 ( -3.400 -0.000 -4.821) 5.900 6.674 ( 2.619 0.000 4.466) 5.177 6.814 ( 1.065 0.000 -4.451) 4.576 7.383 ( 1.902 0.000 -0.732) 2.038 7.518 ( -6.877 -0.000 -12.857) 14.581 8.088 ( 10.204 0.000 11.973) 15.732 8.244 ( -6.513 -0.000 -4.128) 7.711 8.546 ( -5.802 -0.000 -0.168) 5.804 8.579 ( 4.487 0.000 -3.522) 5.705 9.262 ( 3.152 0.000 4.921) 5.844 9.294 ( -6.285 -0.000 1.289) 6.416 9.511 ( 0.056 0.000 -0.561) 0.563 9.542 ( 2.537 0.000 -3.410) 4.250 10.604 ( -0.617 -0.000 1.776) 1.880 10.639 ( 1.821 0.000 -1.689) 2.484 11.113 ( -2.495 -0.000 15.578) 15.776 11.418 ( 4.250 0.000 -15.969) 16.525 11.683 ( 5.284 0.000 4.004) 6.629 11.755 ( -3.433 -0.000 -3.329) 4.782 11.984 ( -6.124 -0.000 4.929) 7.861 12.105 ( 3.227 0.000 -7.463) 8.131 12.760 ( 11.521 0.000 7.786) 13.905 12.855 ( -17.527 -0.000 -2.859) 17.758 13.022 ( -15.098 -0.000 6.402) 16.399 13.208 ( 23.907 0.000 -12.243) 26.860 14.209 ( 1.718 0.000 14.532) 14.633 14.231 ( -4.686 -0.000 8.187) 9.433 14.386 ( -0.150 -0.000 -7.692) 7.693 14.486 ( -2.695 -0.000 -13.987) 14.244 15.188 ( -3.631 -0.000 3.430) 4.995 15.238 ( 6.338 0.000 -1.957) 6.633 15.471 ( 6.915 0.000 3.922) 7.950 15.517 ( -6.283 -0.000 -0.799) 6.334 16.648 ( -8.983 -0.000 11.455) 14.557 16.844 ( 8.599 0.000 -8.738) 12.260 17.889 ( 1.415 0.000 0.733) 1.594 17.920 ( -2.260 -0.000 -2.656) 3.487 18.651 ( -8.434 -0.000 4.594) 9.604 18.739 ( 8.566 0.000 -4.436) 9.647 21.014 ( 4.147 0.000 2.250) 4.718 21.061 ( -1.383 -0.000 -2.695) 3.029 21.432 ( 0.664 0.000 1.750) 1.871 21.467 ( -0.122 -0.000 -1.883) 1.887 25.120 ( 1.316 0.000 3.212) 3.471 25.181 ( -1.631 -0.000 -3.177) 3.571 28.970 ( -2.368 -0.000 2.532) 3.467 29.017 ( 2.475 0.000 -2.342) 3.408 34.429 ( 22.982 0.000 8.805) 24.611 34.602 ( -34.302 -0.000 -9.148) 35.500 37.622 ( -0.916 -0.000 4.397) 4.492 37.705 ( -0.352 -0.000 -4.261) 4.275 40.769 ( -14.395 -0.000 2.608) 14.629 40.827 ( 12.923 0.000 -3.467) 13.380 41.809 ( -18.401 -0.000 1.478) 18.460 41.844 ( 28.606 0.000 -2.103) 28.683 ======================= Grid point 327 (162/205) ======================= q-point: ( 0.11 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.400 ( -2.737 10.303 40.144) 41.536 3.603 ( -7.942 11.055 -25.218) 28.657 3.632 ( 3.413 6.026 22.434) 23.478 4.109 ( -16.123 -2.044 3.215) 16.567 4.374 ( 18.466 1.239 -13.087) 22.667 4.490 ( 10.620 -3.308 -12.696) 16.879 4.862 ( 20.796 -19.881 25.917) 38.723 5.149 ( 14.380 -19.338 -35.674) 43.051 5.766 ( -7.579 4.043 -8.498) 12.083 5.832 ( 6.685 1.376 9.278) 11.518 6.473 ( -5.884 -1.206 13.787) 15.038 6.622 ( -3.351 -6.414 -4.315) 8.425 6.750 ( 1.936 -0.713 0.705) 2.180 6.757 ( -1.153 2.501 -4.312) 5.117 7.292 ( -10.014 4.441 -3.032) 11.367 7.399 ( -1.228 1.344 1.275) 2.223 8.096 ( -9.233 3.548 -6.483) 11.827 8.225 ( 7.034 1.731 7.620) 10.514 8.532 ( -2.046 -4.337 -0.091) 4.796 8.678 ( 5.188 -4.533 -0.980) 6.959 9.146 ( -6.695 7.911 -0.001) 10.364 9.224 ( -1.066 9.911 5.372) 11.324 9.469 ( -2.041 3.012 -1.194) 3.830 9.539 ( 1.515 0.296 -3.221) 3.571 10.570 ( -4.522 2.423 -0.393) 5.145 10.639 ( 0.919 0.191 -0.672) 1.155 11.104 ( -3.506 3.816 12.409) 13.448 11.340 ( 1.997 5.125 -14.478) 15.487 11.688 ( -6.000 0.284 -3.568) 6.986 11.751 ( 0.206 -0.235 3.094) 3.110 11.936 ( -10.481 -1.780 4.959) 11.731 12.085 ( -9.037 -5.718 -1.781) 10.841 12.605 ( -3.291 9.121 0.814) 9.731 12.895 ( -0.441 -3.128 2.658) 4.129 13.030 ( 15.477 1.454 0.532) 15.554 13.342 ( 13.060 4.445 -8.994) 16.469 14.142 ( -3.326 6.426 9.822) 12.199 14.323 ( 0.273 1.352 1.634) 2.139 14.387 ( 5.667 -4.333 6.010) 9.328 14.463 ( -1.006 -4.038 -8.708) 9.651 15.228 ( -3.682 -8.586 0.261) 9.346 15.358 ( 0.727 -9.540 -3.490) 10.184 15.417 ( -5.735 1.720 -0.295) 5.995 15.597 ( 11.920 -0.764 0.444) 11.953 16.591 ( -5.884 1.702 8.259) 10.283 16.878 ( 9.358 5.162 -6.154) 12.332 17.796 ( -7.037 5.940 0.370) 9.216 17.890 ( -0.899 1.212 -1.291) 1.986 18.575 ( -10.720 -1.446 4.333) 11.652 18.858 ( 6.781 -5.606 -4.403) 9.838 20.967 ( -7.357 3.484 -2.230) 8.440 21.056 ( 1.162 -1.889 0.447) 2.262 21.460 ( 1.516 -0.103 0.320) 1.553 21.511 ( 5.824 -1.705 -2.148) 6.437 25.155 ( -0.565 -0.929 0.177) 1.102 25.171 ( 0.638 -1.984 0.146) 2.089 28.967 ( -1.956 -1.333 2.442) 3.401 29.056 ( 2.985 -1.886 -2.449) 4.297 34.244 ( -21.536 -0.680 -2.115) 21.650 34.752 ( 24.652 2.118 13.748) 28.306 37.641 ( -0.168 -0.581 4.654) 4.693 37.699 ( 0.791 -1.155 -2.968) 3.282 40.605 ( -14.460 0.351 3.467) 14.874 40.976 ( 12.914 -1.253 -2.864) 13.288 41.603 ( -17.473 -1.438 -1.753) 17.620 42.173 ( 26.577 -1.782 -9.763) 28.369 ======================= Grid point 328 (163/205) ======================= q-point: ( 0.22 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.111 ( -7.393 6.984 -35.036) 36.483 3.445 ( 3.452 1.988 32.379) 32.623 3.881 ( 11.529 1.718 16.107) 19.882 4.017 ( 2.500 2.639 12.321) 12.846 4.526 ( 12.986 1.101 9.252) 15.982 4.717 ( 20.210 -11.866 -27.697) 36.282 5.380 ( -8.096 -0.021 -14.743) 16.819 5.406 ( 8.316 -12.315 15.646) 21.577 5.637 ( 7.141 -9.594 -22.915) 25.848 5.923 ( 9.793 2.366 5.033) 11.262 6.356 ( -15.297 8.730 3.880) 18.035 6.617 ( -5.194 -3.550 -12.773) 14.239 6.686 ( -3.703 -5.478 8.906) 11.092 6.893 ( 5.052 -4.548 5.244) 8.586 7.184 ( -4.700 -3.451 -1.057) 5.926 7.440 ( 5.010 -2.775 13.670) 14.821 7.886 ( -11.115 3.348 -6.914) 13.512 8.233 ( -1.448 5.185 2.271) 5.843 8.583 ( -1.529 -2.540 -4.107) 5.065 8.725 ( 2.358 10.276 6.637) 12.459 8.960 ( -4.093 7.242 3.452) 9.006 9.060 ( 4.723 5.744 -1.977) 7.695 9.391 ( -4.742 0.182 -0.767) 4.807 9.545 ( 1.933 0.177 -3.952) 4.403 10.426 ( -7.826 4.459 -1.748) 9.176 10.646 ( 0.364 0.610 1.398) 1.568 11.002 ( -5.350 6.355 3.614) 9.060 11.222 ( 1.957 6.558 -8.885) 11.216 11.587 ( -10.139 0.383 3.459) 10.720 11.655 ( -13.213 2.589 -0.108) 13.464 11.814 ( -10.348 0.231 4.006) 11.099 12.117 ( 0.364 -3.024 1.691) 3.484 12.502 ( -5.151 0.059 -4.611) 6.914 13.006 ( 13.140 -2.346 -1.884) 13.481 13.148 ( 10.722 4.516 -1.198) 11.696 13.432 ( 13.501 -0.565 1.108) 13.558 14.043 ( -1.197 6.062 7.766) 9.924 14.292 ( 0.002 4.125 3.050) 5.130 14.483 ( 2.568 -2.062 -4.651) 5.699 14.586 ( 7.205 -5.171 5.213) 10.287 15.263 ( -7.914 1.477 -2.138) 8.330 15.335 ( -9.974 -12.276 -1.703) 15.909 15.574 ( 2.079 -12.063 -2.135) 12.426 15.765 ( 15.122 0.158 -2.975) 15.413 16.513 ( -2.847 2.937 3.095) 5.129 16.879 ( 7.368 5.302 0.070) 9.078 17.597 ( -8.140 6.815 0.405) 10.624 17.837 ( -1.624 2.759 -1.536) 3.551 18.463 ( -12.965 -0.072 3.455) 13.418 19.016 ( 4.688 -6.939 -3.901) 9.238 20.796 ( -8.404 3.960 -2.183) 9.543 21.130 ( 2.128 -4.259 1.332) 4.944 21.479 ( 1.651 0.132 0.331) 1.689 21.588 ( 5.451 -0.507 -3.723) 6.620 25.152 ( -1.208 -1.050 -1.635) 2.288 25.230 ( 0.841 -2.644 1.997) 3.419 28.979 ( -1.742 -1.736 2.199) 3.299 29.118 ( 2.679 -2.502 -2.193) 4.272 34.102 ( -8.884 -3.815 0.091) 9.669 35.001 ( 18.407 6.324 13.968) 23.957 37.658 ( -0.027 -0.010 2.345) 2.345 37.751 ( 2.946 -2.645 1.868) 4.377 40.458 ( -12.588 -0.567 3.593) 13.103 41.139 ( 12.877 -1.394 -5.128) 13.930 41.440 ( -15.346 -3.370 0.088) 15.712 42.429 ( 20.961 -0.822 -13.510) 24.951 ======================= Grid point 329 (164/205) ======================= q-point: ( 0.33 0.00 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.002 ( 2.158 -11.019 -22.733) 25.355 3.660 ( 9.973 -2.785 22.292) 24.579 3.889 ( 1.900 1.679 2.635) 3.656 4.271 ( 28.838 4.150 16.848) 33.656 4.687 ( 5.999 3.115 18.227) 19.440 5.031 ( -8.991 14.591 -6.640) 18.380 5.081 ( 10.449 -19.567 -25.049) 33.459 5.558 ( -4.221 -0.848 4.269) 6.063 5.623 ( -13.866 5.507 -12.010) 19.153 6.003 ( 8.246 3.218 3.137) 9.391 6.262 ( 5.746 -5.203 -4.321) 8.875 6.536 ( -13.144 -6.954 -14.004) 20.426 6.788 ( 4.485 -6.814 4.092) 9.127 6.987 ( -4.158 -3.830 -5.009) 7.553 7.243 ( 1.353 -3.859 12.857) 13.492 7.673 ( -9.725 -1.040 1.414) 9.882 7.753 ( 9.528 -7.740 11.386) 16.743 8.052 ( -5.656 9.399 -5.362) 12.210 8.442 ( -2.512 14.173 7.706) 16.326 8.519 ( -2.954 14.290 -3.083) 14.914 8.917 ( 1.973 -3.642 -1.815) 4.523 9.142 ( 7.904 0.047 1.691) 8.083 9.381 ( -2.426 -5.931 -2.408) 6.845 9.542 ( 0.934 0.325 -3.751) 3.879 10.290 ( -4.510 1.199 -1.272) 4.837 10.605 ( -2.736 5.377 3.354) 6.903 10.839 ( -4.289 5.585 -1.560) 7.213 11.114 ( 1.051 6.175 -3.032) 6.959 11.426 ( -14.032 2.258 -4.816) 15.006 11.476 ( -10.560 0.221 7.663) 13.049 11.784 ( -1.439 -2.995 3.321) 4.698 12.130 ( 0.883 4.490 0.071) 4.577 12.406 ( -5.499 -0.158 -6.309) 8.370 13.151 ( 9.697 3.121 -1.829) 10.349 13.281 ( 5.359 -10.914 3.615) 12.685 13.632 ( 15.163 -0.535 2.272) 15.342 13.999 ( 2.641 4.179 5.917) 7.711 14.222 ( -0.958 5.105 5.716) 7.723 14.528 ( 5.179 0.326 -3.850) 6.461 14.751 ( 6.167 -3.463 0.311) 7.080 15.130 ( -11.193 0.377 1.347) 11.280 15.355 ( -11.865 -7.481 -6.516) 15.466 15.737 ( 3.543 -4.410 -1.595) 5.877 15.900 ( 8.303 -1.030 -0.269) 8.371 16.519 ( 2.932 -2.941 0.883) 4.245 16.878 ( 3.051 3.253 2.054) 4.910 17.432 ( -3.025 4.212 -1.110) 5.303 17.753 ( -2.171 4.335 -1.713) 5.142 18.311 ( -11.797 1.289 2.110) 12.054 19.139 ( 1.876 -4.984 -2.577) 5.916 20.649 ( -5.977 2.830 -0.691) 6.649 21.234 ( 2.624 -4.106 1.132) 5.003 21.499 ( 0.964 -0.493 0.828) 1.363 21.621 ( 3.826 1.263 -4.119) 5.762 25.147 ( -0.790 -0.517 -1.109) 1.457 25.280 ( -0.008 -2.180 1.270) 2.523 28.995 ( -1.329 -1.500 1.690) 2.622 29.170 ( 1.544 -1.621 -1.314) 2.596 34.117 ( -1.722 -4.664 -0.047) 4.972 35.099 ( 9.405 7.021 9.622) 15.177 37.665 ( 0.200 0.148 1.210) 1.235 37.847 ( 3.580 -2.476 4.267) 6.095 40.363 ( -8.596 -1.739 2.817) 9.211 41.220 ( 1.948 0.340 -10.232) 10.422 41.398 ( -3.420 -4.892 7.145) 9.310 42.585 ( 14.299 0.708 -13.176) 19.457 ======================= Grid point 330 (165/205) ======================= q-point: ( 0.44 0.00 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.224 ( 4.055 -13.466 -7.642) 16.005 3.737 ( 1.362 5.909 -0.535) 6.088 4.109 ( 19.562 -6.147 13.644) 24.629 4.500 ( -15.246 10.665 6.888) 19.840 4.630 ( 26.641 1.386 12.106) 29.296 4.874 ( 6.101 8.887 7.334) 13.038 5.164 ( -23.689 -7.684 -11.128) 27.277 5.276 ( -10.371 4.944 -10.327) 15.449 5.691 ( 6.256 -9.601 2.211) 11.671 6.006 ( -2.621 3.751 2.713) 5.320 6.269 ( -0.723 0.404 -5.932) 5.990 6.503 ( -1.116 -2.232 -7.427) 7.835 6.907 ( -11.136 -1.724 0.309) 11.273 7.040 ( 13.397 -4.616 -11.583) 18.302 7.374 ( 0.043 -2.547 10.414) 10.721 7.531 ( -9.784 -2.135 3.961) 10.769 7.847 ( 2.174 8.267 1.658) 8.708 8.054 ( 8.279 -3.936 7.826) 12.053 8.265 ( -1.596 6.155 -1.952) 6.652 8.290 ( -2.102 3.371 -5.795) 7.026 8.989 ( 1.183 -2.815 -4.722) 5.623 9.200 ( 1.593 0.583 4.312) 4.634 9.456 ( 4.886 -0.071 -6.075) 7.796 9.546 ( -2.005 -3.729 0.378) 4.250 10.287 ( 0.500 -3.317 -0.842) 3.459 10.453 ( -2.722 7.537 -0.268) 8.019 10.748 ( -2.053 1.757 4.467) 5.220 11.034 ( 0.638 4.281 0.082) 4.329 11.238 ( -7.983 0.832 -7.553) 11.021 11.441 ( -2.710 -2.019 6.429) 7.263 11.865 ( 1.605 -4.881 2.359) 5.653 12.009 ( -0.669 8.524 -0.772) 8.585 12.348 ( -2.857 -0.628 -3.933) 4.902 13.189 ( 1.081 -0.070 0.794) 1.344 13.523 ( 3.153 -9.759 4.566) 11.226 13.751 ( 5.070 3.971 -1.328) 6.576 14.008 ( 4.099 1.852 3.508) 5.704 14.205 ( 4.147 1.610 8.061) 9.207 14.560 ( 5.604 2.065 -2.738) 6.570 14.776 ( -10.208 -2.611 -5.545) 11.907 15.053 ( 1.043 1.595 6.832) 7.093 15.259 ( -11.912 -2.475 -5.667) 13.422 15.797 ( 6.323 3.533 1.386) 7.375 15.998 ( -0.995 -5.159 0.324) 5.264 16.612 ( 1.943 -2.361 -0.512) 3.100 16.874 ( 1.656 0.206 -0.590) 1.770 17.404 ( 3.225 -0.344 -2.249) 3.947 17.641 ( -2.174 4.162 -2.353) 5.252 18.199 ( -4.179 0.507 0.497) 4.239 19.192 ( -1.047 -1.945 -0.600) 2.289 20.561 ( -3.063 1.867 1.788) 4.008 21.314 ( 2.433 -1.750 -0.513) 3.040 21.525 ( -0.245 -1.451 1.830) 2.348 21.609 ( 2.099 2.602 -3.485) 4.829 25.141 ( 0.027 0.290 -0.511) 0.588 25.309 ( -0.473 -1.342 0.419) 1.483 29.008 ( -0.612 -0.897 0.961) 1.450 29.192 ( 0.239 -0.134 -0.070) 0.283 34.169 ( 0.390 -1.860 -0.172) 1.908 35.117 ( 2.456 1.727 4.501) 5.410 37.669 ( 0.418 0.320 0.776) 0.938 37.932 ( 1.967 -2.149 2.563) 3.880 40.330 ( -3.424 -1.834 1.477) 4.155 41.163 ( -5.731 -1.421 -4.340) 7.328 41.485 ( 3.326 -1.266 3.635) 5.087 42.640 ( 7.369 2.705 -10.339) 12.981 ======================= Grid point 331 (166/205) ======================= q-point: (-0.44 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.140 ( -9.264 21.347 1.056) 23.294 3.717 ( 1.927 -4.617 0.410) 5.020 4.286 ( -8.036 2.877 -2.007) 8.768 4.511 ( 23.838 -3.247 6.753) 24.987 4.684 ( -13.131 1.544 8.466) 15.700 4.923 ( -1.474 3.898 11.614) 12.339 5.020 ( -3.145 -0.208 -3.909) 5.022 5.141 ( -9.057 -11.127 -5.265) 15.283 5.643 ( -13.909 1.488 9.246) 16.768 6.153 ( 8.846 -6.241 -0.345) 10.832 6.228 ( 1.366 -0.971 -10.026) 10.165 6.393 ( -4.278 12.690 0.053) 13.391 6.877 ( -2.657 -4.174 3.171) 5.877 6.957 ( -1.098 9.778 -3.381) 10.404 7.435 ( -0.483 -1.906 5.678) 6.008 7.596 ( 5.543 -2.552 -4.062) 7.331 7.860 ( 9.779 2.744 0.314) 10.162 8.150 ( 1.986 -0.067 1.775) 2.665 8.254 ( -2.202 -8.880 -4.143) 10.043 8.332 ( 5.680 -9.439 -9.070) 14.269 8.980 ( -2.338 0.484 -4.298) 4.916 9.211 ( -2.434 -0.545 4.314) 4.983 9.424 ( -1.508 3.397 -4.088) 5.525 9.569 ( 2.143 2.469 -1.719) 3.694 10.289 ( 0.235 2.766 -0.651) 2.852 10.450 ( 2.675 -7.356 -0.325) 7.834 10.763 ( 0.298 -1.196 3.396) 3.613 11.007 ( 2.281 1.168 3.062) 3.992 11.179 ( 2.302 -1.096 -2.467) 3.548 11.508 ( 5.301 -2.117 0.517) 5.732 11.888 ( 1.314 6.513 0.068) 6.645 11.981 ( 2.081 -5.806 1.995) 6.483 12.318 ( -0.753 0.447 -1.113) 1.416 13.175 ( -4.846 -0.041 2.111) 5.286 13.599 ( -4.548 8.291 -3.108) 9.954 13.695 ( -3.582 -5.230 4.050) 7.522 14.024 ( 1.409 2.598 2.128) 3.642 14.295 ( 3.072 -2.854 0.381) 4.210 14.533 ( -10.134 -2.105 0.203) 10.352 14.714 ( 3.393 0.042 -0.999) 3.537 15.079 ( -2.933 0.206 9.137) 9.599 15.168 ( -0.459 0.651 -1.441) 1.646 15.787 ( 4.386 6.825 2.124) 8.386 16.025 ( -5.154 -2.841 -1.991) 6.213 16.611 ( -1.687 1.488 -0.681) 2.351 16.907 ( 0.909 -2.095 -3.244) 3.967 17.412 ( 1.322 0.916 -3.487) 3.840 17.645 ( 4.505 -4.243 -2.840) 6.809 18.216 ( 6.729 -0.884 -1.250) 6.901 19.171 ( -3.714 1.280 1.599) 4.242 20.531 ( -0.250 0.979 4.768) 4.874 21.339 ( 2.209 1.294 -3.021) 3.960 21.544 ( -1.594 -0.750 2.507) 3.064 21.568 ( 0.141 2.200 -1.912) 2.919 25.135 ( 0.902 1.144 0.151) 1.464 25.317 ( -0.565 -0.448 -0.391) 0.820 29.016 ( 0.266 -0.088 0.151) 0.318 29.180 ( -0.927 1.322 1.115) 1.962 34.167 ( 0.434 2.721 0.078) 2.756 35.164 ( -3.025 -7.136 -0.236) 7.755 37.670 ( 0.518 0.496 0.468) 0.856 37.975 ( -0.988 -2.079 -1.562) 2.782 40.348 ( 2.358 -0.828 -0.252) 2.512 41.110 ( -7.592 -2.696 0.696) 8.086 41.522 ( 3.334 2.688 0.531) 4.316 42.592 ( 0.373 4.999 -5.990) 7.810 ======================= Grid point 332 (167/205) ======================= q-point: (-0.33 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.634 ( -8.056 25.668 14.806) 30.708 3.813 ( 4.830 -0.120 1.587) 5.085 4.112 ( -8.151 0.182 -14.570) 16.696 4.486 ( -12.552 9.758 13.410) 20.799 4.576 ( -25.762 2.773 8.303) 27.209 4.915 ( 6.380 -4.225 3.163) 8.280 5.012 ( -1.753 -5.571 -10.213) 11.765 5.258 ( -13.284 -6.932 14.816) 21.072 5.623 ( 4.981 -0.638 5.852) 7.711 6.071 ( 0.378 10.460 7.950) 13.144 6.126 ( -5.492 6.467 -2.081) 8.736 6.411 ( 6.329 -7.868 -6.126) 11.810 6.838 ( 1.597 1.625 -2.357) 3.279 6.985 ( 7.578 -0.765 -2.636) 8.059 7.476 ( 0.244 -0.651 -2.869) 2.952 7.621 ( 6.659 3.718 -2.971) 8.185 7.981 ( 8.754 -0.614 -0.082) 8.776 8.020 ( -7.501 3.360 -10.148) 13.059 8.440 ( 1.608 -10.243 2.334) 10.628 8.625 ( 7.591 -17.082 -6.665) 19.846 8.933 ( -1.307 -2.695 -4.754) 5.619 9.171 ( -6.485 2.726 -0.033) 7.034 9.313 ( -4.477 1.876 2.586) 5.500 9.530 ( 4.871 5.427 -2.572) 7.732 10.299 ( 4.382 -1.565 -1.871) 5.015 10.635 ( 3.063 -8.655 1.271) 9.268 10.766 ( -1.708 -0.078 4.321) 4.647 11.075 ( 0.410 -6.019 0.631) 6.066 11.334 ( 16.539 -2.673 3.044) 17.028 11.618 ( 10.601 -0.153 -4.354) 11.462 11.837 ( 4.579 3.244 -1.195) 5.737 12.113 ( 2.515 -5.323 2.033) 6.228 12.312 ( 3.300 1.777 2.559) 4.538 13.090 ( -12.612 -0.390 4.102) 13.268 13.343 ( -9.340 9.508 -2.762) 13.612 13.661 ( -11.698 -0.363 -0.545) 11.716 14.021 ( 1.329 0.149 3.004) 3.288 14.345 ( -2.077 -4.791 -5.017) 7.241 14.461 ( -8.809 -2.023 2.634) 9.414 14.733 ( -4.558 -1.839 0.880) 4.993 15.130 ( 7.299 0.177 8.267) 11.029 15.177 ( 5.180 3.927 4.092) 7.681 15.696 ( 0.932 9.609 2.425) 9.954 15.945 ( -7.973 1.535 -3.587) 8.877 16.550 ( -2.000 1.652 -2.228) 3.420 16.915 ( -5.304 -3.778 -1.480) 6.678 17.473 ( 8.761 -3.806 -5.871) 11.212 17.763 ( 3.271 -4.693 -2.957) 6.440 18.357 ( 14.288 -1.117 -2.503) 14.549 19.080 ( -5.927 4.188 3.503) 8.058 20.568 ( 2.988 -0.758 7.421) 8.036 21.295 ( 1.766 5.250 -4.844) 7.358 21.516 ( -2.402 0.516 -0.154) 2.462 21.554 ( -1.510 -0.105 2.186) 2.659 25.127 ( 1.412 1.889 0.961) 2.547 25.306 ( -0.755 0.455 -1.274) 1.550 29.017 ( 1.008 0.771 -0.514) 1.369 29.139 ( -1.867 2.440 1.778) 3.549 34.113 ( 2.079 5.059 0.339) 5.480 35.251 ( -10.578 -14.312 -5.922) 18.756 37.668 ( 0.485 0.706 0.308) 0.910 37.952 ( -4.795 -0.873 -5.781) 7.562 40.412 ( 8.633 0.117 -2.015) 8.866 41.070 ( -9.469 -3.191 5.084) 11.211 41.490 ( 4.725 6.384 -1.681) 8.118 42.450 ( -6.234 6.469 -0.568) 9.002 ======================= Grid point 333 (168/205) ======================= q-point: (-0.22 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.432 ( 4.717 6.119 34.206) 35.067 3.786 ( 7.605 20.104 17.589) 27.773 4.013 ( -2.600 -2.463 -13.342) 13.814 4.235 ( -22.251 -6.996 10.446) 25.557 4.357 ( -20.624 -10.340 -15.772) 27.947 4.790 ( -4.437 8.970 -11.797) 15.470 4.901 ( -25.451 15.380 27.807) 40.713 5.320 ( 8.646 -8.048 8.679) 14.657 5.675 ( 0.994 6.404 -11.509) 13.208 6.006 ( -3.200 1.536 -1.368) 3.804 6.161 ( 11.426 -6.749 14.017) 19.302 6.543 ( 1.814 -4.164 -0.428) 4.562 6.845 ( 5.559 3.907 -2.296) 7.173 7.047 ( 4.269 -0.983 -14.396) 15.048 7.348 ( -4.149 6.555 -15.327) 17.179 7.687 ( -1.065 0.174 2.823) 3.022 7.760 ( -0.147 1.451 -9.009) 9.126 8.219 ( 7.942 -6.682 4.022) 11.131 8.513 ( 1.198 2.691 3.051) 4.241 8.877 ( -3.752 -5.920 -7.407) 10.197 8.997 ( -4.343 -2.746 1.580) 5.375 9.090 ( 4.237 -12.748 -6.687) 15.006 9.328 ( 1.671 -2.129 5.114) 5.786 9.505 ( 2.910 2.599 -0.504) 3.934 10.418 ( 7.423 -4.490 -0.870) 8.719 10.663 ( -1.001 2.361 -0.427) 2.600 10.897 ( 0.131 -8.654 11.909) 14.722 11.203 ( 3.561 -8.049 -4.904) 10.075 11.546 ( 8.180 -0.240 3.379) 8.854 11.723 ( 13.531 2.046 -2.001) 13.830 11.914 ( 10.828 -1.539 -6.273) 12.608 12.160 ( 2.951 2.387 -3.115) 4.910 12.423 ( 11.679 -2.516 4.549) 12.784 12.917 ( -19.253 -1.091 6.556) 20.367 13.132 ( -8.526 2.401 0.482) 8.870 13.478 ( -15.313 1.145 -3.250) 15.696 14.060 ( 2.017 -0.159 5.578) 5.934 14.357 ( -7.628 -2.744 2.537) 8.494 14.408 ( -4.135 -2.695 -3.307) 5.941 14.697 ( -5.728 -2.202 -5.586) 8.299 15.191 ( 5.733 5.146 6.739) 10.235 15.239 ( 10.425 3.731 5.224) 12.243 15.534 ( -1.255 11.028 2.394) 11.354 15.778 ( -9.438 3.968 -3.336) 10.768 16.541 ( -0.920 -4.088 0.748) 4.256 16.893 ( -7.293 -3.255 -2.432) 8.348 17.652 ( 10.709 -5.522 -5.331) 13.176 17.842 ( 1.378 -3.492 -2.177) 4.339 18.532 ( 15.395 0.609 -3.515) 15.803 18.934 ( -7.425 5.929 4.537) 10.529 20.689 ( 6.561 -3.280 8.445) 11.186 21.195 ( 1.508 6.573 -4.812) 8.285 21.480 ( -3.462 -0.054 1.002) 3.605 21.539 ( -1.761 0.392 0.696) 1.934 25.116 ( 1.399 2.232 1.890) 3.242 25.273 ( -1.301 1.184 -2.258) 2.862 29.011 ( 1.218 1.322 -0.675) 1.920 29.077 ( -2.263 2.879 1.544) 3.974 34.090 ( 7.227 4.166 1.127) 8.417 35.265 ( -22.957 -14.984 -13.213) 30.433 37.659 ( 0.020 1.233 0.807) 1.474 37.850 ( -6.594 1.304 -6.937) 9.659 40.534 ( 13.781 0.026 -3.964) 14.340 41.016 ( -11.793 -2.515 6.540) 13.717 41.455 ( 11.014 7.693 0.152) 13.435 42.250 ( -11.802 5.793 4.046) 13.756 ======================= Grid point 334 (169/205) ======================= q-point: (-0.11 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.804 ( 13.567 -15.165 44.111) 48.578 3.584 ( 1.271 19.978 39.302) 44.106 4.020 ( -7.488 -4.681 -3.750) 9.594 4.182 ( -8.469 -6.768 -14.620) 18.201 4.316 ( -2.859 -7.573 -4.936) 9.481 4.473 ( -10.054 11.523 13.123) 20.152 4.571 ( -9.746 4.773 -14.903) 18.436 5.368 ( -5.988 15.424 -21.483) 27.116 5.575 ( 7.221 -3.547 10.959) 13.595 5.943 ( -3.754 0.107 -2.672) 4.609 6.468 ( 4.857 -7.294 11.742) 14.652 6.584 ( -0.157 -0.854 2.748) 2.882 6.798 ( 0.307 4.657 -11.615) 12.517 6.872 ( -3.201 9.045 -10.436) 14.176 7.311 ( 4.595 -5.318 -9.210) 11.586 7.594 ( -4.984 -2.983 -12.837) 14.090 7.904 ( 9.852 -1.672 11.736) 15.413 8.309 ( -4.134 -1.372 -0.576) 4.393 8.533 ( 6.423 1.626 0.662) 6.658 8.697 ( -8.077 6.020 -2.187) 10.309 9.144 ( 1.382 -8.957 -0.592) 9.083 9.285 ( -0.729 -6.982 -0.067) 7.021 9.440 ( 4.428 -5.076 1.065) 6.819 9.512 ( 2.119 0.078 -0.750) 2.249 10.565 ( 5.241 -3.231 0.096) 6.158 10.622 ( -0.190 1.378 0.800) 1.605 11.044 ( -1.976 -4.477 14.785) 15.574 11.352 ( 6.152 -6.456 -12.049) 14.990 11.613 ( 5.102 0.872 3.827) 6.437 11.800 ( 1.779 1.375 -0.280) 2.266 11.991 ( 5.598 1.124 -1.811) 5.990 12.133 ( 9.093 8.654 -7.058) 14.401 12.603 ( -1.107 -9.158 1.660) 9.372 12.914 ( 8.296 -6.942 1.759) 10.960 13.022 ( -11.033 -1.464 1.179) 11.192 13.255 ( -14.192 4.106 -0.447) 14.781 14.119 ( 1.413 -0.915 10.164) 10.303 14.295 ( -6.330 1.335 7.488) 9.895 14.400 ( -4.076 -4.473 -8.649) 10.556 14.607 ( -3.332 2.304 -11.680) 12.362 15.202 ( 8.015 5.741 2.504) 10.172 15.271 ( 0.217 6.062 5.761) 8.365 15.407 ( 4.476 3.914 1.093) 6.045 15.609 ( -8.617 1.668 -0.648) 8.801 16.643 ( -2.274 -6.647 6.774) 9.760 16.825 ( -3.386 0.419 -5.164) 6.190 17.818 ( 6.494 -3.407 -1.781) 7.547 17.901 ( 0.798 -3.559 -2.523) 4.435 18.657 ( 11.755 2.007 -3.771) 12.507 18.771 ( -7.635 4.869 4.303) 10.026 20.875 ( 8.384 -4.288 6.345) 11.355 21.105 ( 1.047 4.230 -3.551) 5.621 21.446 ( -2.295 0.586 1.720) 2.927 21.502 ( -2.663 0.684 -1.181) 2.992 25.108 ( 1.202 1.673 2.723) 3.415 25.224 ( -1.771 1.132 -3.006) 3.668 28.998 ( -0.975 1.121 1.496) 2.108 29.020 ( 0.133 2.052 -1.063) 2.315 34.184 ( 15.336 1.549 3.738) 15.861 35.035 ( -35.343 -6.974 -15.937) 39.392 37.634 ( -1.221 1.610 2.864) 3.505 37.745 ( -2.917 0.843 -5.238) 6.054 40.686 ( 14.271 0.038 -4.963) 15.109 40.915 ( -13.449 -1.080 3.549) 13.951 41.558 ( 21.566 3.860 3.529) 22.191 42.030 ( -15.821 3.413 4.658) 16.842 ======================= Grid point 336 (170/205) ======================= q-point: ( 0.11 0.11 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.538 ( -0.216 -0.000 16.005) 16.006 3.610 ( -24.228 -0.000 -26.510) 35.914 3.674 ( -3.804 -0.000 -19.884) 20.244 3.940 ( 10.964 0.000 36.465) 38.078 4.404 ( 5.829 0.000 -11.385) 12.790 4.631 ( 15.080 0.000 3.518) 15.485 5.099 ( 25.050 0.000 20.198) 32.178 5.245 ( 38.918 0.000 -28.918) 48.486 5.666 ( -9.397 -0.000 -9.081) 13.068 5.941 ( 6.765 0.000 4.587) 8.174 6.464 ( -4.883 -0.000 20.167) 20.750 6.547 ( -2.485 -0.000 4.610) 5.237 6.713 ( -2.618 -0.000 -13.553) 13.803 6.780 ( 0.143 0.000 -1.194) 1.203 7.181 ( -10.760 -0.000 -3.221) 11.232 7.376 ( -5.615 -0.000 14.944) 15.964 7.978 ( -9.873 -0.000 -10.907) 14.712 8.330 ( 0.444 0.000 5.693) 5.710 8.460 ( -1.463 -0.000 -3.472) 3.768 8.712 ( 5.598 0.000 5.208) 7.646 9.139 ( -4.433 -0.000 2.042) 4.881 9.294 ( -5.805 -0.000 7.262) 9.297 9.480 ( 1.082 0.000 -8.102) 8.174 9.509 ( -2.883 -0.000 -2.094) 3.563 10.536 ( -6.380 -0.000 -1.063) 6.468 10.618 ( -1.536 -0.000 -1.250) 1.980 11.132 ( -5.825 -0.000 11.965) 13.307 11.322 ( -1.097 -0.000 -12.000) 12.050 11.610 ( -5.251 -0.000 -4.620) 6.994 11.794 ( -1.651 -0.000 6.585) 6.789 11.846 ( -8.099 -0.000 2.210) 8.395 11.895 ( -7.052 -0.000 -4.350) 8.286 12.539 ( -20.774 -0.000 0.798) 20.789 12.834 ( 10.416 0.000 0.781) 10.445 13.367 ( 24.681 0.000 4.704) 25.125 13.477 ( 8.012 0.000 -13.440) 15.647 14.238 ( -2.412 -0.000 -0.923) 2.582 14.354 ( 1.805 0.000 16.213) 16.313 14.356 ( -0.116 -0.000 0.569) 0.581 14.435 ( 5.063 0.000 -2.394) 5.601 15.127 ( -2.337 -0.000 0.308) 2.358 15.255 ( -2.776 -0.000 -1.276) 3.055 15.364 ( -3.393 -0.000 -4.496) 5.633 15.766 ( 17.495 0.000 -1.102) 17.530 16.585 ( -4.361 -0.000 10.079) 10.982 16.997 ( 7.397 0.000 -6.238) 9.676 17.777 ( -6.247 -0.000 -3.282) 7.057 17.840 ( -5.909 -0.000 2.146) 6.287 18.465 ( -9.596 -0.000 2.414) 9.894 18.841 ( 2.482 0.000 -2.870) 3.794 20.944 ( -3.720 -0.000 -6.770) 7.725 20.953 ( -8.085 -0.000 2.128) 8.361 21.500 ( 2.257 0.000 1.957) 2.987 21.572 ( 8.873 0.000 -4.425) 9.915 25.134 ( -0.014 -0.000 -3.203) 3.203 25.178 ( 0.970 0.000 3.909) 4.027 28.948 ( -1.215 -0.000 2.387) 2.678 29.064 ( 2.786 0.000 -2.536) 3.767 34.040 ( -10.227 -0.000 -0.203) 10.229 35.135 ( 22.169 0.000 21.173) 30.656 37.678 ( 2.865 0.000 6.935) 7.504 37.682 ( 0.570 0.000 -2.959) 3.014 40.456 ( -13.195 -0.000 3.452) 13.639 41.099 ( 11.555 0.000 -1.619) 11.668 41.391 ( -13.309 -0.000 -5.269) 14.314 42.410 ( 23.153 0.000 -15.226) 27.711 ======================= Grid point 337 (171/205) ======================= q-point: ( 0.22 0.11 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.039 ( -9.156 12.673 -38.493) 41.547 3.658 ( 5.758 -4.253 3.388) 7.919 3.706 ( -5.746 -6.812 4.667) 10.060 4.261 ( 12.439 -4.925 29.393) 32.294 4.530 ( 5.875 -11.288 -14.300) 19.142 4.800 ( 18.157 4.098 2.743) 18.814 5.325 ( -9.593 1.225 -3.995) 10.464 5.540 ( 21.147 2.427 5.752) 22.049 5.660 ( 23.057 -1.137 -12.973) 26.481 6.061 ( 13.778 -1.322 -3.266) 14.222 6.376 ( -12.619 12.959 2.766) 18.298 6.514 ( -5.543 2.451 -2.995) 6.760 6.621 ( -2.777 -3.997 14.434) 15.232 6.799 ( -4.453 -7.928 -10.261) 13.710 7.144 ( 1.765 -1.405 10.551) 10.789 7.451 ( 0.081 -6.268 18.887) 19.900 7.780 ( -9.538 3.616 -10.993) 14.997 8.222 ( -13.511 2.465 -1.889) 13.863 8.522 ( 5.547 -3.848 -2.182) 7.095 8.818 ( -0.083 -3.059 8.713) 9.234 9.061 ( -2.787 6.820 3.375) 8.103 9.184 ( -1.505 7.011 2.107) 7.473 9.373 ( -3.168 4.816 -4.188) 7.125 9.524 ( 1.322 -2.255 -6.847) 7.329 10.402 ( -7.792 3.973 -1.400) 8.858 10.620 ( -1.660 -2.288 0.462) 2.864 11.058 ( -5.490 5.307 7.214) 10.505 11.259 ( -0.842 1.690 -6.995) 7.246 11.517 ( -6.422 1.536 -2.643) 7.112 11.580 ( -13.550 9.464 0.186) 16.529 11.755 ( -5.705 0.214 3.671) 6.787 12.002 ( -1.314 -10.810 -0.467) 10.899 12.358 ( -9.146 -2.119 -6.538) 11.440 13.013 ( 10.102 -4.580 4.124) 11.834 13.405 ( 2.817 8.574 -7.642) 11.826 13.647 ( 20.600 1.162 2.955) 20.844 14.124 ( -3.056 4.346 -3.079) 6.141 14.357 ( -1.043 2.761 7.902) 8.435 14.460 ( -3.639 -6.989 0.150) 7.881 14.568 ( 9.365 -3.629 7.668) 12.636 15.120 ( -5.880 -1.233 2.745) 6.606 15.207 ( -2.479 -0.094 -3.222) 4.066 15.403 ( 2.178 -8.502 -6.434) 10.882 15.995 ( 21.625 0.135 -1.870) 21.706 16.543 ( -4.215 3.219 7.715) 9.362 17.011 ( 3.090 3.616 -1.232) 4.913 17.628 ( -4.209 6.631 -3.091) 8.440 17.801 ( -5.147 -1.654 0.202) 5.410 18.344 ( -10.237 1.247 0.876) 10.350 18.906 ( -0.690 -7.097 -1.543) 7.295 20.767 ( -6.551 5.302 -2.953) 8.930 20.998 ( -4.005 -8.678 -2.134) 9.793 21.522 ( 1.618 0.823 1.832) 2.579 21.652 ( 7.702 0.503 -5.422) 9.433 25.130 ( 0.959 -0.298 -2.950) 3.116 25.214 ( 0.287 -1.497 3.777) 4.073 28.951 ( -1.082 -0.843 2.372) 2.740 29.099 ( 2.067 -1.892 -2.513) 3.764 34.000 ( 0.076 -2.101 -0.366) 2.134 35.371 ( 11.284 6.772 21.083) 24.854 37.676 ( 1.033 0.467 -1.006) 1.516 37.778 ( 5.228 -1.739 8.332) 9.989 40.334 ( -9.489 -0.204 3.557) 10.135 41.233 ( 5.752 -0.330 -4.916) 7.574 41.259 ( -3.664 -2.348 0.157) 4.355 42.584 ( 17.134 -0.327 -19.104) 25.664 ======================= Grid point 338 (172/205) ======================= q-point: ( 0.33 0.11 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.810 ( 4.147 -5.239 -28.107) 28.890 3.754 ( -3.648 -9.791 -8.565) 13.510 3.882 ( 12.252 -1.531 20.527) 23.954 4.542 ( 1.422 -6.280 7.747) 10.074 4.684 ( -2.355 -5.547 -1.527) 6.217 4.968 ( 13.970 1.558 0.442) 14.063 5.100 ( -4.944 2.813 -6.459) 8.606 5.652 ( 7.431 8.437 5.370) 12.460 5.795 ( 10.500 14.594 1.377) 18.031 5.994 ( -11.749 3.515 -3.572) 12.774 6.335 ( 23.246 -5.060 -14.462) 27.841 6.380 ( -5.159 5.401 3.347) 8.184 6.727 ( -2.994 -7.062 14.417) 16.330 6.813 ( -4.797 -5.584 -10.967) 13.209 7.272 ( -1.040 -5.016 13.877) 14.792 7.587 ( -2.264 4.188 -5.147) 7.011 7.736 ( 5.957 -11.301 13.266) 18.417 8.010 ( -11.401 1.101 -4.423) 12.279 8.562 ( -2.063 6.436 0.836) 6.810 8.781 ( -2.391 12.973 -2.336) 13.397 8.875 ( -3.531 1.861 5.692) 6.952 9.211 ( 7.627 -3.463 0.501) 8.391 9.285 ( -3.104 0.094 0.424) 3.134 9.536 ( 2.695 0.072 -8.738) 9.144 10.274 ( -3.121 2.358 -0.347) 3.927 10.630 ( -2.564 -0.207 3.246) 4.141 10.903 ( -3.603 8.611 1.052) 9.393 11.186 ( -2.734 3.848 -4.645) 6.622 11.285 ( -10.724 2.536 -6.043) 12.568 11.416 ( -6.981 2.536 5.974) 9.531 11.753 ( 0.323 -2.647 1.282) 2.959 12.114 ( -3.184 -5.261 0.664) 6.186 12.295 ( -3.147 -1.749 -8.580) 9.305 13.217 ( 3.788 -3.863 7.802) 9.495 13.291 ( 3.915 3.306 -2.412) 5.664 13.842 ( 15.433 2.508 0.158) 15.636 14.029 ( -4.595 0.775 -3.091) 5.592 14.314 ( -1.056 3.987 8.638) 9.572 14.497 ( -9.316 -7.012 -4.040) 12.341 14.738 ( 6.790 -0.830 5.178) 8.580 15.053 ( -3.780 -0.458 2.232) 4.414 15.198 ( -1.709 -0.072 -0.570) 1.803 15.558 ( 1.328 -10.299 -6.581) 12.294 16.206 ( 20.445 7.170 1.982) 21.756 16.496 ( -1.498 -1.552 2.373) 3.206 16.961 ( -0.158 4.373 2.019) 4.819 17.493 ( 1.121 5.622 -3.807) 6.882 17.762 ( -3.007 0.957 -0.620) 3.216 18.206 ( -8.996 0.898 -0.345) 9.047 19.006 ( -4.101 -8.654 0.053) 9.576 20.625 ( -4.371 2.904 -2.124) 5.661 21.096 ( -3.814 -9.855 -2.072) 10.769 21.531 ( 1.290 0.890 1.711) 2.320 21.690 ( 5.693 1.913 -5.421) 8.091 25.140 ( 1.764 -0.171 -2.512) 3.074 25.254 ( -0.427 -1.798 3.171) 3.670 28.966 ( -1.013 -1.348 2.153) 2.734 29.143 ( 0.729 -2.394 -1.968) 3.184 34.079 ( 5.804 -2.816 -1.265) 6.574 35.363 ( 0.776 10.659 14.456) 17.978 37.681 ( 1.418 0.373 -0.685) 1.618 37.894 ( 4.197 -0.646 8.981) 9.935 40.279 ( -3.763 -1.101 3.905) 5.534 41.159 ( -5.336 0.985 0.878) 5.497 41.406 ( 8.839 -3.511 -0.565) 9.527 42.674 ( 10.728 -0.027 -19.552) 22.302 ======================= Grid point 339 (173/205) ======================= q-point: ( 0.44 0.11 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.022 ( 9.343 -16.710 -10.590) 21.878 3.826 ( 2.802 -2.090 -6.335) 7.235 4.131 ( 4.161 -5.517 11.080) 13.059 4.371 ( -21.517 0.766 -8.006) 22.971 4.726 ( -6.079 -0.468 11.013) 12.589 4.908 ( -10.553 2.394 -8.182) 13.566 5.188 ( 13.273 3.851 2.353) 14.019 5.510 ( 7.539 17.965 -0.359) 19.486 5.704 ( 4.968 2.834 11.294) 12.659 5.913 ( -3.704 1.585 2.469) 4.726 6.237 ( -5.736 0.563 0.703) 5.806 6.598 ( 17.318 1.469 -10.117) 20.110 6.756 ( -6.463 -4.146 3.458) 8.421 7.004 ( 11.758 -13.423 -2.515) 18.021 7.347 ( -11.694 -6.629 3.702) 13.942 7.478 ( 3.859 7.020 2.487) 8.388 7.878 ( -3.067 -2.408 -7.137) 8.133 8.053 ( 4.439 -6.635 11.064) 13.643 8.332 ( -6.983 10.140 -1.097) 12.361 8.480 ( 1.819 17.251 -2.922) 17.591 8.934 ( 0.657 -3.060 0.492) 3.168 9.255 ( -0.213 1.012 1.568) 1.878 9.401 ( 3.157 -8.896 2.348) 9.727 9.508 ( 1.260 2.268 -9.709) 10.050 10.260 ( 1.624 -1.295 -0.108) 2.079 10.565 ( -1.344 6.600 1.817) 6.977 10.762 ( -3.050 3.419 1.734) 4.899 11.046 ( -5.252 0.780 -7.343) 9.061 11.223 ( 3.954 2.372 -1.689) 4.911 11.372 ( -4.239 -3.692 6.520) 8.609 11.834 ( 3.776 -3.468 -0.619) 5.164 12.076 ( -3.835 3.142 -1.886) 5.305 12.284 ( -0.855 -2.451 -2.818) 3.832 13.191 ( -3.727 1.602 3.321) 5.243 13.457 ( 5.315 -6.705 6.619) 10.818 13.857 ( -3.414 5.533 -3.527) 7.397 13.998 ( 0.825 -1.915 -2.700) 3.411 14.297 ( 0.107 1.794 2.910) 3.421 14.409 ( -16.542 -4.803 -1.711) 17.310 14.795 ( 5.390 3.277 3.436) 7.183 15.090 ( -2.669 -3.968 -2.285) 5.300 15.155 ( 1.003 3.079 9.382) 9.925 15.688 ( 1.186 -7.265 -6.991) 10.152 16.258 ( 13.938 11.571 6.362) 19.200 16.561 ( -0.130 -3.992 -1.218) 4.175 16.918 ( 2.606 2.494 -0.791) 3.692 17.454 ( 4.396 2.153 -3.546) 6.044 17.677 ( -2.381 4.580 -2.141) 5.589 18.150 ( -0.838 -2.687 -1.102) 3.023 19.070 ( -7.330 -7.171 2.183) 10.484 20.557 ( -1.765 0.832 0.195) 1.961 21.185 ( -5.101 -8.856 -2.820) 10.602 21.541 ( 1.133 0.537 1.719) 2.127 21.685 ( 3.830 3.296 -4.616) 6.844 25.156 ( 2.555 0.268 -1.986) 3.248 25.284 ( -0.727 -1.458 2.358) 2.866 28.987 ( -0.563 -1.501 1.708) 2.343 29.171 ( -0.688 -1.735 -0.948) 2.093 34.187 ( 7.359 -1.028 -1.573) 7.595 35.216 ( -5.307 8.610 7.838) 12.796 37.689 ( 1.770 0.640 -0.745) 2.024 37.953 ( 0.807 0.555 5.578) 5.663 40.308 ( 2.255 -1.433 3.995) 4.806 41.090 ( -5.263 1.468 4.950) 7.373 41.543 ( 7.337 -1.518 -0.029) 7.493 42.683 ( 4.341 1.044 -17.530) 18.089 ======================= Grid point 340 (174/205) ======================= q-point: (-0.44 0.11 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.275 ( -0.671 -2.370 1.171) 2.727 3.723 ( -0.917 10.077 -3.816) 10.814 4.068 ( -18.399 -4.899 -6.014) 19.967 4.319 ( -12.407 -10.467 -4.226) 16.774 4.600 ( -9.030 2.246 3.508) 9.944 4.816 ( -1.895 -5.997 -4.684) 7.842 5.096 ( -15.900 5.887 6.952) 18.325 5.429 ( 18.238 21.788 16.670) 32.943 5.687 ( 9.860 -0.619 1.754) 10.033 6.094 ( 12.048 -7.741 -2.485) 14.534 6.159 ( -8.382 0.666 2.408) 8.746 6.578 ( -0.546 7.983 6.191) 10.117 6.878 ( 7.825 0.812 -2.128) 8.150 7.115 ( 1.833 6.441 -2.173) 7.040 7.397 ( 0.104 -8.821 9.921) 13.276 7.514 ( 1.581 -6.270 -2.363) 6.885 7.904 ( 1.061 -7.527 -8.931) 11.728 8.128 ( -2.980 2.700 -6.654) 7.775 8.226 ( 1.823 -2.831 2.927) 4.462 8.280 ( 4.704 9.522 -5.250) 11.847 8.946 ( -2.757 0.253 1.400) 3.102 9.240 ( 0.442 2.180 3.159) 3.863 9.406 ( -4.374 3.750 -8.066) 9.912 9.561 ( 2.364 -5.542 -0.821) 6.081 10.315 ( 1.562 -1.486 -0.272) 2.173 10.475 ( 5.216 4.242 -0.648) 6.754 10.737 ( -2.287 -1.970 2.532) 3.940 10.984 ( -2.921 -0.799 -2.397) 3.862 11.291 ( 12.166 0.086 1.224) 12.228 11.481 ( 2.294 -8.303 2.135) 8.875 11.930 ( 4.542 -2.902 -1.928) 5.724 11.978 ( -0.047 3.862 -2.343) 4.518 12.312 ( 0.499 -1.514 1.601) 2.260 13.119 ( -7.846 1.483 3.951) 8.909 13.593 ( -7.230 -2.333 4.610) 8.886 13.660 ( -4.848 6.017 -2.244) 8.046 13.970 ( -8.290 -1.693 -4.447) 9.559 14.224 ( -5.611 -2.302 -6.831) 9.135 14.377 ( -3.036 -2.525 4.923) 6.311 14.760 ( -8.205 2.365 4.711) 9.752 15.105 ( 6.808 -0.413 3.778) 7.797 15.231 ( 3.178 -0.442 10.079) 10.577 15.757 ( 3.051 -1.985 -7.809) 8.615 16.244 ( 11.622 12.221 4.137) 17.365 16.568 ( -4.447 -1.562 -0.863) 4.792 16.903 ( -0.118 2.745 -2.433) 3.670 17.449 ( 3.420 2.114 -4.780) 6.246 17.629 ( 2.499 -1.473 -2.961) 4.145 18.264 ( 9.972 -4.863 -2.146) 11.300 19.074 ( -9.867 -4.557 4.359) 11.710 20.555 ( 0.692 -0.420 3.625) 3.715 21.227 ( -6.493 -6.897 -4.484) 10.481 21.553 ( 0.642 0.299 1.881) 2.010 21.641 ( 2.332 4.563 -3.546) 6.232 25.174 ( 3.127 0.954 -1.257) 3.503 25.301 ( -0.777 -0.776 1.374) 1.759 29.012 ( 0.383 -1.153 1.042) 1.601 29.173 ( -1.855 -0.495 0.238) 1.935 34.254 ( 6.930 2.888 -0.996) 7.574 35.060 ( -9.377 2.437 3.026) 10.150 37.695 ( 1.838 1.018 -0.757) 2.234 37.945 ( -2.301 0.766 0.714) 2.528 40.402 ( 7.935 -0.877 2.686) 8.423 41.026 ( -6.623 0.944 7.839) 10.306 41.622 ( 6.270 1.675 0.290) 6.497 42.603 ( -1.869 2.922 -14.410) 14.821 ======================= Grid point 341 (175/205) ======================= q-point: (-0.33 0.11 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.024 ( -3.346 22.643 9.565) 24.807 3.713 ( -5.120 -9.556 -0.437) 10.850 3.857 ( -15.329 -2.783 -10.387) 18.725 4.141 ( -20.704 -0.235 -15.195) 25.683 4.500 ( -28.332 5.346 26.091) 38.884 4.886 ( 0.064 -3.378 -17.016) 17.348 4.952 ( 7.833 -6.896 4.551) 11.385 5.523 ( 22.633 9.794 22.297) 33.246 5.812 ( 6.820 5.085 0.155) 8.509 6.027 ( -4.737 4.752 -3.219) 7.442 6.253 ( 2.683 -0.835 -2.219) 3.580 6.451 ( 0.780 8.001 18.342) 20.026 6.845 ( 2.949 0.822 -2.403) 3.892 7.149 ( 8.465 5.421 -0.468) 10.063 7.456 ( -1.389 0.672 0.451) 1.607 7.678 ( 3.022 -7.632 2.078) 8.468 7.924 ( -11.444 3.843 -13.731) 18.283 8.067 ( 10.907 -0.813 -10.670) 15.280 8.242 ( -1.960 -11.666 1.983) 11.995 8.403 ( 3.100 -11.531 -6.763) 13.722 8.897 ( -2.942 1.080 1.518) 3.482 9.181 ( -3.297 6.526 -5.727) 9.288 9.291 ( -2.583 -0.044 6.456) 6.954 9.606 ( 1.205 0.864 -4.436) 4.677 10.340 ( 4.393 -0.048 -0.571) 4.431 10.581 ( 6.797 -4.983 1.044) 8.492 10.749 ( -2.453 -1.843 2.504) 3.960 10.994 ( -0.271 -3.857 0.705) 3.931 11.491 ( 12.855 -3.407 1.859) 13.428 11.671 ( 7.450 -7.380 -2.120) 10.699 11.961 ( 9.494 2.946 -3.024) 10.390 12.026 ( 3.215 -4.360 -0.956) 5.501 12.350 ( -0.558 -2.006 3.325) 3.923 12.965 ( -14.238 4.358 3.155) 15.221 13.347 ( -13.993 6.786 -0.034) 15.552 13.546 ( -10.870 2.951 -2.554) 11.550 13.961 ( -1.266 -5.376 0.844) 5.587 14.206 ( -2.774 -3.722 -6.359) 7.873 14.400 ( -2.226 -1.236 4.972) 5.586 14.626 ( -11.066 -0.104 3.818) 11.706 15.254 ( 9.495 -1.172 0.573) 9.584 15.299 ( -0.319 -0.449 17.267) 17.276 15.761 ( 6.987 5.304 -7.102) 11.287 16.157 ( 8.986 15.466 -1.505) 17.950 16.525 ( -4.224 -0.763 -2.078) 4.769 16.793 ( -9.342 1.403 0.157) 9.448 17.505 ( 9.289 -2.704 -6.593) 11.708 17.699 ( 0.718 -4.656 -2.650) 5.405 18.488 ( 16.117 -4.054 -3.107) 16.908 19.016 ( -11.402 -1.486 5.773) 12.867 20.617 ( 3.419 -1.697 7.228) 8.173 21.215 ( -7.426 -4.642 -6.307) 10.792 21.556 ( -0.256 0.634 1.485) 1.635 21.576 ( 1.837 4.965 -2.210) 5.737 25.187 ( 3.165 1.836 -0.240) 3.667 25.299 ( -1.055 0.188 0.171) 1.085 29.038 ( 1.493 -0.189 0.303) 1.535 29.145 ( -2.621 0.917 1.090) 2.983 34.262 ( 7.702 5.897 0.167) 9.702 34.938 ( -14.672 -3.696 -0.847) 15.154 37.694 ( 1.537 1.265 -0.438) 2.038 37.884 ( -4.396 1.140 -3.017) 5.453 40.538 ( 12.867 -0.070 -0.312) 12.870 40.962 ( -9.166 -0.054 9.328) 13.078 41.655 ( 7.590 4.204 1.684) 8.838 42.435 ( -7.158 4.946 -11.187) 14.172 ======================= Grid point 342 (176/205) ======================= q-point: (-0.22 0.11 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.798 ( 8.313 14.154 23.960) 29.043 3.775 ( -22.130 -12.317 9.269) 26.970 3.801 ( -2.843 -9.349 -9.802) 13.841 3.842 ( -20.176 -3.265 -21.680) 29.795 4.192 ( -6.978 9.756 21.766) 24.852 4.768 ( 0.120 5.334 -23.022) 23.632 5.302 ( 12.554 -7.397 10.240) 17.810 5.432 ( 0.298 28.845 30.713) 42.136 5.827 ( 7.672 3.354 -9.004) 12.296 5.879 ( -6.578 0.819 -7.739) 10.190 6.352 ( 14.125 1.527 12.181) 18.714 6.506 ( 1.505 -2.595 9.182) 9.659 6.903 ( 5.958 -1.420 -7.917) 10.010 7.049 ( -5.129 5.672 -7.212) 10.511 7.382 ( -2.345 5.329 -6.558) 8.770 7.575 ( -13.743 7.719 -13.455) 20.724 7.839 ( 6.584 -2.863 9.779) 12.132 8.189 ( 4.609 -3.927 -3.949) 7.229 8.490 ( 0.359 -13.199 2.217) 13.388 8.610 ( -0.028 -17.082 -9.416) 19.506 8.901 ( -1.312 -5.104 0.060) 5.270 8.987 ( -5.360 5.455 -4.479) 8.863 9.348 ( 2.716 -1.302 8.124) 8.665 9.561 ( 0.457 2.604 -4.855) 5.528 10.439 ( 6.827 -3.324 0.735) 7.629 10.644 ( -3.290 -0.873 -2.684) 4.334 10.851 ( 3.120 -5.981 11.095) 12.985 11.099 ( 3.306 -7.503 -4.867) 9.535 11.638 ( 4.709 -0.680 4.074) 6.264 11.835 ( 3.723 -3.488 -5.400) 7.429 12.079 ( 18.783 4.752 0.003) 19.374 12.165 ( 9.176 -7.710 -2.691) 12.284 12.401 ( -6.291 -8.406 2.239) 10.736 12.650 ( -23.118 6.655 -0.169) 24.057 13.164 ( -1.819 4.287 2.653) 5.360 13.353 ( -10.708 3.039 -2.405) 11.388 14.045 ( -0.363 -3.930 4.303) 5.839 14.212 ( -3.202 -4.549 -5.269) 7.663 14.394 ( -1.703 1.701 7.325) 7.710 14.569 ( -5.076 -3.311 -1.219) 6.181 15.306 ( 1.909 1.283 6.232) 6.643 15.403 ( 1.207 -2.445 8.400) 8.831 15.682 ( 7.636 13.799 -2.765) 16.012 15.944 ( 2.760 17.512 -7.326) 19.182 16.512 ( 1.720 -1.344 0.485) 2.236 16.703 ( -10.380 -5.349 -1.151) 11.734 17.663 ( 9.268 -5.217 -5.630) 12.034 17.754 ( -2.978 -5.047 -1.345) 6.012 18.707 ( 15.026 -0.631 -3.014) 15.338 18.903 ( -10.890 1.527 4.993) 12.077 20.748 ( 6.148 -3.459 9.468) 11.807 21.153 ( -7.347 -2.145 -7.315) 10.587 21.518 ( 2.132 3.854 -1.252) 4.579 21.538 ( -1.104 1.473 0.541) 1.919 25.187 ( 2.508 2.656 1.051) 3.802 25.270 ( -1.572 1.239 -1.213) 2.340 29.050 ( 1.292 1.300 0.638) 1.940 29.095 ( -1.873 1.964 0.325) 2.733 34.287 ( 11.948 4.923 2.144) 13.099 34.791 ( -21.906 -5.250 -4.036) 22.885 37.686 ( 0.521 1.515 0.659) 1.733 37.792 ( -3.980 1.791 -4.223) 6.073 40.696 ( 15.468 0.476 -3.856) 15.949 40.876 ( -12.272 -0.560 8.099) 14.714 41.708 ( 11.137 4.233 5.745) 13.227 42.202 ( -9.396 6.271 -9.617) 14.836 ======================= Grid point 343 (177/205) ======================= q-point: (-0.11 0.11 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.992 ( 15.354 -3.900 36.397) 39.695 3.604 ( -22.798 -3.633 18.888) 29.828 3.684 ( -15.538 -8.549 -18.805) 25.848 3.985 ( 6.414 -12.736 -3.956) 14.798 4.242 ( 7.957 -2.757 4.202) 9.411 4.568 ( 4.652 9.644 -26.351) 28.443 5.024 ( 5.225 32.277 32.105) 45.823 5.583 ( 4.125 21.609 -21.029) 30.433 5.638 ( 8.965 -5.131 8.285) 13.242 5.818 ( -8.800 -5.017 -7.493) 12.599 6.500 ( -1.637 1.409 15.544) 15.694 6.627 ( 8.717 -1.341 10.857) 13.988 6.841 ( 0.176 7.045 -17.625) 18.982 6.857 ( -9.985 2.719 -12.934) 16.565 7.279 ( 2.091 -1.215 2.188) 3.261 7.397 ( -7.583 -3.413 -9.055) 12.294 8.015 ( 5.733 -4.207 12.454) 14.341 8.206 ( -4.232 -1.600 -6.072) 7.573 8.613 ( 1.265 1.664 2.635) 3.363 8.711 ( -1.622 0.598 -7.007) 7.217 8.989 ( 1.862 -12.269 3.069) 12.784 9.050 ( -4.039 -14.045 -2.993) 14.918 9.429 ( 1.283 -1.992 5.014) 5.546 9.524 ( 1.334 0.344 -4.364) 4.576 10.574 ( 4.835 -3.268 1.126) 5.944 10.597 ( -4.646 -1.123 -1.225) 4.934 11.006 ( -0.516 -5.299 12.418) 13.511 11.242 ( 4.141 -8.226 -11.822) 14.986 11.702 ( 3.431 0.422 5.162) 6.212 11.799 ( -4.762 1.473 -4.724) 6.867 12.122 ( -4.242 7.434 8.411) 12.000 12.286 ( -7.001 8.358 -7.105) 13.013 12.462 ( 0.833 -12.031 2.729) 12.365 12.551 ( 8.858 -15.234 -5.115) 18.349 13.168 ( -1.109 4.323 1.174) 4.614 13.190 ( 1.848 1.146 -1.189) 2.478 14.089 ( -6.396 -3.653 9.932) 12.365 14.257 ( 2.944 -4.645 -7.518) 9.314 14.381 ( 1.130 3.798 10.419) 11.147 14.547 ( -2.398 -0.296 -6.699) 7.121 15.342 ( 0.660 0.336 6.722) 6.762 15.464 ( 2.451 -0.526 -3.825) 4.573 15.493 ( 2.790 15.195 5.456) 16.384 15.650 ( -1.104 14.635 -8.496) 16.959 16.588 ( -2.053 -2.805 7.148) 7.948 16.717 ( 1.260 -7.018 -6.215) 9.459 17.776 ( -5.019 -5.319 0.757) 7.352 17.823 ( 4.383 -5.119 -4.059) 7.867 18.726 ( -11.356 2.706 6.863) 13.542 18.851 ( 11.522 4.177 -6.026) 13.657 20.923 ( 4.884 -4.317 8.402) 10.634 21.069 ( -4.812 -0.674 -6.756) 8.322 21.490 ( -1.323 2.300 -0.598) 2.720 21.496 ( 3.083 2.377 -1.057) 4.034 25.172 ( 1.369 2.730 2.331) 3.842 25.218 ( -1.520 1.849 -2.378) 3.374 29.015 ( -2.626 2.295 2.796) 4.470 29.065 ( 2.736 2.252 -2.454) 4.310 34.433 ( 17.494 0.762 6.548) 18.695 34.546 ( -24.705 -1.893 -4.880) 25.254 37.658 ( -1.522 1.818 2.980) 3.809 37.725 ( -0.197 1.277 -3.884) 4.093 40.752 ( -14.102 -0.421 5.034) 14.980 40.848 ( 14.652 0.959 -4.784) 15.443 41.789 ( -4.686 0.952 9.940) 11.030 42.007 ( 10.824 6.714 -13.197) 18.341 ======================= Grid point 346 (178/205) ======================= q-point: ( 0.22 0.22 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.880 ( -11.784 -0.000 -31.822) 33.934 3.438 ( 8.557 0.000 -35.860) 36.866 3.896 ( 9.730 0.000 20.469) 22.664 4.268 ( -2.284 -0.000 1.849) 2.939 4.640 ( 13.927 0.000 21.412) 25.543 5.020 ( 12.436 0.000 -4.182) 13.121 5.124 ( -20.718 -0.000 -0.629) 20.728 5.858 ( 21.504 0.000 5.780) 22.267 5.899 ( 13.917 0.000 1.311) 13.978 6.240 ( 23.398 0.000 -13.489) 27.008 6.445 ( -6.377 -0.000 -0.580) 6.403 6.447 ( -6.334 -0.000 -15.529) 16.771 6.558 ( -5.652 -0.000 5.563) 7.930 6.630 ( -1.247 -0.000 14.964) 15.016 7.192 ( -3.829 -0.000 14.947) 15.429 7.476 ( 1.441 0.000 22.625) 22.670 7.702 ( 0.794 0.000 -10.059) 10.090 8.021 ( -17.327 -0.000 -7.200) 18.763 8.578 ( 8.798 0.000 -0.359) 8.806 8.772 ( -8.731 -0.000 8.764) 12.371 9.079 ( -6.238 -0.000 2.658) 6.781 9.216 ( -1.045 -0.000 1.963) 2.224 9.424 ( -2.650 -0.000 0.060) 2.651 9.480 ( 8.676 0.000 -15.391) 17.668 10.342 ( -6.667 -0.000 -0.102) 6.668 10.585 ( -1.305 -0.000 2.455) 2.781 11.068 ( -5.665 -0.000 8.881) 10.534 11.225 ( -3.864 -0.000 -8.133) 9.004 11.434 ( -11.190 -0.000 -3.959) 11.870 11.517 ( -9.719 -0.000 -1.543) 9.840 11.679 ( -7.308 -0.000 -3.420) 8.068 11.884 ( 1.417 0.000 6.350) 6.506 12.255 ( 0.036 0.000 -9.870) 9.870 13.134 ( 11.018 0.000 7.169) 13.145 13.429 ( -3.889 -0.000 -4.657) 6.067 13.892 ( 15.168 0.000 0.476) 15.176 14.106 ( -0.329 -0.000 -9.672) 9.678 14.262 ( -13.902 -0.000 1.770) 14.014 14.399 ( -3.819 -0.000 10.661) 11.324 14.700 ( 7.965 0.000 7.381) 10.859 15.129 ( 2.443 0.000 5.672) 6.175 15.156 ( -3.747 -0.000 -2.205) 4.347 15.354 ( 7.198 0.000 -8.828) 11.391 16.246 ( 22.316 0.000 -4.231) 22.713 16.556 ( -5.545 -0.000 13.370) 14.475 17.065 ( 2.111 0.000 -0.782) 2.251 17.656 ( 0.740 0.000 -8.490) 8.522 17.703 ( -5.924 -0.000 2.729) 6.522 18.246 ( -9.114 -0.000 -0.785) 9.148 18.810 ( -4.426 -0.000 0.471) 4.451 20.778 ( -7.960 -0.000 3.795) 8.819 20.809 ( -1.671 -0.000 -11.121) 11.246 21.549 ( 0.740 0.000 2.134) 2.258 21.720 ( 6.504 0.000 -6.180) 8.972 25.138 ( 2.766 0.000 -3.804) 4.704 25.219 ( -0.432 -0.000 4.871) 4.890 28.943 ( -1.071 -0.000 2.686) 2.892 29.093 ( 1.297 0.000 -2.822) 3.106 34.030 ( 7.756 0.000 -1.557) 7.911 35.574 ( -1.642 -0.000 20.970) 21.034 37.688 ( 1.701 0.000 -1.725) 2.423 37.882 ( 6.293 0.000 12.399) 13.905 40.264 ( -4.239 -0.000 4.159) 5.939 41.194 ( -1.268 -0.000 2.298) 2.625 41.321 ( 7.990 0.000 -2.568) 8.392 42.669 ( 12.253 0.000 -23.870) 26.831 ======================= Grid point 347 (179/205) ======================= q-point: ( 0.33 0.22 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.701 ( 4.653 -1.827 -25.366) 25.854 3.511 ( 5.161 -9.663 -20.792) 23.501 4.069 ( 9.015 -0.429 7.887) 11.986 4.308 ( -5.697 -8.884 -3.702) 11.184 4.757 ( -11.720 6.197 6.957) 14.972 4.935 ( 1.216 -2.461 8.159) 8.608 5.126 ( 1.811 -0.834 3.698) 4.201 5.889 ( -4.960 8.635 -4.198) 10.807 6.057 ( 17.192 5.132 0.305) 17.944 6.122 ( 2.983 9.511 -10.610) 14.558 6.361 ( -6.583 5.081 8.096) 11.606 6.562 ( -3.344 -5.042 4.622) 7.613 6.602 ( 18.762 -0.959 -7.375) 20.182 6.745 ( 8.021 -3.957 9.906) 13.346 7.138 ( -14.882 -2.692 13.190) 20.067 7.587 ( -9.097 -4.084 7.005) 12.186 7.777 ( 16.241 1.237 -3.189) 16.598 7.872 ( -2.104 -3.449 2.684) 4.850 8.629 ( -4.782 4.298 2.851) 7.033 8.753 ( 3.263 -4.822 -0.827) 5.881 8.937 ( -8.463 5.561 0.748) 10.154 9.228 ( -1.429 -1.281 0.146) 1.925 9.335 ( 2.676 5.914 0.434) 6.506 9.559 ( 8.840 -0.131 -12.260) 15.115 10.276 ( -2.197 1.267 1.795) 3.107 10.596 ( -2.326 -1.529 4.071) 4.931 10.980 ( -6.122 5.814 1.121) 8.517 11.090 ( -10.719 0.120 -7.569) 13.122 11.233 ( -6.044 3.415 -3.097) 7.602 11.440 ( -2.069 4.504 1.034) 5.063 11.662 ( -1.938 -8.161 -3.765) 9.194 11.986 ( -0.846 -5.433 7.936) 9.655 12.242 ( 2.909 -0.247 -10.770) 11.159 13.271 ( 0.307 1.214 8.170) 8.265 13.358 ( 3.799 0.964 1.538) 4.210 13.927 ( -6.311 1.133 -5.795) 8.642 14.042 ( -1.478 2.565 -2.048) 3.600 14.225 ( -2.053 -5.291 -5.291) 7.759 14.365 ( -4.524 1.550 8.021) 9.339 14.794 ( -0.591 -3.142 6.371) 7.128 15.059 ( -0.042 3.647 -1.157) 3.826 15.223 ( 0.832 -0.725 6.480) 6.574 15.473 ( 11.429 -4.399 -7.784) 14.511 16.429 ( 1.252 -2.861 -1.777) 3.593 16.570 ( 12.948 5.712 10.788) 17.795 17.053 ( 3.202 4.922 0.260) 5.878 17.583 ( 2.421 4.763 -5.299) 7.525 17.711 ( -1.470 -3.030 -0.724) 3.444 18.126 ( -7.003 1.254 -2.331) 7.487 18.803 ( -8.214 -7.084 2.082) 11.045 20.628 ( -3.620 4.440 -2.122) 6.109 20.868 ( -4.224 -9.749 -5.400) 11.918 21.561 ( 0.621 0.470 2.375) 2.499 21.752 ( 4.382 1.010 -6.081) 7.563 25.161 ( 3.782 0.154 -3.758) 5.334 25.239 ( -1.020 -1.060 4.737) 4.960 28.946 ( -1.126 -0.738 2.724) 3.038 29.105 ( 0.127 -1.635 -2.652) 3.118 34.151 ( 12.021 -0.794 -2.610) 12.327 35.509 ( -10.503 6.622 14.811) 19.327 37.706 ( 2.697 0.316 -1.226) 2.979 37.983 ( 2.662 0.805 11.615) 11.943 40.274 ( 1.977 -0.565 5.620) 5.985 41.190 ( 0.926 4.153 7.844) 8.923 41.433 ( 6.426 -4.563 -1.373) 8.000 42.688 ( 7.536 -0.184 -25.725) 26.807 ======================= Grid point 348 (180/205) ======================= q-point: ( 0.44 0.22 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.863 ( 11.329 -12.378 -9.321) 19.195 3.656 ( 0.494 -10.959 -6.212) 12.607 4.091 ( -14.953 -1.854 -7.812) 16.972 4.321 ( 9.467 8.418 1.375) 12.743 4.541 ( -16.354 -5.353 -8.751) 19.305 4.954 ( -2.164 8.048 14.560) 16.776 5.115 ( -10.868 -1.331 -2.187) 11.165 5.671 ( -3.068 4.552 -3.911) 6.740 6.083 ( 9.516 4.745 1.516) 10.741 6.131 ( 9.638 9.344 -0.399) 13.429 6.182 ( -1.419 8.178 9.543) 12.648 6.636 ( -0.939 -7.060 6.340) 9.535 6.738 ( 5.500 0.028 7.899) 9.626 7.006 ( 13.899 -7.408 -0.981) 15.780 7.118 ( -7.073 -5.168 3.093) 9.290 7.495 ( -7.610 -2.255 -3.605) 8.718 7.877 ( 8.510 4.948 -6.268) 11.670 8.037 ( 3.331 -6.384 10.499) 12.731 8.426 ( -6.933 11.696 1.793) 13.715 8.716 ( 3.371 9.810 -7.678) 12.906 8.926 ( 2.143 -2.823 6.766) 7.638 9.223 ( -0.971 -1.801 -1.605) 2.601 9.351 ( 2.969 -2.661 1.280) 4.187 9.560 ( 4.356 4.748 -10.365) 12.205 10.272 ( 1.181 -0.290 1.476) 1.913 10.590 ( -3.982 -1.046 2.733) 4.942 10.801 ( -4.110 6.314 -3.924) 8.495 10.972 ( -2.781 0.847 -3.792) 4.778 11.196 ( -3.775 -5.535 -0.261) 6.705 11.362 ( -0.906 1.769 0.333) 2.016 11.812 ( 6.757 -7.243 -2.277) 10.164 12.040 ( -2.590 -0.365 4.089) 4.854 12.250 ( 3.105 -1.004 -5.478) 6.376 13.188 ( -5.872 3.125 5.182) 8.432 13.486 ( 4.228 -1.899 9.500) 10.570 13.767 ( -11.322 1.052 -5.077) 12.452 13.938 ( -13.252 -1.881 -5.599) 14.509 14.233 ( 3.946 3.114 -5.649) 7.562 14.333 ( -3.290 -0.168 4.188) 5.328 14.805 ( -8.136 -1.001 3.065) 8.752 15.065 ( 4.952 -1.619 -0.921) 5.290 15.240 ( -1.220 1.190 11.728) 11.851 15.661 ( 13.994 -3.264 -7.585) 16.249 16.415 ( -7.484 -2.176 6.210) 9.966 16.682 ( 15.934 8.851 1.363) 18.278 17.016 ( 4.974 5.003 -1.331) 7.179 17.537 ( 3.782 3.631 -3.677) 6.404 17.705 ( -1.334 2.506 -1.687) 3.303 18.092 ( 2.147 -4.265 -3.190) 5.742 18.832 ( -11.665 -9.362 3.716) 15.412 20.553 ( -1.165 0.941 -0.304) 1.529 20.947 ( -5.626 -9.863 -5.617) 12.668 21.570 ( 0.689 0.623 2.585) 2.747 21.745 ( 2.450 2.014 -5.300) 6.176 25.191 ( 3.937 0.295 -2.757) 4.815 25.264 ( -0.971 -1.385 3.436) 3.830 28.963 ( -0.680 -1.508 2.458) 2.963 29.121 ( -1.130 -2.167 -1.934) 3.117 34.296 ( 13.121 0.374 -2.842) 13.431 35.283 ( -13.573 8.570 8.729) 18.272 37.729 ( 3.527 0.968 -1.183) 3.844 38.000 ( -1.666 2.267 7.225) 7.753 40.368 ( 7.408 -0.957 6.666) 10.012 41.137 ( -1.529 5.880 8.449) 10.407 41.583 ( 5.464 -4.193 3.090) 7.549 42.649 ( 2.890 0.412 -24.946) 25.117 ======================= Grid point 349 (181/205) ======================= q-point: ( 0.56 0.22 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.122 ( -2.367 -9.581 4.896) 11.016 3.776 ( -14.578 -0.857 -3.609) 15.043 3.882 ( 3.746 -5.176 -5.285) 8.292 4.168 ( -3.498 15.209 -5.353) 16.498 4.456 ( -12.223 -5.005 -3.578) 13.684 4.836 ( 1.005 6.358 -3.634) 7.392 4.935 ( -13.992 0.243 4.235) 14.621 5.576 ( -12.740 -3.506 -4.133) 13.845 6.047 ( 18.373 14.902 7.964) 24.961 6.122 ( -1.777 -1.880 13.356) 13.604 6.291 ( 18.224 3.005 0.341) 18.473 6.720 ( 4.450 4.988 10.686) 12.604 6.929 ( 0.205 -8.855 6.955) 11.262 7.091 ( -1.457 -5.457 -3.946) 6.890 7.253 ( 6.250 -7.149 0.380) 9.503 7.472 ( -3.819 -3.925 -1.734) 5.744 7.808 ( 0.965 4.501 -10.623) 11.578 8.084 ( -6.262 2.320 -5.653) 8.749 8.275 ( 3.270 3.657 10.490) 11.580 8.547 ( 6.132 14.503 -9.263) 18.269 8.965 ( -0.500 2.570 7.244) 7.703 9.256 ( 1.178 -1.881 1.758) 2.831 9.424 ( -1.623 5.997 -12.039) 13.547 9.481 ( 2.437 -5.297 -0.176) 5.833 10.310 ( 1.761 -1.595 0.795) 2.506 10.575 ( -1.604 -0.828 -0.683) 1.930 10.691 ( 0.365 2.551 -1.243) 2.862 10.947 ( -0.978 -0.161 0.337) 1.047 11.299 ( -1.376 -10.929 0.036) 11.015 11.391 ( 2.584 -4.188 -0.615) 4.959 11.991 ( 3.368 -2.284 -2.178) 4.615 12.027 ( 11.635 1.576 -0.064) 11.742 12.289 ( 0.541 -1.472 0.644) 1.695 13.090 ( -6.642 3.416 5.326) 9.174 13.443 ( -18.354 0.213 2.604) 18.539 13.649 ( -6.875 2.710 -2.951) 7.957 13.819 ( -4.117 -3.289 0.572) 5.301 14.194 ( 2.924 3.307 -8.201) 9.314 14.326 ( -2.532 -1.901 3.468) 4.696 14.674 ( -12.702 1.805 2.589) 13.088 15.186 ( 8.600 -2.774 -0.418) 9.046 15.272 ( -2.322 -1.122 13.243) 13.491 15.836 ( 15.754 -0.112 -6.591) 17.078 16.397 ( -7.075 -3.744 4.881) 9.375 16.651 ( 9.213 13.401 -0.109) 16.262 16.969 ( 0.387 6.289 -2.448) 6.760 17.516 ( 4.035 2.760 -4.113) 6.389 17.634 ( -0.303 1.749 -2.380) 2.969 18.280 ( 12.588 -8.348 -3.280) 15.457 18.843 ( -13.849 -8.720 5.204) 17.173 20.563 ( 0.837 -1.529 3.679) 4.071 20.996 ( -6.721 -8.474 -6.929) 12.845 21.577 ( 0.526 0.704 2.650) 2.792 21.706 ( 1.008 2.980 -4.250) 5.288 25.221 ( 3.296 0.400 -1.100) 3.498 25.284 ( -0.532 -0.983 1.414) 1.803 28.998 ( 0.378 -1.948 1.984) 2.806 29.128 ( -2.106 -1.724 -0.947) 2.882 34.411 ( 12.405 3.220 -2.102) 12.988 35.018 ( -14.229 6.837 4.571) 16.435 37.746 ( 3.739 1.832 -1.079) 4.302 37.943 ( -4.093 2.625 2.499) 5.467 40.521 ( 11.519 -0.815 5.702) 12.878 41.043 ( -4.771 5.165 7.599) 10.353 41.704 ( 4.268 -1.315 6.783) 8.121 42.543 ( -1.473 2.031 -23.077) 23.213 ======================= Grid point 350 (182/205) ======================= q-point: (-0.33 0.22 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.150 ( -8.205 -2.230 10.302) 13.358 3.562 ( -10.544 0.607 -7.882) 13.178 3.788 ( -1.999 18.269 -1.960) 18.482 3.975 ( -8.418 4.803 -4.965) 10.889 4.371 ( -12.948 -2.266 17.298) 21.726 4.791 ( 2.202 -4.316 -21.084) 21.634 4.939 ( 7.780 -5.097 8.457) 12.571 5.507 ( -13.529 -11.477 -10.117) 20.423 6.070 ( 11.532 10.416 10.653) 18.841 6.288 ( 14.415 -1.891 7.928) 16.560 6.355 ( 8.919 13.348 1.555) 16.129 6.633 ( -5.768 7.674 15.642) 18.353 6.935 ( 6.412 3.435 1.832) 7.501 7.259 ( -0.933 5.170 -4.322) 6.803 7.456 ( -1.510 -20.605 3.560) 20.965 7.505 ( 1.312 -2.034 6.531) 6.965 7.721 ( -6.546 -2.556 -9.708) 11.984 7.962 ( -2.786 -3.942 -14.539) 15.319 8.301 ( 1.118 2.475 1.338) 3.027 8.361 ( 4.931 10.428 -7.581) 13.803 8.925 ( -0.452 3.813 5.839) 6.989 9.215 ( -4.599 8.163 -9.910) 13.638 9.324 ( 3.355 -1.138 6.819) 7.684 9.568 ( 0.123 -3.312 -5.210) 6.175 10.371 ( 3.335 -1.985 1.503) 4.162 10.574 ( -3.229 -3.083 -4.046) 6.025 10.725 ( 5.942 -1.080 4.266) 7.395 10.945 ( -1.406 -1.846 -0.200) 2.329 11.474 ( 0.293 -10.485 0.679) 10.512 11.535 ( 0.908 -10.746 -0.572) 10.800 12.024 ( 5.820 -0.344 -0.263) 5.836 12.196 ( 8.426 -0.838 -3.853) 9.303 12.311 ( 6.944 2.715 4.473) 8.694 12.905 ( -16.050 6.530 -0.072) 17.328 13.248 ( -9.063 0.956 3.258) 9.678 13.457 ( -10.735 3.569 -3.636) 11.883 13.908 ( 2.480 -3.675 5.726) 7.242 14.139 ( -0.936 0.486 -7.812) 7.883 14.369 ( 1.385 -2.448 3.190) 4.253 14.520 ( -10.047 0.609 2.494) 10.370 15.302 ( -4.748 -1.466 13.147) 14.055 15.327 ( 8.074 -2.076 -2.139) 8.607 15.983 ( 16.980 3.790 -3.493) 17.745 16.381 ( -10.218 -3.111 -3.154) 11.137 16.517 ( 9.600 13.912 1.711) 16.989 16.778 ( -8.197 9.701 -0.913) 12.734 17.549 ( 7.257 -1.199 -5.397) 9.122 17.622 ( -2.399 -2.238 -1.778) 3.732 18.573 ( 15.359 -7.579 -2.433) 17.299 18.821 ( -13.411 -6.539 4.729) 15.652 20.645 ( 2.155 -3.257 8.798) 9.626 21.005 ( -6.193 -6.480 -9.062) 12.746 21.577 ( -0.030 1.129 2.306) 2.568 21.647 ( 0.543 3.493 -3.222) 4.783 25.243 ( 1.599 0.617 0.914) 1.943 25.290 ( 0.135 0.132 -0.915) 0.934 29.045 ( 1.506 -1.567 1.426) 2.599 29.117 ( -2.487 -0.644 -0.155) 2.573 34.472 ( 11.622 5.971 -0.237) 13.068 34.776 ( -14.583 3.825 1.522) 15.153 37.748 ( 2.655 2.507 0.105) 3.653 37.854 ( -4.141 2.316 -1.276) 4.913 40.697 ( 13.158 -0.385 2.874) 13.474 40.925 ( -7.312 3.820 5.674) 10.012 41.788 ( 3.379 0.591 11.242) 11.754 42.372 ( -3.430 4.143 -22.094) 22.739 ======================= Grid point 351 (183/205) ======================= q-point: (-0.22 0.22 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.184 ( 9.658 4.679 15.931) 19.208 3.434 ( -12.986 -1.793 3.505) 13.570 3.557 ( -7.055 3.501 -2.701) 8.326 3.728 ( -3.005 4.220 -10.567) 11.768 4.320 ( -4.291 3.596 22.322) 23.014 4.800 ( 9.937 1.854 -26.046) 27.939 5.292 ( 13.254 -13.528 10.126) 21.476 5.500 ( -13.791 -12.158 -10.577) 21.210 5.955 ( -4.268 19.783 12.626) 23.853 6.158 ( 11.117 13.668 -8.301) 19.476 6.549 ( -2.740 -0.828 16.069) 16.322 6.614 ( 16.990 1.478 10.618) 20.089 6.956 ( 6.042 4.016 -5.296) 8.982 6.976 ( -15.497 8.664 -9.423) 20.101 7.452 ( 0.507 6.998 4.635) 8.410 7.548 ( -8.711 7.471 -7.560) 13.742 7.829 ( 0.955 -10.652 10.094) 14.706 8.058 ( -4.951 -18.487 -10.992) 22.070 8.268 ( 3.086 1.551 -0.006) 3.454 8.373 ( 1.360 -11.591 -7.820) 14.048 8.905 ( 2.486 2.496 3.949) 5.291 9.010 ( -3.429 6.727 -6.536) 9.987 9.413 ( 4.187 -0.422 7.100) 8.253 9.555 ( -0.856 0.414 -7.554) 7.613 10.469 ( 4.646 -2.959 3.423) 6.486 10.544 ( -6.433 -2.342 -4.277) 8.072 10.852 ( 2.751 -3.522 7.791) 8.982 10.994 ( 1.424 -6.420 -6.685) 9.377 11.628 ( -0.984 -7.365 4.854) 8.876 11.695 ( -2.427 -9.425 -1.934) 9.923 12.113 ( -9.061 -5.998 4.935) 11.935 12.180 ( 0.315 -1.799 -2.306) 2.942 12.434 ( 12.486 7.680 5.238) 15.566 12.583 ( -3.617 7.223 -10.034) 12.882 13.229 ( 3.971 1.596 4.551) 6.247 13.294 ( -5.246 2.977 -2.425) 6.501 13.978 ( -5.758 -2.788 8.659) 10.766 14.128 ( 2.040 -2.958 -6.905) 7.784 14.432 ( 1.846 -0.284 4.413) 4.792 14.477 ( -0.249 -2.958 -0.573) 3.024 15.306 ( -5.051 -1.314 9.734) 11.045 15.426 ( 6.144 -1.081 -2.431) 6.695 16.033 ( 11.060 13.716 1.067) 17.652 16.151 ( -8.151 10.838 -10.973) 17.444 16.538 ( 0.258 0.710 2.084) 2.217 16.552 ( -1.023 2.410 0.621) 2.691 17.617 ( -6.403 -4.048 -0.410) 7.586 17.659 ( 6.182 -4.372 -4.733) 8.930 18.719 ( -13.418 -3.777 8.728) 16.446 18.875 ( 14.015 -3.390 -7.407) 16.210 20.773 ( -0.186 -5.001 12.588) 13.546 20.997 ( -1.116 -3.866 -10.626) 11.362 21.555 ( -0.896 1.987 1.412) 2.597 21.593 ( 1.327 3.018 -2.540) 4.162 25.239 ( -1.609 0.822 1.963) 2.668 25.278 ( 1.700 1.819 -2.114) 3.266 29.070 ( -1.952 0.565 2.321) 3.085 29.106 ( 1.815 -0.083 -1.316) 2.244 34.507 ( 1.159 4.055 4.275) 6.005 34.571 ( -3.416 3.727 -2.122) 5.483 37.722 ( -1.848 2.323 2.615) 3.956 37.782 ( 0.536 2.245 -3.579) 4.259 40.765 ( -11.274 1.355 7.346) 13.524 40.884 ( 14.573 1.482 -4.952) 15.462 41.835 ( -5.411 1.241 15.869) 16.812 42.202 ( 6.238 5.140 -22.370) 23.785 ======================= Grid point 352 (184/205) ======================= q-point: (-0.11 0.22 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.278 ( -7.727 1.896 -13.354) 15.545 3.303 ( 6.469 5.506 18.882) 20.705 3.551 ( 6.477 -6.845 17.045) 19.476 3.830 ( 4.154 -12.339 0.125) 13.020 4.373 ( 6.249 1.499 16.868) 18.050 4.756 ( 18.317 9.920 -30.163) 36.657 5.460 ( -11.553 -5.293 -1.341) 12.779 5.614 ( -4.930 10.595 6.609) 13.425 5.681 ( 9.587 -4.069 11.624) 15.608 5.957 ( 8.498 22.141 -21.105) 31.747 6.446 ( -19.860 -3.904 3.974) 20.627 6.728 ( -3.144 4.807 3.233) 6.591 6.834 ( 8.436 2.849 9.735) 13.193 6.879 ( 1.817 6.911 -19.075) 20.369 7.322 ( -5.683 4.682 -1.355) 7.487 7.365 ( 4.998 6.755 8.479) 11.937 7.944 ( -7.937 -5.439 7.673) 12.307 8.160 ( 1.443 -3.646 -8.966) 9.786 8.440 ( -4.964 -20.159 6.664) 21.805 8.590 ( 0.892 -10.844 -6.388) 12.618 8.884 ( 0.080 0.269 1.285) 1.315 8.958 ( 5.455 0.167 -1.086) 5.564 9.458 ( -0.110 2.866 2.156) 3.588 9.517 ( 1.624 -1.107 -5.199) 5.558 10.476 ( -8.119 -2.455 -2.952) 8.981 10.582 ( 2.837 -3.276 3.545) 5.599 10.945 ( -2.795 -5.332 5.054) 7.860 11.109 ( 2.956 -7.822 -9.359) 12.550 11.689 ( -8.803 -1.953 8.164) 12.164 11.715 ( -6.060 -3.097 -2.979) 7.429 12.030 ( -21.330 2.968 4.982) 22.105 12.108 ( -6.887 -4.983 3.112) 9.052 12.494 ( 7.260 -3.988 -7.330) 11.061 12.677 ( 26.774 1.986 -2.661) 26.980 13.196 ( 0.056 5.154 -0.798) 5.215 13.307 ( 9.554 1.587 2.545) 10.014 13.972 ( -7.348 -4.096 9.463) 12.662 14.204 ( 2.065 -4.730 -2.227) 5.621 14.498 ( 2.617 -1.870 -0.830) 3.322 14.518 ( 5.992 2.316 1.764) 6.662 15.305 ( -4.578 -1.846 3.330) 5.954 15.511 ( 6.257 -0.810 1.956) 6.606 15.751 ( -7.873 16.046 -8.075) 19.613 15.874 ( 1.422 16.414 -4.174) 16.996 16.493 ( -3.983 -3.034 2.162) 5.454 16.694 ( 9.869 -3.989 0.536) 10.658 17.600 ( -8.918 -5.426 0.972) 10.484 17.775 ( 2.679 -4.982 -3.301) 6.550 18.608 ( -14.984 -0.851 6.310) 16.281 19.017 ( 11.155 2.178 -6.101) 12.899 20.834 ( -8.745 -4.862 3.399) 10.568 21.065 ( 8.476 -1.572 -1.247) 8.711 21.505 ( -1.359 2.540 0.083) 2.882 21.570 ( 3.032 1.813 -2.558) 4.361 25.198 ( -2.601 1.247 0.091) 2.886 25.257 ( 1.616 2.801 -0.123) 3.236 29.026 ( -2.649 1.814 2.221) 3.904 29.124 ( 3.138 1.428 -1.789) 3.885 34.308 ( -14.855 3.582 0.227) 15.283 34.690 ( 17.329 -0.244 6.099) 18.372 37.672 ( -2.308 1.288 2.711) 3.786 37.758 ( 2.634 2.434 -1.357) 3.834 40.613 ( -13.596 1.210 4.627) 14.413 41.020 ( 14.581 1.189 -6.112) 15.855 41.688 ( -17.382 3.523 5.919) 18.697 42.250 ( 20.631 2.366 -12.950) 24.473 ======================= Grid point 356 (185/205) ======================= q-point: ( 0.33 0.33 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.690 ( 11.987 0.000 -16.874) 20.698 3.449 ( 11.016 0.000 -23.866) 26.286 4.097 ( -11.605 -0.000 0.813) 11.634 4.130 ( -6.556 -0.000 -2.879) 7.160 4.694 ( -2.061 -0.000 7.930) 8.193 5.078 ( 6.861 0.000 18.058) 19.318 5.116 ( -5.124 -0.000 3.073) 5.975 5.823 ( -9.050 -0.000 -17.496) 19.698 6.086 ( -13.338 -0.000 3.411) 13.767 6.200 ( 4.772 0.000 -17.926) 18.550 6.405 ( 4.316 0.000 7.417) 8.581 6.487 ( -2.829 -0.000 -0.674) 2.908 6.832 ( 2.675 0.000 19.086) 19.273 6.855 ( 10.204 0.000 2.021) 10.402 7.070 ( 3.461 0.000 12.931) 13.386 7.436 ( -6.982 -0.000 0.099) 6.983 7.909 ( 5.000 0.000 14.021) 14.885 7.985 ( 15.815 0.000 -5.598) 16.777 8.597 ( -2.046 -0.000 1.110) 2.328 8.813 ( 7.971 0.000 -2.264) 8.286 8.858 ( -8.398 -0.000 2.424) 8.741 9.206 ( -0.135 -0.000 -2.906) 2.909 9.395 ( -0.352 -0.000 1.426) 1.469 9.641 ( 10.927 0.000 -12.458) 16.571 10.273 ( -1.707 -0.000 4.232) 4.563 10.551 ( -6.238 -0.000 1.828) 6.501 10.910 ( -4.988 -0.000 -10.828) 11.922 11.002 ( -4.984 -0.000 5.276) 7.258 11.163 ( -8.797 -0.000 -4.318) 9.799 11.390 ( -11.975 -0.000 -8.667) 14.782 11.609 ( 11.455 0.000 2.197) 11.664 11.997 ( 0.729 0.000 10.897) 10.922 12.255 ( 6.123 0.000 -10.041) 11.761 13.260 ( -7.079 -0.000 5.615) 9.035 13.464 ( 6.999 0.000 9.751) 12.003 13.830 ( -19.218 -0.000 -4.230) 19.678 13.844 ( -6.924 -0.000 -6.945) 9.807 14.316 ( 9.618 0.000 -6.346) 11.523 14.346 ( -1.938 -0.000 5.059) 5.417 14.731 ( -6.498 -0.000 3.559) 7.409 15.071 ( -0.643 -0.000 -2.659) 2.736 15.244 ( -1.679 -0.000 9.025) 9.180 15.606 ( 18.087 0.000 -5.216) 18.824 16.363 ( -7.641 -0.000 3.883) 8.571 16.827 ( 15.551 0.000 7.299) 17.179 17.166 ( 6.813 0.000 -0.687) 6.848 17.634 ( -1.922 -0.000 2.915) 3.492 17.671 ( 5.994 0.000 -8.969) 10.788 18.055 ( -4.065 -0.000 -4.004) 5.706 18.637 ( -11.637 -0.000 3.665) 12.200 20.639 ( -6.882 -0.000 4.716) 8.343 20.697 ( 0.654 0.000 -13.318) 13.334 21.581 ( 0.397 0.000 3.148) 3.173 21.776 ( 2.484 0.000 -6.036) 6.528 25.199 ( 5.040 0.000 -4.888) 7.021 25.234 ( -1.960 -0.000 5.870) 6.189 28.937 ( -1.256 -0.000 3.120) 3.364 29.079 ( -0.447 -0.000 -3.047) 3.080 34.300 ( 15.680 0.000 -3.512) 16.069 35.442 ( -17.422 -0.000 11.248) 20.737 37.746 ( 4.259 0.000 -0.863) 4.346 38.045 ( -1.490 -0.000 10.356) 10.463 40.352 ( 7.347 0.000 7.730) 10.664 41.346 ( 5.323 0.000 18.297) 19.056 41.401 ( 0.770 0.000 -5.508) 5.561 42.652 ( 5.251 0.000 -29.405) 29.870 ======================= Grid point 357 (186/205) ======================= q-point: ( 0.44 0.33 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.861 ( 16.032 -4.635 -4.749) 17.351 3.529 ( 4.419 -5.189 -10.030) 12.126 3.914 ( -11.726 1.444 -2.802) 12.142 4.066 ( -17.280 -11.263 -9.069) 22.532 4.722 ( 14.784 12.753 0.910) 19.546 5.011 ( -11.602 3.666 7.992) 14.557 5.125 ( -1.110 6.461 11.023) 12.825 5.631 ( -6.558 3.952 -14.297) 16.218 5.936 ( -18.966 -6.243 13.806) 24.276 6.189 ( 1.132 -4.414 -15.227) 15.894 6.435 ( 6.470 1.435 -5.440) 8.574 6.549 ( 1.793 -5.374 7.582) 9.465 6.851 ( -6.104 -1.330 8.466) 10.521 6.941 ( 1.053 -2.414 7.836) 8.266 7.186 ( 13.051 6.419 4.981) 15.373 7.486 ( 9.579 0.766 1.891) 9.794 8.030 ( 3.489 5.017 -5.387) 8.146 8.035 ( 1.839 -2.036 11.464) 11.788 8.556 ( 0.243 8.913 1.531) 9.047 8.785 ( 2.900 -2.994 -5.901) 7.224 8.959 ( 6.676 -0.588 6.022) 9.010 9.197 ( 1.002 -0.795 -2.645) 2.938 9.385 ( 1.394 1.871 1.280) 2.661 9.652 ( 3.711 4.804 -10.276) 11.935 10.277 ( -1.087 -0.617 4.176) 4.359 10.476 ( -7.758 -2.612 -3.284) 8.820 10.842 ( 0.457 3.403 -3.181) 4.681 10.962 ( -2.873 0.482 1.299) 3.190 11.054 ( -5.613 -2.318 -3.331) 6.926 11.264 ( -9.202 -4.603 -6.333) 12.081 11.813 ( 13.442 -4.836 -1.397) 14.354 12.042 ( -2.013 -1.195 8.970) 9.270 12.305 ( 9.825 1.529 -5.465) 11.346 13.185 ( -6.401 2.084 6.376) 9.272 13.459 ( -18.303 0.754 7.076) 19.637 13.694 ( 2.796 0.384 -1.015) 2.999 13.740 ( -7.210 -1.325 -5.290) 9.040 14.286 ( -4.274 0.245 -1.700) 4.607 14.375 ( 6.558 5.025 -3.478) 8.964 14.678 ( -8.866 -1.904 0.876) 9.111 15.092 ( 5.211 -1.688 -1.340) 5.639 15.246 ( -5.046 -0.828 10.452) 11.636 15.811 ( 18.429 -0.716 -5.535) 19.255 16.293 ( -9.722 -2.031 5.201) 11.212 16.975 ( 11.241 5.101 4.650) 13.191 17.176 ( 5.488 6.812 -1.607) 8.894 17.613 ( 1.679 2.378 -0.800) 3.019 17.713 ( 1.106 0.298 -2.746) 2.975 18.055 ( 6.333 -3.665 -5.911) 9.407 18.556 ( -14.590 -6.963 4.510) 16.784 20.554 ( -2.982 1.467 1.842) 3.800 20.731 ( -1.954 -7.034 -9.032) 11.613 21.596 ( 0.270 0.369 3.798) 3.825 21.766 ( 0.851 0.864 -5.340) 5.476 25.227 ( 0.451 0.205 2.041) 2.100 25.250 ( 2.241 -0.927 -1.312) 2.757 28.945 ( -0.790 -1.020 3.101) 3.359 29.069 ( -1.066 -1.345 -2.811) 3.293 34.475 ( 16.957 0.965 -3.619) 17.366 35.222 ( -18.919 4.186 7.317) 20.712 37.794 ( 5.535 0.962 -0.786) 5.672 38.025 ( -4.847 1.824 6.790) 8.540 40.501 ( 11.352 -0.352 8.940) 14.454 41.266 ( -2.355 8.026 2.036) 8.609 41.570 ( 2.922 -6.502 14.400) 16.068 42.580 ( 2.928 0.488 -30.214) 30.359 ======================= Grid point 358 (187/205) ======================= q-point: ( 0.56 0.33 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.075 ( 4.816 -1.559 10.953) 12.066 3.598 ( -6.381 -4.126 -1.997) 7.857 3.780 ( -2.797 -2.683 -3.915) 5.509 4.074 ( -8.756 -15.161 -14.122) 22.493 4.570 ( 8.782 21.097 -3.544) 23.125 4.781 ( -15.876 7.269 1.437) 17.520 5.043 ( 3.779 7.911 8.976) 12.547 5.389 ( -11.689 4.085 -9.214) 15.435 6.050 ( -3.810 -13.988 16.691) 22.109 6.248 ( 2.650 -3.874 0.039) 4.694 6.546 ( 15.083 -0.292 -6.430) 16.399 6.673 ( -5.902 -7.284 2.633) 9.737 6.862 ( -4.097 -5.402 10.092) 12.158 7.046 ( 5.513 -5.491 -1.275) 7.885 7.252 ( 9.397 3.970 3.666) 10.840 7.488 ( 2.843 8.160 -3.361) 9.272 7.910 ( 1.018 8.478 -4.461) 9.634 8.041 ( -6.306 3.471 -0.287) 7.204 8.462 ( 4.600 7.077 8.875) 12.248 8.752 ( 2.405 8.818 -9.347) 13.073 9.053 ( 3.641 1.303 8.952) 9.752 9.248 ( 2.478 -2.915 0.241) 3.834 9.393 ( 1.070 -0.784 -3.757) 3.984 9.517 ( -1.659 6.920 -7.626) 10.430 10.303 ( 0.116 -1.932 2.904) 3.490 10.442 ( -5.782 -4.231 -3.081) 7.799 10.792 ( 3.654 3.290 -0.288) 4.925 10.934 ( -3.117 0.010 0.339) 3.136 11.106 ( -0.427 -8.993 -0.062) 9.003 11.263 ( -5.028 -8.089 -4.799) 10.666 11.995 ( 4.388 -2.267 0.149) 4.942 12.087 ( 1.179 -4.405 -0.164) 4.563 12.417 ( 18.429 3.213 1.328) 18.754 13.047 ( -17.644 2.669 0.691) 17.858 13.268 ( -8.715 0.967 7.355) 11.445 13.567 ( -9.034 2.908 -6.026) 11.242 13.832 ( 7.201 -1.339 6.657) 9.898 14.198 ( -4.979 1.592 -6.757) 8.543 14.365 ( 5.587 3.151 0.323) 6.423 14.560 ( -10.869 1.399 0.245) 10.962 15.222 ( 7.046 -4.036 -0.722) 8.153 15.248 ( -4.355 -2.037 8.976) 10.182 16.010 ( 16.738 -0.584 -4.661) 17.385 16.239 ( -10.259 -3.778 3.341) 11.432 16.956 ( 6.037 11.217 2.718) 13.025 17.087 ( 1.018 8.641 -2.562) 9.070 17.592 ( 2.996 2.856 -1.962) 4.581 17.655 ( -2.067 3.457 -1.631) 4.345 18.280 ( 14.331 -9.389 -4.170) 17.633 18.535 ( -14.978 -10.097 3.968) 18.495 20.549 ( -1.963 -2.311 6.184) 6.887 20.781 ( -1.801 -6.891 -10.219) 12.456 21.606 ( 0.062 0.674 4.124) 4.179 21.729 ( -0.312 1.646 -4.327) 4.639 25.233 ( -2.318 -0.770 4.827) 5.410 25.287 ( 4.048 -0.251 -4.487) 6.048 28.978 ( 0.258 -2.108 2.853) 3.557 29.070 ( -1.498 -1.817 -2.185) 3.212 34.627 ( 16.480 3.525 -2.856) 17.093 34.949 ( -17.574 5.426 4.434) 18.920 37.833 ( 5.714 2.451 -0.626) 6.249 37.940 ( -5.841 2.788 3.098) 7.176 40.687 ( 13.123 -0.136 8.164) 15.456 41.101 ( -5.885 6.673 -0.369) 8.905 41.737 ( 0.714 -3.611 18.245) 18.613 42.464 ( 0.686 1.793 -29.598) 29.661 ======================= Grid point 359 (188/205) ======================= q-point: (-0.33 0.33 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.130 ( 0.370 1.623 18.322) 18.397 3.448 ( -5.042 2.751 -12.835) 14.061 3.943 ( -0.508 -4.971 5.550) 7.468 4.082 ( 0.625 8.012 -6.623) 10.414 4.346 ( -3.192 10.243 13.589) 17.314 4.547 ( -11.855 -8.929 -9.968) 17.878 5.054 ( 6.916 1.236 4.403) 8.291 5.257 ( 4.852 0.338 -14.622) 15.410 6.265 ( 3.560 -2.005 8.934) 9.824 6.347 ( 0.678 -2.795 2.545) 3.840 6.592 ( -13.682 -0.025 6.645) 15.210 6.694 ( 13.790 2.681 -0.920) 14.078 7.026 ( -2.950 -10.144 13.252) 16.947 7.203 ( 4.108 1.163 6.294) 7.606 7.311 ( -3.896 -4.278 -11.071) 12.492 7.364 ( 5.300 -2.093 -7.844) 9.695 7.780 ( 2.111 9.288 0.378) 9.532 7.856 ( -6.128 3.693 -7.368) 10.270 8.415 ( 0.192 8.697 6.583) 10.909 8.560 ( 1.064 11.558 -9.137) 14.772 9.054 ( 2.846 6.338 9.234) 11.556 9.253 ( -3.730 5.882 -11.215) 13.202 9.360 ( 3.333 -1.044 5.595) 6.596 9.479 ( -0.810 -4.518 -6.390) 7.867 10.375 ( 2.644 -3.275 3.250) 5.318 10.431 ( -5.136 -4.003 -2.502) 6.976 10.826 ( 2.951 1.303 3.195) 4.540 10.889 ( -1.386 -0.706 -3.032) 3.408 11.290 ( 1.489 -10.970 3.193) 11.522 11.351 ( -2.914 -11.150 -3.544) 12.057 12.017 ( -7.971 -2.286 7.534) 11.203 12.163 ( 5.822 -1.442 -7.854) 9.882 12.635 ( 18.091 4.451 5.092) 19.314 12.732 ( -16.646 2.656 -5.057) 17.599 13.274 ( 4.545 1.359 8.008) 9.308 13.395 ( -5.997 3.710 -4.840) 8.553 13.938 ( 2.440 0.078 8.133) 8.491 14.092 ( -3.618 0.458 -7.458) 8.302 14.421 ( 5.465 0.431 1.315) 5.638 14.426 ( -5.179 0.407 0.381) 5.209 15.251 ( -6.186 -2.546 8.927) 11.155 15.365 ( 7.039 -2.978 -3.298) 8.324 16.144 ( -6.329 -2.839 2.170) 7.268 16.222 ( 8.462 -1.238 -5.721) 10.289 16.824 ( 2.261 12.618 2.857) 13.133 16.888 ( -1.964 13.087 -3.344) 13.649 17.571 ( -3.977 1.686 -0.714) 4.378 17.594 ( 3.828 0.645 -3.234) 5.053 18.497 ( -13.106 -9.446 7.788) 17.935 18.645 ( 14.189 -10.247 -7.550) 19.061 20.612 ( -4.279 -4.985 11.417) 13.172 20.837 ( 2.657 -5.782 -11.768) 13.378 21.606 ( -0.383 1.198 3.890) 4.088 21.677 ( -0.696 2.110 -3.322) 3.997 25.232 ( -3.389 -0.911 4.241) 5.504 25.314 ( 3.580 0.416 -4.289) 5.602 29.034 ( 0.570 -2.402 2.551) 3.550 29.074 ( -0.824 -1.606 -1.588) 2.404 34.671 ( -11.427 5.530 3.985) 13.306 34.739 ( 11.298 5.831 -2.882) 13.036 37.814 ( -3.823 3.381 3.048) 5.945 37.867 ( 3.511 3.027 -2.492) 5.263 40.830 ( 0.798 2.283 7.713) 8.083 40.955 ( 3.690 3.201 -5.008) 6.995 41.840 ( -3.786 -1.068 21.085) 21.448 42.323 ( 2.605 2.558 -28.328) 28.562 ======================= Grid point 360 (189/205) ======================= q-point: (-0.22 0.33 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.252 ( 6.140 -3.393 13.115) 14.873 3.416 ( 9.110 -2.354 -6.460) 11.413 3.743 ( -7.377 16.364 4.932) 18.615 3.867 ( 3.889 17.129 3.583) 17.926 4.384 ( 0.077 -2.757 20.205) 20.392 4.664 ( -3.627 -17.622 -14.145) 22.886 5.201 ( 5.208 -8.725 -10.780) 14.814 5.365 ( 18.410 -0.854 -1.771) 18.515 6.134 ( -10.959 11.813 3.299) 16.447 6.350 ( -3.328 0.732 -1.412) 3.689 6.462 ( -8.662 5.379 -3.277) 10.710 6.846 ( 13.780 -0.500 -1.484) 13.868 6.931 ( -13.042 6.174 1.631) 14.522 7.145 ( 1.249 9.382 3.621) 10.134 7.383 ( -6.792 -11.790 8.615) 16.104 7.572 ( 0.701 -8.338 -1.348) 8.476 7.719 ( 5.685 3.208 10.210) 12.118 7.780 ( -2.918 -5.433 -13.429) 14.777 8.280 ( -2.075 4.524 -0.358) 4.990 8.382 ( 1.923 7.835 -6.725) 10.503 9.035 ( 4.220 5.116 7.585) 10.075 9.070 ( -0.381 7.241 -8.464) 11.145 9.437 ( -0.363 -3.294 1.836) 3.789 9.517 ( 2.150 -2.044 -5.620) 6.355 10.404 ( -5.239 -2.838 -1.566) 6.161 10.493 ( 2.877 -2.301 3.887) 5.356 10.780 ( -7.843 -3.465 -0.823) 8.614 10.953 ( 5.504 -1.435 -1.498) 5.882 11.454 ( -3.630 -9.061 3.227) 10.281 11.522 ( -0.449 -11.687 0.207) 11.698 11.950 ( -10.077 -0.621 6.166) 11.830 12.158 ( -9.672 1.952 0.184) 9.868 12.439 ( -4.424 0.961 -7.405) 8.679 12.886 ( 21.933 6.006 0.894) 22.758 13.297 ( 3.507 2.003 -1.379) 4.268 13.375 ( 9.546 2.134 4.985) 10.979 13.918 ( -6.774 0.984 6.814) 9.659 14.077 ( 0.120 -2.594 -3.419) 4.293 14.399 ( 0.019 -3.141 -0.168) 3.146 14.542 ( 10.960 -0.087 0.643) 10.979 15.248 ( -5.772 -2.251 6.209) 8.772 15.458 ( 4.694 -2.129 -2.712) 5.825 16.002 ( -17.911 -0.117 -5.701) 18.797 16.337 ( 11.352 5.997 0.208) 12.841 16.566 ( -7.335 10.677 -2.113) 13.125 16.753 ( 8.344 8.943 1.271) 12.297 17.497 ( -6.444 -0.408 0.103) 6.458 17.637 ( 2.427 -2.668 -3.238) 4.848 18.480 ( -15.397 -7.132 6.309) 18.104 18.941 ( 14.709 -6.870 -6.830) 17.612 20.666 ( -7.942 -5.538 8.573) 12.933 20.957 ( 9.324 -5.020 -6.191) 12.266 21.585 ( -0.999 2.093 2.797) 3.634 21.627 ( -0.188 1.838 -2.484) 3.096 25.213 ( -3.723 -0.349 2.500) 4.498 25.322 ( 2.295 1.197 -2.779) 3.797 29.050 ( -2.093 -0.480 0.942) 2.345 29.116 ( 2.534 -1.828 0.015) 3.124 34.447 ( -12.527 4.536 2.174) 13.500 34.793 ( 13.927 6.473 -0.095) 15.359 37.725 ( -4.354 2.143 2.316) 5.377 37.857 ( 4.561 3.826 -1.487) 6.136 40.688 ( -12.028 3.485 2.946) 12.865 41.052 ( 13.680 0.923 -6.133) 15.020 41.795 ( -13.914 2.918 13.812) 19.821 42.293 ( 12.800 0.200 -17.515) 21.695 ======================= Grid point 361 (190/205) ======================= q-point: (-0.11 0.33 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.264 ( 0.510 11.754 -14.456) 18.639 3.556 ( 5.801 4.628 20.187) 21.507 3.708 ( 7.907 -9.974 2.002) 12.885 3.817 ( 23.340 4.608 14.876) 28.058 4.521 ( 4.535 -1.287 19.796) 20.350 4.844 ( -1.068 -14.912 -11.208) 18.685 5.271 ( 13.461 5.607 -25.527) 29.398 5.614 ( 0.887 -5.472 9.665) 11.142 5.850 ( -6.599 6.961 5.061) 10.845 6.039 ( -24.651 7.984 -11.882) 28.506 6.316 ( 4.277 5.784 -8.141) 10.864 6.763 ( -7.382 0.997 2.884) 7.988 6.899 ( 4.714 8.328 -17.531) 19.972 7.067 ( 1.665 5.901 6.826) 9.175 7.317 ( -8.392 4.403 8.615) 12.807 7.671 ( 12.344 7.564 10.780) 18.050 7.784 ( -10.894 -3.474 4.832) 12.414 7.882 ( -2.607 -17.791 -1.132) 18.016 8.284 ( 0.082 -3.270 0.312) 3.285 8.368 ( 0.767 -9.300 -6.704) 11.490 8.959 ( 2.743 4.894 -4.372) 7.113 9.063 ( 6.019 2.661 5.432) 8.533 9.463 ( 0.126 -1.491 -9.793) 9.907 9.537 ( 1.794 1.846 2.978) 3.937 10.354 ( -5.580 0.052 -2.236) 6.012 10.543 ( -3.040 -3.957 4.282) 6.576 10.799 ( -4.111 -6.763 -1.474) 8.050 11.026 ( 2.142 -3.717 -2.590) 5.011 11.508 ( -9.150 -5.363 3.823) 11.274 11.588 ( -11.032 -2.689 1.505) 11.455 11.884 ( -8.799 1.915 4.811) 10.209 12.018 ( -2.186 -4.551 0.070) 5.050 12.446 ( 0.404 -2.278 -6.225) 6.641 13.004 ( 16.111 4.445 -1.134) 16.751 13.341 ( 9.584 6.440 0.955) 11.586 13.485 ( 12.297 2.247 3.643) 13.020 13.888 ( -3.038 -2.960 8.577) 9.569 14.130 ( -0.284 -5.019 0.794) 5.089 14.478 ( 3.298 -2.928 -2.887) 5.271 14.667 ( 11.567 1.484 0.283) 11.665 15.224 ( -7.189 -1.534 2.035) 7.627 15.564 ( 7.119 -4.121 1.925) 8.448 15.701 ( -18.355 5.544 -11.373) 22.293 16.131 ( -4.548 17.251 0.585) 17.850 16.507 ( 5.012 1.711 0.148) 5.298 16.781 ( 7.657 0.864 1.258) 7.807 17.440 ( -6.417 -2.266 0.307) 6.812 17.700 ( -0.099 -4.713 -2.630) 5.398 18.413 ( -14.087 -3.856 4.404) 15.255 19.123 ( 8.908 -1.044 -5.282) 10.409 20.672 ( -7.552 -4.196 2.560) 9.011 21.140 ( 10.195 -3.445 0.257) 10.764 21.538 ( -1.357 3.089 1.471) 3.681 21.601 ( 1.086 0.532 -2.771) 3.023 25.179 ( -2.889 0.334 0.572) 2.964 25.309 ( 0.875 1.930 -0.787) 2.261 29.027 ( -1.848 0.815 1.250) 2.376 29.162 ( 2.378 -0.216 -0.570) 2.455 34.255 ( -8.228 4.912 0.962) 9.631 34.890 ( 12.716 1.104 4.002) 13.376 37.672 ( -2.003 0.834 2.151) 3.055 37.844 ( 3.704 3.487 0.661) 5.130 40.508 ( -11.607 2.532 2.368) 12.114 41.162 ( 11.945 0.394 -9.923) 15.534 41.584 ( -15.611 5.032 7.763) 18.146 42.432 ( 16.091 -1.111 -10.299) 19.137 ======================= Grid point 366 (191/205) ======================= q-point: ( 0.44 0.44 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.019 ( 15.877 0.000 0.006) 15.877 3.489 ( 2.674 0.000 -13.364) 13.629 3.760 ( -11.429 -0.000 -4.254) 12.195 3.801 ( -11.580 -0.000 2.107) 11.770 4.966 ( -9.643 -0.000 16.947) 19.499 5.072 ( 19.847 0.000 0.649) 19.858 5.160 ( -8.976 -0.000 7.974) 12.006 5.573 ( -2.588 -0.000 -15.826) 16.036 5.674 ( -17.721 -0.000 14.201) 22.709 6.017 ( -1.994 -0.000 -21.692) 21.784 6.399 ( -1.725 -0.000 -1.868) 2.543 6.586 ( 3.748 0.000 -6.117) 7.174 6.754 ( -5.894 -0.000 14.021) 15.209 7.001 ( 4.822 0.000 0.726) 4.876 7.476 ( 15.073 0.000 4.176) 15.640 7.620 ( 6.049 0.000 6.406) 8.811 8.062 ( -2.102 -0.000 9.734) 9.958 8.092 ( 2.385 0.000 -2.845) 3.712 8.662 ( -1.015 -0.000 -0.295) 1.057 8.757 ( 6.522 0.000 -2.178) 6.876 9.077 ( 7.141 0.000 5.264) 8.871 9.184 ( 0.075 0.000 -1.821) 1.823 9.431 ( 2.226 0.000 1.593) 2.737 9.673 ( -1.573 -0.000 -9.126) 9.261 10.264 ( -3.112 -0.000 5.572) 6.382 10.361 ( -3.819 -0.000 -4.700) 6.056 10.851 ( -2.597 -0.000 -2.011) 3.285 10.901 ( -4.704 -0.000 -1.836) 5.049 11.020 ( 3.285 0.000 -5.093) 6.060 11.071 ( -9.104 -0.000 -1.864) 9.293 11.937 ( 14.706 0.000 -6.083) 15.914 12.010 ( -6.848 -0.000 7.859) 10.424 12.476 ( 18.090 0.000 0.449) 18.096 13.086 ( -19.572 -0.000 0.146) 19.573 13.293 ( -8.438 -0.000 10.449) 13.431 13.616 ( -6.727 -0.000 -7.521) 10.090 13.813 ( 9.533 0.000 6.168) 11.355 14.218 ( -5.693 -0.000 -5.008) 7.582 14.472 ( 4.291 0.000 -3.519) 5.550 14.570 ( -7.379 -0.000 1.370) 7.506 15.146 ( 8.222 0.000 -2.400) 8.565 15.197 ( -7.844 -0.000 9.703) 12.477 15.995 ( 17.223 0.000 -6.079) 18.265 16.174 ( -11.026 -0.000 5.103) 12.149 17.140 ( 6.209 0.000 5.020) 7.985 17.282 ( 2.542 0.000 -2.391) 3.490 17.641 ( 0.288 0.000 2.407) 2.424 17.722 ( 0.801 0.000 -3.503) 3.594 18.110 ( 13.828 0.000 -8.068) 16.010 18.330 ( -16.638 -0.000 4.969) 17.364 20.520 ( -6.895 -0.000 6.295) 9.337 20.645 ( 3.710 0.000 -12.252) 12.801 21.617 ( -0.148 -0.000 4.844) 4.847 21.754 ( -0.415 -0.000 -4.755) 4.773 25.218 ( -3.509 -0.000 6.326) 7.234 25.281 ( 5.115 0.000 -5.768) 7.709 28.941 ( -0.468 -0.000 3.392) 3.424 29.036 ( -0.780 -0.000 -3.156) 3.251 34.684 ( 19.052 0.000 -3.777) 19.423 35.044 ( -20.263 -0.000 5.359) 20.959 37.876 ( 7.116 0.000 -0.605) 7.142 37.993 ( -6.915 -0.000 5.029) 8.550 40.686 ( 13.761 0.000 9.892) 16.947 41.252 ( -8.016 -0.000 -9.968) 12.792 41.637 ( 2.404 0.000 28.121) 28.224 42.492 ( 2.161 0.000 -32.319) 32.391 ======================= Grid point 367 (192/205) ======================= q-point: (-0.44 -0.56 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.191 ( 5.499 -2.057 11.061) 12.522 3.461 ( -6.311 -4.605 -13.995) 16.028 3.658 ( -7.238 -1.596 4.300) 8.569 3.780 ( 1.954 -6.800 -5.572) 9.006 4.794 ( -13.761 13.515 14.544) 24.157 4.926 ( -3.883 14.232 6.957) 16.310 5.286 ( 14.557 7.876 -2.501) 16.739 5.363 ( -0.922 5.697 -11.876) 13.204 5.760 ( -6.636 -18.101 19.048) 27.102 6.117 ( 4.223 -13.523 -13.244) 19.394 6.457 ( -0.470 -7.305 -2.455) 7.720 6.565 ( -0.447 -4.387 -10.267) 11.174 6.846 ( 5.227 -2.062 12.337) 13.556 7.035 ( 3.580 -0.329 -6.322) 7.272 7.523 ( 1.923 10.157 6.207) 12.058 7.618 ( 1.560 5.684 -3.360) 6.785 8.021 ( -5.124 3.510 4.106) 7.446 8.074 ( 4.097 6.449 -0.643) 7.668 8.632 ( 1.908 4.781 7.200) 8.851 8.783 ( -3.059 0.121 -7.865) 8.439 9.145 ( 4.207 0.247 5.505) 6.932 9.209 ( -0.569 -2.786 -2.147) 3.563 9.433 ( 0.781 3.545 3.188) 4.831 9.551 ( -4.509 5.024 -7.438) 10.044 10.268 ( -2.251 -2.607 5.176) 6.217 10.345 ( -0.089 -1.566 -2.875) 3.275 10.838 ( 2.021 -1.393 -0.116) 2.458 10.866 ( -2.768 -1.210 -2.517) 3.932 11.023 ( -3.432 -5.190 1.125) 6.323 11.084 ( 2.856 -3.422 -4.244) 6.154 11.949 ( -9.141 -1.376 6.287) 11.180 12.087 ( 11.703 -2.087 -8.886) 14.842 12.725 ( 23.329 1.402 4.224) 23.750 12.789 ( -25.148 0.986 -2.452) 25.286 13.314 ( 3.051 0.859 11.963) 12.376 13.500 ( -4.819 2.133 -7.405) 9.089 13.948 ( 8.167 0.218 7.922) 11.380 14.110 ( -7.297 0.222 -8.260) 11.024 14.476 ( -3.532 2.083 1.249) 4.287 14.490 ( 1.830 2.469 -0.455) 3.107 15.155 ( -8.181 -2.580 8.247) 11.899 15.262 ( 8.540 -2.555 -3.245) 9.486 16.067 ( -12.144 -1.470 4.102) 12.902 16.170 ( 14.638 -1.196 -6.788) 16.180 17.151 ( 1.312 6.414 3.795) 7.567 17.218 ( -0.461 7.151 -3.116) 7.814 17.649 ( 0.798 1.056 1.094) 1.717 17.681 ( -1.136 3.422 -1.916) 4.083 18.209 ( -14.756 -6.673 4.828) 16.899 18.328 ( 16.200 -7.198 -7.547) 19.267 20.486 ( -6.283 -2.356 8.385) 10.740 20.678 ( 4.609 -3.276 -11.129) 12.483 21.630 ( -0.570 0.366 5.471) 5.513 21.721 ( -1.270 0.690 -3.833) 4.096 25.202 ( -4.067 -0.636 5.957) 7.241 25.315 ( 4.221 -0.119 -5.729) 7.117 28.964 ( 0.271 -1.421 3.373) 3.670 29.025 ( -0.456 -1.043 -2.962) 3.174 34.807 ( -18.528 2.434 3.963) 19.103 34.882 ( 19.228 2.548 -3.591) 19.726 37.908 ( -6.849 1.899 3.368) 7.865 37.950 ( 7.281 1.652 -1.077) 7.543 40.884 ( 12.845 0.934 8.930) 15.672 41.070 ( -9.196 2.948 -10.237) 14.073 41.783 ( -0.684 -1.766 28.346) 28.409 42.372 ( 0.414 0.666 -32.375) 32.385 ======================= Grid point 368 (193/205) ======================= q-point: (-0.33 -0.56 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.233 ( -8.309 -2.267 6.890) 11.030 3.436 ( 5.854 1.461 -0.361) 6.044 3.738 ( -9.217 -15.107 3.619) 18.063 3.979 ( 9.759 -12.440 -4.691) 16.492 4.418 ( -12.118 16.872 9.250) 22.739 4.684 ( 0.056 17.381 12.196) 21.233 5.166 ( 5.307 7.064 -8.099) 11.986 5.454 ( 21.524 3.238 -9.852) 23.892 6.101 ( -6.648 -19.571 17.325) 26.970 6.286 ( 2.554 -6.487 -4.408) 8.249 6.404 ( -12.970 0.379 2.351) 13.187 6.777 ( 10.632 -11.982 -9.364) 18.555 6.966 ( 4.329 -0.043 5.072) 6.668 7.106 ( 5.614 -7.723 -11.936) 15.285 7.272 ( -14.403 9.865 3.222) 17.753 7.499 ( 0.009 8.971 -4.978) 10.260 7.865 ( -6.050 7.576 0.139) 9.696 8.008 ( 7.739 10.053 2.673) 12.965 8.571 ( -2.883 7.544 9.396) 12.389 8.649 ( -3.194 5.775 -10.290) 12.224 9.198 ( -3.388 -0.820 -4.940) 6.046 9.217 ( 3.081 0.881 6.067) 6.861 9.360 ( -5.959 0.692 -3.629) 7.012 9.438 ( 2.157 3.309 0.385) 3.968 10.350 ( -0.772 -0.684 -1.549) 1.861 10.351 ( 1.722 -5.127 5.815) 7.941 10.804 ( -4.624 2.768 -1.396) 5.567 10.934 ( 6.487 -1.525 0.727) 6.704 11.118 ( -2.853 -10.774 -1.895) 11.306 11.207 ( 5.802 -6.676 1.180) 8.923 11.900 ( -8.102 -2.684 6.080) 10.479 12.184 ( 3.079 -0.314 -6.502) 7.201 12.468 ( -19.446 1.004 -4.050) 19.889 13.005 ( 22.640 1.963 4.304) 23.129 13.376 ( 1.784 2.837 -0.124) 3.354 13.432 ( 7.212 1.428 4.718) 8.736 13.973 ( -6.859 0.786 -4.907) 8.470 14.055 ( 3.413 0.989 4.566) 5.786 14.370 ( -4.238 1.846 0.085) 4.623 14.550 ( 9.780 0.778 1.741) 9.964 15.146 ( -7.366 -3.944 6.274) 10.449 15.376 ( 5.159 -2.769 -3.658) 6.904 15.946 ( -15.540 -1.940 1.901) 15.776 16.331 ( 12.513 -1.927 -6.048) 14.031 16.993 ( -5.393 11.941 0.413) 13.109 17.067 ( 0.450 8.842 -1.911) 9.057 17.579 ( -3.370 4.402 -0.370) 5.556 17.640 ( 1.769 2.332 -0.361) 2.949 18.197 ( -12.725 -9.502 3.921) 16.358 18.641 ( 16.103 -10.336 -6.494) 20.207 20.503 ( -6.637 -4.302 9.792) 12.587 20.776 ( 7.364 -5.563 -8.723) 12.699 21.632 ( -1.188 0.915 5.222) 5.433 21.676 ( -1.473 1.107 -2.686) 3.257 25.188 ( -4.316 -0.964 4.855) 6.568 25.338 ( 2.925 -0.016 -5.015) 5.805 29.007 ( -0.369 -1.805 1.640) 2.466 29.041 ( 1.131 -2.204 -0.966) 2.659 34.569 ( -16.160 2.871 2.934) 16.673 35.023 ( 18.466 6.541 -3.013) 19.821 37.803 ( -6.277 2.439 2.426) 7.158 37.987 ( 6.915 3.824 -1.598) 8.062 40.820 ( -11.183 4.376 -4.355) 12.774 41.077 ( 11.956 0.540 -0.278) 11.972 41.862 ( -6.845 1.273 23.404) 24.418 42.265 ( 3.307 -1.629 -25.891) 26.153 ======================= Grid point 369 (194/205) ======================= q-point: (-0.22 -0.56 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.260 ( -2.490 -10.197 -4.848) 11.562 3.551 ( 15.048 2.636 12.684) 19.856 3.783 ( -17.196 -4.814 7.844) 19.504 4.159 ( 8.219 9.632 -2.659) 12.938 4.309 ( 5.295 -10.628 6.792) 13.679 4.536 ( 4.572 8.916 16.400) 19.219 5.187 ( 11.954 -2.412 -9.650) 15.551 5.620 ( 18.784 3.136 -9.205) 21.152 6.118 ( -14.482 5.994 0.994) 15.705 6.240 ( -15.660 0.862 4.095) 16.209 6.372 ( -2.839 -4.439 -7.387) 9.073 6.884 ( -13.792 6.945 -0.062) 15.442 6.975 ( 8.596 2.389 -1.556) 9.056 7.051 ( -6.649 -7.346 -2.741) 10.281 7.326 ( 2.069 -9.441 -4.938) 10.853 7.411 ( 2.111 -5.255 3.905) 6.879 7.685 ( -5.288 5.989 -1.160) 8.073 7.975 ( 9.233 8.680 5.895) 13.976 8.404 ( -3.241 11.033 5.121) 12.588 8.479 ( -0.283 7.204 -10.368) 12.628 9.127 ( 0.243 3.929 -9.200) 10.006 9.208 ( 2.322 5.836 10.033) 11.837 9.336 ( -2.400 -5.287 -5.747) 8.169 9.475 ( 1.263 -4.394 0.209) 4.577 10.331 ( -1.906 -0.401 -1.164) 2.269 10.504 ( 4.042 -4.362 6.680) 8.943 10.672 ( -6.483 3.558 -0.663) 7.425 10.984 ( 1.120 -0.152 -2.124) 2.406 11.283 ( -0.141 -10.065 0.769) 10.095 11.376 ( 2.048 -6.689 1.467) 7.148 11.897 ( -2.504 -1.197 6.811) 7.355 12.018 ( -17.084 2.813 -0.450) 17.320 12.386 ( 1.082 -2.472 -7.657) 8.119 13.146 ( 7.771 3.835 -0.464) 8.678 13.442 ( 16.215 1.068 1.850) 16.355 13.554 ( 10.488 1.695 6.818) 12.624 13.873 ( -5.416 -0.055 -2.162) 5.832 14.053 ( -1.287 1.588 4.260) 4.725 14.370 ( 3.306 -2.341 -1.217) 4.230 14.692 ( 12.920 -0.043 1.209) 12.977 15.144 ( -6.913 -3.437 3.493) 8.474 15.443 ( 1.532 -3.020 -2.957) 4.496 15.765 ( -18.724 -0.300 -0.226) 18.728 16.474 ( 9.249 -1.949 -3.535) 10.092 16.677 ( -9.678 15.060 -1.972) 18.010 16.947 ( 1.652 7.032 -0.825) 7.271 17.475 ( -2.668 3.697 0.175) 4.562 17.624 ( 0.699 0.980 -1.319) 1.786 18.219 ( -9.952 -7.862 2.946) 13.020 18.948 ( 12.434 -9.205 -5.673) 16.478 20.531 ( -6.104 -4.327 7.417) 10.535 20.959 ( 10.028 -7.256 -3.749) 12.933 21.610 ( -1.732 1.375 2.190) 3.112 21.636 ( -1.272 1.406 0.138) 1.901 25.169 ( -3.926 -0.814 3.154) 5.101 25.344 ( 1.439 0.370 -3.596) 3.890 29.021 ( -0.881 -1.009 -0.241) 1.361 29.107 ( 1.921 -2.836 1.101) 3.598 34.369 ( -11.996 2.328 2.065) 12.393 35.082 ( 14.689 9.328 -1.831) 17.496 37.714 ( -4.213 1.792 2.188) 5.074 37.980 ( 5.074 4.923 -1.424) 7.212 40.606 ( -11.262 3.408 -3.190) 12.191 41.183 ( 10.226 1.041 -6.467) 12.144 41.739 ( -13.925 4.792 9.390) 17.466 42.339 ( 9.415 -4.878 -8.397) 13.526 ======================= Grid point 370 (195/205) ======================= q-point: (-0.11 -0.56 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.364 ( -3.903 -3.557 -7.510) 9.180 3.660 ( 2.398 1.106 2.187) 3.429 3.820 ( 16.562 -0.762 19.370) 25.497 4.250 ( 21.615 2.267 7.239) 22.907 4.459 ( -3.347 -7.033 6.305) 10.021 4.644 ( 6.474 -3.433 12.351) 14.361 5.369 ( 6.325 -4.132 -14.093) 15.991 5.622 ( -16.027 3.208 -1.093) 16.381 5.820 ( 6.470 16.000 -15.409) 23.136 5.974 ( -14.970 2.383 7.643) 16.976 6.318 ( -2.359 0.308 -9.842) 10.125 6.651 ( -13.864 0.668 -0.303) 13.884 6.998 ( 3.238 -0.282 -13.412) 13.800 7.041 ( -7.006 -1.480 3.774) 8.094 7.403 ( -0.746 3.585 10.153) 10.794 7.599 ( -3.294 -4.176 -7.600) 9.276 7.632 ( 1.870 -10.334 12.936) 16.662 7.984 ( 7.812 6.195 7.393) 12.412 8.265 ( 2.093 4.239 -3.047) 5.625 8.346 ( 0.560 5.072 -7.905) 9.409 9.035 ( 1.624 3.762 -6.845) 7.978 9.195 ( 1.593 3.906 7.540) 8.640 9.391 ( 2.542 -4.494 -6.890) 8.610 9.563 ( 1.250 -2.791 -0.319) 3.075 10.318 ( -1.647 -0.980 -0.506) 1.982 10.475 ( -4.409 4.320 -0.559) 6.198 10.688 ( 0.075 -4.692 6.350) 7.895 10.986 ( -1.046 -2.046 -1.502) 2.745 11.345 ( -7.085 -3.089 -4.050) 8.726 11.454 ( -3.792 -2.347 4.730) 6.501 11.889 ( -2.416 -3.890 2.123) 5.048 11.911 ( -0.966 1.090 3.434) 3.730 12.391 ( -1.440 -1.199 -5.819) 6.113 13.164 ( 5.121 1.925 -0.965) 5.555 13.591 ( 9.713 6.528 3.499) 12.215 13.650 ( 6.941 -0.110 1.278) 7.058 13.869 ( 2.859 -2.593 6.176) 7.283 14.089 ( 4.118 -2.244 5.258) 7.046 14.463 ( 5.124 -3.234 -3.909) 7.210 14.826 ( 10.001 1.723 -0.672) 10.171 15.092 ( -10.965 -1.740 1.404) 11.191 15.469 ( -10.701 -1.739 -11.266) 15.636 15.598 ( -1.168 -2.856 8.672) 9.205 16.295 ( -10.966 14.995 -1.198) 18.616 16.583 ( 5.552 -0.949 -2.130) 6.022 16.881 ( 2.095 3.655 -0.658) 4.264 17.411 ( 0.204 2.319 -0.627) 2.411 17.621 ( -0.954 -1.727 -2.050) 2.846 18.224 ( -7.323 -4.365 1.834) 8.720 19.152 ( 6.217 -4.320 -3.745) 8.446 20.553 ( -4.581 -3.369 4.253) 7.100 21.185 ( 9.978 -6.055 -0.622) 11.688 21.575 ( -1.633 2.298 2.495) 3.764 21.597 ( -1.061 0.541 -1.716) 2.088 25.149 ( -2.453 -0.480 1.266) 2.802 25.332 ( 0.176 0.931 -1.701) 1.947 29.020 ( -0.761 -0.102 0.231) 0.801 29.168 ( 1.305 -1.756 0.693) 2.295 34.233 ( -6.391 1.871 1.073) 6.745 35.083 ( 8.930 6.703 0.699) 11.188 37.670 ( -1.588 0.539 1.911) 2.542 37.950 ( 3.177 4.259 -0.047) 5.313 40.433 ( -8.375 2.456 -0.885) 8.772 41.230 ( 5.701 1.019 -12.647) 13.910 41.539 ( -11.056 4.053 9.711) 15.263 42.510 ( 9.869 -4.434 -5.713) 12.235 ======================= Grid point 376 (196/205) ======================= q-point: (-0.44 -0.44 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.145 ( -22.144 -0.000 -13.788) 26.086 3.188 ( -8.675 -0.000 13.157) 15.760 3.741 ( 7.461 0.000 0.853) 7.510 3.785 ( 10.868 0.000 6.197) 12.511 4.904 ( -15.403 -0.000 12.901) 20.092 4.960 ( -1.480 -0.000 18.106) 18.167 5.408 ( 3.463 0.000 -17.144) 17.491 5.466 ( 9.521 0.000 1.759) 9.682 5.647 ( 0.053 0.000 11.972) 11.972 6.010 ( 16.167 0.000 -17.538) 23.853 6.447 ( 5.020 0.000 4.622) 6.824 6.461 ( -2.667 -0.000 -6.085) 6.644 6.950 ( 8.066 0.000 3.561) 8.817 7.027 ( 2.742 0.000 -12.549) 12.845 7.522 ( -14.191 -0.000 -0.309) 14.194 7.700 ( 0.009 0.000 -1.772) 1.772 8.007 ( -4.900 -0.000 6.267) 7.955 8.194 ( 6.197 0.000 -2.919) 6.850 8.686 ( -4.572 -0.000 4.400) 6.345 8.690 ( -4.903 -0.000 -3.080) 5.791 9.141 ( -4.687 -0.000 -2.396) 5.263 9.190 ( 1.137 0.000 -0.545) 1.261 9.499 ( -5.287 -0.000 -4.690) 7.067 9.499 ( -1.026 -0.000 7.560) 7.629 10.246 ( -0.023 -0.000 6.977) 6.977 10.347 ( 2.678 0.000 -3.043) 4.053 10.852 ( 2.149 0.000 -1.929) 2.888 10.862 ( 6.268 0.000 1.215) 6.385 10.928 ( -3.790 -0.000 3.696) 5.294 11.114 ( 6.266 0.000 -4.608) 7.778 11.847 ( -8.876 -0.000 3.947) 9.714 12.167 ( 9.552 0.000 -9.391) 13.395 12.493 ( -23.924 -0.000 -1.247) 23.957 13.035 ( 22.554 0.000 5.093) 23.121 13.427 ( 6.498 0.000 12.126) 13.758 13.460 ( 0.568 0.000 -6.706) 6.730 13.973 ( -9.287 -0.000 -10.076) 13.703 14.078 ( 7.247 0.000 8.191) 10.937 14.435 ( -4.758 -0.000 1.252) 4.920 14.573 ( 5.844 0.000 1.184) 5.963 15.060 ( -8.316 -0.000 6.824) 10.758 15.322 ( 6.716 0.000 -3.684) 7.660 15.913 ( -14.132 -0.000 2.843) 14.415 16.294 ( 12.455 0.000 -7.498) 14.538 17.218 ( -2.020 -0.000 4.164) 4.628 17.233 ( -4.574 -0.000 -4.434) 6.371 17.654 ( -2.592 -0.000 3.194) 4.113 17.704 ( 1.030 0.000 -3.594) 3.739 18.003 ( -10.450 -0.000 3.019) 10.877 18.442 ( 16.444 0.000 -6.810) 17.799 20.428 ( -5.693 -0.000 9.746) 11.287 20.673 ( 5.689 0.000 -9.436) 11.018 21.646 ( -1.248 -0.000 6.353) 6.474 21.694 ( -1.869 -0.000 -3.026) 3.557 25.170 ( -4.518 -0.000 5.823) 7.370 25.335 ( 3.180 0.000 -5.827) 6.638 28.971 ( 0.640 0.000 3.535) 3.593 29.004 ( 0.266 0.000 -3.148) 3.159 34.616 ( -18.312 -0.000 3.091) 18.571 35.136 ( 21.742 0.000 -3.928) 22.094 37.848 ( -7.078 -0.000 2.457) 7.492 38.056 ( 8.259 0.000 -1.483) 8.391 40.907 ( -11.995 -0.000 -13.417) 17.997 41.082 ( 12.085 0.000 7.734) 14.348 41.881 ( -1.310 -0.000 31.243) 31.270 42.229 ( -3.103 -0.000 -33.225) 33.370 ======================= Grid point 377 (197/205) ======================= q-point: (-0.33 -0.44 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.880 ( -26.164 -9.520 -6.687) 28.634 3.203 ( -17.858 -14.437 18.751) 29.646 3.829 ( 13.605 6.894 6.617) 16.626 3.997 ( 14.901 -5.466 2.220) 16.027 4.649 ( -4.556 15.400 5.303) 16.912 4.961 ( 1.699 9.871 16.610) 19.396 5.314 ( 7.017 6.751 -15.186) 18.040 5.636 ( 11.185 -3.334 -7.483) 13.864 5.813 ( -5.029 -13.819 20.721) 25.409 6.184 ( 5.614 -5.430 -9.890) 12.602 6.388 ( 0.876 4.501 1.167) 4.732 6.636 ( 6.273 -10.574 -3.854) 12.885 7.028 ( 2.142 -1.305 -5.784) 6.304 7.042 ( 1.503 -3.014 -7.708) 8.412 7.265 ( -9.461 9.390 -1.953) 13.472 7.554 ( -9.768 7.065 -5.402) 13.211 7.932 ( -4.251 6.123 5.112) 9.038 8.203 ( 4.256 3.654 -4.853) 7.418 8.620 ( -5.487 0.608 0.571) 5.550 8.648 ( 0.447 2.773 1.596) 3.231 9.068 ( -7.586 -3.120 -5.465) 9.856 9.193 ( -0.639 -0.869 -1.794) 2.093 9.404 ( -2.098 4.383 3.344) 5.899 9.484 ( -3.359 1.519 3.381) 5.002 10.341 ( 5.213 -3.147 8.578) 10.520 10.353 ( 1.615 0.623 -2.383) 2.946 10.813 ( -3.875 2.022 0.288) 4.381 10.971 ( 4.086 -0.231 0.568) 4.132 11.011 ( 8.957 -4.896 1.714) 10.351 11.206 ( 7.479 -3.708 -1.126) 8.423 11.786 ( -6.675 -3.032 1.780) 7.544 12.163 ( -9.559 4.367 -1.834) 10.668 12.282 ( -4.972 -3.436 -5.619) 8.252 13.236 ( 8.134 1.588 1.721) 8.465 13.498 ( 13.257 2.412 1.625) 13.572 13.571 ( 9.340 -0.725 8.942) 12.951 13.830 ( -8.243 -1.376 -10.823) 13.674 14.157 ( 1.811 2.354 8.201) 8.722 14.376 ( -0.402 2.029 -0.635) 2.164 14.668 ( 8.737 -1.065 2.319) 9.102 15.026 ( -6.000 -3.078 5.452) 8.672 15.372 ( 1.704 -1.287 -3.033) 3.709 15.747 ( -16.305 -0.365 1.487) 16.377 16.405 ( 9.070 -1.478 -6.691) 11.368 17.069 ( -8.681 8.042 -3.384) 12.308 17.150 ( -3.593 4.836 -0.109) 6.026 17.586 ( -5.820 2.564 1.698) 6.582 17.704 ( 2.697 1.280 -1.566) 3.372 17.989 ( -2.287 -4.747 1.049) 5.373 18.652 ( 13.431 -6.833 -5.524) 16.050 20.427 ( -4.395 -1.802 11.117) 12.090 20.747 ( 6.833 -4.602 -7.266) 10.985 21.645 ( -2.204 0.812 3.829) 4.492 21.660 ( -1.838 0.115 0.481) 1.904 25.143 ( -4.392 -0.561 4.988) 6.670 25.344 ( 1.935 -0.120 -5.301) 5.645 28.992 ( 0.238 -0.336 -0.008) 0.412 29.020 ( 1.202 -2.104 0.552) 2.485 34.415 ( -15.958 0.690 2.416) 16.155 35.340 ( 21.495 5.096 -4.650) 22.575 37.769 ( -5.853 1.193 2.025) 6.308 38.118 ( 7.113 2.859 -2.698) 8.127 40.699 ( -11.333 1.883 -11.875) 16.522 41.220 ( 8.119 0.921 3.540) 8.905 41.904 ( -8.045 5.939 9.276) 13.640 42.134 ( -0.151 -7.386 -10.072) 12.491 ======================= Grid point 378 (198/205) ======================= q-point: (-0.22 -0.44 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.801 ( -23.589 -19.981 -2.938) 31.053 3.393 ( -11.758 -21.583 20.556) 32.041 3.909 ( 14.720 7.304 10.781) 19.654 4.256 ( 4.123 -4.424 5.526) 8.192 4.468 ( 12.590 9.020 -2.676) 15.717 4.891 ( 9.125 12.987 15.866) 22.442 5.282 ( 8.904 1.986 -12.811) 15.728 5.726 ( 0.710 0.591 -5.619) 5.694 5.926 ( -15.866 -4.719 10.783) 19.755 6.180 ( -2.615 1.617 -2.375) 3.885 6.363 ( 5.487 4.213 -6.547) 9.525 6.732 ( -24.976 1.025 2.312) 25.104 6.838 ( -7.017 -6.146 -6.856) 11.577 7.063 ( 0.321 3.210 -9.345) 9.886 7.256 ( 12.293 -1.651 -9.027) 15.340 7.402 ( 3.441 -2.405 4.414) 6.092 7.770 ( -4.920 8.779 4.725) 11.118 8.172 ( 3.112 3.133 -2.980) 5.327 8.541 ( -0.126 5.823 -2.510) 6.342 8.573 ( 3.085 9.412 -0.315) 9.910 9.062 ( -3.652 -6.329 -6.455) 9.750 9.224 ( 1.933 -4.100 -1.948) 4.934 9.333 ( -1.389 4.869 6.823) 8.496 9.430 ( -3.108 -0.459 -0.925) 3.276 10.322 ( -0.461 1.576 -3.111) 3.517 10.535 ( 9.049 -3.788 9.855) 13.906 10.721 ( -2.011 5.463 0.750) 5.869 10.965 ( -1.016 2.006 -1.241) 2.568 11.200 ( 6.055 -5.240 -0.201) 8.010 11.356 ( 6.173 -2.946 0.740) 6.880 11.789 ( -8.046 -5.316 -0.270) 9.647 11.970 ( -4.665 4.216 8.090) 10.246 12.307 ( -0.243 -4.176 -8.335) 9.326 13.240 ( 1.480 2.798 -0.216) 3.172 13.629 ( -4.217 -0.502 -2.509) 4.933 13.654 ( 10.412 0.106 6.663) 12.361 13.852 ( 10.456 -1.101 1.065) 10.568 14.112 ( -0.960 3.178 5.931) 6.797 14.398 ( 6.092 -0.160 -2.404) 6.551 14.825 ( 10.393 -2.257 1.792) 10.785 15.031 ( -5.066 -2.228 2.492) 6.070 15.378 ( -3.474 -2.290 -2.037) 4.632 15.555 ( -16.824 -0.482 2.795) 17.062 16.497 ( 3.204 -2.963 -3.382) 5.521 16.754 ( -12.559 12.908 -4.398) 18.539 17.032 ( -0.508 5.030 -3.417) 6.102 17.488 ( -4.277 2.564 1.164) 5.121 17.700 ( 4.075 3.766 -1.187) 5.675 18.063 ( 0.996 -4.631 -0.125) 4.739 18.905 ( 9.249 -9.599 -4.082) 13.941 20.457 ( -3.017 -2.131 9.323) 10.028 20.927 ( 8.711 -8.831 -3.484) 12.884 21.606 ( -2.105 0.972 -0.289) 2.337 21.643 ( -2.572 0.813 4.429) 5.185 25.124 ( -3.532 -0.867 3.562) 5.091 25.343 ( 0.709 -0.072 -4.128) 4.189 28.999 ( 0.117 -0.751 -1.012) 1.265 29.082 ( 1.062 -3.069 1.795) 3.711 34.251 ( -11.876 -0.113 1.707) 11.998 35.418 ( 16.341 11.408 -5.046) 20.558 37.699 ( -3.753 1.134 1.989) 4.396 38.108 ( 4.105 5.051 -3.652) 7.464 40.506 ( -8.888 1.928 -7.893) 12.042 41.276 ( 5.497 1.572 -4.863) 7.506 41.674 ( -14.062 4.802 -0.914) 14.887 42.298 ( 3.667 -8.492 5.004) 10.517 ======================= Grid point 379 (199/205) ======================= q-point: (-0.11 -0.44 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.916 ( -18.682 -25.747 0.339) 31.812 3.682 ( 0.723 -8.976 9.537) 13.117 4.078 ( 16.014 -2.041 20.898) 26.408 4.300 ( 2.771 -2.703 -7.533) 8.469 4.586 ( 11.316 0.639 10.006) 15.119 4.894 ( 11.827 10.476 9.502) 18.437 5.274 ( -11.119 0.814 -7.859) 13.641 5.529 ( -11.313 11.826 -4.888) 17.081 5.776 ( -14.530 -1.755 5.070) 15.489 6.121 ( 9.547 7.210 -14.563) 18.847 6.258 ( -10.033 0.905 2.511) 10.382 6.435 ( -16.914 -2.138 2.057) 17.173 6.869 ( -2.344 -6.084 -8.488) 10.703 6.979 ( -3.265 1.079 -2.878) 4.484 7.395 ( 4.341 -3.943 -0.347) 5.875 7.571 ( 5.004 0.351 -6.882) 8.516 7.680 ( 6.597 -0.701 13.923) 15.423 8.153 ( 2.132 2.858 0.168) 3.569 8.413 ( 0.327 8.481 -2.342) 8.805 8.454 ( 7.726 11.526 -6.976) 15.531 9.042 ( -2.014 1.010 -9.258) 9.528 9.260 ( -3.326 2.499 5.525) 6.916 9.348 ( 4.287 -4.128 0.255) 5.956 9.469 ( -0.445 -7.810 -3.143) 8.431 10.282 ( -1.086 0.453 -1.777) 2.131 10.584 ( 0.677 9.849 -0.659) 9.894 10.715 ( 6.235 -0.804 7.566) 9.836 10.934 ( -0.461 -1.139 2.632) 2.905 11.248 ( -3.086 0.622 -3.824) 4.953 11.449 ( 5.112 -1.099 -0.325) 5.239 11.781 ( -2.433 -4.773 3.391) 6.340 11.991 ( 3.651 1.513 6.137) 7.299 12.324 ( -1.208 -2.409 -5.771) 6.370 13.212 ( -0.691 1.422 0.719) 1.737 13.573 ( -7.161 -5.079 -4.445) 9.840 13.781 ( 4.408 3.985 4.547) 7.483 13.903 ( 1.639 -1.864 6.523) 6.979 14.220 ( 12.874 0.337 6.820) 14.572 14.474 ( 6.869 -2.026 -5.081) 8.782 14.886 ( -7.352 3.912 -5.064) 9.747 15.006 ( 1.975 -1.827 6.153) 6.716 15.281 ( -12.789 -0.118 -3.883) 13.367 15.552 ( 2.261 -8.219 7.353) 11.258 16.333 ( -17.331 11.090 -1.682) 20.644 16.583 ( 1.770 -2.114 -3.257) 4.268 16.956 ( 2.188 4.246 -4.341) 6.455 17.423 ( -1.703 1.046 -0.751) 2.135 17.675 ( 4.922 5.087 -2.022) 7.362 18.146 ( 3.518 -2.509 -0.653) 4.370 19.107 ( 3.313 -6.965 -1.752) 7.910 20.495 ( -1.506 -1.943 6.700) 7.137 21.173 ( 8.933 -8.958 -1.811) 12.780 21.572 ( -1.376 0.275 -1.083) 1.773 21.601 ( -3.643 1.967 3.785) 5.610 25.118 ( -1.684 -1.047 1.855) 2.715 25.332 ( -0.187 0.156 -2.408) 2.421 29.009 ( 0.129 -0.657 -0.589) 0.891 29.145 ( 0.217 -2.759 1.642) 3.218 34.163 ( -6.181 -1.668 0.937) 6.470 35.329 ( 6.392 13.546 -3.608) 15.407 37.666 ( -1.235 0.199 1.624) 2.050 38.042 ( 0.880 4.603 -3.280) 5.720 40.380 ( -3.952 1.215 -3.630) 5.502 41.245 ( -0.513 3.284 -10.974) 11.467 41.497 ( -8.044 -0.033 6.585) 10.396 42.482 ( 3.049 -7.269 1.132) 7.963 ======================= Grid point 386 (200/205) ======================= q-point: (-0.33 -0.33 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.460 ( -27.214 -0.000 4.728) 27.621 2.914 ( -24.027 -0.000 29.100) 37.737 4.090 ( 15.960 0.000 0.598) 15.971 4.108 ( 10.002 0.000 2.223) 10.246 4.732 ( -3.102 -0.000 3.646) 4.787 5.152 ( 3.578 0.000 13.497) 13.964 5.387 ( 5.532 0.000 -21.459) 22.160 5.643 ( 9.335 0.000 -6.100) 11.152 5.755 ( -4.136 -0.000 24.443) 24.790 6.176 ( 0.706 0.000 -1.423) 1.588 6.499 ( 6.472 0.000 -1.454) 6.634 6.558 ( -1.796 -0.000 -5.489) 5.775 6.815 ( -27.825 -0.000 2.607) 27.947 7.114 ( 13.642 0.000 -7.488) 15.563 7.315 ( 8.031 0.000 -11.441) 13.978 7.458 ( -8.237 -0.000 -6.675) 10.602 7.936 ( -8.129 -0.000 1.968) 8.363 8.195 ( -1.781 -0.000 -13.328) 13.446 8.582 ( 3.092 0.000 1.799) 3.577 8.719 ( 0.868 0.000 4.443) 4.527 8.950 ( -1.901 -0.000 -4.961) 5.312 9.184 ( 0.319 0.000 -0.999) 1.049 9.427 ( 0.282 0.000 -1.545) 1.571 9.430 ( -10.796 -0.000 9.248) 14.215 10.361 ( 1.202 0.000 -4.487) 4.645 10.467 ( 11.996 0.000 10.983) 16.265 10.767 ( -5.000 -0.000 3.653) 6.192 11.096 ( 10.622 0.000 2.148) 10.837 11.098 ( 10.211 0.000 -2.321) 10.471 11.264 ( 8.844 0.000 2.151) 9.102 11.665 ( -8.099 -0.000 -3.248) 8.726 12.080 ( -11.129 -0.000 8.092) 13.760 12.200 ( 0.123 0.000 -10.684) 10.684 13.299 ( 1.156 0.000 1.630) 1.999 13.614 ( -10.225 -0.000 -2.643) 10.561 13.685 ( 6.588 0.000 9.928) 11.915 13.801 ( 20.497 0.000 -4.869) 21.067 14.185 ( -6.662 -0.000 6.901) 9.592 14.418 ( 6.041 0.000 -2.341) 6.478 14.755 ( 7.710 0.000 1.339) 7.826 14.978 ( -1.909 -0.000 6.661) 6.929 15.342 ( -4.028 -0.000 -1.362) 4.252 15.557 ( -16.409 -0.000 0.307) 16.412 16.441 ( 2.394 0.000 -5.072) 5.609 17.006 ( -8.130 -0.000 -10.078) 12.949 17.130 ( -7.178 -0.000 3.600) 8.030 17.553 ( -4.164 -0.000 2.401) 4.807 17.718 ( 3.196 0.000 -5.660) 6.501 18.004 ( 6.872 0.000 1.382) 7.010 18.711 ( 9.518 0.000 -4.247) 10.422 20.430 ( -1.734 -0.000 13.950) 14.058 20.752 ( 6.365 0.000 -6.996) 9.458 21.628 ( -1.983 -0.000 -1.587) 2.540 21.650 ( -3.107 -0.000 6.955) 7.618 25.108 ( -3.912 -0.000 4.581) 6.024 25.339 ( 0.963 0.000 -5.088) 5.178 28.996 ( 0.932 0.000 -2.964) 3.107 29.015 ( 0.399 0.000 3.532) 3.554 34.248 ( -14.121 -0.000 1.828) 14.239 35.627 ( 22.662 0.000 -7.670) 23.925 37.722 ( -4.822 -0.000 1.835) 5.159 38.204 ( 5.389 0.000 -5.511) 7.708 40.540 ( -9.031 -0.000 -12.595) 15.499 41.306 ( 2.090 0.000 4.480) 4.943 41.804 ( -11.437 -0.000 -29.524) 31.662 42.090 ( -1.425 -0.000 29.192) 29.227 ======================= Grid point 387 (201/205) ======================= q-point: (-0.22 -0.33 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.284 ( -21.735 -8.506 15.520) 28.029 2.974 ( -15.064 -22.912 32.375) 42.427 4.161 ( 8.301 3.494 1.043) 9.066 4.260 ( 3.347 -2.040 -0.958) 4.035 4.715 ( 8.728 5.268 3.963) 10.937 5.152 ( -0.472 4.324 -0.384) 4.367 5.320 ( 1.975 2.645 -14.223) 14.601 5.730 ( 2.934 1.396 3.791) 4.993 5.813 ( -7.281 -0.109 16.056) 17.630 6.149 ( -2.780 0.557 -1.752) 3.333 6.377 ( -36.798 3.520 6.954) 37.615 6.470 ( -2.224 0.694 0.062) 2.331 6.644 ( -0.435 -6.506 -6.648) 9.312 7.114 ( 4.556 6.486 -21.021) 22.466 7.373 ( 11.409 1.911 -11.110) 16.039 7.510 ( 15.893 -1.412 9.512) 18.576 7.788 ( -9.876 2.698 -3.329) 10.765 8.113 ( -4.459 -2.881 -15.067) 15.975 8.635 ( -2.273 3.458 3.422) 5.370 8.736 ( 9.808 0.072 -1.769) 9.967 8.967 ( 5.920 2.023 -1.371) 6.405 9.212 ( 2.950 -1.793 0.943) 3.578 9.329 ( -11.024 -1.488 6.816) 13.046 9.409 ( 0.459 2.816 -2.435) 3.751 10.341 ( 1.331 2.044 -4.440) 5.066 10.635 ( 4.374 -2.259 1.520) 5.152 10.788 ( 7.718 1.771 12.988) 15.212 11.105 ( 7.197 9.623 -1.247) 12.081 11.223 ( 7.246 -1.294 -2.725) 7.848 11.424 ( 9.114 -1.198 2.915) 9.644 11.613 ( -5.144 -6.083 -0.384) 7.975 12.017 ( -1.639 1.275 9.727) 9.946 12.185 ( -1.989 -4.783 -9.302) 10.647 13.286 ( -2.227 2.357 4.286) 5.374 13.462 ( -11.990 -1.636 -6.719) 13.841 13.790 ( 5.959 -0.155 8.530) 10.406 13.996 ( 2.198 4.328 2.415) 5.422 14.143 ( 6.441 -4.150 3.110) 8.270 14.482 ( 7.745 1.566 -4.282) 8.987 14.871 ( 5.625 -3.624 -0.365) 6.701 15.002 ( -0.152 0.753 4.431) 4.497 15.277 ( -8.152 -1.396 1.200) 8.357 15.370 ( -13.928 -1.079 1.952) 14.106 16.406 ( -10.468 -2.292 -1.081) 10.771 16.793 ( -5.982 10.335 -9.455) 15.231 17.060 ( -2.683 0.829 -0.972) 2.972 17.509 ( 0.403 3.333 0.596) 3.410 17.758 ( 4.137 -1.056 -4.503) 6.205 18.104 ( 9.612 0.470 -0.012) 9.624 18.844 ( 5.366 -6.850 -2.377) 9.020 20.473 ( 0.346 0.680 12.552) 12.575 20.870 ( 7.299 -7.619 -4.281) 11.386 21.595 ( -1.704 0.714 -0.814) 2.019 21.632 ( -4.188 0.232 6.062) 7.372 25.088 ( -2.831 -0.594 3.645) 4.653 25.328 ( 0.070 -0.184 -4.312) 4.316 28.992 ( 0.567 0.005 -1.750) 1.839 29.052 ( -0.004 -2.421 2.467) 3.457 34.113 ( -10.219 -0.967 1.157) 10.329 35.762 ( 17.134 9.631 -11.087) 22.566 37.677 ( -3.210 0.308 1.914) 3.750 38.186 ( 0.635 3.340 -8.522) 9.175 40.407 ( -4.811 0.468 -8.909) 10.136 41.313 ( -0.590 0.495 -0.802) 1.112 41.529 ( -14.466 2.022 -14.088) 20.294 42.232 ( -1.622 -6.380 19.829) 20.893 ======================= Grid point 388 (202/205) ======================= q-point: (-0.11 -0.33 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.345 ( -15.900 -18.874 18.717) 30.973 3.460 ( 2.276 -28.054 23.111) 36.419 4.206 ( 0.230 -1.193 -10.043) 10.116 4.264 ( 1.332 0.401 12.355) 12.433 4.802 ( 10.143 2.451 6.958) 12.542 4.987 ( -16.420 3.550 -8.998) 19.058 5.206 ( -3.421 6.802 -7.521) 10.702 5.666 ( -17.852 2.532 11.741) 21.516 5.710 ( -1.439 17.125 3.437) 17.526 5.889 ( -23.311 -7.451 7.691) 25.653 6.143 ( -3.387 -2.292 -3.448) 5.349 6.466 ( 4.540 4.148 -2.229) 6.541 6.737 ( 2.373 -6.243 -3.029) 7.334 7.015 ( 6.275 4.750 -15.904) 17.745 7.445 ( 8.261 0.466 -1.848) 8.478 7.597 ( -3.344 1.824 -8.188) 9.031 7.815 ( 14.872 -1.603 8.397) 17.154 8.072 ( -5.357 -5.121 -12.385) 14.433 8.544 ( -2.582 4.637 2.883) 6.040 8.754 ( 11.572 12.648 -1.856) 17.243 9.013 ( 4.199 1.923 -5.288) 7.021 9.213 ( -8.986 -4.143 0.804) 9.928 9.330 ( -1.505 1.740 -3.116) 3.873 9.385 ( 5.086 -3.728 3.478) 7.201 10.306 ( 2.546 2.849 -3.248) 5.015 10.678 ( 0.200 -1.389 -1.564) 2.101 10.835 ( 0.817 8.747 8.325) 12.103 11.082 ( 13.693 6.711 4.670) 15.948 11.257 ( 3.151 2.475 -2.629) 4.793 11.514 ( 7.906 -0.553 -3.613) 8.711 11.720 ( 3.526 -4.610 4.872) 7.578 12.077 ( 4.527 -0.404 7.249) 8.556 12.235 ( 0.296 -5.635 -4.899) 7.472 13.210 ( -7.204 2.258 5.197) 9.166 13.355 ( -9.953 -4.886 -5.919) 12.568 13.829 ( -10.135 3.501 1.596) 10.841 13.922 ( 4.440 -2.211 7.351) 8.868 14.366 ( 8.904 -1.599 3.871) 9.839 14.508 ( 4.039 0.296 -5.729) 7.016 14.855 ( -6.345 5.201 -5.941) 10.130 15.034 ( 4.877 -2.891 4.702) 7.366 15.146 ( -10.356 0.881 3.252) 10.890 15.449 ( 2.596 -11.296 5.423) 12.796 16.206 ( -21.889 2.968 0.151) 22.090 16.586 ( -0.394 4.648 -5.153) 6.951 17.014 ( -0.667 2.753 -3.204) 4.277 17.473 ( 4.991 4.354 -2.608) 7.118 17.786 ( 4.409 2.269 -3.240) 5.924 18.220 ( 11.660 0.184 -1.597) 11.771 19.003 ( 0.323 -8.186 0.262) 8.196 20.517 ( 1.923 0.706 9.110) 9.337 21.101 ( 7.422 -10.693 -2.639) 13.282 21.561 ( -1.337 0.923 -1.191) 2.014 21.589 ( -5.123 0.892 5.014) 7.224 25.092 ( -0.970 -1.284 2.359) 2.855 25.315 ( -0.525 -0.381 -2.964) 3.035 28.999 ( 0.542 -0.716 -1.116) 1.432 29.102 ( -0.837 -3.076 2.098) 3.817 34.060 ( -4.435 -3.039 0.597) 5.409 35.612 ( 2.521 17.717 -10.983) 20.997 37.658 ( -1.030 -0.316 1.483) 1.834 38.069 ( -3.997 3.314 -8.424) 9.896 40.359 ( 1.981 0.001 -4.442) 4.864 41.234 ( -5.949 4.242 -7.194) 10.254 41.390 ( -5.578 -5.010 2.280) 7.836 42.377 ( -3.499 -7.587 9.592) 12.721 ======================= Grid point 396 (203/205) ======================= q-point: (-0.22 -0.22 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.217 ( -2.246 -0.000 34.159) 34.233 2.687 ( -16.440 -0.000 41.057) 44.226 4.237 ( 2.566 0.000 -14.119) 14.350 4.262 ( 2.746 0.000 1.309) 3.042 4.843 ( 0.101 0.000 9.611) 9.611 5.066 ( -9.795 -0.000 -17.350) 19.924 5.291 ( 1.943 0.000 -12.560) 12.709 5.684 ( -35.688 -0.000 24.327) 43.191 5.793 ( -9.514 -0.000 12.400) 15.630 6.105 ( -5.263 -0.000 -2.589) 5.865 6.198 ( 0.943 0.000 7.502) 7.561 6.353 ( -2.904 -0.000 -2.867) 4.081 6.644 ( 5.736 0.000 -2.457) 6.240 7.138 ( 4.910 0.000 -26.634) 27.083 7.469 ( 8.789 0.000 -10.631) 13.794 7.662 ( -7.678 -0.000 -6.193) 9.865 7.776 ( 21.090 0.000 7.015) 22.226 7.940 ( -5.690 -0.000 -14.628) 15.695 8.549 ( -10.255 -0.000 2.065) 10.461 8.911 ( 16.148 0.000 -4.703) 16.819 9.140 ( 11.326 0.000 -2.884) 11.687 9.180 ( -13.618 -0.000 13.054) 18.864 9.248 ( 5.472 0.000 -0.468) 5.492 9.433 ( 0.289 0.000 -1.005) 1.045 10.378 ( 4.332 0.000 -3.521) 5.582 10.611 ( -1.639 -0.000 -0.206) 1.652 10.998 ( 7.702 0.000 14.650) 16.551 11.248 ( 7.986 0.000 -9.528) 12.432 11.397 ( 14.803 0.000 1.218) 14.853 11.512 ( 4.276 0.000 -0.917) 4.373 11.544 ( 9.153 0.000 8.172) 12.270 12.063 ( 2.359 0.000 10.248) 10.516 12.063 ( -3.212 -0.000 -10.314) 10.803 13.219 ( -15.357 -0.000 2.035) 15.491 13.343 ( -3.153 -0.000 0.336) 3.171 13.861 ( -0.548 -0.000 6.111) 6.135 13.949 ( -11.489 -0.000 4.320) 12.274 14.264 ( 15.253 0.000 0.460) 15.260 14.569 ( 6.599 0.000 -6.509) 9.269 14.847 ( -3.070 -0.000 -5.289) 6.115 15.067 ( 3.691 0.000 6.822) 7.756 15.167 ( -8.526 -0.000 2.894) 9.004 15.228 ( -7.170 -0.000 1.758) 7.383 16.193 ( -20.459 -0.000 0.070) 20.460 16.838 ( 2.384 0.000 -15.204) 15.390 16.984 ( -8.876 -0.000 7.528) 11.638 17.585 ( 6.152 0.000 -1.097) 6.249 17.780 ( 6.098 0.000 -5.433) 8.167 18.243 ( 11.892 0.000 -0.503) 11.903 18.818 ( 1.389 0.000 -0.601) 1.514 20.565 ( 3.303 0.000 14.414) 14.787 20.864 ( 7.218 0.000 -5.172) 8.880 21.580 ( -1.277 -0.000 -1.047) 1.651 21.600 ( -5.612 -0.000 6.222) 8.379 25.069 ( -1.864 -0.000 3.365) 3.847 25.306 ( -0.608 -0.000 -4.114) 4.159 28.994 ( 0.713 0.000 -2.613) 2.709 29.034 ( -1.196 -0.000 3.292) 3.502 34.008 ( -6.079 -0.000 0.607) 6.110 35.967 ( 10.892 0.000 -19.554) 22.383 37.651 ( -2.634 -0.000 2.233) 3.453 38.135 ( -6.401 -0.000 -13.434) 14.881 40.357 ( 1.730 0.000 -6.083) 6.324 41.270 ( -6.850 -0.000 3.095) 7.517 41.331 ( -10.349 -0.000 -12.917) 16.551 42.227 ( -5.397 -0.000 22.061) 22.711 ======================= Grid point 397 (204/205) ======================= q-point: (-0.11 -0.22 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.261 ( 0.594 7.287 40.663) 41.316 3.101 ( 2.987 -33.636 37.551) 50.502 4.156 ( 0.539 3.436 -18.756) 19.076 4.314 ( 0.785 -1.253 5.421) 5.619 4.789 ( -18.494 3.955 -10.454) 21.609 4.814 ( -11.113 -1.858 -4.784) 12.241 5.218 ( -35.436 2.922 14.703) 38.477 5.321 ( -5.212 1.076 4.462) 6.945 5.692 ( -10.002 -2.610 -3.761) 10.999 6.011 ( -1.339 4.156 4.210) 6.066 6.165 ( 9.321 10.577 5.129) 15.002 6.515 ( 5.069 -4.650 4.575) 8.261 6.711 ( 5.597 -2.987 -2.679) 6.886 7.074 ( 5.065 0.266 -25.522) 26.021 7.436 ( -4.737 0.467 -16.912) 17.569 7.618 ( 6.239 3.091 5.859) 9.099 7.819 ( -4.066 -4.795 -18.592) 19.626 8.099 ( 18.589 1.404 10.281) 21.289 8.477 ( -6.971 -3.175 2.177) 7.963 8.969 ( -7.682 -4.071 -5.371) 10.219 9.107 ( 7.272 10.055 -0.754) 12.432 9.164 ( 5.422 4.914 5.519) 9.166 9.352 ( 3.325 1.165 -5.584) 6.602 9.423 ( 3.139 -0.312 3.989) 5.086 10.405 ( 6.734 3.512 -1.712) 7.786 10.623 ( -0.752 -2.997 0.220) 3.098 11.006 ( -2.616 7.050 11.405) 13.661 11.277 ( 6.074 3.858 -8.038) 10.788 11.455 ( 10.065 4.191 2.708) 11.234 11.588 ( 10.274 2.616 0.363) 10.608 11.792 ( 14.579 -2.153 0.102) 14.737 12.067 ( -0.163 -7.275 -6.305) 9.628 12.214 ( 13.788 -2.438 8.688) 16.478 13.052 ( -16.649 -3.233 1.606) 17.036 13.271 ( -6.409 4.267 4.308) 8.823 13.700 ( -17.501 1.632 -2.354) 17.734 13.976 ( 3.224 -1.112 9.764) 10.343 14.410 ( 1.311 -1.951 2.937) 3.762 14.541 ( -0.336 4.710 -8.230) 9.488 14.780 ( -4.075 -2.541 -11.605) 12.559 15.083 ( -5.266 0.187 7.552) 9.208 15.116 ( 6.646 1.165 3.872) 7.779 15.319 ( 2.786 -9.850 3.301) 10.756 15.955 ( -21.220 -1.264 1.166) 21.290 16.679 ( -1.780 10.137 -3.644) 10.918 16.974 ( -5.277 -3.013 -0.195) 6.079 17.629 ( 9.482 4.480 -3.235) 10.975 17.841 ( 5.362 0.140 -3.751) 6.545 18.374 ( 13.211 0.739 -2.202) 13.413 18.873 ( -2.497 -6.428 1.842) 7.138 20.635 ( 5.441 3.379 10.429) 12.238 21.014 ( 6.969 -8.674 -3.111) 11.554 21.546 ( -5.471 0.747 2.727) 6.159 21.558 ( -2.199 0.177 0.983) 2.415 25.075 ( -0.426 -1.023 2.743) 2.958 25.285 ( -1.106 -0.561 -3.399) 3.618 28.992 ( 0.622 -0.278 -1.560) 1.702 29.050 ( -1.785 -2.413 2.304) 3.784 33.991 ( 0.312 -2.141 0.488) 2.218 35.789 ( -8.231 13.957 -22.335) 27.593 37.642 ( -1.292 -0.884 2.043) 2.574 37.973 ( -9.600 0.207 -11.435) 14.932 40.408 ( 9.549 -0.030 -3.820) 10.285 41.172 ( -10.645 2.013 1.053) 10.885 41.268 ( 0.835 -5.458 -0.648) 5.560 42.255 ( -8.993 -4.284 14.675) 17.737 ======================= Grid point 406 (205/205) ======================= q-point: (-0.11 -0.11 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.828 ( -0.611 -0.000 44.308) 44.312 2.845 ( 22.939 0.000 47.560) 52.803 4.171 ( 6.736 0.000 -22.910) 23.879 4.273 ( -8.952 -0.000 10.246) 13.606 4.498 ( -26.536 -0.000 -2.740) 26.678 4.646 ( -12.485 -0.000 -3.276) 12.908 4.827 ( -28.057 -0.000 -5.753) 28.641 5.405 ( -1.057 -0.000 -6.949) 7.029 5.516 ( -5.060 -0.000 3.855) 6.361 5.984 ( -3.516 -0.000 -0.870) 3.622 6.478 ( 6.089 0.000 8.523) 10.474 6.523 ( 6.633 0.000 7.685) 10.152 6.727 ( 4.662 0.000 -2.204) 5.156 6.922 ( -5.731 -0.000 -26.286) 26.903 7.378 ( 1.491 0.000 -16.951) 17.017 7.685 ( -0.069 -0.000 -16.264) 16.265 7.768 ( 8.097 0.000 10.827) 13.520 8.342 ( 5.538 0.000 4.187) 6.943 8.400 ( 5.198 0.000 2.743) 5.878 8.779 ( -12.519 -0.000 -1.212) 12.577 9.229 ( 0.221 0.000 -6.949) 6.953 9.290 ( 4.014 0.000 6.959) 8.034 9.435 ( 9.097 0.000 -3.655) 9.804 9.464 ( 2.564 0.000 2.470) 3.560 10.527 ( 7.744 0.000 -0.267) 7.748 10.592 ( -0.205 -0.000 1.360) 1.375 11.066 ( -4.358 -0.000 14.058) 14.718 11.362 ( 8.698 0.000 -11.852) 14.701 11.538 ( 4.227 0.000 2.910) 5.132 11.776 ( 4.017 0.000 6.251) 7.430 11.935 ( 13.996 0.000 -6.702) 15.518 11.950 ( 2.063 0.000 -7.832) 8.099 12.519 ( 31.861 0.000 3.930) 32.103 12.829 ( -16.056 -0.000 2.093) 16.192 13.256 ( -9.255 -0.000 8.984) 12.898 13.457 ( -22.739 -0.000 -4.640) 23.207 14.044 ( 2.778 0.000 11.732) 12.056 14.368 ( -8.163 -0.000 4.401) 9.273 14.541 ( -2.999 -0.000 -11.130) 11.527 14.650 ( -1.734 -0.000 -14.557) 14.660 15.083 ( 2.277 0.000 4.349) 4.909 15.193 ( 1.423 0.000 5.209) 5.400 15.301 ( 6.029 0.000 2.594) 6.564 15.727 ( -15.300 -0.000 2.459) 15.496 16.792 ( 2.877 0.000 -11.481) 11.836 16.815 ( -11.889 -0.000 11.897) 16.820 17.767 ( 8.386 0.000 -1.544) 8.526 17.898 ( 5.732 0.000 -4.086) 7.039 18.520 ( 12.153 0.000 -3.215) 12.571 18.782 ( -4.983 -0.000 3.238) 5.942 20.795 ( 7.800 0.000 9.084) 11.973 21.004 ( 6.790 0.000 -3.177) 7.497 21.492 ( -6.337 -0.000 3.956) 7.471 21.534 ( -2.197 -0.000 -1.600) 2.718 25.075 ( 0.229 0.000 2.886) 2.895 25.249 ( -1.639 -0.000 -3.459) 3.828 28.993 ( 1.119 0.000 -2.341) 2.595 29.012 ( -2.631 -0.000 2.887) 3.906 34.022 ( 7.737 0.000 1.395) 7.862 35.592 ( -27.719 -0.000 -27.273) 38.886 37.624 ( -1.647 -0.000 3.178) 3.579 37.821 ( -7.357 -0.000 -8.066) 10.918 40.539 ( 14.176 0.000 -4.812) 14.971 41.064 ( -11.811 -0.000 2.248) 12.023 41.292 ( 11.631 0.000 4.843) 12.599 42.144 ( -13.495 -0.000 12.548) 18.427 =================== 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 3/48114 10.0 1031.060 1301.640 1508.898 0.000 363.660 0.000 3/48114 20.0 614.045 543.939 631.128 0.000 177.319 0.000 3/48114 30.0 210.009 186.689 201.782 0.000 51.556 0.000 3/48114 40.0 102.217 88.096 97.628 0.000 22.586 0.000 3/48114 50.0 60.646 51.004 57.849 0.000 12.388 0.000 3/48114 60.0 40.431 33.479 38.568 0.000 7.760 0.000 3/48114 70.0 29.129 23.900 27.823 0.000 5.324 0.000 3/48114 80.0 22.188 18.108 21.238 0.000 3.905 0.000 3/48114 90.0 17.623 14.339 16.912 0.000 3.012 0.000 3/48114 100.0 14.462 11.745 13.914 0.000 2.415 0.000 3/48114 110.0 12.180 9.879 11.747 0.000 1.997 0.000 3/48114 120.0 10.477 8.488 10.125 0.000 1.691 0.000 3/48114 130.0 9.170 7.420 8.877 0.000 1.461 0.000 3/48114 140.0 8.142 6.581 7.892 0.000 1.282 0.000 3/48114 150.0 7.318 5.906 7.100 0.000 1.140 0.000 3/48114 160.0 6.644 5.355 6.450 0.000 1.025 0.000 3/48114 170.0 6.085 4.897 5.910 0.000 0.930 0.000 3/48114 180.0 5.615 4.511 5.454 0.000 0.851 0.000 3/48114 190.0 5.215 4.183 5.065 0.000 0.784 0.000 3/48114 200.0 4.870 3.900 4.730 0.000 0.726 0.000 3/48114 210.0 4.571 3.654 4.437 0.000 0.677 0.000 3/48114 220.0 4.308 3.438 4.181 0.000 0.633 0.000 3/48114 230.0 4.076 3.247 3.954 0.000 0.595 0.000 3/48114 240.0 3.869 3.077 3.752 0.000 0.561 0.000 3/48114 250.0 3.684 2.925 3.570 0.000 0.530 0.000 3/48114 260.0 3.517 2.788 3.407 0.000 0.503 0.000 3/48114 270.0 3.366 2.665 3.259 0.000 0.478 0.000 3/48114 280.0 3.229 2.552 3.125 0.000 0.455 0.000 3/48114 290.0 3.103 2.449 3.002 0.000 0.435 0.000 3/48114 300.0 2.988 2.354 2.889 0.000 0.416 0.000 3/48114 310.0 2.882 2.267 2.785 0.000 0.399 0.000 3/48114 320.0 2.784 2.187 2.689 0.000 0.383 0.000 3/48114 330.0 2.693 2.113 2.600 0.000 0.368 0.000 3/48114 340.0 2.608 2.044 2.518 0.000 0.355 0.000 3/48114 350.0 2.530 1.979 2.441 0.000 0.342 0.000 3/48114 360.0 2.456 1.919 2.369 0.000 0.330 0.000 3/48114 370.0 2.387 1.863 2.301 0.000 0.319 0.000 3/48114 380.0 2.322 1.810 2.238 0.000 0.308 0.000 3/48114 390.0 2.261 1.760 2.179 0.000 0.299 0.000 3/48114 400.0 2.204 1.713 2.123 0.000 0.289 0.000 3/48114 410.0 2.149 1.668 2.070 0.000 0.281 0.000 3/48114 420.0 2.098 1.627 2.020 0.000 0.272 0.000 3/48114 430.0 2.049 1.587 1.973 0.000 0.264 0.000 3/48114 440.0 2.003 1.549 1.928 0.000 0.257 0.000 3/48114 450.0 1.959 1.513 1.885 0.000 0.250 0.000 3/48114 460.0 1.917 1.479 1.845 0.000 0.243 0.000 3/48114 470.0 1.877 1.447 1.806 0.000 0.237 0.000 3/48114 480.0 1.839 1.416 1.769 0.000 0.231 0.000 3/48114 490.0 1.802 1.386 1.734 0.000 0.225 0.000 3/48114 500.0 1.767 1.358 1.700 0.000 0.220 0.000 3/48114 510.0 1.734 1.330 1.668 0.000 0.215 0.000 3/48114 520.0 1.702 1.304 1.637 0.000 0.210 0.000 3/48114 530.0 1.671 1.279 1.607 0.000 0.205 0.000 3/48114 540.0 1.641 1.255 1.579 0.000 0.200 0.000 3/48114 550.0 1.613 1.232 1.552 0.000 0.196 0.000 3/48114 560.0 1.585 1.210 1.525 0.000 0.191 0.000 3/48114 570.0 1.559 1.189 1.500 0.000 0.187 0.000 3/48114 580.0 1.533 1.168 1.475 0.000 0.183 0.000 3/48114 590.0 1.508 1.148 1.452 0.000 0.180 0.000 3/48114 600.0 1.485 1.129 1.429 0.000 0.176 0.000 3/48114 610.0 1.462 1.111 1.407 0.000 0.173 0.000 3/48114 620.0 1.439 1.093 1.385 0.000 0.169 0.000 3/48114 630.0 1.418 1.076 1.365 0.000 0.166 0.000 3/48114 640.0 1.397 1.059 1.345 0.000 0.163 0.000 3/48114 650.0 1.377 1.043 1.326 0.000 0.160 0.000 3/48114 660.0 1.357 1.027 1.307 0.000 0.157 0.000 3/48114 670.0 1.338 1.012 1.289 0.000 0.154 0.000 3/48114 680.0 1.319 0.997 1.271 0.000 0.151 0.000 3/48114 690.0 1.301 0.983 1.254 0.000 0.149 0.000 3/48114 700.0 1.284 0.969 1.237 0.000 0.146 0.000 3/48114 710.0 1.267 0.955 1.221 0.000 0.144 0.000 3/48114 720.0 1.251 0.942 1.205 0.000 0.141 0.000 3/48114 730.0 1.235 0.930 1.190 0.000 0.139 0.000 3/48114 740.0 1.219 0.917 1.175 0.000 0.137 0.000 3/48114 750.0 1.204 0.905 1.160 0.000 0.135 0.000 3/48114 760.0 1.189 0.893 1.146 0.000 0.132 0.000 3/48114 770.0 1.174 0.882 1.133 0.000 0.130 0.000 3/48114 780.0 1.160 0.871 1.119 0.000 0.128 0.000 3/48114 790.0 1.147 0.860 1.106 0.000 0.126 0.000 3/48114 800.0 1.133 0.849 1.093 0.000 0.125 0.000 3/48114 810.0 1.120 0.839 1.081 0.000 0.123 0.000 3/48114 820.0 1.107 0.829 1.069 0.000 0.121 0.000 3/48114 830.0 1.095 0.819 1.057 0.000 0.119 0.000 3/48114 840.0 1.083 0.810 1.045 0.000 0.118 0.000 3/48114 850.0 1.071 0.800 1.034 0.000 0.116 0.000 3/48114 860.0 1.059 0.791 1.023 0.000 0.114 0.000 3/48114 870.0 1.048 0.782 1.012 0.000 0.113 0.000 3/48114 880.0 1.036 0.774 1.001 0.000 0.111 0.000 3/48114 890.0 1.026 0.765 0.991 0.000 0.110 0.000 3/48114 900.0 1.015 0.757 0.981 0.000 0.108 0.000 3/48114 910.0 1.004 0.749 0.971 0.000 0.107 0.000 3/48114 920.0 0.994 0.741 0.961 0.000 0.106 0.000 3/48114 930.0 0.984 0.733 0.951 0.000 0.104 0.000 3/48114 940.0 0.974 0.725 0.942 0.000 0.103 0.000 3/48114 950.0 0.965 0.718 0.933 0.000 0.102 0.000 3/48114 960.0 0.955 0.710 0.924 0.000 0.100 0.000 3/48114 970.0 0.946 0.703 0.915 0.000 0.099 0.000 3/48114 980.0 0.937 0.696 0.906 0.000 0.098 0.000 3/48114 990.0 0.928 0.689 0.898 0.000 0.097 0.000 3/48114 1000.0 0.919 0.682 0.890 0.000 0.096 0.000 3/48114 Thermal conductivity related properties were written into "kappa-m999.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 01:24:56]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|