----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 19:31:03]------------------------- 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: [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.397634112257501 0.000000000000000 0.000000000000000 b 0.000000000000000 5.614722880000001 0.000000000000000 c -5.365457182140984 0.000000000000000 7.767458503867597 Atomic positions (fractional): *1 F 0.23189345303691 0.76851925783490 0.06725666724914 18.998 2 F 0.76810654696309 0.26851925783490 0.43274333275086 18.998 3 F 0.76810654696309 0.23148074216510 0.93274333275086 18.998 4 F 0.23189345303691 0.73148074216510 0.56725666724914 18.998 *5 F 0.67831198109050 0.67511310538467 0.95219966432429 18.998 6 F 0.32168801890950 0.17511310538468 0.54780033567571 18.998 7 F 0.32168801890950 0.32488689461532 0.04780033567571 18.998 8 F 0.67831198109050 0.82488689461533 0.45219966432429 18.998 *9 F 0.88924103055856 0.95075116479403 0.28048655795510 18.998 10 F 0.11075896944144 0.45075116479403 0.21951344204490 18.998 11 F 0.11075896944144 0.04924883520597 0.71951344204490 18.998 12 F 0.88924103055856 0.54924883520597 0.78048655795510 18.998 *13 Na 0.27024628456623 0.44479922561443 0.75387465345564 22.990 14 Na 0.72975371543377 0.94479922561443 0.74612534654436 22.990 15 Na 0.72975371543377 0.55520077438557 0.24612534654436 22.990 16 Na 0.27024628456623 0.05520077438557 0.25387465345564 22.990 *17 Na 0.50000000000000 0.50000000000000 0.50000000000000 22.990 18 Na 0.50000000000000 0.00000000000000 0.00000000000000 22.990 *19 Al 0.00000000000000 0.50000000000000 0.00000000000000 26.982 20 Al 0.00000000000000 0.00000000000000 0.50000000000000 26.982 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.397634112257501 0.000000000000000 0.000000000000000 b 0.000000000000000 5.614722880000001 0.000000000000000 c -5.365457182140984 0.000000000000000 7.767458503867597 Atomic positions (fractional): *1 F 0.23189345303691 0.76851925783490 0.06725666724914 18.998 > 1 2 F 0.76810654696309 0.26851925783490 0.43274333275086 18.998 > 2 3 F 0.76810654696309 0.23148074216510 0.93274333275086 18.998 > 3 4 F 0.23189345303691 0.73148074216510 0.56725666724914 18.998 > 4 *5 F 0.67831198109050 0.67511310538467 0.95219966432429 18.998 > 5 6 F 0.32168801890950 0.17511310538468 0.54780033567571 18.998 > 6 7 F 0.32168801890950 0.32488689461532 0.04780033567571 18.998 > 7 8 F 0.67831198109050 0.82488689461533 0.45219966432429 18.998 > 8 *9 F 0.88924103055856 0.95075116479403 0.28048655795510 18.998 > 9 10 F 0.11075896944144 0.45075116479403 0.21951344204490 18.998 > 10 11 F 0.11075896944144 0.04924883520597 0.71951344204490 18.998 > 11 12 F 0.88924103055856 0.54924883520597 0.78048655795510 18.998 > 12 *13 Na 0.27024628456623 0.44479922561443 0.75387465345564 22.990 > 13 14 Na 0.72975371543377 0.94479922561443 0.74612534654436 22.990 > 14 15 Na 0.72975371543377 0.55520077438557 0.24612534654436 22.990 > 15 16 Na 0.27024628456623 0.05520077438557 0.25387465345564 22.990 > 16 *17 Na 0.50000000000000 0.50000000000000 0.50000000000000 22.990 > 17 18 Na 0.50000000000000 0.00000000000000 0.00000000000000 22.990 > 18 *19 Al 0.00000000000000 0.50000000000000 0.00000000000000 26.982 > 19 20 Al 0.00000000000000 0.00000000000000 0.50000000000000 26.982 > 20 -------------------------------- super cell -------------------------------- Lattice vectors: a 10.795268224515002 0.000000000000000 0.000000000000000 b 0.000000000000000 11.229445760000003 0.000000000000000 c -5.365457182140984 0.000000000000000 7.767458503867597 Atomic positions (fractional): *1 F 0.11594672651846 0.38425962891745 0.06725666724914 18.998 > 1 2 F 0.61594672651846 0.38425962891745 0.06725666724914 18.998 > 1 3 F 0.11594672651846 0.88425962891745 0.06725666724914 18.998 > 1 4 F 0.61594672651846 0.88425962891745 0.06725666724914 18.998 > 1 5 F 0.38405327348154 0.13425962891745 0.43274333275086 18.998 > 2 6 F 0.88405327348154 0.13425962891745 0.43274333275086 18.998 > 2 7 F 0.38405327348154 0.63425962891745 0.43274333275086 18.998 > 2 8 F 0.88405327348154 0.63425962891745 0.43274333275086 18.998 > 2 9 F 0.38405327348154 0.11574037108255 0.93274333275086 18.998 > 3 10 F 0.88405327348154 0.11574037108255 0.93274333275086 18.998 > 3 11 F 0.38405327348154 0.61574037108255 0.93274333275086 18.998 > 3 12 F 0.88405327348154 0.61574037108255 0.93274333275086 18.998 > 3 13 F 0.11594672651846 0.36574037108255 0.56725666724914 18.998 > 4 14 F 0.61594672651846 0.36574037108255 0.56725666724914 18.998 > 4 15 F 0.11594672651846 0.86574037108255 0.56725666724914 18.998 > 4 16 F 0.61594672651846 0.86574037108255 0.56725666724914 18.998 > 4 *17 F 0.33915599054525 0.33755655269234 0.95219966432429 18.998 > 5 18 F 0.83915599054525 0.33755655269234 0.95219966432429 18.998 > 5 19 F 0.33915599054525 0.83755655269234 0.95219966432429 18.998 > 5 20 F 0.83915599054525 0.83755655269234 0.95219966432429 18.998 > 5 21 F 0.16084400945475 0.08755655269234 0.54780033567571 18.998 > 6 22 F 0.66084400945475 0.08755655269234 0.54780033567571 18.998 > 6 23 F 0.16084400945475 0.58755655269234 0.54780033567571 18.998 > 6 24 F 0.66084400945475 0.58755655269234 0.54780033567571 18.998 > 6 25 F 0.16084400945475 0.16244344730766 0.04780033567571 18.998 > 7 26 F 0.66084400945475 0.16244344730766 0.04780033567571 18.998 > 7 27 F 0.16084400945475 0.66244344730766 0.04780033567571 18.998 > 7 28 F 0.66084400945475 0.66244344730766 0.04780033567571 18.998 > 7 29 F 0.33915599054525 0.41244344730766 0.45219966432429 18.998 > 8 30 F 0.83915599054525 0.41244344730766 0.45219966432429 18.998 > 8 31 F 0.33915599054525 0.91244344730766 0.45219966432429 18.998 > 8 32 F 0.83915599054525 0.91244344730766 0.45219966432429 18.998 > 8 *33 F 0.44462051527928 0.47537558239701 0.28048655795510 18.998 > 9 34 F 0.94462051527928 0.47537558239701 0.28048655795510 18.998 > 9 35 F 0.44462051527928 0.97537558239701 0.28048655795510 18.998 > 9 36 F 0.94462051527928 0.97537558239701 0.28048655795510 18.998 > 9 37 F 0.05537948472072 0.22537558239701 0.21951344204490 18.998 > 10 38 F 0.55537948472072 0.22537558239701 0.21951344204490 18.998 > 10 39 F 0.05537948472072 0.72537558239701 0.21951344204490 18.998 > 10 40 F 0.55537948472072 0.72537558239701 0.21951344204490 18.998 > 10 41 F 0.05537948472072 0.02462441760299 0.71951344204490 18.998 > 11 42 F 0.55537948472072 0.02462441760299 0.71951344204490 18.998 > 11 43 F 0.05537948472072 0.52462441760299 0.71951344204490 18.998 > 11 44 F 0.55537948472072 0.52462441760299 0.71951344204490 18.998 > 11 45 F 0.44462051527928 0.27462441760299 0.78048655795510 18.998 > 12 46 F 0.94462051527928 0.27462441760299 0.78048655795510 18.998 > 12 47 F 0.44462051527928 0.77462441760299 0.78048655795510 18.998 > 12 48 F 0.94462051527928 0.77462441760299 0.78048655795510 18.998 > 12 *49 Na 0.13512314228312 0.22239961280722 0.75387465345564 22.990 > 13 50 Na 0.63512314228311 0.22239961280722 0.75387465345564 22.990 > 13 51 Na 0.13512314228312 0.72239961280722 0.75387465345564 22.990 > 13 52 Na 0.63512314228311 0.72239961280722 0.75387465345564 22.990 > 13 53 Na 0.36487685771688 0.47239961280722 0.74612534654436 22.990 > 14 54 Na 0.86487685771689 0.47239961280722 0.74612534654436 22.990 > 14 55 Na 0.36487685771688 0.97239961280722 0.74612534654436 22.990 > 14 56 Na 0.86487685771689 0.97239961280722 0.74612534654436 22.990 > 14 57 Na 0.36487685771688 0.27760038719278 0.24612534654436 22.990 > 15 58 Na 0.86487685771689 0.27760038719278 0.24612534654436 22.990 > 15 59 Na 0.36487685771688 0.77760038719278 0.24612534654436 22.990 > 15 60 Na 0.86487685771689 0.77760038719278 0.24612534654436 22.990 > 15 61 Na 0.13512314228312 0.02760038719278 0.25387465345564 22.990 > 16 62 Na 0.63512314228311 0.02760038719278 0.25387465345564 22.990 > 16 63 Na 0.13512314228312 0.52760038719278 0.25387465345564 22.990 > 16 64 Na 0.63512314228311 0.52760038719278 0.25387465345564 22.990 > 16 *65 Na 0.25000000000000 0.25000000000000 0.50000000000000 22.990 > 17 66 Na 0.75000000000000 0.25000000000000 0.50000000000000 22.990 > 17 67 Na 0.25000000000000 0.75000000000000 0.50000000000000 22.990 > 17 68 Na 0.75000000000000 0.75000000000000 0.50000000000000 22.990 > 17 69 Na 0.25000000000000 0.00000000000000 0.00000000000000 22.990 > 18 70 Na 0.75000000000000 0.00000000000000 0.00000000000000 22.990 > 18 71 Na 0.25000000000000 0.50000000000000 0.00000000000000 22.990 > 18 72 Na 0.75000000000000 0.50000000000000 0.00000000000000 22.990 > 18 *73 Al 0.00000000000000 0.25000000000000 0.00000000000000 26.982 > 19 74 Al 0.50000000000000 0.25000000000000 0.00000000000000 26.982 > 19 75 Al 0.00000000000000 0.75000000000000 0.00000000000000 26.982 > 19 76 Al 0.50000000000000 0.75000000000000 0.00000000000000 26.982 > 19 77 Al 0.00000000000000 0.00000000000000 0.50000000000000 26.982 > 20 78 Al 0.50000000000000 0.00000000000000 0.50000000000000 26.982 > 20 79 Al 0.00000000000000 0.50000000000000 0.50000000000000 26.982 > 20 80 Al 0.50000000000000 0.50000000000000 0.50000000000000 26.982 > 20 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 1.8990885 0.0000000 0.0015345 0.0000000 1.8958256 0.0000000 0.0015345 0.0000000 1.8988117 -------------------------- Born effective charges -------------------------- 1 F -0.9401210 -0.1580796 -0.0759476 -0.1594494 -1.1212160 -0.0991128 -0.0761505 -0.0955400 -0.8767672 2 F -0.9401210 0.1580796 -0.0759476 0.1594494 -1.1212160 0.0991128 -0.0761505 0.0955400 -0.8767672 3 F -0.9401210 -0.1580796 -0.0759476 -0.1594494 -1.1212160 -0.0991128 -0.0761505 -0.0955400 -0.8767672 4 F -0.9401210 0.1580796 -0.0759476 0.1594494 -1.1212160 0.0991128 -0.0761505 0.0955400 -0.8767672 5 F -1.0960450 0.1666022 -0.0427549 0.1657393 -0.9617419 0.0433692 -0.0456608 0.0436850 -0.8620259 6 F -1.0960450 -0.1666022 -0.0427549 -0.1657393 -0.9617419 -0.0433692 -0.0456608 -0.0436850 -0.8620259 7 F -1.0960450 0.1666022 -0.0427549 0.1657393 -0.9617419 0.0433692 -0.0456608 0.0436850 -0.8620259 8 F -1.0960450 -0.1666022 -0.0427549 -0.1657393 -0.9617419 -0.0433692 -0.0456608 -0.0436850 -0.8620259 9 F -0.8871370 -0.0015324 0.1108079 -0.0061362 -0.8364903 -0.0613190 0.1095557 -0.0580763 -1.1862446 10 F -0.8871370 0.0015324 0.1108079 0.0061362 -0.8364903 0.0613190 0.1095557 0.0580763 -1.1862446 11 F -0.8871370 -0.0015324 0.1108079 -0.0061362 -0.8364903 -0.0613190 0.1095557 -0.0580763 -1.1862446 12 F -0.8871370 0.0015324 0.1108079 0.0061362 -0.8364903 0.0613190 0.1095557 0.0580763 -1.1862446 13 Na 1.0710352 0.0040333 0.0083064 0.0110378 1.0656802 0.0177256 -0.0012348 0.0254087 1.0724921 14 Na 1.0710352 -0.0040333 0.0083064 -0.0110378 1.0656802 -0.0177256 -0.0012348 -0.0254087 1.0724921 15 Na 1.0710352 0.0040333 0.0083064 0.0110378 1.0656802 0.0177256 -0.0012348 0.0254087 1.0724921 16 Na 1.0710352 -0.0040333 0.0083064 -0.0110378 1.0656802 -0.0177256 -0.0012348 -0.0254087 1.0724921 17 Na 1.0467933 0.0131601 -0.0231214 -0.0136648 1.0603082 0.0063736 0.0186636 0.0177349 1.0564816 18 Na 1.0467933 -0.0131601 -0.0231214 0.0136648 1.0603082 -0.0063736 0.0186636 -0.0177349 1.0564816 19 Al 2.6577424 0.0170303 0.0222978 0.0111744 2.6472278 -0.0024720 0.0083172 0.0010978 2.6486098 20 Al 2.6577424 -0.0170303 0.0222978 -0.0111744 2.6472278 0.0024720 0.0083172 -0.0010978 2.6486098 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 240/240 Permutation basis: 7440/7440 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1908 Number of blocks in projector: 1908 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: 404 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 232 Use standard eigh solver. Tree of FC basis block matrices: - (1908, 1855), data: False |-- (232, 226), data: True |-- (232, 226), data: True |-- (232, 226), data: True |-- (404, 393), data: True |-- (404, 392), data: True |-- (404, 392), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 640 - Time: 2.405 Solver_block: 200 / 640 - Time: 2.362 Solver_block: 300 / 640 - Time: 2.306 Solver_block: 400 / 640 - Time: 2.851 Solver_block: 500 / 640 - Time: 2.224 Solver_block: 600 / 640 - Time: 2.307 Solver_block: 640 / 640 - Time: 1.001 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 15.550 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 240/240 Permutation basis: 7440/7440 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1908 Number of blocks in projector: 1908 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: 404 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 232 Use standard eigh solver. Tree of FC basis block matrices: - (1908, 1855), data: False |-- (232, 226), data: True |-- (232, 226), data: True |-- (232, 226), data: True |-- (404, 393), data: True |-- (404, 392), data: True |-- (404, 392), data: True Max drift after symmetrization by symfc projector: -0.00000000 (xx) -0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-07 19:31:42]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 19:31:43]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.397634112257501 0.000000000000000 0.000000000000000 b 0.000000000000000 5.614722880000001 0.000000000000000 c -5.365457182140984 0.000000000000000 7.767458503867597 Atomic positions (fractional): 1 F 0.23189345303691 0.76851925783490 0.06725666724914 18.998 2 F 0.76810654696309 0.26851925783490 0.43274333275086 18.998 3 F 0.76810654696309 0.23148074216510 0.93274333275086 18.998 4 F 0.23189345303691 0.73148074216510 0.56725666724914 18.998 5 F 0.67831198109050 0.67511310538467 0.95219966432429 18.998 6 F 0.32168801890950 0.17511310538468 0.54780033567571 18.998 7 F 0.32168801890950 0.32488689461532 0.04780033567571 18.998 8 F 0.67831198109050 0.82488689461533 0.45219966432429 18.998 9 F 0.88924103055856 0.95075116479403 0.28048655795510 18.998 10 F 0.11075896944144 0.45075116479403 0.21951344204490 18.998 11 F 0.11075896944144 0.04924883520597 0.71951344204490 18.998 12 F 0.88924103055856 0.54924883520597 0.78048655795510 18.998 13 Na 0.27024628456623 0.44479922561443 0.75387465345564 22.990 14 Na 0.72975371543377 0.94479922561443 0.74612534654436 22.990 15 Na 0.72975371543377 0.55520077438557 0.24612534654436 22.990 16 Na 0.27024628456623 0.05520077438557 0.25387465345564 22.990 17 Na 0.50000000000000 0.50000000000000 0.50000000000000 22.990 18 Na 0.50000000000000 0.00000000000000 0.00000000000000 22.990 19 Al 0.00000000000000 0.50000000000000 0.00000000000000 26.982 20 Al 0.00000000000000 0.00000000000000 0.50000000000000 26.982 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.795268224515002 0.000000000000000 0.000000000000000 b 0.000000000000000 11.229445760000003 0.000000000000000 c -5.365457182140984 0.000000000000000 7.767458503867597 Atomic positions (fractional): 1 F 0.11594672651846 0.38425962891745 0.06725666724914 18.998 > 1 2 F 0.61594672651846 0.38425962891745 0.06725666724914 18.998 > 1 3 F 0.11594672651846 0.88425962891745 0.06725666724914 18.998 > 1 4 F 0.61594672651846 0.88425962891745 0.06725666724914 18.998 > 1 5 F 0.38405327348154 0.13425962891745 0.43274333275086 18.998 > 5 6 F 0.88405327348154 0.13425962891745 0.43274333275086 18.998 > 5 7 F 0.38405327348154 0.63425962891745 0.43274333275086 18.998 > 5 8 F 0.88405327348154 0.63425962891745 0.43274333275086 18.998 > 5 9 F 0.38405327348154 0.11574037108255 0.93274333275086 18.998 > 9 10 F 0.88405327348154 0.11574037108255 0.93274333275086 18.998 > 9 11 F 0.38405327348154 0.61574037108255 0.93274333275086 18.998 > 9 12 F 0.88405327348154 0.61574037108255 0.93274333275086 18.998 > 9 13 F 0.11594672651846 0.36574037108255 0.56725666724914 18.998 > 13 14 F 0.61594672651846 0.36574037108255 0.56725666724914 18.998 > 13 15 F 0.11594672651846 0.86574037108255 0.56725666724914 18.998 > 13 16 F 0.61594672651846 0.86574037108255 0.56725666724914 18.998 > 13 17 F 0.33915599054525 0.33755655269234 0.95219966432429 18.998 > 17 18 F 0.83915599054525 0.33755655269234 0.95219966432429 18.998 > 17 19 F 0.33915599054525 0.83755655269234 0.95219966432429 18.998 > 17 20 F 0.83915599054525 0.83755655269234 0.95219966432429 18.998 > 17 21 F 0.16084400945475 0.08755655269234 0.54780033567571 18.998 > 21 22 F 0.66084400945475 0.08755655269234 0.54780033567571 18.998 > 21 23 F 0.16084400945475 0.58755655269234 0.54780033567571 18.998 > 21 24 F 0.66084400945475 0.58755655269234 0.54780033567571 18.998 > 21 25 F 0.16084400945475 0.16244344730766 0.04780033567571 18.998 > 25 26 F 0.66084400945475 0.16244344730766 0.04780033567571 18.998 > 25 27 F 0.16084400945475 0.66244344730766 0.04780033567571 18.998 > 25 28 F 0.66084400945475 0.66244344730766 0.04780033567571 18.998 > 25 29 F 0.33915599054525 0.41244344730766 0.45219966432429 18.998 > 29 30 F 0.83915599054525 0.41244344730766 0.45219966432429 18.998 > 29 31 F 0.33915599054525 0.91244344730766 0.45219966432429 18.998 > 29 32 F 0.83915599054525 0.91244344730766 0.45219966432429 18.998 > 29 33 F 0.44462051527928 0.47537558239701 0.28048655795510 18.998 > 33 34 F 0.94462051527928 0.47537558239701 0.28048655795510 18.998 > 33 35 F 0.44462051527928 0.97537558239701 0.28048655795510 18.998 > 33 36 F 0.94462051527928 0.97537558239701 0.28048655795510 18.998 > 33 37 F 0.05537948472072 0.22537558239701 0.21951344204490 18.998 > 37 38 F 0.55537948472072 0.22537558239701 0.21951344204490 18.998 > 37 39 F 0.05537948472072 0.72537558239701 0.21951344204490 18.998 > 37 40 F 0.55537948472072 0.72537558239701 0.21951344204490 18.998 > 37 41 F 0.05537948472072 0.02462441760299 0.71951344204490 18.998 > 41 42 F 0.55537948472072 0.02462441760299 0.71951344204490 18.998 > 41 43 F 0.05537948472072 0.52462441760299 0.71951344204490 18.998 > 41 44 F 0.55537948472072 0.52462441760299 0.71951344204490 18.998 > 41 45 F 0.44462051527928 0.27462441760299 0.78048655795510 18.998 > 45 46 F 0.94462051527928 0.27462441760299 0.78048655795510 18.998 > 45 47 F 0.44462051527928 0.77462441760299 0.78048655795510 18.998 > 45 48 F 0.94462051527928 0.77462441760299 0.78048655795510 18.998 > 45 49 Na 0.13512314228312 0.22239961280722 0.75387465345564 22.990 > 49 50 Na 0.63512314228311 0.22239961280722 0.75387465345564 22.990 > 49 51 Na 0.13512314228312 0.72239961280722 0.75387465345564 22.990 > 49 52 Na 0.63512314228311 0.72239961280722 0.75387465345564 22.990 > 49 53 Na 0.36487685771688 0.47239961280722 0.74612534654436 22.990 > 53 54 Na 0.86487685771689 0.47239961280722 0.74612534654436 22.990 > 53 55 Na 0.36487685771688 0.97239961280722 0.74612534654436 22.990 > 53 56 Na 0.86487685771689 0.97239961280722 0.74612534654436 22.990 > 53 57 Na 0.36487685771688 0.27760038719278 0.24612534654436 22.990 > 57 58 Na 0.86487685771689 0.27760038719278 0.24612534654436 22.990 > 57 59 Na 0.36487685771688 0.77760038719278 0.24612534654436 22.990 > 57 60 Na 0.86487685771689 0.77760038719278 0.24612534654436 22.990 > 57 61 Na 0.13512314228312 0.02760038719278 0.25387465345564 22.990 > 61 62 Na 0.63512314228311 0.02760038719278 0.25387465345564 22.990 > 61 63 Na 0.13512314228312 0.52760038719278 0.25387465345564 22.990 > 61 64 Na 0.63512314228311 0.52760038719278 0.25387465345564 22.990 > 61 65 Na 0.25000000000000 0.25000000000000 0.50000000000000 22.990 > 65 66 Na 0.75000000000000 0.25000000000000 0.50000000000000 22.990 > 65 67 Na 0.25000000000000 0.75000000000000 0.50000000000000 22.990 > 65 68 Na 0.75000000000000 0.75000000000000 0.50000000000000 22.990 > 65 69 Na 0.25000000000000 0.00000000000000 0.00000000000000 22.990 > 69 70 Na 0.75000000000000 0.00000000000000 0.00000000000000 22.990 > 69 71 Na 0.25000000000000 0.50000000000000 0.00000000000000 22.990 > 69 72 Na 0.75000000000000 0.50000000000000 0.00000000000000 22.990 > 69 73 Al 0.00000000000000 0.25000000000000 0.00000000000000 26.982 > 73 74 Al 0.50000000000000 0.25000000000000 0.00000000000000 26.982 > 73 75 Al 0.00000000000000 0.75000000000000 0.00000000000000 26.982 > 73 76 Al 0.50000000000000 0.75000000000000 0.00000000000000 26.982 > 73 77 Al 0.00000000000000 0.00000000000000 0.50000000000000 26.982 > 77 78 Al 0.50000000000000 0.00000000000000 0.50000000000000 26.982 > 77 79 Al 0.00000000000000 0.50000000000000 0.50000000000000 26.982 > 77 80 Al 0.50000000000000 0.50000000000000 0.50000000000000 26.982 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 1.8990885 0.0000000 0.0015345 0.0000000 1.8958256 0.0000000 0.0015345 0.0000000 1.8988117 -------------------------- Born effective charges -------------------------- 1 F -0.9401210 -0.1580796 -0.0759476 -0.1594494 -1.1212160 -0.0991128 -0.0761505 -0.0955400 -0.8767672 2 F -0.9401210 0.1580796 -0.0759476 0.1594494 -1.1212160 0.0991128 -0.0761505 0.0955400 -0.8767672 3 F -0.9401210 -0.1580796 -0.0759476 -0.1594494 -1.1212160 -0.0991128 -0.0761505 -0.0955400 -0.8767672 4 F -0.9401210 0.1580796 -0.0759476 0.1594494 -1.1212160 0.0991128 -0.0761505 0.0955400 -0.8767672 5 F -1.0960450 0.1666022 -0.0427549 0.1657393 -0.9617419 0.0433692 -0.0456608 0.0436850 -0.8620259 6 F -1.0960450 -0.1666022 -0.0427549 -0.1657393 -0.9617419 -0.0433692 -0.0456608 -0.0436850 -0.8620259 7 F -1.0960450 0.1666022 -0.0427549 0.1657393 -0.9617419 0.0433692 -0.0456608 0.0436850 -0.8620259 8 F -1.0960450 -0.1666022 -0.0427549 -0.1657393 -0.9617419 -0.0433692 -0.0456608 -0.0436850 -0.8620259 9 F -0.8871370 -0.0015324 0.1108079 -0.0061362 -0.8364903 -0.0613190 0.1095557 -0.0580763 -1.1862446 10 F -0.8871370 0.0015324 0.1108079 0.0061362 -0.8364903 0.0613190 0.1095557 0.0580763 -1.1862446 11 F -0.8871370 -0.0015324 0.1108079 -0.0061362 -0.8364903 -0.0613190 0.1095557 -0.0580763 -1.1862446 12 F -0.8871370 0.0015324 0.1108079 0.0061362 -0.8364903 0.0613190 0.1095557 0.0580763 -1.1862446 13 Na 1.0710352 0.0040333 0.0083064 0.0110378 1.0656802 0.0177256 -0.0012348 0.0254087 1.0724921 14 Na 1.0710352 -0.0040333 0.0083064 -0.0110378 1.0656802 -0.0177256 -0.0012348 -0.0254087 1.0724921 15 Na 1.0710352 0.0040333 0.0083064 0.0110378 1.0656802 0.0177256 -0.0012348 0.0254087 1.0724921 16 Na 1.0710352 -0.0040333 0.0083064 -0.0110378 1.0656802 -0.0177256 -0.0012348 -0.0254087 1.0724921 17 Na 1.0467933 0.0131601 -0.0231214 -0.0136648 1.0603082 0.0063736 0.0186636 0.0177349 1.0564816 18 Na 1.0467933 -0.0131601 -0.0231214 0.0136648 1.0603082 -0.0063736 0.0186636 -0.0177349 1.0564816 19 Al 2.6577424 0.0170303 0.0222978 0.0111744 2.6472278 -0.0024720 0.0083172 0.0010978 2.6486098 20 Al 2.6577424 -0.0170303 0.0222978 -0.0111744 2.6472278 0.0024720 0.0083172 -0.0010978 2.6486098 ---------------------------------------------------------------------------- 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] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] 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] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] 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] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Computing fc3[ 65, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000001 (zzz) 0.00000001 (zzz) 0.00000001 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000003 (xy) -0.00000003 (xy) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 19:31:59]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 19:32:00]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.397634112257501 0.000000000000000 0.000000000000000 b 0.000000000000000 5.614722880000001 0.000000000000000 c -5.365457182140984 0.000000000000000 7.767458503867597 Atomic positions (fractional): 1 F 0.23189345303691 0.76851925783490 0.06725666724914 18.998 2 F 0.76810654696309 0.26851925783490 0.43274333275086 18.998 3 F 0.76810654696309 0.23148074216510 0.93274333275086 18.998 4 F 0.23189345303691 0.73148074216510 0.56725666724914 18.998 5 F 0.67831198109050 0.67511310538467 0.95219966432429 18.998 6 F 0.32168801890950 0.17511310538468 0.54780033567571 18.998 7 F 0.32168801890950 0.32488689461532 0.04780033567571 18.998 8 F 0.67831198109050 0.82488689461533 0.45219966432429 18.998 9 F 0.88924103055856 0.95075116479403 0.28048655795510 18.998 10 F 0.11075896944144 0.45075116479403 0.21951344204490 18.998 11 F 0.11075896944144 0.04924883520597 0.71951344204490 18.998 12 F 0.88924103055856 0.54924883520597 0.78048655795510 18.998 13 Na 0.27024628456623 0.44479922561443 0.75387465345564 22.990 14 Na 0.72975371543377 0.94479922561443 0.74612534654436 22.990 15 Na 0.72975371543377 0.55520077438557 0.24612534654436 22.990 16 Na 0.27024628456623 0.05520077438557 0.25387465345564 22.990 17 Na 0.50000000000000 0.50000000000000 0.50000000000000 22.990 18 Na 0.50000000000000 0.00000000000000 0.00000000000000 22.990 19 Al 0.00000000000000 0.50000000000000 0.00000000000000 26.982 20 Al 0.00000000000000 0.00000000000000 0.50000000000000 26.982 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.795268224515002 0.000000000000000 0.000000000000000 b 0.000000000000000 11.229445760000003 0.000000000000000 c -5.365457182140984 0.000000000000000 7.767458503867597 Atomic positions (fractional): 1 F 0.11594672651846 0.38425962891745 0.06725666724914 18.998 > 1 2 F 0.61594672651846 0.38425962891745 0.06725666724914 18.998 > 1 3 F 0.11594672651846 0.88425962891745 0.06725666724914 18.998 > 1 4 F 0.61594672651846 0.88425962891745 0.06725666724914 18.998 > 1 5 F 0.38405327348154 0.13425962891745 0.43274333275086 18.998 > 5 6 F 0.88405327348154 0.13425962891745 0.43274333275086 18.998 > 5 7 F 0.38405327348154 0.63425962891745 0.43274333275086 18.998 > 5 8 F 0.88405327348154 0.63425962891745 0.43274333275086 18.998 > 5 9 F 0.38405327348154 0.11574037108255 0.93274333275086 18.998 > 9 10 F 0.88405327348154 0.11574037108255 0.93274333275086 18.998 > 9 11 F 0.38405327348154 0.61574037108255 0.93274333275086 18.998 > 9 12 F 0.88405327348154 0.61574037108255 0.93274333275086 18.998 > 9 13 F 0.11594672651846 0.36574037108255 0.56725666724914 18.998 > 13 14 F 0.61594672651846 0.36574037108255 0.56725666724914 18.998 > 13 15 F 0.11594672651846 0.86574037108255 0.56725666724914 18.998 > 13 16 F 0.61594672651846 0.86574037108255 0.56725666724914 18.998 > 13 17 F 0.33915599054525 0.33755655269234 0.95219966432429 18.998 > 17 18 F 0.83915599054525 0.33755655269234 0.95219966432429 18.998 > 17 19 F 0.33915599054525 0.83755655269234 0.95219966432429 18.998 > 17 20 F 0.83915599054525 0.83755655269234 0.95219966432429 18.998 > 17 21 F 0.16084400945475 0.08755655269234 0.54780033567571 18.998 > 21 22 F 0.66084400945475 0.08755655269234 0.54780033567571 18.998 > 21 23 F 0.16084400945475 0.58755655269234 0.54780033567571 18.998 > 21 24 F 0.66084400945475 0.58755655269234 0.54780033567571 18.998 > 21 25 F 0.16084400945475 0.16244344730766 0.04780033567571 18.998 > 25 26 F 0.66084400945475 0.16244344730766 0.04780033567571 18.998 > 25 27 F 0.16084400945475 0.66244344730766 0.04780033567571 18.998 > 25 28 F 0.66084400945475 0.66244344730766 0.04780033567571 18.998 > 25 29 F 0.33915599054525 0.41244344730766 0.45219966432429 18.998 > 29 30 F 0.83915599054525 0.41244344730766 0.45219966432429 18.998 > 29 31 F 0.33915599054525 0.91244344730766 0.45219966432429 18.998 > 29 32 F 0.83915599054525 0.91244344730766 0.45219966432429 18.998 > 29 33 F 0.44462051527928 0.47537558239701 0.28048655795510 18.998 > 33 34 F 0.94462051527928 0.47537558239701 0.28048655795510 18.998 > 33 35 F 0.44462051527928 0.97537558239701 0.28048655795510 18.998 > 33 36 F 0.94462051527928 0.97537558239701 0.28048655795510 18.998 > 33 37 F 0.05537948472072 0.22537558239701 0.21951344204490 18.998 > 37 38 F 0.55537948472072 0.22537558239701 0.21951344204490 18.998 > 37 39 F 0.05537948472072 0.72537558239701 0.21951344204490 18.998 > 37 40 F 0.55537948472072 0.72537558239701 0.21951344204490 18.998 > 37 41 F 0.05537948472072 0.02462441760299 0.71951344204490 18.998 > 41 42 F 0.55537948472072 0.02462441760299 0.71951344204490 18.998 > 41 43 F 0.05537948472072 0.52462441760299 0.71951344204490 18.998 > 41 44 F 0.55537948472072 0.52462441760299 0.71951344204490 18.998 > 41 45 F 0.44462051527928 0.27462441760299 0.78048655795510 18.998 > 45 46 F 0.94462051527928 0.27462441760299 0.78048655795510 18.998 > 45 47 F 0.44462051527928 0.77462441760299 0.78048655795510 18.998 > 45 48 F 0.94462051527928 0.77462441760299 0.78048655795510 18.998 > 45 49 Na 0.13512314228312 0.22239961280722 0.75387465345564 22.990 > 49 50 Na 0.63512314228311 0.22239961280722 0.75387465345564 22.990 > 49 51 Na 0.13512314228312 0.72239961280722 0.75387465345564 22.990 > 49 52 Na 0.63512314228311 0.72239961280722 0.75387465345564 22.990 > 49 53 Na 0.36487685771688 0.47239961280722 0.74612534654436 22.990 > 53 54 Na 0.86487685771689 0.47239961280722 0.74612534654436 22.990 > 53 55 Na 0.36487685771688 0.97239961280722 0.74612534654436 22.990 > 53 56 Na 0.86487685771689 0.97239961280722 0.74612534654436 22.990 > 53 57 Na 0.36487685771688 0.27760038719278 0.24612534654436 22.990 > 57 58 Na 0.86487685771689 0.27760038719278 0.24612534654436 22.990 > 57 59 Na 0.36487685771688 0.77760038719278 0.24612534654436 22.990 > 57 60 Na 0.86487685771689 0.77760038719278 0.24612534654436 22.990 > 57 61 Na 0.13512314228312 0.02760038719278 0.25387465345564 22.990 > 61 62 Na 0.63512314228311 0.02760038719278 0.25387465345564 22.990 > 61 63 Na 0.13512314228312 0.52760038719278 0.25387465345564 22.990 > 61 64 Na 0.63512314228311 0.52760038719278 0.25387465345564 22.990 > 61 65 Na 0.25000000000000 0.25000000000000 0.50000000000000 22.990 > 65 66 Na 0.75000000000000 0.25000000000000 0.50000000000000 22.990 > 65 67 Na 0.25000000000000 0.75000000000000 0.50000000000000 22.990 > 65 68 Na 0.75000000000000 0.75000000000000 0.50000000000000 22.990 > 65 69 Na 0.25000000000000 0.00000000000000 0.00000000000000 22.990 > 69 70 Na 0.75000000000000 0.00000000000000 0.00000000000000 22.990 > 69 71 Na 0.25000000000000 0.50000000000000 0.00000000000000 22.990 > 69 72 Na 0.75000000000000 0.50000000000000 0.00000000000000 22.990 > 69 73 Al 0.00000000000000 0.25000000000000 0.00000000000000 26.982 > 73 74 Al 0.50000000000000 0.25000000000000 0.00000000000000 26.982 > 73 75 Al 0.00000000000000 0.75000000000000 0.00000000000000 26.982 > 73 76 Al 0.50000000000000 0.75000000000000 0.00000000000000 26.982 > 73 77 Al 0.00000000000000 0.00000000000000 0.50000000000000 26.982 > 77 78 Al 0.50000000000000 0.00000000000000 0.50000000000000 26.982 > 77 79 Al 0.00000000000000 0.50000000000000 0.50000000000000 26.982 > 77 80 Al 0.50000000000000 0.50000000000000 0.50000000000000 26.982 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 1.8990885 0.0000000 0.0015345 0.0000000 1.8958256 0.0000000 0.0015345 0.0000000 1.8988117 -------------------------- Born effective charges -------------------------- 1 F -0.9401210 -0.1580796 -0.0759476 -0.1594494 -1.1212160 -0.0991128 -0.0761505 -0.0955400 -0.8767672 2 F -0.9401210 0.1580796 -0.0759476 0.1594494 -1.1212160 0.0991128 -0.0761505 0.0955400 -0.8767672 3 F -0.9401210 -0.1580796 -0.0759476 -0.1594494 -1.1212160 -0.0991128 -0.0761505 -0.0955400 -0.8767672 4 F -0.9401210 0.1580796 -0.0759476 0.1594494 -1.1212160 0.0991128 -0.0761505 0.0955400 -0.8767672 5 F -1.0960450 0.1666022 -0.0427549 0.1657393 -0.9617419 0.0433692 -0.0456608 0.0436850 -0.8620259 6 F -1.0960450 -0.1666022 -0.0427549 -0.1657393 -0.9617419 -0.0433692 -0.0456608 -0.0436850 -0.8620259 7 F -1.0960450 0.1666022 -0.0427549 0.1657393 -0.9617419 0.0433692 -0.0456608 0.0436850 -0.8620259 8 F -1.0960450 -0.1666022 -0.0427549 -0.1657393 -0.9617419 -0.0433692 -0.0456608 -0.0436850 -0.8620259 9 F -0.8871370 -0.0015324 0.1108079 -0.0061362 -0.8364903 -0.0613190 0.1095557 -0.0580763 -1.1862446 10 F -0.8871370 0.0015324 0.1108079 0.0061362 -0.8364903 0.0613190 0.1095557 0.0580763 -1.1862446 11 F -0.8871370 -0.0015324 0.1108079 -0.0061362 -0.8364903 -0.0613190 0.1095557 -0.0580763 -1.1862446 12 F -0.8871370 0.0015324 0.1108079 0.0061362 -0.8364903 0.0613190 0.1095557 0.0580763 -1.1862446 13 Na 1.0710352 0.0040333 0.0083064 0.0110378 1.0656802 0.0177256 -0.0012348 0.0254087 1.0724921 14 Na 1.0710352 -0.0040333 0.0083064 -0.0110378 1.0656802 -0.0177256 -0.0012348 -0.0254087 1.0724921 15 Na 1.0710352 0.0040333 0.0083064 0.0110378 1.0656802 0.0177256 -0.0012348 0.0254087 1.0724921 16 Na 1.0710352 -0.0040333 0.0083064 -0.0110378 1.0656802 -0.0177256 -0.0012348 -0.0254087 1.0724921 17 Na 1.0467933 0.0131601 -0.0231214 -0.0136648 1.0603082 0.0063736 0.0186636 0.0177349 1.0564816 18 Na 1.0467933 -0.0131601 -0.0231214 0.0136648 1.0603082 -0.0063736 0.0186636 -0.0177349 1.0564816 19 Al 2.6577424 0.0170303 0.0222978 0.0111744 2.6472278 -0.0024720 0.0083172 0.0010978 2.6486098 20 Al 2.6577424 -0.0170303 0.0222978 -0.0111744 2.6472278 0.0024720 0.0083172 -0.0010978 2.6486098 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000001 (zzz) 0.00000001 (zzz) 0.00000001 (zzz) Max drift of fc2: -0.00000000 (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 ... [ 11 9 6 ] 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: 0.67, Number of G-points: 311, Lambda: 0.10 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/170) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.440 ( 0.000 0.000 0.000) 0.000 2.504 ( 0.000 0.000 0.000) 0.000 2.570 ( 0.000 0.000 0.000) 0.000 2.611 ( 0.000 0.000 0.000) 0.000 2.611 ( 0.000 0.000 0.000) 0.000 3.805 ( 0.000 0.000 0.000) 0.000 3.866 ( 0.000 0.000 0.000) 0.000 3.913 ( 0.000 0.000 0.000) 0.000 4.102 ( 0.000 0.000 0.000) 0.000 4.240 ( 0.000 0.000 0.000) 0.000 4.495 ( 0.000 0.000 0.000) 0.000 4.562 ( 0.000 0.000 0.000) 0.000 4.658 ( 0.000 0.000 0.000) 0.000 4.941 ( 0.000 0.000 0.000) 0.000 5.020 ( 0.000 0.000 0.000) 0.000 5.075 ( 0.000 0.000 0.000) 0.000 5.423 ( 0.000 0.000 0.000) 0.000 5.758 ( 0.000 0.000 0.000) 0.000 5.920 ( 0.000 0.000 0.000) 0.000 6.053 ( 0.000 0.000 0.000) 0.000 6.173 ( 0.000 0.000 0.000) 0.000 6.270 ( 0.000 0.000 0.000) 0.000 6.284 ( 0.000 0.000 0.000) 0.000 6.380 ( 0.000 0.000 0.000) 0.000 6.695 ( 0.000 0.000 0.000) 0.000 6.698 ( 0.000 0.000 0.000) 0.000 6.919 ( 0.000 0.000 0.000) 0.000 7.268 ( 0.000 0.000 0.000) 0.000 7.441 ( 0.000 0.000 0.000) 0.000 7.469 ( 0.000 0.000 0.000) 0.000 7.665 ( 0.000 0.000 0.000) 0.000 7.890 ( 0.000 0.000 0.000) 0.000 8.233 ( 0.000 0.000 0.000) 0.000 9.006 ( 0.000 0.000 0.000) 0.000 9.320 ( 0.000 0.000 0.000) 0.000 9.621 ( 0.000 0.000 0.000) 0.000 9.871 ( 0.000 0.000 0.000) 0.000 10.010 ( 0.000 0.000 0.000) 0.000 10.053 ( 0.000 0.000 0.000) 0.000 11.237 ( 0.000 0.000 0.000) 0.000 11.250 ( 0.000 0.000 0.000) 0.000 11.663 ( 0.000 0.000 0.000) 0.000 11.769 ( 0.000 0.000 0.000) 0.000 11.831 ( 0.000 0.000 0.000) 0.000 11.875 ( 0.000 0.000 0.000) 0.000 11.897 ( 0.000 0.000 0.000) 0.000 11.942 ( 0.000 0.000 0.000) 0.000 12.101 ( 0.000 0.000 0.000) 0.000 13.174 ( 0.000 0.000 0.000) 0.000 16.005 ( 0.000 0.000 0.000) 0.000 16.028 ( 0.000 0.000 0.000) 0.000 16.718 ( 0.000 0.000 0.000) 0.000 16.907 ( 0.000 0.000 0.000) 0.000 17.097 ( 0.000 0.000 0.000) 0.000 17.743 ( 0.000 0.000 0.000) 0.000 17.944 ( 0.000 0.000 0.000) 0.000 18.406 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/170) ======================= q-point: ( 0.09 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.613 ( 24.834 0.000 15.298) 29.168 0.687 ( 30.522 0.000 13.513) 33.380 1.155 ( 41.749 0.000 36.239) 55.283 2.285 ( -17.955 0.000 5.248) 18.706 2.459 ( -7.178 0.000 -4.028) 8.231 2.552 ( 3.306 0.000 6.104) 6.942 2.732 ( 14.148 0.000 -3.926) 14.683 2.877 ( 3.954 0.000 8.995) 9.826 3.654 ( -17.964 0.000 2.999) 18.213 3.702 ( -3.229 0.000 -15.264) 15.602 3.923 ( -5.521 0.000 7.537) 9.343 4.092 ( -8.868 0.000 -9.400) 12.923 4.206 ( 0.663 0.000 8.697) 8.722 4.539 ( -0.303 0.000 2.090) 2.111 4.638 ( -3.027 0.000 11.602) 11.990 4.642 ( 0.578 0.000 -6.723) 6.747 4.927 ( 0.917 0.000 -3.567) 3.683 4.990 ( -1.903 0.000 2.115) 2.845 5.459 ( 6.165 0.000 -4.490) 7.627 5.616 ( -2.530 0.000 -4.019) 4.749 5.767 ( -0.107 0.000 4.990) 4.991 5.884 ( -9.107 0.000 1.059) 9.169 6.116 ( -4.719 0.000 -4.693) 6.655 6.157 ( -10.125 0.000 -2.963) 10.550 6.258 ( 1.803 0.000 0.284) 1.825 6.405 ( 8.873 0.000 2.289) 9.164 6.678 ( 5.357 0.000 -0.848) 5.424 6.755 ( 2.745 0.000 5.420) 6.075 6.822 ( -1.603 0.000 20.068) 20.132 7.007 ( 3.372 0.000 -3.159) 4.620 7.340 ( 4.475 0.000 1.071) 4.601 7.437 ( 0.045 0.000 1.881) 1.882 7.547 ( 0.865 0.000 -5.925) 5.988 7.878 ( -1.898 0.000 1.098) 2.193 7.989 ( -4.321 0.000 -5.433) 6.942 8.845 ( -3.752 0.000 -10.535) 11.183 9.045 ( 1.806 0.000 2.770) 3.306 9.334 ( 1.477 0.000 0.488) 1.556 9.622 ( 0.520 0.000 -1.191) 1.299 9.938 ( 2.828 0.000 6.822) 7.385 10.000 ( -2.238 0.000 -1.614) 2.759 10.009 ( -2.000 0.000 -0.970) 2.222 11.239 ( -0.745 0.000 1.046) 1.285 11.262 ( 1.643 0.000 -0.266) 1.664 11.680 ( 1.837 0.000 0.026) 1.837 11.781 ( -0.133 0.000 -2.120) 2.124 11.795 ( -6.260 0.000 -1.952) 6.557 11.902 ( -3.477 0.000 -2.385) 4.216 11.922 ( 3.931 0.000 1.328) 4.150 12.192 ( 7.244 0.000 0.119) 7.245 12.237 ( 1.974 0.000 -4.160) 4.605 13.133 ( -2.447 0.000 -3.464) 4.242 16.018 ( 0.843 0.000 0.957) 1.276 16.036 ( 0.693 0.000 0.547) 0.883 16.915 ( -0.249 0.000 1.407) 1.429 16.923 ( -11.607 0.000 17.274) 20.812 17.383 ( 7.104 0.000 -17.530) 18.914 17.873 ( 11.569 0.000 4.492) 12.411 18.344 ( -6.857 0.000 0.065) 6.857 19.997 ( -0.883 0.000 -3.586) 3.693 ======================= Grid point 2 (3/170) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.172 ( 22.124 0.000 11.773) 25.062 1.322 ( 27.351 0.000 10.685) 29.364 1.995 ( -7.259 0.000 2.543) 7.692 2.248 ( 26.467 0.000 27.614) 38.250 2.271 ( -7.526 0.000 -5.103) 9.093 2.764 ( 10.626 0.000 12.750) 16.598 2.948 ( 14.842 0.000 -6.437) 16.178 3.009 ( 7.184 0.000 -2.392) 7.571 3.375 ( -16.981 0.000 2.963) 17.238 3.464 ( -3.487 0.000 -11.276) 11.802 3.776 ( -13.517 0.000 -10.575) 17.163 3.867 ( -9.324 0.000 1.846) 9.505 4.195 ( -7.496 0.000 0.769) 7.535 4.571 ( -0.230 0.000 4.322) 4.328 4.620 ( 0.319 0.000 5.636) 5.645 4.691 ( -5.397 0.000 8.008) 9.657 4.893 ( 2.607 0.000 -6.951) 7.424 5.011 ( 3.035 0.000 -2.970) 4.246 5.488 ( 1.442 0.000 -2.533) 2.915 5.517 ( -14.548 0.000 6.139) 15.790 5.658 ( -10.132 0.000 1.550) 10.249 5.901 ( 4.433 0.000 10.342) 11.252 5.976 ( -2.814 0.000 -6.218) 6.825 6.050 ( 1.114 0.000 -7.465) 7.547 6.278 ( 3.419 0.000 -5.027) 6.080 6.593 ( 9.692 0.000 2.062) 9.909 6.758 ( 6.912 0.000 -2.485) 7.345 6.907 ( 4.310 0.000 9.743) 10.653 6.936 ( -1.127 0.000 0.604) 1.279 7.078 ( 6.498 0.000 1.469) 6.662 7.325 ( -4.323 0.000 -0.093) 4.324 7.477 ( -2.201 0.000 -3.394) 4.045 7.539 ( 5.993 0.000 1.068) 6.087 7.811 ( -8.748 0.000 -5.192) 10.173 7.859 ( -3.655 0.000 3.694) 5.196 8.612 ( -9.105 0.000 -9.969) 13.501 9.121 ( 2.087 0.000 4.229) 4.716 9.387 ( 3.127 0.000 1.569) 3.499 9.604 ( -1.407 0.000 -0.414) 1.467 9.894 ( -4.895 0.000 -2.285) 5.402 9.993 ( 0.130 0.000 -0.984) 0.993 10.100 ( 4.673 0.000 8.955) 10.101 11.224 ( -2.979 0.000 1.509) 3.340 11.296 ( 3.051 0.000 -1.002) 3.211 11.699 ( -2.490 0.000 -1.803) 3.074 11.702 ( -0.720 0.000 0.196) 0.746 11.773 ( 4.072 0.000 -3.054) 5.090 11.794 ( -4.253 0.000 -3.112) 5.270 12.021 ( 5.997 0.000 0.598) 6.026 12.218 ( -0.709 0.000 -0.647) 0.960 12.293 ( 5.125 0.000 -1.387) 5.309 13.011 ( -5.014 0.000 -6.725) 8.388 16.055 ( 1.646 0.000 1.706) 2.371 16.063 ( 1.378 0.000 1.000) 1.703 16.923 ( -1.135 0.000 1.571) 1.938 16.927 ( -4.597 0.000 6.653) 8.087 17.267 ( -0.641 0.000 -11.174) 11.192 18.081 ( 2.972 0.000 -9.944) 10.379 18.315 ( 4.546 0.000 17.680) 18.255 19.919 ( -3.737 0.000 -2.818) 4.680 ======================= Grid point 3 (4/170) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.594 ( 15.374 0.000 4.092) 15.909 1.776 ( -0.755 0.000 3.220) 3.307 1.845 ( 9.716 0.000 -0.049) 9.717 2.135 ( -5.245 0.000 2.279) 5.719 2.799 ( 13.270 0.000 5.886) 14.517 2.921 ( -3.530 0.000 -9.461) 10.098 2.996 ( 4.746 0.000 -6.489) 8.040 3.157 ( -10.458 0.000 -1.100) 10.515 3.395 ( 10.822 0.000 23.217) 25.616 3.480 ( 2.788 0.000 2.930) 4.044 3.489 ( 10.271 0.000 -7.475) 12.703 3.661 ( -5.799 0.000 -2.085) 6.163 4.129 ( -4.312 0.000 6.145) 7.507 4.599 ( -10.682 0.000 1.586) 10.799 4.635 ( -0.948 0.000 5.888) 5.963 4.693 ( -3.585 0.000 7.968) 8.737 4.866 ( 4.862 0.000 -8.369) 9.679 5.006 ( 3.552 0.000 -6.309) 7.240 5.286 ( -15.044 0.000 5.016) 15.858 5.437 ( -4.723 0.000 -1.600) 4.987 5.676 ( 1.739 0.000 7.447) 7.648 5.897 ( -0.917 0.000 -1.394) 1.669 5.975 ( -1.541 0.000 -4.465) 4.723 6.100 ( 5.234 0.000 5.282) 7.436 6.276 ( 5.474 0.000 -5.429) 7.710 6.757 ( 8.240 0.000 -1.336) 8.348 6.832 ( 1.433 0.000 -6.622) 6.775 6.863 ( 2.994 0.000 -5.788) 6.517 7.104 ( 4.908 0.000 9.682) 10.855 7.174 ( 2.535 0.000 0.031) 2.535 7.252 ( -5.832 0.000 4.293) 7.242 7.420 ( -0.865 0.000 -1.435) 1.675 7.592 ( -10.795 0.000 -2.936) 11.187 7.610 ( 4.065 0.000 -2.790) 4.931 7.823 ( -7.273 0.000 4.854) 8.744 8.328 ( -9.935 0.000 -10.289) 14.303 9.204 ( 1.841 0.000 4.086) 4.481 9.434 ( -0.102 0.000 -0.242) 0.263 9.573 ( -2.187 0.000 0.475) 2.238 9.820 ( -1.354 0.000 -1.530) 2.043 10.023 ( 4.293 0.000 2.571) 5.003 10.284 ( 4.561 0.000 8.675) 9.801 11.182 ( -3.969 0.000 2.058) 4.470 11.331 ( 2.008 0.000 -0.865) 2.186 11.609 ( -4.929 0.000 -3.232) 5.894 11.670 ( -0.398 0.000 -2.858) 2.886 11.764 ( 3.086 0.000 0.086) 3.087 11.837 ( 5.125 0.000 -0.549) 5.155 12.108 ( 4.472 0.000 -2.707) 5.227 12.219 ( 0.071 0.000 3.368) 3.369 12.324 ( 1.543 0.000 -3.226) 3.575 12.815 ( -6.866 0.000 -9.028) 11.342 16.104 ( 1.813 0.000 1.136) 2.140 16.110 ( 2.180 0.000 2.056) 2.997 16.902 ( -2.543 0.000 -0.233) 2.554 16.914 ( -3.575 0.000 2.395) 4.302 17.122 ( -2.089 0.000 -8.552) 8.804 17.890 ( -7.615 0.000 -7.683) 10.817 18.740 ( 15.573 0.000 17.038) 23.083 19.815 ( -4.621 0.000 -2.346) 5.183 ======================= Grid point 4 (5/170) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.643 ( -6.321 0.000 -1.629) 6.527 1.771 ( 5.577 0.000 -0.920) 5.652 2.013 ( 4.542 0.000 -5.527) 7.154 2.145 ( -2.809 0.000 7.629) 8.130 2.776 ( -1.019 0.000 -8.002) 8.067 2.896 ( 2.041 0.000 -4.614) 5.045 2.996 ( -6.625 0.000 -1.843) 6.877 3.079 ( 6.642 0.000 0.019) 6.642 3.334 ( -3.040 0.000 -8.356) 8.892 3.374 ( 1.918 0.000 7.076) 7.331 3.851 ( 13.047 0.000 2.784) 13.341 4.090 ( 10.705 0.000 17.810) 20.780 4.168 ( -2.003 0.000 8.786) 9.012 4.400 ( -8.947 0.000 4.616) 10.068 4.663 ( -4.438 0.000 0.126) 4.440 4.723 ( 2.759 0.000 5.759) 6.386 4.851 ( 5.258 0.000 -9.345) 10.723 5.013 ( 3.717 0.000 -2.723) 4.608 5.159 ( -6.557 0.000 2.999) 7.210 5.300 ( -6.613 0.000 -4.345) 7.912 5.829 ( 1.989 0.000 10.528) 10.715 5.894 ( -2.589 0.000 4.067) 4.821 5.932 ( 1.816 0.000 0.301) 1.841 6.120 ( 2.642 0.000 -9.118) 9.493 6.396 ( 6.015 0.000 5.554) 8.187 6.653 ( -3.639 0.000 -12.277) 12.806 6.811 ( 3.670 0.000 -6.184) 7.191 6.915 ( 4.644 0.000 -3.735) 5.959 7.162 ( -2.778 0.000 -1.860) 3.343 7.244 ( -1.963 0.000 9.115) 9.324 7.278 ( -10.608 0.000 -5.891) 12.134 7.301 ( 3.829 0.000 6.950) 7.935 7.526 ( 2.833 0.000 3.480) 4.487 7.630 ( 3.499 0.000 -4.560) 5.748 7.729 ( -9.443 0.000 4.491) 10.457 8.057 ( -8.708 0.000 -8.727) 12.328 9.272 ( 1.257 0.000 2.849) 3.114 9.382 ( -2.861 0.000 -2.243) 3.636 9.546 ( -1.719 0.000 0.737) 1.871 9.774 ( -1.461 0.000 -2.581) 2.966 10.217 ( 9.846 0.000 7.260) 12.233 10.443 ( 3.308 0.000 6.709) 7.480 11.146 ( -3.273 0.000 2.249) 3.971 11.337 ( -0.308 0.000 -0.386) 0.494 11.499 ( -4.140 0.000 -1.547) 4.420 11.635 ( 1.426 0.000 -4.363) 4.590 11.856 ( 5.913 0.000 1.523) 6.106 11.918 ( 3.431 0.000 1.611) 3.790 12.109 ( 0.789 0.000 -2.994) 3.096 12.269 ( -2.185 0.000 -5.144) 5.588 12.290 ( 2.513 0.000 3.079) 3.974 12.594 ( -6.398 0.000 -8.441) 10.591 16.146 ( 1.689 0.000 0.892) 1.910 16.170 ( 2.034 0.000 1.783) 2.705 16.832 ( -3.471 0.000 -2.577) 4.323 16.852 ( -4.469 0.000 -0.841) 4.547 17.025 ( -0.172 0.000 -4.479) 4.482 17.706 ( -5.545 0.000 -3.829) 6.738 19.157 ( 12.032 0.000 12.621) 17.437 19.720 ( -3.735 0.000 -1.564) 4.049 ======================= Grid point 5 (6/170) ======================= q-point: ( 0.45 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.550 ( -2.217 0.000 -1.436) 2.641 1.827 ( 1.984 0.000 -0.049) 1.984 1.957 ( -1.116 0.000 -3.522) 3.695 2.175 ( -2.595 0.000 5.745) 6.304 2.642 ( -0.898 0.000 -9.740) 9.781 2.878 ( 0.555 0.000 -1.977) 2.053 2.942 ( -0.871 0.000 1.982) 2.165 3.146 ( 1.853 0.000 0.332) 1.883 3.276 ( 0.393 0.000 -0.912) 0.993 3.572 ( 6.962 0.000 6.441) 9.485 4.027 ( 5.052 0.000 0.412) 5.068 4.037 ( -7.675 0.000 -4.201) 8.750 4.233 ( -0.822 0.000 4.750) 4.820 4.584 ( 0.699 0.000 17.925) 17.939 4.604 ( -0.955 0.000 -0.978) 1.367 4.754 ( 1.192 0.000 -10.735) 10.801 4.889 ( 5.005 0.000 0.688) 5.052 5.052 ( 2.771 0.000 -1.065) 2.969 5.112 ( -1.843 0.000 0.762) 1.994 5.159 ( -3.893 0.000 -2.442) 4.596 5.868 ( -3.732 0.000 1.647) 4.079 5.915 ( -0.340 0.000 4.856) 4.868 6.075 ( 2.173 0.000 -4.436) 4.939 6.093 ( 6.882 0.000 5.869) 9.044 6.484 ( -1.651 0.000 -6.562) 6.766 6.537 ( 2.442 0.000 4.548) 5.163 6.776 ( 0.930 0.000 -4.682) 4.774 6.871 ( -4.979 0.000 -6.055) 7.839 7.002 ( -3.160 0.000 -2.718) 4.168 7.173 ( -1.109 0.000 0.163) 1.121 7.308 ( -0.995 0.000 4.785) 4.887 7.418 ( 2.443 0.000 2.576) 3.550 7.611 ( -0.655 0.000 -2.419) 2.506 7.656 ( 6.367 0.000 4.438) 7.761 7.660 ( -2.349 0.000 1.787) 2.952 7.835 ( -7.510 0.000 -6.162) 9.714 9.309 ( 0.452 0.000 1.012) 1.108 9.323 ( -1.279 0.000 -1.095) 1.684 9.533 ( -0.630 0.000 0.339) 0.716 9.728 ( -0.795 0.000 -1.267) 1.496 10.429 ( 5.211 0.000 3.765) 6.429 10.538 ( 1.240 0.000 2.649) 2.925 11.124 ( -1.517 0.000 1.073) 1.858 11.323 ( -0.618 0.000 -0.138) 0.633 11.442 ( -1.569 0.000 -0.068) 1.570 11.617 ( 0.938 0.000 -2.138) 2.335 11.977 ( 4.782 0.000 2.343) 5.325 11.979 ( 1.137 0.000 1.665) 2.016 12.086 ( 0.165 0.000 -1.779) 1.786 12.151 ( -3.532 0.000 -4.568) 5.774 12.348 ( 1.127 0.000 1.073) 1.556 12.439 ( -2.813 0.000 -3.498) 4.489 16.175 ( 0.742 0.000 0.352) 0.821 16.211 ( 0.877 0.000 0.733) 1.143 16.754 ( -1.768 0.000 -1.678) 2.437 16.780 ( -2.012 0.000 -0.827) 2.175 16.995 ( 0.160 0.000 -1.301) 1.311 17.619 ( -1.800 0.000 -0.903) 2.014 19.403 ( 4.403 0.000 4.706) 6.445 19.662 ( -1.431 0.000 -0.546) 1.531 ======================= Grid point 11 (7/170) ======================= q-point: ( 0.00 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.609 ( 0.000 30.349 0.000) 30.349 0.678 ( 0.000 33.634 0.000) 33.634 1.144 ( 0.000 55.947 0.000) 55.947 2.423 ( 0.000 -1.310 0.000) 1.310 2.515 ( 0.000 1.277 0.000) 1.277 2.571 ( 0.000 -0.069 0.000) 0.069 2.690 ( 0.000 4.384 0.000) 4.384 2.815 ( 0.000 15.326 0.000) 15.326 3.500 ( 0.000 -22.534 0.000) 22.534 3.807 ( 0.000 -9.317 0.000) 9.317 3.910 ( 0.000 -7.782 0.000) 7.782 4.022 ( 0.000 -6.496 0.000) 6.496 4.235 ( 0.000 -0.422 0.000) 0.422 4.631 ( 0.000 7.149 0.000) 7.149 4.785 ( 0.000 -12.989 0.000) 12.989 4.794 ( 0.000 19.875 0.000) 19.875 4.853 ( 0.000 3.589 0.000) 3.589 4.979 ( 0.000 -2.490 0.000) 2.490 5.104 ( 0.000 2.094 0.000) 2.094 5.654 ( 0.000 4.504 0.000) 4.504 5.851 ( 0.000 4.346 0.000) 4.346 5.913 ( 0.000 1.115 0.000) 1.115 5.982 ( 0.000 -7.658 0.000) 7.658 6.157 ( 0.000 -1.311 0.000) 1.311 6.202 ( 0.000 -5.200 0.000) 5.200 6.239 ( 0.000 -10.742 0.000) 10.742 6.619 ( 0.000 2.507 0.000) 2.507 6.701 ( 0.000 -0.088 0.000) 0.088 6.933 ( 0.000 6.597 0.000) 6.597 6.975 ( 0.000 4.479 0.000) 4.479 7.300 ( 0.000 2.299 0.000) 2.299 7.447 ( 0.000 -2.869 0.000) 2.869 7.591 ( 0.000 1.442 0.000) 1.442 7.728 ( 0.000 6.255 0.000) 6.255 8.233 ( 0.000 -0.173 0.000) 0.173 8.821 ( 0.000 -13.603 0.000) 13.603 9.132 ( 0.000 4.423 0.000) 4.423 9.315 ( 0.000 -0.526 0.000) 0.526 9.660 ( 0.000 3.269 0.000) 3.269 9.885 ( 0.000 1.288 0.000) 1.288 10.009 ( 0.000 -0.104 0.000) 0.104 10.022 ( 0.000 -2.835 0.000) 2.835 11.250 ( 0.000 -0.053 0.000) 0.053 11.555 ( 0.000 -3.611 0.000) 3.611 11.658 ( 0.000 -7.035 0.000) 7.035 11.682 ( 0.000 0.872 0.000) 0.872 11.824 ( 0.000 -0.632 0.000) 0.632 11.880 ( 0.000 1.084 0.000) 1.084 11.957 ( 0.000 4.822 0.000) 4.822 12.072 ( 0.000 9.020 0.000) 9.020 12.108 ( 0.000 -1.633 0.000) 1.633 13.070 ( 0.000 -9.746 0.000) 9.746 16.016 ( 0.000 1.096 0.000) 1.096 16.037 ( 0.000 0.970 0.000) 0.970 16.792 ( 0.000 6.756 0.000) 6.756 17.105 ( 0.000 0.818 0.000) 0.818 17.664 ( 0.000 -3.378 0.000) 3.378 18.024 ( 0.000 8.182 0.000) 8.182 18.285 ( 0.000 -6.426 0.000) 6.426 19.722 ( 0.000 -2.877 0.000) 2.877 ======================= Grid point 12 (8/170) ======================= q-point: ( 0.09 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.887 ( 13.381 24.053 14.417) 31.072 1.010 ( 20.787 21.793 16.459) 34.321 1.547 ( 29.505 35.756 17.771) 49.648 2.316 ( -13.742 3.019 3.131) 14.413 2.447 ( -4.789 -0.712 -2.819) 5.602 2.531 ( 0.657 0.160 4.079) 4.134 2.785 ( 12.745 3.283 -5.922) 14.432 2.966 ( 5.352 9.450 6.282) 12.546 3.442 ( -6.238 -17.204 0.071) 18.300 3.677 ( -7.998 -4.109 -7.813) 11.912 3.841 ( -5.082 -6.803 -0.968) 8.546 4.098 ( 0.792 -9.528 6.972) 11.833 4.128 ( -7.863 2.079 -4.394) 9.244 4.626 ( -5.897 1.416 3.923) 7.223 4.667 ( -3.922 5.843 -3.173) 7.719 4.796 ( 1.616 -9.261 -2.138) 9.641 4.825 ( -3.293 14.409 4.813) 15.545 5.007 ( 1.406 1.040 0.889) 1.962 5.341 ( 10.938 -6.519 0.247) 12.736 5.605 ( -3.264 -0.385 -7.450) 8.143 5.799 ( -6.704 -0.192 6.189) 9.126 5.894 ( -2.027 2.310 0.699) 3.152 5.935 ( 0.203 -5.425 -0.957) 5.512 6.056 ( -4.349 -5.478 -3.158) 7.675 6.258 ( 4.513 -5.664 1.286) 7.356 6.530 ( 6.606 4.672 2.236) 8.394 6.621 ( 4.499 -5.114 5.941) 9.038 6.776 ( 3.491 -0.487 6.435) 7.336 6.858 ( -2.178 7.134 2.088) 7.746 7.019 ( 2.697 1.474 -2.691) 4.085 7.358 ( 3.960 0.981 0.429) 4.102 7.473 ( 1.613 0.941 -1.051) 2.143 7.603 ( 2.627 2.988 -1.836) 4.381 7.760 ( 2.394 0.461 -0.205) 2.446 8.141 ( -6.159 4.901 -5.278) 9.477 8.697 ( -11.111 -13.855 -3.735) 18.148 9.060 ( -1.563 4.187 0.912) 4.561 9.334 ( 0.768 -0.495 2.286) 2.462 9.631 ( -3.170 1.835 2.516) 4.443 9.860 ( 2.251 -3.702 1.424) 4.561 10.007 ( 0.859 -0.118 -1.656) 1.869 10.018 ( -3.783 -0.500 -1.123) 3.977 11.267 ( 1.084 0.486 0.658) 1.358 11.354 ( -4.742 5.027 -1.061) 6.992 11.644 ( 0.597 -3.020 0.389) 3.103 11.742 ( -0.966 -3.316 -1.553) 3.787 11.863 ( -1.688 4.459 -2.410) 5.342 11.900 ( -3.794 2.928 0.666) 4.838 12.034 ( 1.116 6.271 -2.441) 6.821 12.094 ( 8.447 -9.063 2.020) 12.552 12.224 ( 10.764 3.537 0.075) 11.331 13.037 ( -1.526 -9.006 -3.544) 9.798 16.025 ( 0.432 0.756 0.915) 1.263 16.047 ( 0.736 0.996 0.560) 1.359 16.831 ( 1.556 3.295 2.285) 4.301 17.102 ( -1.928 4.033 2.632) 5.188 17.642 ( -7.164 15.617 -16.182) 23.603 17.830 ( 9.840 -3.232 2.691) 10.701 18.312 ( -6.274 -2.312 4.501) 8.061 19.799 ( 0.131 -12.276 3.002) 12.639 ======================= Grid point 13 (9/170) ======================= q-point: ( 0.18 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.318 ( 15.399 15.613 14.225) 26.139 1.550 ( 23.240 17.666 10.645) 31.073 2.017 ( -7.749 2.442 1.225) 8.216 2.283 ( -6.376 1.248 -4.067) 7.665 2.379 ( 19.867 10.725 15.871) 27.597 2.757 ( 13.685 2.781 16.858) 21.891 2.939 ( 8.783 -2.299 -3.891) 9.878 3.054 ( 3.851 3.165 -3.256) 5.954 3.330 ( -2.965 -4.857 -5.439) 7.872 3.464 ( -4.749 2.246 -4.267) 6.768 3.681 ( -9.598 -7.230 -6.618) 13.718 3.925 ( -10.231 4.160 -3.382) 11.551 4.101 ( -5.247 -7.831 0.710) 9.452 4.589 ( -0.761 -1.046 5.322) 5.477 4.642 ( -5.127 -1.230 5.653) 7.730 4.763 ( -2.402 -3.824 -1.387) 4.724 4.793 ( -4.047 7.388 1.377) 8.535 5.078 ( 5.647 3.452 -1.305) 6.746 5.395 ( -6.448 -5.172 2.520) 8.642 5.488 ( -4.245 -3.897 -0.952) 5.841 5.661 ( -8.916 -0.424 1.329) 9.024 5.934 ( -3.764 -0.202 6.299) 7.340 5.955 ( 2.908 -2.119 -3.475) 5.002 6.001 ( 5.859 1.800 -1.445) 6.297 6.295 ( 1.290 -2.892 -3.668) 4.846 6.600 ( 5.953 0.763 1.097) 6.102 6.792 ( 7.776 3.599 -1.787) 8.753 6.857 ( 1.610 -1.559 -2.065) 3.047 6.963 ( 4.256 -2.774 9.335) 10.628 7.054 ( 3.640 0.950 0.808) 3.847 7.340 ( -4.173 -0.181 -1.877) 4.579 7.476 ( -0.347 2.241 -0.854) 2.423 7.651 ( 4.241 5.287 -1.130) 6.872 7.758 ( -1.977 0.973 -2.542) 3.364 7.958 ( -9.035 5.434 -1.099) 10.601 8.461 ( -8.447 -13.342 -7.115) 17.320 9.098 ( 0.902 -0.764 4.283) 4.443 9.397 ( 1.638 0.104 4.226) 4.534 9.611 ( -2.121 0.617 1.422) 2.627 9.895 ( -5.594 -0.469 -3.167) 6.445 9.966 ( 1.904 -5.202 5.640) 7.906 10.018 ( 3.459 -2.307 0.148) 4.160 11.283 ( -0.864 2.503 0.811) 2.769 11.318 ( 0.245 2.972 -0.503) 3.024 11.660 ( 0.561 -2.992 0.252) 3.054 11.695 ( -0.829 -3.916 -2.158) 4.547 11.781 ( -4.484 6.059 -2.192) 7.850 11.873 ( 1.949 4.665 -1.985) 5.431 12.053 ( 3.883 1.332 -3.020) 5.096 12.175 ( 2.219 -0.824 1.513) 2.809 12.380 ( 7.531 6.405 -1.562) 10.008 12.934 ( -3.654 -7.135 -6.750) 10.479 16.052 ( 1.100 0.010 1.431) 1.805 16.074 ( 1.259 0.828 1.198) 1.925 16.878 ( 1.488 2.114 1.287) 2.888 17.098 ( -3.173 7.843 3.298) 9.080 17.360 ( -4.894 8.429 -13.724) 16.833 18.061 ( 7.416 -1.971 -6.752) 10.221 18.290 ( -0.699 -1.684 17.458) 17.553 19.773 ( -3.999 -12.608 -0.291) 13.230 ======================= Grid point 14 (10/170) ======================= q-point: ( 0.27 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.660 ( 8.256 9.099 7.044) 14.162 1.842 ( -8.421 3.479 -1.047) 9.171 1.968 ( 13.352 10.492 1.091) 17.016 2.202 ( 0.551 7.463 4.254) 8.608 2.735 ( 8.849 -5.015 5.135) 11.394 2.905 ( -2.267 -1.378 -9.679) 10.036 2.975 ( 1.235 -1.839 -0.581) 2.290 3.188 ( -4.971 -0.343 -9.193) 10.457 3.429 ( -3.597 -1.967 -5.785) 7.090 3.460 ( 21.155 4.853 26.058) 33.914 3.529 ( 10.753 2.294 -2.042) 11.183 3.707 ( -7.459 6.686 -2.920) 10.434 4.054 ( -3.013 -5.635 4.327) 7.717 4.548 ( -9.819 -6.319 0.408) 11.684 4.636 ( -5.154 -5.563 4.361) 8.749 4.723 ( -3.776 3.693 3.428) 6.297 4.775 ( 4.331 0.450 -1.018) 4.472 5.133 ( 4.099 6.360 -3.859) 8.494 5.249 ( -12.604 -1.444 5.782) 13.941 5.403 ( -3.885 -3.610 -3.708) 6.471 5.643 ( -0.240 -3.616 7.767) 8.571 5.890 ( -2.115 -1.483 0.434) 2.620 5.971 ( 1.223 1.314 -1.704) 2.475 6.127 ( 3.948 1.701 -0.166) 4.302 6.287 ( 3.750 0.839 0.040) 3.843 6.706 ( 4.597 -4.405 -2.045) 6.687 6.775 ( -1.984 -5.253 -7.633) 9.476 6.901 ( 7.221 4.961 -2.473) 9.104 7.100 ( 3.103 -6.874 0.538) 7.561 7.162 ( 4.418 3.124 5.042) 7.395 7.237 ( -5.327 -2.097 1.685) 5.968 7.455 ( -1.885 3.760 1.394) 4.431 7.602 ( -9.141 3.996 -4.507) 10.947 7.693 ( 2.019 3.865 -1.857) 4.739 7.847 ( -7.054 2.559 3.005) 8.083 8.252 ( -5.321 -6.326 -8.670) 11.979 9.170 ( 1.427 -2.518 4.433) 5.294 9.438 ( -3.057 -0.080 3.000) 4.284 9.593 ( -1.462 1.131 -0.298) 1.872 9.798 ( -1.924 -2.196 -1.291) 3.192 10.028 ( 4.141 0.487 2.489) 4.856 10.161 ( 5.137 -9.336 6.970) 12.733 11.250 ( -3.679 4.783 1.279) 6.168 11.330 ( 1.191 -0.054 -0.618) 1.343 11.636 ( -1.465 -1.070 -3.455) 3.902 11.653 ( -3.276 0.801 -1.695) 3.775 11.738 ( 3.532 0.579 -0.130) 3.582 11.920 ( 4.919 6.179 -0.626) 7.923 12.062 ( 2.299 -2.973 -4.579) 5.923 12.245 ( 2.499 3.148 3.482) 5.318 12.442 ( 3.348 9.041 -3.161) 10.146 12.764 ( -5.307 -4.568 -8.867) 11.299 16.092 ( 1.630 -0.721 1.376) 2.252 16.116 ( 1.595 0.246 1.680) 2.329 16.910 ( 1.515 3.234 -0.382) 3.592 17.041 ( -6.659 8.587 -0.328) 10.872 17.169 ( -1.864 4.403 -7.945) 9.272 17.927 ( -7.598 4.127 -5.657) 10.332 18.666 ( 13.988 -7.271 16.809) 23.045 19.684 ( -4.890 -12.325 -1.347) 13.328 ======================= Grid point 15 (11/170) ======================= q-point: ( 0.36 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.664 ( -6.437 2.557 -0.965) 6.993 1.821 ( 3.397 5.739 0.584) 6.694 2.040 ( -0.196 3.601 -1.043) 3.754 2.283 ( -1.363 10.820 -0.588) 10.921 2.784 ( 1.428 -2.297 -3.755) 4.627 2.846 ( 1.158 0.613 -3.118) 3.382 2.966 ( -3.704 -2.847 -4.197) 6.280 3.106 ( 7.120 2.051 1.673) 7.596 3.372 ( 1.161 -0.990 3.655) 3.960 3.493 ( 0.675 13.075 -8.328) 15.516 3.813 ( 10.955 -2.546 3.682) 11.834 4.025 ( 4.861 -6.534 11.024) 13.706 4.090 ( 0.225 -5.139 8.694) 10.102 4.384 ( -5.345 -4.309 3.281) 7.609 4.576 ( -3.379 -3.100 0.122) 4.587 4.719 ( -0.932 -2.161 4.370) 4.963 4.845 ( 3.821 0.665 -1.714) 4.241 5.137 ( 3.106 8.753 -4.183) 10.186 5.175 ( -4.830 1.151 5.262) 7.235 5.261 ( -5.764 -3.320 -5.399) 8.567 5.777 ( 1.477 -5.124 10.139) 11.456 5.877 ( -1.575 -1.755 2.398) 3.363 5.999 ( 2.258 5.519 2.592) 6.502 6.089 ( 0.211 -2.411 -6.738) 7.159 6.419 ( 4.618 1.927 5.168) 7.194 6.579 ( -3.077 -5.998 -11.889) 13.667 6.741 ( 0.922 -6.921 -3.388) 7.761 6.968 ( 3.628 5.342 -4.708) 7.991 7.062 ( -2.968 -7.921 -2.897) 8.941 7.223 ( -0.717 -4.604 4.154) 6.242 7.306 ( 2.233 1.843 3.139) 4.271 7.380 ( -5.750 0.203 -1.414) 5.924 7.488 ( -1.067 9.836 3.688) 10.559 7.647 ( -7.564 -5.060 1.287) 9.191 7.803 ( 2.195 8.711 -1.742) 9.151 8.084 ( -4.266 2.303 -6.383) 8.015 9.240 ( 1.291 -2.757 3.245) 4.449 9.380 ( -4.278 -0.518 -0.471) 4.335 9.556 ( -1.929 0.610 0.042) 2.024 9.759 ( -1.339 -1.481 -2.017) 2.839 10.204 ( 8.976 -1.706 6.308) 11.103 10.314 ( 3.419 -10.196 6.176) 12.401 11.205 ( -3.313 4.153 1.356) 5.483 11.332 ( -0.294 -0.334 -0.361) 0.573 11.546 ( -3.892 3.964 -1.073) 5.658 11.614 ( 1.296 -1.718 -4.041) 4.578 11.820 ( 4.568 -1.106 1.283) 4.872 12.000 ( 4.341 3.191 -2.030) 5.757 12.040 ( 1.394 -0.364 -1.949) 2.423 12.319 ( 0.610 3.170 3.485) 4.750 12.427 ( 0.884 10.368 -4.841) 11.477 12.575 ( -4.649 -0.825 -7.632) 8.974 16.133 ( 1.497 -1.160 0.920) 2.106 16.163 ( 1.539 -0.699 1.577) 2.312 16.886 ( -2.558 4.814 -4.591) 7.127 16.936 ( -2.027 7.384 -0.307) 7.663 17.084 ( -1.849 6.131 -2.871) 7.018 17.751 ( -6.517 4.710 -2.793) 8.512 19.059 ( 11.295 -9.683 12.067) 19.156 19.592 ( -3.889 -12.350 -1.227) 13.006 ======================= Grid point 16 (12/170) ======================= q-point: ( 0.45 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.569 ( -2.447 2.038 -1.325) 3.449 1.882 ( 1.815 5.538 1.652) 6.058 2.002 ( -0.599 4.791 -2.788) 5.576 2.198 ( -4.768 2.591 1.141) 5.545 2.702 ( -1.277 4.745 -7.686) 9.123 2.806 ( 0.572 -5.337 -1.111) 5.481 3.004 ( 2.244 6.481 3.023) 7.495 3.201 ( 1.984 4.969 0.839) 5.416 3.445 ( 1.044 13.794 -1.468) 13.911 3.525 ( 5.780 -4.625 4.053) 8.439 3.960 ( -5.334 -6.359 -0.023) 8.300 3.991 ( 4.421 -3.729 -2.322) 6.232 4.125 ( -2.373 -8.399 3.533) 9.416 4.437 ( 1.022 -11.002 -0.844) 11.082 4.625 ( -1.836 1.032 15.144) 15.290 4.768 ( 2.633 -0.434 -5.881) 6.458 4.855 ( 2.601 -1.888 -1.789) 3.679 5.118 ( -2.245 -2.923 -3.100) 4.816 5.152 ( 1.088 6.124 -1.050) 6.308 5.179 ( -1.367 5.635 2.112) 6.171 5.847 ( -3.985 -1.990 1.335) 4.650 5.879 ( 0.904 -3.498 3.563) 5.075 6.024 ( 1.767 -4.401 -2.058) 5.169 6.166 ( 5.143 5.897 5.712) 9.687 6.392 ( -1.381 -6.805 -5.889) 9.105 6.559 ( 1.810 0.618 4.188) 4.604 6.694 ( -0.360 -7.503 -5.028) 9.040 6.850 ( -6.066 -5.378 -4.948) 9.498 7.028 ( 1.339 5.521 -2.476) 6.197 7.199 ( -2.067 4.564 0.017) 5.010 7.323 ( -0.195 -8.542 2.776) 8.984 7.406 ( 0.705 -3.060 1.669) 3.556 7.526 ( 0.705 8.323 1.557) 8.497 7.547 ( -3.733 -5.001 0.699) 6.280 7.846 ( 3.957 8.780 -1.167) 9.701 7.961 ( -3.945 8.775 -2.297) 9.892 9.283 ( 0.654 -2.451 1.267) 2.836 9.317 ( -1.833 -0.906 -0.743) 2.175 9.536 ( -0.732 0.339 0.284) 0.855 9.718 ( -0.775 -0.991 -1.178) 1.723 10.392 ( 5.003 -6.716 1.937) 8.596 10.409 ( 0.861 -7.843 4.029) 8.859 11.174 ( -1.539 3.304 0.542) 3.685 11.319 ( -0.452 -0.072 -0.237) 0.515 11.495 ( -1.505 4.779 0.132) 5.012 11.597 ( 0.874 -1.897 -2.029) 2.912 11.905 ( 2.250 -2.319 3.036) 4.434 11.970 ( 0.209 -3.833 -5.090) 6.376 12.100 ( 2.236 6.660 1.442) 7.172 12.309 ( -2.123 5.738 -0.841) 6.175 12.411 ( 1.399 6.433 -1.119) 6.678 12.459 ( -1.851 4.520 -2.503) 5.489 16.159 ( 0.613 -1.453 0.326) 1.611 16.196 ( 0.682 -1.416 0.652) 1.701 16.812 ( -0.980 5.591 -1.615) 5.902 16.900 ( -1.410 10.897 -0.867) 11.022 17.042 ( -0.429 4.800 -0.939) 4.909 17.657 ( -2.307 3.884 -0.617) 4.560 19.292 ( 4.250 -10.856 4.457) 12.481 19.534 ( -1.539 -12.538 -0.483) 12.641 ======================= Grid point 22 (13/170) ======================= q-point: ( 0.00 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.194 ( 0.000 28.563 0.000) 28.563 1.319 ( 0.000 30.892 0.000) 30.892 2.115 ( 0.000 33.956 0.000) 33.956 2.424 ( 0.000 3.694 0.000) 3.694 2.583 ( 0.000 0.999 0.000) 0.999 2.593 ( 0.000 10.831 0.000) 10.831 2.788 ( 0.000 5.276 0.000) 5.276 2.997 ( 0.000 -13.992 0.000) 13.992 3.228 ( 0.000 10.336 0.000) 10.336 3.611 ( 0.000 -7.966 0.000) 7.966 3.655 ( 0.000 -16.610 0.000) 16.610 3.874 ( 0.000 -9.135 0.000) 9.135 4.249 ( 0.000 2.755 0.000) 2.755 4.513 ( 0.000 -13.020 0.000) 13.020 4.763 ( 0.000 3.464 0.000) 3.464 4.905 ( 0.000 -1.058 0.000) 1.058 4.942 ( 0.000 4.811 0.000) 4.811 5.027 ( 0.000 -0.981 0.000) 0.981 5.302 ( 0.000 18.583 0.000) 18.583 5.742 ( 0.000 3.050 0.000) 3.050 5.803 ( 0.000 -8.474 0.000) 8.474 5.830 ( 0.000 -3.165 0.000) 3.165 5.970 ( 0.000 -3.028 0.000) 3.028 6.063 ( 0.000 -4.480 0.000) 4.480 6.112 ( 0.000 3.866 0.000) 3.866 6.208 ( 0.000 2.566 0.000) 2.566 6.652 ( 0.000 0.044 0.000) 0.044 6.685 ( 0.000 -1.203 0.000) 1.203 7.040 ( 0.000 3.698 0.000) 3.698 7.046 ( 0.000 1.722 0.000) 1.722 7.349 ( 0.000 2.838 0.000) 2.838 7.353 ( 0.000 -5.918 0.000) 5.918 7.664 ( 0.000 5.781 0.000) 5.781 7.877 ( 0.000 7.637 0.000) 7.637 8.211 ( 0.000 -2.613 0.000) 2.613 8.500 ( 0.000 -18.173 0.000) 18.173 9.223 ( 0.000 4.849 0.000) 4.849 9.300 ( 0.000 -0.778 0.000) 0.778 9.725 ( 0.000 3.008 0.000) 3.008 9.914 ( 0.000 1.476 0.000) 1.476 9.958 ( 0.000 -3.111 0.000) 3.111 10.005 ( 0.000 -0.424 0.000) 0.424 11.246 ( 0.000 -0.307 0.000) 0.307 11.479 ( 0.000 -3.967 0.000) 3.967 11.548 ( 0.000 -3.695 0.000) 3.695 11.685 ( 0.000 -0.706 0.000) 0.706 11.807 ( 0.000 -1.061 0.000) 1.061 11.904 ( 0.000 0.514 0.000) 0.514 12.018 ( 0.000 0.184 0.000) 0.184 12.135 ( 0.000 6.214 0.000) 6.214 12.244 ( 0.000 7.817 0.000) 7.817 12.832 ( 0.000 -13.147 0.000) 13.147 16.045 ( 0.000 1.722 0.000) 1.722 16.063 ( 0.000 1.494 0.000) 1.494 16.949 ( 0.000 8.205 0.000) 8.205 17.129 ( 0.000 1.774 0.000) 1.774 17.569 ( 0.000 -6.036 0.000) 6.036 18.108 ( 0.000 -11.046 0.000) 11.046 18.262 ( 0.000 15.444 0.000) 15.444 19.635 ( 0.000 -5.989 0.000) 5.989 ======================= Grid point 23 (14/170) ======================= q-point: ( 0.09 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.376 ( 10.337 23.330 10.950) 27.768 1.487 ( 11.119 26.344 12.193) 31.085 2.206 ( 2.219 17.293 2.265) 17.581 2.416 ( -2.881 7.151 3.582) 8.501 2.448 ( -4.497 0.960 -4.741) 6.605 2.657 ( 5.272 20.495 7.236) 22.365 2.809 ( 5.194 -2.649 -6.437) 8.685 3.039 ( 0.993 -7.791 3.529) 8.611 3.300 ( 6.178 7.940 -1.064) 10.117 3.540 ( -3.249 -6.715 -5.622) 9.341 3.655 ( -0.780 -12.161 -1.240) 12.249 3.876 ( -0.722 -10.844 3.353) 11.373 4.190 ( -4.998 4.609 -2.296) 7.176 4.518 ( -1.307 -12.108 2.029) 12.347 4.665 ( -7.856 0.311 -2.177) 8.158 4.810 ( -3.538 5.341 -0.898) 6.470 4.980 ( -0.156 -1.082 2.484) 2.714 5.098 ( -0.036 5.294 3.647) 6.429 5.355 ( 4.243 9.353 0.271) 10.274 5.569 ( -7.538 -3.692 -9.742) 12.859 5.737 ( -8.980 -4.472 4.172) 10.865 5.862 ( 2.784 -1.738 0.860) 3.393 5.963 ( 1.959 -1.387 -3.315) 4.093 6.014 ( -3.151 4.773 2.823) 6.378 6.175 ( 2.729 -0.516 1.910) 3.371 6.480 ( 11.114 -4.755 15.371) 19.555 6.584 ( -1.062 -1.877 -2.123) 3.026 6.779 ( 4.249 -0.319 1.758) 4.609 6.964 ( -2.028 2.565 -2.292) 3.993 7.083 ( 2.627 4.547 -2.846) 5.973 7.325 ( 1.769 -4.973 -1.466) 5.478 7.457 ( 5.026 -0.170 0.422) 5.047 7.682 ( 2.187 5.883 0.346) 6.286 7.872 ( 1.854 7.089 -3.314) 8.042 8.169 ( -1.449 -1.619 -4.801) 5.269 8.388 ( -12.417 -16.375 -0.402) 20.554 9.164 ( -5.715 5.271 0.620) 7.799 9.311 ( 0.423 -1.588 1.641) 2.322 9.689 ( -6.207 3.544 2.638) 7.619 9.810 ( 0.791 -1.280 -1.855) 2.389 9.981 ( -1.748 -2.103 -2.914) 3.996 10.014 ( -1.861 0.134 3.076) 3.598 11.277 ( 2.228 0.548 0.512) 2.351 11.400 ( -2.961 0.335 -0.266) 2.991 11.584 ( 1.016 -2.523 0.718) 2.813 11.672 ( -2.646 -3.349 -0.480) 4.295 11.920 ( 2.926 0.536 1.488) 3.326 11.944 ( 5.049 -3.569 0.588) 6.211 11.982 ( -1.375 2.439 -0.218) 2.808 12.148 ( 3.729 5.942 -1.776) 7.236 12.337 ( 10.596 6.773 -1.016) 12.617 12.819 ( 0.650 -11.894 -3.384) 12.383 16.047 ( -0.287 1.396 0.873) 1.671 16.072 ( 0.510 1.348 0.581) 1.554 16.951 ( 1.849 7.375 -2.123) 7.895 17.157 ( 2.793 2.349 0.512) 3.685 17.674 ( 9.061 -7.170 0.350) 11.560 17.865 ( -5.517 0.078 -16.833) 17.714 18.343 ( -6.700 8.225 12.930) 16.725 19.600 ( -6.265 -8.618 3.297) 11.153 ======================= Grid point 24 (15/170) ======================= q-point: ( 0.18 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.707 ( 10.558 20.208 13.100) 26.295 1.887 ( 13.877 15.421 13.204) 24.591 2.107 ( -8.084 6.941 -1.848) 10.814 2.321 ( -4.961 2.873 -0.957) 5.812 2.504 ( 5.018 1.354 4.879) 7.129 2.822 ( 2.410 -8.158 -1.022) 8.568 2.985 ( 11.055 10.683 0.224) 15.375 3.085 ( 7.666 6.417 4.505) 10.965 3.325 ( 3.342 2.862 -7.428) 8.633 3.444 ( 0.570 -5.482 -3.993) 6.806 3.581 ( -1.549 -1.332 -5.806) 6.155 3.919 ( -1.369 -6.104 5.065) 8.049 4.052 ( -6.723 6.958 -3.196) 10.189 4.495 ( -3.233 -10.068 -0.066) 10.574 4.559 ( -4.439 -2.333 3.271) 5.987 4.729 ( -5.533 2.373 0.794) 6.072 4.996 ( -4.716 6.742 3.166) 8.816 5.109 ( 0.031 -0.026 2.621) 2.622 5.356 ( -5.415 1.060 3.116) 6.337 5.406 ( -4.831 -3.111 -1.602) 5.965 5.609 ( -7.464 -4.386 -0.860) 8.700 5.867 ( -4.876 -4.063 3.159) 7.089 5.968 ( 3.858 3.355 0.988) 5.207 6.103 ( 5.712 3.817 0.104) 6.871 6.227 ( 3.290 0.076 0.565) 3.339 6.567 ( 0.347 -3.701 0.962) 3.839 6.790 ( 6.444 -4.929 4.925) 9.491 6.819 ( 1.559 -3.286 -1.987) 4.144 6.949 ( 2.026 2.366 0.916) 3.247 7.102 ( 2.399 0.295 -1.681) 2.944 7.307 ( -1.044 -0.643 -2.279) 2.587 7.511 ( 1.886 1.073 -0.433) 2.212 7.721 ( 1.037 4.540 -0.659) 4.704 7.865 ( 2.890 5.297 -5.209) 7.972 8.024 ( -11.483 0.180 -2.421) 11.737 8.192 ( -3.477 -11.054 -3.675) 12.157 9.110 ( -3.229 1.659 3.648) 5.147 9.362 ( -0.063 -3.746 6.082) 7.144 9.628 ( -4.765 1.173 2.906) 5.703 9.838 ( -3.489 -4.218 -1.226) 5.610 9.906 ( 1.646 0.321 1.784) 2.448 10.015 ( 0.443 0.481 -0.400) 0.767 11.308 ( 1.774 0.839 -0.830) 2.131 11.372 ( -2.014 1.394 0.497) 2.500 11.614 ( 1.688 -1.304 -0.332) 2.159 11.626 ( -0.094 -2.497 -1.034) 2.704 11.879 ( -5.184 3.080 -0.589) 6.059 11.985 ( 4.625 5.751 -1.210) 7.478 12.022 ( 2.825 -2.446 -3.089) 4.849 12.228 ( 5.212 4.174 0.718) 6.716 12.513 ( 10.543 6.337 -2.174) 12.492 12.770 ( 0.351 -8.029 -6.514) 10.345 16.058 ( 0.114 0.607 1.297) 1.437 16.091 ( 0.563 0.782 1.188) 1.530 16.966 ( 3.211 5.812 -2.404) 7.062 17.219 ( 1.971 4.894 2.191) 5.713 17.482 ( -6.681 1.478 -17.786) 19.057 17.983 ( 15.657 -6.664 1.189) 17.057 18.327 ( -12.229 7.243 14.991) 20.658 19.508 ( -8.156 -12.758 2.197) 15.301 ======================= Grid point 25 (16/170) ======================= q-point: ( 0.27 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.897 ( -10.092 6.561 1.400) 12.118 1.941 ( 2.055 11.111 3.712) 11.894 2.161 ( 3.112 10.886 2.063) 11.509 2.420 ( 10.194 12.425 8.379) 18.125 2.645 ( 2.423 -3.832 5.991) 7.513 2.877 ( 0.690 -1.473 -7.631) 7.803 2.909 ( 5.468 -3.953 0.455) 6.762 3.112 ( -2.237 -6.145 -14.802) 16.182 3.349 ( 0.932 -5.982 -6.454) 8.849 3.590 ( 10.509 6.333 -2.580) 12.538 3.615 ( 10.193 7.003 13.222) 18.104 3.924 ( -3.042 10.857 -1.497) 11.374 3.944 ( -1.456 -2.522 3.950) 4.907 4.405 ( -5.398 -6.092 -2.614) 8.549 4.530 ( -6.182 -4.367 6.151) 9.753 4.701 ( -1.343 -0.438 2.888) 3.215 4.906 ( -5.299 6.258 0.449) 8.212 5.156 ( -1.360 -1.182 4.937) 5.255 5.294 ( -5.527 -0.004 -0.432) 5.544 5.327 ( -3.202 -0.459 0.931) 3.366 5.530 ( -2.167 -6.931 4.608) 8.601 5.829 ( -3.358 -4.232 2.598) 5.995 6.053 ( 2.495 5.857 2.812) 6.960 6.114 ( -0.257 -2.512 -3.807) 4.569 6.346 ( 6.072 4.936 3.358) 8.515 6.583 ( -0.484 -7.933 0.885) 7.997 6.690 ( -4.252 -3.699 -10.755) 12.142 6.916 ( 3.870 -4.964 0.884) 6.356 6.994 ( -0.167 -5.314 -3.603) 6.423 7.099 ( -0.628 -3.579 3.391) 4.970 7.317 ( 2.936 8.140 1.441) 8.773 7.507 ( -2.097 1.415 -1.295) 2.842 7.680 ( -3.818 0.410 -0.679) 3.900 7.776 ( -7.611 6.028 -2.974) 10.154 7.906 ( 1.860 2.885 -0.558) 3.478 8.151 ( 2.656 -2.655 -5.118) 6.348 9.128 ( -0.934 -1.518 4.954) 5.265 9.405 ( -5.005 -3.974 6.262) 8.948 9.595 ( -2.398 -0.557 1.047) 2.675 9.737 ( -3.096 -3.717 -0.418) 4.856 10.020 ( 3.959 -3.540 0.916) 5.389 10.041 ( 3.970 0.559 3.559) 5.361 11.319 ( -0.543 1.868 -1.312) 2.347 11.332 ( -1.511 0.300 0.439) 1.602 11.598 ( 1.075 -1.336 -3.621) 4.006 11.662 ( 0.957 0.372 0.272) 1.063 11.801 ( -1.185 3.870 -1.234) 4.231 12.011 ( 2.682 -0.640 -5.631) 6.270 12.066 ( 5.385 6.528 -0.100) 8.463 12.316 ( 2.637 2.935 2.768) 4.820 12.605 ( 4.310 4.614 -5.095) 8.113 12.696 ( 1.734 1.246 -7.049) 7.365 16.080 ( 0.664 -0.454 1.264) 1.498 16.117 ( 0.582 -0.157 1.491) 1.609 17.003 ( 4.524 5.448 -3.028) 7.701 17.188 ( -6.810 4.703 -6.948) 10.806 17.276 ( 0.842 6.393 -1.786) 6.691 18.065 ( -5.165 9.177 -3.126) 10.985 18.471 ( 7.133 -11.410 17.079) 21.743 19.387 ( -7.488 -16.058 0.136) 17.719 ======================= Grid point 26 (17/170) ======================= q-point: ( 0.36 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.741 ( -7.323 4.830 -1.504) 8.901 1.973 ( -0.872 7.083 3.391) 7.902 2.181 ( -1.601 11.646 -0.711) 11.777 2.485 ( -3.180 7.878 -9.471) 12.723 2.698 ( -1.786 -3.213 5.417) 6.547 2.902 ( -1.797 -2.726 -9.471) 10.018 2.961 ( 9.087 7.229 4.782) 12.558 3.117 ( 12.635 -1.021 2.778) 12.977 3.325 ( 2.170 -3.123 -0.241) 3.811 3.719 ( 3.851 5.532 -6.805) 9.578 3.777 ( 9.287 -0.948 1.082) 9.398 3.901 ( -3.760 -5.750 2.506) 7.313 4.022 ( -0.451 1.566 5.488) 5.725 4.285 ( -4.078 -2.720 -1.380) 5.093 4.565 ( -0.043 0.483 9.364) 9.377 4.649 ( -6.107 -3.537 2.122) 7.370 4.900 ( 2.182 4.058 -0.193) 4.612 5.160 ( -5.392 -3.399 -1.705) 6.598 5.185 ( -2.246 -1.121 1.239) 2.799 5.297 ( -0.176 4.375 0.023) 4.378 5.641 ( 3.030 -7.930 9.767) 12.940 5.819 ( -1.785 -4.088 2.917) 5.330 5.993 ( -3.990 -3.833 -5.359) 7.703 6.171 ( 2.745 8.086 6.280) 10.600 6.437 ( -1.074 -1.203 -1.626) 2.290 6.460 ( -3.237 -5.439 -10.704) 12.435 6.581 ( -0.288 -9.600 1.646) 9.744 6.869 ( -4.453 -8.200 -7.074) 11.710 6.994 ( 3.078 -7.769 1.929) 8.576 7.170 ( 2.123 5.171 3.810) 6.765 7.357 ( -2.441 0.755 -2.914) 3.875 7.410 ( -3.624 1.402 0.433) 3.910 7.606 ( -3.189 3.856 -1.052) 5.113 7.696 ( -1.292 8.993 2.645) 9.462 7.958 ( 4.297 6.642 -1.379) 8.030 8.134 ( 1.196 2.494 -3.440) 4.414 9.178 ( 0.129 -3.232 4.106) 5.227 9.346 ( -5.897 -3.327 1.397) 6.913 9.562 ( -2.260 0.063 0.957) 2.455 9.717 ( -0.871 -2.712 -0.108) 2.850 10.097 ( 4.520 -7.373 1.673) 8.809 10.184 ( 4.607 -3.148 5.598) 7.904 11.267 ( -2.896 1.990 -0.381) 3.534 11.333 ( 0.536 0.483 -0.808) 1.083 11.569 ( 0.748 -1.195 -3.522) 3.794 11.634 ( -2.256 2.919 -1.088) 3.846 11.831 ( 3.649 1.970 0.432) 4.170 11.980 ( 2.163 -0.560 -6.508) 6.881 12.162 ( 4.587 7.115 1.384) 8.578 12.364 ( -1.066 0.325 2.144) 2.417 12.563 ( 1.831 5.466 -5.976) 8.303 12.678 ( 2.108 9.983 -4.354) 11.093 16.106 ( 0.858 -1.418 0.871) 1.872 16.143 ( 0.479 -1.309 1.244) 1.869 16.991 ( 0.380 5.350 -6.751) 8.622 17.096 ( 2.020 8.168 -0.187) 8.416 17.258 ( -2.945 10.366 0.471) 10.786 17.899 ( -9.521 10.167 -0.741) 13.949 18.791 ( 9.504 -16.884 10.445) 22.011 19.272 ( -5.400 -18.601 -0.772) 19.385 ======================= Grid point 27 (18/170) ======================= q-point: ( 0.45 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.633 ( -2.837 4.416 -1.321) 5.413 2.002 ( -0.479 4.532 2.709) 5.301 2.157 ( 0.993 11.211 -0.314) 11.259 2.297 ( -5.247 7.143 -5.490) 10.426 2.717 ( -0.107 -2.525 0.987) 2.713 2.787 ( -1.365 3.853 -3.628) 5.465 3.168 ( 6.434 6.907 2.412) 9.742 3.306 ( 4.881 3.834 0.840) 6.263 3.388 ( 1.889 -4.580 3.009) 5.796 3.693 ( 0.265 3.179 -1.935) 3.731 3.851 ( -1.810 -1.290 -1.115) 2.486 3.917 ( 8.219 -2.364 -4.033) 9.455 3.990 ( -7.151 -2.362 4.577) 8.813 4.259 ( 0.433 -6.303 0.018) 6.318 4.602 ( -2.810 -2.220 5.835) 6.846 4.692 ( 2.010 -6.419 2.320) 7.116 4.880 ( -0.860 2.181 -4.572) 5.138 5.061 ( -1.783 -1.379 -0.198) 2.263 5.199 ( -0.479 -0.667 2.177) 2.327 5.304 ( 0.474 4.462 -0.222) 4.492 5.770 ( 1.174 -5.780 0.158) 5.900 5.817 ( -1.919 -2.322 4.092) 5.081 5.927 ( 0.571 -4.494 2.480) 5.165 6.201 ( -3.290 -4.961 -7.824) 9.832 6.310 ( 1.422 -1.003 0.267) 1.761 6.471 ( 2.071 -5.429 5.233) 7.820 6.611 ( 0.114 -9.732 1.021) 9.786 6.695 ( -4.926 -2.229 -7.709) 9.417 7.061 ( 2.295 -6.862 1.278) 7.348 7.207 ( -4.098 -3.969 0.145) 5.706 7.259 ( 1.472 5.221 -1.037) 5.522 7.380 ( -2.177 3.718 -0.003) 4.309 7.587 ( 0.435 8.407 0.186) 8.420 7.726 ( 0.282 9.188 2.029) 9.413 7.993 ( 1.692 6.293 -1.425) 6.670 8.120 ( 0.200 6.619 -0.777) 6.668 9.218 ( 0.360 -3.936 1.704) 4.304 9.276 ( -2.475 -3.418 -0.282) 4.229 9.548 ( -0.776 0.961 0.885) 1.519 9.693 ( -0.644 -1.346 -0.857) 1.721 10.175 ( 1.891 -10.072 1.182) 10.316 10.301 ( 2.322 -6.517 2.935) 7.515 11.223 ( -1.294 1.745 -0.584) 2.250 11.330 ( 0.069 1.063 -0.402) 1.139 11.551 ( 0.178 -1.844 -0.747) 1.997 11.593 ( -0.786 3.588 -1.082) 3.829 11.895 ( 1.856 1.092 1.928) 2.891 11.939 ( 0.684 0.253 -4.430) 4.490 12.236 ( 1.998 6.634 1.084) 7.012 12.338 ( -1.491 -0.057 -0.821) 1.703 12.566 ( 1.671 9.413 -0.260) 9.563 12.651 ( 0.015 11.301 -2.607) 11.598 16.125 ( 0.388 -1.917 0.293) 1.978 16.159 ( 0.196 -2.237 0.489) 2.298 16.951 ( 0.787 7.959 -1.794) 8.197 17.139 ( 1.920 11.154 -0.187) 11.320 17.202 ( -2.638 11.875 -0.275) 12.167 17.772 ( -4.275 7.562 0.067) 8.687 18.995 ( 4.194 -18.497 3.672) 19.318 19.197 ( -2.382 -20.425 -0.445) 20.568 ======================= Grid point 33 (19/170) ======================= q-point: ( 0.00 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.732 ( 0.000 25.674 0.000) 25.674 1.879 ( 0.000 24.684 0.000) 24.684 2.319 ( 0.000 1.131 0.000) 1.131 2.510 ( 0.000 2.258 0.000) 2.258 2.606 ( 0.000 1.254 0.000) 1.254 2.710 ( 0.000 -9.902 0.000) 9.902 2.775 ( 0.000 -2.291 0.000) 2.291 3.112 ( 0.000 9.337 0.000) 9.337 3.280 ( 0.000 -6.109 0.000) 6.109 3.392 ( 0.000 4.534 0.000) 4.534 3.648 ( 0.000 -13.590 0.000) 13.590 3.685 ( 0.000 11.908 0.000) 11.908 4.311 ( 0.000 -6.601 0.000) 6.601 4.389 ( 0.000 12.676 0.000) 12.676 4.654 ( 0.000 -11.442 0.000) 11.442 4.975 ( 0.000 2.281 0.000) 2.281 4.998 ( 0.000 2.448 0.000) 2.448 5.022 ( 0.000 2.829 0.000) 2.829 5.581 ( 0.000 4.879 0.000) 4.879 5.672 ( 0.000 -7.549 0.000) 7.549 5.694 ( 0.000 -1.150 0.000) 1.150 5.794 ( 0.000 -2.093 0.000) 2.093 5.968 ( 0.000 4.588 0.000) 4.588 6.051 ( 0.000 4.680 0.000) 4.680 6.250 ( 0.000 0.850 0.000) 0.850 6.268 ( 0.000 9.417 0.000) 9.417 6.606 ( 0.000 -4.535 0.000) 4.535 6.682 ( 0.000 1.949 0.000) 1.949 6.993 ( 0.000 -7.953 0.000) 7.953 7.054 ( 0.000 -2.482 0.000) 2.482 7.277 ( 0.000 0.081 0.000) 0.081 7.446 ( 0.000 7.084 0.000) 7.084 7.779 ( 0.000 4.052 0.000) 4.052 7.995 ( 0.000 3.783 0.000) 3.783 8.111 ( 0.000 -7.565 0.000) 7.565 8.140 ( 0.000 -16.274 0.000) 16.274 9.299 ( 0.000 0.940 0.000) 0.940 9.313 ( 0.000 3.718 0.000) 3.718 9.778 ( 0.000 2.492 0.000) 2.492 9.912 ( 0.000 -1.494 0.000) 1.494 9.939 ( 0.000 0.995 0.000) 0.995 9.989 ( 0.000 -1.200 0.000) 1.200 11.244 ( 0.000 0.404 0.000) 0.404 11.401 ( 0.000 -3.916 0.000) 3.916 11.514 ( 0.000 0.025 0.000) 0.025 11.652 ( 0.000 -2.493 0.000) 2.493 11.787 ( 0.000 -0.761 0.000) 0.761 11.871 ( 0.000 -3.132 0.000) 3.132 12.055 ( 0.000 3.926 0.000) 3.926 12.286 ( 0.000 7.801 0.000) 7.801 12.357 ( 0.000 2.592 0.000) 2.592 12.592 ( 0.000 -9.935 0.000) 9.935 16.079 ( 0.000 1.606 0.000) 1.606 16.092 ( 0.000 1.272 0.000) 1.272 17.085 ( 0.000 4.955 0.000) 4.955 17.205 ( 0.000 6.851 0.000) 6.851 17.434 ( 0.000 -7.345 0.000) 7.345 17.866 ( 0.000 -12.908 0.000) 12.908 18.605 ( 0.000 18.264 0.000) 18.264 19.482 ( 0.000 -9.510 0.000) 9.510 ======================= Grid point 34 (20/170) ======================= q-point: ( 0.09 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.807 ( 5.366 20.075 4.691) 21.303 1.988 ( 6.325 22.518 8.612) 24.925 2.319 ( -5.476 1.383 6.262) 8.433 2.449 ( -5.167 -0.821 -6.596) 8.420 2.510 ( -0.897 3.622 -0.329) 3.746 2.690 ( 1.842 -4.298 -3.045) 5.580 2.919 ( 10.604 -3.758 -3.324) 11.731 3.138 ( -0.664 -0.623 2.972) 3.108 3.298 ( 0.546 -8.203 0.730) 8.254 3.426 ( 5.458 13.710 -0.724) 14.774 3.598 ( -0.511 -6.645 -5.375) 8.562 3.752 ( 3.459 6.022 6.225) 9.326 4.322 ( -1.207 -6.617 2.842) 7.302 4.356 ( -2.521 13.150 -1.981) 13.535 4.594 ( -5.850 -8.018 -0.992) 9.975 4.915 ( -6.304 4.967 -0.199) 8.028 4.957 ( 1.359 0.322 0.670) 1.549 5.129 ( 3.506 -0.303 1.719) 3.916 5.471 ( -7.492 -5.178 -8.636) 12.551 5.548 ( -3.531 3.872 -0.643) 5.279 5.671 ( -10.176 -0.409 5.587) 11.616 5.831 ( -0.915 -1.912 2.735) 3.460 5.980 ( 1.517 4.255 0.453) 4.540 6.085 ( 1.177 3.181 1.839) 3.858 6.285 ( 0.565 9.115 1.962) 9.341 6.408 ( 7.093 -2.332 12.509) 14.568 6.516 ( -2.625 -4.560 -1.892) 5.591 6.762 ( 1.947 -0.259 1.132) 2.267 6.950 ( -1.232 -4.619 -2.595) 5.440 7.065 ( 2.742 -7.500 -3.518) 8.726 7.295 ( 2.338 3.987 0.663) 4.669 7.496 ( 4.022 4.233 -0.130) 5.841 7.798 ( 2.607 3.892 -0.131) 4.686 7.957 ( -3.529 -1.123 -3.902) 5.380 8.076 ( -0.329 -6.778 -1.412) 6.931 8.108 ( -0.905 -8.731 -5.239) 10.222 9.241 ( -7.130 2.207 2.682) 7.931 9.293 ( -1.369 0.160 -2.071) 2.487 9.758 ( -6.956 3.110 0.776) 7.659 9.808 ( 1.558 0.865 -2.289) 2.901 9.946 ( -3.411 -1.009 0.201) 3.563 10.013 ( -2.228 -0.372 5.315) 5.775 11.288 ( 2.804 0.584 0.829) 2.982 11.380 ( -1.074 -1.988 0.389) 2.293 11.558 ( 3.436 -0.152 -0.086) 3.440 11.619 ( -2.521 -1.940 -0.067) 3.182 11.858 ( 4.535 -2.541 1.855) 5.520 11.929 ( 6.441 -2.311 -0.074) 6.843 12.037 ( -1.245 3.959 -0.965) 4.261 12.271 ( 0.273 4.777 -0.925) 4.874 12.446 ( 9.863 3.467 -1.756) 10.601 12.615 ( 4.650 -7.165 -2.753) 8.974 16.077 ( -0.804 1.475 0.852) 1.884 16.096 ( -0.028 1.012 0.616) 1.185 17.091 ( 2.104 6.200 -3.215) 7.294 17.221 ( 3.854 4.874 -1.322) 6.353 17.509 ( 6.938 -8.902 -0.262) 11.290 17.752 ( -2.478 -9.148 -11.107) 14.601 18.609 ( -7.538 16.271 10.076) 20.569 19.426 ( -8.865 -9.543 3.524) 13.494 ======================= Grid point 35 (21/170) ======================= q-point: ( 0.18 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.979 ( 4.799 8.242 5.574) 11.046 2.177 ( -6.456 7.470 4.300) 10.769 2.279 ( 7.744 13.353 3.871) 15.914 2.408 ( -2.242 4.287 10.896) 11.922 2.521 ( 1.936 3.839 2.014) 4.748 2.720 ( 7.145 -0.565 -3.834) 8.128 2.955 ( 3.352 -5.415 -11.026) 12.733 3.095 ( -2.841 -9.379 -5.008) 11.006 3.281 ( 2.032 -9.889 -8.384) 13.123 3.537 ( 2.753 -1.296 0.111) 3.045 3.626 ( 10.338 16.065 3.253) 19.379 3.895 ( 2.283 4.671 5.797) 7.787 4.251 ( -4.467 10.563 -3.486) 11.987 4.345 ( -1.738 -1.630 4.593) 5.174 4.486 ( -5.479 -5.205 0.971) 7.619 4.803 ( -6.257 4.013 -0.202) 7.436 5.028 ( 1.189 -1.041 6.049) 6.252 5.110 ( -4.469 0.110 -1.714) 4.788 5.319 ( -4.047 -2.730 -1.372) 5.071 5.454 ( -7.445 2.078 1.350) 7.847 5.536 ( -10.686 -0.256 2.989) 11.099 5.793 ( -6.146 -3.501 3.318) 7.813 6.051 ( 3.045 2.402 2.644) 4.694 6.100 ( -1.537 0.871 1.769) 2.500 6.341 ( 5.804 6.973 -0.847) 9.112 6.485 ( -2.267 -3.950 1.788) 4.893 6.672 ( 5.639 -6.595 7.761) 11.641 6.749 ( -2.755 -3.504 0.367) 4.473 6.916 ( 0.569 -6.106 -3.279) 6.955 7.041 ( 0.906 -1.938 -4.282) 4.786 7.378 ( 4.959 4.542 2.026) 7.023 7.544 ( 1.921 2.967 -0.205) 3.541 7.785 ( -7.333 -3.755 -5.948) 10.161 7.865 ( 3.675 -0.402 0.425) 3.722 7.998 ( -2.616 -0.415 -6.940) 7.428 8.093 ( 5.124 -1.139 -3.972) 6.583 9.147 ( -6.288 1.823 2.795) 7.119 9.273 ( -2.482 -4.352 4.603) 6.803 9.657 ( -6.903 1.642 2.899) 7.665 9.768 ( -5.471 -2.902 -1.561) 6.387 9.942 ( 2.012 2.861 2.859) 4.517 10.025 ( -0.351 0.426 1.047) 1.184 11.323 ( 1.771 0.663 -0.949) 2.116 11.372 ( -1.269 -0.953 0.175) 1.597 11.596 ( 1.246 -0.162 -1.931) 2.304 11.616 ( 3.490 0.606 0.361) 3.561 11.906 ( -0.426 0.256 -0.544) 0.737 12.011 ( 2.361 1.202 -3.612) 4.479 12.055 ( 6.362 1.366 1.237) 6.624 12.283 ( 1.842 -0.051 -0.256) 1.860 12.592 ( 9.255 1.861 -3.506) 10.070 12.690 ( 9.583 0.788 -4.539) 10.633 16.074 ( -0.860 0.981 1.230) 1.793 16.103 ( -0.380 0.369 1.170) 1.284 17.082 ( 3.233 5.490 -4.779) 7.964 17.309 ( 5.918 4.794 1.042) 7.687 17.424 ( -3.687 -5.856 -15.014) 16.532 17.811 ( 13.263 -9.896 3.149) 16.845 18.553 ( -14.569 13.848 11.686) 23.251 19.281 ( -12.838 -10.598 3.587) 17.029 ======================= Grid point 36 (22/170) ======================= q-point: ( 0.27 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.979 ( -7.353 3.783 0.659) 8.295 2.092 ( -3.420 3.039 -0.154) 4.577 2.464 ( 2.930 15.630 7.534) 17.596 2.589 ( -1.093 -0.150 6.158) 6.256 2.628 ( 8.504 8.408 4.939) 12.939 2.821 ( 7.606 -4.135 -6.413) 10.773 2.888 ( 6.465 1.168 -1.606) 6.763 2.977 ( 0.787 -6.396 -7.085) 9.578 3.209 ( 2.351 -6.976 -7.529) 10.530 3.615 ( 3.806 -5.227 2.820) 7.054 3.780 ( 5.032 6.296 -3.467) 8.774 3.912 ( -1.808 5.238 -2.131) 5.938 4.163 ( -1.471 8.366 -2.585) 8.879 4.372 ( -2.289 3.895 3.823) 5.918 4.459 ( -3.938 -2.951 9.187) 10.422 4.719 ( -4.686 1.237 0.569) 4.880 5.005 ( -3.713 4.393 -0.918) 5.825 5.121 ( 0.053 -2.739 6.046) 6.638 5.235 ( -5.625 -2.237 -0.712) 6.095 5.351 ( -5.803 -1.978 1.139) 6.236 5.440 ( -5.915 0.691 7.162) 9.314 5.736 ( -4.458 -4.930 2.913) 7.257 6.037 ( -4.018 -3.366 -0.541) 5.269 6.159 ( 0.764 0.414 5.765) 5.831 6.422 ( 4.098 0.891 -2.260) 4.765 6.451 ( -3.521 -1.835 1.706) 4.322 6.600 ( -6.284 -5.770 -8.077) 11.748 6.765 ( -0.175 -10.212 -2.972) 10.637 6.894 ( 0.486 1.248 -1.346) 1.899 7.098 ( 4.632 -0.048 5.912) 7.511 7.468 ( 1.226 4.471 0.300) 4.646 7.516 ( -4.394 0.753 -2.680) 5.202 7.655 ( 1.571 -0.877 -1.947) 2.651 7.862 ( -3.527 1.437 -1.172) 3.984 7.974 ( 6.830 4.312 -2.377) 8.420 8.135 ( 4.906 -0.080 -3.822) 6.220 9.111 ( -3.610 -0.223 4.804) 6.013 9.290 ( -4.453 -6.524 6.462) 10.205 9.593 ( -4.611 0.413 2.890) 5.457 9.667 ( -4.342 -3.035 0.920) 5.377 10.001 ( 1.781 0.770 -1.016) 2.190 10.052 ( 2.547 0.317 1.975) 3.238 11.335 ( -0.635 0.202 -0.094) 0.673 11.339 ( 0.253 0.336 -2.186) 2.226 11.594 ( 2.063 0.855 -4.235) 4.788 11.671 ( 1.897 0.152 -0.010) 1.903 11.870 ( -0.098 3.397 -2.098) 3.994 12.008 ( 3.528 0.403 -6.348) 7.273 12.170 ( 5.176 3.009 1.723) 6.230 12.322 ( 1.374 -2.155 1.884) 3.175 12.669 ( 7.041 5.413 -5.518) 10.456 12.800 ( 8.795 5.177 -5.057) 11.390 16.077 ( -0.530 0.117 1.141) 1.264 16.110 ( -0.559 -0.527 1.331) 1.537 17.103 ( 5.213 4.208 -4.734) 8.203 17.221 ( -1.441 -0.365 -8.823) 8.947 17.414 ( 3.002 7.368 2.866) 8.457 18.103 ( 16.109 -10.947 1.245) 19.516 18.396 ( -19.139 9.125 11.701) 24.217 19.092 ( -12.383 -13.336 1.170) 18.237 ======================= Grid point 37 (23/170) ======================= q-point: ( 0.36 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.844 ( -7.045 5.346 -1.431) 8.958 2.049 ( -2.634 0.973 1.668) 3.266 2.460 ( -5.778 12.356 -1.316) 13.704 2.543 ( 2.186 0.750 -12.266) 12.482 2.712 ( 0.047 2.736 4.262) 5.065 2.872 ( 3.073 1.385 -2.543) 4.223 3.056 ( 4.862 0.901 1.873) 5.288 3.120 ( 11.937 2.210 7.942) 14.507 3.248 ( 8.712 -4.839 2.409) 10.253 3.691 ( -2.438 -5.809 5.430) 8.317 3.777 ( 2.541 -1.275 -4.319) 5.170 3.855 ( 4.953 5.674 -8.725) 11.526 4.113 ( -0.603 3.674 -3.066) 4.823 4.320 ( -6.431 5.437 0.837) 8.463 4.530 ( -2.094 -3.469 6.327) 7.514 4.625 ( -7.868 -0.723 3.969) 8.842 4.982 ( 0.629 3.643 -1.815) 4.118 5.108 ( -6.890 -0.829 -0.253) 6.945 5.155 ( -1.651 -2.322 2.205) 3.603 5.315 ( -0.609 -2.233 1.399) 2.704 5.512 ( 1.574 -3.670 10.129) 10.888 5.720 ( -1.808 -5.644 3.613) 6.941 5.938 ( -6.319 -1.338 0.145) 6.461 6.230 ( -1.837 -7.835 7.579) 11.054 6.358 ( -6.249 -4.273 -9.411) 12.078 6.387 ( -3.768 1.349 -6.820) 7.908 6.438 ( 1.747 -3.823 -2.251) 4.769 6.704 ( -1.064 -8.555 -4.714) 9.825 6.908 ( 0.450 0.555 3.024) 3.107 7.238 ( 2.310 -3.872 1.335) 4.702 7.334 ( -3.460 4.900 -2.700) 6.578 7.514 ( -0.801 6.522 0.799) 6.620 7.718 ( 4.104 4.884 1.358) 6.522 7.830 ( -0.438 4.767 1.668) 5.070 8.062 ( 5.028 3.958 -1.238) 6.517 8.171 ( 3.646 0.843 -2.074) 4.278 9.121 ( -1.806 -2.210 4.169) 5.053 9.252 ( -5.912 -5.507 2.854) 8.569 9.567 ( -2.505 0.564 2.990) 3.941 9.657 ( -0.552 -3.079 2.567) 4.047 10.009 ( 1.950 -1.562 -1.704) 3.025 10.122 ( 2.210 -3.175 1.973) 4.342 11.293 ( -1.851 0.875 -1.280) 2.414 11.343 ( 1.297 0.193 -1.606) 2.073 11.563 ( 0.791 0.730 -4.615) 4.739 11.663 ( -1.129 -0.069 -1.618) 1.974 11.885 ( 3.192 3.187 -0.659) 4.559 11.986 ( 2.760 0.665 -6.116) 6.742 12.266 ( 3.230 3.140 2.508) 5.156 12.360 ( 0.716 0.156 1.110) 1.330 12.718 ( 5.486 9.049 -3.974) 11.304 12.853 ( 4.469 6.892 -4.964) 9.598 16.083 ( -0.079 -0.854 0.769) 1.151 16.114 ( -0.569 -1.481 0.979) 1.864 17.093 ( 3.069 5.056 -5.302) 7.943 17.243 ( 7.052 5.768 -0.134) 9.111 17.458 ( -1.865 9.996 2.827) 10.554 18.132 ( -13.373 12.513 0.615) 18.324 18.418 ( 7.927 -20.037 7.528) 22.825 18.908 ( -9.201 -17.106 -0.756) 19.438 ======================= Grid point 38 (24/170) ======================= q-point: ( 0.45 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.738 ( -2.861 5.917 -1.230) 6.687 2.035 ( -1.013 -1.033 0.976) 1.745 2.379 ( -3.607 6.892 2.563) 8.191 2.430 ( 1.383 7.353 -9.365) 11.987 2.756 ( 0.453 6.213 1.663) 6.448 2.873 ( -0.113 4.990 -0.818) 5.058 3.107 ( 1.735 -6.464 0.322) 6.701 3.368 ( 8.290 1.118 1.180) 8.448 3.460 ( 3.413 5.999 8.863) 11.234 3.652 ( -1.647 -0.214 -2.347) 2.875 3.780 ( -0.522 -4.094 1.198) 4.297 3.885 ( 4.905 -1.780 -4.154) 6.670 4.092 ( 3.483 4.373 -3.287) 6.485 4.201 ( -7.764 1.380 0.912) 7.938 4.529 ( 2.101 -6.266 -2.029) 6.913 4.570 ( -7.100 -4.642 6.114) 10.457 4.896 ( -2.979 0.689 -4.522) 5.459 5.087 ( -0.582 2.844 3.972) 4.920 5.142 ( -0.769 -4.064 -0.332) 4.149 5.331 ( 0.554 -1.565 0.499) 1.733 5.659 ( 3.357 -4.494 3.519) 6.622 5.755 ( -0.148 -3.832 3.606) 5.264 5.892 ( -1.852 1.029 6.767) 7.090 6.106 ( -4.927 -2.933 -11.260) 12.636 6.226 ( -4.077 -6.624 -2.868) 8.291 6.313 ( 0.224 -11.170 1.237) 11.240 6.466 ( 2.301 -2.923 0.155) 3.724 6.624 ( -2.094 -7.009 -2.972) 7.896 6.980 ( 1.709 0.100 5.156) 5.433 7.131 ( -3.046 -1.791 -6.746) 7.615 7.405 ( 2.853 6.436 4.249) 8.223 7.484 ( -2.135 7.100 -1.427) 7.550 7.786 ( 1.871 9.264 0.632) 9.473 7.863 ( 0.595 4.640 2.031) 5.100 8.098 ( 1.398 4.367 -1.265) 4.756 8.208 ( 1.693 2.089 -0.162) 2.694 9.140 ( 0.039 -3.517 1.593) 3.861 9.188 ( -3.202 -4.850 0.437) 5.829 9.574 ( -0.646 1.549 2.041) 2.643 9.666 ( -0.286 -1.383 0.138) 1.418 10.031 ( 1.318 -4.369 -0.088) 4.564 10.163 ( 0.698 -6.852 0.771) 6.930 11.252 ( -0.756 1.424 -1.214) 2.018 11.346 ( 0.387 0.046 -0.382) 0.546 11.530 ( 0.117 0.071 -1.849) 1.854 11.628 ( -0.646 -0.078 -0.940) 1.143 11.932 ( 1.848 2.257 0.619) 2.982 11.963 ( 0.882 1.639 -3.089) 3.606 12.331 ( 1.101 2.605 2.176) 3.568 12.367 ( 0.132 3.227 -0.979) 3.375 12.762 ( 2.508 9.596 -0.597) 9.936 12.847 ( 0.832 7.975 -2.727) 8.470 16.090 ( 0.087 -1.470 0.260) 1.496 16.114 ( -0.291 -2.135 0.354) 2.184 17.119 ( 3.150 9.092 -1.018) 9.676 17.360 ( 4.434 11.103 0.230) 11.958 17.432 ( -2.040 10.049 0.705) 10.278 17.934 ( -8.640 7.867 0.992) 11.727 18.596 ( 5.621 -20.529 1.870) 21.366 18.778 ( -4.885 -20.458 -0.565) 21.040 ======================= Grid point 44 (25/170) ======================= q-point: ( 0.00 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.203 ( 0.000 21.799 0.000) 21.799 2.233 ( 0.000 9.963 0.000) 9.963 2.323 ( 0.000 -1.057 0.000) 1.057 2.534 ( 0.000 -0.965 0.000) 0.965 2.577 ( 0.000 -2.339 0.000) 2.339 2.596 ( 0.000 -13.628 0.000) 13.628 2.722 ( 0.000 9.063 0.000) 9.063 2.934 ( 0.000 -11.325 0.000) 11.325 3.207 ( 0.000 1.230 0.000) 1.230 3.365 ( 0.000 -13.388 0.000) 13.388 3.731 ( 0.000 13.289 0.000) 13.289 3.840 ( 0.000 1.930 0.000) 1.930 4.268 ( 0.000 2.531 0.000) 2.531 4.412 ( 0.000 -11.230 0.000) 11.230 4.741 ( 0.000 19.595 0.000) 19.595 4.970 ( 0.000 -2.128 0.000) 2.128 5.049 ( 0.000 0.199 0.000) 0.199 5.059 ( 0.000 -0.108 0.000) 0.108 5.530 ( 0.000 -4.236 0.000) 4.236 5.538 ( 0.000 -4.872 0.000) 4.872 5.717 ( 0.000 1.271 0.000) 1.271 5.749 ( 0.000 -2.065 0.000) 2.065 6.078 ( 0.000 5.604 0.000) 5.604 6.159 ( 0.000 -0.415 0.000) 0.415 6.281 ( 0.000 6.798 0.000) 6.798 6.422 ( 0.000 -1.061 0.000) 1.061 6.535 ( 0.000 4.710 0.000) 4.710 6.731 ( 0.000 -6.261 0.000) 6.261 6.828 ( 0.000 1.386 0.000) 1.386 6.959 ( 0.000 -6.697 0.000) 6.697 7.360 ( 0.000 7.920 0.000) 7.920 7.534 ( 0.000 -4.255 0.000) 4.255 7.766 ( 0.000 1.625 0.000) 1.625 7.925 ( 0.000 -10.290 0.000) 10.290 7.999 ( 0.000 1.052 0.000) 1.052 8.027 ( 0.000 -0.481 0.000) 0.481 9.333 ( 0.000 1.995 0.000) 1.995 9.354 ( 0.000 0.332 0.000) 0.332 9.832 ( 0.000 2.948 0.000) 2.948 9.884 ( 0.000 -1.938 0.000) 1.938 9.953 ( 0.000 0.431 0.000) 0.431 9.964 ( 0.000 -0.978 0.000) 0.978 11.269 ( 0.000 2.172 0.000) 2.172 11.327 ( 0.000 -3.474 0.000) 3.474 11.538 ( 0.000 2.214 0.000) 2.214 11.593 ( 0.000 -3.172 0.000) 3.172 11.784 ( 0.000 0.604 0.000) 0.604 11.813 ( 0.000 -2.362 0.000) 2.362 12.159 ( 0.000 6.331 0.000) 6.331 12.298 ( 0.000 -7.101 0.000) 7.101 12.419 ( 0.000 5.176 0.000) 5.176 12.487 ( 0.000 -2.238 0.000) 2.238 16.104 ( 0.000 0.794 0.000) 0.794 16.109 ( 0.000 0.356 0.000) 0.356 17.174 ( 0.000 4.919 0.000) 4.919 17.291 ( 0.000 -6.837 0.000) 6.837 17.385 ( 0.000 10.588 0.000) 10.588 17.613 ( 0.000 -12.380 0.000) 12.380 18.957 ( 0.000 16.800 0.000) 16.800 19.257 ( 0.000 -13.343 0.000) 13.343 ======================= Grid point 45 (26/170) ======================= q-point: ( 0.09 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.154 ( -1.664 14.391 -2.540) 14.708 2.298 ( 2.092 7.654 7.633) 11.010 2.321 ( -6.835 -1.568 4.648) 8.413 2.391 ( -1.798 -4.947 -3.598) 6.376 2.617 ( 4.287 7.340 1.209) 8.586 2.724 ( 6.834 5.694 -4.617) 10.022 2.801 ( 6.554 -6.660 1.150) 9.415 2.925 ( 2.337 -11.410 -3.683) 12.215 3.191 ( -1.185 1.382 -1.166) 2.162 3.357 ( -0.655 -13.102 -0.514) 13.128 3.782 ( 3.810 12.131 3.106) 13.089 3.880 ( 3.232 1.988 2.765) 4.695 4.272 ( -1.509 1.862 2.694) 3.606 4.394 ( -3.075 -9.644 1.413) 10.220 4.710 ( -2.436 18.698 -2.360) 19.003 4.942 ( -4.117 -3.802 -1.556) 5.816 5.018 ( -0.440 4.906 0.750) 4.982 5.104 ( 3.014 -2.522 -0.204) 3.935 5.392 ( -6.087 -1.201 -5.741) 8.453 5.470 ( -4.127 -7.481 -2.119) 8.803 5.724 ( -6.279 3.208 5.295) 8.818 5.783 ( -2.972 -2.778 3.734) 5.522 6.106 ( -0.803 6.163 4.926) 7.930 6.152 ( -3.195 2.241 2.069) 4.417 6.336 ( 0.431 -0.288 9.978) 9.991 6.409 ( -2.376 -5.841 0.910) 6.371 6.521 ( 2.651 10.863 -3.050) 11.590 6.750 ( -3.073 -10.830 -3.703) 11.851 6.823 ( 2.737 3.739 2.180) 5.120 6.935 ( 0.427 -5.801 0.648) 5.853 7.402 ( 3.758 6.938 -0.842) 7.936 7.552 ( 1.773 -4.117 -0.360) 4.497 7.759 ( 0.581 1.005 -2.335) 2.608 7.888 ( -1.503 -6.957 -3.443) 7.906 8.005 ( 3.769 1.218 -3.901) 5.559 8.044 ( 3.677 -1.231 -3.313) 5.100 9.272 ( -5.714 1.472 0.307) 5.909 9.296 ( -4.895 -0.553 -1.997) 5.315 9.805 ( -5.175 1.680 -2.297) 5.905 9.823 ( -0.935 0.027 -3.248) 3.380 9.953 ( -2.963 1.696 5.584) 6.545 9.993 ( -2.359 -1.734 6.961) 7.552 11.304 ( 2.098 1.178 1.051) 2.626 11.337 ( 0.531 -2.083 0.868) 2.319 11.569 ( 3.457 1.036 -0.676) 3.672 11.591 ( 0.395 -1.115 -0.370) 1.240 11.835 ( 4.906 0.331 0.639) 4.959 11.870 ( 6.614 -2.885 0.064) 7.216 12.136 ( -1.731 5.854 -0.842) 6.163 12.256 ( -2.683 -5.476 -0.863) 6.159 12.504 ( 9.619 3.438 -2.010) 10.411 12.554 ( 8.633 -1.380 -1.836) 8.933 16.101 ( -0.906 0.860 0.800) 1.483 16.108 ( -0.594 0.144 0.700) 0.929 17.201 ( 3.506 5.676 -2.505) 7.126 17.328 ( 6.065 -4.777 -5.197) 9.307 17.371 ( 0.829 5.671 -0.425) 5.747 17.555 ( -0.073 -10.150 -6.434) 12.018 18.931 ( -8.274 15.547 7.030) 18.963 19.209 ( -8.959 -12.483 4.873) 16.119 ======================= Grid point 46 (27/170) ======================= q-point: ( 0.18 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.113 ( -2.341 5.672 0.245) 6.141 2.196 ( -5.885 -2.369 -1.444) 6.506 2.452 ( 1.200 3.084 9.261) 9.834 2.486 ( 5.822 2.590 11.847) 13.452 2.680 ( 5.021 8.026 -1.729) 9.623 2.785 ( 5.531 3.103 -9.883) 11.743 2.821 ( 5.663 -3.937 -6.378) 9.394 2.940 ( -0.014 -6.572 -1.932) 6.851 3.161 ( 1.851 2.154 -3.294) 4.349 3.354 ( 2.325 -12.562 -0.487) 12.784 3.892 ( 4.036 8.686 0.781) 9.610 3.979 ( 3.191 0.431 0.927) 3.351 4.285 ( -2.499 1.563 6.404) 7.050 4.361 ( -3.948 -5.687 5.099) 8.598 4.614 ( -3.650 16.212 -3.799) 17.046 4.820 ( -6.267 -4.024 -2.450) 7.840 5.042 ( -0.278 3.378 3.041) 4.553 5.110 ( -1.385 -1.144 -0.983) 2.047 5.290 ( -2.660 0.725 -0.022) 2.758 5.374 ( -5.447 -6.364 -1.052) 8.443 5.629 ( -11.553 5.631 6.544) 14.422 5.722 ( -8.174 -3.870 4.292) 10.011 6.069 ( -7.000 2.255 2.125) 7.655 6.128 ( -4.624 -1.543 2.723) 5.583 6.422 ( 0.673 2.322 5.922) 6.396 6.461 ( 0.821 1.154 1.753) 2.254 6.554 ( 3.412 -3.567 2.110) 5.368 6.621 ( -4.233 -7.892 -5.440) 10.479 6.907 ( 4.196 4.774 2.718) 6.913 7.000 ( 3.953 -3.364 -0.055) 5.191 7.445 ( 2.986 3.796 -0.470) 4.852 7.555 ( -0.967 -5.645 -1.772) 5.995 7.720 ( 0.431 4.196 -4.430) 6.117 7.837 ( 0.780 -5.192 -3.445) 6.279 8.024 ( 4.780 3.215 -5.012) 7.636 8.076 ( 5.656 -1.553 -4.534) 7.413 9.177 ( -6.545 1.288 2.239) 7.037 9.208 ( -4.980 -2.194 2.742) 6.094 9.689 ( -7.583 1.580 1.725) 7.936 9.722 ( -7.119 -1.866 -0.099) 7.361 9.997 ( 0.872 2.275 3.156) 3.987 10.025 ( -0.265 -0.583 2.385) 2.469 11.335 ( 1.359 0.637 -0.606) 1.619 11.351 ( 0.125 -0.997 -0.188) 1.023 11.607 ( 2.546 0.951 -1.404) 3.059 11.622 ( 3.409 -0.284 -0.549) 3.465 11.928 ( 4.927 2.406 -1.293) 5.634 11.991 ( 6.491 -3.188 -2.472) 7.642 12.113 ( 1.363 4.709 0.604) 4.939 12.217 ( -0.183 -5.288 -0.442) 5.309 12.656 ( 11.379 3.949 -3.360) 12.504 12.706 ( 12.091 -0.626 -3.372) 12.568 16.093 ( -1.348 0.826 1.209) 1.990 16.104 ( -1.142 -0.252 1.187) 1.666 17.181 ( 2.147 4.897 -7.122) 8.906 17.291 ( 0.503 -6.322 -11.323) 12.978 17.436 ( 6.944 7.713 1.571) 10.496 17.613 ( 9.689 -9.794 1.941) 13.913 18.828 ( -14.907 13.321 8.469) 21.712 19.070 ( -14.752 -11.163 5.636) 19.339 ======================= Grid point 47 (28/170) ======================= q-point: ( 0.27 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.052 ( -6.047 3.432 1.042) 7.031 2.103 ( -4.892 -1.374 0.284) 5.089 2.570 ( 3.539 3.496 -0.508) 5.000 2.684 ( 4.113 -6.722 -13.598) 15.717 2.743 ( 6.271 6.317 7.548) 11.670 2.779 ( 3.694 4.180 5.973) 8.173 2.896 ( 3.046 -1.789 -4.104) 5.415 2.907 ( 8.369 -1.601 1.811) 8.711 3.181 ( 2.286 7.634 -0.792) 8.008 3.420 ( 1.725 -12.800 4.381) 13.638 3.885 ( 1.330 5.151 -7.426) 9.135 3.968 ( 2.087 -2.049 -7.676) 8.215 4.322 ( -4.934 7.272 7.150) 11.329 4.406 ( -1.950 -2.407 9.200) 9.707 4.524 ( -3.274 9.795 -1.518) 10.438 4.692 ( -6.014 -5.103 -2.750) 8.353 5.066 ( -1.558 0.710 0.581) 1.808 5.078 ( -0.203 -0.548 1.953) 2.039 5.226 ( -7.319 1.138 2.082) 7.694 5.275 ( -5.806 -3.801 1.888) 7.192 5.530 ( -8.428 6.287 6.438) 12.329 5.642 ( -6.304 -4.748 3.596) 8.673 5.991 ( -5.881 -0.395 3.587) 6.900 6.058 ( -7.739 -6.845 5.428) 11.671 6.425 ( 0.500 0.894 -5.924) 6.012 6.482 ( -3.756 -4.960 -6.006) 8.648 6.510 ( 0.310 5.104 2.327) 5.618 6.615 ( 0.718 -5.640 -1.289) 5.830 6.974 ( 1.117 5.246 -1.082) 5.471 7.064 ( 3.437 -3.360 2.082) 5.238 7.483 ( -1.854 0.723 -1.578) 2.540 7.518 ( 3.041 -2.011 1.847) 4.087 7.717 ( 3.115 5.955 -1.003) 6.795 7.827 ( 1.505 -4.358 -0.980) 4.713 8.063 ( 5.834 4.046 -3.667) 7.991 8.121 ( 5.336 -1.695 -3.990) 6.875 9.123 ( -4.965 1.576 4.754) 7.052 9.180 ( -4.770 -4.271 5.455) 8.411 9.605 ( -5.534 0.696 3.223) 6.442 9.624 ( -5.309 -1.391 2.336) 5.965 10.026 ( 0.674 1.429 -0.764) 1.755 10.049 ( 1.134 -0.682 0.533) 1.427 11.337 ( -0.474 0.174 -1.099) 1.210 11.342 ( 1.281 -0.148 -2.140) 2.499 11.623 ( 2.220 1.902 -3.574) 4.617 11.659 ( 2.019 -1.407 -1.863) 3.087 11.942 ( 1.771 3.731 -3.774) 5.595 12.001 ( 2.934 -1.712 -6.155) 7.030 12.209 ( 4.813 2.111 3.205) 6.156 12.265 ( 3.788 -3.186 2.374) 5.490 12.791 ( 9.899 5.508 -4.695) 12.263 12.852 ( 10.284 -0.246 -4.886) 11.388 16.084 ( -1.338 0.585 1.117) 1.839 16.097 ( -1.337 -0.704 1.202) 1.931 17.162 ( 4.170 2.030 -5.397) 7.116 17.198 ( 2.920 -1.693 -5.855) 6.758 17.588 ( 6.386 10.646 3.276) 12.839 17.833 ( 10.816 -13.839 4.047) 18.024 18.627 ( -18.013 11.959 5.259) 22.252 18.854 ( -16.146 -11.229 2.708) 19.852 ======================= Grid point 48 (29/170) ======================= q-point: ( 0.36 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.945 ( -6.032 4.751 -0.844) 7.725 2.025 ( -4.345 -3.026 -0.010) 5.295 2.533 ( -0.176 1.779 -7.054) 7.277 2.579 ( 1.587 -1.877 -10.033) 10.330 2.839 ( 4.636 9.124 -2.607) 10.560 2.951 ( 5.947 4.466 3.960) 8.426 2.995 ( 2.386 -4.230 2.273) 5.362 3.106 ( 9.336 -7.400 4.693) 12.803 3.272 ( 5.483 10.688 12.047) 17.012 3.506 ( -0.973 -11.459 10.068) 15.284 3.839 ( 4.888 5.155 -9.010) 11.474 3.922 ( 5.483 -1.640 -11.489) 12.836 4.252 ( -7.647 12.107 0.570) 14.331 4.424 ( -5.875 4.517 -1.134) 7.497 4.454 ( -5.652 -5.245 4.935) 9.155 4.540 ( -7.813 -7.631 -0.966) 10.964 5.031 ( -2.479 1.961 -2.176) 3.838 5.085 ( -4.218 -3.325 1.828) 5.674 5.152 ( -1.364 3.762 1.919) 4.438 5.241 ( -0.969 -4.668 2.506) 5.386 5.519 ( -2.286 3.704 8.344) 9.411 5.612 ( -2.974 -5.076 5.733) 8.214 5.940 ( -5.478 1.754 4.597) 7.363 6.033 ( -4.224 -8.197 6.968) 11.557 6.311 ( -4.900 -0.052 -9.003) 10.250 6.353 ( -2.624 -3.585 -6.976) 8.271 6.467 ( -1.590 4.069 -5.433) 6.972 6.561 ( -1.370 -5.779 -5.414) 8.036 6.983 ( 1.050 5.883 1.077) 6.073 7.113 ( 1.172 -6.940 -1.124) 7.127 7.479 ( 0.579 7.470 2.974) 8.061 7.580 ( 0.262 -1.378 2.296) 2.691 7.800 ( 5.210 4.516 2.475) 7.326 7.871 ( 2.531 -1.214 1.760) 3.313 8.124 ( 4.940 2.545 -2.081) 5.934 8.164 ( 4.350 -1.348 -2.313) 5.108 9.104 ( -3.659 0.779 4.016) 5.488 9.153 ( -4.940 -4.009 3.772) 7.396 9.582 ( -2.317 0.928 4.077) 4.780 9.607 ( -1.377 -1.799 3.990) 4.588 10.015 ( 0.519 1.661 -2.544) 3.082 10.061 ( 0.602 -2.830 -1.098) 3.094 11.311 ( -0.391 1.103 -1.939) 2.265 11.334 ( 0.845 -1.010 -2.135) 2.509 11.594 ( 0.286 2.204 -4.338) 4.874 11.639 ( -0.319 -2.027 -3.153) 3.761 11.946 ( 2.949 2.767 -2.288) 4.646 11.985 ( 2.762 -1.002 -4.477) 5.355 12.315 ( 3.276 2.410 2.976) 5.039 12.355 ( 3.151 -1.207 2.006) 3.926 12.876 ( 6.486 5.986 -4.417) 9.870 12.931 ( 5.964 0.655 -5.003) 7.812 16.076 ( -0.895 0.147 0.726) 1.162 16.088 ( -1.115 -1.052 0.802) 1.730 17.197 ( 6.399 5.345 -2.029) 8.581 17.281 ( 8.966 -2.083 0.069) 9.205 17.693 ( 0.384 14.395 3.882) 14.914 18.025 ( 2.988 -18.752 5.919) 19.889 18.376 ( -12.732 11.819 -0.717) 17.387 18.614 ( -12.691 -12.841 -0.831) 18.073 ======================= Grid point 49 (30/170) ======================= q-point: ( 0.45 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.859 ( -2.396 6.103 -0.797) 6.605 1.971 ( -1.666 -4.949 -0.075) 5.222 2.460 ( -0.554 3.859 -3.038) 4.942 2.520 ( 0.695 -0.452 -3.453) 3.551 2.873 ( 2.202 3.859 -1.782) 4.787 2.911 ( -1.976 -0.930 -2.667) 3.447 3.142 ( 3.660 8.975 4.243) 10.581 3.307 ( 5.927 -6.172 3.641) 9.300 3.546 ( 5.378 3.504 13.390) 14.849 3.629 ( -0.116 -4.414 10.552) 11.439 3.792 ( 2.144 4.729 -10.932) 12.102 3.860 ( 2.534 -1.669 -10.331) 10.767 4.142 ( -2.362 4.373 -1.254) 5.126 4.236 ( -9.528 -1.525 -2.328) 9.926 4.418 ( -2.158 -2.443 0.896) 3.380 4.469 ( -2.173 -5.515 1.591) 6.138 4.942 ( -2.832 3.774 -1.964) 5.111 5.032 ( -2.469 -5.121 0.575) 5.714 5.174 ( 0.573 4.245 0.557) 4.319 5.263 ( 0.483 -4.552 0.682) 4.629 5.625 ( 2.490 1.340 5.515) 6.197 5.683 ( 1.294 -3.498 6.166) 7.206 5.940 ( -2.369 3.557 8.362) 9.391 6.050 ( -2.981 -7.826 4.321) 9.424 6.106 ( -3.722 1.890 -9.450) 10.331 6.174 ( -2.994 -4.324 -11.423) 12.576 6.423 ( 0.489 -0.399 -1.221) 1.374 6.479 ( -1.236 -5.963 -2.989) 6.783 7.028 ( 1.253 3.540 2.402) 4.458 7.092 ( -0.455 -2.625 -2.446) 3.617 7.533 ( 0.862 5.930 2.511) 6.497 7.587 ( -0.589 1.542 0.151) 1.658 7.904 ( 2.764 2.863 1.846) 4.387 7.922 ( 0.754 1.336 1.229) 1.966 8.167 ( 2.005 2.709 -0.779) 3.459 8.210 ( 2.172 -1.432 -0.331) 2.622 9.093 ( -1.052 -0.868 1.358) 1.925 9.111 ( -2.852 -2.556 1.004) 3.959 9.606 ( -0.325 1.638 2.684) 3.161 9.638 ( -0.032 -1.530 1.842) 2.395 9.997 ( 0.338 0.638 -1.352) 1.533 10.048 ( -0.102 -4.413 -1.212) 4.577 11.285 ( -0.171 1.943 -1.245) 2.314 11.325 ( 0.273 -1.861 -0.846) 2.063 11.555 ( -0.179 2.179 -1.795) 2.828 11.602 ( -0.402 -2.192 -1.387) 2.625 11.971 ( 1.556 1.493 -0.604) 2.240 11.984 ( 1.170 0.271 -1.750) 2.122 12.381 ( 1.194 2.363 1.446) 3.017 12.406 ( 1.036 0.216 0.571) 1.203 12.914 ( 2.368 5.117 -1.619) 5.866 12.948 ( 1.666 1.823 -2.415) 3.454 16.071 ( -0.270 -0.272 0.245) 0.455 16.080 ( -0.468 -1.153 0.275) 1.274 17.308 ( 5.897 9.507 0.291) 11.191 17.448 ( 7.760 -2.862 0.678) 8.298 17.689 ( -3.353 16.028 1.765) 16.470 17.981 ( -10.526 -8.485 3.080) 13.866 18.303 ( 3.992 -2.925 -1.720) 5.239 18.438 ( -6.094 -12.996 -1.100) 14.396 ======================= Grid point 99 (31/170) ======================= q-point: ( 0.00 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.683 ( -3.808 0.000 31.246) 31.477 0.698 ( -9.536 0.000 31.628) 33.034 1.165 ( 11.649 0.000 52.322) 53.603 2.445 ( 7.876 0.000 -11.428) 13.879 2.445 ( 0.747 0.000 -0.725) 1.041 2.468 ( 7.572 0.000 -2.237) 7.896 2.561 ( -6.178 0.000 -2.669) 6.730 3.113 ( -8.528 0.000 -7.322) 11.240 3.558 ( 1.281 0.000 -16.385) 16.435 3.760 ( 4.833 0.000 -2.648) 5.511 4.121 ( -1.706 0.000 10.048) 10.192 4.159 ( -6.663 0.000 -6.497) 9.307 4.341 ( -6.801 0.000 13.012) 14.682 4.564 ( 0.014 0.000 5.340) 5.340 4.621 ( -6.788 0.000 -3.376) 7.581 4.853 ( -3.417 0.000 -6.263) 7.134 5.019 ( -14.407 0.000 4.390) 15.061 5.052 ( 1.394 0.000 2.348) 2.731 5.406 ( -5.070 0.000 1.317) 5.239 5.487 ( 10.885 0.000 9.615) 14.524 5.718 ( 5.617 0.000 -3.738) 6.747 5.812 ( 10.613 0.000 -9.208) 14.051 6.144 ( -0.429 0.000 -2.644) 2.678 6.275 ( 8.562 0.000 2.011) 8.795 6.304 ( -6.393 0.000 1.618) 6.595 6.337 ( -4.859 0.000 -2.771) 5.593 6.563 ( 8.150 0.000 2.936) 8.663 6.802 ( 0.408 0.000 8.750) 8.760 6.861 ( 8.754 0.000 -2.979) 9.247 7.285 ( -6.478 0.000 -0.290) 6.485 7.298 ( 1.442 0.000 2.117) 2.561 7.436 ( 1.432 0.000 -0.562) 1.538 7.464 ( -11.968 0.000 -2.484) 12.223 7.906 ( 0.074 0.000 1.626) 1.628 8.042 ( -12.640 0.000 -4.769) 13.509 8.352 ( 23.064 0.000 -13.352) 26.650 9.068 ( -0.738 0.000 5.397) 5.448 9.338 ( -0.900 0.000 1.508) 1.756 9.678 ( 1.626 0.000 4.431) 4.720 9.887 ( 5.071 0.000 1.001) 5.169 9.982 ( 0.627 0.000 -2.465) 2.543 10.028 ( -0.957 0.000 -2.170) 2.372 11.276 ( -0.980 0.000 3.573) 3.705 11.473 ( -20.671 0.000 -0.400) 20.675 11.679 ( -0.090 0.000 1.043) 1.047 11.751 ( 0.362 0.000 -3.281) 3.301 11.843 ( -0.904 0.000 -4.563) 4.652 11.915 ( -0.601 0.000 2.547) 2.617 11.922 ( -1.483 0.000 -2.006) 2.494 12.014 ( 15.595 0.000 5.980) 16.702 12.092 ( 2.173 0.000 -0.799) 2.315 13.065 ( 2.725 0.000 -9.644) 10.022 16.019 ( 0.213 0.000 1.166) 1.185 16.038 ( -0.092 0.000 0.906) 0.911 16.928 ( 0.516 0.000 1.841) 1.912 17.000 ( 13.626 0.000 1.269) 13.685 17.649 ( -32.974 0.000 -0.883) 32.986 17.735 ( 6.713 0.000 -0.975) 6.784 18.512 ( -6.975 0.000 9.676) 11.928 19.699 ( 16.684 0.000 -7.109) 18.136 ======================= Grid point 100 (32/170) ======================= q-point: ( 0.09 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.080 ( 8.791 0.000 24.372) 25.909 1.092 ( 14.014 0.000 22.638) 26.624 2.014 ( 17.993 0.000 33.382) 37.922 2.334 ( -5.132 0.000 -5.255) 7.345 2.377 ( -7.894 0.000 3.998) 8.848 2.603 ( 14.666 0.000 -8.881) 17.145 2.637 ( 13.087 0.000 1.891) 13.223 2.947 ( -1.015 0.000 2.302) 2.516 3.358 ( -0.961 0.000 -15.321) 15.351 3.670 ( -12.082 0.000 -1.007) 12.124 3.902 ( -12.251 0.000 -7.498) 14.363 4.088 ( -14.348 0.000 1.960) 14.481 4.295 ( -4.746 0.000 -2.494) 5.361 4.592 ( 6.258 0.000 4.951) 7.979 4.626 ( 0.390 0.000 4.026) 4.045 4.757 ( -0.140 0.000 -3.700) 3.702 4.944 ( -8.530 0.000 8.582) 12.100 5.044 ( -4.930 0.000 1.951) 5.302 5.422 ( 2.346 0.000 2.031) 3.103 5.644 ( -0.482 0.000 5.653) 5.674 5.824 ( 7.964 0.000 0.536) 7.982 5.839 ( 4.756 0.000 -6.925) 8.401 6.083 ( -4.581 0.000 3.097) 5.530 6.089 ( -18.737 0.000 -2.212) 18.867 6.222 ( -3.460 0.000 -2.494) 4.266 6.459 ( 8.689 0.000 2.744) 9.112 6.642 ( 3.652 0.000 -1.599) 3.987 6.922 ( 3.074 0.000 -6.185) 6.907 6.957 ( 2.762 0.000 12.129) 12.439 7.043 ( -5.857 0.000 3.043) 6.600 7.348 ( 1.274 0.000 0.298) 1.309 7.451 ( 1.238 0.000 -3.037) 3.279 7.472 ( 3.229 0.000 0.444) 3.260 7.871 ( -4.922 0.000 -6.669) 8.289 7.931 ( -0.516 0.000 3.827) 3.861 8.426 ( 10.348 0.000 -20.945) 23.362 9.141 ( 0.943 0.000 6.129) 6.202 9.358 ( 1.530 0.000 1.403) 2.076 9.714 ( -3.956 0.000 5.825) 7.041 9.947 ( -4.156 0.000 -3.115) 5.194 9.963 ( 0.876 0.000 -3.174) 3.293 10.050 ( 9.587 0.000 2.379) 9.878 11.280 ( -6.031 0.000 2.256) 6.439 11.297 ( -2.320 0.000 4.212) 4.808 11.704 ( -0.318 0.000 -2.041) 2.066 11.716 ( 1.756 0.000 0.288) 1.780 11.737 ( -3.921 0.000 -3.203) 5.063 11.828 ( -4.200 0.000 -4.045) 5.831 11.958 ( 2.498 0.000 1.717) 3.031 12.175 ( 6.677 0.000 -1.674) 6.884 12.198 ( 3.430 0.000 2.655) 4.337 12.964 ( -0.074 0.000 -11.635) 11.635 16.046 ( 1.171 0.000 1.510) 1.911 16.055 ( 0.729 0.000 0.951) 1.198 16.953 ( -0.488 0.000 1.882) 1.944 17.104 ( 0.027 0.000 0.001) 0.027 17.270 ( -15.642 0.000 3.206) 15.967 17.888 ( 10.237 0.000 -2.218) 10.475 18.510 ( -6.548 0.000 14.050) 15.501 19.804 ( 8.865 0.000 -11.927) 14.861 ======================= Grid point 101 (33/170) ======================= q-point: ( 0.18 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.466 ( 9.014 0.000 13.870) 16.542 1.575 ( 16.860 0.000 12.152) 20.783 2.050 ( -15.358 0.000 2.404) 15.545 2.240 ( -3.325 0.000 2.997) 4.476 2.622 ( 13.315 0.000 0.859) 13.343 2.710 ( 11.386 0.000 -15.219) 19.007 2.827 ( 7.422 0.000 -1.639) 7.601 3.252 ( 6.724 0.000 -9.206) 11.400 3.327 ( 20.488 0.000 28.023) 34.714 3.408 ( -14.894 0.000 -1.388) 14.958 3.622 ( -11.939 0.000 -0.566) 11.953 3.747 ( -13.145 0.000 -10.636) 16.909 4.268 ( -4.217 0.000 8.153) 9.179 4.658 ( 3.316 0.000 -4.856) 5.880 4.747 ( -0.588 0.000 2.690) 2.753 4.793 ( 7.092 0.000 6.032) 9.311 4.857 ( -12.671 0.000 6.316) 14.158 4.937 ( -7.031 0.000 -2.670) 7.520 5.440 ( 0.476 0.000 -4.746) 4.769 5.620 ( -15.474 0.000 2.289) 15.643 5.744 ( -4.000 0.000 5.761) 7.014 5.917 ( 3.086 0.000 -4.646) 5.578 5.924 ( -0.748 0.000 5.002) 5.057 6.107 ( -2.865 0.000 -3.097) 4.219 6.163 ( 5.204 0.000 5.342) 7.458 6.615 ( 7.413 0.000 -0.177) 7.415 6.683 ( 5.713 0.000 -5.670) 8.049 6.802 ( -2.567 0.000 -10.062) 10.384 7.099 ( 4.997 0.000 0.070) 4.997 7.142 ( 2.573 0.000 10.964) 11.261 7.364 ( -1.646 0.000 4.784) 5.059 7.416 ( -0.902 0.000 -2.824) 2.965 7.521 ( 3.406 0.000 -2.468) 4.206 7.699 ( -6.521 0.000 -6.056) 8.900 7.967 ( -2.988 0.000 5.872) 6.589 8.282 ( -0.132 0.000 -16.367) 16.367 9.227 ( 0.908 0.000 5.539) 5.613 9.413 ( 2.480 0.000 0.238) 2.491 9.689 ( -6.460 0.000 5.461) 8.459 9.839 ( -3.467 0.000 -2.923) 4.535 9.963 ( 3.443 0.000 -1.262) 3.667 10.238 ( 9.005 0.000 2.446) 9.331 11.264 ( 1.246 0.000 0.326) 1.288 11.288 ( -4.541 0.000 4.269) 6.232 11.638 ( -1.018 0.000 -5.212) 5.311 11.657 ( -3.597 0.000 -1.960) 4.096 11.732 ( -0.522 0.000 -2.159) 2.221 11.796 ( 3.075 0.000 4.202) 5.207 12.021 ( 3.399 0.000 -0.210) 3.405 12.241 ( 4.240 0.000 -3.468) 5.477 12.262 ( -0.065 0.000 5.103) 5.103 12.792 ( -3.082 0.000 -12.933) 13.295 16.084 ( 1.511 0.000 0.667) 1.651 16.091 ( 2.018 0.000 1.424) 2.470 16.942 ( -2.380 0.000 -0.188) 2.388 17.071 ( -7.964 0.000 6.724) 10.423 17.096 ( -4.298 0.000 -5.479) 6.964 17.908 ( -2.010 0.000 -5.859) 6.194 18.720 ( 7.611 0.000 19.405) 20.844 19.765 ( 3.271 0.000 -10.985) 11.462 ======================= Grid point 102 (34/170) ======================= q-point: ( 0.27 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.686 ( 5.077 0.000 4.813) 6.996 1.801 ( -6.178 0.000 -0.490) 6.198 1.914 ( 1.105 0.000 5.923) 6.025 2.291 ( -1.512 0.000 9.890) 10.005 2.626 ( 3.538 0.000 -17.946) 18.291 2.731 ( 9.052 0.000 -9.461) 13.094 2.965 ( 7.061 0.000 3.007) 7.674 3.120 ( -7.027 0.000 -6.001) 9.240 3.315 ( -4.453 0.000 -0.034) 4.453 3.437 ( -3.061 0.000 2.291) 3.824 3.608 ( 12.107 0.000 -5.734) 13.396 4.049 ( 15.969 0.000 23.751) 28.620 4.316 ( -3.544 0.000 10.946) 11.505 4.584 ( -5.297 0.000 -5.100) 7.353 4.706 ( -3.047 0.000 -1.823) 3.551 4.761 ( -7.758 0.000 -4.565) 9.002 4.802 ( -2.670 0.000 8.153) 8.579 4.932 ( 3.118 0.000 1.972) 3.689 5.339 ( -2.805 0.000 -7.333) 7.851 5.367 ( -13.475 0.000 1.883) 13.606 5.855 ( 4.735 0.000 7.397) 8.783 5.936 ( 0.306 0.000 -0.801) 0.857 5.936 ( 0.612 0.000 0.941) 1.122 6.024 ( -2.100 0.000 -2.017) 2.912 6.359 ( 5.823 0.000 8.319) 10.154 6.576 ( -1.771 0.000 -13.992) 14.104 6.692 ( 4.883 0.000 -3.569) 6.048 6.762 ( 6.346 0.000 -5.345) 8.297 7.151 ( 1.889 0.000 -1.962) 2.724 7.291 ( 2.581 0.000 6.960) 7.424 7.337 ( -4.402 0.000 -6.630) 7.959 7.423 ( -3.068 0.000 11.376) 11.783 7.533 ( 2.871 0.000 -4.178) 5.069 7.550 ( -3.151 0.000 -1.054) 3.323 7.938 ( -8.541 0.000 5.686) 10.260 8.077 ( -4.724 0.000 -10.720) 11.715 9.294 ( 0.196 0.000 4.164) 4.168 9.400 ( -1.876 0.000 -2.804) 3.374 9.635 ( -5.954 0.000 3.732) 7.028 9.767 ( -1.313 0.000 -3.263) 3.517 10.100 ( 10.451 0.000 4.180) 11.256 10.398 ( 7.472 0.000 0.616) 7.497 11.253 ( -5.311 0.000 4.162) 6.747 11.302 ( 2.203 0.000 0.111) 2.206 11.560 ( -4.596 0.000 -1.257) 4.765 11.565 ( 0.222 0.000 -5.171) 5.175 11.776 ( 5.069 0.000 1.218) 5.213 11.901 ( 2.931 0.000 4.235) 5.150 12.057 ( 1.806 0.000 -0.853) 1.997 12.228 ( 0.530 0.000 -5.736) 5.761 12.328 ( -0.338 0.000 6.610) 6.618 12.580 ( -3.835 0.000 -11.880) 12.484 16.118 ( 2.012 0.000 0.096) 2.014 16.143 ( 2.474 0.000 0.800) 2.600 16.868 ( -3.884 0.000 -2.856) 4.821 16.941 ( -6.623 0.000 -2.412) 7.049 17.051 ( -3.714 0.000 4.361) 5.729 17.771 ( -5.997 0.000 -3.189) 6.793 19.108 ( 10.677 0.000 16.407) 19.575 19.680 ( 1.753 0.000 -10.108) 10.259 ======================= Grid point 103 (35/170) ======================= q-point: ( 0.36 0.00 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.678 ( -8.775 0.000 5.442) 10.326 1.799 ( 3.119 0.000 4.051) 5.112 1.950 ( -0.632 0.000 -0.026) 0.633 2.267 ( -4.687 0.000 -9.423) 10.525 2.550 ( 3.441 0.000 1.469) 3.742 2.767 ( 6.971 0.000 -7.026) 9.897 3.023 ( -3.875 0.000 2.375) 4.544 3.099 ( 5.008 0.000 2.191) 5.466 3.244 ( -1.683 0.000 -0.185) 1.694 3.528 ( 5.251 0.000 6.606) 8.439 3.818 ( 16.103 0.000 -6.079) 17.212 4.145 ( -10.411 0.000 -5.374) 11.717 4.371 ( -5.666 0.000 8.632) 10.326 4.592 ( 2.546 0.000 -8.653) 9.020 4.620 ( -2.285 0.000 -2.012) 3.045 4.716 ( 5.304 0.000 8.505) 10.024 4.853 ( -1.306 0.000 6.748) 6.873 4.946 ( 2.581 0.000 -5.722) 6.277 5.225 ( -7.212 0.000 3.481) 8.008 5.235 ( -3.787 0.000 0.361) 3.804 5.873 ( 1.600 0.000 -11.171) 11.285 5.947 ( -0.368 0.000 -0.347) 0.506 6.001 ( -0.851 0.000 3.176) 3.288 6.079 ( 5.803 0.000 11.580) 12.953 6.435 ( 0.755 0.000 -5.457) 5.509 6.511 ( 3.091 0.000 2.796) 4.168 6.740 ( 3.612 0.000 1.796) 4.034 6.791 ( 5.127 0.000 -7.883) 9.403 7.063 ( -8.427 0.000 -5.723) 10.187 7.180 ( -1.084 0.000 -3.367) 3.537 7.376 ( 0.739 0.000 1.535) 1.703 7.476 ( -3.615 0.000 5.611) 6.675 7.536 ( 0.317 0.000 0.286) 0.427 7.595 ( 5.128 0.000 3.116) 6.001 7.839 ( -9.597 0.000 5.581) 11.102 7.886 ( -5.935 0.000 -6.677) 8.934 9.328 ( -0.702 0.000 2.329) 2.432 9.331 ( -1.600 0.000 -2.416) 2.898 9.584 ( -4.035 0.000 2.072) 4.536 9.719 ( -0.246 0.000 -2.186) 2.200 10.335 ( 9.692 0.000 3.200) 10.206 10.491 ( 4.883 0.000 -2.919) 5.689 11.203 ( -5.334 0.000 2.386) 5.843 11.316 ( -0.021 0.000 -1.115) 1.115 11.482 ( -3.492 0.000 -0.600) 3.543 11.552 ( 3.235 0.000 -1.616) 3.617 11.906 ( 6.661 0.000 3.265) 7.419 11.966 ( 1.829 0.000 -0.755) 1.978 12.085 ( 0.119 0.000 3.607) 3.608 12.140 ( -1.359 0.000 -6.151) 6.300 12.391 ( -1.370 0.000 5.983) 6.138 12.425 ( -1.312 0.000 -6.457) 6.589 16.150 ( 1.944 0.000 -0.568) 2.025 16.186 ( 2.106 0.000 -0.367) 2.138 16.774 ( -2.702 0.000 -2.150) 3.453 16.824 ( -4.175 0.000 -1.529) 4.446 17.054 ( -3.662 0.000 6.813) 7.735 17.662 ( -4.136 0.000 -0.583) 4.177 19.394 ( 4.605 0.000 8.916) 10.035 19.603 ( 2.749 0.000 -9.220) 9.622 ======================= Grid point 104 (36/170) ======================= q-point: ( 0.45 0.00 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.646 ( -6.125 0.000 9.727) 11.494 1.864 ( -1.473 0.000 1.781) 2.311 1.974 ( 1.783 0.000 5.068) 5.373 2.100 ( 1.339 0.000 -6.845) 6.975 2.696 ( 3.326 0.000 10.723) 11.227 2.821 ( 6.893 0.000 -3.270) 7.629 2.968 ( -4.857 0.000 -0.330) 4.868 3.166 ( -0.300 0.000 1.717) 1.743 3.244 ( 2.176 0.000 -1.399) 2.587 3.616 ( -3.415 0.000 -3.321) 4.764 3.948 ( 8.052 0.000 -7.236) 10.826 3.973 ( 1.083 0.000 -0.899) 1.408 4.298 ( -7.745 0.000 0.488) 7.760 4.403 ( -1.507 0.000 -20.605) 20.660 4.622 ( -1.013 0.000 3.218) 3.373 4.848 ( 1.379 0.000 0.569) 1.492 4.942 ( -0.363 0.000 10.646) 10.652 4.972 ( 7.972 0.000 -4.026) 8.931 5.172 ( -5.422 0.000 3.482) 6.444 5.203 ( -2.688 0.000 3.145) 4.137 5.792 ( 1.473 0.000 -4.981) 5.194 5.866 ( -2.216 0.000 -7.952) 8.255 6.056 ( 5.005 0.000 -0.249) 5.011 6.192 ( -6.752 0.000 1.260) 6.869 6.505 ( 4.377 0.000 7.643) 8.807 6.519 ( -1.428 0.000 -1.890) 2.369 6.798 ( 7.180 0.000 0.756) 7.219 6.857 ( 1.573 0.000 8.270) 8.418 6.957 ( 1.842 0.000 -1.658) 2.478 7.153 ( 0.478 0.000 -2.010) 2.066 7.322 ( -4.822 0.000 -4.147) 6.360 7.449 ( -2.821 0.000 -1.381) 3.141 7.530 ( -0.317 0.000 -0.013) 0.317 7.714 ( -5.031 0.000 -4.679) 6.870 7.761 ( 6.892 0.000 4.783) 8.389 7.775 ( -6.210 0.000 5.816) 8.508 9.309 ( 0.963 0.000 -0.242) 0.993 9.324 ( -1.645 0.000 0.356) 1.683 9.552 ( -2.094 0.000 1.522) 2.589 9.719 ( 1.290 0.000 0.750) 1.492 10.429 ( 0.700 0.000 -3.914) 3.976 10.490 ( 1.714 0.000 -6.720) 6.935 11.135 ( -3.314 0.000 -0.408) 3.339 11.298 ( 0.736 0.000 -2.052) 2.180 11.435 ( -0.976 0.000 -0.226) 1.002 11.612 ( 2.834 0.000 1.681) 3.295 11.962 ( 1.267 0.000 -3.149) 3.395 12.013 ( -0.678 0.000 0.094) 0.685 12.115 ( 4.592 0.000 2.173) 5.080 12.131 ( -1.611 0.000 5.570) 5.798 12.402 ( 3.512 0.000 0.022) 3.512 12.410 ( -3.648 0.000 4.260) 5.609 16.166 ( 0.957 0.000 -1.184) 1.522 16.200 ( 0.763 0.000 -1.635) 1.804 16.750 ( 0.511 0.000 1.356) 1.449 16.776 ( -0.632 0.000 0.454) 0.778 17.084 ( -3.901 0.000 9.119) 9.919 17.620 ( -0.900 0.000 0.883) 1.261 19.449 ( -4.019 0.000 -0.427) 4.042 19.568 ( 5.220 0.000 -7.981) 9.537 ======================= Grid point 105 (37/170) ======================= q-point: (-0.45 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.675 ( -3.446 0.000 9.019) 9.655 1.836 ( -0.900 0.000 1.438) 1.697 2.121 ( 1.669 0.000 10.786) 10.914 2.123 ( -1.379 0.000 3.704) 3.953 2.814 ( -2.234 0.000 1.586) 2.740 2.913 ( 4.416 0.000 1.466) 4.653 2.926 ( 4.752 0.000 1.051) 4.867 3.139 ( -2.195 0.000 -0.521) 2.256 3.309 ( 5.987 0.000 2.923) 6.662 3.388 ( -9.500 0.000 -9.700) 13.578 3.921 ( 0.121 0.000 -8.912) 8.913 4.003 ( -0.360 0.000 -18.401) 18.404 4.149 ( -8.001 0.000 -2.381) 8.347 4.213 ( 7.663 0.000 -4.439) 8.856 4.640 ( -0.718 0.000 2.034) 2.157 4.782 ( -7.163 0.000 -2.578) 7.613 5.034 ( -4.882 0.000 9.919) 11.055 5.049 ( 2.571 0.000 0.163) 2.576 5.112 ( -2.476 0.000 -0.349) 2.500 5.247 ( 3.770 0.000 3.211) 4.952 5.745 ( -0.155 0.000 -8.355) 8.357 5.807 ( 3.767 0.000 -1.190) 3.950 6.004 ( -8.165 0.000 -2.199) 8.456 6.148 ( 5.472 0.000 -0.954) 5.555 6.459 ( -4.472 0.000 1.442) 4.699 6.700 ( 4.625 0.000 11.171) 12.091 6.941 ( -3.000 0.000 7.449) 8.030 6.953 ( 3.057 0.000 1.281) 3.315 7.095 ( 12.597 0.000 5.198) 13.627 7.144 ( 2.255 0.000 -2.440) 3.322 7.170 ( -3.751 0.000 -7.192) 8.112 7.335 ( -6.295 0.000 -5.074) 8.085 7.558 ( 5.748 0.000 -2.574) 6.298 7.564 ( -5.469 0.000 -4.215) 6.905 7.745 ( -4.848 0.000 4.633) 6.705 7.972 ( 9.457 0.000 5.853) 11.121 9.283 ( -2.512 0.000 -1.273) 2.816 9.352 ( 2.937 0.000 1.313) 3.217 9.553 ( -0.697 0.000 2.899) 2.982 9.771 ( 1.826 0.000 2.885) 3.414 10.279 ( -7.104 0.000 -9.729) 12.046 10.401 ( -1.045 0.000 -9.048) 9.108 11.104 ( 0.216 0.000 -0.468) 0.515 11.299 ( 2.277 0.000 -2.361) 3.280 11.458 ( 2.558 0.000 1.963) 3.224 11.661 ( 0.847 0.000 0.710) 1.105 11.938 ( -5.320 0.000 -1.281) 5.472 11.956 ( 0.453 0.000 -0.145) 0.475 12.152 ( -2.393 0.000 3.940) 4.610 12.255 ( 4.925 0.000 4.375) 6.588 12.366 ( -5.985 0.000 2.254) 6.395 12.535 ( 8.032 0.000 4.762) 9.338 16.153 ( -0.483 0.000 -1.493) 1.569 16.174 ( -0.889 0.000 -2.304) 2.470 16.806 ( 2.460 0.000 2.540) 3.536 16.808 ( 2.493 0.000 1.618) 2.972 17.134 ( -3.898 0.000 10.873) 11.550 17.663 ( 3.614 0.000 3.161) 4.801 19.260 ( -11.981 0.000 -8.039) 14.428 19.596 ( 7.855 0.000 -6.251) 10.039 ======================= Grid point 106 (38/170) ======================= q-point: (-0.36 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.748 ( 0.264 0.000 8.428) 8.432 1.837 ( -9.974 0.000 4.986) 11.151 2.082 ( -2.000 0.000 1.985) 2.818 2.107 ( -14.526 0.000 0.393) 14.532 2.831 ( 6.521 0.000 -1.301) 6.649 2.943 ( -7.326 0.000 -2.378) 7.703 3.074 ( 7.641 0.000 6.087) 9.769 3.089 ( -1.835 0.000 2.150) 2.827 3.264 ( 6.563 0.000 -2.826) 7.145 3.508 ( 11.062 0.000 3.497) 11.601 3.576 ( -16.102 0.000 -21.743) 27.057 3.740 ( -10.369 0.000 -7.068) 12.549 4.027 ( -0.798 0.000 -3.353) 3.446 4.404 ( 11.377 0.000 0.880) 11.410 4.625 ( -1.612 0.000 -1.511) 2.209 4.630 ( -4.611 0.000 -2.706) 5.347 5.000 ( -4.491 0.000 2.310) 5.050 5.092 ( 0.022 0.000 4.006) 4.006 5.111 ( 1.171 0.000 0.123) 1.177 5.359 ( 5.304 0.000 1.593) 5.538 5.642 ( -2.002 0.000 -5.784) 6.120 5.872 ( 3.796 0.000 0.940) 3.911 5.977 ( 2.629 0.000 4.146) 4.909 6.141 ( -3.303 0.000 -4.838) 5.858 6.433 ( -5.073 0.000 7.519) 9.070 6.867 ( 2.324 0.000 4.480) 5.047 6.904 ( -7.569 0.000 0.544) 7.588 6.975 ( -2.775 0.000 3.325) 4.331 7.095 ( 1.481 0.000 -4.094) 4.353 7.140 ( -4.492 0.000 -7.198) 8.484 7.164 ( 2.708 0.000 -1.113) 2.927 7.386 ( 12.241 0.000 4.279) 12.967 7.451 ( -0.578 0.000 -2.841) 2.899 7.649 ( 7.855 0.000 -2.634) 8.285 7.716 ( -4.484 0.000 3.364) 5.605 8.202 ( 11.203 0.000 3.220) 11.657 9.214 ( -3.142 0.000 -2.092) 3.774 9.417 ( 2.424 0.000 0.641) 2.508 9.599 ( -0.398 0.000 6.632) 6.644 9.821 ( 0.257 0.000 1.483) 1.505 10.057 ( -5.029 0.000 -6.485) 8.207 10.255 ( -3.002 0.000 -9.804) 10.253 11.122 ( 1.993 0.000 0.161) 1.999 11.308 ( 2.263 0.000 -3.208) 3.926 11.559 ( 4.955 0.000 3.851) 6.275 11.664 ( 0.747 0.000 -1.537) 1.709 11.831 ( -5.303 0.000 -1.079) 5.411 11.957 ( -3.728 0.000 3.768) 5.301 12.158 ( -0.067 0.000 1.405) 1.407 12.267 ( -7.367 0.000 0.505) 7.384 12.353 ( 1.542 0.000 2.667) 3.081 12.746 ( 9.266 0.000 4.963) 10.511 16.119 ( -1.427 0.000 -1.323) 1.947 16.123 ( -1.856 0.000 -2.142) 2.834 16.864 ( 2.118 0.000 0.274) 2.135 16.867 ( 2.063 0.000 0.423) 2.106 17.218 ( -1.654 0.000 12.425) 12.535 17.818 ( 8.291 0.000 5.415) 9.902 18.889 ( -17.761 0.000 -10.930) 20.855 19.681 ( 9.330 0.000 -4.422) 10.325 ======================= Grid point 107 (39/170) ======================= q-point: (-0.27 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.523 ( -25.089 0.000 -1.469) 25.132 1.672 ( -25.227 0.000 -10.271) 27.238 1.900 ( 4.253 0.000 8.172) 9.212 2.204 ( 6.294 0.000 6.736) 9.219 2.620 ( -28.316 0.000 -7.156) 29.207 2.831 ( -19.231 0.000 -17.579) 26.054 2.984 ( 13.326 0.000 -2.548) 13.567 3.126 ( -2.615 0.000 1.184) 2.871 3.286 ( -1.792 0.000 7.788) 7.991 3.484 ( -2.653 0.000 -1.887) 3.255 3.638 ( 15.441 0.000 10.433) 18.635 3.705 ( 9.144 0.000 -1.238) 9.228 4.054 ( 6.479 0.000 -2.186) 6.838 4.520 ( 4.594 0.000 -4.476) 6.414 4.582 ( -0.842 0.000 0.536) 0.998 4.584 ( -0.529 0.000 0.050) 0.532 4.980 ( -1.075 0.000 0.948) 1.433 5.121 ( -3.226 0.000 4.129) 5.240 5.178 ( 11.311 0.000 -4.755) 12.270 5.463 ( 5.287 0.000 1.472) 5.489 5.597 ( 1.225 0.000 1.499) 1.936 5.900 ( -3.552 0.000 -6.015) 6.986 6.019 ( -2.004 0.000 3.264) 3.830 6.106 ( 3.349 0.000 6.662) 7.456 6.419 ( -6.541 0.000 5.640) 8.637 6.730 ( -9.792 0.000 -4.094) 10.613 6.863 ( -2.134 0.000 -2.657) 3.408 6.918 ( -6.180 0.000 -5.897) 8.542 6.939 ( -5.162 0.000 -1.353) 5.337 7.143 ( -2.806 0.000 -2.157) 3.539 7.212 ( 8.217 0.000 -0.664) 8.244 7.450 ( 3.664 0.000 2.172) 4.259 7.645 ( -6.846 0.000 -0.139) 6.847 7.684 ( 12.622 0.000 6.071) 14.006 7.745 ( 6.254 0.000 -1.706) 6.483 8.417 ( 13.634 0.000 -2.397) 13.843 9.135 ( -3.400 0.000 -1.744) 3.822 9.417 ( -1.720 0.000 -1.338) 2.179 9.688 ( -1.803 0.000 11.126) 11.271 9.838 ( 2.957 0.000 0.128) 2.960 9.994 ( 0.015 0.000 0.009) 0.018 10.081 ( -4.041 0.000 -9.273) 10.115 11.171 ( 2.816 0.000 0.995) 2.987 11.293 ( 1.112 0.000 -4.104) 4.252 11.670 ( 2.170 0.000 -1.383) 2.574 11.689 ( 3.180 0.000 3.888) 5.023 11.759 ( -0.015 0.000 -0.649) 0.649 11.907 ( -6.745 0.000 3.323) 7.519 12.135 ( -7.602 0.000 -0.287) 7.607 12.189 ( 1.996 0.000 -0.494) 2.056 12.367 ( -2.224 0.000 0.731) 2.341 12.938 ( 8.250 0.000 1.911) 8.469 16.069 ( -1.940 0.000 -1.427) 2.408 16.080 ( -1.630 0.000 -0.752) 1.795 16.867 ( -0.696 0.000 -2.505) 2.600 16.885 ( 1.496 0.000 -1.478) 2.103 17.372 ( 1.474 0.000 13.932) 14.010 18.028 ( 10.238 0.000 0.306) 10.243 18.461 ( -19.901 0.000 -4.085) 20.316 19.793 ( 8.958 0.000 -3.574) 9.645 ======================= Grid point 108 (40/170) ======================= q-point: (-0.18 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.049 ( -29.812 0.000 1.873) 29.870 1.051 ( -29.163 0.000 -14.398) 32.524 1.814 ( -50.342 0.000 -1.735) 50.372 2.123 ( 8.129 0.000 11.521) 14.100 2.367 ( 6.407 0.000 1.029) 6.489 2.546 ( -4.860 0.000 -6.941) 8.473 3.012 ( -15.389 0.000 0.094) 15.389 3.021 ( -9.977 0.000 -0.180) 9.979 3.266 ( 18.424 0.000 -7.157) 19.766 3.700 ( 10.140 0.000 7.371) 12.536 3.811 ( 4.548 0.000 0.488) 4.574 4.006 ( 12.746 0.000 8.625) 15.390 4.132 ( 4.791 0.000 -0.141) 4.793 4.538 ( -0.190 0.000 1.270) 1.284 4.561 ( 1.286 0.000 -1.683) 2.118 4.658 ( 4.624 0.000 5.978) 7.557 4.960 ( -1.023 0.000 -1.026) 1.449 5.061 ( -7.957 0.000 2.110) 8.233 5.344 ( 16.837 0.000 -9.958) 19.561 5.576 ( 3.550 0.000 4.463) 5.703 5.697 ( -6.429 0.000 -7.316) 9.740 5.756 ( 8.833 0.000 10.907) 14.035 6.100 ( 3.044 0.000 3.266) 4.464 6.195 ( -0.816 0.000 2.336) 2.475 6.330 ( -7.415 0.000 -0.737) 7.451 6.518 ( -8.071 0.000 -4.135) 9.069 6.711 ( -8.939 0.000 -15.301) 17.721 6.790 ( -4.059 0.000 -0.355) 4.074 6.794 ( -4.742 0.000 -0.006) 4.742 7.091 ( -2.849 0.000 2.449) 3.757 7.331 ( 5.767 0.000 -0.157) 5.770 7.481 ( -8.768 0.000 -3.558) 9.462 7.552 ( 4.081 0.000 2.620) 4.850 7.822 ( 3.994 0.000 0.097) 3.995 7.942 ( 8.431 0.000 6.766) 10.810 8.598 ( 14.552 0.000 -8.454) 16.829 9.068 ( -3.153 0.000 0.142) 3.156 9.369 ( -2.385 0.000 0.259) 2.399 9.759 ( -5.018 0.000 7.148) 8.734 9.927 ( 6.073 0.000 0.267) 6.079 9.934 ( -3.199 0.000 -2.461) 4.036 10.002 ( 0.165 0.000 0.393) 0.426 11.226 ( 1.408 0.000 1.645) 2.165 11.274 ( 1.688 0.000 -1.112) 2.021 11.697 ( 1.593 0.000 -0.102) 1.597 11.723 ( 2.656 0.000 0.031) 2.656 11.827 ( -4.904 0.000 0.865) 4.980 11.848 ( 5.147 0.000 1.834) 5.464 12.003 ( -6.518 0.000 -1.273) 6.642 12.201 ( 1.418 0.000 -4.225) 4.456 12.298 ( -5.557 0.000 -0.959) 5.639 13.059 ( 6.413 0.000 -2.466) 6.870 16.029 ( -1.411 0.000 -0.464) 1.486 16.051 ( -1.305 0.000 0.002) 1.305 16.794 ( -2.362 0.000 -4.787) 5.338 16.890 ( 1.178 0.000 -1.174) 1.663 17.586 ( 3.244 0.000 16.247) 16.568 17.957 ( -6.165 0.000 -14.699) 15.940 18.351 ( -2.232 0.000 14.251) 14.425 19.874 ( 6.265 0.000 -6.325) 8.903 ======================= Grid point 109 (41/170) ======================= q-point: (-0.09 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.533 ( -20.529 0.000 18.556) 27.673 0.647 ( -27.293 0.000 17.896) 32.637 1.055 ( -48.616 0.000 22.215) 53.451 2.388 ( 9.639 0.000 -2.283) 9.906 2.431 ( 6.122 0.000 -7.213) 9.461 2.460 ( -2.083 0.000 0.669) 2.188 2.757 ( -12.288 0.000 -1.883) 12.432 2.981 ( 4.526 0.000 20.264) 20.763 3.521 ( 19.446 0.000 -7.741) 20.931 3.760 ( 1.605 0.000 -8.949) 9.091 3.975 ( 4.193 0.000 10.649) 11.445 4.205 ( 4.502 0.000 -0.115) 4.504 4.251 ( -0.735 0.000 13.002) 13.023 4.528 ( -1.707 0.000 3.181) 3.610 4.753 ( -5.001 0.000 2.942) 5.802 4.763 ( 14.919 0.000 21.496) 26.166 4.926 ( -0.298 0.000 -2.911) 2.927 4.979 ( 0.413 0.000 1.615) 1.667 5.483 ( 12.594 0.000 -15.359) 19.862 5.520 ( -8.096 0.000 0.536) 8.114 5.693 ( 4.726 0.000 -2.161) 5.196 5.913 ( -11.776 0.000 -19.032) 22.381 6.136 ( 2.127 0.000 -3.541) 4.130 6.171 ( 11.091 0.000 17.345) 20.588 6.218 ( -1.047 0.000 -1.883) 2.155 6.391 ( -5.782 0.000 1.021) 5.871 6.425 ( -7.648 0.000 -1.030) 7.717 6.751 ( -3.203 0.000 4.345) 5.398 6.758 ( 1.235 0.000 0.515) 1.338 7.121 ( 1.379 0.000 7.243) 7.373 7.314 ( -5.345 0.000 -0.305) 5.354 7.410 ( 3.155 0.000 -1.094) 3.339 7.631 ( 3.036 0.000 -0.639) 3.103 7.878 ( 1.838 0.000 0.880) 2.038 8.122 ( 6.369 0.000 4.356) 7.716 8.586 ( -4.799 0.000 -21.772) 22.295 9.043 ( -2.109 0.000 3.396) 3.997 9.345 ( -1.870 0.000 1.488) 2.390 9.663 ( -5.173 0.000 -2.300) 5.661 9.902 ( -3.736 0.000 0.682) 3.797 9.993 ( 1.434 0.000 -1.840) 2.333 10.023 ( 2.566 0.000 0.110) 2.568 11.255 ( -0.496 0.000 2.427) 2.478 11.438 ( 13.272 0.000 15.182) 20.165 11.699 ( -2.452 0.000 1.526) 2.888 11.784 ( 0.852 0.000 -2.076) 2.244 11.807 ( 7.033 0.000 -1.301) 7.153 11.890 ( -4.266 0.000 -4.568) 6.250 11.923 ( 2.219 0.000 -0.197) 2.228 12.057 ( -10.397 0.000 -11.451) 15.466 12.171 ( -6.857 0.000 -1.823) 7.095 13.098 ( 4.643 0.000 -6.634) 8.097 16.013 ( -0.612 0.000 0.507) 0.795 16.037 ( -0.766 0.000 0.599) 0.973 16.743 ( 1.890 0.000 4.540) 4.918 16.902 ( 0.884 0.000 0.375) 0.960 17.741 ( -2.648 0.000 -6.527) 7.044 17.875 ( 9.162 0.000 11.086) 14.382 18.473 ( -2.254 0.000 10.721) 10.956 19.765 ( -6.734 0.000 -15.965) 17.327 ======================= Grid point 110 (42/170) ======================= q-point: ( 0.00 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.883 ( 4.483 22.886 18.082) 29.510 1.009 ( 2.332 19.066 27.381) 33.446 1.592 ( -1.451 37.192 34.254) 50.583 2.397 ( 5.199 -1.245 -7.494) 9.206 2.457 ( 2.480 0.165 -3.881) 4.609 2.496 ( 1.855 0.819 -1.049) 2.283 2.610 ( -0.009 5.871 -1.728) 6.120 3.098 ( -7.763 4.549 1.513) 9.124 3.442 ( 1.713 -13.466 -7.653) 15.583 3.723 ( -0.864 -5.719 -5.234) 7.800 3.905 ( -3.198 -13.839 0.791) 14.225 4.143 ( 0.513 -9.455 3.888) 10.236 4.273 ( -6.967 -0.605 6.198) 9.344 4.621 ( 1.457 2.039 -3.345) 4.180 4.740 ( -0.822 -0.466 1.166) 1.501 4.759 ( -5.958 2.469 -1.109) 6.544 5.007 ( -2.413 -0.472 4.242) 4.903 5.111 ( -6.637 7.269 5.102) 11.087 5.213 ( 5.180 -8.370 16.644) 19.337 5.541 ( 0.774 3.023 -3.079) 4.384 5.789 ( 8.494 -0.651 -7.639) 11.443 5.817 ( 3.844 5.842 -5.268) 8.755 6.015 ( -5.306 -7.656 -2.617) 9.676 6.127 ( -0.809 -4.500 3.819) 5.957 6.222 ( -0.794 -5.286 1.563) 5.569 6.453 ( 8.312 -1.649 7.316) 11.195 6.580 ( 1.388 1.628 -1.417) 2.566 6.773 ( 3.861 -2.298 2.470) 5.127 6.946 ( 3.669 5.410 1.021) 6.616 7.074 ( -11.884 -4.199 7.924) 14.889 7.315 ( 1.615 1.194 1.043) 2.263 7.439 ( -2.360 -2.083 -0.828) 3.255 7.554 ( 0.264 4.561 -3.137) 5.542 7.700 ( 2.857 0.223 -2.079) 3.541 8.172 ( -3.287 0.549 -4.055) 5.249 8.598 ( 6.024 2.840 -17.573) 18.792 9.100 ( -0.937 3.819 3.745) 5.430 9.377 ( -2.592 2.084 1.877) 3.819 9.702 ( 1.978 2.132 2.909) 4.113 9.841 ( 0.390 -2.711 0.042) 2.739 10.007 ( -1.339 -1.316 -1.039) 2.146 10.056 ( -1.015 4.646 -0.270) 4.764 11.231 ( 0.853 -1.752 0.749) 2.088 11.507 ( -12.105 0.349 -1.127) 12.162 11.661 ( -1.829 -2.092 -0.227) 2.788 11.678 ( 5.597 -3.874 -2.807) 7.363 11.848 ( -0.245 0.087 -2.785) 2.797 11.893 ( 13.130 -5.492 5.147) 15.135 11.977 ( 0.491 4.598 2.886) 5.451 12.041 ( -4.918 8.231 -2.514) 9.913 12.099 ( 2.106 -0.529 -0.459) 2.220 12.973 ( 1.935 -8.780 -8.800) 12.581 16.030 ( 0.264 1.102 1.158) 1.621 16.048 ( -0.110 0.975 0.909) 1.338 16.835 ( 1.998 -0.293 3.322) 3.888 17.082 ( 3.353 2.437 -0.966) 4.256 17.676 ( 3.991 -3.945 0.005) 5.612 17.775 ( -14.731 5.953 -10.366) 18.971 18.501 ( -4.767 0.126 13.449) 14.269 19.714 ( 7.422 -0.304 -4.269) 8.568 ======================= Grid point 111 (43/170) ======================= q-point: ( 0.09 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.276 ( 14.838 17.059 17.250) 28.438 1.363 ( 6.619 22.250 20.648) 31.068 2.099 ( 7.306 6.921 18.697) 21.233 2.334 ( -1.586 2.324 -1.036) 2.999 2.407 ( -3.889 2.456 3.028) 5.507 2.587 ( 13.418 1.221 -4.178) 14.107 2.762 ( 11.598 8.721 8.765) 16.952 2.988 ( -0.650 5.993 -2.874) 6.678 3.309 ( -1.859 -7.833 -11.272) 13.852 3.573 ( -10.330 -5.909 -0.927) 11.936 3.776 ( -8.269 -11.121 -4.526) 14.579 4.106 ( -12.902 -1.720 -6.086) 14.368 4.168 ( -3.499 -6.506 3.098) 8.011 4.593 ( 0.825 -1.588 -0.591) 1.885 4.718 ( 4.688 -0.462 -2.828) 5.494 4.765 ( -2.905 4.445 5.667) 7.766 5.010 ( -4.038 5.626 5.415) 8.791 5.049 ( -9.627 4.803 6.402) 12.519 5.413 ( 1.550 -2.806 5.552) 6.411 5.554 ( -0.512 -6.055 4.584) 7.612 5.812 ( 4.658 -2.258 -6.655) 8.431 5.873 ( -0.178 0.936 -4.056) 4.166 5.901 ( -0.881 -5.014 0.325) 5.101 6.099 ( -5.864 1.030 7.601) 9.655 6.251 ( 0.645 -4.517 -2.729) 5.317 6.532 ( 2.268 5.448 0.544) 5.926 6.656 ( 5.747 1.585 -0.744) 6.008 6.819 ( 0.819 -3.573 -2.534) 4.456 6.980 ( -1.053 -2.536 3.711) 4.616 7.051 ( 0.597 2.069 6.352) 6.707 7.352 ( 0.872 -0.790 -0.655) 1.346 7.450 ( 2.364 0.638 -0.555) 2.511 7.564 ( 3.731 6.070 -2.275) 7.479 7.731 ( 2.885 -4.269 -2.554) 5.750 8.052 ( -5.083 3.972 -2.463) 6.905 8.414 ( -1.240 -3.040 -17.040) 17.354 9.152 ( -0.619 1.642 6.643) 6.871 9.389 ( 2.020 1.942 1.817) 3.340 9.722 ( -3.478 0.748 4.354) 5.623 9.928 ( 4.078 -4.944 -1.539) 6.591 9.952 ( -1.597 -0.910 0.465) 1.896 10.020 ( -2.138 1.642 1.239) 2.967 11.244 ( 0.753 -0.575 -0.582) 1.112 11.381 ( -4.883 3.901 2.809) 6.852 11.648 ( 0.487 -3.762 -1.883) 4.235 11.676 ( 0.243 -2.280 -2.764) 3.592 11.805 ( -1.087 4.034 -1.720) 4.518 11.891 ( -5.216 4.259 -1.946) 7.010 11.984 ( 0.978 2.159 -1.791) 2.971 12.147 ( 3.945 -2.946 4.540) 6.697 12.205 ( 10.682 2.474 -1.233) 11.034 12.876 ( 0.138 -8.178 -10.933) 13.654 16.052 ( 0.533 0.655 1.339) 1.583 16.067 ( 0.944 1.080 1.110) 1.814 16.893 ( -0.166 -2.036 3.269) 3.855 17.124 ( 2.561 1.642 -0.625) 3.106 17.410 ( -13.646 8.055 -5.480) 16.767 17.848 ( 11.574 -3.876 -1.283) 12.273 18.542 ( -7.807 3.795 15.716) 17.954 19.739 ( 3.661 -5.453 -7.928) 10.295 ======================= Grid point 112 (44/170) ======================= q-point: ( 0.18 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.649 ( 4.021 16.098 14.252) 21.873 1.726 ( 16.917 13.831 6.736) 22.866 2.068 ( -12.660 1.778 3.153) 13.167 2.272 ( -2.487 3.469 3.717) 5.660 2.582 ( 10.977 -2.294 -1.328) 11.292 2.732 ( 9.772 0.982 -8.583) 13.043 2.882 ( 3.700 4.500 -9.034) 10.749 3.205 ( 3.662 -8.467 -3.152) 9.749 3.342 ( 15.338 0.832 19.685) 24.969 3.379 ( -9.260 1.575 -3.965) 10.195 3.595 ( -5.362 -2.208 5.449) 7.957 3.802 ( -9.438 5.379 -8.015) 13.500 4.147 ( -4.196 -8.028 6.137) 10.942 4.580 ( 1.656 -8.742 -8.238) 12.125 4.746 ( -5.209 0.363 3.391) 6.226 4.809 ( -0.224 -1.541 8.271) 8.416 4.935 ( -11.961 7.860 7.257) 16.047 5.002 ( 2.318 6.661 -4.317) 8.269 5.416 ( -2.171 -2.717 -2.011) 4.017 5.540 ( -13.255 -6.261 4.775) 15.418 5.733 ( -2.269 -2.172 5.132) 6.017 5.823 ( 4.589 -2.088 -8.336) 9.742 5.987 ( 1.112 3.084 5.535) 6.433 6.121 ( -2.706 0.240 1.869) 3.298 6.240 ( 3.787 3.814 2.775) 6.049 6.595 ( 4.210 -1.589 -3.452) 5.672 6.729 ( 4.854 1.992 -3.941) 6.562 6.744 ( 0.310 -0.856 -7.201) 7.259 7.041 ( 3.734 -4.957 0.889) 6.269 7.161 ( 2.428 1.856 6.609) 7.281 7.325 ( -2.778 -3.156 0.846) 4.289 7.480 ( 0.686 1.962 0.838) 2.241 7.589 ( 2.469 6.718 -5.090) 8.783 7.691 ( -2.896 0.081 -2.344) 3.727 7.988 ( -3.849 1.981 3.050) 5.295 8.201 ( -2.443 -7.516 -13.397) 15.554 9.216 ( -0.592 -0.499 6.001) 6.051 9.465 ( 2.686 3.577 1.329) 4.666 9.694 ( -6.144 0.433 4.741) 7.772 9.829 ( -4.097 -1.119 -3.020) 5.211 9.975 ( 2.525 0.923 -1.249) 2.964 10.128 ( 6.407 -8.406 5.152) 11.758 11.262 ( 2.695 0.248 -0.986) 2.881 11.346 ( -4.263 3.907 2.863) 6.452 11.600 ( -0.574 -2.609 -5.352) 5.981 11.671 ( 0.973 -3.493 -0.118) 3.628 11.735 ( -3.854 6.138 -1.980) 7.513 11.869 ( 2.057 4.638 2.264) 5.556 11.982 ( 1.931 -3.002 -3.042) 4.690 12.245 ( 2.667 1.404 4.363) 5.303 12.333 ( 5.983 5.398 -1.751) 8.246 12.723 ( -2.110 -6.329 -12.231) 13.932 16.079 ( 1.187 -0.089 0.872) 1.475 16.103 ( 1.595 0.824 1.195) 2.156 16.907 ( -0.981 -0.930 0.932) 1.642 17.127 ( -1.369 2.659 -6.225) 6.906 17.179 ( -8.276 7.086 2.441) 11.165 17.936 ( 1.204 2.405 -4.252) 5.031 18.699 ( 3.056 -1.517 19.426) 19.723 19.672 ( 0.643 -8.406 -8.855) 12.226 ======================= Grid point 113 (45/170) ======================= q-point: ( 0.27 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.795 ( 1.587 10.629 5.415) 12.034 1.833 ( -8.721 2.872 -0.241) 9.185 2.019 ( 1.776 9.332 3.618) 10.166 2.335 ( -0.148 3.908 5.678) 6.894 2.662 ( 5.535 3.325 -8.761) 10.883 2.693 ( 5.296 -2.324 -14.438) 15.553 2.942 ( 7.970 -1.965 3.734) 9.018 3.151 ( -10.112 0.292 0.985) 10.164 3.290 ( 8.082 -2.682 -5.838) 10.325 3.411 ( -1.397 -0.320 -1.231) 1.889 3.697 ( 5.503 7.416 -0.317) 9.240 4.032 ( 11.225 -1.432 20.068) 23.039 4.174 ( -2.018 -10.218 7.205) 12.665 4.458 ( -3.730 -9.632 -6.664) 12.292 4.668 ( -5.338 -1.416 2.310) 5.987 4.829 ( -5.058 5.451 2.242) 7.767 4.857 ( -7.082 -0.608 5.334) 8.886 5.015 ( 5.306 7.776 -4.517) 10.442 5.277 ( -5.236 -3.146 -5.591) 8.281 5.404 ( -10.355 1.061 6.565) 12.307 5.799 ( 4.706 -3.233 -7.984) 9.815 5.839 ( 3.007 -4.500 8.798) 10.329 6.043 ( -3.164 1.341 -1.222) 3.647 6.076 ( -0.866 6.671 6.075) 9.064 6.391 ( 4.309 2.791 5.351) 7.416 6.500 ( -1.209 -6.104 -11.785) 13.327 6.683 ( 1.201 -3.903 -3.418) 5.325 6.804 ( 8.225 6.436 -6.179) 12.135 7.077 ( -0.258 -7.136 -1.645) 7.328 7.254 ( 1.334 0.487 2.384) 2.775 7.328 ( -0.260 -6.401 4.238) 7.681 7.432 ( -3.706 0.202 -4.891) 6.140 7.551 ( -1.716 9.343 4.022) 10.316 7.680 ( 1.827 5.724 -0.091) 6.009 7.891 ( -10.354 -4.298 -0.396) 11.217 8.065 ( -0.559 -0.289 -5.221) 5.258 9.269 ( -0.260 -1.682 4.128) 4.465 9.444 ( -4.066 2.843 -1.794) 5.276 9.635 ( -5.558 -0.030 2.837) 6.240 9.759 ( -1.520 -0.706 -2.254) 2.809 10.091 ( 9.633 -1.372 3.239) 10.255 10.286 ( 6.068 -8.852 3.094) 11.169 11.287 ( -3.080 0.659 1.142) 3.351 11.312 ( 0.519 2.359 0.598) 2.488 11.534 ( 0.690 -2.188 -5.010) 5.510 11.613 ( -4.387 3.709 -1.154) 5.860 11.763 ( 4.611 -0.032 2.183) 5.101 11.924 ( 2.229 -0.697 -2.543) 3.452 12.003 ( 2.482 0.299 2.603) 3.609 12.336 ( 3.168 5.623 0.634) 6.485 12.368 ( 0.144 5.037 0.128) 5.041 12.545 ( -2.175 -2.592 -10.185) 10.732 16.111 ( 1.729 -0.659 0.195) 1.861 16.144 ( 1.886 0.024 0.698) 2.012 16.870 ( -1.782 0.830 -3.673) 4.166 16.994 ( -4.538 4.383 -1.171) 6.417 17.139 ( -4.038 7.859 2.745) 9.252 17.838 ( -6.151 6.657 -2.270) 9.343 19.025 ( 8.565 -8.008 15.641) 19.548 19.573 ( 0.254 -10.151 -8.806) 13.441 ======================= Grid point 114 (46/170) ======================= q-point: ( 0.36 0.11 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.696 ( -8.867 1.832 4.550) 10.133 1.881 ( 1.775 8.275 4.791) 9.725 2.009 ( -2.247 5.377 -1.077) 5.926 2.283 ( -4.636 2.082 -7.689) 9.217 2.603 ( 4.273 1.537 -3.641) 5.821 2.735 ( 4.585 1.262 -2.157) 5.222 3.056 ( -3.616 2.578 3.471) 5.636 3.141 ( 7.586 3.229 3.283) 8.874 3.334 ( 5.053 6.551 -4.785) 9.557 3.473 ( 5.057 -4.045 4.727) 8.017 3.850 ( 9.953 2.967 -1.263) 10.463 4.067 ( -9.366 -7.141 -3.961) 12.426 4.221 ( -3.358 -10.575 3.855) 11.746 4.427 ( 1.056 -10.016 1.627) 10.202 4.710 ( -5.623 -0.688 -9.752) 11.278 4.742 ( 6.101 0.959 4.057) 7.389 4.813 ( -2.359 2.492 7.640) 8.375 5.047 ( 3.896 6.596 -4.049) 8.665 5.189 ( -3.293 -2.794 1.994) 4.757 5.315 ( -8.432 5.257 5.491) 11.353 5.793 ( 5.119 -4.781 -9.184) 11.550 5.932 ( -3.265 -2.005 0.999) 3.960 5.987 ( 0.347 -1.555 0.846) 1.804 6.178 ( 2.567 6.528 8.470) 10.998 6.345 ( 1.051 -6.978 -4.328) 8.278 6.530 ( 2.995 1.554 1.004) 3.521 6.667 ( 0.480 -7.193 -0.372) 7.218 6.853 ( 3.794 4.526 -5.723) 8.224 6.982 ( -3.865 -5.854 -4.018) 8.084 7.224 ( -1.278 5.041 -3.574) 6.310 7.364 ( 0.792 -8.552 2.794) 9.032 7.424 ( 0.444 0.577 2.798) 2.892 7.561 ( -5.190 7.233 3.405) 9.532 7.664 ( -7.305 -7.746 0.381) 10.654 7.770 ( 3.260 8.682 -0.770) 9.306 8.009 ( -3.047 6.085 -0.026) 6.805 9.292 ( -0.412 -2.163 0.455) 2.249 9.356 ( -3.577 0.684 -0.346) 3.659 9.581 ( -3.589 -0.291 1.234) 3.806 9.715 ( -0.723 -0.273 -1.431) 1.627 10.292 ( 8.416 -5.468 0.947) 10.081 10.395 ( 4.091 -6.974 0.845) 8.129 11.219 ( -3.810 0.455 -1.078) 3.986 11.325 ( -0.486 1.436 0.392) 1.565 11.530 ( 2.021 0.626 -1.010) 2.344 11.538 ( -2.017 2.113 -1.177) 3.149 11.887 ( 4.860 -1.022 4.457) 6.672 11.909 ( 1.610 -3.499 -3.660) 5.313 12.091 ( 1.777 4.004 4.109) 6.007 12.286 ( -0.117 6.069 -6.387) 8.811 12.417 ( 0.409 3.115 1.880) 3.661 12.455 ( -0.675 4.855 -0.347) 4.913 16.138 ( 1.661 -1.095 -0.503) 2.052 16.177 ( 1.614 -0.868 -0.349) 1.866 16.803 ( -0.753 3.135 -2.210) 3.909 16.928 ( -2.893 8.963 -0.796) 9.452 17.112 ( -4.157 5.827 5.394) 8.962 17.721 ( -5.515 5.992 -0.168) 8.145 19.281 ( 4.423 -11.144 7.738) 14.270 19.489 ( 1.602 -10.981 -7.923) 13.635 ======================= Grid point 115 (47/170) ======================= q-point: ( 0.45 0.11 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.652 ( -5.624 0.973 8.322) 10.091 1.910 ( -2.629 4.045 -0.108) 4.826 2.027 ( 1.695 6.148 5.391) 8.351 2.149 ( 0.689 5.129 -2.724) 5.848 2.684 ( 5.026 -5.108 0.698) 7.200 2.794 ( 3.046 2.545 3.802) 5.496 3.041 ( -2.244 6.626 -0.257) 7.000 3.228 ( -1.365 5.650 1.986) 6.142 3.375 ( 5.979 9.636 -4.147) 12.075 3.560 ( -1.641 -5.049 -2.078) 5.701 3.880 ( 0.962 -4.024 -4.001) 5.756 3.979 ( 4.113 -1.236 -1.679) 4.612 4.153 ( -4.743 -8.985 -2.161) 10.387 4.461 ( -4.484 0.289 -16.011) 16.630 4.496 ( 0.617 -8.855 6.544) 11.027 4.837 ( 2.331 -3.114 -1.398) 4.133 4.870 ( -0.400 0.943 2.726) 2.912 5.097 ( 4.476 4.118 2.473) 6.566 5.181 ( -1.972 -0.889 3.238) 3.895 5.243 ( -6.635 5.144 3.583) 9.128 5.752 ( 2.762 -3.098 -6.492) 7.705 5.859 ( -2.881 -1.134 -6.765) 7.439 5.997 ( 4.260 -4.788 -0.475) 6.426 6.248 ( -6.070 3.709 0.276) 7.119 6.418 ( 2.969 -6.837 6.648) 9.988 6.520 ( 0.413 -0.283 -2.993) 3.034 6.722 ( 0.645 -9.422 2.920) 9.885 6.812 ( 3.674 -3.082 3.489) 5.930 7.012 ( 5.918 5.938 0.592) 8.405 7.183 ( -0.608 4.345 -1.429) 4.614 7.377 ( -4.996 -5.891 1.335) 7.839 7.415 ( -4.196 -8.561 -0.728) 9.562 7.447 ( 0.697 4.611 -5.563) 7.259 7.593 ( -3.868 1.428 0.993) 4.241 7.873 ( 4.743 7.940 3.578) 9.916 7.964 ( -2.982 9.949 2.019) 10.580 9.282 ( 0.317 -2.662 -0.934) 2.839 9.315 ( -1.778 -1.077 -0.026) 2.079 9.549 ( -1.649 -0.420 1.121) 2.038 9.713 ( 0.793 -0.444 1.054) 1.392 10.350 ( 2.273 -8.343 -5.271) 10.127 10.418 ( -1.011 -5.202 -3.679) 6.451 11.158 ( -0.791 1.677 -1.688) 2.507 11.317 ( -0.356 2.047 -0.137) 2.083 11.485 ( -1.034 4.009 -0.817) 4.220 11.592 ( 2.827 -1.472 1.499) 3.522 11.901 ( 0.589 -2.077 -1.320) 2.531 12.011 ( 2.140 -1.918 5.825) 6.496 12.126 ( -1.028 5.007 0.494) 5.135 12.266 ( 2.163 4.772 -0.266) 5.246 12.432 ( 2.537 4.700 0.648) 5.380 12.476 ( -1.967 7.001 4.383) 8.491 16.151 ( 0.805 -1.359 -1.063) 1.904 16.186 ( 0.599 -1.338 -1.509) 2.104 16.802 ( 1.134 4.920 0.880) 5.125 16.893 ( -0.044 10.898 0.224) 10.900 17.126 ( -3.990 4.139 8.278) 10.079 17.660 ( -1.853 4.039 0.733) 4.504 19.335 ( -3.288 -11.181 -0.561) 11.668 19.447 ( 4.262 -11.815 -7.316) 14.536 ======================= Grid point 116 (48/170) ======================= q-point: (-0.45 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.679 ( -2.630 1.067 7.803) 8.303 1.867 ( -1.694 3.234 1.385) 3.904 2.095 ( -2.719 3.268 6.770) 7.994 2.272 ( 5.870 8.798 7.457) 12.941 2.749 ( 4.492 -9.284 -2.227) 10.551 2.909 ( -4.429 8.510 1.445) 9.702 2.977 ( 2.408 0.323 4.678) 5.271 3.182 ( -3.161 4.003 -0.988) 5.195 3.382 ( -6.820 -1.307 -6.863) 9.764 3.455 ( 7.247 11.156 -2.729) 13.580 3.872 ( 0.115 -2.249 -7.298) 7.637 3.979 ( 1.330 -3.588 -13.087) 13.635 4.064 ( -5.513 -4.875 1.954) 7.614 4.249 ( 1.953 1.074 -8.019) 8.323 4.581 ( -0.158 -5.839 6.639) 8.843 4.738 ( -5.968 -3.987 -3.329) 7.912 4.921 ( -0.985 -2.852 1.722) 3.474 5.128 ( -2.913 1.117 -1.909) 3.658 5.199 ( -1.232 7.364 2.079) 7.750 5.247 ( 2.827 -1.623 6.569) 7.333 5.698 ( -0.657 -3.924 -8.687) 9.555 5.784 ( 3.756 -2.810 -4.317) 6.375 6.055 ( -7.708 5.131 -3.206) 9.798 6.110 ( 5.696 -4.031 3.147) 7.655 6.441 ( -2.966 -1.076 -1.877) 3.671 6.632 ( 4.411 -6.065 11.471) 13.705 6.746 ( 1.900 -11.288 -0.747) 11.471 7.002 ( 4.947 -3.918 7.677) 9.938 7.096 ( -1.880 3.419 2.556) 4.664 7.186 ( 2.950 2.361 -1.059) 3.924 7.263 ( 0.385 0.515 -3.184) 3.248 7.344 ( -3.098 -2.398 -4.023) 5.615 7.427 ( 2.003 2.466 -4.127) 5.208 7.547 ( 0.419 0.247 -1.394) 1.477 7.895 ( -4.505 9.011 2.887) 10.480 8.051 ( 5.977 6.329 4.880) 9.980 9.250 ( -2.668 -3.288 -1.539) 4.505 9.320 ( 2.837 -2.682 -0.615) 3.953 9.558 ( 0.012 -0.082 2.980) 2.981 9.756 ( 1.305 -1.478 2.292) 3.023 10.253 ( -5.014 -2.663 -8.988) 10.631 10.298 ( -2.732 -8.325 -6.715) 11.038 11.156 ( 1.585 3.874 -0.472) 4.212 11.314 ( 0.873 1.802 -1.151) 2.309 11.498 ( 2.559 3.325 0.933) 4.298 11.639 ( 0.841 -1.325 0.803) 1.762 11.887 ( -2.478 -1.121 1.091) 2.930 12.057 ( -0.703 4.436 -1.352) 4.691 12.112 ( -3.366 0.075 6.129) 6.993 12.306 ( 0.798 2.156 0.744) 2.416 12.485 ( -1.725 10.457 3.498) 11.161 12.542 ( 6.216 1.950 4.702) 8.034 16.139 ( -0.471 -1.305 -1.372) 1.951 16.163 ( -0.639 -1.112 -2.130) 2.486 16.856 ( 3.247 5.471 2.369) 6.789 16.924 ( 1.603 10.086 0.952) 10.257 17.166 ( -3.677 3.241 10.052) 11.183 17.689 ( 3.586 2.677 2.228) 4.999 19.158 ( -11.494 -9.958 -7.482) 16.948 19.471 ( 7.447 -12.105 -5.845) 15.367 ======================= Grid point 117 (49/170) ======================= q-point: (-0.36 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.724 ( -2.785 0.942 4.407) 5.297 1.878 ( -4.303 3.340 6.308) 8.334 2.086 ( -3.524 3.864 4.013) 6.592 2.293 ( -11.012 11.749 -3.172) 16.413 2.726 ( 0.196 -7.400 -7.050) 10.223 2.921 ( 4.584 -1.311 8.346) 9.612 3.040 ( -7.725 -0.876 -3.711) 8.615 3.179 ( 7.965 2.586 9.174) 12.421 3.344 ( 6.915 6.398 0.162) 9.422 3.554 ( -0.320 1.342 -8.320) 8.434 3.621 ( -7.251 8.798 -12.164) 16.672 3.763 ( -10.147 2.501 -4.580) 11.410 3.968 ( -1.038 -4.802 -1.963) 5.291 4.373 ( 10.264 -3.117 0.383) 10.733 4.577 ( -2.779 -3.856 -1.607) 5.017 4.679 ( 0.046 2.310 1.633) 2.830 4.882 ( -4.719 -6.905 2.988) 8.881 5.068 ( 1.266 -0.838 -3.669) 3.970 5.199 ( -0.973 4.741 0.233) 4.845 5.366 ( 3.968 -0.942 3.073) 5.107 5.588 ( -1.378 -4.687 -5.483) 7.344 5.813 ( 4.321 -5.496 -3.224) 7.699 6.001 ( 0.604 2.726 3.122) 4.188 6.194 ( -1.254 4.050 0.032) 4.239 6.373 ( -4.187 -4.483 3.757) 7.193 6.749 ( -0.117 -10.343 -2.376) 10.613 6.821 ( 2.548 -4.677 9.078) 10.525 7.015 ( -6.292 3.578 -1.828) 7.466 7.126 ( 0.042 -6.054 0.941) 6.126 7.142 ( 2.310 -1.448 -0.562) 2.784 7.209 ( -5.374 3.810 -5.009) 8.276 7.407 ( 1.539 4.228 -1.245) 4.668 7.441 ( 13.193 5.478 1.391) 14.353 7.604 ( 7.625 -3.284 -2.286) 8.611 7.852 ( -4.419 9.110 2.775) 10.498 8.205 ( 6.336 0.331 3.053) 7.041 9.176 ( -3.135 -3.542 -2.359) 5.285 9.367 ( 3.007 -4.055 -0.706) 5.097 9.612 ( 0.140 0.031 4.862) 4.864 9.789 ( 0.388 -3.192 0.731) 3.297 10.062 ( -4.726 0.495 -5.820) 7.513 10.169 ( -3.520 -6.498 -6.574) 9.892 11.192 ( 2.657 5.336 0.473) 5.980 11.314 ( 1.316 0.866 -2.442) 2.906 11.585 ( 4.947 2.127 2.463) 5.922 11.644 ( 0.451 -1.190 -1.151) 1.716 11.828 ( -5.617 0.376 0.904) 5.702 12.019 ( -3.482 5.157 1.421) 6.383 12.127 ( -1.712 -1.533 3.652) 4.315 12.282 ( -3.902 2.529 0.175) 4.653 12.501 ( -0.830 11.177 1.879) 11.364 12.723 ( 7.503 -1.553 5.215) 9.268 16.105 ( -1.497 -1.114 -1.522) 2.408 16.123 ( -1.208 -0.327 -1.748) 2.150 16.934 ( -0.052 7.015 -0.294) 7.021 16.955 ( 4.067 7.393 1.114) 8.511 17.252 ( -0.742 3.363 12.104) 12.585 17.829 ( 8.444 1.396 3.410) 9.213 18.805 ( -17.098 -8.194 -10.141) 21.502 19.551 ( 8.637 -12.405 -4.262) 15.705 ======================= Grid point 118 (50/170) ======================= q-point: (-0.27 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.532 ( -18.844 5.678 -3.826) 20.049 1.825 ( -22.774 11.084 -12.854) 28.403 1.942 ( 2.858 3.079 8.367) 9.363 2.234 ( 4.850 2.671 6.488) 8.530 2.596 ( -9.520 -4.556 -5.907) 12.094 2.910 ( 3.708 -4.055 -4.812) 7.304 2.935 ( -29.236 13.973 -12.812) 34.844 3.204 ( 2.633 0.268 10.865) 11.183 3.355 ( 1.758 8.041 2.881) 8.721 3.475 ( -7.185 0.046 -4.328) 8.388 3.589 ( 9.513 -1.891 7.392) 12.194 3.782 ( 11.258 4.726 1.593) 12.313 3.991 ( 5.147 -5.108 -1.648) 7.436 4.494 ( 6.283 -2.837 -3.808) 7.875 4.535 ( -0.129 -1.991 -0.547) 2.069 4.712 ( 0.822 8.782 2.262) 9.106 4.853 ( -2.755 -8.812 2.432) 9.548 5.110 ( 5.884 -4.512 -4.228) 8.535 5.181 ( 3.104 1.597 -1.466) 3.786 5.452 ( 3.318 -1.892 2.246) 4.431 5.575 ( 3.652 -1.338 1.145) 4.055 5.840 ( 2.816 -6.741 -4.315) 8.485 6.049 ( -4.191 0.961 2.967) 5.224 6.109 ( -4.000 4.794 2.839) 6.859 6.379 ( -3.458 -5.052 5.403) 8.165 6.673 ( -4.392 -5.398 -3.232) 7.673 6.883 ( -2.528 1.357 -6.959) 7.528 6.904 ( -2.177 0.715 3.673) 4.329 6.979 ( -8.784 -2.319 -6.755) 11.321 7.108 ( -2.578 0.866 -1.249) 2.993 7.263 ( 6.280 2.763 2.618) 7.344 7.450 ( 3.443 3.691 0.416) 5.064 7.666 ( 5.678 -0.459 2.814) 6.354 7.750 ( 13.361 0.735 1.854) 13.509 7.798 ( -3.648 9.300 -0.340) 9.995 8.328 ( 7.593 -7.359 -2.147) 10.790 9.100 ( -2.755 -2.846 -1.652) 4.291 9.386 ( -0.088 -3.110 -0.702) 3.189 9.639 ( -2.203 -3.565 3.708) 5.595 9.835 ( 4.039 -1.501 1.930) 4.721 9.967 ( -2.738 -1.900 -2.405) 4.110 10.053 ( -2.453 -1.385 -2.480) 3.753 11.246 ( 2.091 5.743 0.305) 6.119 11.301 ( 1.583 0.840 -2.728) 3.264 11.643 ( 1.485 -1.940 -1.299) 2.767 11.695 ( 3.459 -2.261 1.078) 4.270 11.755 ( -2.065 3.209 1.159) 3.988 11.963 ( -5.379 4.338 2.134) 7.232 12.135 ( -1.667 -1.876 1.357) 2.853 12.207 ( -4.136 4.523 -0.012) 6.129 12.477 ( -3.453 9.057 -0.414) 9.701 12.890 ( 6.560 -4.196 2.448) 8.163 16.061 ( -1.559 -0.545 -1.213) 2.049 16.086 ( -1.310 0.331 -0.866) 1.605 16.903 ( -2.010 5.334 -1.054) 5.797 17.013 ( 3.116 9.068 -2.220) 9.842 17.435 ( 3.650 6.084 14.750) 16.367 18.011 ( 9.948 -1.409 -2.249) 10.296 18.397 ( -19.203 -6.124 -3.418) 20.444 19.648 ( 7.803 -13.277 -3.648) 15.826 ======================= Grid point 119 (51/170) ======================= q-point: (-0.18 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.120 ( -22.463 13.083 -3.808) 26.272 1.248 ( -25.292 14.342 -12.447) 31.627 2.072 ( -22.404 13.174 7.298) 26.995 2.198 ( -9.683 14.401 3.985) 17.805 2.386 ( 5.208 1.524 1.882) 5.743 2.495 ( -4.592 -1.492 -8.567) 9.834 2.986 ( 2.771 -3.471 2.556) 5.124 3.085 ( -14.732 5.181 -1.919) 15.734 3.325 ( 1.037 5.911 -4.969) 7.791 3.594 ( 9.297 -8.139 5.288) 13.440 3.771 ( 5.536 -3.714 3.068) 7.338 4.026 ( 7.436 -6.923 2.053) 10.365 4.069 ( 5.974 1.872 4.530) 7.727 4.515 ( 3.176 -2.192 -2.317) 4.501 4.610 ( 6.154 3.857 2.905) 7.822 4.769 ( 2.046 9.334 4.640) 10.623 4.820 ( -1.664 -10.114 -2.029) 10.449 5.078 ( -3.925 -0.340 -0.183) 3.944 5.302 ( 11.596 -2.757 -6.429) 13.542 5.568 ( 5.364 -1.101 4.756) 7.253 5.735 ( 5.989 -1.514 9.211) 11.091 5.762 ( -0.298 2.892 -7.183) 7.750 5.988 ( -3.416 -5.111 -0.683) 6.185 6.115 ( -3.769 -3.291 5.845) 7.694 6.337 ( -5.537 -4.870 -0.166) 7.376 6.583 ( -2.481 0.975 -5.135) 5.786 6.640 ( -9.247 -4.104 -12.777) 16.297 6.807 ( -5.137 2.731 -2.093) 6.183 6.882 ( -3.099 6.588 1.637) 7.462 7.083 ( -1.337 0.248 2.685) 3.010 7.378 ( 3.368 2.294 1.251) 4.263 7.479 ( -0.337 3.401 -1.907) 3.913 7.676 ( -3.957 4.558 1.398) 6.196 7.774 ( 0.772 1.824 -0.424) 2.025 8.044 ( 12.809 6.065 5.921) 15.359 8.418 ( 11.332 -15.384 -8.591) 20.949 9.055 ( -1.483 -0.503 0.489) 1.640 9.368 ( -1.841 -0.481 1.930) 2.710 9.643 ( -2.585 -5.540 2.629) 6.655 9.880 ( 0.443 -3.018 -0.986) 3.206 9.956 ( 1.782 0.466 1.704) 2.509 10.039 ( 0.556 0.623 2.556) 2.689 11.232 ( 0.569 1.651 -4.200) 4.548 11.336 ( 1.729 3.736 2.290) 4.711 11.656 ( 0.214 -3.372 -0.116) 3.381 11.703 ( 2.269 -4.263 -1.475) 5.050 11.817 ( 3.387 4.156 1.179) 5.490 11.906 ( -2.637 2.923 0.546) 3.974 12.084 ( -3.071 2.380 -1.716) 4.248 12.153 ( -3.407 0.152 -0.788) 3.501 12.368 ( -7.288 6.044 -2.613) 9.822 12.991 ( 4.793 -6.359 -1.664) 8.135 16.030 ( -0.973 0.158 -0.426) 1.074 16.060 ( -1.124 0.799 -0.012) 1.379 16.848 ( -2.436 5.904 -1.801) 6.636 17.024 ( 2.587 9.085 -3.205) 9.975 17.701 ( 6.713 10.713 14.596) 19.310 17.920 ( -6.144 -3.460 -12.943) 14.739 18.287 ( -2.476 -6.067 11.683) 13.395 19.708 ( 4.473 -13.516 -4.791) 15.021 ======================= Grid point 120 (52/170) ======================= q-point: (-0.09 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.779 ( -13.100 23.329 7.199) 27.707 0.844 ( -17.370 20.555 11.111) 29.114 1.590 ( -31.477 40.179 17.408) 53.928 2.364 ( 2.324 -3.901 4.257) 6.224 2.402 ( 6.983 2.120 -4.936) 8.810 2.468 ( 5.185 2.253 -4.888) 7.473 2.793 ( -13.288 4.526 -4.709) 14.806 3.082 ( -3.069 8.571 15.226) 17.740 3.369 ( 11.306 -14.035 -4.802) 18.652 3.718 ( 5.000 -6.218 -4.591) 9.206 3.876 ( 3.302 -6.744 2.267) 7.844 4.092 ( -1.607 -11.214 7.640) 13.664 4.239 ( 3.362 1.139 4.095) 5.419 4.580 ( 3.923 -1.657 2.034) 4.720 4.753 ( -0.076 5.057 1.332) 5.230 4.792 ( 2.515 -3.849 4.267) 6.272 4.878 ( 4.770 3.646 4.846) 7.716 5.016 ( -2.134 2.658 2.491) 4.222 5.320 ( -6.822 -5.647 -3.772) 9.625 5.606 ( -2.369 4.144 -2.836) 5.552 5.746 ( 9.682 2.420 -6.648) 11.992 5.854 ( -5.087 -0.072 -5.221) 7.290 6.030 ( 5.886 -4.800 10.240) 12.749 6.133 ( 2.937 -0.488 1.720) 3.438 6.225 ( -6.309 -9.265 -2.997) 11.603 6.282 ( -5.244 -6.348 -4.085) 9.191 6.590 ( -0.841 7.302 0.544) 7.370 6.723 ( -1.199 -1.337 -0.805) 1.968 6.883 ( 0.392 8.706 2.641) 9.107 7.111 ( -1.852 0.905 5.198) 5.592 7.335 ( -5.011 1.693 -1.131) 5.409 7.475 ( 1.570 3.850 -0.895) 4.253 7.651 ( -4.343 -6.117 2.146) 7.803 7.719 ( -2.925 4.192 -4.396) 6.742 8.218 ( 2.006 1.729 0.307) 2.667 8.553 ( 17.168 -6.665 -11.007) 21.455 9.070 ( 0.870 2.819 2.199) 3.680 9.382 ( -1.772 1.849 4.709) 5.361 9.630 ( 0.358 -0.145 1.416) 1.467 9.892 ( -2.091 -0.840 0.893) 2.424 9.983 ( 3.457 -2.167 -1.231) 4.261 10.084 ( -1.143 2.835 1.706) 3.501 11.210 ( 1.332 -1.060 -1.449) 2.236 11.445 ( 8.056 0.051 6.720) 10.490 11.641 ( -1.971 -4.559 0.037) 4.967 11.731 ( 2.319 -4.252 -2.437) 5.422 11.868 ( 1.464 3.215 -2.032) 4.075 11.894 ( -0.358 2.435 -2.299) 3.367 11.938 ( -6.836 -4.437 -7.049) 10.775 12.077 ( -3.175 6.831 1.531) 7.687 12.204 ( -8.113 3.664 -1.460) 9.021 13.015 ( 3.245 -8.088 -5.723) 10.426 16.020 ( -0.249 0.772 0.453) 0.929 16.048 ( -0.790 0.988 0.601) 1.401 16.798 ( -0.754 5.886 -0.500) 5.955 17.041 ( 2.992 6.974 -1.666) 7.770 17.690 ( -3.140 -3.859 -5.726) 7.585 17.986 ( 4.902 8.512 2.520) 10.141 18.379 ( -2.684 -7.551 12.695) 15.013 19.682 ( 0.869 -5.441 -4.850) 7.341 ======================= Grid point 121 (53/170) ======================= q-point: ( 0.00 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.393 ( 4.071 24.338 11.342) 27.158 1.424 ( 6.496 24.356 14.566) 29.113 2.235 ( -1.340 14.333 5.107) 15.275 2.430 ( 1.690 3.120 -5.487) 6.535 2.468 ( 0.931 2.691 0.114) 2.850 2.606 ( 0.368 12.608 -1.196) 12.670 2.780 ( -0.796 16.361 8.114) 18.279 3.076 ( 1.651 -16.218 -0.306) 16.305 3.338 ( -8.429 12.781 2.984) 15.598 3.528 ( -0.323 -12.585 -1.594) 12.690 3.647 ( -1.196 -12.978 -5.477) 14.137 3.887 ( 1.389 -12.677 2.549) 13.005 4.297 ( -5.187 2.738 4.218) 7.224 4.533 ( 0.713 -9.503 2.372) 9.821 4.730 ( -0.938 4.236 -7.707) 8.844 4.857 ( -3.242 1.381 6.122) 7.064 4.989 ( 0.282 -0.829 0.137) 0.887 5.136 ( 3.195 -1.085 9.644) 10.217 5.358 ( -1.434 13.686 3.825) 14.283 5.581 ( -2.735 0.206 -3.512) 4.457 5.751 ( 5.207 -2.515 -6.671) 8.828 5.857 ( 0.264 -1.733 -6.071) 6.319 5.929 ( -5.845 -1.739 1.233) 6.222 6.116 ( 7.703 0.601 0.765) 7.764 6.137 ( -4.969 1.486 6.284) 8.148 6.409 ( 11.990 -0.794 11.665) 16.747 6.587 ( -2.901 -0.930 -3.184) 4.407 6.731 ( 4.087 -1.644 1.128) 4.547 7.034 ( 0.913 2.914 -0.118) 3.056 7.084 ( -10.828 1.464 3.474) 11.466 7.324 ( -2.482 -0.911 -1.070) 2.852 7.374 ( 4.178 -3.026 0.614) 5.195 7.638 ( 2.093 5.282 -2.215) 6.098 7.805 ( 0.289 7.005 -5.875) 9.147 8.140 ( -0.490 -4.100 -5.062) 6.532 8.443 ( 1.018 -14.331 -6.727) 15.864 9.194 ( 1.214 4.922 1.276) 5.228 9.387 ( -4.252 -0.756 3.915) 5.829 9.746 ( 2.154 2.018 0.302) 2.967 9.798 ( -2.034 -1.558 -2.691) 3.716 9.984 ( -0.053 -0.374 1.189) 1.247 10.140 ( -4.864 3.355 6.362) 8.683 11.224 ( 2.719 0.588 -1.455) 3.139 11.481 ( -5.462 -1.958 0.498) 5.824 11.561 ( 2.634 -5.302 -0.183) 5.923 11.663 ( 4.214 -0.609 -1.803) 4.624 11.815 ( 6.293 -2.472 1.387) 6.902 11.851 ( 1.500 0.103 -3.571) 3.875 12.039 ( -0.812 -1.395 1.786) 2.407 12.123 ( -1.091 7.177 -0.769) 7.300 12.216 ( -1.099 7.664 -2.452) 8.121 12.757 ( 0.790 -11.923 -6.796) 13.747 16.059 ( 0.290 1.754 1.185) 2.137 16.074 ( -0.152 1.523 0.938) 1.795 16.901 ( 0.986 5.612 -2.800) 6.348 17.113 ( 1.114 1.161 -0.826) 1.809 17.571 ( 4.221 -6.188 -0.509) 7.508 17.812 ( -8.260 -3.071 -14.634) 17.083 18.576 ( -2.033 8.474 17.869) 19.881 19.667 ( 1.549 -4.255 0.486) 4.554 ======================= Grid point 122 (54/170) ======================= q-point: ( 0.09 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.674 ( 11.601 20.517 12.379) 26.623 1.771 ( 10.470 18.270 15.803) 26.328 2.193 ( -3.167 2.640 -4.195) 5.881 2.422 ( -4.299 4.608 2.073) 6.634 2.469 ( 2.401 2.881 1.552) 4.059 2.662 ( 8.989 3.613 -4.704) 10.770 2.969 ( 0.438 2.065 10.430) 10.642 3.122 ( 1.701 5.140 10.886) 12.158 3.159 ( -1.143 7.285 -13.656) 15.519 3.469 ( -4.000 -8.161 0.819) 9.125 3.543 ( -1.669 -8.389 -7.312) 11.253 3.937 ( 0.745 -7.653 -0.087) 7.690 4.197 ( -10.124 4.464 2.372) 11.316 4.496 ( -1.734 -6.295 -4.333) 7.837 4.691 ( -2.366 -1.852 6.529) 7.187 4.865 ( -5.538 4.755 4.075) 8.360 5.016 ( 3.107 -0.401 0.197) 3.139 5.216 ( -8.625 -0.338 6.098) 10.568 5.399 ( 1.158 7.395 3.403) 8.223 5.466 ( -4.298 -3.846 0.452) 5.785 5.760 ( -2.595 -2.978 -2.493) 4.671 5.834 ( -0.884 -0.035 -2.314) 2.477 5.905 ( 8.662 1.014 -1.354) 8.825 6.126 ( -3.916 0.387 5.693) 6.921 6.208 ( 1.878 3.207 1.563) 4.031 6.558 ( 0.962 -1.622 -0.113) 1.889 6.692 ( 9.059 0.480 3.431) 9.699 6.771 ( 0.926 -1.852 -3.314) 3.908 6.966 ( -4.303 0.684 2.429) 4.988 7.078 ( 1.730 -0.153 3.457) 3.869 7.293 ( -0.123 -3.267 -1.728) 3.698 7.462 ( 4.051 0.437 0.319) 4.087 7.665 ( 3.690 4.703 -1.524) 6.169 7.759 ( 2.690 4.732 -6.565) 8.529 8.063 ( -1.391 -2.680 -3.949) 4.971 8.262 ( -8.510 -12.088 -10.357) 18.050 9.209 ( -3.085 3.532 4.703) 6.642 9.395 ( 1.256 -1.721 3.609) 4.191 9.737 ( -2.071 0.647 1.456) 2.613 9.823 ( 2.754 -3.620 0.245) 4.555 9.959 ( -3.746 1.650 2.047) 4.576 10.084 ( -7.365 3.718 3.445) 8.941 11.250 ( 2.620 0.939 -2.109) 3.492 11.429 ( -3.006 1.091 2.521) 4.072 11.568 ( 1.864 -3.929 -2.609) 5.071 11.638 ( -2.120 -1.681 -2.165) 3.465 11.869 ( 5.336 2.262 -2.860) 6.463 11.955 ( -2.225 1.145 -2.338) 3.425 11.978 ( -1.070 -2.629 -0.186) 2.845 12.154 ( 4.767 4.518 3.589) 7.485 12.291 ( 11.271 5.533 -2.668) 12.836 12.681 ( 1.073 -10.327 -8.955) 13.711 16.073 ( -0.292 1.374 1.259) 1.887 16.093 ( 0.686 1.407 1.212) 1.980 16.907 ( 1.609 2.866 -0.791) 3.381 17.155 ( 4.837 1.275 -1.271) 5.161 17.475 ( -9.377 -1.541 -10.793) 14.380 17.744 ( 12.790 -6.377 -0.925) 14.321 18.678 ( -9.580 9.886 17.605) 22.348 19.625 ( -4.550 -5.792 -2.528) 7.787 ======================= Grid point 123 (55/170) ======================= q-point: ( 0.18 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.975 ( 3.726 12.821 8.644) 15.905 2.010 ( 3.224 10.709 -1.627) 11.301 2.149 ( -0.536 9.559 8.400) 12.736 2.385 ( 0.938 7.373 3.161) 8.076 2.581 ( 6.570 3.253 1.152) 7.421 2.741 ( 6.765 -0.019 -4.732) 8.256 2.916 ( -4.049 -5.491 -4.775) 8.327 2.981 ( 0.192 -8.210 -8.377) 11.731 3.303 ( 0.175 -6.258 0.454) 6.277 3.441 ( 0.790 3.214 -6.844) 7.602 3.621 ( 7.920 6.228 18.157) 20.765 3.922 ( 2.463 3.614 -3.364) 5.517 4.058 ( -10.007 2.227 4.701) 11.278 4.423 ( -1.303 -5.068 -5.079) 7.292 4.730 ( -6.829 -3.713 8.262) 11.344 4.786 ( -5.168 1.773 5.092) 7.469 5.044 ( -5.911 2.991 0.916) 6.688 5.108 ( 1.237 1.318 -3.208) 3.682 5.362 ( -4.502 -2.181 -3.189) 5.932 5.472 ( -5.480 -0.563 6.809) 8.758 5.648 ( -5.880 -3.543 4.389) 8.148 5.819 ( 2.353 -0.382 -5.539) 6.030 6.067 ( 4.797 5.013 7.007) 9.861 6.116 ( -1.869 -0.253 -0.063) 1.887 6.289 ( 4.176 2.445 5.153) 7.069 6.559 ( -0.102 -2.348 -3.864) 4.523 6.668 ( -3.258 -2.813 -7.423) 8.580 6.827 ( 6.115 1.510 -0.929) 6.367 6.963 ( 0.261 -3.149 -0.141) 3.163 7.154 ( -0.601 -5.541 3.770) 6.729 7.276 ( 2.048 3.445 -0.296) 4.019 7.511 ( 0.917 1.937 -0.092) 2.145 7.707 ( -0.212 0.024 -1.428) 1.444 7.724 ( 3.922 6.254 -4.527) 8.660 7.993 ( -9.044 -6.176 -4.590) 11.875 8.044 ( 2.927 -3.281 -4.326) 6.168 9.216 ( -2.857 0.415 5.496) 6.208 9.484 ( 1.857 -2.781 3.628) 4.934 9.708 ( -5.505 0.983 3.805) 6.764 9.788 ( -3.745 -2.877 -2.436) 5.314 9.972 ( 1.154 -0.324 0.612) 1.346 10.044 ( -0.339 0.825 5.368) 5.442 11.273 ( 2.610 0.770 -1.398) 3.059 11.399 ( -3.779 1.097 1.459) 4.197 11.544 ( 0.141 -2.489 -5.202) 5.769 11.624 ( 2.669 -0.954 0.260) 2.846 11.841 ( -4.162 2.718 -2.657) 5.636 11.929 ( 1.116 -1.842 -4.621) 5.098 11.968 ( 4.895 5.696 0.659) 7.539 12.294 ( 4.442 3.010 4.978) 7.319 12.442 ( 9.108 4.578 -4.001) 10.951 12.588 ( 1.418 -5.400 -9.412) 10.944 16.083 ( 0.162 0.529 0.854) 1.017 16.119 ( 0.726 0.753 1.158) 1.561 16.924 ( 1.658 2.345 -1.488) 3.234 17.162 ( -0.862 0.213 -8.921) 8.965 17.296 ( -1.685 4.555 2.082) 5.284 17.955 ( 11.150 -2.189 -1.828) 11.509 18.707 ( -9.710 3.533 17.960) 20.720 19.484 ( -6.240 -9.428 -4.834) 12.296 ======================= Grid point 124 (56/170) ======================= q-point: ( 0.27 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.902 ( -9.731 4.200 -0.029) 10.599 2.035 ( -1.232 10.394 5.041) 11.617 2.241 ( -1.744 12.289 0.222) 12.415 2.402 ( 1.120 2.068 -5.873) 6.326 2.648 ( 3.786 1.372 -9.522) 10.338 2.824 ( 5.534 10.722 -0.712) 12.087 2.912 ( 10.608 -0.287 5.522) 11.963 3.011 ( -0.526 -11.730 8.151) 14.294 3.253 ( 1.052 -3.751 -5.005) 6.343 3.455 ( 8.563 4.749 -6.571) 11.792 3.792 ( -0.133 -1.232 3.377) 3.597 3.993 ( -2.782 -7.151 2.164) 7.972 4.048 ( 2.859 4.351 8.479) 9.950 4.326 ( -3.043 -1.349 -3.638) 4.931 4.686 ( -4.224 2.641 7.288) 8.828 4.797 ( -6.587 -3.620 3.494) 8.289 4.922 ( -5.377 3.003 1.903) 6.446 5.132 ( 5.715 3.429 -6.155) 9.072 5.211 ( -5.185 -3.075 -5.025) 7.848 5.435 ( -8.391 1.194 8.326) 11.881 5.691 ( 0.718 -5.979 6.338) 8.743 5.795 ( 2.491 -1.149 -3.705) 4.609 6.055 ( -4.822 -0.070 -0.351) 4.835 6.208 ( 1.613 6.800 7.969) 10.599 6.382 ( -1.834 -5.174 -12.122) 13.307 6.440 ( 0.784 1.294 1.939) 2.460 6.578 ( -0.134 -6.168 -2.894) 6.815 6.881 ( -1.094 -5.915 -4.369) 7.435 6.934 ( 1.851 -3.554 -0.474) 4.035 7.189 ( 1.409 -0.077 4.299) 4.525 7.337 ( 2.354 4.286 -1.192) 5.033 7.469 ( -3.189 1.653 -0.961) 3.719 7.663 ( -4.973 -5.016 -1.043) 7.140 7.720 ( -0.295 5.857 -0.691) 5.905 7.883 ( 2.754 3.915 -2.344) 5.330 8.079 ( 2.448 1.265 0.032) 2.756 9.237 ( -1.752 -1.619 4.141) 4.779 9.461 ( -6.348 -2.047 -0.365) 6.680 9.635 ( -4.828 0.117 0.888) 4.910 9.745 ( -2.303 -0.667 1.212) 2.687 10.020 ( 5.506 -4.753 0.718) 7.309 10.160 ( 4.286 -3.162 5.187) 7.435 11.285 ( -0.849 -0.087 -1.383) 1.625 11.354 ( -1.722 1.048 0.970) 2.237 11.492 ( 1.564 -1.421 -5.027) 5.453 11.663 ( -0.475 1.254 -0.262) 1.366 11.791 ( 1.592 1.515 0.513) 2.256 11.889 ( 1.579 -0.607 -4.395) 4.709 12.085 ( 5.714 5.876 2.209) 8.489 12.387 ( -0.243 -1.604 -0.953) 1.881 12.459 ( 4.282 4.902 -3.485) 7.382 12.580 ( 4.841 6.612 -3.275) 8.825 16.098 ( 0.744 -0.525 0.252) 0.944 16.142 ( 0.675 -0.324 0.592) 0.954 16.909 ( 1.000 2.954 -4.785) 5.712 17.079 ( 0.125 3.714 -0.930) 3.831 17.317 ( -1.515 9.086 2.180) 9.466 18.008 ( -2.583 8.896 -1.313) 9.356 18.816 ( 0.470 -11.868 13.415) 17.917 19.325 ( -4.854 -13.528 -5.595) 15.423 ======================= Grid point 125 (57/170) ======================= q-point: ( 0.36 0.22 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.754 ( -8.853 4.073 3.066) 10.216 2.059 ( -2.563 6.426 1.374) 7.054 2.173 ( -1.191 12.371 0.511) 12.439 2.339 ( -2.775 1.312 -2.755) 4.125 2.574 ( 3.720 1.643 -9.354) 10.200 2.885 ( -2.516 9.244 3.760) 10.291 3.108 ( 2.452 2.834 5.146) 6.366 3.164 ( 11.281 -4.251 1.703) 12.175 3.314 ( 10.381 -1.310 -2.848) 10.844 3.528 ( 7.012 4.317 -3.534) 8.961 3.856 ( 1.430 -5.141 3.511) 6.387 3.921 ( -6.574 -5.975 -0.424) 8.893 4.095 ( -1.189 -0.117 0.745) 1.408 4.279 ( -1.115 -2.782 1.390) 3.304 4.632 ( -5.833 -4.037 -4.174) 8.230 4.769 ( -0.064 1.235 1.842) 2.219 4.890 ( -3.043 2.025 4.764) 6.005 5.109 ( -2.706 -1.348 -1.544) 3.395 5.167 ( 4.228 2.343 -2.341) 5.371 5.386 ( -7.807 1.017 6.186) 10.013 5.717 ( 2.423 -3.115 -5.261) 6.577 5.851 ( 1.132 -5.374 2.392) 5.991 5.973 ( -4.018 0.428 0.465) 4.068 6.174 ( -2.509 -6.566 -8.165) 10.774 6.291 ( 1.207 0.417 0.894) 1.559 6.497 ( 1.736 -4.284 5.860) 7.464 6.592 ( 2.061 -2.517 -0.476) 3.288 6.732 ( -7.720 -9.169 -4.935) 12.962 7.005 ( 5.153 0.760 0.052) 5.209 7.254 ( -4.595 -5.667 -5.008) 8.849 7.280 ( 1.628 2.295 4.701) 5.478 7.439 ( -4.204 3.096 1.164) 5.349 7.559 ( -0.877 3.111 -2.473) 4.070 7.742 ( 0.320 7.066 1.075) 7.154 7.938 ( 4.080 7.287 0.261) 8.356 8.115 ( 0.672 4.617 1.538) 4.912 9.239 ( -1.330 -3.264 0.338) 3.541 9.343 ( -5.775 -2.279 -0.165) 6.211 9.576 ( -2.309 0.019 -0.992) 2.514 9.712 ( -2.093 0.018 0.678) 2.200 10.130 ( 4.666 -8.392 0.675) 9.626 10.275 ( 3.513 -6.090 1.985) 7.305 11.224 ( -1.435 0.605 -3.052) 3.426 11.358 ( -1.325 1.357 2.439) 3.089 11.493 ( 2.984 -1.702 -1.986) 3.968 11.620 ( -1.793 3.091 -1.145) 3.752 11.873 ( 3.704 -0.376 1.103) 3.883 11.893 ( 1.844 1.502 1.919) 3.056 12.192 ( 4.001 5.691 1.111) 7.045 12.314 ( 0.197 -0.570 -5.804) 5.835 12.543 ( 2.761 8.066 3.057) 9.057 12.615 ( 2.282 9.623 -0.630) 9.910 16.112 ( 0.956 -1.418 -0.395) 1.755 16.154 ( 0.494 -1.469 -0.308) 1.580 16.891 ( 2.343 5.517 -2.151) 6.368 17.110 ( 2.174 8.248 1.054) 8.594 17.283 ( -4.610 10.803 1.829) 11.887 17.895 ( -8.511 11.174 0.629) 14.061 18.970 ( 3.865 -19.680 4.345) 20.522 19.206 ( -2.431 -16.429 -4.203) 17.131 ======================= Grid point 126 (58/170) ======================= q-point: ( 0.45 0.22 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.697 ( -4.789 3.727 6.806) 9.118 2.003 ( -2.168 5.177 -1.524) 5.816 2.207 ( -1.686 9.619 3.301) 10.308 2.302 ( 1.309 9.821 5.702) 11.432 2.574 ( 5.512 -2.305 -6.426) 8.775 2.887 ( -2.165 5.332 6.160) 8.430 3.184 ( 2.733 5.639 -1.510) 6.446 3.297 ( 4.332 -5.877 -2.009) 7.572 3.402 ( 0.279 2.291 -2.499) 3.402 3.578 ( 3.279 3.552 -4.763) 6.786 3.850 ( 1.949 -1.273 -1.373) 2.703 3.866 ( -0.399 -7.258 -0.307) 7.275 4.089 ( -2.330 3.754 2.828) 5.246 4.305 ( -1.758 -7.694 4.371) 9.022 4.476 ( -1.658 0.788 -9.459) 9.635 4.750 ( -1.748 -5.324 -1.312) 5.755 4.924 ( -1.583 2.064 4.020) 4.788 5.061 ( -0.658 -4.156 1.189) 4.372 5.203 ( 0.252 1.001 -0.408) 1.110 5.325 ( -4.128 2.020 2.143) 5.071 5.698 ( 3.829 -2.037 -6.196) 7.563 5.814 ( -5.537 -3.430 -6.576) 9.256 5.890 ( 2.089 -5.532 -2.141) 6.289 6.221 ( 3.796 -6.346 7.521) 10.548 6.314 ( 1.872 -4.588 1.355) 5.137 6.494 ( -8.181 -2.950 -5.351) 10.211 6.597 ( 0.693 -4.078 -2.707) 4.944 6.680 ( 4.512 -5.831 8.321) 11.118 7.101 ( -0.862 -4.710 2.448) 5.377 7.128 ( 1.440 -5.009 -3.071) 6.050 7.343 ( 1.626 4.210 -2.079) 4.969 7.357 ( -5.396 4.589 3.981) 8.126 7.545 ( 1.740 7.308 -3.873) 8.452 7.726 ( -1.555 7.640 -1.763) 7.993 8.017 ( 1.954 6.322 3.461) 7.468 8.136 ( -0.278 7.062 1.845) 7.304 9.212 ( -0.374 -4.151 -1.873) 4.569 9.269 ( -2.461 -3.855 -1.055) 4.693 9.537 ( -0.617 -0.518 -1.120) 1.380 9.705 ( -0.604 -0.452 1.705) 1.865 10.170 ( 0.922 -8.174 -1.618) 8.383 10.292 ( -0.510 -7.344 -3.755) 8.264 11.198 ( 1.032 2.431 -0.792) 2.758 11.363 ( -1.395 2.099 2.469) 3.528 11.514 ( 1.737 -0.957 -1.415) 2.436 11.615 ( 0.662 3.324 1.979) 3.925 11.901 ( 0.268 1.527 0.372) 1.594 11.992 ( 1.157 -0.051 7.103) 7.197 12.221 ( 1.582 4.228 -3.506) 5.716 12.303 ( 1.772 1.113 -0.123) 2.096 12.592 ( 0.373 10.148 1.966) 10.344 12.668 ( 1.529 10.925 3.743) 11.649 16.118 ( 0.526 -1.839 -0.876) 2.104 16.150 ( 0.171 -2.135 -1.222) 2.466 16.928 ( 2.887 7.483 0.058) 8.021 17.149 ( 1.804 13.231 -0.316) 13.357 17.245 ( -4.042 7.986 5.306) 10.405 17.779 ( -4.851 7.773 0.379) 9.170 19.027 ( -0.077 -19.301 -1.127) 19.334 19.134 ( 0.353 -18.622 -4.777) 19.228 ======================= Grid point 127 (59/170) ======================= q-point: (-0.45 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.733 ( -1.136 4.215 7.188) 8.410 1.964 ( -1.627 6.122 0.961) 6.407 2.230 ( -2.418 9.142 6.259) 11.341 2.465 ( 7.000 10.442 3.064) 12.940 2.594 ( 3.907 -4.700 0.111) 6.113 2.971 ( 0.646 -0.215 6.503) 6.538 3.084 ( -9.172 6.579 -4.230) 12.054 3.261 ( -7.625 1.394 -4.745) 9.088 3.319 ( 1.571 -3.413 -1.823) 4.176 3.581 ( 8.347 0.799 -9.232) 12.471 3.852 ( 0.746 -6.321 -2.871) 6.982 3.929 ( 3.142 3.392 -0.531) 4.654 4.058 ( -7.546 7.568 4.954) 11.780 4.244 ( -1.093 -1.892 -3.462) 4.094 4.465 ( 3.901 -3.419 1.478) 5.394 4.643 ( -6.201 -5.517 -3.252) 8.914 4.926 ( -0.268 2.174 -1.362) 2.579 5.121 ( -1.034 -3.849 1.087) 4.131 5.181 ( 0.784 -2.445 4.918) 5.548 5.299 ( -0.719 2.042 -1.371) 2.563 5.604 ( -4.324 -5.940 -10.488) 12.806 5.705 ( 4.747 -3.915 -6.886) 9.235 5.991 ( 4.928 -7.463 6.281) 10.929 6.190 ( -6.279 7.114 -4.228) 10.388 6.417 ( 2.625 -3.602 0.130) 4.459 6.464 ( 4.980 -9.727 5.549) 12.256 6.576 ( 0.497 -4.508 2.047) 4.976 6.853 ( 5.121 -8.075 5.755) 11.160 7.010 ( -3.136 -11.533 -2.241) 12.159 7.195 ( -1.976 4.687 -0.487) 5.110 7.334 ( 4.728 1.363 1.494) 5.143 7.366 ( -0.844 4.092 1.175) 4.340 7.530 ( 3.659 8.847 -4.878) 10.745 7.666 ( -1.533 7.592 -3.116) 8.349 8.045 ( -3.190 6.296 2.819) 7.600 8.171 ( 0.897 5.124 3.368) 6.198 9.166 ( -2.196 -4.698 -2.567) 5.787 9.248 ( 2.934 -4.880 -3.278) 6.570 9.538 ( 0.881 -1.590 1.200) 2.179 9.714 ( -0.333 -2.710 0.431) 2.764 10.134 ( -2.079 -6.395 -2.226) 7.083 10.195 ( -3.211 -3.503 -5.891) 7.568 11.224 ( 2.027 3.028 0.391) 3.665 11.366 ( -1.229 2.888 1.688) 3.564 11.546 ( 3.207 1.212 0.219) 3.436 11.652 ( -0.132 2.577 2.193) 3.386 11.892 ( -2.576 1.321 1.527) 3.273 12.079 ( -1.308 0.451 7.405) 7.533 12.189 ( -0.715 4.082 -3.024) 5.131 12.328 ( 1.157 0.634 -0.247) 1.343 12.633 ( -0.115 8.529 4.914) 9.844 12.732 ( 0.506 12.153 3.901) 12.774 16.107 ( -0.377 -1.781 -1.167) 2.162 16.133 ( -0.102 -1.867 -1.736) 2.551 16.990 ( 3.823 7.339 1.959) 8.504 17.159 ( -1.155 12.083 -0.432) 12.146 17.262 ( -2.185 6.487 6.847) 9.682 17.773 ( 4.278 5.642 -0.262) 7.085 18.890 ( -10.546 -16.225 -5.448) 20.103 19.151 ( 6.949 -19.007 -4.249) 20.679 ======================= Grid point 128 (60/170) ======================= q-point: (-0.36 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.809 ( 1.296 6.027 4.323) 7.530 1.972 ( -1.752 6.065 3.440) 7.189 2.218 ( -4.849 9.486 3.180) 11.118 2.479 ( -2.806 4.857 -8.895) 10.516 2.624 ( -6.400 -0.536 -6.047) 8.821 2.910 ( 4.053 0.429 7.507) 8.542 3.028 ( -9.847 -0.609 -6.019) 11.557 3.176 ( 5.042 -2.383 10.901) 12.245 3.402 ( 4.160 -1.320 6.425) 7.768 3.601 ( 4.029 0.806 -8.666) 9.591 3.770 ( -9.318 5.205 -7.312) 12.938 3.876 ( -0.413 0.685 1.270) 1.501 3.958 ( -6.552 13.782 -1.899) 15.378 4.307 ( 7.605 -2.973 0.222) 8.168 4.477 ( -3.683 -5.598 1.694) 6.912 4.640 ( 5.164 -3.804 3.428) 7.272 4.860 ( -1.638 3.025 -3.978) 5.259 5.067 ( -1.084 0.258 -3.456) 3.632 5.239 ( -0.373 -1.014 -7.773) 7.848 5.301 ( 2.355 -4.872 5.679) 7.844 5.476 ( 0.317 -6.397 -2.772) 6.979 5.706 ( 4.834 -4.093 -6.865) 9.340 6.082 ( -1.735 3.769 0.117) 4.151 6.157 ( 2.198 -6.186 7.276) 9.800 6.405 ( -3.236 6.488 -1.822) 7.475 6.516 ( 3.751 -11.889 -3.416) 12.926 6.731 ( 3.462 -5.495 10.175) 12.071 6.933 ( -0.072 -8.568 -2.097) 8.821 7.008 ( 2.475 -9.141 4.251) 10.381 7.093 ( -3.940 1.171 -4.139) 5.833 7.328 ( -0.800 7.943 -2.432) 8.346 7.477 ( 3.909 0.731 3.780) 5.486 7.581 ( 7.800 5.020 -3.455) 9.899 7.636 ( 3.773 7.869 -2.588) 9.102 8.005 ( -4.905 6.165 3.190) 8.499 8.217 ( -0.407 0.901 2.756) 2.928 9.096 ( -1.724 -4.008 -3.103) 5.354 9.270 ( 4.251 -5.804 -3.845) 8.158 9.580 ( 0.561 -2.697 1.894) 3.343 9.703 ( 0.722 -5.079 -0.768) 5.187 10.067 ( -3.759 -1.682 -2.886) 5.029 10.078 ( -3.024 -0.445 -1.855) 3.576 11.273 ( 2.790 2.529 0.927) 3.878 11.357 ( -1.291 3.249 0.400) 3.519 11.616 ( 2.949 1.125 1.361) 3.437 11.654 ( -0.289 2.198 -0.476) 2.267 11.851 ( -4.412 1.602 1.836) 5.040 12.111 ( -1.782 1.767 2.569) 3.591 12.135 ( -4.089 3.919 1.112) 5.772 12.332 ( -0.773 1.322 0.275) 1.556 12.687 ( -0.768 5.383 3.920) 6.703 12.774 ( -0.572 9.399 4.013) 10.236 16.081 ( -0.897 -1.235 -1.336) 2.028 16.110 ( -0.311 -0.966 -1.509) 1.818 17.096 ( -0.624 7.956 0.332) 7.987 17.114 ( 2.800 7.822 1.368) 8.420 17.340 ( 0.485 4.920 10.160) 11.299 17.891 ( 10.410 5.179 -2.639) 11.923 18.587 ( -15.831 -12.988 -6.996) 21.639 19.239 ( 8.153 -17.693 -3.217) 19.745 ======================= Grid point 129 (61/170) ======================= q-point: (-0.27 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.767 ( -7.889 15.989 -7.201) 19.228 1.972 ( -4.871 2.190 3.826) 6.570 2.084 ( -10.589 12.443 -10.928) 19.657 2.295 ( 1.385 3.318 5.212) 6.332 2.507 ( -2.115 -2.684 -5.564) 6.529 2.851 ( -2.869 -1.752 -4.147) 5.338 3.127 ( 4.140 -4.192 10.150) 11.735 3.279 ( -14.984 9.018 0.228) 17.490 3.456 ( -7.837 6.763 3.649) 10.976 3.506 ( -0.168 0.077 -0.871) 0.890 3.615 ( 1.111 2.672 6.296) 6.929 3.810 ( -0.128 -0.481 -9.716) 9.729 3.991 ( 6.736 8.192 4.902) 11.683 4.411 ( 4.699 -6.038 -1.760) 7.851 4.491 ( 2.472 -2.574 2.717) 4.485 4.703 ( -1.879 -2.805 1.675) 3.769 4.890 ( 7.510 6.166 -0.880) 9.757 5.026 ( 3.291 -3.744 -5.965) 7.773 5.177 ( 4.808 -0.041 -5.139) 7.037 5.379 ( 1.826 -5.485 4.108) 7.092 5.541 ( 5.651 -3.032 2.512) 6.888 5.708 ( 4.782 -4.634 -6.597) 9.374 6.060 ( -3.735 1.586 2.246) 4.638 6.223 ( -3.712 -6.489 4.788) 8.877 6.300 ( -6.353 8.428 -0.735) 10.580 6.538 ( 2.605 -7.441 -1.599) 8.044 6.811 ( -5.978 -7.641 -11.978) 15.414 6.842 ( 0.836 -6.041 2.422) 6.562 6.989 ( -2.464 3.474 1.625) 4.558 7.151 ( 2.031 -3.489 4.528) 6.066 7.304 ( 1.085 4.802 0.891) 5.003 7.531 ( 0.460 2.015 1.061) 2.323 7.691 ( 6.466 1.771 0.287) 6.710 7.753 ( 13.315 2.390 -4.756) 14.340 7.970 ( -3.784 6.922 4.282) 8.976 8.216 ( -1.642 -2.719 0.361) 3.197 9.050 ( 0.188 -1.869 -2.090) 2.810 9.296 ( 2.597 -5.804 -1.539) 6.543 9.576 ( -0.017 -2.477 -0.824) 2.611 9.769 ( 4.925 -4.510 2.075) 6.993 9.959 ( -4.794 1.123 -0.924) 5.010 10.040 ( -1.555 -0.136 0.107) 1.564 11.319 ( 0.447 1.320 -1.543) 2.079 11.348 ( 1.001 3.527 1.839) 4.101 11.624 ( -0.399 0.532 -1.177) 1.352 11.653 ( -1.262 -1.152 -0.581) 1.805 11.826 ( 0.755 2.875 1.118) 3.176 12.059 ( -3.931 4.808 -0.882) 6.273 12.103 ( -3.570 -0.644 2.015) 4.149 12.306 ( -3.546 3.898 1.636) 5.518 12.656 ( -5.416 7.337 -0.513) 9.134 12.819 ( 0.321 -0.973 3.273) 3.429 16.052 ( -0.632 -0.277 -1.058) 1.263 16.089 ( -0.428 -0.021 -0.827) 0.931 17.039 ( -3.140 7.322 0.222) 7.970 17.183 ( 2.532 7.656 -2.157) 8.347 17.561 ( 6.156 4.129 18.135) 19.591 17.998 ( 9.289 0.186 -13.148) 16.099 18.252 ( -15.875 -6.376 1.102) 17.143 19.341 ( 8.166 -16.045 -3.012) 18.254 ======================= Grid point 130 (62/170) ======================= q-point: (-0.18 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.497 ( -11.632 21.854 -5.627) 25.388 1.588 ( -17.120 19.460 -11.068) 28.183 2.148 ( 4.954 0.835 5.137) 7.185 2.413 ( 2.246 1.614 2.525) 3.745 2.422 ( 0.243 2.646 -1.313) 2.964 2.769 ( -8.710 13.764 -5.575) 17.216 2.929 ( -10.606 9.497 6.163) 15.513 3.169 ( -12.215 1.583 -0.234) 12.319 3.383 ( -0.612 -4.460 0.240) 4.508 3.555 ( -0.294 8.004 0.930) 8.063 3.666 ( 0.419 -6.455 3.607) 7.406 3.801 ( 4.017 -12.302 -0.835) 12.969 4.164 ( 4.553 6.770 6.364) 10.347 4.448 ( 3.477 -8.017 -2.581) 9.111 4.591 ( 4.253 -2.639 1.931) 5.365 4.721 ( 5.633 2.332 0.030) 6.096 4.957 ( 0.659 4.604 2.079) 5.094 5.063 ( 4.312 1.164 -2.104) 4.937 5.268 ( 9.386 0.277 -3.987) 10.201 5.517 ( 6.785 -4.459 7.594) 11.117 5.685 ( 2.574 -4.073 6.208) 7.858 5.721 ( 9.593 -3.505 -8.193) 13.093 5.985 ( -6.766 1.313 0.845) 6.944 6.139 ( -8.677 2.500 2.834) 9.464 6.226 ( -3.292 -1.036 0.265) 3.462 6.482 ( -8.831 -6.345 -16.490) 19.753 6.584 ( 0.799 -3.879 0.331) 3.975 6.830 ( -2.872 -1.902 -1.487) 3.752 6.989 ( -0.955 2.665 2.650) 3.878 7.153 ( -2.072 6.850 1.274) 7.269 7.377 ( -0.140 -3.619 3.987) 5.386 7.530 ( -2.644 -0.650 1.148) 2.955 7.708 ( -2.432 4.899 -2.599) 6.056 7.903 ( 2.911 3.056 -0.890) 4.313 8.073 ( 17.011 -3.625 -2.314) 17.546 8.195 ( -0.300 -2.220 1.136) 2.511 9.063 ( 3.199 1.225 -0.501) 3.462 9.335 ( 0.711 -2.835 4.094) 5.030 9.593 ( 2.764 -0.214 -0.373) 2.798 9.840 ( 0.710 -0.920 0.660) 1.336 9.938 ( 1.164 -2.059 2.123) 3.178 10.027 ( -0.261 -1.003 1.697) 1.989 11.278 ( -0.730 2.416 -3.759) 4.528 11.391 ( 0.298 1.629 2.218) 2.769 11.594 ( -1.409 -2.191 -1.514) 3.013 11.630 ( 1.416 -2.323 -1.266) 3.001 11.877 ( 3.119 0.958 -0.003) 3.263 11.983 ( -2.955 3.822 -1.692) 5.119 12.033 ( -4.823 -1.877 -2.393) 5.701 12.254 ( -5.335 5.143 2.260) 7.747 12.507 ( -9.224 7.132 -2.613) 11.949 12.841 ( 0.001 -7.675 -0.339) 7.683 16.038 ( -0.043 0.696 -0.375) 0.791 16.077 ( -0.479 0.797 -0.026) 0.930 16.995 ( -2.197 8.073 -0.587) 8.388 17.169 ( -0.337 5.550 -2.548) 6.117 17.801 ( -7.314 -5.968 -11.540) 14.909 17.933 ( 8.511 3.782 21.000) 22.973 18.177 ( -0.060 0.724 -1.208) 1.410 19.445 ( 7.929 -12.094 -1.980) 14.597 ======================= Grid point 131 (63/170) ======================= q-point: (-0.09 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.306 ( -9.022 25.500 4.974) 27.502 1.326 ( -3.660 27.912 0.089) 28.151 2.223 ( -2.967 7.625 4.047) 9.128 2.400 ( -1.554 9.468 2.547) 9.927 2.479 ( 5.201 3.864 -4.746) 8.031 2.612 ( -3.436 22.853 3.565) 23.383 2.883 ( -10.525 3.428 -4.202) 11.840 3.023 ( 2.288 -13.852 3.862) 14.561 3.332 ( -4.357 8.247 5.832) 11.000 3.572 ( 0.928 -3.276 -3.493) 4.878 3.699 ( -1.714 -12.755 1.470) 12.953 3.845 ( 1.296 -12.271 1.755) 12.463 4.275 ( 1.011 3.344 4.658) 5.823 4.478 ( 2.964 -10.286 -0.513) 10.717 4.691 ( 6.149 3.548 0.989) 7.168 4.862 ( 5.519 -1.203 1.846) 5.942 4.999 ( -1.784 5.441 6.441) 8.619 5.046 ( -2.446 0.410 -2.787) 3.731 5.338 ( 3.365 6.226 -2.589) 7.536 5.640 ( -1.196 -1.014 -0.767) 1.745 5.734 ( 7.026 -1.713 -7.005) 10.068 5.874 ( 3.090 -3.758 8.675) 9.946 5.984 ( 7.439 0.579 0.810) 7.506 6.040 ( -6.858 -3.840 -0.120) 7.861 6.127 ( -4.871 -1.502 -2.622) 5.732 6.219 ( -2.546 2.474 -0.486) 3.583 6.637 ( 2.440 -1.569 2.150) 3.611 6.721 ( -5.275 0.501 -3.645) 6.431 7.009 ( 0.409 3.239 1.584) 3.629 7.164 ( -1.697 4.346 3.814) 6.027 7.347 ( -4.184 -2.658 -0.034) 4.957 7.446 ( -7.609 -4.439 -0.053) 8.809 7.644 ( 0.300 6.072 -2.911) 6.740 7.874 ( -1.595 8.018 -3.339) 8.830 8.177 ( 2.976 -6.528 -4.683) 8.567 8.367 ( 12.558 -9.768 -0.818) 15.930 9.134 ( 4.589 3.449 0.167) 5.744 9.392 ( -2.519 -0.530 6.168) 6.684 9.667 ( 5.569 3.028 0.535) 6.361 9.877 ( -0.557 -0.342 1.464) 1.603 9.934 ( 1.711 -2.436 -1.830) 3.494 10.097 ( 0.224 -0.919 6.800) 6.866 11.223 ( 0.348 1.497 -3.761) 4.062 11.441 ( 3.630 -0.602 3.233) 4.897 11.555 ( -1.843 -3.403 -1.209) 4.055 11.646 ( 2.272 -3.718 -2.948) 5.261 11.854 ( -5.208 -2.760 -4.091) 7.175 11.899 ( -1.684 0.786 -3.552) 4.008 11.981 ( 2.854 3.288 0.455) 4.378 12.184 ( -5.064 4.917 1.118) 7.146 12.328 ( -8.135 7.445 -1.497) 11.128 12.814 ( 0.006 -11.130 -3.964) 11.815 16.042 ( 0.425 1.428 0.452) 1.557 16.072 ( -0.537 1.346 0.611) 1.573 16.943 ( -1.173 8.071 -3.278) 8.790 17.130 ( -1.116 2.866 -1.409) 3.383 17.596 ( -3.856 -5.535 -4.943) 8.363 18.078 ( -4.844 -6.048 -9.219) 12.042 18.318 ( 6.547 8.453 19.503) 22.241 19.571 ( 7.298 -6.195 1.042) 9.630 ======================= Grid point 132 (64/170) ======================= q-point: ( 0.00 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.815 ( 1.135 19.626 7.410) 21.009 1.929 ( 7.033 23.736 4.031) 25.082 2.332 ( 3.520 2.232 -4.586) 6.197 2.438 ( -0.714 -0.854 -2.751) 2.968 2.523 ( -0.102 1.812 -0.159) 1.822 2.724 ( -2.048 1.386 -4.537) 5.167 2.764 ( 0.533 -10.425 3.679) 11.068 3.221 ( -2.916 -11.092 1.801) 11.610 3.293 ( -0.640 -9.704 -1.335) 9.817 3.439 ( -2.208 23.199 8.612) 24.844 3.541 ( -0.302 -6.591 -9.085) 11.228 3.788 ( 0.069 6.679 9.403) 11.534 4.371 ( -0.898 -3.540 4.006) 5.421 4.433 ( -4.301 9.974 5.401) 12.130 4.696 ( -5.804 -7.686 -0.175) 9.633 4.891 ( 5.474 2.339 0.205) 5.956 5.008 ( -0.981 2.689 0.735) 2.955 5.133 ( -2.666 0.381 6.629) 7.155 5.493 ( 1.279 -0.858 -6.795) 6.968 5.574 ( -3.650 -0.334 -1.170) 3.847 5.703 ( 5.273 -1.780 -3.998) 6.853 5.793 ( 4.720 -3.974 -3.019) 6.869 6.020 ( -5.170 9.721 2.170) 11.222 6.102 ( 2.332 1.551 6.777) 7.333 6.267 ( 5.760 6.643 2.890) 9.255 6.427 ( 4.438 2.173 10.629) 11.721 6.550 ( -4.794 -2.768 -3.392) 6.492 6.715 ( 4.985 0.875 1.176) 5.196 7.011 ( -2.749 -6.242 0.727) 6.859 7.071 ( -8.259 -2.942 2.591) 9.142 7.277 ( 0.779 -0.704 0.174) 1.064 7.416 ( 2.756 6.235 -2.872) 7.397 7.743 ( 2.052 3.611 -2.931) 5.083 7.919 ( -0.589 3.987 -6.232) 7.422 7.998 ( 3.467 -9.830 -6.913) 12.508 8.133 ( -3.858 -14.808 -3.926) 15.798 9.276 ( 1.609 3.153 0.147) 3.543 9.368 ( -4.321 -0.838 2.496) 5.060 9.776 ( 2.059 0.971 -1.168) 2.558 9.780 ( -1.170 -0.270 -3.942) 4.120 10.009 ( -0.650 2.987 5.704) 6.471 10.180 ( -4.265 0.589 10.249) 11.116 11.243 ( 2.302 1.333 -0.484) 2.704 11.432 ( -2.208 -3.846 2.551) 5.116 11.491 ( 1.874 -0.603 -1.980) 2.793 11.630 ( 3.499 -2.635 -1.484) 4.625 11.781 ( 1.817 -1.083 -0.314) 2.138 11.843 ( 2.371 -1.293 -2.745) 3.851 12.030 ( -0.109 1.672 -1.509) 2.255 12.274 ( 2.968 6.393 -1.488) 7.204 12.325 ( -3.559 2.714 -2.538) 5.145 12.547 ( -0.411 -7.785 -3.829) 8.685 16.094 ( 0.270 1.623 1.239) 2.060 16.104 ( -0.176 1.339 1.030) 1.698 17.025 ( 0.393 6.418 -6.060) 8.835 17.142 ( 1.473 2.142 -2.758) 3.790 17.444 ( 1.754 -6.322 -0.082) 6.561 17.676 ( -4.493 -9.431 -13.108) 16.761 18.816 ( -0.885 14.453 15.707) 21.364 19.548 ( -0.148 -7.761 4.203) 8.827 ======================= Grid point 133 (65/170) ======================= q-point: ( 0.09 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.975 ( 4.910 10.440 9.302) 14.819 2.142 ( 9.759 15.748 1.520) 18.589 2.247 ( -0.109 5.173 -2.196) 5.621 2.509 ( -0.072 3.671 -0.642) 3.728 2.522 ( 4.285 3.076 4.951) 7.234 2.657 ( -2.332 -2.295 1.696) 3.685 2.810 ( 1.715 -7.353 -2.746) 8.035 3.103 ( -3.915 -10.062 -10.372) 14.972 3.209 ( -2.855 -8.933 -4.965) 10.612 3.441 ( 2.609 -6.217 -7.819) 10.324 3.621 ( 2.579 22.462 15.920) 27.652 3.913 ( 1.540 4.385 6.307) 7.835 4.336 ( -6.666 8.764 0.842) 11.044 4.415 ( -2.631 1.029 3.080) 4.180 4.617 ( -5.631 -5.562 5.814) 9.821 4.951 ( -7.741 4.045 3.221) 9.309 5.011 ( 5.218 -0.273 2.598) 5.835 5.147 ( -3.218 -3.883 -0.425) 5.061 5.384 ( -4.334 -3.649 1.267) 5.806 5.501 ( -2.446 -0.364 -4.112) 4.798 5.752 ( -2.906 2.018 2.150) 4.140 5.820 ( 2.350 -1.242 -3.727) 4.578 6.003 ( 3.787 8.180 1.879) 9.208 6.155 ( -2.345 2.891 3.824) 5.336 6.325 ( -1.732 7.324 2.592) 7.960 6.513 ( 0.966 -2.315 1.622) 2.987 6.650 ( 4.945 -4.319 5.381) 8.489 6.776 ( 1.980 3.073 0.916) 3.768 6.917 ( -6.140 -7.617 -0.730) 9.810 7.020 ( -1.040 -3.439 1.259) 3.807 7.311 ( 3.613 3.291 0.667) 4.933 7.473 ( 5.515 2.021 -1.761) 6.132 7.765 ( 4.086 4.247 -2.373) 6.354 7.817 ( -2.976 -1.461 -7.971) 8.633 7.966 ( 2.519 -7.080 -4.957) 9.003 7.991 ( -3.040 -10.833 -8.134) 13.884 9.264 ( -4.094 1.695 1.863) 4.806 9.340 ( -1.198 -3.028 3.270) 4.615 9.750 ( -0.572 0.680 -0.300) 0.938 9.784 ( 0.356 -0.862 -1.505) 1.770 10.026 ( -4.868 4.806 6.704) 9.578 10.148 ( -9.607 2.440 6.550) 11.881 11.275 ( 2.461 1.458 -1.853) 3.408 11.417 ( -2.611 -2.451 2.335) 4.275 11.522 ( 4.412 -0.121 -2.970) 5.320 11.608 ( -2.071 -1.383 -0.590) 2.559 11.864 ( 3.584 -2.395 -1.913) 4.716 11.918 ( 7.271 -3.071 -0.848) 7.938 11.990 ( -0.057 3.341 -2.562) 4.210 12.258 ( 0.290 3.055 -0.050) 3.070 12.379 ( 10.391 2.792 -3.854) 11.428 12.523 ( 4.027 -3.809 -5.034) 7.487 16.102 ( -0.882 1.499 1.290) 2.165 16.119 ( 0.059 1.102 1.314) 1.716 16.983 ( 2.363 4.390 -5.005) 7.064 17.173 ( 5.779 0.520 -4.262) 7.199 17.394 ( -4.916 -5.048 -7.336) 10.172 17.603 ( 10.993 -7.722 -2.234) 13.618 18.910 ( -10.121 12.658 15.757) 22.604 19.505 ( -8.942 -6.553 2.047) 11.273 ======================= Grid point 134 (66/170) ======================= q-point: ( 0.18 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.082 ( -1.344 2.362 -0.422) 2.750 2.150 ( -2.031 3.646 2.835) 5.046 2.398 ( 8.033 8.542 -4.897) 12.707 2.544 ( 5.142 10.261 3.085) 11.885 2.666 ( 6.431 -2.616 4.510) 8.278 2.717 ( -2.430 1.421 11.671) 12.006 2.772 ( 2.493 -0.616 -4.392) 5.088 2.897 ( -0.728 -4.083 -11.600) 12.319 3.138 ( -0.373 -7.994 -1.655) 8.172 3.463 ( 8.402 -2.954 -5.953) 10.712 3.773 ( -2.412 7.484 5.627) 9.669 3.948 ( -1.663 1.640 0.455) 2.379 4.231 ( -6.629 12.516 2.602) 14.400 4.412 ( -0.656 3.074 0.935) 3.279 4.643 ( -4.262 -4.096 11.691) 13.100 4.840 ( -8.737 2.174 3.872) 9.800 5.051 ( -3.682 -0.899 -3.435) 5.115 5.100 ( 3.868 -1.381 -0.931) 4.211 5.343 ( -5.438 0.546 -1.459) 5.657 5.413 ( -3.239 -4.375 1.684) 5.698 5.679 ( -9.402 4.535 7.177) 12.667 5.794 ( -0.500 -1.673 -2.641) 3.166 6.105 ( -0.995 0.341 1.881) 2.155 6.183 ( 3.103 4.404 5.763) 7.889 6.339 ( 1.602 2.172 0.296) 2.715 6.514 ( -2.512 -1.165 -0.359) 2.792 6.626 ( -4.343 -1.583 -7.084) 8.459 6.782 ( -6.097 -13.244 -2.150) 14.738 6.851 ( 3.046 2.787 0.556) 4.165 7.093 ( 3.477 -1.467 6.914) 7.877 7.406 ( 5.793 6.880 0.383) 9.002 7.548 ( 3.539 1.696 0.716) 3.989 7.614 ( -6.871 -8.636 -8.500) 13.930 7.835 ( 5.481 4.993 -2.980) 7.991 7.864 ( 0.216 -4.909 -5.148) 7.117 8.007 ( 5.847 -2.022 -2.424) 6.645 9.226 ( -4.141 0.486 4.049) 5.811 9.382 ( -0.275 -5.994 3.984) 7.203 9.723 ( -4.793 0.364 1.644) 5.080 9.742 ( -2.684 -1.365 0.069) 3.012 10.015 ( -4.303 3.630 2.755) 6.268 10.080 ( -3.805 1.914 4.862) 6.463 11.290 ( 1.849 0.996 -1.407) 2.527 11.386 ( -2.766 -1.996 0.257) 3.421 11.525 ( 0.921 0.768 -4.011) 4.186 11.625 ( 3.484 0.396 0.675) 3.571 11.839 ( -0.474 -1.108 -4.983) 5.126 11.918 ( 0.766 -0.201 -4.360) 4.431 12.066 ( 7.304 3.657 -0.039) 8.168 12.309 ( 2.706 -3.034 1.326) 4.276 12.489 ( 8.076 3.513 -4.552) 9.914 12.592 ( 9.765 3.348 -3.642) 10.947 16.099 ( -0.921 0.985 0.849) 1.593 16.131 ( -0.380 0.351 1.141) 1.253 16.983 ( 3.320 3.136 -4.182) 6.193 17.136 ( 0.930 -2.381 -8.439) 8.818 17.370 ( 4.693 3.574 2.252) 6.314 17.832 ( 15.980 -9.267 -0.164) 18.473 18.842 ( -17.715 9.058 13.428) 24.004 19.320 ( -13.122 -7.283 -0.710) 15.025 ======================= Grid point 135 (67/170) ======================= q-point: ( 0.27 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.989 ( -8.466 4.295 0.181) 9.495 2.150 ( -2.922 1.335 5.504) 6.372 2.344 ( 3.288 0.430 -14.733) 15.102 2.544 ( -5.579 10.110 -4.300) 12.322 2.729 ( 1.415 -2.535 -0.614) 2.967 2.781 ( 7.589 -2.011 1.469) 7.988 2.946 ( 9.240 4.678 5.602) 11.775 3.047 ( 10.410 7.753 12.908) 18.305 3.136 ( 1.893 -6.238 -1.278) 6.643 3.540 ( 10.019 1.759 -9.933) 14.217 3.718 ( -2.784 -2.534 -0.208) 3.770 3.890 ( -5.251 -2.495 0.885) 5.880 4.172 ( -5.049 7.682 2.960) 9.658 4.398 ( -2.170 6.138 -0.081) 6.511 4.675 ( -6.954 -3.945 5.056) 9.459 4.776 ( -5.345 -0.042 5.874) 7.942 4.967 ( -1.550 2.299 -2.021) 3.431 5.127 ( 1.760 -2.145 -2.839) 3.970 5.214 ( -3.329 2.067 -3.778) 5.444 5.392 ( -5.011 -4.593 4.770) 8.305 5.644 ( -5.731 1.129 8.965) 10.699 5.765 ( -0.664 -1.815 -0.257) 1.950 6.054 ( -5.485 0.282 1.613) 5.724 6.298 ( -0.381 -2.216 -9.500) 9.762 6.316 ( -0.267 0.410 4.749) 4.774 6.420 ( -5.415 -2.603 -5.021) 7.830 6.455 ( -4.569 -4.799 -1.214) 6.737 6.680 ( -1.785 -9.921 -3.000) 10.517 6.912 ( 2.087 1.250 2.892) 3.779 7.230 ( 2.111 -2.653 3.274) 4.714 7.373 ( -5.246 1.582 -4.303) 6.967 7.515 ( 2.283 5.366 1.146) 5.943 7.630 ( 4.915 1.903 -1.457) 5.468 7.809 ( 1.898 2.059 -2.247) 3.591 7.953 ( 6.987 2.870 -0.586) 7.576 8.088 ( 4.914 -0.756 0.374) 4.986 9.209 ( -3.517 -0.957 3.379) 4.970 9.371 ( -5.137 -5.872 1.211) 7.895 9.643 ( -3.944 0.789 -0.055) 4.023 9.729 ( -3.517 -1.065 4.829) 6.068 9.975 ( -0.140 0.381 -0.383) 0.558 10.113 ( 0.690 -2.192 2.896) 3.697 11.289 ( -0.636 0.420 -2.010) 2.149 11.353 ( -0.832 -0.952 0.922) 1.565 11.493 ( 1.168 1.627 -3.939) 4.419 11.668 ( 0.023 -1.063 -0.552) 1.199 11.809 ( 3.931 1.305 -2.606) 4.894 11.896 ( 1.963 0.429 -2.610) 3.294 12.190 ( 6.757 4.001 0.327) 7.859 12.338 ( 1.743 -2.224 -2.680) 3.894 12.588 ( 6.976 7.306 0.014) 10.102 12.708 ( 7.743 5.234 -2.850) 9.771 16.093 ( -0.522 0.071 0.253) 0.585 16.132 ( -0.621 -0.676 0.500) 1.045 16.979 ( 3.385 3.978 -4.734) 7.049 17.137 ( 4.956 1.878 -0.622) 5.336 17.477 ( 3.236 7.319 2.155) 8.288 18.083 ( 12.297 -4.256 -0.506) 13.022 18.655 ( -18.316 -1.345 9.040) 20.470 19.079 ( -12.539 -10.779 -1.929) 16.647 ======================= Grid point 136 (68/170) ======================= q-point: ( 0.36 0.33 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.852 ( -8.392 5.624 2.710) 10.460 2.142 ( -6.048 1.652 4.928) 7.974 2.268 ( 4.952 -1.808 -9.135) 10.547 2.459 ( -1.299 10.994 1.636) 11.191 2.723 ( 0.896 8.984 -3.676) 9.748 2.902 ( 1.645 -7.308 3.645) 8.331 3.072 ( 1.680 -0.670 1.380) 2.275 3.201 ( 9.031 4.924 -0.731) 10.312 3.387 ( 12.905 6.585 2.677) 14.733 3.551 ( 6.878 -0.316 -7.076) 9.873 3.742 ( 1.083 -4.039 -0.435) 4.204 3.832 ( -2.280 -3.584 3.449) 5.471 4.118 ( -4.442 2.479 1.848) 5.412 4.335 ( -5.031 5.193 0.326) 7.238 4.564 ( -6.059 -3.006 0.111) 6.764 4.754 ( -6.548 -4.419 4.653) 9.168 4.895 ( -2.661 0.873 -4.083) 4.951 5.110 ( -0.941 0.653 -0.920) 1.469 5.182 ( 0.620 -0.624 0.271) 0.920 5.354 ( -4.294 -3.535 2.703) 6.184 5.666 ( -1.024 -1.462 2.872) 3.381 5.772 ( 0.662 -2.099 0.573) 2.275 6.002 ( -5.172 2.403 2.095) 6.076 6.063 ( -3.288 -3.912 -11.227) 12.336 6.235 ( -4.461 -4.744 -7.466) 9.907 6.386 ( -3.881 -12.667 4.102) 13.869 6.453 ( 2.131 -2.137 4.582) 5.487 6.628 ( -1.729 -6.182 -1.976) 6.717 6.999 ( 2.647 0.804 5.357) 6.029 7.122 ( -5.139 -4.229 -6.849) 9.550 7.406 ( 2.309 7.381 3.964) 8.690 7.522 ( -2.483 5.339 0.224) 5.892 7.695 ( 6.017 7.559 -3.652) 10.329 7.841 ( 2.592 2.743 -1.042) 3.915 8.049 ( 4.306 4.144 0.889) 6.042 8.175 ( 3.231 0.943 2.079) 3.956 9.174 ( -2.860 -2.778 0.014) 3.987 9.270 ( -6.248 -4.529 -0.358) 7.725 9.590 ( -1.412 1.562 -2.091) 2.967 9.712 ( -3.361 -0.357 2.634) 4.285 10.012 ( 2.164 -3.351 1.993) 4.459 10.146 ( 1.165 -6.457 -0.254) 6.566 11.248 ( -0.598 1.706 -1.305) 2.230 11.368 ( -0.719 -0.660 2.685) 2.857 11.483 ( 1.831 1.069 -1.968) 2.893 11.644 ( -0.716 -0.660 -0.451) 1.073 11.884 ( 4.592 1.372 0.667) 4.839 11.926 ( 2.156 1.366 1.536) 2.978 12.290 ( 4.689 3.228 -0.002) 5.692 12.320 ( 1.787 1.861 -4.881) 5.521 12.710 ( 4.879 8.195 2.935) 9.979 12.786 ( 4.399 7.009 -0.683) 8.303 16.088 ( -0.008 -0.879 -0.331) 0.939 16.122 ( -0.598 -1.597 -0.267) 1.727 17.017 ( 5.337 7.151 -1.653) 9.075 17.246 ( 7.364 5.120 0.409) 8.978 17.499 ( -2.568 10.746 0.525) 11.061 18.134 ( -8.618 11.955 1.233) 14.789 18.540 ( 0.256 -22.400 1.048) 22.426 18.882 ( -8.730 -15.442 -0.622) 17.750 ======================= Grid point 137 (69/170) ======================= q-point: ( 0.45 0.33 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.795 ( -4.604 5.973 6.382) 9.880 2.096 ( -4.774 2.523 3.408) 6.385 2.273 ( 4.323 0.294 -2.692) 5.102 2.524 ( 1.283 10.652 8.549) 13.719 2.702 ( 2.242 12.534 -4.547) 13.520 2.939 ( -2.830 -3.706 5.854) 7.484 3.093 ( 2.056 -3.782 -2.772) 5.120 3.322 ( 7.029 4.202 -4.408) 9.301 3.423 ( 1.222 -0.741 -10.142) 10.242 3.639 ( -4.370 -6.424 -9.687) 12.418 3.707 ( 6.267 4.773 6.175) 10.009 3.892 ( 3.234 1.457 2.687) 4.449 4.136 ( 2.918 -2.269 3.954) 5.413 4.251 ( -5.849 2.345 1.970) 6.602 4.496 ( -3.611 -0.090 1.232) 3.816 4.647 ( -7.823 -4.456 -0.307) 9.009 4.886 ( 2.308 -3.129 4.234) 5.748 5.039 ( -1.691 -0.054 -6.394) 6.614 5.192 ( -2.807 -1.110 2.664) 4.025 5.322 ( -0.688 -1.815 -1.295) 2.334 5.663 ( 0.238 -1.864 -4.404) 4.788 5.729 ( -4.149 -4.525 -5.394) 8.172 5.809 ( -0.693 -1.800 -8.797) 9.006 6.129 ( 4.442 -2.205 8.627) 9.950 6.175 ( 1.366 -9.113 0.147) 9.216 6.348 ( -2.495 -7.660 1.162) 8.139 6.531 ( -2.725 -4.063 4.712) 6.792 6.609 ( 2.608 -4.733 1.963) 5.750 6.970 ( -3.689 -0.665 -5.565) 6.709 7.131 ( 4.217 0.168 6.536) 7.780 7.424 ( -3.002 4.134 -3.124) 5.989 7.489 ( -0.739 7.598 2.190) 7.942 7.728 ( 4.128 8.943 -5.636) 11.348 7.836 ( 0.263 3.213 -4.122) 5.233 8.123 ( 1.215 4.452 3.352) 5.704 8.229 ( 0.432 2.191 1.795) 2.865 9.131 ( -0.353 -3.714 -2.361) 4.415 9.171 ( -3.426 -5.230 -2.177) 6.620 9.541 ( -0.275 1.093 -3.520) 3.696 9.689 ( -2.141 -1.387 0.970) 2.729 10.053 ( -0.104 -3.654 1.523) 3.960 10.149 ( 0.781 -6.464 -1.739) 6.739 11.251 ( 0.452 2.849 1.560) 3.279 11.386 ( -1.238 -0.084 3.448) 3.664 11.510 ( 2.511 1.042 0.293) 2.734 11.653 ( -0.008 -0.005 2.896) 2.896 11.940 ( 0.884 2.085 0.512) 2.322 12.001 ( 1.447 0.583 5.274) 5.500 12.289 ( 1.386 3.108 -4.926) 5.988 12.347 ( 2.385 2.816 -0.559) 3.732 12.796 ( 0.949 9.667 3.324) 10.266 12.864 ( 2.793 8.167 3.763) 9.416 16.084 ( 0.198 -1.437 -0.750) 1.633 16.107 ( -0.277 -2.052 -0.936) 2.273 17.092 ( 4.431 9.027 -1.161) 10.123 17.364 ( 5.619 7.931 -1.084) 9.780 17.437 ( -4.040 10.695 0.859) 11.464 17.941 ( -10.022 7.432 -0.744) 12.499 18.613 ( 5.054 -20.910 -0.625) 21.521 18.760 ( -5.140 -17.942 -0.631) 18.674 ======================= Grid point 138 (70/170) ======================= q-point: (-0.45 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.831 ( -0.804 5.411 6.868) 8.780 2.063 ( -3.248 2.210 3.038) 4.967 2.365 ( 6.799 4.221 1.428) 8.130 2.642 ( -3.010 12.557 -3.372) 13.346 2.697 ( 3.920 9.364 9.887) 14.171 2.951 ( -3.632 -2.501 3.525) 5.646 3.092 ( -0.060 -5.720 -1.108) 5.826 3.206 ( -7.983 -0.088 -11.598) 14.080 3.323 ( -2.293 -0.841 -1.896) 3.092 3.520 ( 5.277 -7.269 -10.173) 13.571 3.826 ( 0.631 5.429 3.947) 6.742 3.974 ( 0.987 2.871 3.992) 5.015 4.175 ( 0.196 -3.547 0.394) 3.574 4.271 ( 1.186 8.499 4.036) 9.483 4.455 ( -0.838 -0.077 -1.327) 1.571 4.539 ( -3.483 -3.792 -0.868) 5.221 4.959 ( 1.630 0.035 -5.777) 6.002 5.017 ( 4.669 -3.636 5.128) 7.830 5.158 ( -2.183 -0.930 0.372) 2.402 5.281 ( -0.142 -3.182 -5.202) 6.100 5.484 ( -6.055 -4.446 -9.487) 12.101 5.645 ( 2.257 -3.272 -5.148) 6.504 5.853 ( 5.065 -5.216 2.816) 7.797 6.146 ( -0.738 -12.290 -6.071) 13.728 6.324 ( 5.926 -1.125 6.717) 9.028 6.399 ( 2.725 1.330 5.702) 6.458 6.519 ( -2.813 -3.327 4.789) 6.474 6.718 ( 3.435 -6.558 4.926) 8.892 6.874 ( -0.695 0.524 -3.732) 3.832 7.277 ( -1.372 -5.004 1.340) 5.359 7.308 ( 0.993 6.693 0.278) 6.772 7.497 ( -0.070 6.818 -0.281) 6.824 7.710 ( 1.844 7.255 -5.877) 9.517 7.775 ( 0.253 3.533 -5.390) 6.450 8.149 ( -2.797 4.274 2.928) 5.888 8.240 ( -1.605 1.812 2.554) 3.519 9.079 ( -1.345 -3.833 -3.592) 5.423 9.135 ( 3.277 -5.778 -4.553) 8.053 9.515 ( 1.068 -0.442 -1.620) 1.990 9.648 ( -1.896 -3.821 -2.068) 4.740 10.055 ( -1.296 -1.737 1.576) 2.680 10.131 ( -0.793 -2.847 -1.636) 3.378 11.282 ( 0.565 2.925 1.925) 3.547 11.406 ( -1.885 0.816 4.183) 4.660 11.574 ( 3.045 1.996 2.392) 4.356 11.693 ( -0.705 0.750 3.905) 4.038 11.931 ( -1.923 2.509 -0.034) 3.161 12.081 ( -0.295 -0.833 6.565) 6.624 12.248 ( 0.180 2.966 -4.587) 5.465 12.359 ( -0.103 1.975 -0.541) 2.051 12.833 ( -2.491 10.453 5.235) 11.953 12.943 ( -0.112 8.521 5.029) 9.895 16.075 ( -0.100 -1.382 -1.004) 1.711 16.094 ( 0.361 -1.861 -1.333) 2.317 17.133 ( 2.128 7.087 0.561) 7.421 17.354 ( -4.583 6.992 -2.161) 8.635 17.417 ( -0.078 8.685 1.382) 8.795 17.884 ( 6.951 4.158 -4.299) 9.170 18.564 ( -9.796 -14.972 -0.498) 17.899 18.774 ( 7.042 -17.698 -0.816) 19.065 ======================= Grid point 139 (71/170) ======================= q-point: (-0.36 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.913 ( 1.784 4.488 5.253) 7.135 2.069 ( 0.002 2.286 2.357) 3.284 2.466 ( -0.740 13.706 -1.416) 13.799 2.514 ( -1.429 3.857 -5.140) 6.583 2.702 ( -9.174 4.894 -10.321) 14.650 2.934 ( 0.757 0.700 5.968) 6.057 3.008 ( -6.816 -0.702 -3.400) 7.649 3.097 ( -2.166 -4.933 9.927) 11.294 3.323 ( -1.104 -5.724 8.055) 9.943 3.510 ( 5.905 -8.214 -9.704) 14.018 3.875 ( 0.551 5.395 4.468) 7.026 3.987 ( -4.525 10.052 3.108) 11.453 4.204 ( -0.252 1.083 0.676) 1.301 4.272 ( 1.642 5.428 -6.212) 8.411 4.398 ( -3.125 -1.352 2.833) 4.429 4.604 ( 8.479 -0.357 0.760) 8.521 4.929 ( 2.255 3.014 -5.298) 6.499 5.050 ( -0.853 -1.429 -6.608) 6.815 5.187 ( 1.693 -4.762 -1.135) 5.180 5.213 ( 3.633 -2.408 -2.260) 4.909 5.375 ( 0.430 -2.187 -0.699) 2.336 5.641 ( 2.833 -3.330 -3.465) 5.578 5.990 ( 5.231 -7.182 4.087) 9.780 6.081 ( 1.956 -9.175 -5.665) 10.959 6.398 ( 0.584 2.877 -1.171) 3.161 6.499 ( -0.523 1.373 3.268) 3.583 6.588 ( 3.144 -7.790 6.994) 10.931 6.806 ( -0.334 -8.783 3.708) 9.539 6.873 ( 2.797 2.597 -0.717) 3.883 7.128 ( -4.737 0.984 -4.736) 6.770 7.459 ( 3.657 -0.968 5.191) 6.423 7.482 ( 0.735 6.078 -1.780) 6.376 7.660 ( 0.079 2.351 -3.734) 4.414 7.766 ( 5.542 4.417 -4.043) 8.159 8.108 ( -5.542 4.615 3.189) 7.886 8.237 ( -2.986 0.814 3.064) 4.356 9.030 ( 0.867 -2.529 -3.758) 4.612 9.145 ( 4.662 -6.309 -5.485) 9.572 9.534 ( 1.395 -1.635 -0.188) 2.158 9.606 ( 1.261 -4.336 -1.691) 4.822 10.049 ( -1.847 0.118 1.385) 2.311 10.084 ( -2.585 0.117 -1.297) 2.894 11.316 ( 0.833 2.272 1.942) 3.103 11.409 ( -2.909 1.485 3.110) 4.510 11.648 ( 1.134 2.041 2.916) 3.736 11.700 ( -1.886 1.845 0.889) 2.785 11.890 ( -1.936 2.633 -0.605) 3.324 12.135 ( -2.725 -0.507 6.359) 6.937 12.190 ( -1.237 2.038 -3.741) 4.436 12.338 ( -1.656 0.097 0.125) 1.664 12.826 ( -5.452 8.742 4.800) 11.366 12.961 ( -4.450 7.608 4.084) 9.714 16.060 ( 0.019 -0.710 -1.143) 1.346 16.087 ( 0.575 -1.217 -1.273) 1.852 17.210 ( 1.096 3.459 3.084) 4.762 17.246 ( -1.628 4.843 0.403) 5.125 17.439 ( -0.714 5.748 3.616) 6.828 17.984 ( 12.748 0.378 -12.348) 17.752 18.365 ( -12.550 -5.640 2.145) 13.925 18.902 ( 8.946 -15.444 -0.992) 17.875 ======================= Grid point 140 (72/170) ======================= q-point: (-0.27 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.005 ( 3.142 3.381 3.022) 5.517 2.053 ( -3.089 7.906 -5.068) 9.886 2.326 ( -8.604 11.053 -12.783) 18.963 2.375 ( -3.060 5.673 2.434) 6.890 2.536 ( -2.102 6.203 -2.454) 6.994 2.851 ( -6.519 2.122 -2.836) 7.419 3.020 ( 2.542 -5.817 6.033) 8.758 3.223 ( -3.090 -8.430 12.808) 15.642 3.381 ( -2.668 -9.112 1.920) 9.687 3.508 ( 4.474 -6.548 -3.442) 8.645 3.826 ( -11.769 15.110 1.170) 19.188 3.909 ( -5.434 8.861 -3.043) 10.831 4.217 ( 5.239 8.203 2.652) 10.087 4.284 ( 1.670 -2.625 0.401) 3.137 4.438 ( 1.421 -1.069 4.334) 4.684 4.731 ( 4.097 3.218 0.827) 5.274 4.953 ( 3.424 -2.818 -7.088) 8.361 4.967 ( 8.792 3.579 -5.237) 10.841 5.220 ( 7.459 0.183 -2.490) 7.866 5.283 ( 3.239 -0.471 1.352) 3.541 5.456 ( 5.341 -4.643 3.952) 8.106 5.648 ( 3.610 -2.586 -4.837) 6.566 6.050 ( 0.200 -7.742 -1.594) 7.907 6.090 ( 0.867 -1.833 0.448) 2.077 6.391 ( 1.730 -3.466 -2.598) 4.664 6.480 ( -3.993 3.773 1.895) 5.811 6.695 ( -2.058 -2.590 -5.117) 6.094 6.716 ( -2.700 -6.721 -0.218) 7.247 6.927 ( 2.596 -6.710 1.167) 7.289 7.106 ( 0.344 0.599 6.306) 6.343 7.416 ( -2.842 4.090 -3.593) 6.141 7.552 ( 1.018 1.517 0.643) 1.937 7.686 ( 6.603 -1.184 -0.585) 6.734 7.836 ( 5.065 3.071 -2.598) 6.468 8.071 ( -3.396 3.956 5.504) 7.581 8.205 ( -4.339 0.555 1.997) 4.809 9.030 ( 3.749 -0.163 -2.474) 4.495 9.176 ( 4.679 -5.724 -1.885) 7.630 9.548 ( 2.929 -0.361 -1.577) 3.346 9.677 ( 5.827 -4.437 1.845) 7.553 9.996 ( -4.646 2.144 -0.517) 5.142 10.042 ( -1.711 0.221 0.096) 1.728 11.346 ( 0.001 1.373 0.823) 1.601 11.389 ( -2.336 0.873 2.078) 3.246 11.651 ( -3.100 0.760 0.209) 3.199 11.658 ( -2.421 2.055 -0.821) 3.280 11.875 ( 1.513 2.778 -1.327) 3.431 12.110 ( -4.550 1.871 -0.939) 5.009 12.127 ( -4.131 0.651 1.307) 4.382 12.321 ( -1.613 -2.269 1.612) 3.217 12.757 ( -7.504 5.255 2.026) 9.383 12.883 ( -8.486 4.712 1.798) 9.871 16.052 ( 0.477 0.233 -0.936) 1.076 16.085 ( 0.586 -0.424 -0.774) 1.059 17.169 ( -2.784 5.579 1.608) 6.439 17.315 ( 1.614 5.647 -2.541) 6.399 17.551 ( 1.987 -3.817 16.569) 17.118 17.900 ( -3.308 -10.018 -14.509) 17.939 18.306 ( 3.099 10.945 0.864) 11.408 19.050 ( 10.643 -13.260 -1.826) 17.100 ======================= Grid point 141 (73/170) ======================= q-point: (-0.18 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.885 ( -6.769 16.597 -4.353) 18.446 1.993 ( -5.976 19.139 -6.911) 21.208 2.158 ( 4.164 0.952 -1.668) 4.585 2.434 ( 2.081 0.758 4.822) 5.307 2.505 ( 0.217 5.935 0.362) 5.950 2.745 ( -2.238 -1.855 -2.965) 4.152 3.093 ( -4.719 -7.293 3.438) 9.342 3.217 ( -7.969 -1.676 3.483) 8.857 3.307 ( -2.505 -7.650 -1.842) 8.258 3.536 ( 1.958 -5.347 -2.310) 6.145 3.641 ( -9.633 8.014 1.930) 12.678 3.801 ( -4.842 10.664 1.526) 11.811 4.278 ( 1.361 -5.876 -0.927) 6.103 4.375 ( 1.020 14.919 6.726) 16.397 4.535 ( 4.315 -5.498 4.379) 8.248 4.809 ( 6.167 5.572 -0.408) 8.322 4.952 ( 1.646 -0.727 0.579) 1.890 5.095 ( 7.990 0.337 -4.127) 8.999 5.355 ( 10.374 6.285 -3.252) 12.558 5.418 ( 8.344 -3.799 7.486) 11.836 5.582 ( 2.014 -6.361 3.705) 7.632 5.668 ( 8.793 -2.801 -6.984) 11.573 6.012 ( -2.880 1.123 -1.028) 3.258 6.072 ( -0.473 -2.874 -1.625) 3.335 6.312 ( -6.087 -0.938 -8.411) 10.425 6.444 ( -2.620 1.383 -2.384) 3.803 6.507 ( -3.402 1.256 2.030) 4.156 6.761 ( 1.187 -3.648 -0.109) 3.838 6.966 ( 0.627 -5.077 1.370) 5.296 7.183 ( -3.344 -10.402 7.070) 13.014 7.325 ( -2.339 6.448 -2.546) 7.316 7.546 ( -1.919 3.004 -0.141) 3.567 7.791 ( 4.972 -3.965 -5.987) 8.735 7.856 ( 4.229 3.129 0.297) 5.269 8.110 ( -1.937 3.059 0.325) 3.635 8.158 ( -1.370 -3.173 3.857) 5.180 9.099 ( 6.415 2.420 -0.775) 6.900 9.272 ( 4.753 -3.128 4.291) 7.126 9.614 ( 6.701 2.026 -1.052) 7.080 9.812 ( 5.998 -2.932 2.472) 7.120 9.917 ( -3.592 1.032 0.480) 3.768 10.012 ( -1.621 -0.630 0.147) 1.745 11.316 ( -2.262 1.387 -1.605) 3.102 11.392 ( -0.960 -1.274 1.942) 2.513 11.583 ( -2.022 0.808 -2.308) 3.174 11.616 ( -1.704 0.581 -0.644) 1.912 11.876 ( -0.154 -0.036 -2.180) 2.186 12.004 ( -4.264 0.163 -3.648) 5.614 12.062 ( -4.212 2.123 0.764) 4.779 12.308 ( -2.154 -0.673 1.113) 2.517 12.619 ( -9.446 4.106 -0.773) 10.329 12.745 ( -8.264 -1.058 0.114) 8.332 16.056 ( 0.868 1.049 -0.321) 1.399 16.089 ( 0.410 0.345 -0.046) 0.537 17.149 ( -1.978 7.272 0.574) 7.558 17.263 ( -2.299 4.622 -3.247) 6.098 17.650 ( -8.993 -8.495 -6.147) 13.814 17.800 ( 2.686 -11.035 12.484) 16.877 18.408 ( 8.857 16.233 -0.814) 18.510 19.225 ( 11.689 -10.736 -0.241) 15.873 ======================= Grid point 142 (74/170) ======================= q-point: (-0.09 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.781 ( -3.565 22.320 1.955) 22.687 1.860 ( -0.696 24.514 -2.343) 24.636 2.249 ( 5.308 0.560 1.070) 5.444 2.487 ( 1.138 1.924 -0.309) 2.257 2.542 ( 3.119 3.026 -4.188) 6.035 2.694 ( -0.039 -9.395 -0.319) 9.401 2.913 ( -12.335 -2.913 -1.983) 12.828 3.178 ( -1.457 3.689 5.088) 6.451 3.286 ( -0.577 -5.687 1.755) 5.980 3.495 ( -8.926 7.159 3.931) 12.099 3.587 ( 4.096 -12.333 -4.349) 13.704 3.756 ( -4.664 10.883 3.770) 12.426 4.313 ( 1.240 -4.867 3.550) 6.150 4.422 ( -1.199 12.673 3.594) 13.228 4.673 ( 2.724 -7.914 7.156) 11.012 4.879 ( 3.721 4.232 -4.829) 7.421 4.997 ( -0.010 -1.272 1.729) 2.146 5.113 ( -1.369 3.774 2.271) 4.612 5.465 ( 10.214 5.634 -7.864) 14.068 5.588 ( 2.430 -3.652 -2.146) 4.883 5.686 ( 4.938 -6.530 6.773) 10.626 5.747 ( 4.456 -4.286 -2.690) 6.742 5.981 ( 0.601 1.388 1.265) 1.972 6.060 ( 0.910 3.055 -0.976) 3.334 6.146 ( 1.382 1.807 -3.404) 4.095 6.370 ( -5.949 11.394 4.812) 13.725 6.572 ( 4.138 -4.928 2.664) 6.964 6.717 ( -4.049 0.062 -3.242) 5.188 7.001 ( 1.130 -3.797 1.806) 4.354 7.155 ( -5.989 -12.289 4.550) 14.408 7.282 ( -1.757 5.656 -0.321) 5.931 7.475 ( -4.390 5.421 -2.112) 7.288 7.758 ( 0.820 2.826 -3.714) 4.739 7.956 ( 6.463 -4.781 -3.848) 8.913 8.025 ( -1.883 -0.630 -4.692) 5.095 8.192 ( -0.970 -8.865 0.992) 8.972 9.207 ( 5.709 4.005 0.541) 6.995 9.375 ( -0.098 -1.094 3.978) 4.127 9.728 ( 6.232 2.994 -1.263) 7.029 9.871 ( -1.897 -1.339 -4.195) 4.795 9.909 ( 2.849 0.920 5.241) 6.036 10.064 ( 2.442 -2.207 8.304) 8.933 11.252 ( -1.782 1.390 -2.141) 3.113 11.405 ( 0.064 -3.044 2.488) 3.932 11.530 ( -1.909 0.766 -2.167) 2.988 11.595 ( 1.850 -1.506 -2.508) 3.461 11.817 ( -2.606 -1.098 -1.796) 3.350 11.895 ( -3.371 -1.479 -3.508) 5.085 12.031 ( 0.432 2.800 -0.673) 2.912 12.277 ( -1.210 2.762 -0.880) 3.141 12.452 ( -8.456 4.532 -0.942) 9.640 12.624 ( -4.706 -6.474 -1.911) 8.229 16.072 ( 0.903 1.525 0.493) 1.840 16.096 ( 0.017 0.985 0.630) 1.170 17.098 ( -2.105 7.011 -3.138) 7.964 17.186 ( -1.532 3.720 -3.829) 5.554 17.479 ( -4.652 -5.942 -2.366) 7.908 17.855 ( -2.823 -13.224 -3.613) 13.996 18.602 ( 6.831 16.755 10.269) 20.805 19.424 ( 8.654 -8.948 3.373) 12.897 ======================= Grid point 143 (75/170) ======================= q-point: ( 0.00 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.154 ( -0.667 13.953 -2.402) 14.174 2.301 ( 5.639 11.416 4.912) 13.647 2.342 ( -0.160 -2.917 -12.844) 13.172 2.414 ( 2.223 -1.105 6.248) 6.723 2.546 ( 0.153 2.057 0.495) 2.121 2.630 ( 4.439 -4.927 0.745) 6.674 2.748 ( -3.948 3.579 -0.467) 5.350 2.919 ( -2.431 -13.324 -0.400) 13.550 3.190 ( -0.667 0.640 -2.916) 3.059 3.325 ( 0.805 -11.352 -5.437) 12.613 3.822 ( -0.773 11.177 7.977) 13.753 3.908 ( -0.760 1.775 6.776) 7.046 4.353 ( -2.586 3.245 6.765) 7.936 4.493 ( -3.831 -9.675 5.936) 11.980 4.768 ( -3.414 17.253 2.633) 17.783 4.926 ( 3.245 0.184 -0.450) 3.281 5.057 ( 1.178 2.136 1.089) 2.671 5.125 ( -7.414 -2.441 4.051) 8.794 5.452 ( -6.094 -1.152 -4.364) 7.584 5.504 ( -2.868 -5.753 -2.817) 7.018 5.693 ( 9.699 0.654 -3.278) 10.259 5.724 ( 9.095 -2.558 -3.177) 9.968 6.162 ( 4.365 3.546 5.964) 8.198 6.186 ( -0.034 3.678 2.326) 4.352 6.349 ( 5.852 3.645 5.640) 8.907 6.457 ( -2.655 -5.179 1.945) 6.137 6.547 ( -3.222 8.895 2.284) 9.732 6.734 ( 3.375 -5.324 0.191) 6.307 6.883 ( -5.142 0.411 4.593) 6.907 6.982 ( -3.209 -5.682 2.558) 7.009 7.342 ( 0.536 7.422 -1.747) 7.644 7.516 ( 0.575 -3.335 -1.775) 3.822 7.694 ( 1.827 -0.265 -6.163) 6.434 7.843 ( 1.006 -8.977 -6.721) 11.260 7.946 ( -2.611 0.002 -5.033) 5.670 7.964 ( 0.325 -0.485 -5.136) 5.169 9.322 ( -0.843 1.808 -0.668) 2.104 9.351 ( -2.677 -1.061 -0.232) 2.889 9.782 ( 0.419 0.354 -2.896) 2.947 9.786 ( 1.581 0.050 -2.945) 3.343 10.088 ( -1.330 4.369 9.905) 10.907 10.160 ( -2.444 -2.559 11.437) 11.972 11.282 ( 1.335 2.669 0.590) 3.042 11.349 ( 0.116 -4.027 1.425) 4.274 11.514 ( 0.598 2.272 -1.559) 2.820 11.570 ( 1.545 -3.156 -1.541) 3.837 11.775 ( 0.840 0.644 -0.635) 1.234 11.805 ( 1.140 -2.100 -0.837) 2.532 12.107 ( 2.030 5.621 -4.390) 7.416 12.236 ( 3.069 -6.767 -5.430) 9.203 12.415 ( -2.554 4.753 -0.291) 5.403 12.475 ( -1.439 -1.639 -0.993) 2.397 16.119 ( 0.140 0.769 1.243) 1.468 16.122 ( -0.067 0.422 1.161) 1.237 17.137 ( -0.018 4.663 -4.866) 6.739 17.191 ( 2.375 0.818 -7.413) 7.827 17.361 ( -0.985 0.374 -1.144) 1.555 17.481 ( -1.790 -9.352 -9.290) 13.303 19.106 ( -0.633 14.169 11.662) 18.362 19.360 ( -0.556 -11.266 7.789) 13.707 ======================= Grid point 144 (76/170) ======================= q-point: ( 0.09 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.134 ( 0.239 6.133 0.097) 6.138 2.216 ( -0.781 -1.688 -5.809) 6.100 2.470 ( 6.193 8.644 2.494) 10.922 2.555 ( 1.368 0.999 7.712) 7.896 2.561 ( 4.175 1.174 -2.361) 4.938 2.642 ( 0.819 -4.426 -0.680) 4.552 2.739 ( 1.865 5.396 1.558) 5.918 2.900 ( 1.197 -9.360 -4.104) 10.290 3.117 ( -1.203 1.754 -4.812) 5.261 3.264 ( 2.799 -10.430 -6.446) 12.576 3.917 ( -1.024 8.101 7.390) 11.013 3.986 ( -0.560 0.789 4.797) 4.893 4.390 ( -1.907 2.521 7.402) 8.049 4.482 ( -4.293 -6.283 5.563) 9.426 4.704 ( -7.587 17.832 3.134) 19.631 4.953 ( -7.520 -6.542 2.889) 10.378 5.038 ( 0.012 3.807 0.447) 3.833 5.094 ( 1.050 -1.667 -1.650) 2.570 5.343 ( -3.110 0.758 2.167) 3.865 5.429 ( -2.646 -5.911 -1.384) 6.623 5.786 ( 1.422 1.055 0.410) 1.818 5.801 ( 2.561 -0.700 -2.022) 3.337 6.151 ( -2.193 5.563 0.753) 6.027 6.204 ( -2.837 0.570 1.556) 3.286 6.478 ( -2.353 6.483 2.071) 7.201 6.496 ( 1.149 2.362 3.083) 4.050 6.562 ( 0.693 -2.891 7.909) 8.449 6.710 ( -8.777 -11.572 -0.297) 14.527 6.877 ( 1.471 5.793 3.701) 7.030 6.962 ( 0.280 -2.991 2.397) 3.843 7.367 ( 4.044 4.653 -2.168) 6.535 7.530 ( 2.357 -5.367 -1.831) 6.141 7.643 ( 1.046 -0.791 -7.805) 7.915 7.766 ( 1.266 -6.936 -6.337) 9.480 7.895 ( 3.635 2.453 -5.662) 7.162 7.934 ( 4.251 -1.014 -6.146) 7.541 9.281 ( -3.666 0.404 0.675) 3.749 9.295 ( -3.058 -1.341 1.533) 3.675 9.763 ( -0.457 0.637 -1.195) 1.429 9.774 ( -0.528 -0.428 -1.640) 1.776 10.121 ( -7.099 4.062 9.017) 12.174 10.169 ( -9.256 -0.609 8.583) 12.638 11.308 ( 1.510 2.008 -1.097) 2.741 11.357 ( -0.279 -2.974 0.099) 2.989 11.545 ( 3.417 1.873 -0.818) 3.981 11.580 ( 0.771 -1.525 0.017) 1.709 11.829 ( 4.171 -0.448 -1.458) 4.441 11.854 ( 6.254 -2.747 -1.467) 6.986 12.081 ( 1.756 5.555 -3.834) 6.974 12.201 ( 0.911 -6.140 -4.147) 7.465 12.456 ( 7.576 4.141 -1.776) 8.815 12.505 ( 6.877 -0.713 -2.258) 7.273 16.127 ( -0.989 0.837 1.379) 1.892 16.133 ( -0.605 0.241 1.397) 1.541 17.070 ( 1.833 4.412 -8.040) 9.352 17.153 ( 2.673 -3.237 -9.723) 10.590 17.351 ( 2.692 2.075 -1.075) 3.565 17.452 ( 8.003 -7.048 -2.012) 10.852 19.153 ( -10.297 11.498 11.547) 19.276 19.355 ( -10.222 -8.828 6.736) 15.093 ======================= Grid point 145 (77/170) ======================= q-point: ( 0.18 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.128 ( -0.781 2.433 -1.660) 3.047 2.170 ( -1.574 -1.195 -0.667) 2.085 2.481 ( 1.553 2.273 -8.873) 9.290 2.537 ( 0.574 -4.038 -1.257) 4.268 2.722 ( 4.571 3.370 5.707) 8.052 2.784 ( 6.079 -1.273 3.074) 6.930 2.803 ( 2.398 3.236 5.708) 6.986 2.837 ( 2.344 -1.307 -3.615) 4.502 3.103 ( 4.437 7.226 -0.678) 8.506 3.317 ( 9.056 -10.818 -2.835) 14.390 3.891 ( -6.545 4.741 -0.673) 8.110 3.958 ( -4.534 -1.539 -1.197) 4.936 4.463 ( -2.074 5.089 7.927) 9.646 4.484 ( -2.159 3.019 2.677) 4.577 4.630 ( -6.477 6.739 6.531) 11.402 4.806 ( -9.752 -6.305 1.393) 11.696 5.055 ( 1.030 0.942 -2.647) 2.993 5.074 ( 0.435 -0.920 -2.059) 2.297 5.354 ( -3.631 0.120 4.997) 6.178 5.364 ( -4.506 -0.620 -0.422) 4.568 5.750 ( -6.830 2.029 3.897) 8.121 5.772 ( -3.805 -0.560 0.941) 3.959 6.132 ( -4.651 2.803 3.399) 6.407 6.200 ( -1.862 -2.594 4.112) 5.206 6.385 ( -3.121 3.512 -3.425) 5.814 6.512 ( -5.953 -7.253 -4.166) 10.266 6.553 ( -4.063 0.566 2.548) 4.829 6.606 ( -1.468 -2.322 -1.795) 3.281 6.944 ( 1.388 5.493 0.408) 5.680 7.042 ( 2.962 -3.991 5.001) 7.051 7.440 ( 6.057 -0.688 -1.070) 6.189 7.491 ( -0.762 -4.155 -1.685) 4.548 7.627 ( 4.762 6.230 -3.177) 8.461 7.751 ( 3.228 -6.246 -4.402) 8.295 7.922 ( 6.272 3.581 -3.797) 8.160 7.974 ( 7.141 -1.772 -4.143) 8.444 9.240 ( -3.775 1.177 3.107) 5.028 9.284 ( -2.318 -3.564 3.292) 5.377 9.725 ( -3.852 0.155 0.098) 3.856 9.730 ( -3.479 -0.280 1.699) 3.882 10.080 ( -6.905 2.449 4.073) 8.383 10.103 ( -6.260 0.129 4.854) 7.923 11.312 ( 0.863 1.246 -1.371) 2.043 11.343 ( -0.647 -1.980 -0.926) 2.279 11.564 ( 1.071 2.674 -1.929) 3.467 11.613 ( 1.999 -1.842 0.129) 2.721 11.844 ( 3.034 1.800 -5.671) 6.678 11.893 ( 3.007 -2.377 -5.441) 6.656 12.133 ( 6.386 3.707 0.266) 7.389 12.219 ( 4.128 -4.889 -0.224) 6.402 12.583 ( 9.728 4.404 -2.366) 10.937 12.630 ( 10.515 -0.080 -2.820) 10.887 16.119 ( -1.498 0.905 0.937) 1.985 16.131 ( -1.269 -0.307 1.073) 1.690 17.037 ( 3.660 2.365 -5.652) 7.137 17.085 ( 3.023 -2.586 -6.476) 7.600 17.466 ( 9.231 6.656 1.190) 11.443 17.634 ( 13.408 -9.882 0.327) 16.659 19.025 ( -18.547 8.806 8.458) 22.205 19.181 ( -17.010 -7.128 3.708) 18.812 ======================= Grid point 146 (78/170) ======================= q-point: ( 0.27 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.063 ( -5.740 3.196 -0.091) 6.570 2.122 ( -3.094 -2.788 0.562) 4.203 2.396 ( 0.297 4.795 -7.682) 9.061 2.526 ( 0.166 -8.230 -2.187) 8.518 2.740 ( 3.037 7.368 -4.784) 9.294 2.839 ( 7.211 -0.392 -1.735) 7.427 2.990 ( 3.338 -1.789 6.589) 7.600 3.013 ( 8.654 -2.514 6.626) 11.186 3.248 ( 9.405 11.788 6.200) 16.305 3.465 ( 11.111 -8.661 -2.114) 14.245 3.753 ( -5.060 4.871 -3.052) 7.658 3.847 ( -5.563 -3.542 -1.700) 6.810 4.399 ( -7.830 14.568 1.245) 16.586 4.505 ( -3.150 4.518 2.327) 5.979 4.592 ( -5.753 -4.135 1.442) 7.230 4.680 ( -8.726 -9.939 3.326) 13.638 5.021 ( -0.067 2.845 -3.347) 4.393 5.078 ( 1.977 -2.885 -1.918) 3.988 5.258 ( -6.005 2.528 -0.229) 6.519 5.315 ( -5.176 -3.138 2.328) 6.485 5.693 ( -7.230 2.984 7.451) 10.802 5.735 ( -3.961 -1.291 4.491) 6.126 6.078 ( -5.664 2.688 3.290) 7.080 6.184 ( -5.649 -7.792 3.937) 10.398 6.295 ( -3.447 1.053 -6.350) 7.301 6.358 ( -5.319 -4.684 -5.682) 9.084 6.454 ( -3.656 3.631 -5.784) 7.746 6.540 ( -1.571 -5.035 -3.374) 6.262 6.975 ( 1.364 4.738 2.090) 5.356 7.094 ( 0.003 -7.329 -0.137) 7.331 7.488 ( 2.307 7.212 2.814) 8.078 7.582 ( 3.326 -0.779 2.985) 4.537 7.689 ( 6.667 4.153 -1.691) 8.034 7.780 ( 6.096 -4.318 -3.402) 8.209 8.009 ( 6.817 2.886 -0.890) 7.456 8.058 ( 6.286 -1.970 -1.054) 6.671 9.210 ( -4.321 1.297 2.635) 5.225 9.266 ( -4.355 -4.307 2.137) 6.487 9.668 ( -3.644 1.630 1.710) 4.343 9.702 ( -3.767 -1.631 4.229) 5.894 10.011 ( -3.084 2.646 -0.238) 4.070 10.065 ( -2.522 -2.659 0.799) 3.751 11.302 ( -0.391 0.960 -1.260) 1.631 11.327 ( -0.235 -1.466 0.025) 1.485 11.548 ( 0.437 3.579 -2.589) 4.439 11.621 ( -0.162 -3.399 -1.384) 3.673 11.850 ( 4.850 2.442 -3.347) 6.379 11.890 ( 3.613 -1.246 -3.278) 5.035 12.249 ( 6.352 2.541 0.083) 6.842 12.297 ( 4.847 -2.184 -0.663) 5.358 12.718 ( 8.464 5.044 -1.080) 9.912 12.766 ( 8.766 0.323 -2.241) 9.054 16.100 ( -1.418 0.653 0.286) 1.587 16.116 ( -1.460 -0.849 0.386) 1.733 17.063 ( 5.847 4.360 -2.793) 7.810 17.135 ( 7.206 -2.272 -1.004) 7.622 17.641 ( 8.341 10.043 1.515) 13.143 17.878 ( 13.740 -13.146 0.972) 19.041 18.742 ( -22.879 7.356 3.961) 24.357 18.896 ( -19.057 -8.183 1.035) 20.765 ======================= Grid point 147 (79/170) ======================= q-point: ( 0.36 0.44 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.968 ( -7.146 5.928 3.736) 10.009 2.082 ( -6.006 -5.486 5.476) 9.806 2.341 ( 3.788 7.601 -6.708) 10.822 2.508 ( 1.239 -7.170 -0.737) 7.314 2.795 ( 5.507 4.582 -0.525) 7.183 2.875 ( 2.254 -1.144 -4.689) 5.327 3.112 ( 4.057 5.154 4.374) 7.883 3.214 ( 8.090 -3.467 2.729) 9.215 3.513 ( 11.917 5.438 2.057) 13.260 3.567 ( 8.395 0.669 -13.535) 15.941 3.708 ( -0.149 0.358 1.037) 1.107 3.762 ( -4.063 -3.911 8.042) 9.822 4.249 ( -9.904 10.766 -0.548) 14.639 4.395 ( -9.348 -0.239 -1.468) 9.466 4.513 ( -5.394 -1.576 2.697) 6.233 4.589 ( -6.115 -10.099 4.114) 12.502 4.953 ( -2.204 4.434 -4.447) 6.656 5.056 ( -1.347 -5.352 -3.552) 6.563 5.210 ( -2.053 3.154 3.073) 4.859 5.279 ( -1.773 -3.691 1.686) 4.428 5.683 ( -3.207 2.945 5.263) 6.831 5.742 ( -1.884 -2.026 3.718) 4.634 6.031 ( -3.346 0.740 -11.298) 11.806 6.055 ( -4.539 1.540 -1.241) 4.952 6.141 ( -6.148 -3.488 -8.624) 11.150 6.184 ( -4.281 -6.297 4.625) 8.909 6.424 ( 0.063 0.105 2.623) 2.626 6.487 ( -1.690 -6.201 -0.095) 6.428 7.035 ( 1.437 2.253 3.473) 4.383 7.075 ( -0.331 -1.738 -1.939) 2.625 7.549 ( 0.270 6.478 2.412) 6.918 7.608 ( -1.243 1.508 0.539) 2.027 7.802 ( 7.908 3.298 -3.300) 9.182 7.850 ( 5.737 -1.521 -3.703) 6.996 8.114 ( 4.742 2.642 1.618) 5.664 8.159 ( 4.611 -1.912 1.931) 5.352 9.148 ( -4.391 0.374 -0.250) 4.414 9.187 ( -5.525 -3.399 -0.396) 6.498 9.636 ( -1.875 2.804 -0.435) 3.401 9.688 ( -3.027 -2.105 2.268) 4.329 9.989 ( 0.141 0.817 1.021) 1.315 10.038 ( -0.333 -4.112 -0.703) 4.185 11.287 ( -0.399 2.257 0.714) 2.401 11.334 ( -0.284 -2.331 1.894) 3.016 11.533 ( 0.634 3.459 -1.034) 3.666 11.602 ( -0.237 -3.189 -0.176) 3.203 11.917 ( 4.498 1.606 0.083) 4.776 11.937 ( 3.536 -0.288 0.431) 3.574 12.334 ( 4.232 1.856 -1.443) 4.841 12.353 ( 3.978 0.324 -2.471) 4.694 12.842 ( 5.907 4.569 1.588) 7.635 12.874 ( 5.644 1.524 0.185) 5.850 16.081 ( -0.860 0.173 -0.292) 0.924 16.094 ( -1.126 -1.138 -0.262) 1.622 17.166 ( 8.254 7.423 -0.967) 11.143 17.276 ( 9.906 -2.613 -0.580) 10.261 17.739 ( 1.091 14.516 0.094) 14.557 18.082 ( 7.285 -19.394 0.275) 20.719 18.392 ( -18.915 10.333 0.881) 21.571 18.611 ( -14.449 -11.981 0.920) 18.793 ======================= Grid point 148 (80/170) ======================= q-point: ( 0.45 0.44 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.922 ( -5.133 6.591 6.287) 10.455 2.047 ( -6.035 -5.646 6.197) 10.330 2.379 ( 6.358 9.235 -1.574) 11.322 2.570 ( 3.001 -7.582 4.776) 9.450 2.875 ( 3.475 2.480 1.467) 4.514 2.899 ( 2.772 3.457 2.540) 5.108 3.145 ( -1.865 7.669 -3.836) 8.775 3.313 ( 1.614 -6.093 -2.753) 6.878 3.455 ( 0.820 3.037 -14.504) 14.841 3.509 ( 1.012 -3.772 -16.167) 16.632 3.832 ( 5.701 5.161 9.924) 12.555 3.901 ( 3.053 -1.443 7.699) 8.407 4.135 ( -1.457 3.748 0.412) 4.042 4.237 ( -5.075 -4.305 0.412) 6.668 4.478 ( -5.731 0.488 6.007) 8.317 4.548 ( -6.727 -5.648 5.428) 10.325 4.899 ( 1.970 3.792 -2.242) 4.825 4.988 ( -0.133 -4.452 -4.199) 6.122 5.207 ( -2.372 2.448 1.598) 3.765 5.268 ( -0.989 -3.308 -0.909) 3.570 5.642 ( -5.243 0.268 -5.309) 7.466 5.666 ( -4.196 -1.932 -7.606) 8.899 5.823 ( 0.960 3.440 -9.291) 9.954 5.959 ( 0.671 -9.946 -5.397) 11.335 6.158 ( 1.695 3.432 9.268) 10.028 6.241 ( 1.382 -4.367 8.693) 9.826 6.464 ( -1.166 -1.323 4.402) 4.742 6.500 ( 0.892 -4.557 4.573) 6.517 7.029 ( -1.439 4.381 -2.284) 5.146 7.105 ( 1.285 -2.855 3.255) 4.516 7.532 ( -2.065 5.869 -2.419) 6.675 7.591 ( -1.067 1.354 0.172) 1.732 7.846 ( 4.389 2.761 -6.699) 8.471 7.863 ( 2.630 0.160 -6.200) 6.737 8.194 ( 1.083 2.751 3.001) 4.213 8.234 ( 0.909 -1.226 2.321) 2.778 9.078 ( -1.236 -1.159 -2.708) 3.195 9.092 ( -3.184 -2.457 -2.640) 4.811 9.581 ( -1.276 2.872 -3.813) 4.941 9.644 ( -2.474 -3.070 -1.851) 4.356 10.019 ( 0.193 0.059 2.681) 2.688 10.052 ( 1.078 -3.259 1.561) 3.771 11.308 ( -0.270 2.841 3.320) 4.378 11.360 ( -0.667 -2.226 3.806) 4.459 11.555 ( 1.557 3.196 1.897) 4.029 11.620 ( 0.359 -2.924 3.064) 4.250 11.979 ( 1.674 1.721 0.803) 2.531 12.002 ( 1.773 -0.568 2.415) 3.050 12.351 ( 1.506 2.783 -3.173) 4.481 12.381 ( 2.175 0.137 -2.095) 3.023 12.945 ( 2.166 4.748 4.025) 6.590 12.970 ( 2.911 2.238 4.066) 5.478 16.066 ( -0.182 -0.268 -0.704) 0.775 16.075 ( -0.418 -1.118 -0.756) 1.413 17.278 ( 6.027 9.298 -2.713) 11.408 17.415 ( 7.468 -3.089 -3.415) 8.774 17.685 ( -3.980 14.576 -1.956) 15.236 17.962 ( -10.846 -9.369 -4.746) 15.098 18.337 ( 3.365 -1.946 4.491) 5.940 18.462 ( -6.276 -11.548 3.068) 13.497 ======================= Grid point 149 (81/170) ======================= q-point: (-0.45 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.939 ( -1.563 5.297 5.881) 8.068 2.034 ( -2.840 -3.998 4.695) 6.789 2.499 ( 6.469 9.433 2.373) 11.681 2.700 ( 2.600 -9.084 8.226) 12.527 2.934 ( -4.034 10.195 0.058) 10.964 2.963 ( -0.009 8.872 -1.091) 8.939 3.016 ( -2.422 -2.013 -1.710) 3.584 3.201 ( -5.270 -6.622 -2.693) 8.881 3.267 ( -5.807 0.796 -10.558) 12.076 3.365 ( 1.768 -6.924 -9.889) 12.201 3.959 ( -0.890 5.707 3.386) 6.695 4.033 ( 4.960 -0.363 4.486) 6.698 4.160 ( 2.770 5.226 0.591) 5.944 4.303 ( 8.447 -5.458 -0.838) 10.092 4.446 ( -5.759 1.603 6.340) 8.714 4.496 ( -3.398 -2.501 3.213) 5.303 4.951 ( 5.628 0.550 -4.834) 7.439 4.977 ( 4.001 -1.787 -1.368) 4.591 5.157 ( -2.332 1.223 -2.591) 3.694 5.207 ( -1.202 -3.582 -5.989) 7.081 5.467 ( -3.624 2.562 -5.071) 6.739 5.554 ( -0.738 -5.277 -2.549) 5.906 5.817 ( 4.268 1.669 -3.153) 5.563 5.923 ( 1.554 -8.923 -5.437) 10.564 6.317 ( 4.145 1.730 8.354) 9.485 6.385 ( 2.594 -4.056 7.377) 8.809 6.507 ( -0.311 3.209 5.227) 6.142 6.595 ( 1.599 -5.438 6.330) 8.497 6.983 ( -0.561 7.962 -1.629) 8.147 7.143 ( -0.707 -7.816 1.374) 7.967 7.461 ( -1.080 7.619 -3.174) 8.324 7.565 ( -0.866 -1.418 -1.984) 2.588 7.794 ( 0.100 2.854 -7.172) 7.720 7.825 ( 2.199 0.664 -6.741) 7.121 8.215 ( -2.676 2.469 3.262) 4.889 8.248 ( -2.335 -0.798 2.980) 3.869 9.027 ( 0.344 -1.026 -4.373) 4.505 9.046 ( 2.343 -2.891 -4.765) 6.046 9.526 ( 0.152 1.574 -3.238) 3.604 9.575 ( -1.395 -3.274 -3.402) 4.923 10.051 ( -0.350 0.943 2.609) 2.796 10.082 ( -0.073 -2.083 1.446) 2.537 11.342 ( -0.871 3.054 3.852) 4.992 11.394 ( -1.690 -1.907 4.971) 5.586 11.624 ( 1.825 2.858 4.318) 5.490 11.676 ( 0.189 -2.106 4.975) 5.406 11.987 ( -0.630 2.992 -0.557) 3.108 12.044 ( 0.285 -2.611 1.774) 3.169 12.321 ( -1.283 3.812 -2.140) 4.556 12.373 ( -0.915 -0.989 -1.094) 1.736 13.004 ( -2.336 5.963 5.811) 8.647 13.048 ( -1.217 1.691 5.835) 6.195 16.057 ( 0.280 -0.284 -0.949) 1.030 16.065 ( 0.501 -1.010 -1.056) 1.545 17.275 ( -1.480 7.143 -2.260) 7.637 17.389 ( -4.200 -3.200 -4.333) 6.830 17.626 ( 0.861 12.212 -3.404) 12.707 17.853 ( 5.620 -8.412 -7.971) 12.879 18.393 ( -3.701 -0.709 5.661) 6.800 18.495 ( 4.871 -9.937 3.631) 11.647 ======================= Grid point 150 (82/170) ======================= q-point: (-0.36 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.995 ( 1.079 3.824 4.008) 5.644 2.060 ( 0.582 -2.441 2.906) 3.839 2.602 ( 0.890 7.041 -0.882) 7.151 2.731 ( -4.232 -2.666 -9.542) 10.773 2.767 ( -4.475 10.591 -6.124) 13.026 2.884 ( -1.624 -3.017 5.845) 6.775 3.021 ( -4.621 -0.266 6.144) 7.693 3.047 ( -9.073 0.184 -1.473) 9.194 3.226 ( -0.641 -1.228 7.805) 7.927 3.331 ( 2.976 -8.988 -5.174) 10.790 3.992 ( 0.297 6.166 5.349) 8.168 4.110 ( -0.438 -5.221 4.827) 7.124 4.194 ( 0.902 7.860 -4.243) 8.978 4.301 ( -1.008 -3.124 -7.246) 7.954 4.493 ( 3.149 7.140 4.293) 8.907 4.587 ( 8.684 -2.197 2.054) 9.190 4.955 ( 4.901 1.748 -7.626) 9.232 5.033 ( 3.342 -3.370 -4.526) 6.558 5.120 ( 3.070 -0.737 -0.642) 3.221 5.150 ( 2.621 -2.799 -3.641) 5.287 5.427 ( 0.791 6.336 0.134) 6.387 5.557 ( 1.597 -5.474 0.123) 5.704 5.875 ( 6.307 -3.591 -1.728) 7.460 5.896 ( 3.035 -6.048 -4.827) 8.312 6.471 ( 2.143 -0.245 3.457) 4.075 6.478 ( 2.683 -2.337 4.998) 6.135 6.527 ( -2.643 5.295 1.936) 6.227 6.654 ( -1.713 -6.903 2.265) 7.464 6.988 ( 0.635 7.044 0.520) 7.092 7.103 ( -2.641 -3.872 -1.252) 4.851 7.463 ( 2.116 2.036 1.360) 3.236 7.520 ( -0.598 -2.311 -2.774) 3.660 7.725 ( 0.379 4.753 -4.049) 6.256 7.797 ( 2.832 -1.421 -4.416) 5.435 8.189 ( -4.819 3.410 3.651) 6.941 8.235 ( -3.832 -1.152 3.700) 5.450 9.004 ( 3.210 0.180 -4.446) 5.487 9.042 ( 4.376 -3.698 -5.343) 7.834 9.519 ( 2.090 0.156 -1.522) 2.590 9.541 ( 1.887 -2.147 -1.991) 3.483 10.061 ( -1.336 0.922 1.424) 2.159 10.078 ( -1.654 -0.659 0.398) 1.824 11.366 ( -1.398 2.623 3.464) 4.564 11.409 ( -2.966 -1.388 4.164) 5.297 11.688 ( -0.670 1.854 3.615) 4.117 11.713 ( -1.907 -0.471 2.871) 3.478 11.963 ( 0.214 4.719 -1.797) 5.054 12.065 ( 0.878 -5.128 0.663) 5.244 12.259 ( -4.510 4.108 -0.092) 6.101 12.324 ( -4.120 -2.019 0.206) 4.593 12.987 ( -7.303 6.333 4.824) 10.803 13.046 ( -6.628 0.684 4.686) 8.146 16.055 ( 0.810 0.146 -1.050) 1.334 16.065 ( 1.035 -0.899 -1.102) 1.759 17.255 ( -0.860 1.725 2.823) 3.418 17.283 ( -2.858 -0.594 0.843) 3.039 17.598 ( -0.158 10.376 -3.963) 11.108 17.831 ( 2.537 -12.210 -10.752) 16.466 18.433 ( 2.733 8.966 3.629) 10.051 18.638 ( 8.298 -11.519 1.330) 14.259 ======================= Grid point 151 (83/170) ======================= q-point: (-0.27 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.067 ( 3.046 3.129 2.787) 5.180 2.112 ( 2.712 -0.695 0.195) 2.806 2.450 ( -7.258 5.047 -6.366) 10.894 2.510 ( -7.384 1.567 -6.608) 10.032 2.725 ( -0.513 11.173 -2.475) 11.455 2.895 ( 0.502 -4.631 -1.465) 4.883 2.957 ( -6.090 4.866 3.859) 8.699 3.056 ( -4.677 -6.354 11.358) 13.830 3.231 ( -3.759 -3.293 1.292) 5.162 3.332 ( 1.513 -10.081 -2.949) 10.612 4.025 ( -7.601 6.810 3.999) 10.961 4.075 ( -7.048 4.098 -1.615) 8.311 4.190 ( 3.822 -0.711 -0.476) 3.916 4.250 ( 4.984 -5.422 0.009) 7.364 4.611 ( 3.876 12.039 4.778) 13.520 4.748 ( 7.256 -2.298 1.684) 7.796 4.961 ( 4.665 4.466 -4.697) 7.985 5.041 ( 5.061 0.972 -4.063) 6.562 5.191 ( 6.963 -0.112 -1.251) 7.076 5.247 ( 9.481 -5.884 0.460) 11.168 5.456 ( 2.372 5.493 -0.519) 6.005 5.579 ( 2.411 -5.111 -2.761) 6.289 5.929 ( 6.307 -2.133 -2.711) 7.189 5.990 ( 8.129 -6.545 -0.685) 10.459 6.401 ( -3.763 3.787 -5.760) 7.853 6.482 ( -4.302 -2.878 -4.986) 7.187 6.602 ( 1.209 -2.332 5.213) 5.837 6.638 ( -0.477 -4.341 5.182) 6.776 6.943 ( -3.287 6.808 -3.139) 8.185 7.072 ( -3.234 -4.675 1.424) 5.860 7.469 ( -0.514 2.913 -1.182) 3.185 7.543 ( 2.155 -3.559 1.517) 4.428 7.723 ( 2.392 5.381 -0.774) 5.940 7.827 ( 3.909 -3.768 -1.005) 5.521 8.149 ( -4.909 3.740 3.889) 7.294 8.202 ( -4.875 -1.345 2.945) 5.852 9.042 ( 6.078 1.315 -2.196) 6.594 9.086 ( 6.241 -3.287 -1.791) 7.277 9.559 ( 5.006 1.390 -1.089) 5.308 9.603 ( 5.956 -3.008 0.431) 6.687 10.031 ( -3.335 1.253 -0.213) 3.569 10.044 ( -2.292 -0.164 -0.077) 2.299 11.372 ( -1.815 1.223 1.978) 2.950 11.391 ( -3.415 -0.532 2.221) 4.108 11.671 ( -3.548 1.004 0.269) 3.697 11.682 ( -3.361 0.137 0.311) 3.378 11.957 ( 0.983 5.479 -2.406) 6.064 12.071 ( -0.791 -5.186 -1.992) 5.612 12.175 ( -6.073 3.918 1.977) 7.493 12.255 ( -4.270 -3.864 1.388) 5.923 12.873 ( -10.662 5.301 2.221) 12.112 12.933 ( -10.950 -0.269 1.829) 11.105 16.061 ( 1.228 0.609 -0.840) 1.608 16.074 ( 1.257 -0.657 -0.775) 1.616 17.267 ( -0.769 4.742 4.168) 6.360 17.358 ( 2.802 -3.180 4.700) 6.329 17.531 ( -4.379 4.974 1.153) 6.727 17.693 ( -4.656 -9.995 -8.063) 13.660 18.557 ( 9.604 13.046 -1.074) 16.235 18.804 ( 11.484 -12.042 -1.246) 16.687 ======================= Grid point 152 (84/170) ======================= q-point: (-0.18 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.126 ( 2.274 6.557 -4.081) 8.051 2.164 ( 5.458 1.334 0.327) 5.628 2.294 ( -4.413 9.293 -1.411) 10.384 2.425 ( -1.373 -3.143 5.303) 6.316 2.658 ( -3.489 9.270 -3.360) 10.459 2.789 ( -3.603 2.834 -10.079) 11.073 2.932 ( -6.529 -4.077 5.425) 9.417 3.070 ( -6.322 -10.064 6.016) 13.321 3.185 ( -0.554 -0.575 -1.165) 1.413 3.310 ( 2.336 -11.877 -4.429) 12.889 3.894 ( -8.892 8.786 1.453) 12.584 3.950 ( -5.537 3.129 0.506) 6.380 4.248 ( 1.169 2.704 2.781) 4.051 4.369 ( 2.359 -8.643 5.865) 10.709 4.722 ( 1.562 15.326 5.074) 16.220 4.873 ( 5.423 -0.941 1.192) 5.632 4.999 ( 2.782 6.016 -0.422) 6.642 5.099 ( 5.392 -0.829 -2.333) 5.933 5.341 ( 8.415 -1.407 4.145) 9.486 5.415 ( 5.745 -8.089 2.813) 10.313 5.503 ( 7.051 4.932 -3.998) 9.488 5.598 ( 8.077 -4.311 -6.535) 11.248 6.028 ( 7.449 1.860 -2.412) 8.048 6.063 ( 1.015 -0.379 -3.418) 3.585 6.279 ( -3.576 -0.031 -7.063) 7.917 6.344 ( 1.586 -6.018 -2.301) 6.635 6.650 ( -4.001 5.418 6.769) 9.549 6.736 ( 3.087 -1.117 4.730) 5.758 6.853 ( -2.029 -0.184 -2.475) 3.206 6.988 ( -6.238 -8.978 -0.745) 10.958 7.452 ( -1.318 6.287 0.049) 6.423 7.569 ( -0.000 -3.965 -0.119) 3.967 7.753 ( 1.641 4.506 -1.675) 5.079 7.873 ( 2.284 -4.314 -0.747) 4.938 8.112 ( -4.599 0.597 2.640) 5.337 8.138 ( -5.079 -0.610 0.660) 5.158 9.155 ( 7.709 3.030 0.877) 8.329 9.214 ( 7.404 -2.902 2.956) 8.484 9.667 ( 8.560 3.280 -0.239) 9.170 9.739 ( 8.411 -3.875 1.423) 9.370 9.958 ( -4.366 2.292 -0.238) 4.937 9.994 ( -3.044 -1.296 -0.291) 3.321 11.338 ( -3.052 0.990 -0.293) 3.222 11.361 ( -2.281 -1.489 0.841) 2.850 11.609 ( -2.509 1.410 -1.092) 3.078 11.626 ( -2.974 -0.136 -0.428) 3.007 11.903 ( -3.783 2.945 -2.714) 5.509 11.974 ( -5.737 -3.312 -3.212) 7.361 12.125 ( -1.776 4.625 0.579) 4.988 12.232 ( -0.138 -5.643 0.159) 5.647 12.699 ( -11.219 3.800 0.407) 11.852 12.746 ( -11.613 -0.645 0.036) 11.631 16.076 ( 1.319 0.913 -0.231) 1.621 16.089 ( 1.126 -0.336 -0.117) 1.181 17.283 ( -2.997 6.448 0.858) 7.162 17.358 ( -0.599 2.876 -5.143) 5.923 17.499 ( -7.899 -4.076 2.542) 9.245 17.592 ( 0.197 -9.332 3.718) 10.047 18.726 ( 11.170 15.228 0.092) 18.886 18.999 ( 12.346 -12.422 0.253) 17.516 ======================= Grid point 153 (85/170) ======================= q-point: (-0.09 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.145 ( 4.645 12.120 -2.341) 13.189 2.210 ( 1.976 6.043 -0.219) 6.362 2.315 ( 2.094 9.841 3.378) 10.613 2.518 ( 2.955 -2.533 4.855) 6.223 2.539 ( -3.463 -2.064 -5.792) 7.057 2.589 ( -3.179 -1.187 -10.041) 10.599 2.843 ( -9.013 0.164 3.596) 9.705 2.994 ( -5.342 -11.742 -0.037) 12.900 3.196 ( 1.288 0.471 0.056) 1.373 3.326 ( 3.086 -11.802 -1.741) 12.323 3.802 ( -5.146 11.407 3.888) 13.104 3.894 ( -3.573 1.682 2.664) 4.764 4.304 ( -0.681 3.957 6.112) 7.313 4.456 ( -0.759 -10.331 6.797) 12.390 4.768 ( -0.899 16.083 2.801) 16.349 4.921 ( 2.211 -1.291 -4.114) 4.845 5.029 ( -0.003 5.470 1.733) 5.737 5.152 ( -0.996 -1.876 4.161) 4.671 5.500 ( 4.592 -3.686 -0.095) 5.889 5.528 ( 3.781 -5.384 3.977) 7.688 5.575 ( 8.745 3.899 -6.895) 11.799 5.668 ( 5.112 -4.672 -6.008) 9.168 6.029 ( 2.770 3.079 -0.100) 4.143 6.085 ( 5.370 -1.824 -1.468) 5.858 6.247 ( 3.893 8.861 0.655) 9.700 6.433 ( 4.485 -8.834 2.156) 10.139 6.599 ( -7.319 10.979 3.546) 13.663 6.762 ( -2.974 1.794 -3.622) 5.018 6.860 ( -0.118 -7.121 5.956) 9.284 6.943 ( 1.799 -7.915 2.162) 8.399 7.403 ( -4.172 7.010 -0.655) 8.184 7.547 ( -1.633 -4.068 -0.826) 4.461 7.734 ( 0.918 3.686 -4.420) 5.828 7.880 ( 1.653 -5.751 -3.772) 7.074 8.036 ( -4.162 -0.493 -1.645) 4.503 8.056 ( -4.236 -2.169 -2.067) 5.189 9.286 ( 5.012 3.721 1.345) 6.386 9.345 ( 3.020 -2.118 1.989) 4.191 9.783 ( 4.290 2.595 -3.130) 5.910 9.831 ( 1.169 -2.270 -4.596) 5.258 9.953 ( 2.102 2.943 7.580) 8.399 10.013 ( 2.704 -2.888 8.217) 9.119 11.285 ( -1.991 2.150 -0.451) 2.965 11.339 ( -1.217 -3.231 1.087) 3.620 11.559 ( -2.414 1.475 -1.660) 3.280 11.578 ( -0.450 -0.570 -1.713) 1.861 11.812 ( -3.075 0.726 -1.339) 3.432 11.848 ( -4.541 -2.661 -1.963) 5.618 12.114 ( 1.571 5.492 -2.618) 6.283 12.234 ( 2.284 -5.837 -2.985) 6.942 12.525 ( -9.074 3.367 -0.031) 9.679 12.570 ( -8.331 -1.137 -0.395) 8.418 16.098 ( 0.963 0.949 0.558) 1.463 16.107 ( 0.609 0.061 0.617) 0.870 17.203 ( -3.745 4.346 -1.868) 6.034 17.267 ( -0.850 0.411 -7.266) 7.327 17.417 ( -3.991 3.442 0.116) 5.272 17.599 ( -1.672 -12.090 -3.126) 12.599 18.930 ( 7.489 15.763 7.068) 18.829 19.212 ( 8.282 -12.509 5.091) 15.843 ======================= Grid point 198 (86/170) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.327 ( -5.111 0.000 28.365) 28.822 1.337 ( -9.948 0.000 27.439) 29.187 2.091 ( 8.158 0.000 17.847) 19.623 2.186 ( 10.917 0.000 -12.493) 16.591 2.407 ( 4.249 0.000 5.788) 7.180 2.467 ( -6.071 0.000 -5.466) 8.169 2.472 ( 7.919 0.000 5.969) 9.916 3.004 ( -1.607 0.000 1.915) 2.500 3.210 ( 0.563 0.000 -15.577) 15.587 3.704 ( 3.692 0.000 -4.137) 5.545 4.016 ( -7.394 0.000 -5.801) 9.398 4.248 ( -10.619 0.000 -16.824) 19.895 4.306 ( 2.985 0.000 5.120) 5.926 4.641 ( -3.694 0.000 -4.368) 5.720 4.720 ( -10.965 0.000 10.892) 15.455 4.765 ( 0.315 0.000 3.543) 3.557 5.094 ( -1.377 0.000 1.687) 2.178 5.119 ( -1.394 0.000 4.273) 4.495 5.483 ( -3.232 0.000 -3.184) 4.537 5.557 ( 12.381 0.000 -11.414) 16.839 5.720 ( 1.588 0.000 9.247) 9.383 5.736 ( 6.050 0.000 13.424) 14.724 6.079 ( 1.274 0.000 -2.758) 3.038 6.278 ( -6.995 0.000 -2.830) 7.546 6.305 ( 3.247 0.000 1.165) 3.450 6.416 ( -2.602 0.000 7.958) 8.373 6.568 ( 3.358 0.000 -3.931) 5.170 6.757 ( 8.607 0.000 -6.688) 10.901 7.037 ( 3.123 0.000 12.607) 12.988 7.276 ( -12.337 0.000 -0.441) 12.345 7.334 ( -0.494 0.000 1.143) 1.245 7.409 ( -1.498 0.000 -1.941) 2.452 7.416 ( 3.165 0.000 -1.247) 3.401 7.803 ( -0.683 0.000 -17.615) 17.628 7.959 ( 0.910 0.000 3.166) 3.294 8.122 ( 2.772 0.000 -5.925) 6.542 9.209 ( -0.917 0.000 6.957) 7.018 9.367 ( -1.125 0.000 0.550) 1.252 9.781 ( 1.733 0.000 4.817) 5.120 9.894 ( 6.397 0.000 -0.375) 6.408 9.918 ( -0.127 0.000 -2.945) 2.948 9.967 ( -1.881 0.000 -3.418) 3.901 11.381 ( -1.539 0.000 5.865) 6.063 11.496 ( -10.517 0.000 2.723) 10.864 11.648 ( 1.575 0.000 -5.263) 5.494 11.718 ( 0.625 0.000 1.912) 2.012 11.720 ( 1.483 0.000 -6.394) 6.564 11.859 ( -3.434 0.000 -3.581) 4.961 11.969 ( -1.057 0.000 2.553) 2.763 12.066 ( 3.019 0.000 -1.650) 3.441 12.204 ( 2.415 0.000 11.238) 11.495 12.796 ( 3.981 0.000 -14.425) 14.965 16.047 ( 0.331 0.000 1.260) 1.302 16.059 ( -0.210 0.000 0.778) 0.806 16.978 ( 0.139 0.000 2.524) 2.528 17.027 ( 5.644 0.000 0.809) 5.702 17.633 ( -18.404 0.000 -0.232) 18.405 17.697 ( 10.283 0.000 -2.347) 10.547 18.796 ( -9.786 0.000 15.937) 18.702 19.479 ( 11.261 0.000 -13.102) 17.276 ======================= Grid point 199 (87/170) ======================= q-point: ( 0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.562 ( 2.350 0.000 19.591) 19.732 1.574 ( -1.298 0.000 20.434) 20.475 2.188 ( 2.064 0.000 -12.891) 13.055 2.251 ( 10.256 0.000 -8.797) 13.512 2.367 ( 3.222 0.000 -6.406) 7.171 2.416 ( 3.278 0.000 0.080) 3.279 2.779 ( 4.016 0.000 10.999) 11.709 3.065 ( 3.320 0.000 -12.226) 12.669 3.306 ( 13.147 0.000 25.893) 29.039 3.485 ( -9.257 0.000 -21.909) 23.784 3.818 ( -9.441 0.000 2.453) 9.754 3.923 ( -11.511 0.000 -3.623) 12.068 4.427 ( -1.440 0.000 10.169) 10.271 4.533 ( 0.809 0.000 -8.717) 8.755 4.728 ( 0.684 0.000 6.465) 6.502 4.825 ( -0.977 0.000 5.892) 5.973 5.045 ( -4.401 0.000 -1.154) 4.549 5.114 ( -7.911 0.000 7.374) 10.815 5.394 ( -2.312 0.000 -5.797) 6.241 5.620 ( 9.779 0.000 -12.092) 15.551 5.797 ( 0.036 0.000 7.104) 7.104 5.973 ( 4.703 0.000 6.120) 7.718 6.051 ( -16.175 0.000 -1.823) 16.277 6.075 ( -1.495 0.000 1.763) 2.312 6.281 ( -5.535 0.000 7.352) 9.203 6.523 ( 3.837 0.000 2.778) 4.737 6.541 ( 3.178 0.000 -10.241) 10.723 6.727 ( 0.270 0.000 -9.868) 9.872 7.087 ( -4.686 0.000 1.799) 5.019 7.235 ( -0.100 0.000 12.429) 12.430 7.389 ( 4.811 0.000 4.929) 6.888 7.399 ( -0.435 0.000 -2.258) 2.299 7.447 ( 2.666 0.000 -2.234) 3.479 7.652 ( 2.137 0.000 -13.235) 13.407 8.029 ( 1.699 0.000 4.872) 5.160 8.096 ( 3.412 0.000 -8.960) 9.587 9.281 ( -0.041 0.000 6.216) 6.216 9.370 ( 1.753 0.000 -1.024) 2.030 9.827 ( -2.947 0.000 4.528) 5.402 9.871 ( -3.920 0.000 -3.918) 5.542 9.893 ( 1.878 0.000 -2.698) 3.287 10.038 ( 11.569 0.000 -2.616) 11.861 11.383 ( -9.102 0.000 7.014) 11.490 11.408 ( -3.601 0.000 5.754) 6.787 11.593 ( 0.073 0.000 -5.976) 5.977 11.669 ( 0.003 0.000 -2.688) 2.688 11.748 ( -4.144 0.000 -3.111) 5.182 11.789 ( 2.818 0.000 4.145) 5.013 11.994 ( 1.048 0.000 1.862) 2.137 12.122 ( 5.434 0.000 -3.148) 6.280 12.334 ( -0.655 0.000 9.431) 9.454 12.667 ( 1.101 0.000 -15.261) 15.301 16.069 ( 0.700 0.000 0.190) 0.725 16.073 ( 1.305 0.000 0.817) 1.540 16.980 ( -2.210 0.000 0.252) 2.224 17.064 ( 0.494 0.000 -2.812) 2.855 17.365 ( -15.549 0.000 5.047) 16.348 17.834 ( 6.436 0.000 -2.005) 6.741 18.867 ( -2.992 0.000 17.827) 18.077 19.504 ( 10.635 0.000 -15.805) 19.050 ======================= Grid point 200 (88/170) ======================= q-point: ( 0.18 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.722 ( -1.075 0.000 9.255) 9.317 1.790 ( 3.588 0.000 7.957) 8.729 2.032 ( -2.032 0.000 -8.997) 9.223 2.281 ( 7.206 0.000 -16.326) 17.845 2.404 ( 4.113 0.000 2.109) 4.622 2.512 ( 6.046 0.000 1.350) 6.195 2.928 ( 2.209 0.000 6.353) 6.726 3.072 ( 5.736 0.000 -5.892) 8.223 3.131 ( 8.021 0.000 -22.584) 23.966 3.496 ( -2.675 0.000 0.190) 2.682 3.709 ( -16.834 0.000 6.747) 18.136 4.068 ( 10.022 0.000 24.838) 26.784 4.465 ( 3.482 0.000 -8.147) 8.860 4.499 ( -4.487 0.000 12.321) 13.113 4.774 ( -1.464 0.000 -5.100) 5.306 4.837 ( -4.467 0.000 1.195) 4.624 4.995 ( -2.607 0.000 5.963) 6.508 5.027 ( -12.146 0.000 9.929) 15.688 5.256 ( -1.413 0.000 -11.004) 11.094 5.546 ( -5.749 0.000 -8.898) 10.593 5.848 ( -0.492 0.000 2.862) 2.904 5.898 ( -2.522 0.000 -10.754) 11.046 5.928 ( 3.177 0.000 5.978) 6.769 6.134 ( -5.035 0.000 10.155) 11.335 6.378 ( 2.482 0.000 9.814) 10.123 6.417 ( 1.827 0.000 -16.711) 16.810 6.584 ( 4.168 0.000 -2.154) 4.691 6.646 ( 1.710 0.000 -5.458) 5.719 7.090 ( 2.263 0.000 -1.282) 2.601 7.328 ( 0.407 0.000 5.091) 5.107 7.335 ( -2.682 0.000 -4.605) 5.329 7.454 ( 1.953 0.000 -2.573) 3.230 7.550 ( -0.008 0.000 -6.490) 6.490 7.569 ( 0.926 0.000 13.984) 14.015 8.021 ( -0.581 0.000 -7.712) 7.734 8.097 ( -2.603 0.000 6.115) 6.646 9.342 ( -0.403 0.000 4.684) 4.701 9.376 ( 1.111 0.000 -3.858) 4.015 9.765 ( -2.773 0.000 -3.747) 4.662 9.789 ( -6.746 0.000 3.580) 7.637 9.962 ( 8.477 0.000 1.231) 8.566 10.198 ( 11.945 0.000 -4.865) 12.897 11.355 ( -4.718 0.000 7.347) 8.732 11.393 ( -5.519 0.000 5.037) 7.472 11.518 ( -0.399 0.000 -5.631) 5.645 11.626 ( -4.054 0.000 -0.648) 4.105 11.714 ( 3.162 0.000 0.521) 3.205 11.884 ( 2.787 0.000 2.601) 3.812 12.046 ( 1.672 0.000 3.443) 3.828 12.144 ( 2.566 0.000 -5.715) 6.265 12.422 ( -1.696 0.000 9.545) 9.694 12.489 ( -0.732 0.000 -14.328) 14.346 16.086 ( 1.509 0.000 -0.522) 1.597 16.108 ( 2.089 0.000 0.035) 2.089 16.906 ( -4.214 0.000 -3.118) 5.242 16.991 ( -3.646 0.000 -4.162) 5.533 17.239 ( -9.207 0.000 8.561) 12.572 17.832 ( -3.250 0.000 -1.415) 3.545 19.125 ( 6.995 0.000 17.784) 19.110 19.468 ( 7.518 0.000 -16.218) 17.876 ======================= Grid point 201 (89/170) ======================= q-point: ( 0.27 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.808 ( 2.764 0.000 5.277) 5.957 1.855 ( -3.821 0.000 6.562) 7.594 1.958 ( 2.098 0.000 -4.265) 4.753 2.082 ( 1.130 0.000 -24.156) 24.183 2.556 ( 5.776 0.000 7.704) 9.629 2.606 ( 2.321 0.000 0.587) 2.395 3.030 ( 5.439 0.000 2.964) 6.194 3.035 ( 1.149 0.000 -0.272) 1.181 3.302 ( 21.983 0.000 -11.429) 24.776 3.524 ( -12.603 0.000 6.176) 14.035 3.526 ( 2.424 0.000 5.220) 5.755 4.224 ( -3.592 0.000 -6.256) 7.214 4.488 ( -1.202 0.000 -5.839) 5.962 4.568 ( -6.515 0.000 9.785) 11.756 4.635 ( -2.513 0.000 -2.840) 3.792 4.742 ( -2.238 0.000 3.792) 4.403 4.913 ( -6.510 0.000 -7.228) 9.728 5.001 ( -5.059 0.000 9.797) 11.026 5.214 ( 5.228 0.000 -3.420) 6.247 5.365 ( -6.047 0.000 -0.784) 6.098 5.773 ( -0.897 0.000 -4.604) 4.691 5.937 ( 0.459 0.000 0.026) 0.459 6.077 ( 7.435 0.000 8.663) 11.416 6.085 ( -6.482 0.000 -0.157) 6.484 6.317 ( 6.411 0.000 -7.562) 9.914 6.511 ( 1.718 0.000 5.177) 5.454 6.629 ( 3.752 0.000 -6.403) 7.421 6.673 ( 6.686 0.000 3.068) 7.356 7.099 ( 1.510 0.000 -3.082) 3.431 7.186 ( -7.447 0.000 -5.574) 9.301 7.356 ( 0.904 0.000 -2.808) 2.949 7.464 ( 0.649 0.000 0.429) 0.778 7.540 ( 3.773 0.000 0.023) 3.773 7.706 ( -4.191 0.000 12.882) 13.547 7.905 ( -3.729 0.000 -5.645) 6.766 8.062 ( -9.423 0.000 5.802) 11.066 9.319 ( -0.729 0.000 -4.596) 4.653 9.373 ( -1.241 0.000 2.818) 3.079 9.702 ( -0.478 0.000 -2.101) 2.154 9.703 ( -7.003 0.000 2.595) 7.469 10.178 ( 11.917 0.000 2.645) 12.207 10.311 ( 9.535 0.000 -7.208) 11.953 11.333 ( -6.998 0.000 2.093) 7.304 11.342 ( -3.745 0.000 0.903) 3.852 11.499 ( 2.524 0.000 0.943) 2.695 11.548 ( -4.746 0.000 -0.077) 4.746 11.824 ( 6.725 0.000 3.399) 7.535 11.919 ( 1.194 0.000 -2.093) 2.410 12.079 ( 0.534 0.000 -7.405) 7.425 12.134 ( 1.198 0.000 6.813) 6.918 12.356 ( 0.942 0.000 -8.063) 8.118 12.498 ( -2.536 0.000 9.145) 9.491 16.106 ( 2.052 0.000 -1.156) 2.355 16.140 ( 2.327 0.000 -0.992) 2.529 16.799 ( -3.102 0.000 -2.956) 4.285 16.878 ( -4.337 0.000 -2.432) 4.972 17.230 ( -5.900 0.000 11.022) 12.502 17.741 ( -5.423 0.000 -0.173) 5.426 19.396 ( 6.657 0.000 -15.887) 17.225 19.419 ( 4.840 0.000 12.196) 13.122 ======================= Grid point 202 (90/170) ======================= q-point: ( 0.36 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.870 ( 2.188 0.000 -14.265) 14.432 1.878 ( -6.110 0.000 11.044) 12.621 1.961 ( 6.667 0.000 7.009) 9.673 1.991 ( 3.062 0.000 4.071) 5.094 2.638 ( 5.922 0.000 -3.815) 7.045 2.731 ( 4.782 0.000 5.519) 7.302 3.030 ( -2.462 0.000 -0.595) 2.533 3.171 ( 4.179 0.000 4.515) 6.153 3.326 ( -11.069 0.000 6.659) 12.918 3.614 ( 20.672 0.000 -11.644) 23.726 3.621 ( 0.689 0.000 0.702) 0.983 4.010 ( -8.321 0.000 -5.621) 10.041 4.244 ( -4.467 0.000 -21.193) 21.658 4.437 ( -8.360 0.000 -0.813) 8.400 4.700 ( -2.635 0.000 5.349) 5.963 4.786 ( 3.106 0.000 -0.407) 3.133 4.788 ( 6.171 0.000 -4.658) 7.732 5.078 ( -1.420 0.000 10.394) 10.490 5.223 ( 1.332 0.000 -4.986) 5.160 5.307 ( -5.182 0.000 4.334) 6.755 5.751 ( -0.857 0.000 2.169) 2.332 5.831 ( -3.329 0.000 -8.564) 9.188 5.992 ( -0.199 0.000 -3.484) 3.489 6.296 ( -0.573 0.000 5.007) 5.039 6.458 ( 11.217 0.000 5.542) 12.511 6.555 ( -1.422 0.000 2.960) 3.284 6.645 ( 7.415 0.000 -2.430) 7.803 6.855 ( 6.817 0.000 6.698) 9.557 6.986 ( -7.453 0.000 -1.226) 7.553 7.100 ( 2.287 0.000 -4.168) 4.754 7.303 ( -0.520 0.000 -6.556) 6.577 7.460 ( -1.523 0.000 -0.880) 1.759 7.659 ( 7.128 0.000 2.410) 7.524 7.691 ( -10.418 0.000 5.205) 11.646 7.773 ( -4.629 0.000 -3.584) 5.854 7.959 ( -9.103 0.000 5.539) 10.655 9.279 ( 1.254 0.000 -2.483) 2.781 9.366 ( -2.188 0.000 1.104) 2.451 9.631 ( -4.794 0.000 2.535) 5.423 9.708 ( 1.355 0.000 1.918) 2.348 10.337 ( 5.536 0.000 -3.458) 6.528 10.345 ( 5.788 0.000 -9.168) 10.842 11.207 ( -6.270 0.000 -2.531) 6.761 11.279 ( -1.632 0.000 -2.521) 3.003 11.477 ( -3.657 0.000 1.055) 3.806 11.587 ( 3.001 0.000 4.086) 5.070 11.897 ( 1.240 0.000 -4.199) 4.378 11.995 ( 5.875 0.000 4.675) 7.508 12.049 ( 3.027 0.000 -1.697) 3.470 12.222 ( -0.787 0.000 6.919) 6.964 12.327 ( 3.476 0.000 -2.818) 4.474 12.538 ( -4.549 0.000 7.486) 8.760 16.125 ( 1.983 0.000 -1.529) 2.504 16.159 ( 1.788 0.000 -1.886) 2.599 16.759 ( -0.064 0.000 0.924) 0.926 16.804 ( -2.373 0.000 -0.132) 2.377 17.282 ( -5.425 0.000 13.543) 14.589 17.663 ( -3.440 0.000 0.189) 3.445 19.340 ( 8.236 0.000 -14.690) 16.841 19.526 ( -3.266 0.000 3.273) 4.624 ======================= Grid point 203 (91/170) ======================= q-point: ( 0.45 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.847 ( 2.932 0.000 2.302) 3.727 1.885 ( -7.444 0.000 10.752) 13.077 2.158 ( 5.201 0.000 7.068) 8.775 2.171 ( 5.425 0.000 11.847) 13.030 2.749 ( 11.588 0.000 -3.024) 11.976 2.845 ( 5.254 0.000 0.920) 5.334 2.920 ( -8.477 0.000 -1.539) 8.615 3.223 ( -4.902 0.000 3.405) 5.968 3.267 ( -1.474 0.000 2.886) 3.240 3.461 ( -9.319 0.000 -9.142) 13.054 3.739 ( 9.226 0.000 -11.562) 14.791 3.813 ( -3.832 0.000 -22.214) 22.542 4.069 ( 6.557 0.000 -1.054) 6.641 4.290 ( -8.739 0.000 -0.460) 8.751 4.690 ( -0.484 0.000 1.144) 1.242 4.826 ( 0.817 0.000 -1.149) 1.410 4.937 ( 8.626 0.000 1.769) 8.806 5.141 ( -1.780 0.000 3.441) 3.874 5.206 ( 3.418 0.000 -1.872) 3.898 5.258 ( -7.975 0.000 6.340) 10.188 5.690 ( -2.041 0.000 -6.069) 6.403 5.771 ( 0.626 0.000 1.317) 1.458 6.006 ( 5.326 0.000 -2.845) 6.038 6.152 ( -11.313 0.000 -3.550) 11.856 6.559 ( -2.999 0.000 5.211) 6.012 6.707 ( 6.531 0.000 8.589) 10.790 6.855 ( 12.609 0.000 2.721) 12.899 6.942 ( 3.351 0.000 0.728) 3.429 7.015 ( 2.198 0.000 5.607) 6.023 7.099 ( 2.226 0.000 -2.317) 3.213 7.185 ( -4.103 0.000 -6.761) 7.909 7.392 ( -4.120 0.000 -2.621) 4.883 7.536 ( -6.995 0.000 -2.149) 7.318 7.615 ( -5.393 0.000 -4.307) 6.902 7.864 ( 8.796 0.000 3.925) 9.632 7.890 ( -6.861 0.000 5.160) 8.585 9.303 ( 3.413 0.000 -0.620) 3.469 9.328 ( -3.185 0.000 0.268) 3.197 9.613 ( -1.848 0.000 4.472) 4.839 9.780 ( 1.623 0.000 5.071) 5.324 10.262 ( -3.142 0.000 -11.120) 11.555 10.298 ( 2.086 0.000 -10.021) 10.235 11.119 ( -1.952 0.000 -0.162) 1.958 11.240 ( 0.880 0.000 -3.160) 3.281 11.463 ( -0.539 0.000 2.959) 3.008 11.652 ( 0.380 0.000 0.862) 0.942 11.897 ( 3.945 0.000 -2.095) 4.467 12.005 ( -3.422 0.000 -0.494) 3.457 12.192 ( 7.109 0.000 3.758) 8.042 12.259 ( -3.363 0.000 5.254) 6.238 12.425 ( 8.480 0.000 1.529) 8.616 12.512 ( -7.036 0.000 4.897) 8.572 16.133 ( 0.991 0.000 -1.517) 1.812 16.155 ( 0.520 0.000 -2.144) 2.206 16.798 ( 0.510 0.000 1.474) 1.559 16.800 ( 1.405 0.000 2.701) 3.045 17.349 ( -6.132 0.000 14.313) 15.571 17.645 ( 1.029 0.000 0.853) 1.336 19.345 ( 10.962 0.000 -11.762) 16.078 19.397 ( -10.970 0.000 -3.699) 11.577 ======================= Grid point 204 (92/170) ======================= q-point: (-0.45 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.903 ( -5.268 0.000 11.408) 12.566 1.976 ( 0.812 0.000 10.639) 10.669 2.230 ( -5.714 0.000 4.162) 7.069 2.298 ( -6.172 0.000 1.366) 6.321 2.756 ( -2.916 0.000 -4.819) 5.632 2.917 ( 9.958 0.000 -2.407) 10.245 3.004 ( 7.721 0.000 7.877) 11.030 3.126 ( -6.179 0.000 -0.867) 6.240 3.220 ( -4.591 0.000 -3.997) 6.087 3.338 ( 8.502 0.000 -1.718) 8.674 3.533 ( -2.695 0.000 -15.690) 15.920 3.681 ( 1.872 0.000 -12.410) 12.550 4.128 ( -9.344 0.000 -0.476) 9.356 4.237 ( 10.051 0.000 2.055) 10.259 4.692 ( -3.071 0.000 3.374) 4.563 4.734 ( -8.670 0.000 -2.190) 8.942 5.076 ( 5.162 0.000 2.321) 5.660 5.083 ( -4.799 0.000 -2.150) 5.259 5.194 ( -6.709 0.000 3.439) 7.539 5.292 ( 5.267 0.000 1.778) 5.559 5.636 ( -1.260 0.000 -0.311) 1.298 5.803 ( 3.373 0.000 -1.668) 3.763 5.993 ( -2.620 0.000 0.757) 2.727 6.074 ( 5.684 0.000 -2.800) 6.336 6.582 ( -3.629 0.000 7.730) 8.539 6.834 ( 3.365 0.000 -1.668) 3.756 6.995 ( -5.290 0.000 -3.467) 6.324 7.015 ( 3.004 0.000 6.008) 6.717 7.074 ( 5.826 0.000 -2.942) 6.527 7.076 ( -2.610 0.000 -0.251) 2.622 7.206 ( 11.916 0.000 5.489) 13.119 7.212 ( -10.025 0.000 -6.330) 11.856 7.479 ( -4.712 0.000 -3.447) 5.838 7.515 ( 5.549 0.000 -0.966) 5.632 7.840 ( -5.886 0.000 4.151) 7.202 8.045 ( 9.228 0.000 0.375) 9.236 9.267 ( -4.138 0.000 0.036) 4.138 9.364 ( 3.977 0.000 -0.330) 3.990 9.680 ( 0.526 0.000 9.033) 9.048 9.845 ( -0.790 0.000 2.343) 2.473 10.062 ( -3.935 0.000 -7.788) 8.726 10.191 ( -0.823 0.000 -9.815) 9.849 11.116 ( -0.020 0.000 1.648) 1.649 11.229 ( 2.269 0.000 -3.875) 4.490 11.528 ( 3.048 0.000 4.269) 5.245 11.631 ( -0.115 0.000 -3.128) 3.130 11.914 ( -5.644 0.000 -1.158) 5.762 11.968 ( 4.070 0.000 1.055) 4.205 12.232 ( -5.125 0.000 2.742) 5.812 12.325 ( 4.375 0.000 1.968) 4.797 12.418 ( -8.759 0.000 2.125) 9.013 12.611 ( 10.327 0.000 1.734) 10.471 16.124 ( -0.373 0.000 -0.975) 1.044 16.129 ( -0.918 0.000 -1.634) 1.874 16.840 ( 1.911 0.000 1.071) 2.191 16.841 ( 0.947 0.000 0.522) 1.081 17.408 ( -5.297 0.000 12.900) 13.945 17.723 ( 6.567 0.000 0.788) 6.615 19.105 ( -16.573 0.000 -4.634) 17.209 19.435 ( 12.573 0.000 -7.281) 14.529 ======================= Grid point 205 (93/170) ======================= q-point: (-0.36 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.919 ( -18.799 0.000 2.302) 18.939 1.943 ( -15.350 0.000 -10.394) 18.538 1.996 ( -7.281 0.000 9.071) 11.631 2.217 ( 0.026 0.000 7.116) 7.116 2.746 ( 7.952 0.000 -5.552) 9.698 2.816 ( -10.344 0.000 -7.911) 13.022 3.083 ( 2.751 0.000 -3.199) 4.219 3.197 ( -20.872 0.000 0.969) 20.894 3.283 ( 10.550 0.000 12.095) 16.049 3.453 ( 15.508 0.000 5.227) 16.366 3.491 ( 5.718 0.000 -3.288) 6.595 3.545 ( 2.150 0.000 -6.819) 7.150 4.000 ( -3.469 0.000 -1.122) 3.646 4.402 ( 6.624 0.000 -0.308) 6.631 4.596 ( -2.538 0.000 -0.912) 2.697 4.667 ( -4.797 0.000 4.935) 6.882 4.986 ( -3.148 0.000 -0.715) 3.228 5.107 ( -3.424 0.000 -3.015) 4.562 5.165 ( 1.771 0.000 2.546) 3.101 5.396 ( 4.411 0.000 2.118) 4.893 5.626 ( -1.275 0.000 4.371) 4.553 5.828 ( 3.845 0.000 -6.288) 7.370 6.066 ( 5.969 0.000 2.208) 6.365 6.105 ( -1.733 0.000 3.023) 3.484 6.588 ( -6.227 0.000 5.927) 8.597 6.810 ( 0.755 0.000 -7.324) 7.362 6.835 ( -8.953 0.000 -6.492) 11.059 6.989 ( -6.440 0.000 -2.938) 7.079 7.035 ( -4.903 0.000 0.184) 4.907 7.073 ( 4.662 0.000 -2.107) 5.116 7.130 ( 2.118 0.000 -0.961) 2.326 7.414 ( 1.957 0.000 0.200) 1.967 7.524 ( 13.727 0.000 8.072) 15.924 7.623 ( 6.401 0.000 0.329) 6.409 7.770 ( -6.670 0.000 1.283) 6.792 8.184 ( 10.016 0.000 -3.902) 10.749 9.196 ( -4.365 0.000 0.441) 4.387 9.406 ( 1.607 0.000 -1.282) 2.056 9.796 ( 0.037 0.000 -4.035) 4.036 9.820 ( 0.377 0.000 11.578) 11.584 10.016 ( -1.151 0.000 3.345) 3.537 10.055 ( -2.652 0.000 -7.290) 7.757 11.152 ( 1.468 0.000 2.401) 2.814 11.216 ( 2.054 0.000 -4.524) 4.968 11.607 ( 2.190 0.000 -3.292) 3.954 11.650 ( 5.122 0.000 4.069) 6.542 11.802 ( -5.402 0.000 -1.521) 5.612 12.016 ( -1.553 0.000 1.538) 2.186 12.169 ( -2.710 0.000 -0.894) 2.854 12.279 ( -8.928 0.000 0.364) 8.936 12.380 ( 0.923 0.000 -0.201) 0.945 12.786 ( 9.634 0.000 -1.388) 9.734 16.091 ( -1.805 0.000 -0.691) 1.933 16.102 ( -1.351 0.000 -0.086) 1.353 16.849 ( 0.964 0.000 -1.404) 1.703 16.857 ( -0.124 0.000 -1.534) 1.539 17.491 ( -0.859 0.000 11.038) 11.072 17.840 ( 8.662 0.000 -5.611) 10.321 18.787 ( -18.255 0.000 3.519) 18.591 19.582 ( 11.519 0.000 -3.510) 12.042 ======================= Grid point 206 (94/170) ======================= q-point: (-0.27 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.408 ( -25.612 0.000 -7.883) 26.798 1.568 ( -25.754 0.000 5.989) 26.441 2.118 ( 3.457 0.000 5.765) 6.723 2.276 ( 2.952 0.000 -3.130) 4.302 2.592 ( -11.566 0.000 -3.656) 12.130 2.649 ( -36.687 0.000 9.818) 37.978 2.874 ( 15.726 0.000 -6.675) 17.084 3.117 ( -1.953 0.000 -1.478) 2.449 3.261 ( -12.698 0.000 -7.476) 14.736 3.591 ( 9.609 0.000 7.052) 11.919 3.755 ( 6.889 0.000 9.467) 11.708 3.809 ( 17.726 0.000 2.601) 17.915 4.024 ( 8.169 0.000 1.727) 8.350 4.488 ( 4.894 0.000 3.001) 5.741 4.584 ( -0.348 0.000 -0.374) 0.511 4.679 ( -0.415 0.000 5.592) 5.608 4.966 ( -2.097 0.000 0.691) 2.208 5.053 ( 6.487 0.000 -7.361) 9.811 5.183 ( -2.778 0.000 1.636) 3.224 5.490 ( 4.627 0.000 -0.115) 4.629 5.742 ( 5.580 0.000 10.356) 11.764 5.769 ( -2.174 0.000 -3.783) 4.363 6.119 ( -2.668 0.000 5.109) 5.764 6.143 ( 3.474 0.000 -6.696) 7.543 6.475 ( -10.822 0.000 -2.040) 11.013 6.597 ( -7.181 0.000 -5.757) 9.204 6.703 ( -2.817 0.000 -7.612) 8.117 6.881 ( -8.462 0.000 -3.479) 9.150 6.897 ( -5.262 0.000 2.949) 6.032 7.146 ( -0.656 0.000 2.675) 2.755 7.186 ( 9.589 0.000 -1.910) 9.777 7.492 ( 4.589 0.000 1.133) 4.727 7.602 ( -8.273 0.000 -2.838) 8.747 7.758 ( 4.327 0.000 2.027) 4.778 7.839 ( 11.703 0.000 6.828) 13.549 8.306 ( 11.662 0.000 -5.915) 13.076 9.140 ( -3.750 0.000 2.131) 4.313 9.400 ( -0.603 0.000 -0.001) 0.603 9.814 ( 5.763 0.000 -2.282) 6.198 9.835 ( -3.406 0.000 -5.564) 6.523 10.029 ( -2.859 0.000 9.959) 10.361 10.034 ( -2.145 0.000 3.783) 4.349 11.215 ( 3.148 0.000 -1.146) 3.350 11.218 ( 2.323 0.000 3.112) 3.883 11.631 ( 4.193 0.000 -2.279) 4.772 11.707 ( -1.610 0.000 -3.247) 3.624 11.783 ( 4.464 0.000 3.564) 5.713 11.941 ( -7.161 0.000 0.091) 7.162 12.082 ( -5.175 0.000 -5.317) 7.420 12.183 ( -2.702 0.000 1.127) 2.928 12.352 ( -2.545 0.000 -2.133) 3.321 12.892 ( 7.866 0.000 -5.930) 9.851 16.056 ( -1.896 0.000 0.265) 1.914 16.080 ( -1.658 0.000 0.770) 1.828 16.803 ( -2.347 0.000 -2.988) 3.799 16.854 ( 1.664 0.000 -1.117) 2.004 17.637 ( 4.139 0.000 8.760) 9.688 17.821 ( 3.022 0.000 -14.705) 15.013 18.643 ( -11.891 0.000 15.900) 19.855 19.710 ( 7.464 0.000 -3.535) 8.259 ======================= Grid point 207 (95/170) ======================= q-point: (-0.18 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.049 ( -19.012 0.000 18.324) 26.405 1.257 ( -24.719 0.000 16.173) 29.540 2.048 ( -42.755 0.000 18.969) 46.774 2.200 ( 5.669 0.000 -5.559) 7.940 2.247 ( 4.311 0.000 -11.222) 12.022 2.532 ( -5.481 0.000 1.895) 5.799 2.951 ( -13.348 0.000 -6.598) 14.890 3.076 ( -1.241 0.000 3.143) 3.379 3.109 ( 19.534 0.000 -5.689) 20.346 3.667 ( 0.575 0.000 -5.942) 5.969 3.980 ( 6.175 0.000 10.778) 12.421 4.058 ( 12.055 0.000 -3.481) 12.548 4.307 ( 9.765 0.000 13.721) 16.841 4.584 ( -0.148 0.000 2.387) 2.392 4.711 ( 11.219 0.000 13.452) 17.516 4.770 ( 3.200 0.000 3.615) 4.828 4.918 ( -1.978 0.000 -1.831) 2.695 5.115 ( -7.623 0.000 3.149) 8.247 5.130 ( 12.217 0.000 -7.944) 14.573 5.505 ( 3.222 0.000 -7.409) 8.079 5.749 ( -4.799 0.000 8.270) 9.562 5.931 ( -7.198 0.000 -10.954) 13.108 6.070 ( 12.441 0.000 6.218) 13.909 6.074 ( -2.486 0.000 -5.111) 5.684 6.258 ( -6.550 0.000 -4.762) 8.098 6.480 ( -4.010 0.000 0.597) 4.054 6.563 ( -7.466 0.000 -1.141) 7.553 6.742 ( -2.215 0.000 -4.353) 4.884 6.869 ( -4.305 0.000 5.845) 7.259 7.179 ( -0.679 0.000 5.401) 5.443 7.309 ( 6.931 0.000 -1.713) 7.140 7.429 ( -7.993 0.000 -0.719) 8.025 7.560 ( 3.511 0.000 -1.760) 3.928 7.849 ( 3.198 0.000 2.141) 3.849 8.033 ( 6.426 0.000 -0.415) 6.440 8.412 ( 7.496 0.000 -8.225) 11.128 9.128 ( -2.574 0.000 5.042) 5.661 9.395 ( -1.405 0.000 1.633) 2.154 9.708 ( -3.300 0.000 -3.763) 5.005 9.898 ( 6.371 0.000 -2.351) 6.791 10.019 ( -8.132 0.000 1.947) 8.361 10.029 ( -2.352 0.000 2.005) 3.091 11.288 ( 0.751 0.000 3.973) 4.043 11.358 ( 9.598 0.000 8.410) 12.761 11.681 ( 4.020 0.000 -4.326) 5.906 11.685 ( 4.648 0.000 -1.452) 4.869 11.811 ( -6.700 0.000 -1.990) 6.989 11.878 ( 3.123 0.000 1.102) 3.312 11.928 ( -5.242 0.000 -3.951) 6.564 12.139 ( -4.926 0.000 1.121) 5.052 12.251 ( -5.274 0.000 -3.394) 6.271 12.915 ( 6.298 0.000 -10.217) 12.002 16.036 ( -1.336 0.000 0.996) 1.666 16.065 ( -1.484 0.000 1.212) 1.916 16.757 ( -0.047 0.000 1.260) 1.261 16.882 ( 2.056 0.000 0.584) 2.137 17.673 ( 0.310 0.000 -11.892) 11.896 17.813 ( 6.823 0.000 4.102) 7.961 18.696 ( -7.096 0.000 17.623) 18.998 19.703 ( -0.754 0.000 -9.109) 9.140 ======================= Grid point 208 (96/170) ======================= q-point: (-0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.163 ( -15.645 0.000 26.935) 31.149 1.196 ( -8.029 0.000 31.884) 32.880 1.754 ( -24.083 0.000 38.346) 45.282 2.190 ( 6.574 0.000 -13.162) 14.712 2.251 ( 9.844 0.000 -7.313) 12.263 2.451 ( -2.201 0.000 -0.523) 2.263 2.675 ( -10.534 0.000 -5.810) 12.030 3.087 ( -0.302 0.000 -4.569) 4.579 3.311 ( 11.569 0.000 -12.136) 16.767 3.614 ( 4.918 0.000 -3.782) 6.204 4.132 ( 3.018 0.000 -6.304) 6.989 4.173 ( 3.701 0.000 7.644) 8.493 4.506 ( -1.906 0.000 1.492) 2.420 4.638 ( -0.159 0.000 6.577) 6.579 4.785 ( -6.118 0.000 3.358) 6.979 4.837 ( -3.029 0.000 -6.136) 6.843 5.048 ( 8.031 0.000 3.267) 8.670 5.074 ( -3.865 0.000 7.475) 8.415 5.366 ( 22.797 0.000 0.924) 22.816 5.525 ( 8.414 0.000 -3.584) 9.146 5.632 ( -8.395 0.000 -2.789) 8.846 5.636 ( -13.048 0.000 2.954) 13.378 6.089 ( 4.798 0.000 -1.691) 5.087 6.169 ( 3.026 0.000 -0.774) 3.124 6.410 ( 0.843 0.000 -0.746) 1.126 6.432 ( 5.881 0.000 5.271) 7.897 6.438 ( -4.930 0.000 3.655) 6.137 6.695 ( 4.047 0.000 -6.015) 7.250 6.899 ( -1.415 0.000 8.547) 8.663 7.255 ( 2.270 0.000 5.003) 5.494 7.344 ( -3.791 0.000 2.724) 4.668 7.377 ( 3.904 0.000 -1.886) 4.336 7.551 ( -0.862 0.000 -5.242) 5.313 7.912 ( 1.360 0.000 2.312) 2.682 8.049 ( 3.008 0.000 -12.823) 13.172 8.250 ( -11.828 0.000 -9.046) 14.890 9.158 ( -2.345 0.000 6.671) 7.071 9.384 ( -2.046 0.000 1.557) 2.571 9.686 ( 1.239 0.000 3.772) 3.970 9.882 ( -4.439 0.000 -1.273) 4.617 9.943 ( 1.672 0.000 -2.357) 2.890 10.010 ( -0.435 0.000 -1.218) 1.293 11.336 ( -0.869 0.000 4.987) 5.062 11.596 ( 5.975 0.000 -0.846) 6.035 11.668 ( -4.727 0.000 -3.062) 5.632 11.723 ( 6.949 0.000 -6.336) 9.404 11.739 ( 0.534 0.000 -2.685) 2.737 11.906 ( 2.571 0.000 8.718) 9.089 11.909 ( 0.586 0.000 -1.045) 1.198 12.071 ( -5.930 0.000 7.577) 9.621 12.116 ( -5.131 0.000 -3.117) 6.004 12.876 ( 5.389 0.000 -13.036) 14.106 16.034 ( -0.570 0.000 1.317) 1.435 16.058 ( -0.997 0.000 1.151) 1.523 16.866 ( 7.255 0.000 5.200) 8.926 16.932 ( 1.571 0.000 2.313) 2.797 17.608 ( 4.973 0.000 -5.925) 7.735 17.877 ( -3.215 0.000 -3.551) 4.790 18.768 ( -8.280 0.000 16.161) 18.159 19.520 ( -1.947 0.000 -10.950) 11.122 ======================= Grid point 209 (97/170) ======================= q-point: ( 0.00 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.341 ( -1.609 9.093 22.373) 24.203 1.601 ( -3.124 15.454 26.598) 30.920 2.087 ( 5.732 -0.276 -8.453) 10.217 2.300 ( 7.180 11.073 5.778) 14.407 2.425 ( -0.191 2.135 4.100) 4.626 2.473 ( -4.158 0.903 -3.723) 5.654 2.666 ( 8.789 17.902 11.434) 22.988 3.016 ( -1.937 1.442 -0.245) 2.427 3.198 ( 0.051 -1.155 -12.217) 12.272 3.648 ( 1.091 -6.315 -2.582) 6.909 3.865 ( -5.351 -13.569 -3.805) 15.074 4.119 ( -4.749 -11.438 -11.654) 17.006 4.284 ( -1.288 1.438 0.746) 2.070 4.591 ( -3.591 -5.309 -8.672) 10.783 4.732 ( -7.161 1.130 10.218) 12.529 4.848 ( -0.406 6.485 4.214) 7.745 5.078 ( -1.823 -1.612 2.995) 3.859 5.244 ( 0.502 10.313 5.113) 11.522 5.548 ( 0.504 1.265 -3.724) 3.965 5.588 ( 3.039 0.387 1.878) 3.593 5.608 ( 2.374 -6.576 9.227) 11.576 5.731 ( 7.602 1.395 3.196) 8.364 5.928 ( -2.877 -7.540 -4.994) 9.490 6.185 ( 2.856 -7.480 -1.352) 8.120 6.291 ( -5.759 -0.026 5.334) 7.849 6.528 ( 0.534 4.432 2.905) 5.326 6.559 ( 4.289 -0.509 -2.933) 5.220 6.747 ( 4.672 -1.227 -3.996) 6.269 7.041 ( 2.442 0.535 7.529) 7.933 7.207 ( -10.489 -3.615 3.872) 11.751 7.328 ( 1.344 -0.997 -0.048) 1.674 7.409 ( -0.970 -0.601 -1.941) 2.251 7.485 ( 2.532 5.456 -2.427) 6.486 7.629 ( 2.683 -3.677 -5.340) 7.017 8.101 ( -3.561 0.664 -2.235) 4.257 8.244 ( 2.526 7.984 -12.908) 15.386 9.231 ( -0.368 2.205 7.021) 7.368 9.399 ( -2.472 2.526 0.036) 3.534 9.765 ( 1.166 -1.203 2.898) 3.347 9.849 ( 2.807 -3.412 -0.197) 4.423 9.976 ( -0.887 1.594 -1.601) 2.427 10.016 ( 0.917 8.024 -2.536) 8.465 11.300 ( -2.711 -5.343 5.224) 7.949 11.516 ( -7.433 -0.609 1.185) 7.551 11.585 ( 1.828 -3.025 -5.066) 6.178 11.645 ( 2.431 -3.059 -1.860) 4.328 11.798 ( 1.031 2.471 -0.429) 2.712 11.948 ( -4.348 2.871 -3.647) 6.360 11.971 ( 4.223 1.902 1.519) 4.875 12.051 ( 1.553 1.040 -0.630) 1.972 12.173 ( 0.641 -2.271 9.816) 10.096 12.724 ( 3.023 -6.743 -13.441) 15.339 16.058 ( 0.388 1.079 1.242) 1.691 16.069 ( -0.244 0.994 0.789) 1.293 16.920 ( 2.114 -2.951 4.433) 5.729 17.064 ( 1.731 1.644 -1.287) 2.712 17.633 ( -9.555 -1.458 -3.404) 10.248 17.651 ( 4.252 -3.706 -2.078) 6.011 18.837 ( -7.432 4.333 17.311) 19.330 19.528 ( 7.517 3.801 -12.319) 14.923 ======================= Grid point 210 (98/170) ======================= q-point: ( 0.09 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.615 ( 6.829 8.925 14.377) 18.248 1.811 ( -3.842 16.796 18.064) 24.964 2.090 ( 7.932 -3.325 -11.966) 14.736 2.385 ( -4.722 4.051 2.691) 6.778 2.423 ( 1.607 2.199 -0.412) 2.755 2.444 ( 11.535 8.299 -12.856) 19.163 2.807 ( 0.930 2.579 4.008) 4.856 3.063 ( 3.698 -1.115 -9.425) 10.186 3.337 ( 8.880 3.590 21.214) 23.276 3.499 ( -8.555 0.879 -11.430) 14.304 3.740 ( -4.885 -7.342 5.284) 10.281 3.841 ( -5.545 -6.533 -8.240) 11.888 4.338 ( -4.931 -4.039 9.487) 11.430 4.468 ( 0.779 -5.926 -8.868) 10.694 4.764 ( 1.950 3.278 4.656) 6.019 4.866 ( -3.439 2.531 3.117) 5.287 5.042 ( -4.672 -0.556 0.920) 4.794 5.236 ( -10.462 10.492 8.035) 16.855 5.450 ( -4.138 -0.720 -3.324) 5.356 5.612 ( 7.311 2.002 -10.577) 13.013 5.755 ( -1.637 -8.835 8.829) 12.598 5.801 ( -4.885 -6.151 -2.976) 8.400 5.967 ( 6.928 -0.422 7.136) 9.955 6.150 ( 0.312 -3.763 -5.197) 6.424 6.287 ( -3.229 1.816 8.773) 9.523 6.523 ( 0.109 1.057 -5.019) 5.130 6.605 ( 3.120 5.207 -2.062) 6.411 6.705 ( -0.962 -2.047 -6.326) 6.718 7.052 ( -4.452 -2.309 2.905) 5.796 7.205 ( 0.705 -0.653 7.227) 7.291 7.345 ( 0.613 -3.958 -0.068) 4.006 7.438 ( 3.359 0.756 -2.053) 4.009 7.514 ( 3.149 5.626 -0.252) 6.452 7.628 ( 5.212 -0.945 -6.762) 8.590 8.038 ( -1.865 1.847 0.720) 2.722 8.137 ( -1.686 0.143 -6.487) 6.704 9.294 ( -1.589 1.078 5.245) 5.585 9.412 ( 3.863 3.545 0.570) 5.274 9.791 ( -1.004 -2.157 1.728) 2.941 9.857 ( -1.980 -2.075 -3.390) 4.440 9.945 ( -0.519 3.198 -0.237) 3.248 10.039 ( 5.574 2.053 -0.974) 6.020 11.297 ( -4.181 -4.294 5.497) 8.132 11.455 ( -4.418 1.483 3.760) 5.988 11.543 ( 0.743 -3.239 -5.666) 6.568 11.647 ( 1.206 -2.877 -1.430) 3.432 11.789 ( -4.556 4.835 -1.706) 6.858 11.873 ( 1.245 4.826 2.450) 5.554 11.953 ( -1.289 -2.878 -1.198) 3.373 12.162 ( 7.971 3.382 -1.740) 8.832 12.308 ( 1.175 -2.175 9.203) 9.529 12.599 ( 1.096 -6.243 -14.197) 15.547 16.072 ( 0.335 0.566 0.368) 0.754 16.087 ( 1.244 1.149 0.624) 1.805 16.950 ( -2.617 -2.102 1.096) 3.531 17.076 ( 1.979 0.722 -2.842) 3.537 17.378 ( -12.511 0.509 1.686) 12.634 17.815 ( 9.544 -2.293 -1.028) 9.869 18.916 ( -5.854 4.929 17.718) 19.300 19.494 ( 6.387 -0.839 -14.181) 15.576 ======================= Grid point 211 (99/170) ======================= q-point: ( 0.18 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.825 ( 2.979 8.311 5.344) 10.320 1.891 ( -2.284 9.580 5.342) 11.204 2.042 ( 3.612 1.486 -10.719) 11.408 2.319 ( 1.685 3.151 -11.529) 12.070 2.481 ( 3.190 5.582 -0.156) 6.431 2.516 ( 6.003 3.258 2.943) 7.437 2.882 ( 2.424 -3.475 4.392) 6.103 3.091 ( 7.715 0.509 -5.110) 9.268 3.219 ( 0.255 7.646 -12.444) 14.608 3.452 ( -2.507 -4.818 1.293) 5.583 3.705 ( -7.488 0.076 3.041) 8.082 4.058 ( 9.633 -1.108 20.254) 22.456 4.329 ( -6.044 -9.398 5.424) 12.421 4.403 ( 0.168 -7.185 -1.933) 7.442 4.774 ( -5.110 -0.303 -1.582) 5.358 4.864 ( 1.577 4.153 -2.965) 5.341 4.987 ( -4.491 -0.837 5.901) 7.462 5.117 ( -13.326 4.225 6.871) 15.577 5.290 ( -5.427 -0.273 -8.642) 10.209 5.578 ( 1.707 3.752 -9.540) 10.393 5.665 ( -4.345 -6.557 2.325) 8.202 5.869 ( 2.430 -4.572 6.528) 8.332 6.023 ( 1.641 3.993 -5.042) 6.638 6.188 ( -0.807 1.973 7.426) 7.726 6.390 ( -2.720 0.768 -8.301) 8.769 6.398 ( 3.448 -0.927 3.567) 5.047 6.617 ( 5.089 5.734 -5.873) 9.658 6.640 ( 0.429 -2.158 -3.055) 3.765 7.058 ( 0.924 -3.007 0.534) 3.191 7.256 ( -0.503 -0.625 -0.222) 0.832 7.345 ( 0.203 -7.803 -0.870) 7.854 7.429 ( -0.289 2.729 -0.777) 2.853 7.599 ( 2.371 3.035 4.808) 6.160 7.644 ( 2.737 6.105 -1.396) 6.834 8.006 ( -4.540 -3.101 -3.437) 6.484 8.065 ( -2.279 -1.560 3.878) 4.760 9.310 ( -0.668 -1.177 1.080) 1.732 9.472 ( -0.004 6.172 0.657) 6.207 9.737 ( -4.320 -1.929 -2.556) 5.377 9.801 ( -3.745 0.545 2.260) 4.408 9.967 ( 5.857 0.070 0.482) 5.877 10.158 ( 9.044 -2.742 -1.775) 9.616 11.315 ( -1.514 -2.076 5.938) 6.470 11.399 ( -5.882 -0.503 0.416) 5.918 11.487 ( -0.071 -2.266 -3.828) 4.449 11.670 ( -1.290 -0.555 0.280) 1.432 11.716 ( 1.186 4.201 0.706) 4.422 11.878 ( -0.377 -2.447 -2.944) 3.846 12.004 ( 2.994 0.319 5.438) 6.216 12.242 ( 4.485 6.265 -3.426) 8.432 12.412 ( -0.370 -1.269 4.044) 4.254 12.453 ( 0.818 -2.286 -7.962) 8.324 16.084 ( 1.151 -0.004 -0.433) 1.230 16.117 ( 1.713 0.732 -0.039) 1.863 16.879 ( -3.234 -1.216 -3.498) 4.917 17.043 ( -2.452 3.040 -1.412) 4.153 17.268 ( -6.392 3.034 5.342) 8.866 17.887 ( -0.360 4.555 -0.333) 4.582 19.083 ( 2.539 -3.822 14.534) 15.241 19.421 ( 4.297 -4.131 -12.854) 14.169 ======================= Grid point 212 (100/170) ======================= q-point: ( 0.27 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.858 ( -3.475 1.805 0.721) 3.981 1.908 ( 1.730 8.211 5.550) 10.061 1.993 ( 3.184 2.666 -9.639) 10.495 2.164 ( -0.047 7.808 -14.420) 16.398 2.535 ( 0.773 -1.279 4.136) 4.398 2.660 ( 5.665 5.687 3.089) 8.601 3.025 ( 8.245 -0.402 3.379) 8.920 3.087 ( 0.177 3.230 -1.588) 3.604 3.289 ( 11.927 -0.649 -2.630) 12.231 3.455 ( -3.443 -2.463 5.839) 7.212 3.678 ( 2.601 9.993 1.127) 10.388 4.157 ( -4.807 -6.179 -6.277) 10.034 4.309 ( -3.970 -12.732 1.248) 13.395 4.460 ( -0.609 -9.376 8.791) 12.867 4.667 ( -2.599 3.071 -6.967) 8.046 4.769 ( -7.159 -0.389 -4.017) 8.218 4.907 ( -3.067 2.394 -2.312) 4.525 5.026 ( -3.080 0.875 5.461) 6.331 5.242 ( 0.613 0.739 3.010) 3.159 5.473 ( -3.301 7.893 -4.403) 9.622 5.656 ( -0.294 -5.768 0.947) 5.852 5.975 ( -1.919 1.558 -5.288) 5.837 5.982 ( 0.686 -4.748 2.904) 5.608 6.229 ( -1.129 5.818 4.255) 7.295 6.262 ( 4.783 -5.224 -3.914) 8.092 6.501 ( 2.240 -0.559 0.711) 2.416 6.647 ( 3.506 -0.342 -1.041) 3.673 6.682 ( 6.907 4.066 -0.705) 8.045 7.042 ( -4.183 -6.183 -1.335) 7.583 7.176 ( -0.611 1.852 -6.791) 7.066 7.362 ( 1.245 -5.281 1.380) 5.599 7.433 ( -0.176 3.871 0.195) 3.880 7.682 ( 3.880 9.763 0.767) 10.534 7.693 ( -1.157 -0.116 6.532) 6.635 7.844 ( -11.483 -7.499 -0.462) 13.723 8.071 ( -2.639 2.224 3.133) 4.661 9.289 ( -0.372 -1.851 -3.103) 3.632 9.430 ( -4.525 3.617 0.945) 5.870 9.657 ( -3.218 -2.676 -0.261) 4.194 9.740 ( -4.093 1.977 0.761) 4.609 10.136 ( 10.127 -4.365 -0.003) 11.028 10.280 ( 8.153 -2.423 -2.386) 8.833 11.272 ( -5.297 -3.803 -3.930) 7.613 11.363 ( -1.901 0.936 3.933) 4.468 11.477 ( 2.095 -1.321 0.527) 2.532 11.603 ( -4.832 2.959 -0.401) 5.680 11.827 ( 5.597 1.185 2.549) 6.263 11.856 ( 2.273 -3.323 -0.425) 4.048 12.097 ( 1.907 1.435 0.788) 2.514 12.228 ( 0.897 4.838 -2.191) 5.386 12.372 ( 2.427 3.270 -4.368) 5.972 12.514 ( -0.911 1.792 7.708) 7.966 16.100 ( 1.753 -0.536 -1.097) 2.136 16.141 ( 1.791 -0.001 -0.957) 2.031 16.801 ( -1.330 1.301 -1.804) 2.592 16.975 ( -3.605 7.379 -1.310) 8.316 17.257 ( -4.521 2.982 8.250) 9.869 17.824 ( -5.985 7.987 0.523) 9.994 19.237 ( 5.954 -13.012 -5.697) 15.402 19.391 ( 1.968 -4.990 1.648) 5.611 ======================= Grid point 213 (101/170) ======================= q-point: ( 0.36 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.828 ( -2.255 -0.611 2.054) 3.111 1.931 ( 0.350 2.020 -4.445) 4.895 2.038 ( 4.158 7.568 6.512) 10.815 2.083 ( 1.922 8.979 1.573) 9.316 2.586 ( 3.297 -3.934 -0.727) 5.184 2.780 ( 5.300 4.150 1.940) 7.006 3.058 ( -0.714 2.148 -0.760) 2.388 3.223 ( 6.092 3.568 4.021) 8.125 3.349 ( -5.448 1.220 4.920) 7.442 3.532 ( 4.677 -2.868 -0.237) 5.492 3.758 ( 7.938 9.809 -6.471) 14.181 3.964 ( -7.402 -4.152 -4.366) 9.544 4.149 ( -4.336 -8.013 -12.661) 15.598 4.439 ( -6.840 -0.476 -7.730) 10.333 4.584 ( 0.264 -10.823 10.153) 14.842 4.738 ( 5.354 -0.719 -1.775) 5.687 4.841 ( -0.129 3.343 -6.975) 7.736 5.091 ( 1.135 1.216 5.774) 6.009 5.262 ( -2.287 0.888 2.331) 3.384 5.381 ( -4.256 6.224 -0.705) 7.573 5.666 ( -0.401 -6.167 1.312) 6.317 5.830 ( -3.480 -0.895 -9.920) 10.551 5.953 ( -0.205 -2.769 -0.934) 2.930 6.312 ( 0.613 -1.043 2.375) 2.665 6.410 ( 6.604 -6.052 7.302) 11.556 6.504 ( 0.581 -0.855 -1.597) 1.902 6.748 ( 7.041 6.668 0.636) 9.718 6.767 ( -0.921 -6.834 4.062) 8.003 6.930 ( -0.714 -2.610 -0.446) 2.743 7.143 ( 2.514 3.439 -3.532) 5.534 7.384 ( 0.480 -0.126 -1.619) 1.693 7.408 ( -1.049 2.138 -2.348) 3.344 7.613 ( -13.249 -10.905 -1.535) 17.228 7.686 ( -5.880 1.384 3.319) 6.892 7.808 ( 6.479 9.554 3.537) 12.073 8.051 ( -3.836 6.118 2.973) 7.809 9.251 ( 0.959 -2.585 -3.149) 4.185 9.366 ( -3.780 -0.400 0.066) 3.802 9.611 ( -3.579 -2.208 2.191) 4.742 9.720 ( 0.013 1.197 1.949) 2.287 10.230 ( 5.240 -6.704 -5.826) 10.312 10.351 ( 3.579 -2.828 -5.124) 6.860 11.160 ( -2.061 -1.693 -3.101) 4.090 11.339 ( -2.654 3.738 -0.110) 4.585 11.516 ( -3.144 3.012 -0.622) 4.398 11.561 ( 2.919 -2.216 3.499) 5.067 11.864 ( 1.990 -0.080 -0.933) 2.199 12.002 ( 5.206 0.837 5.532) 7.642 12.104 ( 2.944 1.541 -2.404) 4.101 12.270 ( 0.225 3.606 4.543) 5.804 12.383 ( 2.893 6.640 -0.935) 7.302 12.568 ( -2.704 3.450 6.441) 7.790 16.115 ( 1.744 -0.956 -1.461) 2.468 16.152 ( 1.338 -0.704 -1.761) 2.321 16.799 ( 0.730 3.844 1.690) 4.262 16.910 ( -2.066 9.526 -0.523) 9.762 17.301 ( -4.355 1.972 11.509) 12.463 17.728 ( -5.363 6.516 0.322) 8.445 19.218 ( 7.872 -11.978 -13.164) 19.461 19.425 ( -3.692 -9.602 2.112) 10.501 ======================= Grid point 214 (102/170) ======================= q-point: ( 0.45 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.841 ( -2.814 0.035 8.030) 8.509 1.920 ( -1.595 3.414 4.404) 5.796 2.199 ( 5.134 3.336 9.297) 11.132 2.213 ( 4.368 5.282 4.290) 8.086 2.662 ( 5.323 -5.046 2.332) 7.696 2.896 ( 8.233 2.585 -0.293) 8.634 3.008 ( -4.886 6.865 -1.033) 8.489 3.269 ( -7.865 3.225 -0.145) 8.502 3.312 ( 2.421 2.963 -0.172) 3.831 3.440 ( -7.154 -1.633 -7.150) 10.245 3.751 ( 0.485 0.810 -12.845) 12.880 3.819 ( 2.914 2.992 -11.988) 12.694 4.054 ( 5.036 -1.274 -0.792) 5.254 4.270 ( -7.390 -1.380 -2.318) 7.867 4.681 ( -2.021 -4.129 7.416) 8.725 4.780 ( -0.500 -3.676 -1.433) 3.977 4.858 ( 8.551 -3.977 -0.532) 9.445 5.139 ( 0.227 1.212 -0.492) 1.328 5.268 ( 1.036 2.398 1.542) 3.033 5.300 ( -6.696 3.751 2.782) 8.163 5.649 ( -1.981 -4.565 -4.447) 6.674 5.691 ( 1.237 -6.594 -5.215) 8.498 6.003 ( 5.337 -0.220 1.258) 5.487 6.192 ( -10.468 3.816 -3.197) 11.592 6.492 ( -1.898 -5.724 2.699) 6.607 6.649 ( 6.821 -4.983 10.129) 13.190 6.702 ( -0.030 -12.675 -2.129) 12.852 6.976 ( 7.736 -0.213 8.301) 11.349 7.020 ( 8.419 4.087 -0.685) 9.383 7.148 ( 0.631 3.782 -1.357) 4.067 7.302 ( -5.030 5.403 -6.228) 9.658 7.360 ( -2.252 -4.101 -2.652) 5.378 7.411 ( -6.175 -7.684 -0.305) 9.862 7.584 ( -6.028 2.701 -2.327) 7.003 7.965 ( 4.761 7.731 4.121) 9.970 8.020 ( -2.417 8.691 2.741) 9.428 9.257 ( 2.871 -4.155 -1.511) 5.272 9.301 ( -3.670 -2.790 -0.645) 4.655 9.604 ( -1.146 -1.443 4.116) 4.510 9.767 ( 0.841 -1.150 3.685) 3.951 10.198 ( 0.612 -4.565 -8.119) 9.334 10.265 ( -1.922 -3.840 -9.339) 10.279 11.138 ( 0.636 2.354 0.425) 2.475 11.293 ( -0.742 4.518 -2.314) 5.130 11.490 ( -0.309 2.083 1.718) 2.718 11.627 ( 0.959 -1.230 0.826) 1.765 11.895 ( 2.485 0.986 0.578) 2.735 12.055 ( -1.157 3.519 -1.432) 3.971 12.193 ( 3.008 -0.424 5.654) 6.418 12.312 ( -0.430 2.923 2.991) 4.204 12.468 ( 6.187 5.700 2.406) 8.750 12.569 ( -4.124 6.291 3.913) 8.479 16.122 ( 0.912 -1.119 -1.393) 2.006 16.144 ( 0.361 -1.065 -2.025) 2.316 16.843 ( 1.274 4.778 2.532) 5.555 16.909 ( 0.972 9.532 1.052) 9.639 17.364 ( -5.311 1.466 12.847) 13.979 17.675 ( -0.530 3.143 0.168) 3.191 19.230 ( 9.405 -11.272 -10.223) 17.889 19.296 ( -9.337 -9.729 -4.097) 14.093 ======================= Grid point 215 (103/170) ======================= q-point: (-0.45 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.878 ( -5.931 -0.884 9.969) 11.633 1.999 ( -0.377 2.331 9.910) 10.187 2.241 ( -6.332 3.453 4.148) 8.320 2.347 ( 2.670 1.520 -2.400) 3.899 2.729 ( -8.253 -0.367 -2.028) 8.506 2.921 ( 3.808 -0.249 6.044) 7.148 3.064 ( 10.997 2.133 -1.748) 11.337 3.150 ( -9.424 1.736 -3.856) 10.329 3.231 ( 3.172 3.289 -1.964) 4.974 3.383 ( 8.147 2.333 -3.769) 9.275 3.597 ( -1.548 7.589 -10.323) 12.906 3.729 ( -0.163 5.382 -9.893) 11.263 4.092 ( -8.651 -2.917 0.323) 9.135 4.217 ( 8.639 -1.985 0.899) 8.909 4.677 ( -5.698 -1.495 3.011) 6.616 4.748 ( -5.021 0.360 1.550) 5.267 4.967 ( 1.754 -9.215 4.948) 10.606 5.088 ( -3.827 0.426 -2.189) 4.429 5.211 ( -4.615 1.707 -1.579) 5.168 5.329 ( 3.861 2.388 1.059) 4.661 5.577 ( -1.384 -5.427 -1.547) 5.811 5.697 ( 4.302 -9.529 -4.111) 11.235 6.037 ( -3.550 4.239 1.008) 5.621 6.132 ( 7.338 4.968 0.195) 8.864 6.485 ( -3.536 -8.197 5.107) 10.285 6.692 ( 2.323 -12.814 -3.924) 13.601 6.861 ( 2.957 -4.073 8.674) 10.029 7.058 ( -1.846 -1.320 -5.361) 5.821 7.138 ( 0.722 1.643 3.339) 3.790 7.147 ( -4.104 0.172 -2.728) 4.931 7.229 ( 11.297 3.743 1.472) 11.992 7.245 ( -4.328 -1.852 -4.604) 6.585 7.395 ( 0.054 2.468 1.071) 2.691 7.493 ( 2.018 0.743 -2.951) 3.652 7.963 ( -4.910 8.529 3.288) 10.376 8.116 ( 6.050 5.568 0.485) 8.237 9.225 ( -4.239 -4.108 -0.590) 5.932 9.306 ( 3.869 -5.250 -0.468) 6.538 9.668 ( 0.488 -1.859 6.931) 7.192 9.800 ( -0.791 -4.281 0.534) 4.386 10.071 ( -3.116 0.831 -5.792) 6.629 10.146 ( -1.439 -3.387 -6.722) 7.664 11.170 ( 1.400 4.433 1.831) 4.996 11.262 ( 0.833 3.547 -3.538) 5.078 11.543 ( 2.895 1.370 3.033) 4.411 11.619 ( 0.013 -0.332 -2.437) 2.459 11.924 ( -3.754 1.219 1.458) 4.207 12.018 ( 1.865 3.945 -1.371) 4.574 12.238 ( -5.083 0.713 4.549) 6.859 12.339 ( -0.167 0.644 1.533) 1.671 12.532 ( -2.766 10.343 0.719) 10.730 12.624 ( 8.171 2.389 2.337) 8.828 16.111 ( -0.647 -1.131 -0.994) 1.639 16.121 ( -0.417 -0.828 -1.464) 1.733 16.904 ( 2.424 5.973 1.649) 6.654 16.929 ( 0.772 8.095 -0.525) 8.149 17.422 ( -4.465 1.455 12.235) 13.106 17.723 ( 5.805 0.186 -0.304) 5.816 19.016 ( -15.779 -8.611 -4.199) 18.460 19.323 ( 11.736 -10.780 -6.621) 17.256 ======================= Grid point 216 (104/170) ======================= q-point: (-0.36 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.823 ( -14.263 -2.504 4.048) 15.036 2.003 ( -11.471 5.625 -7.228) 14.679 2.091 ( -8.106 3.710 2.666) 9.305 2.277 ( -2.871 5.386 6.003) 8.561 2.605 ( -0.953 -7.536 -2.471) 7.988 2.856 ( -6.890 0.082 -10.004) 12.147 3.164 ( 9.425 2.344 5.408) 11.117 3.248 ( 4.768 1.946 2.651) 5.792 3.362 ( -14.934 12.261 -0.348) 19.326 3.469 ( 11.235 1.243 5.442) 12.545 3.509 ( 7.124 2.978 -0.613) 7.745 3.610 ( 2.340 6.645 -6.818) 9.804 3.966 ( -4.230 -2.689 0.130) 5.014 4.365 ( 6.662 -3.426 -0.749) 7.529 4.591 ( -4.989 -0.710 1.680) 5.312 4.707 ( -0.430 2.947 1.556) 3.361 4.987 ( -9.057 -2.935 5.753) 11.123 5.011 ( 0.119 -5.001 -4.100) 6.468 5.149 ( 2.022 -2.665 -1.271) 3.579 5.415 ( 3.780 2.143 2.250) 4.893 5.560 ( 0.044 -5.872 1.853) 6.158 5.728 ( 4.891 -8.428 -4.366) 10.678 6.081 ( 3.272 1.230 2.229) 4.146 6.194 ( -1.409 8.079 1.887) 8.415 6.503 ( -3.570 -8.273 6.252) 10.967 6.665 ( 0.617 -10.375 -4.695) 11.405 6.860 ( -6.907 -0.108 -10.821) 12.838 6.948 ( 0.781 -2.193 1.504) 2.772 7.062 ( -5.959 -3.193 -2.369) 7.163 7.106 ( -2.329 5.684 -4.244) 7.466 7.224 ( 2.712 4.531 3.538) 6.356 7.379 ( 4.562 2.090 -0.625) 5.057 7.517 ( 12.832 -2.947 3.878) 13.725 7.586 ( 7.257 -0.392 2.173) 7.586 7.902 ( -5.929 9.879 1.237) 11.588 8.196 ( 5.308 1.132 -3.024) 6.213 9.151 ( -3.917 -4.097 0.175) 5.671 9.363 ( 2.727 -4.390 -0.020) 5.168 9.712 ( -2.212 -6.432 1.476) 6.960 9.804 ( 1.588 -2.585 1.722) 3.488 10.011 ( -2.437 0.233 2.346) 3.390 10.060 ( -1.476 0.235 -2.452) 2.872 11.219 ( 1.023 5.467 -1.172) 5.684 11.240 ( 2.454 2.652 -0.831) 3.708 11.596 ( 1.454 -0.552 -2.802) 3.205 11.637 ( 4.032 -0.799 1.803) 4.488 11.832 ( -5.549 2.930 -0.283) 6.281 12.047 ( -0.837 1.986 0.859) 2.320 12.174 ( -4.550 0.494 0.500) 4.604 12.304 ( -5.291 3.352 1.173) 6.373 12.498 ( -1.010 9.900 -2.169) 10.185 12.774 ( 7.849 -0.530 -0.688) 7.897 16.080 ( -1.634 -0.932 -0.536) 1.956 16.100 ( -0.968 -0.278 -0.211) 1.029 16.907 ( -0.309 6.222 -1.931) 6.522 16.955 ( 1.775 8.042 -1.211) 8.324 17.523 ( 0.854 3.327 11.012) 11.535 17.820 ( 7.956 -1.999 -5.717) 9.999 18.713 ( -17.548 -7.153 3.175) 19.214 19.459 ( 10.412 -11.572 -3.062) 15.865 ======================= Grid point 217 (105/170) ======================= q-point: (-0.27 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.480 ( -22.967 6.660 -3.580) 24.179 1.602 ( -21.791 5.673 0.688) 22.527 2.162 ( 2.691 3.478 6.575) 7.910 2.315 ( 2.372 3.821 -2.303) 5.053 2.513 ( -7.264 -7.379 0.142) 10.355 2.730 ( -8.447 2.409 -2.781) 9.214 2.941 ( -16.635 13.797 3.953) 21.971 3.257 ( 1.392 6.666 -8.131) 10.606 3.306 ( -11.898 7.886 -4.898) 15.091 3.499 ( 7.907 -7.792 6.393) 12.810 3.734 ( 6.064 -0.768 9.507) 11.302 3.860 ( 16.256 0.586 4.112) 16.778 3.988 ( 6.097 -0.563 1.161) 6.232 4.447 ( 4.652 -4.255 0.666) 6.340 4.567 ( 0.504 0.430 2.033) 2.139 4.756 ( 2.978 0.769 -0.484) 3.113 4.892 ( -5.236 -3.175 2.249) 6.523 5.002 ( 4.548 -2.729 -3.312) 6.253 5.191 ( 0.382 -0.440 1.767) 1.860 5.505 ( 4.432 1.258 0.641) 4.652 5.656 ( 6.003 -6.947 5.256) 10.579 5.759 ( 3.090 -3.263 0.277) 4.502 6.074 ( -4.570 0.101 -2.204) 5.074 6.208 ( -1.706 4.046 4.541) 6.317 6.437 ( -7.507 -6.642 -1.611) 10.152 6.565 ( -7.750 -3.295 -13.050) 15.532 6.651 ( -0.667 -3.286 -1.343) 3.612 6.888 ( -7.260 0.777 -4.213) 8.430 6.966 ( -3.614 4.543 2.796) 6.443 7.081 ( 3.322 -0.727 -1.493) 3.714 7.314 ( 3.968 7.273 2.218) 8.577 7.439 ( 2.755 0.397 -1.460) 3.143 7.709 ( 6.076 -2.223 1.089) 6.561 7.773 ( -3.996 8.015 -0.452) 8.967 7.853 ( 12.542 -0.143 4.747) 13.411 8.231 ( 4.609 -4.576 -4.921) 8.148 9.107 ( -2.752 -2.845 2.292) 4.574 9.395 ( 0.925 -1.052 1.180) 1.832 9.709 ( -1.196 -8.272 1.208) 8.445 9.813 ( 2.243 -0.909 -2.867) 3.752 10.013 ( -2.926 0.033 2.743) 4.011 10.069 ( -0.362 -0.135 6.647) 6.658 11.180 ( 0.548 1.198 -4.056) 4.264 11.323 ( 3.264 5.235 3.521) 7.103 11.607 ( 2.968 -1.778 -2.135) 4.065 11.669 ( 0.239 -4.081 -3.071) 5.113 11.797 ( 0.557 3.835 2.369) 4.542 11.984 ( -5.655 1.579 0.052) 5.872 12.098 ( -3.390 -0.077 -4.775) 5.857 12.231 ( -4.497 6.178 1.881) 7.870 12.427 ( -3.502 6.891 -3.658) 8.552 12.860 ( 6.237 -2.777 -5.076) 8.508 16.051 ( -1.577 -0.442 0.304) 1.666 16.084 ( -1.269 0.283 0.695) 1.474 16.864 ( -1.793 5.880 -2.685) 6.708 16.959 ( 2.033 8.836 -2.009) 9.287 17.684 ( 5.269 3.630 2.694) 6.943 17.819 ( 3.571 0.948 -7.452) 8.317 18.564 ( -11.806 -7.759 14.518) 20.257 19.578 ( 6.693 -12.021 -2.345) 13.957 ======================= Grid point 218 (106/170) ======================= q-point: (-0.18 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.166 ( -17.215 11.226 14.448) 25.122 1.313 ( -21.398 7.924 13.654) 26.592 2.231 ( 4.122 3.709 -7.975) 9.713 2.303 ( 0.718 9.696 -3.304) 10.269 2.351 ( -29.213 19.416 13.263) 37.500 2.449 ( -4.902 -5.818 4.776) 8.982 2.969 ( -12.257 3.062 -8.035) 14.972 3.057 ( 13.861 -3.359 0.992) 14.297 3.204 ( -0.431 8.735 -4.341) 9.763 3.616 ( 2.424 -5.512 -3.059) 6.754 3.861 ( 1.938 -6.943 4.381) 8.435 4.112 ( 6.938 1.160 -1.728) 7.243 4.198 ( 8.880 -7.940 13.449) 17.966 4.543 ( 4.490 -4.898 2.701) 7.173 4.710 ( 9.823 1.694 7.289) 12.349 4.759 ( 0.549 -8.400 -0.812) 8.457 4.912 ( 0.918 6.882 3.385) 7.724 5.050 ( 3.095 -2.342 -0.802) 3.963 5.199 ( 1.486 2.666 -0.541) 3.100 5.546 ( 4.754 1.153 -7.821) 9.225 5.751 ( -2.684 -0.656 7.274) 7.781 5.902 ( -8.003 0.278 -7.133) 10.724 5.966 ( 10.121 -5.308 6.619) 13.207 6.138 ( -5.484 5.038 -3.342) 8.162 6.297 ( -5.670 -6.159 -6.141) 10.382 6.338 ( -3.600 -6.208 2.496) 7.598 6.635 ( -2.300 3.473 0.080) 4.166 6.736 ( -3.987 0.354 -4.132) 5.753 6.942 ( -3.038 5.967 3.666) 7.634 7.142 ( 2.577 -1.603 2.288) 3.800 7.398 ( 2.651 4.591 0.943) 5.385 7.409 ( -1.872 1.550 -3.159) 3.985 7.674 ( -2.389 8.776 -2.321) 9.386 7.761 ( -1.301 -4.632 -0.471) 4.835 8.136 ( 11.342 5.176 0.729) 12.488 8.247 ( 6.231 -13.221 -6.189) 15.872 9.117 ( -1.226 -0.849 4.954) 5.174 9.441 ( 0.671 3.219 4.009) 5.186 9.665 ( -2.674 -3.446 0.101) 4.362 9.880 ( 6.419 -1.629 -0.793) 6.670 9.969 ( -4.822 -1.331 0.629) 5.041 10.110 ( -2.270 2.972 1.693) 4.105 11.186 ( 2.389 -4.171 2.067) 5.233 11.417 ( 2.816 2.327 4.489) 5.788 11.625 ( 4.050 -3.975 -5.450) 7.868 11.658 ( 1.371 -4.164 0.371) 4.400 11.823 ( 0.210 5.264 -1.357) 5.440 11.921 ( -2.995 0.159 1.065) 3.183 11.944 ( -3.943 -0.621 -6.744) 7.837 12.180 ( -5.175 5.745 2.259) 8.055 12.303 ( -5.945 4.827 -3.265) 8.325 12.867 ( 4.720 -4.593 -9.252) 11.357 16.037 ( -0.961 0.149 0.976) 1.377 16.074 ( -1.250 0.755 1.167) 1.869 16.804 ( -1.139 4.745 -1.527) 5.113 16.991 ( 2.643 8.318 0.230) 8.731 17.625 ( 0.497 -3.386 -11.015) 11.534 17.923 ( 5.663 9.240 2.260) 11.071 18.610 ( -6.517 -8.322 17.732) 20.644 19.609 ( 1.968 -8.044 -5.181) 9.769 ======================= Grid point 219 (107/170) ======================= q-point: (-0.09 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.193 ( -12.784 7.481 23.736) 27.979 1.318 ( -4.365 11.236 29.007) 31.412 2.094 ( -15.254 20.579 16.381) 30.405 2.198 ( 0.321 8.124 -3.122) 8.709 2.354 ( 5.928 7.577 -2.546) 9.952 2.453 ( 1.350 1.396 3.715) 4.191 2.682 ( -9.972 2.251 -6.137) 11.924 3.132 ( -0.642 2.543 -7.721) 8.155 3.280 ( 8.055 -1.447 -6.698) 10.575 3.599 ( 5.432 -3.056 -4.518) 7.698 3.924 ( 1.078 -14.049 0.447) 14.097 4.147 ( 0.954 -7.109 -0.949) 7.235 4.384 ( -0.749 -7.244 2.210) 7.610 4.664 ( 2.430 -0.289 7.355) 7.751 4.742 ( -1.820 -5.639 -3.904) 7.096 4.882 ( -6.579 4.965 0.026) 8.243 4.995 ( 7.345 -3.922 8.144) 11.647 5.116 ( 2.897 4.741 6.623) 8.645 5.318 ( 12.003 -3.351 3.569) 12.963 5.529 ( 6.941 -0.900 -7.934) 10.580 5.649 ( -12.452 4.241 5.750) 14.356 5.745 ( -4.201 9.078 -4.469) 10.956 6.039 ( 1.195 -4.922 -3.930) 6.411 6.098 ( 0.782 -5.190 -0.113) 5.249 6.319 ( -2.693 -2.739 5.389) 6.618 6.396 ( 7.660 -4.827 7.620) 11.834 6.567 ( -2.046 5.318 -2.507) 6.225 6.692 ( 3.476 -0.659 -3.126) 4.722 6.955 ( -0.805 4.722 4.507) 6.577 7.214 ( 1.416 -1.273 3.806) 4.255 7.333 ( -3.276 -1.262 0.934) 3.633 7.446 ( 2.324 4.159 -1.277) 4.932 7.596 ( -5.244 3.820 -6.052) 8.872 7.669 ( -4.382 -8.042 -1.006) 9.213 8.174 ( -0.791 -0.858 -3.069) 3.283 8.310 ( 8.809 3.455 -12.078) 15.343 9.167 ( -0.943 0.935 6.192) 6.333 9.458 ( -4.033 4.935 1.930) 6.660 9.686 ( 2.632 0.055 3.558) 4.426 9.865 ( -4.118 -1.453 -1.853) 4.744 9.968 ( 3.719 -0.057 -0.772) 3.799 10.054 ( -1.678 6.629 -2.875) 7.418 11.265 ( -0.124 -5.607 5.211) 7.656 11.550 ( 7.018 -3.606 1.060) 7.961 11.620 ( 1.406 -3.372 -4.097) 5.489 11.666 ( -3.369 -4.524 -2.621) 6.220 11.801 ( 2.046 2.543 -3.064) 4.477 11.811 ( 1.365 -2.727 1.918) 3.603 11.981 ( 1.388 1.526 4.283) 4.754 12.108 ( -5.716 5.615 1.607) 8.173 12.166 ( -6.402 3.450 -1.083) 7.352 12.814 ( 3.918 -6.014 -12.037) 14.014 16.040 ( -0.187 0.714 1.293) 1.489 16.069 ( -0.986 1.004 1.163) 1.825 16.823 ( 2.611 -0.144 2.820) 3.846 17.038 ( 1.844 5.618 0.800) 5.967 17.562 ( 4.578 -3.862 -5.898) 8.406 17.907 ( -7.029 1.771 -5.079) 8.851 18.731 ( -4.528 -2.292 17.897) 18.602 19.555 ( 2.970 2.151 -8.645) 9.391 ======================= Grid point 220 (108/170) ======================= q-point: ( 0.00 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.622 ( 4.240 17.092 11.851) 21.226 1.879 ( 2.688 12.725 23.003) 26.425 2.106 ( 3.103 2.010 -10.137) 10.790 2.422 ( 2.719 2.358 -3.124) 4.766 2.480 ( -1.481 2.019 1.390) 2.864 2.583 ( -0.204 7.987 2.238) 8.297 2.983 ( -0.099 -5.400 -8.057) 9.699 3.098 ( -3.288 12.806 -1.714) 13.332 3.252 ( 0.615 15.327 13.770) 20.613 3.479 ( 0.719 -9.680 -5.581) 11.197 3.551 ( -3.412 -15.681 -2.375) 16.223 3.950 ( -2.018 -3.068 0.280) 3.682 4.338 ( -1.938 3.740 -0.042) 4.212 4.498 ( -4.538 -3.392 -5.484) 7.885 4.776 ( -2.809 2.949 9.498) 10.334 4.951 ( 0.220 3.984 1.401) 4.229 5.015 ( -0.919 -4.675 3.987) 6.212 5.350 ( 6.675 -1.013 -1.285) 6.873 5.418 ( 2.497 -7.057 8.775) 11.534 5.578 ( -3.214 0.507 -0.799) 3.350 5.630 ( -0.814 1.209 -0.279) 1.484 5.770 ( 1.805 1.415 -0.779) 2.422 5.900 ( -3.595 1.700 -2.235) 4.562 6.094 ( 5.067 2.513 -3.306) 6.552 6.313 ( -5.344 2.207 8.615) 10.376 6.547 ( 0.178 -1.459 -0.246) 1.490 6.574 ( 8.546 2.264 3.006) 9.338 6.714 ( 2.668 -1.679 -2.143) 3.811 7.050 ( 0.519 0.097 2.262) 2.323 7.180 ( -9.642 -0.216 3.813) 10.371 7.297 ( -0.424 -1.363 -1.192) 1.859 7.379 ( 3.227 -2.832 -0.282) 4.302 7.585 ( 3.025 4.891 -2.147) 6.139 7.671 ( -0.204 5.566 -5.749) 8.004 8.048 ( -0.279 -6.218 -2.682) 6.778 8.229 ( -0.774 -8.586 -11.076) 14.035 9.283 ( 0.894 2.373 5.700) 6.239 9.429 ( -3.928 -0.128 0.079) 3.931 9.738 ( 1.454 -1.341 0.440) 2.026 9.787 ( 0.468 -2.333 -0.687) 2.477 10.036 ( -1.387 5.007 3.717) 6.389 10.203 ( -1.819 9.365 -0.735) 9.568 11.225 ( -0.394 -1.802 2.487) 3.096 11.463 ( 0.671 -3.125 -4.358) 5.404 11.546 ( -2.222 -2.393 0.821) 3.367 11.614 ( 2.486 0.173 -2.380) 3.446 11.805 ( 0.456 -1.211 0.355) 1.342 11.870 ( 8.317 -5.206 2.270) 10.071 12.053 ( -6.437 0.161 -0.893) 6.500 12.123 ( 5.378 4.428 -2.134) 7.286 12.185 ( -3.222 5.369 3.794) 7.321 12.564 ( 1.162 -8.304 -10.338) 13.311 16.087 ( 0.485 1.795 1.211) 2.219 16.096 ( -0.339 1.613 0.851) 1.855 16.892 ( 1.675 0.048 2.285) 2.833 17.080 ( 0.642 0.072 -2.977) 3.046 17.537 ( 9.528 -6.027 -2.413) 11.530 17.581 ( -12.799 -5.194 -6.230) 15.153 18.970 ( -3.486 8.836 18.247) 20.572 19.587 ( 2.612 1.559 -8.167) 8.715 ======================= Grid point 221 (109/170) ======================= q-point: ( 0.09 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.849 ( 8.633 12.565 5.742) 16.290 2.071 ( 5.497 2.037 -8.289) 10.152 2.118 ( -1.205 11.432 10.688) 15.697 2.429 ( -0.086 2.257 2.482) 3.356 2.517 ( 6.244 5.525 4.496) 9.473 2.602 ( 0.825 6.719 -10.174) 12.220 2.852 ( -3.116 1.150 -5.018) 6.018 2.993 ( 0.893 -6.135 -1.178) 6.311 3.369 ( -5.363 -6.538 2.093) 8.712 3.425 ( -2.460 -8.088 -1.792) 8.642 3.668 ( 5.382 6.826 14.120) 16.581 3.841 ( 0.641 8.014 -5.603) 9.800 4.311 ( -8.049 1.081 7.800) 11.261 4.385 ( -1.703 -1.242 -5.242) 5.650 4.835 ( 1.050 2.840 4.558) 5.472 4.928 ( -5.008 3.616 1.314) 6.315 5.014 ( -2.455 -1.448 1.594) 3.266 5.294 ( -14.082 -7.340 1.423) 15.944 5.375 ( -0.708 -3.895 -6.938) 7.988 5.586 ( 0.006 -2.888 5.933) 6.599 5.696 ( 2.161 3.210 -2.033) 4.370 5.776 ( -2.974 -0.624 -0.507) 3.081 5.965 ( 11.361 0.904 5.874) 12.822 6.102 ( 3.007 2.706 -5.210) 6.596 6.341 ( -2.555 3.390 7.687) 8.781 6.542 ( -1.038 0.336 -2.496) 2.724 6.647 ( -2.313 -2.296 -6.321) 7.111 6.713 ( 5.595 3.954 -1.090) 6.937 7.028 ( -5.854 -0.430 3.411) 6.789 7.176 ( 1.568 -5.475 1.992) 6.033 7.255 ( -0.654 -0.442 0.027) 0.790 7.471 ( 4.482 1.329 0.007) 4.675 7.620 ( 3.009 4.894 -3.423) 6.687 7.644 ( 4.956 2.644 -1.811) 5.902 8.002 ( -3.556 -7.540 -3.031) 8.870 8.071 ( -3.531 -5.845 -3.290) 7.580 9.314 ( -3.341 0.722 3.247) 4.714 9.453 ( 4.619 -0.676 2.433) 5.264 9.759 ( 0.225 -1.013 -0.108) 1.043 9.788 ( 0.688 -3.594 -1.598) 3.993 10.030 ( -4.238 6.442 3.606) 8.512 10.139 ( -4.153 6.492 0.547) 7.726 11.245 ( -0.098 -0.988 2.561) 2.747 11.458 ( 3.689 -2.362 -4.528) 6.300 11.489 ( -5.021 -0.815 0.107) 5.088 11.604 ( 0.077 -1.036 -0.712) 1.259 11.839 ( 0.287 -1.041 -1.520) 1.865 11.898 ( -0.492 -0.525 -2.517) 2.618 11.960 ( -2.564 1.885 0.977) 3.329 12.240 ( 10.792 3.304 -2.031) 11.468 12.283 ( 3.289 0.910 7.395) 8.145 12.465 ( 1.588 -5.843 -10.310) 11.956 16.092 ( -0.412 1.360 0.376) 1.470 16.114 ( 0.861 1.497 0.624) 1.836 16.922 ( -1.509 -0.617 0.890) 1.858 17.075 ( 3.149 -1.112 -4.389) 5.515 17.367 ( -6.369 -1.540 -0.379) 6.563 17.729 ( 13.749 -6.376 -0.013) 15.156 19.052 ( -10.177 8.372 15.978) 20.711 19.481 ( -1.601 -0.349 -10.118) 10.250 ======================= Grid point 222 (110/170) ======================= q-point: ( 0.18 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.972 ( 1.199 5.746 -0.411) 5.885 2.083 ( 8.071 3.076 -12.577) 15.258 2.114 ( -2.795 10.108 2.100) 10.695 2.391 ( -2.065 3.947 -14.226) 14.907 2.539 ( 3.642 5.198 7.955) 10.177 2.733 ( 5.511 11.480 1.663) 12.842 2.815 ( 4.453 -2.796 4.250) 6.761 3.065 ( 0.619 -2.383 5.057) 5.624 3.302 ( -5.661 -7.675 1.989) 9.742 3.345 ( -0.289 1.385 -1.706) 2.216 3.721 ( 6.657 1.132 -5.703) 8.838 4.023 ( 4.453 -1.957 7.519) 8.955 4.228 ( -11.969 1.001 8.305) 14.602 4.323 ( -0.947 0.575 -0.840) 1.390 4.821 ( -5.913 4.759 1.233) 7.690 4.932 ( 2.339 -0.619 2.053) 3.173 4.972 ( -3.214 1.366 -3.523) 4.961 5.095 ( -11.559 -4.394 2.023) 12.530 5.225 ( -2.878 -4.040 -6.887) 8.487 5.605 ( -0.617 -1.251 -0.182) 1.407 5.684 ( -1.259 2.746 -1.451) 3.351 5.784 ( -0.706 -1.244 6.985) 7.130 6.088 ( 0.678 2.082 -2.402) 3.250 6.181 ( 6.329 -0.444 -2.653) 6.877 6.359 ( -3.773 -0.109 -0.359) 3.791 6.458 ( -1.437 2.987 1.371) 3.587 6.554 ( -0.799 -5.364 -3.218) 6.306 6.767 ( 5.650 6.059 -5.048) 9.702 6.987 ( -4.444 -4.798 2.356) 6.951 7.175 ( 1.824 -4.880 -1.585) 5.446 7.301 ( 1.386 3.632 2.066) 4.402 7.491 ( -0.302 3.363 -0.337) 3.393 7.664 ( 3.777 1.540 0.311) 4.090 7.739 ( 4.829 3.366 1.461) 6.065 7.841 ( -7.321 -10.116 -4.074) 13.135 8.077 ( 0.387 -0.092 3.839) 3.860 9.294 ( -1.732 -0.617 0.501) 1.906 9.528 ( -0.715 -1.886 1.432) 2.474 9.702 ( -4.226 -1.623 -3.235) 5.564 9.810 ( 0.297 0.219 3.283) 3.304 9.975 ( -2.313 2.255 0.212) 3.237 10.144 ( 2.163 1.317 2.543) 3.589 11.295 ( 1.139 -0.106 4.018) 4.178 11.362 ( -3.445 -2.780 -6.841) 8.148 11.462 ( -0.819 0.101 -0.261) 0.865 11.642 ( 2.915 -0.902 1.371) 3.346 11.772 ( -1.346 -1.676 -3.547) 4.147 11.852 ( 0.086 1.845 -1.707) 2.515 12.041 ( 3.653 2.289 5.147) 6.714 12.306 ( 2.526 -2.038 -8.437) 9.039 12.407 ( 4.014 3.633 3.065) 6.221 12.461 ( 6.322 2.982 0.638) 7.019 16.089 ( 0.153 0.548 -0.356) 0.671 16.132 ( 0.780 0.738 -0.075) 1.076 16.874 ( -1.217 0.753 -2.944) 3.274 17.076 ( 0.199 0.387 0.719) 0.840 17.344 ( 0.069 3.827 1.859) 4.255 17.945 ( 9.130 -0.410 1.399) 9.246 19.013 ( -9.516 -1.862 6.789) 11.837 19.336 ( -3.664 -3.872 -5.624) 7.749 ======================= Grid point 223 (111/170) ======================= q-point: ( 0.27 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.908 ( -4.930 3.828 -0.565) 6.267 2.031 ( 3.544 1.279 -13.042) 13.575 2.130 ( 4.043 12.715 0.400) 13.348 2.307 ( 1.635 4.029 -1.908) 4.748 2.585 ( -8.570 7.531 5.217) 12.545 2.802 ( 10.868 6.200 -5.383) 13.621 3.036 ( 9.598 3.212 3.080) 10.579 3.091 ( 1.545 -2.492 -2.345) 3.754 3.261 ( -4.347 -3.705 10.841) 12.253 3.426 ( 5.957 -0.452 2.445) 6.455 3.817 ( 7.634 -0.249 -0.235) 7.642 4.050 ( -6.620 -10.541 2.033) 12.612 4.115 ( -4.174 5.231 -2.257) 7.063 4.332 ( -3.159 -2.500 5.226) 6.598 4.716 ( -10.251 -2.052 -10.849) 15.066 4.760 ( -1.873 4.347 -1.286) 4.905 4.968 ( 5.197 1.674 -8.571) 10.162 5.031 ( -4.691 -0.229 7.681) 9.003 5.208 ( -0.730 -2.402 5.370) 5.928 5.583 ( 1.955 -0.783 -5.412) 5.808 5.610 ( -7.479 2.662 2.051) 8.199 5.868 ( 0.410 -5.566 3.931) 6.827 6.016 ( -4.576 1.942 -7.598) 9.080 6.128 ( 1.137 -6.197 -3.586) 7.249 6.283 ( -1.373 -0.638 -3.104) 3.454 6.497 ( 2.055 -1.027 0.981) 2.498 6.593 ( 1.649 -2.239 6.577) 7.141 6.786 ( 0.651 -1.676 -4.434) 4.785 6.942 ( -0.963 0.015 1.589) 1.858 7.200 ( 3.301 1.052 -4.326) 5.542 7.320 ( -1.570 1.013 2.443) 3.075 7.496 ( -0.564 2.390 1.822) 3.058 7.645 ( -9.987 -9.325 -0.120) 13.664 7.728 ( 2.086 2.943 0.040) 3.608 7.862 ( 5.960 7.424 1.685) 9.668 8.132 ( 0.363 2.681 3.742) 4.618 9.253 ( -1.556 -1.834 -3.118) 3.938 9.458 ( -7.196 -1.695 0.102) 7.394 9.603 ( -2.941 -2.144 -2.196) 4.251 9.785 ( -4.805 2.430 1.825) 5.685 10.038 ( 6.223 -4.255 0.301) 7.545 10.222 ( 3.977 -3.749 0.163) 5.468 11.221 ( -2.610 -0.581 -4.785) 5.481 11.384 ( 1.702 0.859 3.149) 3.681 11.456 ( 0.376 -0.506 1.335) 1.477 11.626 ( -2.001 0.132 -3.241) 3.812 11.814 ( 4.800 -1.208 2.296) 5.456 11.886 ( 3.023 3.238 3.574) 5.692 12.129 ( 3.208 2.375 -2.319) 4.616 12.257 ( 1.077 -0.717 -1.069) 1.679 12.505 ( 4.683 8.286 0.391) 9.526 12.578 ( 3.510 4.768 4.521) 7.449 16.089 ( 0.785 -0.442 -0.978) 1.330 16.138 ( 0.610 -0.320 -0.874) 1.113 16.852 ( 1.011 3.623 -0.036) 3.762 17.099 ( 0.469 4.444 1.705) 4.783 17.358 ( -1.559 6.752 2.404) 7.335 18.019 ( -3.200 10.160 2.065) 10.850 18.925 ( 0.229 -16.967 -6.716) 18.249 19.245 ( -4.693 -8.891 1.581) 10.178 ======================= Grid point 224 (112/170) ======================= q-point: ( 0.36 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.857 ( -4.012 3.393 4.946) 7.216 1.978 ( 3.873 3.468 -5.666) 7.689 2.236 ( 3.301 10.874 2.844) 11.714 2.293 ( 0.503 10.114 0.329) 10.132 2.535 ( -2.791 1.117 4.617) 5.510 2.880 ( 7.868 5.155 -7.597) 12.090 3.100 ( 3.488 1.668 -1.649) 4.203 3.192 ( 2.836 -5.310 5.342) 8.049 3.355 ( 1.231 -2.835 3.317) 4.534 3.554 ( 3.776 5.623 3.357) 7.559 3.843 ( -5.993 -8.117 -6.328) 11.910 3.943 ( -5.665 -1.399 2.880) 6.507 4.039 ( 3.756 6.496 -5.201) 9.130 4.370 ( 0.935 -6.902 7.140) 9.975 4.470 ( -5.894 3.458 -8.612) 10.994 4.732 ( 0.459 -0.823 -1.084) 1.436 4.914 ( 2.079 3.863 -10.886) 11.737 5.079 ( -0.047 -4.283 5.970) 7.348 5.240 ( -3.080 -0.968 4.887) 5.857 5.492 ( -6.649 3.248 -0.390) 7.410 5.553 ( 1.117 -4.669 -4.891) 6.853 5.792 ( -3.491 -2.759 -12.342) 13.119 5.893 ( -2.230 -4.050 2.322) 5.174 6.201 ( 4.716 -7.164 3.507) 9.266 6.292 ( 3.264 -5.289 3.514) 7.140 6.536 ( 2.493 0.752 -2.110) 3.352 6.635 ( -10.836 -6.014 -3.252) 12.813 6.718 ( 1.918 -5.210 8.592) 10.230 7.022 ( 6.596 6.121 0.949) 9.049 7.172 ( -1.641 -4.166 -1.724) 4.798 7.301 ( -1.842 -0.387 -1.610) 2.476 7.484 ( -4.414 2.024 2.023) 5.261 7.506 ( -3.000 2.487 -2.765) 4.779 7.732 ( -0.892 3.125 -1.343) 3.517 7.994 ( 5.094 8.115 4.333) 10.516 8.165 ( -0.629 4.992 2.286) 5.526 9.187 ( -0.332 -3.638 -4.224) 5.585 9.332 ( -6.122 -3.372 -1.759) 7.207 9.550 ( -1.738 -3.173 -0.245) 3.626 9.747 ( -2.187 1.191 1.884) 3.122 10.113 ( 3.546 -4.494 -1.889) 6.028 10.243 ( 1.330 -7.182 -4.823) 8.752 11.179 ( 0.736 3.492 -0.111) 3.570 11.404 ( -1.208 2.509 1.162) 3.017 11.496 ( 0.037 -2.223 1.416) 2.636 11.597 ( 2.298 3.502 0.207) 4.194 11.896 ( 1.713 1.971 2.165) 3.392 12.022 ( 4.270 0.181 6.778) 8.013 12.124 ( 3.709 2.635 -5.428) 7.083 12.302 ( 0.394 -0.042 3.788) 3.809 12.577 ( 3.317 11.320 1.226) 11.860 12.680 ( 1.883 7.409 4.881) 9.070 16.092 ( 1.080 -1.262 -1.306) 2.113 16.132 ( 0.331 -1.257 -1.491) 1.978 16.898 ( 1.961 5.797 2.525) 6.621 17.117 ( 0.838 9.664 -0.476) 9.712 17.367 ( -2.829 5.016 6.375) 8.591 17.912 ( -9.407 11.634 0.161) 14.962 18.889 ( 7.273 -20.370 -10.002) 23.830 19.179 ( -5.812 -14.294 0.603) 15.443 ======================= Grid point 225 (113/170) ======================= q-point: ( 0.45 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.871 ( -3.645 3.108 8.181) 9.480 2.016 ( 0.625 6.387 4.010) 7.567 2.279 ( 4.702 2.988 -1.079) 5.674 2.370 ( 1.037 10.560 2.746) 10.960 2.618 ( 1.972 2.015 11.897) 12.226 2.941 ( 8.575 2.119 -4.855) 10.080 3.128 ( -0.358 4.450 -3.803) 5.864 3.242 ( -1.358 -7.241 -2.491) 7.777 3.289 ( -3.281 -2.758 -3.779) 5.714 3.500 ( -7.905 4.600 -5.805) 10.833 3.745 ( 5.664 0.780 -2.462) 6.225 3.944 ( -1.518 3.432 3.759) 5.312 4.054 ( 3.637 4.376 -5.041) 7.602 4.288 ( -6.097 3.898 -5.778) 9.260 4.497 ( 1.120 -9.144 10.338) 13.847 4.715 ( -2.895 -3.891 -0.457) 4.871 4.858 ( 4.723 2.056 -5.068) 7.226 5.131 ( 0.986 -3.868 -1.377) 4.222 5.244 ( -1.917 -2.534 5.186) 6.082 5.377 ( -8.236 0.047 2.216) 8.529 5.525 ( 5.863 -4.189 -9.583) 11.990 5.582 ( -4.253 -4.513 -10.363) 12.077 5.959 ( 3.907 -5.231 6.012) 8.876 6.275 ( -2.166 2.918 0.346) 3.650 6.392 ( -4.073 -4.837 -2.305) 6.731 6.445 ( 0.717 -10.742 1.843) 10.923 6.571 ( 4.104 -1.732 4.850) 6.586 6.850 ( 2.227 -7.848 6.493) 10.427 7.054 ( -2.996 -11.545 -2.210) 12.130 7.200 ( 2.467 4.239 3.197) 5.855 7.246 ( 2.575 5.674 -4.603) 7.746 7.424 ( -3.065 6.015 -0.798) 6.798 7.449 ( -0.831 4.194 -1.912) 4.683 7.671 ( -2.693 4.585 -3.353) 6.286 8.105 ( 0.887 6.139 4.052) 7.409 8.176 ( 0.539 6.543 1.398) 6.712 9.157 ( 1.761 -5.575 -3.086) 6.611 9.217 ( -4.282 -5.526 -2.692) 7.491 9.547 ( 0.291 -3.678 2.091) 4.241 9.736 ( -1.525 -2.200 0.469) 2.718 10.121 ( 0.739 -3.074 -2.509) 4.036 10.173 ( -1.082 -4.353 -5.991) 7.484 11.213 ( 0.982 4.911 2.284) 5.504 11.389 ( -0.661 4.545 -0.811) 4.664 11.514 ( 1.070 0.723 1.828) 2.238 11.653 ( 1.505 3.477 0.807) 3.873 11.933 ( 0.329 2.175 2.323) 3.199 12.125 ( 2.032 1.987 -4.095) 4.985 12.163 ( 2.176 -0.733 7.483) 7.827 12.333 ( -0.753 0.150 1.968) 2.112 12.658 ( 2.581 12.038 3.888) 12.911 12.750 ( 0.786 10.823 3.164) 11.303 16.093 ( 0.714 -1.624 -1.186) 2.134 16.116 ( -0.029 -1.730 -1.718) 2.438 16.960 ( 1.920 6.493 2.785) 7.321 17.130 ( 1.654 11.369 -1.217) 11.553 17.406 ( -3.528 2.933 8.952) 10.059 17.768 ( -4.659 5.883 -2.048) 7.779 18.931 ( 8.386 -17.696 -6.723) 20.705 19.043 ( -8.096 -14.857 -3.326) 17.243 ======================= Grid point 226 (114/170) ======================= q-point: (-0.45 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.911 ( -4.208 4.080 8.360) 10.210 2.063 ( -2.377 3.892 6.525) 7.961 2.357 ( 7.116 2.177 -3.523) 8.234 2.369 ( -6.244 7.420 3.813) 10.420 2.742 ( -11.361 1.305 -1.375) 11.518 2.921 ( 1.558 0.595 4.055) 4.385 3.051 ( 4.306 -2.356 -8.078) 9.452 3.173 ( -2.203 0.122 -1.350) 2.586 3.312 ( 8.819 3.582 0.664) 9.542 3.409 ( 4.814 0.044 -4.995) 6.937 3.782 ( -0.420 8.764 -1.125) 8.846 3.906 ( -1.550 10.385 -2.658) 10.831 4.057 ( -5.103 1.070 -2.402) 5.741 4.181 ( 4.909 -0.734 -2.095) 5.387 4.632 ( -5.585 -4.057 8.791) 11.177 4.660 ( -1.449 -7.332 7.762) 10.775 4.866 ( -0.611 -0.070 -3.588) 3.640 5.057 ( -0.876 -4.731 -8.858) 10.081 5.226 ( -6.863 0.281 -0.931) 6.931 5.338 ( 0.337 -5.077 5.975) 7.848 5.456 ( -0.965 -6.029 -2.974) 6.792 5.532 ( 7.276 -2.624 -8.065) 11.174 6.128 ( -3.302 0.038 0.779) 3.393 6.150 ( 5.380 -3.935 5.401) 8.579 6.403 ( 0.180 3.211 -2.025) 3.800 6.431 ( 2.438 -10.974 -2.568) 11.532 6.771 ( 4.230 -5.882 9.999) 12.348 6.901 ( 0.196 -11.118 -1.080) 11.172 7.018 ( -0.114 -8.879 2.256) 9.162 7.121 ( -4.195 1.030 -5.625) 7.092 7.316 ( 0.093 7.287 -1.129) 7.374 7.402 ( 6.690 9.686 -4.121) 12.472 7.468 ( 1.929 2.189 4.293) 5.191 7.588 ( -0.974 5.707 -4.112) 7.101 8.111 ( -3.675 6.186 3.233) 7.888 8.219 ( 1.771 4.417 0.341) 4.771 9.119 ( -3.531 -6.049 -1.631) 7.191 9.180 ( 3.544 -7.170 -1.882) 8.216 9.600 ( 0.871 -4.411 3.884) 5.941 9.695 ( -1.356 -5.820 -2.287) 6.399 10.089 ( -1.681 0.321 -2.174) 2.767 10.097 ( -1.459 -0.806 -2.050) 2.643 11.258 ( 0.977 4.422 2.759) 5.303 11.364 ( -0.232 6.082 -2.144) 6.453 11.576 ( 2.740 2.060 2.475) 4.228 11.649 ( -0.458 3.354 -2.192) 4.033 11.950 ( -3.591 0.807 3.196) 4.874 12.098 ( 1.143 3.519 -3.306) 4.962 12.242 ( -3.124 -0.372 5.132) 6.020 12.341 ( 0.820 -0.149 0.949) 1.263 12.728 ( -0.347 9.635 3.119) 10.133 12.788 ( 1.478 12.842 1.081) 12.971 16.083 ( -0.657 -1.577 -0.863) 1.914 16.097 ( 0.166 -1.484 -1.261) 1.954 17.041 ( 3.635 6.973 2.590) 8.279 17.118 ( -0.225 9.646 -2.991) 10.101 17.461 ( -2.291 2.288 10.450) 10.940 17.736 ( 4.105 1.115 -3.725) 5.654 18.796 ( -13.823 -12.501 -2.438) 18.796 19.048 ( 10.080 -15.733 -4.422) 19.201 ======================= Grid point 227 (115/170) ======================= q-point: (-0.36 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.869 ( -8.252 6.327 0.855) 10.433 2.108 ( -1.751 2.259 7.832) 8.337 2.179 ( -12.031 8.006 -12.028) 18.802 2.396 ( -4.964 6.162 6.178) 10.039 2.507 ( -4.833 -1.828 -0.840) 5.235 2.858 ( -6.353 0.829 -8.967) 11.020 3.119 ( 6.385 -4.027 9.459) 12.102 3.287 ( 10.701 0.010 -4.814) 11.734 3.456 ( 5.243 -2.765 0.109) 5.929 3.516 ( 6.870 1.343 0.190) 7.003 3.709 ( -6.695 13.867 4.104) 15.936 3.823 ( -7.972 12.273 -7.009) 16.227 3.959 ( 1.059 5.368 5.668) 7.878 4.289 ( 6.598 -3.749 -1.657) 7.767 4.566 ( -6.117 -1.833 4.152) 7.616 4.750 ( 1.171 1.755 -2.843) 3.540 4.800 ( -3.586 -9.255 2.698) 10.286 4.970 ( 1.517 -6.735 -1.571) 7.080 5.128 ( -2.876 3.153 0.813) 4.345 5.396 ( 0.671 -7.623 2.234) 7.972 5.470 ( 3.692 -1.404 0.568) 3.990 5.579 ( 5.826 -3.970 -3.135) 7.716 6.099 ( 0.664 -0.445 0.123) 0.809 6.292 ( -2.061 -10.714 1.746) 11.050 6.389 ( 0.909 9.318 2.422) 9.671 6.455 ( 4.005 -9.524 -1.136) 10.394 6.781 ( -4.236 -8.219 -10.159) 13.737 6.870 ( -3.776 -3.217 0.008) 4.961 7.047 ( -1.566 -2.303 0.961) 2.946 7.102 ( 7.171 -5.967 4.343) 10.291 7.290 ( 0.375 6.930 -0.998) 7.012 7.473 ( 7.207 6.012 -4.597) 10.451 7.531 ( 1.876 2.883 -0.330) 3.455 7.624 ( 5.991 3.424 2.359) 7.293 8.076 ( -4.512 7.052 2.622) 8.773 8.227 ( -0.030 1.998 -1.330) 2.400 9.058 ( -2.116 -4.778 -0.214) 5.231 9.240 ( 4.070 -7.531 0.983) 8.617 9.590 ( -2.189 -5.216 -1.048) 5.753 9.724 ( 3.290 -5.134 2.505) 6.592 10.031 ( -3.442 1.537 0.836) 3.861 10.065 ( -1.482 0.284 -0.247) 1.529 11.296 ( 0.217 3.757 -0.710) 3.830 11.346 ( 1.153 5.795 0.322) 5.917 11.608 ( -0.195 2.026 -2.974) 3.604 11.640 ( 1.569 1.295 0.426) 2.079 11.887 ( -5.169 1.464 1.405) 5.553 12.083 ( -0.755 1.822 -1.893) 2.734 12.194 ( -5.200 1.889 0.893) 5.605 12.367 ( -0.835 1.164 1.937) 2.409 12.704 ( -2.829 9.670 -2.097) 10.291 12.823 ( 1.120 6.921 0.048) 7.011 16.059 ( -1.032 -1.060 -0.438) 1.543 16.089 ( -0.145 -0.837 -0.247) 0.884 17.058 ( -0.749 7.907 -2.874) 8.447 17.124 ( 2.425 7.948 -0.599) 8.331 17.614 ( 5.139 4.952 12.193) 14.128 17.767 ( 6.044 -2.985 -7.522) 10.100 18.536 ( -15.559 -9.386 2.242) 18.309 19.175 ( 8.964 -15.640 -1.776) 18.114 ======================= Grid point 228 (116/170) ======================= q-point: (-0.27 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.669 ( -13.356 12.092 -1.358) 18.068 1.805 ( -15.911 13.614 -5.798) 21.728 2.213 ( 0.160 0.557 11.597) 11.611 2.399 ( -0.977 2.635 1.459) 3.167 2.422 ( -3.396 1.799 -2.927) 4.831 2.738 ( 1.624 0.223 -3.793) 4.132 3.258 ( -7.124 3.889 -1.589) 8.271 3.302 ( -6.948 2.927 -8.906) 11.669 3.354 ( -0.020 -0.008 5.837) 5.837 3.566 ( -9.120 12.966 -6.183) 17.015 3.673 ( 8.332 -8.032 9.814) 15.174 3.790 ( 0.563 -0.273 5.842) 5.876 4.123 ( 7.204 11.930 4.220) 14.561 4.357 ( 4.472 -4.629 -1.383) 6.584 4.552 ( 1.067 -3.394 0.491) 3.592 4.662 ( -0.193 -1.600 -2.154) 2.690 4.863 ( 9.299 -3.174 -5.355) 11.190 5.037 ( -2.572 1.471 10.908) 11.303 5.161 ( 3.652 0.594 1.536) 4.006 5.487 ( 7.813 -8.991 1.378) 11.991 5.533 ( 2.639 0.970 1.357) 3.122 5.668 ( 5.263 -4.967 3.305) 7.955 6.081 ( -2.747 -0.514 -2.088) 3.489 6.236 ( -2.419 -10.194 -2.801) 10.845 6.337 ( -6.715 4.985 2.060) 8.613 6.484 ( -9.823 -2.810 -13.061) 16.583 6.573 ( 2.359 -4.063 3.848) 6.073 6.840 ( -0.740 -4.886 -1.931) 5.306 7.028 ( -0.992 0.448 0.707) 1.298 7.164 ( -0.785 6.963 -2.366) 7.396 7.395 ( 4.487 -0.531 5.988) 7.501 7.521 ( 4.334 5.562 -4.194) 8.204 7.634 ( 12.456 -9.420 -1.828) 15.723 7.713 ( 1.720 1.949 0.520) 2.650 8.015 ( -3.962 9.213 -1.058) 10.084 8.209 ( -0.189 0.976 0.041) 0.995 9.051 ( -0.050 -2.323 2.426) 3.359 9.337 ( 4.117 -4.991 3.903) 7.556 9.572 ( 0.571 -4.713 0.489) 4.772 9.798 ( 3.042 -1.244 0.630) 3.347 10.006 ( -3.636 -0.976 3.697) 5.277 10.045 ( -0.478 -0.959 1.763) 2.063 11.247 ( -1.005 4.845 -4.661) 6.798 11.403 ( 1.837 2.688 2.892) 4.355 11.582 ( 0.766 -0.707 -2.210) 2.443 11.614 ( -2.010 -0.486 -3.160) 3.776 11.865 ( -0.352 1.398 2.800) 3.149 12.011 ( -3.515 1.562 -3.420) 5.147 12.097 ( -5.707 1.399 -2.645) 6.444 12.351 ( -3.333 3.561 1.575) 5.126 12.592 ( -5.504 8.890 -4.517) 11.389 12.817 ( 0.322 -0.361 -3.311) 3.346 16.043 ( -0.669 -0.217 0.298) 0.764 16.087 ( -0.364 -0.030 0.608) 0.710 17.006 ( -1.403 7.687 -3.601) 8.604 17.134 ( 1.270 7.698 -1.862) 8.021 17.690 ( 2.073 -2.724 -12.624) 13.080 17.935 ( 10.523 9.290 13.038) 19.158 18.360 ( -12.290 -11.341 8.517) 18.767 19.304 ( 7.774 -14.180 -0.145) 16.172 ======================= Grid point 229 (117/170) ======================= q-point: (-0.18 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.471 ( -10.531 18.425 5.800) 22.001 1.570 ( -12.570 16.636 7.841) 22.276 2.308 ( -4.330 -1.950 -0.444) 4.769 2.347 ( 2.861 3.438 1.756) 4.805 2.412 ( 1.741 4.244 -2.228) 5.099 2.796 ( 0.170 7.555 6.934) 10.256 3.016 ( -11.749 7.282 -3.651) 14.297 3.061 ( -8.705 6.684 -2.255) 11.204 3.378 ( -0.143 3.348 -0.391) 3.373 3.497 ( 2.954 -1.049 -3.942) 5.036 3.751 ( -5.182 -4.697 -0.797) 7.039 3.910 ( -0.068 -13.844 8.889) 16.452 4.244 ( 6.612 7.478 0.764) 10.011 4.434 ( 4.015 -5.693 4.541) 8.315 4.626 ( 5.032 -1.706 2.949) 6.077 4.763 ( 8.109 2.747 2.967) 9.061 4.935 ( 8.296 -2.790 -9.117) 12.638 5.128 ( -2.587 3.957 12.172) 13.058 5.225 ( 3.048 2.658 -0.772) 4.118 5.518 ( 5.007 -3.223 -10.187) 11.800 5.694 ( 3.418 -3.700 8.531) 9.907 5.856 ( 8.715 -6.601 5.930) 12.438 5.968 ( -4.579 3.344 -2.240) 6.097 6.120 ( -5.599 -8.158 -6.528) 11.854 6.191 ( -6.382 -2.343 -1.990) 7.084 6.315 ( -4.829 6.986 6.509) 10.700 6.630 ( 0.375 -2.341 2.275) 3.286 6.761 ( -4.037 -0.150 -4.948) 6.387 7.032 ( -0.558 1.243 1.431) 1.976 7.146 ( 2.714 3.118 -1.516) 4.403 7.432 ( -3.681 2.612 -0.144) 4.515 7.532 ( 0.949 4.362 -1.871) 4.841 7.642 ( -5.031 -5.554 -0.901) 7.547 7.860 ( 2.848 2.177 -3.069) 4.719 7.955 ( 9.435 -5.394 -5.725) 12.284 8.238 ( 3.159 1.465 0.129) 3.484 9.110 ( 1.715 0.532 4.696) 5.028 9.463 ( 2.465 -2.001 5.985) 6.775 9.604 ( 2.427 -1.701 1.107) 3.164 9.867 ( 4.425 0.488 1.033) 4.570 9.950 ( -5.027 -0.856 0.106) 5.101 10.115 ( 2.562 -2.013 4.909) 5.892 11.181 ( -0.192 3.036 -3.410) 4.570 11.449 ( -0.247 1.132 2.426) 2.688 11.550 ( 1.000 -3.451 -3.916) 5.314 11.585 ( 1.035 -2.273 -0.790) 2.620 11.883 ( -3.116 -2.284 -3.607) 5.286 11.906 ( -3.027 -0.459 -2.144) 3.738 11.969 ( -1.971 5.524 -0.950) 5.942 12.291 ( -5.357 3.573 0.538) 6.461 12.437 ( -7.059 8.067 -3.148) 11.172 12.758 ( -0.132 -5.429 -6.749) 8.662 16.045 ( -0.025 0.700 0.932) 1.166 16.090 ( -0.543 0.764 1.115) 1.456 16.925 ( -1.633 6.925 -4.965) 8.676 17.133 ( -0.027 5.358 -0.500) 5.381 17.556 ( -0.717 -3.554 -9.828) 10.475 18.106 ( -3.347 5.144 -3.584) 7.107 18.426 ( 3.030 -5.912 21.201) 22.217 19.440 ( 8.382 -8.422 0.096) 11.882 ======================= Grid point 230 (118/170) ======================= q-point: (-0.09 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.470 ( -3.499 18.459 12.456) 22.541 1.602 ( -2.644 16.522 20.203) 26.232 2.199 ( 0.509 2.283 -10.496) 10.753 2.408 ( 1.528 4.601 -1.772) 5.162 2.424 ( 0.941 1.182 5.187) 5.403 2.710 ( -11.239 5.457 -2.763) 12.796 2.931 ( -2.431 29.820 15.854) 33.860 3.033 ( 1.654 -7.869 -2.485) 8.416 3.386 ( -2.735 6.376 -10.170) 12.311 3.477 ( 5.747 -7.101 -1.544) 9.265 3.644 ( -3.627 -13.929 -2.965) 14.696 3.923 ( -2.156 -10.613 3.753) 11.461 4.348 ( 2.573 2.550 0.151) 3.625 4.601 ( -0.792 -5.409 9.005) 10.534 4.690 ( 0.915 1.638 0.955) 2.105 4.915 ( 2.493 -3.496 1.848) 4.675 4.940 ( 5.441 0.652 -1.709) 5.740 5.235 ( -1.446 4.893 12.110) 13.141 5.272 ( 7.298 -0.531 -3.155) 7.968 5.507 ( 8.999 -1.539 -9.365) 13.078 5.747 ( -7.261 3.367 6.393) 10.244 5.859 ( -5.414 -3.487 -4.410) 7.805 5.974 ( 1.241 3.174 -1.449) 3.703 6.006 ( 0.794 -1.611 -0.226) 1.810 6.281 ( 2.344 -4.240 9.365) 10.544 6.352 ( 2.536 4.865 9.151) 10.670 6.614 ( -4.305 0.215 -4.897) 6.523 6.669 ( 2.821 -1.344 -0.494) 3.164 7.036 ( -0.609 2.554 1.068) 2.834 7.215 ( 5.148 0.237 0.454) 5.173 7.323 ( -6.585 1.118 -1.284) 6.802 7.460 ( -8.364 -5.272 0.650) 9.908 7.581 ( 0.562 4.031 -2.330) 4.690 7.761 ( -2.378 7.619 -5.920) 9.937 8.060 ( 5.392 -9.764 -4.985) 12.217 8.290 ( 5.920 -4.856 -6.757) 10.212 9.199 ( 1.654 2.312 5.051) 5.796 9.496 ( -4.111 -1.381 2.882) 5.207 9.690 ( 4.105 0.344 1.223) 4.297 9.831 ( -4.309 -1.807 -2.442) 5.272 9.979 ( 2.983 2.247 3.518) 5.131 10.199 ( 2.294 5.920 0.930) 6.417 11.189 ( 1.347 -1.123 1.941) 2.616 11.488 ( 2.798 -2.307 0.277) 3.638 11.539 ( 3.427 -3.994 -4.863) 7.166 11.593 ( -1.561 -2.895 2.604) 4.195 11.759 ( -0.165 -1.166 -2.852) 3.085 11.837 ( -2.118 -0.241 -2.236) 3.089 12.024 ( 3.223 2.213 3.537) 5.272 12.184 ( -6.429 2.712 -1.408) 7.119 12.289 ( -7.178 7.657 -1.539) 10.608 12.665 ( 0.330 -8.004 -9.073) 12.103 16.062 ( 0.521 1.440 1.249) 1.976 16.093 ( -0.666 1.390 1.208) 1.958 16.866 ( 0.332 3.889 -2.084) 4.424 17.113 ( -1.418 2.045 -0.772) 2.605 17.479 ( 2.866 -4.252 -5.486) 7.509 17.886 ( -12.289 -4.992 -7.458) 15.217 18.746 ( 3.708 4.968 19.505) 20.467 19.566 ( 7.623 -1.329 -3.348) 8.432 ======================= Grid point 231 (119/170) ======================= q-point: ( 0.00 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.931 ( 5.093 12.068 1.716) 13.210 2.114 ( 3.021 8.498 11.884) 14.919 2.166 ( 2.353 6.736 -3.962) 8.162 2.469 ( 1.260 2.945 -2.138) 3.851 2.529 ( -0.259 2.608 2.446) 3.585 2.681 ( 1.021 1.887 2.504) 3.297 2.829 ( -1.539 -6.906 1.506) 7.234 3.073 ( -7.240 -8.616 -12.713) 16.979 3.204 ( -1.410 -12.385 -4.838) 13.371 3.320 ( 1.563 -8.178 -9.685) 12.772 3.764 ( 2.002 20.805 16.923) 26.893 4.009 ( -2.655 6.258 8.408) 10.813 4.427 ( -1.782 3.308 1.825) 4.177 4.505 ( -5.344 7.576 -1.525) 9.396 4.792 ( -5.108 -2.781 12.596) 13.874 4.950 ( 2.954 0.421 2.311) 3.774 5.015 ( 1.987 2.572 -0.472) 3.284 5.308 ( -9.271 -3.054 8.504) 12.946 5.339 ( 9.358 -0.062 -8.844) 12.876 5.555 ( -9.432 -4.712 0.821) 10.575 5.602 ( 13.507 0.067 -5.080) 14.431 5.716 ( 2.859 -4.535 -3.829) 6.588 6.051 ( -3.433 9.792 2.247) 10.617 6.205 ( 1.384 5.386 -0.050) 5.561 6.383 ( -0.195 4.994 7.475) 8.992 6.509 ( 0.567 -1.680 0.948) 2.011 6.623 ( 3.795 0.570 5.527) 6.729 6.705 ( 4.606 2.412 -1.951) 5.553 7.023 ( -3.475 -2.710 1.806) 4.762 7.167 ( -11.202 -2.368 4.685) 12.371 7.292 ( 0.466 -2.098 0.902) 2.331 7.324 ( 6.334 2.534 -4.935) 8.420 7.679 ( 2.924 3.237 -2.324) 4.943 7.773 ( -0.968 3.488 -6.430) 7.379 7.864 ( 3.928 -11.036 -4.652) 12.604 7.979 ( -5.030 -14.098 -8.871) 17.400 9.310 ( 0.739 0.521 2.682) 2.830 9.396 ( -3.370 -2.678 -0.016) 4.304 9.727 ( 1.506 0.317 -0.560) 1.638 9.760 ( 0.170 -0.623 -1.128) 1.300 10.169 ( -1.737 7.758 8.377) 11.549 10.347 ( -3.959 4.768 4.086) 7.423 11.223 ( 1.239 1.196 -0.379) 1.763 11.401 ( 2.391 -3.407 -5.653) 7.020 11.511 ( -2.178 -0.513 3.619) 4.255 11.613 ( 2.227 -1.117 -0.563) 2.554 11.779 ( 1.838 -0.946 -0.950) 2.275 11.791 ( 6.469 -2.175 0.503) 6.843 12.011 ( -4.358 -2.389 -0.210) 4.975 12.178 ( 5.119 -1.405 -6.848) 8.665 12.308 ( -3.481 6.188 1.143) 7.191 12.451 ( -0.718 -1.976 -4.642) 5.096 16.123 ( 0.558 1.692 1.250) 2.176 16.128 ( -0.443 1.536 1.015) 1.894 16.916 ( 1.268 2.236 -2.256) 3.420 17.071 ( 0.579 -0.988 -5.120) 5.246 17.421 ( 6.355 -5.364 -1.902) 8.531 17.453 ( -8.983 -6.936 -5.755) 12.725 19.166 ( -1.286 10.377 15.595) 18.776 19.582 ( 0.292 -2.101 -2.088) 2.976 ======================= Grid point 232 (120/170) ======================= q-point: ( 0.09 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.021 ( 4.345 4.204 -0.815) 6.101 2.131 ( 4.347 2.502 -8.301) 9.699 2.303 ( -0.314 8.351 7.249) 11.063 2.518 ( 3.412 6.826 5.275) 9.276 2.593 ( 7.162 2.467 4.253) 8.688 2.689 ( -0.246 1.714 -12.245) 12.366 2.813 ( -6.343 -6.386 -6.355) 11.018 2.882 ( 1.902 -1.997 10.237) 10.602 3.149 ( -0.651 -10.395 -1.074) 10.471 3.284 ( 5.429 -6.793 -6.051) 10.594 3.909 ( -6.975 11.335 4.521) 14.056 4.008 ( -1.575 5.836 5.654) 8.277 4.406 ( -6.933 9.589 5.067) 12.872 4.431 ( -1.448 5.193 0.226) 5.396 4.830 ( -5.428 -2.474 10.887) 12.414 4.981 ( 0.362 1.288 -1.514) 2.021 5.032 ( 0.772 2.368 -0.624) 2.568 5.149 ( -14.198 -6.225 2.457) 15.696 5.322 ( 1.571 1.234 -10.161) 10.356 5.519 ( -2.872 -4.428 6.732) 8.555 5.699 ( 4.801 -0.105 -6.741) 8.276 5.776 ( 5.849 -0.678 0.053) 5.889 6.065 ( 2.380 7.237 3.372) 8.331 6.191 ( 0.355 4.034 -0.130) 4.051 6.414 ( -4.569 3.707 4.658) 7.504 6.541 ( -0.976 0.170 -0.161) 1.004 6.613 ( -3.282 -0.521 -5.519) 6.442 6.766 ( 4.019 0.206 -2.554) 4.766 6.961 ( -8.992 -4.402 5.714) 11.528 7.116 ( -0.295 -0.614 3.768) 3.829 7.308 ( 5.059 5.213 -0.747) 7.302 7.447 ( 7.560 -4.020 -0.151) 8.564 7.666 ( -4.758 -2.174 -5.170) 7.355 7.724 ( 4.870 3.217 -1.142) 5.947 7.805 ( -2.580 -8.091 -6.849) 10.910 7.910 ( 4.776 -9.057 0.180) 10.240 9.316 ( -3.129 -0.492 1.744) 3.616 9.395 ( 1.909 -4.032 2.174) 4.962 9.741 ( -0.420 -0.691 -2.192) 2.336 9.754 ( 1.428 -0.203 0.491) 1.523 10.183 ( -7.493 7.864 7.037) 12.942 10.258 ( -9.205 5.119 2.585) 10.845 11.247 ( 1.946 0.824 0.430) 2.157 11.383 ( 1.972 -4.034 -5.698) 7.255 11.507 ( -1.811 1.922 1.598) 3.087 11.601 ( -0.294 0.367 -0.165) 0.498 11.801 ( 0.223 -2.057 -3.663) 4.207 11.866 ( 1.909 -2.876 -3.211) 4.714 11.972 ( 2.281 0.267 1.495) 2.740 12.215 ( 7.161 -5.049 -4.752) 9.967 12.359 ( 4.677 5.160 2.918) 7.550 12.434 ( 4.970 2.300 -2.764) 6.135 16.122 ( -1.025 1.606 0.420) 1.951 16.142 ( 0.107 1.206 0.679) 1.388 16.923 ( 0.409 0.655 -1.105) 1.348 17.034 ( 2.995 -2.738 -5.252) 6.637 17.335 ( -0.206 -1.049 0.192) 1.087 17.579 ( 13.348 -8.088 -0.081) 15.608 19.222 ( -11.711 8.179 12.016) 18.666 19.474 ( -7.296 -0.670 -4.802) 8.760 ======================= Grid point 233 (121/170) ======================= q-point: ( 0.18 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.057 ( 2.352 2.693 -2.864) 4.581 2.094 ( 2.034 -0.396 -7.214) 7.506 2.307 ( -3.452 7.944 2.625) 9.050 2.482 ( 0.659 5.867 -15.766) 16.835 2.662 ( 6.527 0.378 1.292) 6.664 2.736 ( -1.834 0.123 3.704) 4.135 2.830 ( 10.902 -0.269 4.878) 11.947 3.071 ( 3.123 -0.447 12.634) 13.022 3.160 ( -0.419 -4.187 3.995) 5.803 3.325 ( 5.803 -3.057 -5.714) 8.699 3.771 ( -4.669 5.158 -3.199) 7.657 4.002 ( -5.678 -0.588 2.652) 6.294 4.334 ( -8.391 8.191 5.658) 13.019 4.421 ( -1.666 8.228 1.097) 8.466 4.838 ( -7.590 -5.732 2.955) 9.959 4.934 ( -4.462 3.997 0.072) 5.991 4.972 ( -3.480 -2.717 -1.541) 4.677 5.050 ( 1.452 -0.686 -0.510) 1.685 5.206 ( -1.779 3.312 -6.437) 7.454 5.523 ( -4.520 -5.131 4.578) 8.229 5.710 ( 4.262 1.383 -4.768) 6.543 5.820 ( -3.581 1.837 5.788) 7.050 6.100 ( 0.198 1.018 -3.676) 3.819 6.206 ( -0.595 1.600 -6.459) 6.681 6.388 ( -2.520 2.222 3.528) 4.872 6.447 ( -3.320 -4.701 -4.651) 7.400 6.503 ( -3.409 1.302 -0.599) 3.698 6.732 ( -3.997 -9.540 -1.477) 10.448 6.928 ( -1.576 1.863 4.891) 5.466 7.193 ( 4.777 2.362 0.057) 5.330 7.388 ( 1.827 4.583 -0.773) 4.994 7.510 ( -3.015 -9.800 0.232) 10.256 7.558 ( 2.547 1.952 -0.461) 3.242 7.747 ( 2.108 -1.259 -3.084) 3.942 7.829 ( 6.937 3.647 1.304) 7.944 8.020 ( 5.144 -4.924 3.485) 7.928 9.284 ( -2.638 -0.366 0.646) 2.740 9.435 ( -1.016 -5.907 1.274) 6.128 9.685 ( -2.806 0.296 -2.680) 3.892 9.796 ( 1.531 -1.437 2.579) 3.326 10.061 ( -9.732 5.124 1.154) 11.059 10.180 ( -4.905 1.620 3.026) 5.986 11.295 ( -0.452 -0.186 1.458) 1.537 11.324 ( 1.798 -0.829 -4.523) 4.938 11.484 ( -1.654 2.084 -0.035) 2.661 11.641 ( 2.953 0.346 0.398) 3.000 11.729 ( 0.482 -1.505 -4.218) 4.504 11.859 ( 1.486 -1.636 -0.800) 2.350 12.082 ( 6.119 1.741 2.157) 6.718 12.243 ( 3.808 -3.289 -5.969) 7.807 12.497 ( 6.365 4.911 4.160) 9.052 12.548 ( 8.962 4.562 -0.589) 10.073 16.105 ( -0.964 1.032 -0.307) 1.445 16.143 ( -0.422 0.310 -0.097) 0.533 16.905 ( 1.247 2.313 -2.067) 3.344 17.069 ( 3.321 -1.027 1.191) 3.674 17.406 ( 5.737 2.856 0.842) 6.463 17.845 ( 15.866 -8.997 1.888) 18.337 19.037 ( -18.816 3.947 1.325) 19.271 19.273 ( -11.691 -2.667 -0.856) 12.022 ======================= Grid point 234 (122/170) ======================= q-point: ( 0.27 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.007 ( -5.184 5.662 0.868) 7.726 2.059 ( 5.110 2.142 -9.006) 10.574 2.312 ( -3.295 1.949 7.502) 8.423 2.406 ( 5.285 9.842 -5.877) 12.623 2.719 ( -0.503 0.190 0.046) 0.539 2.795 ( 6.592 -2.817 -2.723) 7.668 3.042 ( 9.683 0.467 -0.366) 9.701 3.155 ( -2.924 -4.004 6.302) 8.019 3.219 ( 1.363 8.765 -3.484) 9.530 3.398 ( 8.487 -2.949 4.047) 9.854 3.765 ( 1.576 -0.970 4.151) 4.545 3.921 ( -5.317 -2.188 0.587) 5.780 4.257 ( -8.502 6.142 3.891) 11.187 4.386 ( -3.078 6.913 0.040) 7.567 4.672 ( -6.975 -2.447 -2.554) 7.821 4.847 ( -3.793 3.791 -3.768) 6.555 4.933 ( -2.531 -5.337 -0.130) 5.908 5.039 ( 1.598 1.052 -5.410) 5.739 5.194 ( 0.716 0.990 4.450) 4.615 5.486 ( -5.476 -6.614 3.332) 9.211 5.692 ( -0.081 4.549 -6.767) 8.154 5.800 ( -4.901 -0.986 4.134) 6.487 5.988 ( -3.277 -3.862 -13.502) 14.421 6.091 ( -2.209 1.471 0.242) 2.665 6.237 ( -4.124 -3.143 -7.454) 9.080 6.452 ( -1.653 -4.896 -0.207) 5.172 6.510 ( -1.172 -5.186 8.057) 9.653 6.671 ( -3.363 -6.244 1.944) 7.353 6.997 ( 2.774 3.243 4.112) 5.926 7.164 ( -4.555 -6.034 -4.872) 8.994 7.395 ( 1.707 7.193 1.896) 7.632 7.543 ( 1.809 3.210 1.147) 3.859 7.580 ( 1.741 2.018 -1.932) 3.291 7.771 ( 3.173 0.231 -2.069) 3.795 7.976 ( 6.648 4.305 3.597) 8.698 8.143 ( 3.833 -1.606 3.870) 5.679 9.222 ( -3.758 -1.028 -2.424) 4.589 9.374 ( -6.052 -5.522 -0.734) 8.225 9.596 ( -2.998 1.591 -3.332) 4.756 9.812 ( -4.473 -0.599 2.132) 4.991 9.995 ( 1.294 -0.054 1.603) 2.061 10.137 ( -1.429 -4.317 -1.315) 4.733 11.249 ( -0.406 2.759 -1.006) 2.964 11.384 ( 1.920 -0.864 2.589) 3.338 11.467 ( -0.643 1.803 0.999) 2.160 11.627 ( 0.528 -0.200 -2.572) 2.634 11.807 ( 6.074 0.508 2.632) 6.639 11.908 ( 2.995 -0.837 2.385) 3.919 12.192 ( 5.429 2.980 -1.873) 6.470 12.238 ( 2.602 -0.533 -2.154) 3.420 12.654 ( 6.133 6.382 4.069) 9.742 12.688 ( 7.275 5.568 1.188) 9.238 16.086 ( -0.475 0.125 -0.872) 1.001 16.128 ( -0.658 -0.701 -0.796) 1.248 16.940 ( 3.267 5.200 1.221) 6.262 17.156 ( 4.405 1.326 2.020) 5.024 17.493 ( 3.178 6.721 -0.311) 7.441 18.119 ( 11.534 -3.872 3.567) 12.678 18.677 ( -17.506 -4.146 -7.646) 19.548 19.068 ( -12.602 -8.580 1.380) 15.308 ======================= Grid point 235 (123/170) ======================= q-point: ( 0.36 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.954 ( -4.162 6.136 3.919) 8.386 2.085 ( 5.027 7.390 -0.601) 8.958 2.311 ( -5.337 -2.207 4.054) 7.056 2.497 ( 7.726 9.760 0.658) 12.465 2.681 ( -2.662 10.014 1.422) 10.459 2.880 ( 10.475 -6.488 -7.772) 14.567 3.118 ( -3.699 2.353 4.699) 6.427 3.167 ( 5.347 1.748 -2.230) 6.051 3.263 ( 5.085 -3.859 -3.373) 7.220 3.554 ( 3.277 -10.182 -3.290) 11.191 3.766 ( -3.376 5.292 3.678) 7.275 3.919 ( -0.416 1.666 4.464) 4.783 4.147 ( -3.450 1.965 0.898) 4.071 4.341 ( -4.034 2.640 1.151) 4.957 4.592 ( -3.081 5.428 1.598) 6.443 4.720 ( -4.373 1.495 -5.382) 7.094 4.918 ( 0.485 -8.739 1.582) 8.894 4.985 ( -0.342 0.706 -6.548) 6.594 5.243 ( -1.522 0.577 3.102) 3.503 5.403 ( -7.379 -6.910 0.825) 10.143 5.581 ( 0.059 3.267 -9.276) 9.835 5.736 ( -3.025 -2.532 -12.098) 12.724 5.777 ( -4.092 -6.382 0.061) 7.582 6.107 ( 2.490 -4.071 1.652) 5.050 6.205 ( 0.957 -2.724 5.466) 6.181 6.402 ( -3.140 -8.781 -0.646) 9.348 6.588 ( 1.538 -2.681 3.620) 4.760 6.646 ( -4.105 -3.566 5.499) 7.733 6.990 ( -4.065 -2.846 -5.145) 7.148 7.140 ( 2.317 1.101 7.189) 7.633 7.417 ( 0.454 6.889 -3.668) 7.818 7.538 ( -2.263 4.349 1.080) 5.021 7.598 ( 3.341 5.280 -4.094) 7.470 7.777 ( 1.336 0.392 -3.978) 4.215 8.119 ( 4.078 4.717 4.774) 7.853 8.228 ( 1.921 1.162 2.236) 3.169 9.120 ( -2.549 -2.678 -4.493) 5.818 9.238 ( -6.848 -5.450 -2.948) 9.236 9.522 ( -1.341 0.739 -2.796) 3.187 9.747 ( -3.939 -1.759 -0.155) 4.316 10.055 ( 1.769 -1.671 1.369) 2.792 10.109 ( 1.194 -5.397 -2.449) 6.046 11.271 ( 0.491 4.978 3.467) 6.086 11.424 ( 0.451 -0.411 1.800) 1.901 11.489 ( 0.716 1.662 2.430) 3.030 11.652 ( 2.813 1.559 1.444) 3.525 11.920 ( 2.861 0.630 2.584) 3.906 11.999 ( 3.913 -1.766 2.264) 4.854 12.214 ( 2.681 4.944 -2.569) 6.183 12.297 ( 2.945 0.089 1.254) 3.202 12.786 ( 4.606 9.111 3.525) 10.800 12.829 ( 5.519 6.906 4.181) 9.779 16.071 ( 0.119 -0.767 -1.140) 1.379 16.105 ( -0.637 -1.441 -1.226) 1.996 17.023 ( 3.400 6.809 2.220) 7.928 17.251 ( 5.146 3.699 -0.233) 6.342 17.501 ( -1.633 8.245 0.584) 8.425 18.160 ( -14.700 12.416 -1.388) 19.292 18.455 ( 8.307 -22.111 -5.837) 24.331 18.895 ( -9.553 -13.760 0.857) 16.773 ======================= Grid point 236 (124/170) ======================= q-point: ( 0.45 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.957 ( -2.977 5.282 6.830) 9.133 2.166 ( -1.850 7.606 4.516) 9.037 2.286 ( 2.285 -0.606 1.601) 2.855 2.604 ( 3.187 11.500 -1.988) 12.098 2.743 ( 3.419 8.535 9.842) 13.468 2.950 ( 10.003 -2.764 -9.010) 13.743 3.073 ( -8.561 -5.205 -2.863) 10.420 3.202 ( -1.297 2.009 -0.520) 2.447 3.259 ( 5.021 -0.002 -4.172) 6.528 3.434 ( -4.003 -9.479 -4.329) 11.163 3.862 ( 2.021 8.719 6.947) 11.329 3.951 ( 1.387 0.688 2.626) 3.048 4.167 ( 3.682 3.464 -5.497) 7.468 4.256 ( -6.381 -5.085 2.807) 8.629 4.539 ( -3.295 8.643 -3.560) 9.912 4.644 ( -3.786 -1.945 5.779) 7.177 4.878 ( 1.131 -1.230 -6.477) 6.689 4.994 ( 2.296 -7.875 1.430) 8.327 5.191 ( -2.812 -2.992 -4.440) 6.048 5.279 ( -5.863 -6.335 -1.680) 8.794 5.498 ( -2.110 -0.718 -6.280) 6.664 5.551 ( 0.098 0.727 -5.913) 5.959 5.818 ( 3.092 -7.419 4.290) 9.111 6.136 ( -2.224 -13.753 -2.934) 14.237 6.307 ( 3.030 -0.204 5.812) 6.558 6.409 ( 2.030 0.994 4.621) 5.144 6.598 ( -1.209 1.259 2.002) 2.656 6.703 ( 1.056 -6.071 4.329) 7.531 6.888 ( -2.582 -2.050 -0.586) 3.349 7.283 ( 4.130 -0.978 6.614) 7.858 7.315 ( -3.879 4.434 -6.849) 9.035 7.518 ( -1.807 5.671 0.784) 6.003 7.587 ( 2.985 6.911 -6.257) 9.789 7.725 ( -0.514 0.372 -5.616) 5.651 8.208 ( 0.074 4.251 3.884) 5.759 8.267 ( 0.728 2.672 1.297) 3.058 9.051 ( 0.679 -4.703 -4.485) 6.534 9.099 ( -4.476 -5.790 -3.833) 8.261 9.494 ( 0.380 -1.131 -0.390) 1.256 9.670 ( -3.223 -4.462 -2.800) 6.176 10.077 ( 0.124 -1.214 0.693) 1.404 10.115 ( 1.029 -1.829 -1.143) 2.389 11.316 ( -0.747 5.143 4.263) 6.721 11.459 ( 0.542 2.261 2.110) 3.140 11.548 ( 2.217 2.886 3.387) 4.972 11.720 ( 1.596 2.354 2.077) 3.521 11.957 ( -0.623 0.064 1.214) 1.366 12.072 ( 4.116 -3.824 -1.742) 5.882 12.239 ( -0.379 5.119 3.088) 5.990 12.347 ( 1.568 1.314 0.595) 2.131 12.895 ( 1.710 10.927 5.309) 12.268 12.955 ( 3.475 9.027 3.838) 10.406 16.063 ( 0.379 -1.312 -1.023) 1.706 16.080 ( -0.389 -1.700 -1.351) 2.207 17.089 ( 2.281 6.595 1.278) 7.094 17.305 ( 3.367 5.265 -3.714) 7.270 17.487 ( -2.465 5.400 3.549) 6.916 17.869 ( -9.232 2.586 -6.407) 11.531 18.594 ( 8.720 -14.167 -0.382) 16.640 18.753 ( -7.934 -13.353 -0.266) 15.535 ======================= Grid point 237 (125/170) ======================= q-point: (-0.45 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.005 ( -2.561 4.663 8.544) 10.065 2.133 ( -3.977 2.268 1.875) 4.947 2.408 ( 5.566 4.609 3.278) 7.935 2.567 ( -4.303 10.659 -1.516) 11.594 2.764 ( -11.666 0.057 -10.888) 15.958 2.934 ( 5.480 -1.167 1.239) 5.739 3.017 ( 2.480 1.414 -1.022) 3.032 3.157 ( 0.690 -1.474 -0.871) 1.846 3.364 ( 5.431 1.433 3.450) 6.592 3.377 ( -1.163 -2.731 0.632) 3.035 3.890 ( -1.479 3.420 2.387) 4.425 4.061 ( 2.524 4.862 4.199) 6.902 4.119 ( 3.199 2.224 -6.672) 7.726 4.197 ( -0.712 1.115 -4.878) 5.054 4.533 ( 1.926 -0.762 5.824) 6.182 4.604 ( -9.435 -1.475 6.363) 11.476 4.856 ( 0.873 -3.269 -6.026) 6.911 4.957 ( 1.897 -2.608 -10.411) 10.899 5.173 ( 0.453 -7.149 1.487) 7.316 5.189 ( -0.774 -5.305 0.365) 5.373 5.401 ( -3.749 1.214 0.437) 3.964 5.553 ( 4.061 1.637 -3.507) 5.610 5.946 ( 4.184 -10.250 4.561) 11.974 6.026 ( -1.474 -11.514 -4.322) 12.387 6.400 ( -0.669 5.072 1.110) 5.235 6.481 ( 4.086 1.247 1.347) 4.479 6.640 ( -0.834 -5.888 4.899) 7.705 6.755 ( 4.913 -2.675 -1.071) 5.696 6.906 ( -1.757 -1.777 6.169) 6.656 7.146 ( -3.866 0.717 -7.231) 8.231 7.436 ( 4.142 1.777 4.225) 6.178 7.489 ( -1.679 2.910 0.983) 3.501 7.571 ( 3.667 6.146 -5.803) 9.214 7.655 ( 1.129 1.481 -5.426) 5.736 8.215 ( -3.341 4.525 3.059) 6.403 8.287 ( -0.369 2.447 1.059) 2.691 9.006 ( -1.752 -4.972 -2.741) 5.942 9.039 ( 2.986 -6.494 -3.006) 7.754 9.522 ( 1.349 -3.001 1.862) 3.780 9.586 ( -1.593 -4.827 -3.180) 5.995 10.082 ( -0.737 0.003 0.878) 1.147 10.104 ( -0.948 0.165 -0.915) 1.328 11.350 ( -1.071 4.917 4.293) 6.615 11.472 ( -1.116 4.083 0.683) 4.287 11.632 ( 2.726 3.674 3.175) 5.569 11.728 ( -0.943 3.916 -1.577) 4.325 11.938 ( -3.558 -1.823 1.261) 4.192 12.103 ( 3.755 -3.742 -3.877) 6.568 12.263 ( -2.783 3.544 5.068) 6.782 12.361 ( -0.273 1.945 0.222) 1.976 12.943 ( -3.028 11.000 4.227) 12.167 13.024 ( 0.344 9.996 1.837) 10.170 16.054 ( -0.335 -1.256 -0.741) 1.497 16.066 ( 0.526 -1.504 -1.021) 1.892 17.158 ( 4.049 4.780 1.996) 6.575 17.264 ( -1.058 4.363 -5.260) 6.916 17.509 ( -0.996 2.652 6.674) 7.250 17.749 ( 3.109 -0.764 -7.641) 8.284 18.577 ( -10.411 -8.190 1.219) 13.302 18.755 ( 8.059 -12.695 -0.729) 15.055 ======================= Grid point 238 (126/170) ======================= q-point: (-0.36 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.010 ( -3.654 6.357 -0.503) 7.349 2.130 ( -1.988 0.682 6.822) 7.138 2.363 ( -8.183 9.378 -9.354) 15.569 2.513 ( -8.205 5.973 5.559) 11.572 2.543 ( -0.852 4.649 -0.515) 4.755 2.894 ( -4.675 2.193 -6.992) 8.692 3.033 ( 2.405 -4.139 4.013) 6.247 3.250 ( 7.143 -3.548 -2.934) 8.498 3.354 ( 1.726 -6.140 -1.545) 6.563 3.498 ( -0.265 -2.897 5.472) 6.197 3.931 ( -0.530 8.738 0.724) 8.784 3.993 ( -5.359 7.683 -2.820) 9.782 4.129 ( 5.393 1.706 -1.197) 5.781 4.264 ( 4.892 4.370 4.581) 8.001 4.526 ( -5.051 -1.388 3.803) 6.473 4.658 ( 4.025 -4.301 3.518) 6.861 4.815 ( 3.247 -1.515 -2.773) 4.531 4.856 ( -1.215 3.475 -6.143) 7.161 5.150 ( 0.638 -2.922 0.364) 3.013 5.269 ( 1.747 -5.149 2.888) 6.157 5.410 ( 3.502 -0.571 2.923) 4.597 5.573 ( 2.120 0.566 -2.715) 3.491 5.977 ( 3.934 -11.506 -4.286) 12.893 6.085 ( 2.180 -10.015 3.630) 10.874 6.360 ( -1.039 0.644 -1.582) 1.999 6.527 ( -0.903 1.762 -2.125) 2.904 6.659 ( 1.167 -3.032 -0.937) 3.382 6.830 ( -7.984 0.970 -0.751) 8.077 6.850 ( 5.228 -8.915 0.148) 10.336 7.135 ( 2.850 2.221 5.053) 6.212 7.416 ( -1.916 4.023 -3.867) 5.899 7.542 ( 1.052 -0.082 0.763) 1.302 7.577 ( 3.621 3.592 -2.580) 5.716 7.694 ( 7.689 2.456 -1.542) 8.218 8.184 ( -4.322 4.371 3.274) 6.965 8.271 ( -2.208 2.174 -0.040) 3.098 8.978 ( 0.891 -3.037 -0.596) 3.221 9.090 ( 4.790 -6.992 0.851) 8.518 9.515 ( -0.347 -2.276 -1.519) 2.758 9.619 ( 3.949 -5.025 2.831) 6.990 10.061 ( -3.043 1.302 -0.008) 3.310 10.071 ( -1.551 0.352 0.068) 1.591 11.374 ( -1.413 3.925 2.848) 5.051 11.443 ( -1.894 3.792 -0.530) 4.272 11.667 ( -1.590 3.075 -3.005) 4.584 11.691 ( -0.289 3.921 0.356) 3.947 11.878 ( -3.380 -1.525 0.494) 3.740 12.100 ( 0.633 -1.315 -3.909) 4.172 12.245 ( -5.105 2.797 2.574) 6.365 12.356 ( -0.678 -0.754 0.651) 1.205 12.889 ( -6.540 9.328 0.748) 11.417 12.995 ( -4.336 8.132 -1.164) 9.289 16.042 ( -0.123 -0.579 -0.380) 0.704 16.069 ( 0.644 -1.091 -0.239) 1.289 17.189 ( -0.249 5.138 -2.856) 5.883 17.250 ( 2.997 4.666 -0.830) 5.607 17.648 ( 3.964 -2.181 12.972) 13.738 17.721 ( 4.926 -2.295 -9.608) 11.038 18.415 ( -9.750 -1.043 1.462) 9.914 18.886 ( 8.217 -12.973 -0.154) 15.357 ======================= Grid point 239 (127/170) ======================= q-point: (-0.27 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.904 ( -4.116 10.432 -4.357) 12.032 2.110 ( -10.175 16.338 -3.854) 19.629 2.194 ( -2.748 -1.338 9.372) 9.858 2.484 ( -2.351 5.782 4.192) 7.519 2.508 ( -1.980 5.436 -1.538) 5.986 2.743 ( -3.148 0.191 -4.378) 5.395 3.154 ( 1.783 -6.943 4.637) 8.537 3.248 ( 0.857 -4.193 -8.112) 9.171 3.416 ( 3.853 -12.433 1.638) 13.119 3.421 ( -6.229 -5.353 -3.709) 9.012 3.851 ( -8.785 12.131 0.237) 14.980 3.889 ( -4.130 8.835 1.239) 9.831 4.247 ( 4.733 -1.592 1.731) 5.285 4.433 ( 3.473 13.124 10.893) 17.405 4.521 ( 0.516 0.928 -0.327) 1.111 4.712 ( 3.065 4.848 -0.109) 5.737 4.818 ( 10.052 0.033 -6.897) 12.191 4.947 ( 3.639 -5.876 5.789) 9.016 5.233 ( 6.015 0.968 3.734) 7.146 5.356 ( 5.643 -2.245 4.424) 7.513 5.530 ( 3.839 -1.847 0.251) 4.268 5.573 ( 2.282 -4.153 1.180) 4.884 5.977 ( 2.386 -9.497 -5.401) 11.183 6.104 ( -2.232 -2.998 -0.213) 3.743 6.321 ( -4.142 -3.193 -6.336) 8.215 6.424 ( -0.325 -5.087 -2.178) 5.543 6.644 ( -3.700 9.280 2.157) 10.220 6.746 ( -1.830 -3.292 0.904) 3.874 6.934 ( 3.955 -8.846 -0.163) 9.692 7.268 ( 2.554 -6.032 7.266) 9.783 7.320 ( -2.104 4.844 -5.050) 7.307 7.559 ( 0.344 1.594 0.169) 1.639 7.614 ( 5.170 2.684 -4.769) 7.529 7.788 ( 4.530 3.088 -1.991) 5.832 8.151 ( -3.206 4.419 0.304) 5.468 8.220 ( -2.895 0.168 0.334) 2.919 9.027 ( 3.562 0.008 2.604) 4.412 9.221 ( 6.512 -5.916 4.819) 10.032 9.526 ( 3.102 -0.163 -0.343) 3.125 9.738 ( 5.439 -4.636 3.569) 7.989 10.003 ( -4.330 0.969 1.248) 4.609 10.040 ( -1.742 0.089 -0.091) 1.747 11.344 ( -3.058 4.288 -1.599) 5.504 11.426 ( -0.402 -0.023 1.277) 1.338 11.595 ( -1.997 2.078 -3.768) 4.744 11.641 ( -3.219 2.423 -1.932) 4.468 11.863 ( -0.541 -0.368 1.193) 1.360 12.026 ( -3.082 -0.235 -5.044) 5.916 12.156 ( -6.310 3.352 -0.333) 7.153 12.345 ( -1.276 -3.228 -0.366) 3.491 12.754 ( -8.322 7.340 -1.909) 11.259 12.865 ( -7.308 4.111 -3.155) 8.959 16.044 ( 0.446 0.300 0.279) 0.606 16.082 ( 0.639 -0.456 0.530) 0.947 17.152 ( -0.399 6.948 -4.087) 8.071 17.249 ( -0.019 4.073 -2.594) 4.829 17.622 ( -0.733 -3.502 -9.338) 10.000 17.950 ( 2.562 -11.089 18.496) 21.717 18.318 ( 0.324 10.258 -0.286) 10.267 19.045 ( 10.378 -11.991 1.466) 15.926 ======================= Grid point 240 (128/170) ======================= q-point: (-0.18 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.817 ( -1.978 15.155 -0.367) 15.288 1.945 ( -7.290 20.380 2.501) 21.789 2.257 ( -1.934 -1.601 6.253) 6.738 2.457 ( 0.594 5.300 -4.374) 6.898 2.487 ( -1.059 3.766 0.243) 3.919 2.711 ( -0.781 -7.011 2.293) 7.418 3.065 ( -8.024 -1.156 -5.845) 9.994 3.188 ( 1.004 -4.228 -0.545) 4.380 3.336 ( -1.614 -7.172 -0.985) 7.417 3.478 ( 2.056 -9.672 -2.586) 10.220 3.718 ( -11.197 10.020 3.738) 15.484 3.849 ( -1.257 6.716 2.777) 7.375 4.350 ( 1.716 -0.301 6.915) 7.131 4.470 ( -0.336 12.825 2.788) 13.129 4.666 ( 6.460 3.708 6.856) 10.124 4.803 ( 2.243 0.922 0.111) 2.428 4.905 ( 11.278 1.203 -9.272) 14.650 5.069 ( 4.243 -5.182 5.683) 8.784 5.360 ( 0.823 7.399 3.903) 8.406 5.440 ( 5.296 -4.256 -9.007) 11.282 5.635 ( 6.347 -3.008 5.932) 9.194 5.692 ( 4.775 -9.167 5.956) 11.929 5.976 ( 4.944 -1.472 -1.953) 5.516 6.032 ( -4.253 -0.968 -0.785) 4.432 6.161 ( -3.967 0.109 -1.419) 4.215 6.464 ( 2.002 1.600 1.806) 3.135 6.607 ( -5.376 3.905 5.459) 8.599 6.723 ( -0.748 -2.284 -3.685) 4.400 6.986 ( 2.252 -4.870 1.045) 5.467 7.210 ( -1.782 -3.547 -4.060) 5.678 7.380 ( -2.716 -3.858 6.814) 8.288 7.530 ( -3.582 3.746 -1.851) 5.503 7.639 ( 6.441 -0.290 -6.511) 9.163 7.814 ( 3.594 0.912 -3.758) 5.280 8.042 ( -5.032 4.642 -5.443) 8.746 8.201 ( -0.828 -4.613 -0.835) 4.761 9.144 ( 4.620 2.850 4.414) 6.996 9.383 ( 4.166 -4.789 4.504) 7.783 9.610 ( 6.243 1.914 0.559) 6.553 9.854 ( 2.401 -2.958 0.668) 3.868 9.954 ( -2.491 1.835 3.108) 4.386 10.068 ( 3.842 -2.121 5.299) 6.880 11.261 ( -2.684 4.036 -3.060) 5.732 11.441 ( -0.356 -2.584 1.836) 3.190 11.520 ( -1.444 1.448 -3.105) 3.717 11.577 ( -1.428 0.982 -2.219) 2.816 11.847 ( -2.980 -0.952 -1.015) 3.289 11.895 ( -3.346 -0.514 -5.518) 6.474 12.061 ( -3.636 3.253 -0.072) 4.879 12.297 ( -2.350 -3.053 -2.545) 4.617 12.584 ( -8.724 6.253 -1.925) 10.905 12.699 ( -7.085 -0.047 -3.898) 8.087 16.063 ( 0.933 1.093 0.916) 1.704 16.101 ( 0.412 0.299 1.079) 1.193 17.066 ( -1.311 7.156 -7.429) 10.398 17.202 ( -2.285 1.966 -2.075) 3.660 17.494 ( -3.025 -2.267 -6.083) 7.161 17.961 ( -11.246 -14.447 0.777) 18.324 18.553 ( 13.369 13.629 13.381) 23.314 19.273 ( 12.629 -8.783 3.403) 15.755 ======================= Grid point 241 (129/170) ======================= q-point: (-0.09 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.837 ( 2.140 16.825 2.887) 17.205 1.945 ( -1.324 17.700 10.256) 20.499 2.231 ( -0.152 0.924 -6.861) 6.924 2.454 ( -0.658 1.444 4.518) 4.789 2.485 ( 2.377 3.644 -1.762) 4.694 2.709 ( -2.212 -4.688 0.114) 5.185 2.881 ( -7.058 -2.591 -0.852) 7.566 3.234 ( 0.416 -11.383 -1.027) 11.437 3.290 ( -1.418 -11.159 -4.081) 11.966 3.424 ( 1.164 -7.134 -10.503) 12.750 3.609 ( -5.506 21.550 8.827) 23.930 3.908 ( -0.723 6.239 9.729) 11.581 4.420 ( 0.170 2.528 2.549) 3.594 4.572 ( -1.918 6.446 9.279) 11.460 4.737 ( -0.680 -0.735 -2.877) 3.046 4.840 ( 3.357 -0.241 6.667) 7.469 4.976 ( 4.543 2.567 -2.521) 5.795 5.222 ( 8.378 -1.808 0.733) 8.602 5.356 ( -3.981 5.132 2.743) 7.051 5.463 ( 10.117 -2.581 -7.959) 13.129 5.705 ( 2.747 -6.706 -2.747) 7.750 5.740 ( -8.741 -6.036 1.418) 10.717 6.063 ( 2.082 6.952 0.984) 7.323 6.070 ( 6.182 3.255 5.389) 8.823 6.233 ( 6.040 -0.476 8.982) 10.835 6.504 ( -1.850 8.579 6.427) 10.878 6.592 ( -3.898 -2.590 -3.187) 5.663 6.645 ( 1.877 -0.419 -0.719) 2.053 7.035 ( 0.377 -2.229 1.758) 2.864 7.192 ( 4.398 -5.514 -1.878) 7.299 7.329 ( -10.589 -0.855 4.697) 11.616 7.409 ( -5.235 4.717 -3.694) 7.956 7.667 ( 3.443 1.265 -3.868) 5.331 7.833 ( 5.085 -6.265 -6.619) 10.436 7.899 ( -2.550 1.951 -6.347) 7.113 8.135 ( -2.666 -10.057 -5.866) 11.944 9.254 ( 2.631 2.992 3.037) 5.010 9.436 ( -1.369 -3.673 1.559) 4.219 9.702 ( 3.899 0.965 -1.051) 4.152 9.798 ( -3.409 -1.566 -2.015) 4.258 10.054 ( 3.320 4.817 7.630) 9.615 10.259 ( 6.024 0.371 7.550) 9.665 11.212 ( 0.110 2.791 -0.914) 2.939 11.439 ( -0.370 -3.608 -2.088) 4.186 11.495 ( 1.486 0.251 -0.952) 1.782 11.552 ( -0.008 -1.106 1.784) 2.099 11.760 ( -0.072 0.979 -4.224) 4.337 11.815 ( -2.608 -1.535 -2.114) 3.691 12.040 ( -0.850 -0.203 1.704) 1.915 12.216 ( -1.363 -1.103 -4.988) 5.288 12.423 ( -7.999 5.505 -1.361) 9.805 12.549 ( -4.538 -2.423 -4.470) 6.815 16.094 ( 1.043 1.587 1.278) 2.290 16.119 ( -0.022 1.043 1.294) 1.662 16.962 ( -0.613 5.539 -6.478) 8.545 17.132 ( -2.401 0.177 -2.661) 3.589 17.404 ( -0.029 -2.960 -3.915) 4.908 17.717 ( -12.101 -10.971 -6.546) 17.596 18.920 ( 7.844 11.412 16.411) 21.472 19.501 ( 9.041 -5.237 1.909) 10.621 ======================= Grid point 242 (130/170) ======================= q-point: ( 0.00 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.083 ( 2.110 4.680 -4.999) 7.166 2.148 ( 2.225 -1.579 -4.511) 5.272 2.392 ( 3.084 10.567 4.370) 11.844 2.516 ( 1.469 -1.274 3.061) 3.627 2.589 ( 1.525 4.871 2.567) 5.713 2.665 ( 1.543 -2.377 3.814) 4.752 2.767 ( -3.573 0.409 1.602) 3.937 2.867 ( -4.618 -9.456 -5.324) 11.793 3.078 ( -0.626 -0.520 -6.038) 6.093 3.159 ( 1.087 -7.376 -7.798) 10.789 4.012 ( 0.454 6.458 8.311) 10.535 4.078 ( -1.393 -0.225 6.793) 6.938 4.491 ( -2.273 4.429 5.505) 7.422 4.595 ( -3.632 -4.559 2.478) 6.334 4.862 ( -1.065 10.800 5.796) 12.303 4.982 ( 1.018 -1.060 2.725) 3.096 5.083 ( -3.612 7.602 2.396) 8.751 5.241 ( -11.044 -4.810 6.595) 13.733 5.373 ( 4.223 2.696 -4.598) 6.800 5.451 ( -4.983 -5.216 -1.081) 7.294 5.608 ( 12.729 0.563 -3.212) 13.140 5.642 ( 8.564 -2.971 -2.816) 9.492 6.197 ( -2.065 5.029 0.030) 5.436 6.256 ( -1.478 -0.576 -0.340) 1.623 6.480 ( 5.347 3.025 5.592) 8.308 6.505 ( 1.920 0.679 3.577) 4.116 6.626 ( -0.366 3.096 3.462) 4.659 6.730 ( 4.508 -3.521 -0.863) 5.785 7.008 ( -6.828 2.403 7.050) 10.104 7.080 ( -6.186 -4.713 5.743) 9.668 7.294 ( 0.949 5.054 -2.073) 5.545 7.445 ( 1.649 3.566 -5.556) 6.805 7.545 ( 2.560 -9.338 -5.958) 11.369 7.672 ( 0.316 -9.789 -8.527) 12.986 7.826 ( -1.922 0.920 -4.931) 5.371 7.837 ( 0.135 0.273 -5.488) 5.497 9.318 ( -0.650 0.665 0.376) 1.003 9.345 ( -2.076 -2.083 -0.391) 2.966 9.741 ( 1.092 0.779 -0.768) 1.546 9.752 ( 0.543 -0.378 -0.989) 1.190 10.312 ( -1.953 5.968 9.850) 11.682 10.384 ( -3.201 -1.052 8.180) 8.847 11.263 ( 1.144 2.755 -2.140) 3.671 11.328 ( 1.190 -3.719 -3.804) 5.451 11.526 ( -0.097 1.745 3.036) 3.503 11.571 ( 1.624 -2.601 1.825) 3.568 11.766 ( 1.220 0.272 -0.110) 1.255 11.780 ( 2.778 -0.536 -1.176) 3.064 12.002 ( 0.095 2.140 -4.462) 4.949 12.088 ( 3.451 -5.716 -7.556) 10.084 12.411 ( -2.109 3.771 0.038) 4.320 12.448 ( -1.410 -0.139 -1.409) 1.998 16.149 ( 0.301 0.751 1.307) 1.537 16.150 ( -0.192 0.591 1.235) 1.383 16.974 ( 0.572 3.461 -6.565) 7.443 17.038 ( 0.419 -2.510 -7.689) 8.099 17.339 ( 1.135 -2.434 -0.975) 2.857 17.344 ( -2.757 -3.165 -2.670) 4.975 19.360 ( -0.617 8.801 10.420) 13.654 19.505 ( -0.404 -5.693 4.285) 7.137 ======================= Grid point 243 (131/170) ======================= q-point: ( 0.09 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.074 ( 1.969 2.253 -2.905) 4.170 2.123 ( 1.597 -2.366 -6.110) 6.744 2.454 ( -0.839 6.525 3.358) 7.386 2.555 ( 0.014 -3.351 4.480) 5.594 2.684 ( 3.746 1.674 -5.010) 6.476 2.698 ( 1.354 -0.131 -6.859) 6.992 2.744 ( 1.984 4.147 2.903) 5.437 2.842 ( 3.913 -3.222 8.254) 9.686 3.043 ( 2.272 0.496 -1.507) 2.771 3.141 ( 6.163 -7.432 -4.759) 10.764 4.037 ( -8.071 2.896 1.863) 8.774 4.061 ( -5.104 0.344 3.791) 6.367 4.535 ( -1.170 4.339 4.293) 6.215 4.576 ( -2.148 2.220 3.599) 4.743 4.852 ( -9.492 6.744 8.658) 14.510 4.979 ( -2.514 -3.679 -1.981) 4.877 5.030 ( -1.970 0.776 -2.699) 3.430 5.081 ( -10.376 -2.139 4.082) 11.354 5.396 ( 0.406 4.022 -2.799) 4.917 5.451 ( -1.132 -2.244 5.466) 6.016 5.714 ( 5.759 1.713 -5.136) 7.904 5.755 ( 7.866 -1.679 -3.357) 8.715 6.178 ( -0.062 3.781 2.001) 4.278 6.223 ( 0.253 -0.765 0.882) 1.194 6.488 ( -7.378 4.166 -0.381) 8.481 6.551 ( -1.634 -0.423 -0.587) 1.787 6.630 ( -3.023 1.625 -0.217) 3.439 6.685 ( -6.712 -5.283 -2.920) 9.027 6.983 ( -4.483 4.639 5.692) 8.604 7.080 ( -0.710 -3.751 7.280) 8.221 7.336 ( 4.676 0.245 -0.210) 4.687 7.480 ( 4.785 6.126 -6.121) 9.894 7.481 ( 2.055 -9.638 -1.751) 10.009 7.647 ( 4.648 -8.252 -4.529) 10.498 7.803 ( 3.587 2.300 -2.067) 4.736 7.828 ( 4.905 -0.567 -2.494) 5.532 9.307 ( -1.897 -0.003 1.172) 2.230 9.328 ( -0.363 -2.279 1.509) 2.757 9.742 ( -0.232 0.477 -1.184) 1.298 9.750 ( 0.544 -0.298 -0.371) 0.723 10.304 ( -10.205 3.788 6.962) 12.922 10.326 ( -11.085 1.408 4.992) 12.238 11.270 ( 2.237 1.579 -1.373) 3.063 11.313 ( 1.845 -2.865 -3.531) 4.907 11.558 ( -0.271 2.964 1.565) 3.363 11.601 ( 0.555 -0.896 1.411) 1.761 11.770 ( -0.105 -0.371 -3.822) 3.842 11.801 ( 1.801 -3.089 -3.195) 4.795 12.007 ( 6.286 3.457 -2.052) 7.461 12.101 ( 6.730 -5.700 -4.325) 9.823 12.449 ( 5.144 3.302 1.162) 6.222 12.475 ( 5.738 0.765 -0.352) 5.799 16.149 ( -1.164 0.997 0.550) 1.628 16.157 ( -0.705 0.217 0.679) 1.003 16.943 ( 1.892 1.344 -3.196) 3.950 16.980 ( 2.626 -2.412 -4.540) 5.773 17.345 ( 4.952 2.387 0.285) 5.505 17.433 ( 9.666 -6.250 -0.160) 11.511 19.361 ( -11.367 5.658 6.753) 14.381 19.443 ( -10.084 -2.701 0.982) 10.486 ======================= Grid point 244 (132/170) ======================= q-point: ( 0.18 0.44 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.075 ( 2.995 0.534 -3.974) 5.005 2.093 ( 0.687 -0.648 -0.758) 1.211 2.429 ( -4.844 5.151 -0.066) 7.071 2.537 ( -2.939 -5.905 -2.725) 7.137 2.625 ( 3.970 6.232 -5.836) 9.416 2.726 ( 4.501 -3.341 -0.365) 5.617 2.920 ( 8.195 5.531 4.428) 10.832 3.004 ( 3.393 -4.025 6.653) 8.484 3.138 ( 8.051 2.214 3.316) 8.984 3.237 ( 9.989 -5.774 -4.383) 12.342 3.889 ( -9.247 5.403 1.293) 10.787 3.971 ( -7.649 -2.828 1.714) 8.333 4.512 ( -4.049 8.232 1.060) 9.235 4.592 ( -2.882 5.126 4.265) 7.265 4.741 ( -11.605 -0.192 1.415) 11.692 4.878 ( -8.599 -7.360 4.309) 12.111 4.983 ( -0.967 1.713 -3.303) 3.845 5.022 ( 1.230 -1.930 -2.031) 3.060 5.321 ( -3.731 6.519 -3.487) 8.281 5.432 ( -5.391 -4.665 1.840) 7.363 5.756 ( 3.890 3.228 -1.604) 5.303 5.816 ( 1.639 -2.144 1.068) 2.903 6.165 ( -4.500 4.891 -2.400) 7.067 6.224 ( -2.632 -0.207 -4.438) 5.164 6.369 ( -4.766 -1.288 1.193) 5.079 6.416 ( -7.420 -2.917 -5.392) 9.625 6.501 ( -6.927 0.808 -1.717) 7.182 6.570 ( -4.202 -5.017 0.485) 6.563 6.992 ( -0.611 4.387 3.613) 5.716 7.117 ( -2.146 -8.037 0.773) 8.354 7.430 ( 6.496 5.221 1.762) 8.518 7.524 ( 5.270 1.656 1.873) 5.833 7.572 ( 6.453 1.017 -2.106) 6.863 7.669 ( 2.620 -5.859 -1.759) 6.655 7.889 ( 6.963 2.505 1.133) 7.486 7.937 ( 7.767 -2.842 1.433) 8.394 9.287 ( -2.569 1.033 1.037) 2.957 9.334 ( -1.839 -3.830 1.362) 4.462 9.713 ( -1.512 2.181 -1.119) 2.880 9.759 ( 0.145 -2.251 0.900) 2.429 10.147 ( -11.446 3.378 1.178) 11.992 10.190 ( -9.911 -0.819 1.895) 10.124 11.297 ( 0.466 0.477 -0.097) 0.674 11.311 ( 2.048 -0.763 -0.510) 2.244 11.545 ( -1.496 3.869 -0.257) 4.156 11.619 ( -0.467 -2.933 -0.712) 3.054 11.740 ( 3.883 2.576 -2.419) 5.250 11.804 ( 3.275 -3.435 -1.720) 5.048 12.119 ( 7.673 2.382 -0.893) 8.084 12.178 ( 6.603 -3.324 -3.186) 8.050 12.584 ( 7.917 3.266 2.163) 8.833 12.608 ( 8.808 1.047 0.614) 8.891 16.127 ( -1.598 1.027 -0.255) 1.916 16.142 ( -1.385 -0.435 -0.170) 1.462 16.963 ( 3.685 3.439 -0.501) 5.065 17.030 ( 4.867 -2.916 0.837) 5.734 17.486 ( 9.946 5.844 0.568) 11.550 17.645 ( 14.146 -9.900 0.991) 17.294 19.133 ( -19.671 4.958 0.150) 20.287 19.217 ( -16.937 -3.378 0.324) 17.274 ======================= Grid point 245 (133/170) ======================= q-point: ( 0.27 0.44 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.102 ( -1.627 3.517 5.155) 6.449 2.120 ( 3.792 2.437 -1.031) 4.624 2.341 ( -5.399 3.016 1.594) 6.386 2.462 ( 1.035 -7.054 -4.286) 8.319 2.685 ( 6.337 4.675 -0.530) 7.893 2.776 ( 3.796 -2.856 -2.894) 5.563 3.090 ( 7.996 2.127 0.938) 8.327 3.102 ( 2.616 -0.297 3.566) 4.433 3.305 ( 6.584 0.431 -10.352) 12.276 3.329 ( 8.502 -2.887 -0.011) 8.979 3.821 ( -4.280 4.991 7.679) 10.110 3.898 ( -4.114 -2.045 4.701) 6.574 4.431 ( -9.559 11.287 1.424) 14.859 4.516 ( -8.838 5.603 -1.035) 10.515 4.608 ( -2.610 -3.152 2.413) 4.750 4.751 ( -9.603 -11.920 2.562) 15.520 4.929 ( -0.737 4.175 -4.912) 6.489 5.015 ( 1.067 -3.710 -4.311) 5.787 5.259 ( -1.105 5.043 1.181) 5.296 5.364 ( -4.998 -5.545 2.278) 7.805 5.774 ( 0.020 3.175 -3.190) 4.501 5.812 ( -5.188 0.195 2.263) 5.663 5.964 ( -5.951 3.512 -14.371) 15.946 6.081 ( -4.914 -4.533 -7.585) 10.111 6.204 ( -5.007 1.293 -2.399) 5.701 6.292 ( -5.477 -7.568 0.262) 9.346 6.482 ( -1.836 1.113 6.510) 6.855 6.549 ( -3.096 -5.517 4.881) 7.990 7.044 ( 1.548 1.443 3.266) 3.891 7.073 ( -1.357 -2.324 -1.629) 3.146 7.551 ( 3.823 8.241 0.705) 9.112 7.615 ( 3.715 2.756 -0.346) 4.639 7.629 ( 3.917 1.691 -2.474) 4.932 7.709 ( 4.504 -6.322 -2.337) 8.107 8.043 ( 6.863 2.725 4.087) 8.440 8.094 ( 6.461 -2.677 3.870) 7.993 9.222 ( -5.096 1.275 -1.537) 5.474 9.276 ( -5.431 -4.042 -1.088) 6.857 9.660 ( -2.681 4.510 -2.292) 5.725 9.756 ( -2.620 -4.514 0.197) 5.222 10.020 ( -3.223 2.007 0.679) 3.857 10.066 ( -4.166 -2.800 -0.901) 5.100 11.306 ( 0.237 2.702 2.018) 3.380 11.353 ( 0.887 -2.082 2.516) 3.384 11.527 ( -0.331 3.975 0.598) 4.034 11.601 ( 0.391 -2.782 -0.134) 2.813 11.832 ( 5.986 1.893 1.420) 6.436 11.874 ( 4.752 -2.199 1.152) 5.362 12.225 ( 6.379 1.063 -1.353) 6.607 12.240 ( 5.329 -0.084 -3.268) 6.252 12.751 ( 7.774 3.156 3.455) 9.073 12.766 ( 8.170 1.776 1.818) 8.557 16.094 ( -1.382 0.719 -0.799) 1.751 16.111 ( -1.456 -0.920 -0.769) 1.886 17.051 ( 5.339 5.624 1.670) 7.933 17.141 ( 6.240 -2.940 1.552) 7.070 17.650 ( 8.132 10.001 -0.609) 12.904 17.897 ( 13.364 -14.228 0.572) 19.529 18.749 ( -22.174 7.639 -3.265) 23.679 18.907 ( -18.620 -7.973 -0.157) 20.256 ======================= Grid point 246 (134/170) ======================= q-point: ( 0.36 0.44 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.088 ( -4.608 6.997 3.810) 9.204 2.204 ( -1.050 -2.643 5.438) 6.136 2.299 ( -0.443 8.326 3.238) 8.945 2.511 ( 5.811 -9.263 1.533) 11.042 2.816 ( 7.098 1.984 1.762) 7.578 2.825 ( 6.174 3.255 0.030) 6.980 3.149 ( -1.940 3.332 -1.590) 4.171 3.210 ( 7.276 1.208 -2.686) 7.850 3.252 ( 5.965 0.909 -10.939) 12.493 3.334 ( 0.180 -9.881 -10.980) 14.772 3.890 ( -0.288 5.857 9.146) 10.865 3.959 ( 0.439 -0.127 8.071) 8.084 4.233 ( -10.097 7.611 -0.429) 12.651 4.359 ( -9.665 -2.587 -1.688) 10.146 4.618 ( -2.569 0.843 6.081) 6.655 4.712 ( -3.095 -8.128 7.433) 11.440 4.838 ( -0.823 5.633 -6.786) 8.858 4.950 ( -1.295 -4.692 -6.393) 8.035 5.261 ( -1.900 1.413 0.129) 2.371 5.301 ( -4.830 -3.052 -0.435) 5.730 5.636 ( -3.232 1.461 -11.281) 11.825 5.675 ( -5.409 -3.060 -11.408) 12.991 5.760 ( -2.778 6.083 -1.973) 6.973 5.947 ( -3.311 -10.837 -1.831) 11.479 6.217 ( 1.172 2.806 6.188) 6.894 6.283 ( 1.407 -3.872 4.282) 5.942 6.540 ( -0.244 -1.377 6.574) 6.721 6.558 ( -3.308 -3.478 5.919) 7.621 7.027 ( -0.952 4.565 -2.706) 5.392 7.116 ( 1.542 -3.517 3.340) 5.090 7.548 ( -1.862 6.830 -2.952) 7.671 7.624 ( -1.831 1.768 1.071) 2.761 7.677 ( 6.006 2.509 -6.199) 8.988 7.733 ( 3.964 -3.926 -6.191) 8.334 8.189 ( 3.935 2.489 4.521) 6.489 8.224 ( 3.575 -1.140 3.373) 5.046 9.097 ( -4.812 0.585 -4.195) 6.411 9.142 ( -6.201 -3.823 -3.715) 8.177 9.575 ( -2.518 4.306 -3.822) 6.284 9.674 ( -3.873 -5.087 -3.207) 7.152 10.037 ( 0.784 -0.293 2.226) 2.378 10.045 ( 1.185 -1.384 1.258) 2.214 11.352 ( 0.172 3.126 4.728) 5.671 11.401 ( 0.808 -1.835 3.738) 4.242 11.555 ( 1.047 4.630 3.140) 5.691 11.639 ( 1.492 -2.968 3.584) 4.887 11.934 ( 3.875 1.109 0.594) 4.074 11.964 ( 4.216 -1.748 0.172) 4.567 12.287 ( 3.374 2.254 -1.021) 4.184 12.306 ( 4.669 0.209 -0.730) 4.731 12.917 ( 6.177 3.742 4.555) 8.538 12.928 ( 6.830 2.551 4.287) 8.458 16.065 ( -0.757 0.222 -1.038) 1.304 16.079 ( -1.074 -1.091 -1.061) 1.863 17.160 ( 5.225 6.624 0.727) 8.468 17.260 ( 6.621 -2.753 -0.634) 7.198 17.702 ( 0.211 12.812 -3.120) 13.188 18.020 ( 0.517 -19.046 -6.842) 20.245 18.419 ( -10.312 11.573 2.443) 15.692 18.645 ( -12.015 -11.635 1.700) 16.812 ======================= Grid point 247 (135/170) ======================= q-point: ( 0.45 0.44 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.069 ( -4.122 5.784 6.013) 9.306 2.174 ( -6.040 -4.398 4.570) 8.759 2.416 ( 5.305 11.311 4.370) 13.235 2.638 ( 6.737 -9.288 0.018) 11.474 2.911 ( 2.880 8.397 -6.485) 10.994 2.961 ( 6.536 4.634 3.898) 8.910 3.034 ( -5.268 0.396 -6.394) 8.295 3.185 ( 0.496 -9.100 -5.281) 10.533 3.257 ( 0.920 0.786 0.854) 1.481 3.281 ( 2.767 -1.236 -0.454) 3.064 3.982 ( 1.550 3.266 3.506) 5.036 4.007 ( -2.960 2.623 2.264) 4.557 4.165 ( 0.107 0.323 1.796) 1.828 4.211 ( -2.725 -2.159 -2.499) 4.282 4.610 ( -6.188 2.857 3.140) 7.505 4.686 ( -8.886 -0.791 6.216) 10.873 4.808 ( 4.171 -0.968 -6.400) 7.700 4.876 ( 3.374 -4.910 -5.741) 8.273 5.157 ( -3.290 -0.055 -7.564) 8.249 5.185 ( -3.757 -2.939 -4.638) 6.654 5.512 ( -3.737 1.864 -0.830) 4.257 5.548 ( 0.263 -1.242 -1.544) 1.999 5.743 ( 1.964 1.622 -0.710) 2.644 5.883 ( -1.876 -11.081 -2.754) 11.571 6.334 ( 3.125 2.919 6.752) 7.992 6.399 ( 3.452 -2.681 5.726) 7.203 6.582 ( -1.981 0.417 5.975) 6.309 6.626 ( 1.698 -3.127 5.566) 6.607 6.977 ( -1.101 8.650 -1.954) 8.936 7.159 ( 0.031 -8.755 0.516) 8.771 7.458 ( -2.456 7.921 -3.616) 9.047 7.580 ( -3.082 -2.217 -1.349) 4.029 7.680 ( 3.599 2.789 -6.782) 8.169 7.710 ( 2.747 -0.514 -6.680) 7.241 8.271 ( 0.260 2.124 3.652) 4.233 8.292 ( 0.631 0.058 2.612) 2.687 8.989 ( -1.341 -1.178 -4.910) 5.224 9.009 ( -3.292 -3.002 -4.587) 6.394 9.506 ( -0.982 2.272 -2.435) 3.472 9.576 ( -2.623 -4.504 -3.608) 6.339 10.071 ( 0.538 0.435 1.778) 1.908 10.087 ( 1.005 -1.092 1.158) 1.882 11.408 ( -0.850 4.006 5.563) 6.908 11.466 ( 0.051 -1.545 5.248) 5.471 11.630 ( 2.176 5.048 4.546) 7.133 11.717 ( 1.210 -2.846 5.084) 5.951 11.961 ( 1.051 1.111 -2.935) 3.310 12.004 ( 2.739 -2.979 -3.410) 5.292 12.329 ( 0.661 3.489 2.066) 4.108 12.365 ( 1.974 -0.118 0.968) 2.201 13.058 ( 2.841 4.998 5.793) 8.162 13.079 ( 3.912 2.935 5.123) 7.082 16.046 ( -0.077 -0.272 -0.963) 1.003 16.053 ( -0.417 -0.936 -1.070) 1.482 17.221 ( 2.639 6.541 -1.952) 7.318 17.324 ( 3.676 -2.947 -4.436) 6.471 17.626 ( -2.918 8.661 -2.869) 9.579 17.808 ( -6.991 -8.240 -8.538) 13.772 18.454 ( 2.764 0.111 5.271) 5.953 18.541 ( -5.158 -7.807 3.571) 10.016 ======================= Grid point 248 (136/170) ======================= q-point: (-0.45 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.086 ( -3.455 3.432 7.315) 8.788 2.137 ( -4.281 -1.546 4.173) 6.174 2.536 ( 4.910 7.568 0.928) 9.069 2.671 ( 0.913 -4.362 -8.295) 9.417 2.794 ( -4.944 6.371 -6.598) 10.419 2.889 ( 0.253 -2.872 -5.452) 6.168 3.078 ( 0.295 2.889 1.635) 3.333 3.124 ( -0.642 -1.883 -2.280) 3.026 3.340 ( -2.977 0.154 10.401) 10.819 3.366 ( -0.551 -1.246 9.525) 9.622 3.963 ( 1.408 3.909 -1.360) 4.372 4.043 ( 4.518 -4.195 -2.555) 6.673 4.170 ( 0.721 2.938 -1.234) 3.267 4.211 ( 5.059 -0.679 -5.359) 7.400 4.560 ( -2.792 2.093 2.981) 4.589 4.596 ( -7.914 -0.292 4.949) 9.339 4.797 ( 4.043 0.563 -7.763) 8.771 4.892 ( 6.812 -6.038 -5.225) 10.496 5.084 ( 0.874 -0.738 -0.713) 1.348 5.110 ( -0.394 -2.650 -2.631) 3.755 5.474 ( -3.325 5.493 3.187) 7.169 5.562 ( 0.214 -1.608 1.293) 2.074 5.786 ( 2.104 -4.090 -0.505) 4.627 5.830 ( 1.410 -7.179 -2.554) 7.749 6.461 ( 3.367 0.433 4.225) 5.420 6.477 ( 0.514 -0.675 0.863) 1.211 6.608 ( -2.760 3.367 4.308) 6.124 6.699 ( 0.291 -4.383 2.672) 5.142 6.975 ( 0.971 7.290 1.337) 7.475 7.111 ( -1.232 -4.935 -4.120) 6.546 7.443 ( 1.924 1.843 1.793) 3.212 7.506 ( -1.746 -2.930 -3.344) 4.777 7.655 ( 1.769 3.475 -4.574) 6.011 7.687 ( 3.102 0.709 -5.222) 6.115 8.288 ( -2.660 2.636 3.012) 4.806 8.314 ( -1.521 0.091 2.395) 2.838 8.935 ( 0.357 -1.838 -3.386) 3.870 8.944 ( 1.904 -2.751 -3.588) 4.906 9.489 ( 0.742 -0.262 -0.272) 0.832 9.512 ( -0.598 -2.531 -2.205) 3.410 10.088 ( -0.470 0.536 0.919) 1.163 10.100 ( -0.441 -0.499 0.189) 0.693 11.446 ( -2.416 4.443 5.409) 7.405 11.505 ( -2.379 -0.899 4.308) 5.003 11.715 ( 1.358 4.216 3.610) 5.714 11.772 ( -1.105 -0.529 2.781) 3.039 11.919 ( 0.100 1.489 -4.701) 4.932 11.999 ( 3.344 -5.558 -4.583) 7.942 12.344 ( -2.681 3.608 2.996) 5.402 12.384 ( -1.465 -0.246 1.308) 1.979 13.120 ( -3.010 5.945 4.128) 7.838 13.155 ( -1.383 2.659 3.227) 4.405 16.038 ( 0.154 -0.315 -0.706) 0.789 16.043 ( 0.514 -0.789 -0.807) 1.240 17.236 ( 2.636 3.286 -0.948) 4.317 17.287 ( 0.189 -1.447 -4.564) 4.791 17.579 ( -0.566 4.658 -0.118) 4.693 17.685 ( 1.371 -5.266 -6.659) 8.599 18.502 ( -3.573 0.345 3.673) 5.136 18.568 ( 3.655 -6.206 2.618) 7.664 ======================= Grid point 249 (137/170) ======================= q-point: (-0.36 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.099 ( -2.812 2.947 2.953) 5.032 2.134 ( -2.074 -0.601 4.794) 5.258 2.517 ( -5.358 6.014 -4.486) 9.219 2.590 ( -3.486 -0.337 0.279) 3.513 2.680 ( -0.465 9.187 -2.162) 9.449 2.849 ( 0.938 -6.973 -5.288) 8.802 3.047 ( -1.982 5.264 0.928) 5.701 3.154 ( 1.071 -5.368 1.645) 5.716 3.290 ( -5.778 0.977 -1.860) 6.148 3.391 ( -7.052 -7.267 2.164) 10.355 4.066 ( 3.656 4.126 -0.384) 5.526 4.104 ( 7.650 0.155 2.502) 8.050 4.138 ( -2.184 5.908 -2.224) 6.680 4.268 ( 3.091 -5.415 4.746) 7.836 4.560 ( 2.398 3.430 1.413) 4.417 4.607 ( 4.768 -1.697 0.657) 5.103 4.827 ( 6.346 5.676 -2.077) 8.764 4.941 ( 2.731 -0.931 -3.136) 4.261 5.102 ( 2.441 -0.493 -0.857) 2.633 5.143 ( 5.047 -5.611 2.373) 7.911 5.467 ( -1.354 4.685 2.467) 5.465 5.561 ( -1.018 -2.989 -0.688) 3.231 5.800 ( 4.553 -2.244 -2.940) 5.866 5.893 ( 4.524 -8.708 1.463) 9.921 6.417 ( -3.689 3.889 -4.148) 6.778 6.494 ( -2.424 -3.513 -4.286) 6.049 6.627 ( 0.409 1.058 4.254) 4.403 6.704 ( -1.146 -5.887 2.653) 6.558 6.959 ( -2.133 8.979 -2.002) 9.444 7.113 ( 0.741 -5.190 1.620) 5.488 7.454 ( 0.083 2.380 -1.898) 3.045 7.523 ( 2.318 -3.216 2.525) 4.700 7.650 ( 2.909 4.298 -2.444) 5.736 7.709 ( 5.870 -1.123 -3.295) 6.824 8.259 ( -4.215 3.063 2.350) 5.716 8.294 ( -3.360 -0.236 1.183) 3.570 8.946 ( 3.707 -0.051 -0.422) 3.731 8.982 ( 5.007 -3.751 0.327) 6.265 9.499 ( 1.686 0.573 -0.397) 1.824 9.536 ( 3.269 -3.164 1.457) 4.777 10.077 ( -1.765 0.360 0.176) 1.810 10.079 ( -1.867 0.229 -0.291) 1.903 11.447 ( -3.592 3.187 3.298) 5.826 11.483 ( -4.178 -0.010 1.674) 4.501 11.718 ( -2.684 2.143 -1.073) 3.598 11.746 ( -3.565 0.037 0.140) 3.568 11.891 ( 2.335 4.428 -3.009) 5.841 12.014 ( 2.978 -6.475 -3.526) 7.952 12.304 ( -5.593 2.993 2.114) 6.686 12.346 ( -4.164 -1.031 0.621) 4.334 13.049 ( -8.305 5.874 0.511) 10.185 13.095 ( -7.318 1.463 -0.528) 7.481 16.038 ( 0.691 0.203 -0.317) 0.787 16.049 ( 0.993 -0.854 -0.254) 1.334 17.268 ( 2.229 3.098 -1.302) 4.032 17.302 ( 4.153 0.317 -1.279) 4.357 17.602 ( -0.000 -0.782 5.166) 5.225 17.643 ( 0.919 -4.315 -4.234) 6.114 18.493 ( -0.131 7.357 1.295) 7.471 18.664 ( 5.800 -9.738 0.913) 11.371 ======================= Grid point 250 (138/170) ======================= q-point: (-0.27 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.069 ( -0.897 6.357 -1.712) 6.644 2.159 ( -1.220 -2.820 3.868) 4.940 2.401 ( -5.893 11.811 2.413) 13.418 2.539 ( -4.824 -1.446 5.575) 7.513 2.653 ( -0.729 7.616 -4.167) 8.712 2.746 ( -4.102 -0.718 -8.897) 9.823 3.052 ( -1.555 -0.631 4.326) 4.640 3.167 ( 0.235 -4.043 -0.764) 4.121 3.214 ( -6.924 -9.338 -3.065) 12.022 3.230 ( 0.503 -6.884 -4.584) 8.286 4.029 ( -5.482 5.146 -1.772) 7.725 4.038 ( -4.249 4.310 -0.605) 6.082 4.286 ( 2.550 5.252 8.275) 10.127 4.418 ( 2.672 -6.730 9.515) 11.956 4.691 ( 8.420 6.479 2.736) 10.971 4.745 ( 9.960 -0.753 -1.069) 10.046 4.907 ( 5.003 4.445 -2.931) 7.306 4.933 ( 3.765 4.781 -3.532) 7.036 5.211 ( 8.440 0.571 3.976) 9.347 5.305 ( 8.811 -6.079 4.972) 11.803 5.480 ( -0.461 -0.691 1.915) 2.088 5.516 ( -1.439 -2.998 -2.304) 4.045 5.875 ( 7.396 1.503 -2.099) 7.833 5.994 ( 4.961 -7.844 0.409) 9.290 6.297 ( -4.462 0.926 -4.024) 6.080 6.341 ( -4.902 -3.202 -5.112) 7.773 6.687 ( 2.359 0.766 1.176) 2.745 6.762 ( 3.231 -6.301 3.294) 7.810 6.881 ( -5.409 10.410 -0.404) 11.738 7.089 ( -4.833 -10.164 0.499) 11.265 7.454 ( 0.551 6.712 0.043) 6.735 7.562 ( 0.413 -3.299 0.599) 3.379 7.684 ( 3.336 5.409 -2.454) 6.813 7.784 ( 5.717 -3.487 -2.940) 7.314 8.205 ( -4.484 1.739 0.679) 4.857 8.225 ( -5.094 -0.125 -0.959) 5.185 9.052 ( 6.665 2.388 3.188) 7.764 9.119 ( 7.697 -4.321 4.140) 9.749 9.557 ( 4.927 3.059 0.916) 5.871 9.638 ( 5.802 -4.918 2.778) 8.098 10.027 ( -3.477 1.100 0.001) 3.647 10.040 ( -2.429 -0.219 -0.208) 2.448 11.402 ( -4.365 1.673 0.262) 4.682 11.421 ( -3.441 -0.439 0.220) 3.476 11.644 ( -3.131 2.395 -2.257) 4.542 11.673 ( -3.720 -0.032 -1.311) 3.944 11.893 ( 0.514 3.869 -2.223) 4.491 11.985 ( -1.111 -4.124 -4.731) 6.373 12.213 ( -6.475 2.735 0.360) 7.039 12.273 ( -4.098 -3.402 -0.522) 5.352 12.877 ( -10.454 4.665 -1.648) 11.566 12.920 ( -10.285 0.540 -2.726) 10.654 16.055 ( 1.219 0.717 0.322) 1.450 16.070 ( 1.279 -0.753 0.429) 1.545 17.272 ( 1.268 4.537 -5.132) 6.966 17.302 ( 0.516 1.175 -5.257) 5.412 17.585 ( -3.314 1.023 -0.296) 3.481 17.706 ( -2.871 -10.783 10.226) 15.135 18.570 ( 8.517 13.145 2.091) 15.802 18.816 ( 10.858 -11.682 2.173) 16.096 ======================= Grid point 251 (139/170) ======================= q-point: (-0.18 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.062 ( 2.148 9.580 -0.651) 9.839 2.192 ( 0.638 -2.879 3.363) 4.473 2.343 ( -3.630 15.262 -2.633) 15.907 2.541 ( -0.865 2.144 0.019) 2.312 2.551 ( -4.322 0.561 -6.204) 7.582 2.585 ( -4.082 -4.585 2.322) 6.563 3.015 ( -6.993 -2.191 1.074) 7.406 3.069 ( -4.018 -7.283 -1.797) 8.510 3.175 ( 0.576 -2.172 -0.266) 2.263 3.260 ( 2.214 -9.299 -0.255) 9.562 3.932 ( -5.446 6.683 1.823) 8.812 3.965 ( -2.484 3.066 -0.007) 3.946 4.402 ( -0.714 5.611 9.552) 11.102 4.539 ( 0.533 -6.326 7.242) 9.631 4.808 ( 0.223 6.392 2.857) 7.005 4.835 ( 3.762 2.040 -3.472) 5.511 4.990 ( 9.491 6.599 -2.718) 11.875 5.033 ( 11.357 1.957 -1.682) 11.647 5.361 ( 5.656 -1.548 -4.420) 7.343 5.473 ( 2.059 -10.110 0.424) 10.327 5.492 ( 2.093 5.076 4.740) 7.254 5.587 ( 4.833 -4.029 8.108) 10.264 5.981 ( 6.690 1.740 -0.268) 6.918 6.014 ( -0.399 -1.263 -0.128) 1.330 6.204 ( 0.312 4.607 -0.207) 4.622 6.348 ( 6.228 -8.926 1.448) 10.980 6.721 ( 1.614 2.547 -2.990) 4.247 6.757 ( -4.852 4.931 -3.331) 7.678 6.882 ( 1.788 -2.067 7.335) 7.828 7.011 ( -4.725 -10.374 3.031) 11.795 7.451 ( -1.619 5.765 -0.015) 5.988 7.557 ( -0.677 -4.123 -1.008) 4.298 7.673 ( 0.111 7.006 -4.797) 8.491 7.805 ( 2.295 -4.135 -4.943) 6.841 8.094 ( -6.095 1.048 -4.447) 7.617 8.117 ( -5.451 -2.362 -2.448) 6.425 9.213 ( 6.316 3.905 3.766) 8.326 9.294 ( 6.014 -4.211 3.475) 8.123 9.672 ( 6.239 4.221 0.475) 7.548 9.767 ( 4.259 -5.084 0.796) 6.680 9.999 ( -0.120 2.160 4.068) 4.608 10.034 ( 1.801 -1.514 4.378) 4.970 11.327 ( -3.515 2.766 -0.730) 4.532 11.381 ( -2.039 -2.956 0.661) 3.651 11.570 ( -2.301 2.582 -2.216) 4.108 11.596 ( -2.910 0.205 -2.132) 3.614 11.847 ( -2.699 1.136 -2.016) 3.555 11.880 ( -3.398 -1.416 -5.153) 6.332 12.115 ( -4.134 3.148 -1.031) 5.297 12.202 ( -2.079 -5.373 -2.873) 6.437 12.681 ( -10.033 3.521 -1.687) 10.766 12.714 ( -9.845 0.177 -2.580) 10.179 16.085 ( 1.406 1.013 0.954) 1.978 16.100 ( 1.186 -0.433 1.026) 1.627 17.188 ( -0.602 4.263 -8.876) 9.865 17.223 ( -1.875 0.122 -5.615) 5.921 17.500 ( -6.371 4.225 -0.367) 7.653 17.678 ( -8.571 -12.818 1.729) 15.516 18.833 ( 13.504 13.729 8.719) 21.139 19.079 ( 13.743 -11.049 5.946) 18.609 ======================= Grid point 252 (140/170) ======================= q-point: (-0.09 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.099 ( 3.054 9.383 -3.141) 10.355 2.205 ( 0.822 -0.207 -9.264) 9.303 2.283 ( 0.901 11.056 5.502) 12.382 2.445 ( -0.569 -3.663 1.361) 3.949 2.557 ( 0.419 3.467 2.077) 4.063 2.619 ( 0.009 -3.281 4.045) 5.208 2.876 ( -9.160 1.659 0.202) 9.311 2.985 ( -5.705 -10.174 -0.211) 11.666 3.157 ( -0.182 -1.168 -4.130) 4.296 3.244 ( 0.521 -8.721 -6.814) 11.079 3.917 ( -1.041 8.385 6.029) 10.380 3.987 ( 0.748 0.537 6.055) 6.124 4.472 ( -2.557 4.775 6.682) 8.602 4.608 ( -2.112 -7.853 5.564) 9.853 4.805 ( 1.566 9.361 -0.443) 9.502 4.896 ( 2.035 0.328 5.253) 5.643 5.080 ( 0.406 10.175 2.978) 10.610 5.211 ( 9.657 -0.567 -1.900) 9.858 5.409 ( 5.184 0.407 -5.379) 7.482 5.470 ( 1.897 3.430 -0.811) 4.003 5.545 ( 3.292 -7.962 -1.577) 8.758 5.607 ( -8.079 -6.941 0.477) 10.662 6.120 ( 6.897 2.347 6.705) 9.901 6.155 ( 7.728 -0.049 5.931) 9.741 6.298 ( 6.175 8.142 4.212) 11.053 6.473 ( 3.449 -7.881 1.089) 8.671 6.641 ( -4.947 3.606 0.146) 6.123 6.673 ( 1.066 1.490 -4.106) 4.496 6.990 ( 0.086 -0.985 6.630) 6.703 7.040 ( 1.159 -6.204 5.260) 8.215 7.380 ( -5.901 5.149 -1.255) 7.931 7.514 ( -2.308 -4.323 -2.323) 5.423 7.593 ( 0.519 4.755 -7.835) 9.180 7.758 ( 0.566 -5.915 -6.706) 8.960 7.939 ( -3.977 0.863 -6.176) 7.396 7.968 ( -5.852 -4.052 -5.882) 9.234 9.311 ( 1.848 2.832 0.747) 3.463 9.369 ( 0.538 -3.085 0.222) 3.139 9.730 ( 2.132 1.770 -1.516) 3.159 9.766 ( -0.833 -1.741 -1.550) 2.476 10.152 ( 5.556 4.674 9.895) 12.273 10.230 ( 7.202 -2.983 10.188) 12.828 11.279 ( -1.183 3.716 -0.702) 3.962 11.358 ( -1.040 -4.223 -0.818) 4.426 11.521 ( -1.254 1.623 -0.662) 2.155 11.542 ( -0.965 -0.421 0.002) 1.053 11.780 ( -0.937 0.653 -2.457) 2.710 11.790 ( -1.823 -0.760 -2.441) 3.140 12.052 ( -1.351 2.303 -2.268) 3.503 12.136 ( 0.287 -5.431 -5.683) 7.866 12.510 ( -7.928 3.273 -1.169) 8.656 12.543 ( -7.007 -0.092 -1.943) 7.272 16.120 ( 1.099 1.014 1.345) 2.011 16.130 ( 0.675 0.057 1.364) 1.523 17.070 ( -0.708 4.692 -8.881) 10.069 17.125 ( -1.338 -1.080 -6.091) 6.329 17.385 ( -4.472 1.910 -2.036) 5.272 17.502 ( -9.037 -9.504 -3.914) 13.686 19.155 ( 8.876 11.625 11.631) 18.687 19.361 ( 9.173 -8.876 6.787) 14.457 ======================= Grid point 297 (141/170) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 85 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.851 ( 11.333 0.000 -19.857) 22.864 1.851 ( -11.333 0.000 19.857) 22.864 1.873 ( 7.878 0.000 -21.551) 22.946 1.873 ( -7.878 0.000 21.551) 22.946 2.398 ( -2.783 0.000 0.108) 2.786 2.398 ( 2.783 0.000 -0.108) 2.786 2.893 ( 0.911 0.000 -15.058) 15.085 2.893 ( -0.911 0.000 15.058) 15.085 3.385 ( -9.240 0.000 -27.157) 28.686 3.385 ( 9.240 0.000 27.157) 28.686 3.959 ( 3.032 0.000 -2.697) 4.057 3.959 ( -3.032 0.000 2.697) 4.057 4.473 ( -3.444 0.000 -8.568) 9.234 4.473 ( 3.444 0.000 8.568) 9.234 4.858 ( -3.158 0.000 -0.488) 3.195 4.858 ( 3.158 0.000 0.488) 3.195 5.151 ( -8.778 0.000 2.842) 9.226 5.151 ( 8.778 0.000 -2.842) 9.226 5.389 ( -2.467 0.000 0.056) 2.467 5.389 ( 2.467 0.000 -0.056) 2.467 5.891 ( 3.298 0.000 -4.937) 5.937 5.891 ( -3.298 0.000 4.937) 5.937 6.175 ( -3.027 0.000 -9.322) 9.801 6.175 ( 3.027 0.000 9.322) 9.801 6.388 ( 0.777 0.000 -8.824) 8.858 6.388 ( -0.777 0.000 8.824) 8.858 6.595 ( 4.179 0.000 -8.122) 9.135 6.595 ( -4.179 0.000 8.122) 9.135 7.259 ( -12.794 0.000 -3.342) 13.223 7.259 ( 12.794 0.000 3.342) 13.223 7.390 ( -1.859 0.000 0.574) 1.946 7.390 ( 1.859 0.000 -0.574) 1.946 7.435 ( 2.662 0.000 -12.146) 12.434 7.435 ( -2.662 0.000 12.146) 12.434 8.032 ( -1.591 0.000 -3.524) 3.867 8.032 ( 1.591 0.000 3.524) 3.867 9.334 ( 0.036 0.000 -3.977) 3.977 9.334 ( -0.036 0.000 3.977) 3.977 9.873 ( -1.773 0.000 -2.606) 3.152 9.873 ( 1.773 0.000 2.606) 3.152 9.893 ( -3.778 0.000 -1.946) 4.250 9.893 ( 3.778 0.000 1.946) 4.250 11.515 ( 1.958 0.000 -6.296) 6.593 11.515 ( -1.958 0.000 6.296) 6.593 11.589 ( 5.741 0.000 -5.304) 7.816 11.589 ( -5.741 0.000 5.304) 7.816 11.780 ( -3.101 0.000 -3.563) 4.723 11.780 ( 3.101 0.000 3.563) 4.723 12.022 ( 2.429 0.000 -2.346) 3.377 12.022 ( -2.429 0.000 2.346) 3.377 12.481 ( 2.613 0.000 -14.257) 14.494 12.481 ( -2.613 0.000 14.257) 14.494 16.065 ( -0.317 0.000 -0.287) 0.427 16.065 ( 0.317 0.000 0.287) 0.427 17.022 ( 1.858 0.000 -1.295) 2.265 17.022 ( -1.858 0.000 1.295) 2.265 17.649 ( -13.280 0.000 1.719) 13.391 17.649 ( 13.280 0.000 -1.719) 13.391 19.155 ( 10.374 0.000 -16.630) 19.601 19.155 ( -10.374 0.000 16.630) 19.601 ======================= Grid point 299 (142/170) ======================= q-point: ( 0.09 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.731 ( 9.348 0.000 -24.298) 26.034 1.776 ( 5.502 0.000 -17.890) 18.717 1.915 ( -4.318 0.000 12.229) 12.968 1.998 ( 2.880 0.000 6.081) 6.729 2.411 ( 0.433 0.000 3.608) 3.634 2.516 ( 5.270 0.000 7.794) 9.408 2.653 ( 4.810 0.000 -33.930) 34.270 3.034 ( -2.800 0.000 12.842) 13.144 3.041 ( -1.267 0.000 -5.949) 6.082 3.570 ( -5.795 0.000 2.013) 6.134 3.983 ( -5.452 0.000 6.338) 8.361 4.174 ( 6.098 0.000 22.397) 23.212 4.354 ( 1.275 0.000 -6.291) 6.419 4.648 ( 2.967 0.000 9.748) 10.189 4.776 ( -3.486 0.000 -3.458) 4.910 4.880 ( -0.278 0.000 -1.494) 1.519 5.064 ( -4.170 0.000 2.382) 4.802 5.253 ( 3.487 0.000 -0.978) 3.621 5.295 ( -9.636 0.000 -0.123) 9.637 5.389 ( 0.006 0.000 -2.080) 2.080 5.809 ( -0.816 0.000 -11.770) 11.798 5.855 ( 0.815 0.000 -7.573) 7.617 6.016 ( -5.360 0.000 1.997) 5.720 6.262 ( -2.566 0.000 -10.076) 10.398 6.304 ( 0.267 0.000 8.410) 8.414 6.460 ( -2.272 0.000 6.914) 7.278 6.555 ( 2.828 0.000 -6.855) 7.416 6.563 ( -4.761 0.000 2.316) 5.295 7.069 ( -2.958 0.000 -5.300) 6.070 7.344 ( -0.624 0.000 -2.752) 2.822 7.353 ( -2.912 0.000 -0.892) 3.046 7.429 ( 5.113 0.000 -5.986) 7.872 7.438 ( 1.969 0.000 4.499) 4.911 7.671 ( 5.274 0.000 18.462) 19.201 7.976 ( -0.712 0.000 -3.692) 3.760 8.130 ( 4.476 0.000 4.494) 6.343 9.298 ( 2.103 0.000 -5.531) 5.918 9.380 ( 0.714 0.000 2.484) 2.585 9.780 ( -3.331 0.000 -4.488) 5.589 9.865 ( 2.778 0.000 0.030) 2.779 9.900 ( -2.311 0.000 2.195) 3.188 9.992 ( 6.754 0.000 -0.547) 6.776 11.459 ( 0.576 0.000 -6.096) 6.123 11.526 ( -4.064 0.000 4.719) 6.228 11.558 ( -7.897 0.000 8.419) 11.543 11.639 ( 2.939 0.000 0.065) 2.940 11.707 ( -2.072 0.000 -0.357) 2.103 11.869 ( 2.092 0.000 2.872) 3.553 12.042 ( 3.151 0.000 -4.478) 5.475 12.047 ( 2.116 0.000 3.062) 3.721 12.335 ( 1.074 0.000 -15.082) 15.120 12.583 ( -4.010 0.000 13.323) 13.913 16.060 ( 0.613 0.000 -0.936) 1.119 16.077 ( 1.226 0.000 -0.466) 1.311 16.954 ( -5.079 0.000 -2.767) 5.784 16.995 ( -1.414 0.000 -3.336) 3.623 17.482 ( -10.569 0.000 5.765) 12.039 17.822 ( 5.381 0.000 1.115) 5.496 19.139 ( 10.592 0.000 -17.754) 20.674 19.234 ( -0.942 0.000 15.678) 15.707 ======================= Grid point 300 (143/170) ======================= q-point: ( 0.18 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.611 ( 6.997 0.000 -26.151) 27.071 1.668 ( 14.843 0.000 -20.320) 25.164 1.987 ( -3.102 0.000 11.004) 11.433 2.035 ( -6.005 0.000 5.161) 7.919 2.467 ( 11.269 0.000 -5.056) 12.351 2.616 ( 26.704 0.000 -18.464) 32.466 2.718 ( 1.734 0.000 13.106) 13.220 3.035 ( -6.537 0.000 3.274) 7.311 3.058 ( 0.628 0.000 3.021) 3.085 3.543 ( 0.726 0.000 4.481) 4.540 3.904 ( -14.877 0.000 9.669) 17.743 4.187 ( -2.866 0.000 -8.089) 8.582 4.501 ( -0.695 0.000 1.901) 2.024 4.654 ( -3.848 0.000 -4.380) 5.830 4.769 ( -3.598 0.000 11.108) 11.676 4.813 ( -3.436 0.000 -1.836) 3.896 5.000 ( -10.731 0.000 -12.205) 16.252 5.090 ( -0.982 0.000 0.358) 1.046 5.187 ( -6.244 0.000 0.105) 6.245 5.377 ( 0.564 0.000 -0.092) 0.572 5.741 ( 3.924 0.000 -0.174) 3.927 5.919 ( 14.142 0.000 0.654) 14.157 5.983 ( -5.054 0.000 -3.130) 5.945 6.169 ( 3.645 0.000 0.104) 3.647 6.230 ( -12.499 0.000 -2.906) 12.832 6.519 ( 4.725 0.000 2.873) 5.530 6.535 ( 2.335 0.000 -4.358) 4.945 6.616 ( 2.966 0.000 6.387) 7.042 7.008 ( 2.735 0.000 -6.232) 6.806 7.279 ( -5.994 0.000 0.212) 5.998 7.298 ( 0.660 0.000 -5.163) 5.205 7.453 ( 4.905 0.000 -2.794) 5.645 7.494 ( -1.021 0.000 3.981) 4.110 7.886 ( -2.241 0.000 12.883) 13.077 7.909 ( -2.326 0.000 -3.586) 4.275 8.237 ( -2.575 0.000 7.367) 7.805 9.259 ( 1.376 0.000 -6.459) 6.604 9.408 ( -0.018 0.000 1.078) 1.078 9.696 ( -1.088 0.000 -2.126) 2.389 9.848 ( -6.523 0.000 2.284) 6.911 10.002 ( 10.999 0.000 2.072) 11.193 10.092 ( 7.860 0.000 -4.099) 8.865 11.389 ( -1.575 0.000 -5.113) 5.351 11.469 ( -7.611 0.000 0.403) 7.622 11.543 ( -4.222 0.000 7.950) 9.002 11.637 ( -4.354 0.000 1.851) 4.731 11.752 ( 5.326 0.000 2.802) 6.018 11.898 ( -0.205 0.000 -0.601) 0.635 11.986 ( 1.028 0.000 -8.122) 8.186 12.155 ( 3.818 0.000 5.440) 6.646 12.236 ( 3.907 0.000 -8.095) 8.989 12.662 ( -4.444 0.000 12.321) 13.098 16.064 ( 1.405 0.000 -1.355) 1.952 16.094 ( 1.831 0.000 -1.210) 2.195 16.822 ( -4.036 0.000 -4.110) 5.760 16.917 ( -3.127 0.000 -2.600) 4.067 17.439 ( -5.778 0.000 10.057) 11.599 17.831 ( -4.494 0.000 0.671) 4.544 19.090 ( 8.796 0.000 -18.517) 20.500 19.464 ( 4.994 0.000 13.537) 14.429 ======================= Grid point 301 (144/170) ======================= q-point: ( 0.27 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.521 ( 15.322 0.000 -17.776) 23.468 1.762 ( 17.438 0.000 -10.995) 20.614 2.038 ( -2.407 0.000 8.777) 9.101 2.078 ( -2.116 0.000 12.446) 12.624 2.626 ( 8.618 0.000 -1.495) 8.747 2.723 ( -12.890 0.000 7.519) 14.923 2.956 ( 34.944 0.000 -16.672) 38.717 3.078 ( -1.225 0.000 2.028) 2.369 3.110 ( 8.765 0.000 5.231) 10.207 3.625 ( 0.629 0.000 2.955) 3.021 3.722 ( -18.829 0.000 8.880) 20.818 4.021 ( -2.334 0.000 -11.297) 11.536 4.225 ( -14.978 0.000 -15.750) 21.734 4.549 ( -5.607 0.000 -0.932) 5.684 4.686 ( -5.016 0.000 -11.107) 12.187 4.761 ( -1.058 0.000 -1.857) 2.138 4.840 ( -2.640 0.000 10.973) 11.287 5.086 ( 4.099 0.000 -7.967) 8.959 5.171 ( -0.351 0.000 3.987) 4.003 5.409 ( -1.353 0.000 5.309) 5.479 5.820 ( -4.230 0.000 -7.272) 8.413 5.868 ( -2.751 0.000 11.007) 11.345 5.978 ( -4.697 0.000 -7.619) 8.951 6.218 ( 13.643 0.000 -2.527) 13.875 6.315 ( 8.027 0.000 9.531) 12.461 6.548 ( 3.903 0.000 -0.331) 3.917 6.602 ( 0.536 0.000 3.717) 3.755 6.783 ( 7.977 0.000 5.538) 9.711 6.997 ( 3.943 0.000 -5.569) 6.823 7.147 ( -10.087 0.000 1.031) 10.140 7.243 ( 0.279 0.000 -5.786) 5.792 7.494 ( -2.522 0.000 0.916) 2.683 7.553 ( 7.711 0.000 1.395) 7.836 7.814 ( -4.122 0.000 -3.229) 5.236 7.894 ( -8.253 0.000 3.118) 8.822 8.186 ( -10.749 0.000 5.638) 12.138 9.216 ( 1.991 0.000 -4.599) 5.011 9.405 ( -1.112 0.000 0.208) 1.131 9.711 ( 1.692 0.000 3.517) 3.903 9.757 ( -6.890 0.000 2.657) 7.384 10.151 ( 6.514 0.000 -6.877) 9.473 10.187 ( 8.316 0.000 -2.800) 8.775 11.283 ( -7.716 0.000 -5.827) 9.668 11.294 ( -2.988 0.000 -3.703) 4.758 11.574 ( -5.295 0.000 2.602) 5.900 11.602 ( 0.917 0.000 6.108) 6.176 11.858 ( -1.367 0.000 -3.289) 3.562 11.913 ( 8.164 0.000 3.742) 8.981 11.985 ( 3.887 0.000 0.352) 3.903 12.235 ( 3.538 0.000 -3.730) 5.141 12.272 ( 2.184 0.000 5.314) 5.745 12.710 ( -5.649 0.000 10.062) 11.539 16.076 ( 1.964 0.000 -1.394) 2.409 16.109 ( 1.936 0.000 -1.691) 2.570 16.765 ( 0.136 0.000 0.148) 0.201 16.846 ( -2.775 0.000 -0.518) 2.823 17.504 ( -4.027 0.000 14.151) 14.713 17.734 ( -5.458 0.000 -1.327) 5.617 19.022 ( 9.409 0.000 -18.349) 20.621 19.617 ( -1.861 0.000 6.214) 6.487 ======================= Grid point 302 (145/170) ======================= q-point: ( 0.36 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.719 ( 16.214 0.000 3.363) 16.559 1.956 ( 11.663 0.000 -0.881) 11.696 2.123 ( 2.942 0.000 2.809) 4.068 2.201 ( 1.376 0.000 9.366) 9.467 2.635 ( -2.951 0.000 3.484) 4.566 2.722 ( 7.712 0.000 -1.574) 7.871 3.049 ( -5.013 0.000 1.417) 5.209 3.303 ( 2.806 0.000 7.962) 8.442 3.322 ( 22.202 0.000 -9.273) 24.061 3.498 ( -14.084 0.000 2.191) 14.254 3.522 ( -8.578 0.000 -8.794) 12.285 3.752 ( -12.132 0.000 -20.173) 23.540 3.972 ( 3.137 0.000 0.436) 3.167 4.419 ( -7.052 0.000 -1.191) 7.151 4.611 ( 3.826 0.000 -3.725) 5.340 4.759 ( 3.701 0.000 -2.572) 4.507 4.928 ( -0.408 0.000 7.635) 7.645 5.082 ( 6.319 0.000 -4.735) 7.896 5.191 ( -1.441 0.000 0.687) 1.596 5.416 ( -4.390 0.000 2.860) 5.239 5.708 ( -3.667 0.000 0.446) 3.694 5.764 ( -1.820 0.000 -5.937) 6.210 6.006 ( -2.843 0.000 6.505) 7.099 6.225 ( -1.450 0.000 -6.905) 7.056 6.645 ( 14.062 0.000 8.795) 16.586 6.650 ( -0.955 0.000 6.072) 6.147 6.661 ( 6.693 0.000 1.008) 6.768 6.981 ( 7.366 0.000 4.610) 8.689 6.997 ( -3.916 0.000 -0.203) 3.921 7.021 ( 0.866 0.000 -0.457) 0.979 7.171 ( -1.621 0.000 -4.712) 4.983 7.434 ( -3.646 0.000 -1.380) 3.899 7.655 ( -2.425 0.000 -2.108) 3.213 7.687 ( -13.059 0.000 -5.245) 14.073 7.763 ( 5.601 0.000 1.483) 5.794 8.077 ( -9.134 0.000 5.449) 10.636 9.227 ( 3.781 0.000 -2.184) 4.366 9.382 ( -2.141 0.000 0.752) 2.269 9.701 ( -3.708 0.000 4.069) 5.505 9.812 ( 1.978 0.000 7.049) 7.321 10.150 ( 3.936 0.000 -8.261) 9.151 10.171 ( 0.569 0.000 -11.560) 11.574 11.158 ( -2.814 0.000 -0.040) 2.814 11.215 ( -1.476 0.000 -3.233) 3.554 11.532 ( -3.538 0.000 3.465) 4.952 11.675 ( -0.858 0.000 2.749) 2.880 11.810 ( 2.590 0.000 -3.198) 4.115 12.031 ( 1.313 0.000 -0.079) 1.315 12.106 ( 6.381 0.000 4.478) 7.795 12.291 ( 7.358 0.000 -0.905) 7.414 12.339 ( -0.688 0.000 3.713) 3.776 12.695 ( -7.794 0.000 6.517) 10.160 16.095 ( 1.867 0.000 -1.005) 2.120 16.119 ( 1.475 0.000 -1.563) 2.149 16.806 ( 1.386 0.000 2.873) 3.190 16.818 ( -1.121 0.000 1.230) 1.664 17.598 ( -5.875 0.000 14.761) 15.887 17.642 ( -1.830 0.000 -3.145) 3.638 19.010 ( 12.897 0.000 -14.794) 19.626 19.551 ( -9.340 0.000 0.074) 9.340 ======================= Grid point 303 (146/170) ======================= q-point: ( 0.45 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.021 ( 5.572 0.000 8.013) 9.760 2.067 ( -1.197 0.000 4.702) 4.852 2.211 ( 9.217 0.000 -0.403) 9.225 2.320 ( 3.730 0.000 -1.471) 4.010 2.703 ( 8.005 0.000 -0.750) 8.040 2.853 ( -4.622 0.000 2.623) 5.315 2.976 ( 3.046 0.000 6.875) 7.520 3.236 ( -6.683 0.000 -7.234) 9.848 3.276 ( -6.508 0.000 -3.038) 7.182 3.303 ( -13.846 0.000 -5.012) 14.725 3.475 ( -0.180 0.000 2.054) 2.062 3.497 ( 7.992 0.000 -8.937) 11.989 4.102 ( 8.614 0.000 1.905) 8.822 4.274 ( -8.963 0.000 -1.254) 9.050 4.694 ( 6.666 0.000 0.905) 6.727 4.779 ( 1.166 0.000 -3.683) 3.863 5.018 ( 3.771 0.000 4.021) 5.512 5.132 ( -4.226 0.000 -2.329) 4.825 5.195 ( 7.815 0.000 1.157) 7.900 5.330 ( -6.367 0.000 -0.885) 6.429 5.697 ( -2.981 0.000 5.973) 6.676 5.718 ( 2.918 0.000 -5.622) 6.334 5.999 ( -0.360 0.000 0.825) 0.900 6.081 ( -7.100 0.000 -2.576) 7.553 6.709 ( -2.333 0.000 7.811) 8.152 6.732 ( 4.383 0.000 -5.125) 6.744 6.933 ( 8.869 0.000 2.356) 9.176 7.012 ( 3.905 0.000 6.275) 7.391 7.057 ( -4.335 0.000 -1.274) 4.518 7.096 ( 6.894 0.000 2.609) 7.372 7.099 ( -0.470 0.000 -1.392) 1.469 7.336 ( -10.259 0.000 -4.301) 11.124 7.451 ( -0.452 0.000 -2.612) 2.651 7.536 ( -5.778 0.000 -2.738) 6.394 7.900 ( 7.670 0.000 -0.836) 7.715 7.996 ( -7.690 0.000 4.262) 8.792 9.282 ( 4.662 0.000 -1.104) 4.791 9.344 ( -3.903 0.000 1.172) 4.075 9.749 ( 1.255 0.000 7.881) 7.980 9.874 ( -1.698 0.000 -2.572) 3.082 10.045 ( -0.443 0.000 -2.099) 2.145 10.096 ( 1.198 0.000 -7.954) 8.044 11.150 ( -1.304 0.000 2.955) 3.229 11.170 ( 0.452 0.000 -3.155) 3.187 11.546 ( -0.102 0.000 4.353) 4.354 11.620 ( -2.664 0.000 -3.601) 4.479 11.889 ( 5.903 0.000 0.961) 5.981 11.991 ( -4.346 0.000 -0.886) 4.435 12.249 ( 6.179 0.000 1.171) 6.288 12.332 ( -3.747 0.000 1.461) 4.022 12.444 ( 10.137 0.000 -0.094) 10.138 12.600 ( -9.710 0.000 2.689) 10.076 16.113 ( 0.938 0.000 -0.198) 0.959 16.121 ( 0.396 0.000 -0.813) 0.905 16.830 ( 0.477 0.000 1.294) 1.379 16.843 ( -0.130 0.000 0.978) 0.987 17.612 ( 3.962 0.000 -5.156) 6.503 17.629 ( -7.266 0.000 9.915) 12.292 19.126 ( 15.578 0.000 -6.843) 17.015 19.345 ( -14.135 0.000 0.347) 14.139 ======================= Grid point 309 (147/170) ======================= q-point: ( 0.00 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 153 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.782 ( 6.393 1.180 -17.802) 18.952 1.782 ( -6.393 1.180 17.802) 18.952 2.106 ( 6.059 12.991 -18.489) 23.395 2.106 ( -6.059 12.991 18.489) 23.395 2.432 ( 0.030 3.526 -2.091) 4.100 2.432 ( -0.030 3.526 2.091) 4.100 2.908 ( 2.219 1.201 -10.935) 11.222 2.908 ( -2.219 1.201 10.935) 11.222 3.438 ( -6.784 5.802 -22.918) 24.595 3.438 ( 6.784 5.802 22.918) 24.595 3.833 ( -0.001 -11.891 -4.304) 12.646 3.833 ( 0.001 -11.891 4.304) 12.646 4.403 ( -3.706 -3.495 -8.035) 9.514 4.403 ( 3.706 -3.495 8.035) 9.514 4.888 ( 0.846 2.117 -1.474) 2.715 4.888 ( -0.846 2.117 1.474) 2.715 5.191 ( 10.598 1.227 -7.867) 13.256 5.191 ( -10.598 1.227 7.867) 13.256 5.506 ( -0.550 10.436 -4.658) 11.442 5.506 ( 0.550 10.436 4.658) 11.442 5.794 ( -2.320 -8.422 -7.635) 11.602 5.794 ( 2.320 -8.422 7.635) 11.602 6.039 ( -0.299 -9.226 -13.004) 15.947 6.039 ( 0.299 -9.226 13.004) 15.947 6.424 ( 3.267 2.466 -7.470) 8.517 6.424 ( -3.267 2.466 7.470) 8.517 6.636 ( 0.879 1.915 -5.953) 6.315 6.636 ( -0.879 1.915 5.953) 6.315 7.207 ( -7.925 -3.846 -5.153) 10.206 7.207 ( 7.925 -3.846 5.153) 10.206 7.345 ( -1.384 -0.944 -2.953) 3.395 7.345 ( 1.384 -0.944 2.953) 3.395 7.499 ( -0.100 3.524 -4.274) 5.540 7.499 ( 0.100 3.524 4.274) 5.540 8.092 ( 2.148 2.958 -2.141) 4.236 8.092 ( -2.148 2.958 2.141) 4.236 9.358 ( -1.684 2.125 -4.037) 4.863 9.358 ( 1.684 2.125 4.037) 4.863 9.821 ( 0.345 -3.183 -2.125) 3.843 9.821 ( -0.345 -3.183 2.125) 3.843 9.970 ( 0.960 6.100 -1.284) 6.307 9.970 ( -0.960 6.100 1.284) 6.307 11.434 ( 1.816 -5.934 -6.623) 9.076 11.434 ( -1.816 -5.934 6.623) 9.076 11.584 ( 3.950 -0.570 -3.037) 5.014 11.584 ( -3.950 -0.570 3.037) 5.014 11.849 ( -4.091 4.080 -4.289) 7.196 11.849 ( 4.091 4.080 4.289) 7.196 12.017 ( -5.503 0.253 -1.467) 5.701 12.017 ( 5.503 0.253 1.467) 5.701 12.430 ( 1.827 -4.522 -13.347) 14.210 12.430 ( -1.827 -4.522 13.347) 14.210 16.075 ( -0.503 1.033 -0.250) 1.176 16.075 ( 0.503 1.033 0.250) 1.176 17.011 ( -1.687 -1.094 -3.467) 4.007 17.011 ( 1.687 -1.094 3.467) 4.007 17.612 ( -12.880 -3.677 0.419) 13.401 17.612 ( 12.880 -3.677 -0.419) 13.401 19.210 ( 7.168 5.173 -16.660) 18.860 19.210 ( -7.168 5.173 16.660) 18.860 ======================= Grid point 311 (148/170) ======================= q-point: ( 0.09 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.698 ( 11.583 0.797 -22.295) 25.137 1.871 ( -1.184 5.064 -1.528) 5.421 1.923 ( -0.099 5.810 -6.898) 9.020 2.182 ( -1.460 11.029 3.277) 11.598 2.476 ( 1.564 5.474 1.549) 5.900 2.517 ( 5.491 1.116 8.090) 9.841 2.821 ( 5.756 15.599 -21.517) 27.193 2.967 ( -4.161 -2.970 5.970) 7.860 3.135 ( -0.417 6.502 -2.361) 6.930 3.537 ( -6.253 -3.877 2.108) 7.653 3.851 ( -1.981 -12.441 5.105) 13.593 4.089 ( 6.836 -7.956 14.251) 17.695 4.305 ( 1.378 -2.127 -1.744) 3.076 4.556 ( -0.044 -5.077 9.932) 11.155 4.800 ( -4.808 2.065 -2.658) 5.869 4.895 ( -1.556 1.289 -0.263) 2.037 5.121 ( -6.165 2.376 6.401) 9.199 5.239 ( 5.059 -4.104 -12.300) 13.919 5.362 ( -8.774 4.774 -1.809) 10.151 5.468 ( -9.090 5.159 -0.231) 10.455 5.718 ( 2.372 -1.354 -3.467) 4.414 5.873 ( 3.068 -0.609 -6.989) 7.657 5.932 ( 2.565 -5.602 1.484) 6.337 6.147 ( 1.968 -6.652 -1.664) 7.134 6.395 ( 0.960 4.088 -2.009) 4.655 6.450 ( -3.569 -0.716 4.259) 5.603 6.556 ( -1.569 1.342 -2.710) 3.407 6.625 ( -3.093 2.418 0.033) 3.926 7.059 ( -1.885 -0.419 -3.453) 3.956 7.268 ( -2.802 -2.269 -2.018) 4.132 7.338 ( 1.128 -5.413 1.228) 5.664 7.433 ( 0.696 1.743 1.502) 2.404 7.516 ( 7.351 5.167 -1.370) 9.089 7.593 ( 4.768 -2.166 5.550) 7.631 8.089 ( -3.978 6.163 5.492) 9.164 8.120 ( 0.273 -2.659 2.763) 3.844 9.295 ( 0.170 0.104 -4.588) 4.592 9.454 ( 4.148 5.494 2.274) 7.250 9.765 ( -2.811 -1.787 -3.496) 4.829 9.833 ( 0.874 -1.673 1.025) 2.148 9.956 ( -2.025 3.365 0.453) 3.953 10.013 ( 4.716 3.923 0.164) 6.136 11.381 ( 0.144 -5.696 -3.717) 6.802 11.482 ( -2.987 -3.993 5.212) 7.213 11.533 ( -6.252 -1.886 2.935) 7.159 11.631 ( 4.539 -1.453 0.311) 4.776 11.757 ( -3.283 4.420 -0.019) 5.506 11.889 ( -4.529 -2.239 -2.758) 5.756 11.986 ( 4.415 1.179 3.838) 5.968 12.129 ( 6.160 4.429 -1.128) 7.670 12.300 ( 1.667 -2.647 -12.451) 12.838 12.543 ( -2.437 -3.749 12.338) 13.123 16.066 ( 0.225 0.643 -0.876) 1.110 16.089 ( 1.195 1.060 -0.530) 1.683 16.905 ( -4.159 -2.229 -4.180) 6.304 17.052 ( 0.074 2.649 -0.214) 2.659 17.449 ( -8.939 -2.802 4.463) 10.377 17.826 ( 8.959 -0.560 2.246) 9.253 19.105 ( 3.229 -1.203 -14.054) 14.470 19.313 ( -0.892 5.658 11.180) 12.562 ======================= Grid point 312 (149/170) ======================= q-point: ( 0.18 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.651 ( 10.206 2.550 -24.526) 26.687 1.689 ( 10.336 4.546 -19.719) 22.723 2.000 ( -1.318 3.583 10.334) 11.017 2.171 ( -5.264 9.752 4.468) 11.949 2.520 ( 4.708 2.852 -2.019) 5.864 2.693 ( 5.222 4.952 2.876) 7.750 2.819 ( 21.406 12.358 -10.354) 26.798 2.991 ( -2.610 -2.065 4.833) 5.868 3.135 ( -3.225 6.402 3.073) 7.799 3.518 ( 0.660 -3.059 4.679) 5.629 3.848 ( -7.010 -6.179 6.947) 11.644 4.126 ( -1.945 -4.304 -5.521) 7.266 4.375 ( -2.379 -10.337 0.485) 10.619 4.602 ( -5.305 -5.162 5.350) 9.133 4.693 ( -4.353 -2.097 -0.862) 4.908 4.851 ( -5.130 1.668 0.343) 5.405 4.958 ( -11.138 -5.013 -11.102) 16.506 5.126 ( -1.668 3.580 -1.014) 4.078 5.257 ( -1.726 4.997 -1.671) 5.544 5.390 ( 1.331 -1.120 0.450) 1.797 5.748 ( 0.370 3.663 4.728) 5.992 5.933 ( 5.768 -1.725 -4.702) 7.639 5.967 ( -0.393 0.397 0.111) 0.570 6.124 ( 4.617 -2.831 -1.377) 5.588 6.306 ( -7.409 1.379 -3.476) 8.300 6.427 ( 3.372 -2.002 -4.475) 5.950 6.583 ( 2.811 3.164 3.544) 5.520 6.645 ( 2.490 0.417 3.817) 4.577 7.029 ( 2.268 1.792 -3.701) 4.696 7.182 ( -4.655 -3.783 -2.378) 6.453 7.361 ( 0.414 -1.638 1.465) 2.236 7.433 ( -0.102 3.039 -1.415) 3.353 7.612 ( 4.210 8.677 1.903) 9.831 7.731 ( 2.870 -6.052 3.277) 7.457 8.054 ( -9.469 1.923 6.272) 11.520 8.147 ( -1.887 -5.055 3.742) 6.566 9.242 ( 0.569 -1.066 -5.838) 5.962 9.497 ( -1.685 6.299 -0.231) 6.524 9.679 ( -1.471 -1.759 -1.752) 2.886 9.849 ( -5.263 0.212 1.770) 5.557 9.979 ( 7.264 -1.872 0.169) 7.503 10.117 ( 7.615 2.445 -0.763) 8.034 11.301 ( -3.607 -6.514 -6.758) 10.056 11.475 ( -4.327 -0.471 1.997) 4.789 11.477 ( -2.389 -3.420 5.556) 6.948 11.679 ( -3.484 -1.092 -0.374) 3.671 11.768 ( 4.011 4.245 3.638) 6.880 11.826 ( 1.302 -3.751 0.138) 3.973 12.034 ( 1.446 1.039 -5.442) 5.726 12.202 ( 3.813 4.141 1.887) 5.937 12.268 ( 4.899 4.015 -3.303) 7.144 12.637 ( -2.777 -2.333 11.163) 11.737 16.064 ( 1.047 0.090 -1.320) 1.687 16.102 ( 1.522 0.703 -1.199) 2.061 16.809 ( -1.861 0.503 -2.087) 2.842 17.015 ( -2.684 6.774 -1.535) 7.446 17.415 ( -4.318 -1.605 8.412) 9.590 17.910 ( -2.056 6.604 1.874) 7.166 19.000 ( 6.194 -8.012 -17.333) 20.075 19.443 ( 0.598 -2.072 10.179) 10.405 ======================= Grid point 313 (150/170) ======================= q-point: ( 0.27 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.586 ( 14.279 6.493 -15.030) 21.724 1.761 ( 15.168 0.344 -10.441) 18.417 2.100 ( -1.023 5.674 8.992) 10.681 2.153 ( -3.359 7.877 8.410) 12.003 2.602 ( 6.166 -2.046 -2.091) 6.825 2.706 ( -6.896 -1.026 1.551) 7.142 3.070 ( 12.215 4.734 -3.435) 13.544 3.099 ( 10.706 2.425 2.086) 11.174 3.196 ( 11.443 11.779 2.363) 16.591 3.568 ( -2.317 -5.195 1.606) 5.911 3.775 ( -10.669 4.438 5.777) 12.919 4.001 ( -2.521 -0.405 -6.421) 6.910 4.151 ( -13.063 -7.384 -14.770) 21.055 4.493 ( -5.427 -4.227 -4.132) 8.025 4.638 ( -2.057 -6.015 -0.448) 6.373 4.730 ( -2.447 -4.634 3.363) 6.227 4.816 ( -3.673 1.020 -1.397) 4.060 5.098 ( 1.507 3.393 -3.345) 4.998 5.234 ( 1.760 3.742 -3.506) 5.422 5.432 ( -1.943 -0.045 4.808) 5.186 5.792 ( -4.685 -2.805 -5.568) 7.798 5.814 ( -6.566 -3.790 3.071) 8.180 5.953 ( 0.292 -0.210 -0.627) 0.723 6.269 ( 8.366 1.343 0.846) 8.515 6.337 ( 7.353 -1.215 5.878) 9.491 6.428 ( 4.304 -5.827 -2.674) 7.722 6.661 ( 2.588 3.965 0.852) 4.811 6.774 ( 5.515 -0.726 6.031) 8.205 7.024 ( -1.996 -1.247 -1.323) 2.699 7.066 ( -2.793 0.234 -2.188) 3.556 7.365 ( -0.862 5.988 -1.880) 6.335 7.414 ( -0.623 -1.605 0.022) 1.721 7.717 ( 1.646 7.173 1.497) 7.510 7.743 ( 0.241 -0.098 0.565) 0.622 7.900 ( -13.617 -5.979 1.820) 14.982 8.144 ( -3.321 0.095 3.474) 4.807 9.190 ( 1.352 -2.250 -4.966) 5.617 9.427 ( -3.654 1.315 -1.390) 4.125 9.683 ( -0.428 -3.483 2.447) 4.278 9.766 ( -4.423 1.320 1.513) 4.858 10.080 ( 5.974 -3.769 -3.968) 8.102 10.217 ( 5.710 -0.191 -4.542) 7.299 11.168 ( -2.853 -3.902 -3.452) 5.939 11.396 ( -4.366 3.685 -2.084) 6.082 11.540 ( 0.672 -1.428 4.275) 4.558 11.604 ( -3.514 -2.020 1.609) 4.361 11.829 ( 1.258 2.313 -0.205) 2.640 11.962 ( 6.151 0.937 6.727) 9.163 12.009 ( 4.018 0.438 -3.535) 5.369 12.272 ( 3.146 4.974 -0.882) 5.951 12.340 ( 3.063 5.908 3.447) 7.495 12.700 ( -3.988 -0.768 8.954) 9.832 16.071 ( 1.672 -0.455 -1.385) 2.218 16.111 ( 1.476 0.132 -1.591) 2.174 16.804 ( 0.946 3.937 1.987) 4.510 16.948 ( -2.999 8.685 -0.753) 9.219 17.480 ( -2.898 -1.584 12.039) 12.484 17.832 ( -6.650 9.005 -0.651) 11.213 18.920 ( 8.830 -10.113 -17.435) 22.005 19.517 ( -3.060 -9.197 4.470) 10.674 ======================= Grid point 314 (151/170) ======================= q-point: ( 0.36 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.782 ( 15.095 6.092 3.635) 16.678 1.911 ( 10.230 -2.779 -2.349) 10.858 2.149 ( -0.430 2.913 2.438) 3.823 2.265 ( 2.207 5.739 8.460) 10.458 2.636 ( -0.283 0.975 2.391) 2.597 2.697 ( 9.508 -2.871 -3.213) 10.439 3.105 ( -4.822 3.428 4.463) 7.411 3.337 ( 6.637 3.397 4.511) 8.715 3.411 ( -1.477 3.886 -0.140) 4.159 3.447 ( -1.442 -1.074 -6.278) 6.530 3.633 ( -3.483 12.035 -4.465) 13.301 3.722 ( -11.918 -3.185 -16.872) 20.901 3.967 ( 3.296 0.160 -0.608) 3.356 4.369 ( -5.986 -4.362 -1.132) 7.492 4.641 ( 5.456 2.284 -4.651) 7.525 4.749 ( 1.910 -2.265 -1.542) 3.340 4.830 ( -0.503 -8.932 10.733) 13.973 5.099 ( 4.541 3.573 -4.156) 7.118 5.211 ( 0.485 0.710 -4.530) 4.611 5.426 ( -4.227 -0.012 3.009) 5.188 5.638 ( -2.898 -6.548 -6.313) 9.546 5.696 ( -4.672 -5.271 -1.452) 7.192 6.021 ( -1.681 1.232 6.795) 7.108 6.272 ( -2.003 3.620 -4.306) 5.971 6.524 ( 3.227 -9.001 3.557) 10.202 6.604 ( 8.956 -4.109 9.274) 13.531 6.674 ( 1.753 -3.812 -3.472) 5.446 6.941 ( -2.963 1.011 2.871) 4.247 6.954 ( 6.271 -1.587 6.374) 9.081 7.084 ( 4.160 3.977 -1.730) 6.009 7.303 ( -2.077 7.817 -4.067) 9.053 7.383 ( -2.882 -2.044 -0.806) 3.624 7.566 ( -11.337 -8.558 -2.088) 14.357 7.686 ( -9.378 0.078 -3.905) 10.158 7.885 ( 7.142 10.355 2.805) 12.888 8.119 ( -4.313 3.597 3.479) 6.606 9.183 ( 3.136 -3.897 -2.675) 5.673 9.362 ( -3.372 -2.345 -0.078) 4.108 9.672 ( -2.506 -3.757 3.105) 5.481 9.788 ( 1.305 -1.468 3.555) 4.062 10.096 ( 2.798 -2.256 -5.503) 6.573 10.175 ( 0.840 -1.975 -10.114) 10.339 11.144 ( -0.017 1.389 2.091) 2.511 11.299 ( -3.035 5.423 -3.129) 6.958 11.537 ( -2.468 0.484 2.332) 3.429 11.634 ( -0.111 -2.660 2.331) 3.539 11.840 ( 2.924 3.364 -1.189) 4.613 12.054 ( 1.462 0.861 0.081) 1.699 12.137 ( 6.681 1.102 3.759) 7.745 12.320 ( 3.688 4.431 -0.107) 5.765 12.425 ( 1.761 7.432 4.040) 8.641 12.702 ( -5.871 1.279 5.483) 8.134 16.086 ( 1.709 -0.872 -1.014) 2.170 16.115 ( 1.045 -0.448 -1.426) 1.823 16.856 ( 0.698 5.085 2.883) 5.887 16.918 ( -0.717 8.764 1.445) 8.911 17.567 ( -3.783 -1.686 11.264) 12.001 17.712 ( -5.013 5.737 -1.733) 7.814 18.914 ( 12.565 -9.362 -13.583) 20.737 19.437 ( -8.758 -10.739 -0.340) 13.861 ======================= Grid point 315 (152/170) ======================= q-point: ( 0.45 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.019 ( 3.780 -1.697 2.942) 5.082 2.071 ( 0.519 2.369 5.994) 6.466 2.176 ( 9.019 -0.810 2.134) 9.304 2.348 ( -0.774 3.014 -1.366) 3.399 2.742 ( 13.262 2.762 -3.636) 14.026 2.900 ( 6.090 0.553 11.117) 12.688 2.988 ( -10.508 2.384 -0.669) 10.796 3.187 ( -5.354 -3.336 -9.688) 11.561 3.309 ( -11.370 0.451 -0.558) 11.393 3.321 ( -6.477 3.207 -2.741) 7.730 3.553 ( 1.716 8.490 2.535) 9.025 3.612 ( 3.834 11.179 -8.181) 14.373 4.078 ( 8.175 -2.168 1.453) 8.581 4.239 ( -8.332 -3.177 -1.148) 8.991 4.715 ( 5.703 1.815 0.540) 6.009 4.776 ( 2.031 -0.400 -2.845) 3.519 4.968 ( 2.858 -6.959 8.400) 11.276 5.103 ( -3.579 -3.326 -3.402) 5.954 5.206 ( 8.994 2.583 -3.598) 10.026 5.341 ( -7.347 1.757 -0.420) 7.566 5.594 ( 1.190 -9.306 -0.205) 9.384 5.628 ( -2.272 -7.736 -0.645) 8.089 6.048 ( 1.353 3.905 1.295) 4.331 6.146 ( -7.810 5.993 -1.227) 9.921 6.584 ( -1.414 -10.895 4.799) 11.989 6.609 ( 1.374 -11.019 -4.768) 12.084 6.883 ( 5.733 -4.350 9.912) 12.248 6.978 ( 4.134 1.909 -2.870) 5.383 7.121 ( 3.263 3.336 1.907) 5.041 7.133 ( 4.676 -1.265 3.116) 5.760 7.198 ( -4.459 4.005 -3.028) 6.715 7.295 ( -6.246 -4.693 -3.328) 8.492 7.413 ( -1.936 -0.179 0.614) 2.039 7.498 ( -6.388 2.752 -4.370) 8.214 8.012 ( 5.944 8.404 -0.447) 10.304 8.080 ( -4.938 6.183 2.978) 8.455 9.228 ( 4.369 -4.970 -0.853) 6.672 9.299 ( -4.372 -4.522 0.250) 6.295 9.718 ( 1.494 -3.686 5.867) 7.088 9.810 ( -1.187 -5.234 -2.558) 5.945 10.060 ( -0.162 1.322 -1.520) 2.021 10.087 ( 0.701 -0.697 -5.925) 6.007 11.182 ( 0.191 3.623 3.354) 4.940 11.228 ( -1.030 4.861 -3.282) 5.954 11.551 ( 0.114 0.675 3.458) 3.525 11.608 ( -1.850 -0.305 -2.441) 3.078 11.921 ( 5.447 2.964 1.394) 6.356 12.021 ( -3.774 2.431 -1.384) 4.697 12.278 ( 6.040 0.973 1.309) 6.256 12.351 ( -1.605 1.480 0.505) 2.241 12.518 ( 5.551 7.889 1.841) 9.821 12.632 ( -7.031 4.266 1.565) 8.371 16.102 ( 0.997 -1.013 -0.242) 1.442 16.112 ( 0.126 -0.859 -0.706) 1.119 16.895 ( 0.956 6.064 2.045) 6.471 16.925 ( -0.801 7.545 0.196) 7.590 17.607 ( -0.661 -0.470 3.113) 3.217 17.640 ( -3.088 1.071 0.626) 3.328 19.034 ( 14.835 -8.878 -6.089) 18.330 19.243 ( -13.192 -9.752 0.165) 16.406 ======================= Grid point 321 (153/170) ======================= q-point: ( 0.00 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 153 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.875 ( 1.527 6.950 -11.261) 13.321 1.875 ( -1.527 6.950 11.261) 13.321 2.306 ( 0.972 7.243 -12.147) 14.176 2.306 ( -0.972 7.243 12.147) 14.176 2.523 ( -2.225 4.664 -8.996) 10.375 2.523 ( 2.225 4.664 8.996) 10.375 2.922 ( -2.195 -0.194 -7.130) 7.463 2.922 ( 2.195 -0.194 7.130) 7.463 3.437 ( -1.613 -13.414 -0.953) 13.544 3.437 ( 1.613 -13.414 0.953) 13.544 3.757 ( -6.450 12.995 -17.348) 22.614 3.757 ( 6.450 12.995 17.348) 22.614 4.384 ( -4.023 1.419 -4.407) 6.134 4.384 ( 4.023 1.419 4.407) 6.134 4.930 ( 3.497 2.235 -3.547) 5.459 4.930 ( -3.497 2.235 3.547) 5.459 5.168 ( 8.576 -3.377 -9.901) 13.526 5.168 ( -8.576 -3.377 9.901) 13.526 5.553 ( -10.677 -5.810 -2.007) 12.320 5.553 ( 10.677 -5.810 2.007) 12.320 5.719 ( -4.856 -2.511 -6.179) 8.250 5.719 ( 4.856 -2.511 6.179) 8.250 5.964 ( 0.516 5.832 -7.602) 9.595 5.964 ( -0.516 5.832 7.602) 9.595 6.478 ( 3.622 2.778 -6.313) 7.790 6.478 ( -3.622 2.778 6.313) 7.790 6.646 ( -3.023 -0.035 -4.208) 5.181 6.646 ( 3.023 -0.035 4.208) 5.181 7.143 ( -3.225 -2.426 -5.316) 6.674 7.143 ( 3.225 -2.426 5.316) 6.674 7.340 ( -2.171 -0.677 -2.388) 3.297 7.340 ( 2.171 -0.677 2.388) 3.297 7.581 ( -1.797 4.946 -2.264) 5.729 7.581 ( 1.797 4.946 2.264) 5.729 8.055 ( -1.216 -7.262 -4.020) 8.389 8.055 ( 1.216 -7.262 4.020) 8.389 9.391 ( -3.525 0.403 -3.529) 5.004 9.391 ( 3.525 0.403 3.529) 5.004 9.761 ( -1.006 -2.460 -1.393) 3.001 9.761 ( 1.006 -2.460 1.393) 3.001 10.133 ( 1.224 9.928 -4.731) 11.065 10.133 ( -1.224 9.928 4.731) 11.065 11.331 ( 2.148 -4.074 -6.440) 7.917 11.331 ( -2.148 -4.074 6.440) 7.917 11.573 ( 0.143 -0.252 -1.049) 1.089 11.573 ( -0.143 -0.252 1.049) 1.089 11.858 ( -0.258 -2.621 -3.112) 4.077 11.858 ( 0.258 -2.621 3.112) 4.077 12.060 ( -5.812 2.499 -0.986) 6.403 12.060 ( 5.812 2.499 0.986) 6.403 12.345 ( 0.486 -2.679 -9.503) 9.885 12.345 ( -0.486 -2.679 9.503) 9.885 16.104 ( -0.747 1.731 -0.167) 1.893 16.104 ( 0.747 1.731 0.167) 1.893 16.982 ( -2.094 -1.709 -5.184) 5.846 16.982 ( 2.094 -1.709 5.184) 5.846 17.514 ( -11.281 -5.820 -0.705) 12.714 17.514 ( 11.281 -5.820 0.705) 12.714 19.333 ( 2.708 6.530 -14.859) 16.455 19.333 ( -2.708 6.530 14.859) 16.455 ======================= Grid point 323 (154/170) ======================= q-point: ( 0.09 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.784 ( 6.184 7.120 -15.320) 17.990 1.987 ( 1.578 6.107 7.660) 9.922 2.079 ( -1.703 9.099 -20.452) 22.450 2.333 ( -3.173 4.674 1.002) 5.738 2.528 ( 4.013 2.140 2.038) 4.984 2.642 ( 5.742 7.212 1.212) 9.298 2.890 ( -2.572 -3.653 7.381) 8.628 3.103 ( 4.372 5.882 9.588) 12.068 3.363 ( -4.584 13.337 -11.977) 18.502 3.400 ( -3.840 -9.463 2.868) 10.607 3.576 ( 3.475 -9.042 -1.186) 9.760 3.984 ( 4.140 0.484 2.342) 4.781 4.317 ( -1.171 3.288 0.966) 3.621 4.499 ( -1.070 -0.940 8.511) 8.630 4.857 ( -5.428 3.839 -2.426) 7.078 4.916 ( -0.973 0.570 -1.982) 2.280 5.100 ( -5.372 -5.120 -5.854) 9.452 5.151 ( -1.217 -3.054 0.120) 3.290 5.341 ( -12.085 -4.373 3.182) 13.239 5.514 ( -1.165 1.148 -9.418) 9.559 5.742 ( 1.146 -4.252 4.366) 6.201 5.868 ( 1.247 1.570 6.132) 6.451 5.935 ( 9.336 3.899 -7.621) 12.666 6.059 ( 3.145 2.160 -1.287) 4.027 6.431 ( -3.426 -0.306 -2.858) 4.472 6.486 ( -0.449 4.365 -1.558) 4.656 6.540 ( -1.301 -2.433 -0.785) 2.868 6.669 ( -0.426 2.448 -2.145) 3.282 7.061 ( -0.817 0.625 -0.939) 1.392 7.184 ( -5.368 -5.837 2.094) 8.202 7.302 ( 2.293 1.270 1.646) 3.095 7.463 ( 5.433 0.514 -0.074) 5.458 7.568 ( 4.037 2.323 -1.346) 4.849 7.660 ( 3.723 5.884 3.086) 7.616 7.980 ( -6.512 -11.149 2.018) 13.068 8.127 ( -0.686 -2.953 6.572) 7.237 9.304 ( -1.664 0.627 -3.682) 4.089 9.507 ( 4.891 -1.186 1.687) 5.309 9.721 ( -1.692 -2.030 -1.884) 3.245 9.795 ( 2.011 -1.836 1.125) 2.946 10.058 ( -4.194 7.195 -2.846) 8.800 10.153 ( -1.594 8.980 3.217) 9.671 11.285 ( 0.659 -3.534 -4.511) 5.768 11.393 ( -1.050 -4.167 4.964) 6.566 11.503 ( -4.937 -0.722 0.080) 4.991 11.610 ( 2.437 -0.579 0.973) 2.687 11.784 ( -4.325 -3.699 -3.157) 6.509 11.829 ( 0.314 -0.299 -2.391) 2.430 12.050 ( 0.811 3.125 4.322) 5.395 12.180 ( 5.501 -1.301 -3.609) 6.707 12.299 ( 5.646 4.277 -3.462) 7.884 12.462 ( 1.235 -3.334 9.146) 9.813 16.087 ( -0.503 1.401 -0.807) 1.693 16.115 ( 0.816 1.473 -0.599) 1.787 16.880 ( -2.611 -0.293 -2.985) 3.977 17.073 ( 2.166 -0.376 2.686) 3.471 17.392 ( -4.324 -2.683 2.390) 5.622 17.766 ( 14.033 -5.796 3.702) 15.628 19.128 ( -5.345 3.678 -14.329) 15.730 19.415 ( -5.148 4.132 9.192) 11.317 ======================= Grid point 324 (155/170) ======================= q-point: ( 0.18 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.731 ( 9.199 6.398 -15.657) 19.253 1.852 ( 3.180 10.448 -17.137) 20.321 2.109 ( 1.937 6.707 8.319) 10.860 2.331 ( -1.716 5.537 4.594) 7.397 2.557 ( 6.530 1.307 -9.711) 11.775 2.820 ( -0.436 6.888 10.632) 12.676 2.894 ( 1.080 -4.798 0.151) 4.921 3.131 ( -0.350 13.016 -3.132) 13.392 3.321 ( 2.318 9.560 2.807) 10.229 3.411 ( 1.056 -7.440 5.062) 9.061 3.684 ( 6.408 -7.737 3.118) 10.519 4.023 ( 4.186 -6.259 -3.926) 8.492 4.258 ( -8.393 2.040 -0.375) 8.645 4.535 ( -8.826 -1.165 12.158) 15.069 4.693 ( -4.847 1.350 -14.360) 15.216 4.847 ( -7.309 -1.282 -2.853) 7.950 4.868 ( -2.923 -2.990 -6.500) 7.729 5.174 ( -3.036 0.309 4.260) 5.240 5.276 ( -2.045 -2.463 8.134) 8.741 5.422 ( 3.050 5.093 -10.824) 12.346 5.768 ( -3.254 -5.398 4.233) 7.593 5.908 ( -2.274 1.741 -1.215) 3.111 6.000 ( -1.881 -0.695 -4.228) 4.679 6.037 ( 7.229 -2.067 -1.457) 7.659 6.278 ( -4.126 -2.892 -7.040) 8.658 6.457 ( 1.887 3.169 -4.650) 5.936 6.623 ( 3.510 -0.504 7.325) 8.138 6.669 ( 3.727 3.181 -2.333) 5.427 7.039 ( -3.631 -1.985 1.554) 4.420 7.128 ( -0.554 -0.611 -1.184) 1.443 7.367 ( 0.797 3.414 4.006) 5.323 7.506 ( 0.417 3.205 0.752) 3.319 7.656 ( 5.876 -2.949 -1.037) 6.656 7.779 ( 4.831 6.224 3.449) 8.601 7.859 ( -11.126 -11.394 3.428) 16.290 8.179 ( -1.165 0.887 4.860) 5.076 9.230 ( -1.139 0.069 -5.450) 5.568 9.544 ( -1.923 -2.941 -1.020) 3.659 9.638 ( -4.061 -1.432 -2.351) 4.906 9.863 ( -0.049 0.520 1.401) 1.495 9.968 ( 0.050 1.718 -1.046) 2.012 10.168 ( 0.907 2.011 0.007) 2.206 11.205 ( -1.760 -1.992 -5.679) 6.270 11.424 ( -1.347 -1.638 6.839) 7.161 11.469 ( -0.432 -0.090 0.243) 0.504 11.628 ( -1.550 -2.615 -3.286) 4.477 11.765 ( 4.396 -1.939 4.100) 6.316 11.861 ( 3.000 2.508 2.128) 4.452 12.047 ( 0.665 1.666 -5.630) 5.909 12.248 ( 3.351 0.050 3.754) 5.032 12.403 ( 6.875 8.217 -0.157) 10.714 12.591 ( 2.022 -1.451 7.886) 8.269 16.070 ( 0.084 0.632 -1.237) 1.392 16.117 ( 0.681 0.731 -1.183) 1.548 16.849 ( 0.242 3.191 1.251) 3.436 17.117 ( 0.126 2.918 1.693) 3.375 17.399 ( -0.391 0.156 4.437) 4.456 18.013 ( 7.693 1.369 4.379) 8.957 18.847 ( -4.979 -4.955 -16.985) 18.380 19.388 ( -7.448 -3.425 5.234) 9.726 ======================= Grid point 325 (156/170) ======================= q-point: ( 0.27 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.749 ( 11.725 7.849 -9.634) 17.085 1.825 ( 7.782 8.258 -5.258) 12.506 2.242 ( 1.310 8.174 8.223) 11.668 2.335 ( -2.659 7.657 2.357) 8.441 2.558 ( 8.641 -1.090 -10.731) 13.821 2.718 ( -7.126 2.020 0.085) 7.407 3.071 ( 3.905 -0.703 6.554) 7.662 3.184 ( 5.519 2.494 6.038) 8.552 3.427 ( 0.297 -2.427 1.979) 3.146 3.481 ( 7.135 6.605 2.307) 9.993 3.829 ( 5.378 0.076 1.036) 5.477 3.952 ( -6.806 -10.804 -11.313) 17.060 4.106 ( -7.422 11.265 2.273) 13.680 4.426 ( -4.831 -2.471 -5.795) 7.939 4.500 ( -5.271 -1.759 2.377) 6.044 4.742 ( -1.245 2.896 -3.972) 5.071 4.783 ( -2.007 -3.170 -3.055) 4.838 5.158 ( -3.173 -1.246 2.850) 4.443 5.299 ( 2.151 4.193 -8.109) 9.379 5.389 ( -1.172 -2.697 1.859) 3.479 5.709 ( -5.721 -5.533 -2.279) 8.279 5.748 ( -7.469 -3.234 -7.876) 11.326 5.961 ( -0.990 -1.096 4.335) 4.580 6.154 ( 4.687 -7.487 3.590) 9.535 6.263 ( 4.368 -4.377 2.799) 6.788 6.458 ( 4.339 3.500 -3.701) 6.691 6.683 ( 0.968 -0.622 -5.118) 5.246 6.756 ( 2.098 -3.165 6.118) 7.200 7.001 ( -2.435 0.730 3.123) 4.027 7.132 ( 2.216 3.988 -0.785) 4.630 7.398 ( -4.780 2.047 5.013) 7.223 7.492 ( -1.190 3.414 -2.523) 4.409 7.644 ( -11.102 -10.740 -0.579) 15.458 7.721 ( 1.371 -0.577 -0.289) 1.516 7.942 ( 5.847 9.096 4.666) 11.777 8.199 ( -0.979 2.829 1.799) 3.492 9.145 ( -0.681 -1.905 -5.660) 6.011 9.421 ( -6.817 -2.537 -3.434) 8.044 9.583 ( -1.927 -5.122 -0.256) 5.479 9.806 ( -3.433 2.048 0.049) 3.998 10.031 ( 4.340 -1.235 -0.572) 4.548 10.160 ( 1.656 -4.917 -5.603) 7.636 11.169 ( 0.883 3.791 1.138) 4.055 11.441 ( -2.354 1.050 0.428) 2.613 11.519 ( 1.870 -1.598 4.262) 4.921 11.568 ( -0.442 0.375 -0.978) 1.137 11.890 ( 2.199 1.448 3.458) 4.346 11.971 ( 5.263 -2.046 0.489) 5.668 12.022 ( 4.585 5.029 -0.083) 6.806 12.336 ( 1.416 0.104 3.581) 3.852 12.514 ( 5.444 10.481 1.778) 11.943 12.705 ( 1.451 1.926 6.255) 6.704 16.062 ( 0.745 -0.304 -1.298) 1.527 16.111 ( 0.455 -0.170 -1.427) 1.508 16.905 ( 1.613 5.777 4.515) 7.507 17.119 ( -0.961 7.149 0.151) 7.215 17.465 ( -0.759 0.382 7.981) 8.026 18.058 ( -6.616 12.952 0.142) 14.545 18.642 ( 5.813 -16.954 -15.936) 23.983 19.301 ( -7.205 -11.590 1.311) 13.710 ======================= Grid point 326 (157/170) ======================= q-point: ( 0.36 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.887 ( 9.331 1.927 -1.627) 9.666 1.958 ( 8.820 10.368 5.818) 14.804 2.237 ( -3.013 5.159 -2.686) 6.551 2.406 ( 2.081 7.910 6.599) 10.509 2.627 ( 13.142 -2.554 -9.566) 16.454 2.691 ( 1.826 3.946 5.500) 7.011 3.138 ( -3.032 0.102 4.946) 5.802 3.299 ( -4.443 -6.433 -6.217) 9.988 3.385 ( -3.694 -0.752 8.975) 9.735 3.596 ( -11.041 -1.369 -10.238) 15.120 3.666 ( 5.448 7.800 3.937) 10.297 3.907 ( 5.730 8.685 -7.603) 12.887 4.024 ( -4.217 7.390 2.023) 8.746 4.306 ( -3.822 1.001 -5.117) 6.465 4.564 ( 4.120 -9.633 8.125) 13.258 4.710 ( 4.395 2.484 -4.844) 6.996 4.732 ( -1.871 -2.758 1.136) 3.521 5.118 ( -2.547 -5.101 -3.308) 6.592 5.254 ( 6.878 5.355 -10.717) 13.814 5.357 ( -4.013 -6.912 2.801) 8.469 5.553 ( -3.382 -0.996 -7.518) 8.304 5.574 ( -8.031 -6.694 -0.629) 10.473 6.019 ( -2.100 -3.166 7.505) 8.412 6.255 ( 3.543 -6.512 2.634) 7.867 6.407 ( 3.270 -2.263 2.659) 4.784 6.519 ( -2.507 -6.898 -1.476) 7.486 6.561 ( -0.488 -0.735 2.395) 2.553 6.856 ( 3.789 -4.499 2.896) 6.557 7.032 ( 1.559 -1.352 0.976) 2.283 7.176 ( 1.855 5.380 -0.441) 5.708 7.277 ( -8.959 -3.802 0.056) 9.732 7.433 ( -2.317 5.298 -1.932) 6.097 7.516 ( -4.497 2.224 0.711) 5.067 7.691 ( -3.061 0.867 -2.776) 4.222 8.080 ( 5.075 8.384 2.619) 10.145 8.197 ( -0.894 3.763 0.988) 3.992 9.094 ( 1.313 -4.601 -3.541) 5.953 9.282 ( -5.528 -5.678 -2.403) 8.281 9.563 ( -0.229 -5.580 1.122) 5.697 9.766 ( -1.929 -1.728 -0.638) 2.667 10.074 ( 2.179 -0.421 -1.271) 2.558 10.110 ( 1.413 -3.393 -6.103) 7.124 11.226 ( 1.307 6.370 3.855) 7.560 11.390 ( -1.932 3.368 -2.142) 4.434 11.541 ( -0.846 0.267 2.804) 2.941 11.629 ( 2.434 2.174 1.619) 3.643 11.918 ( 2.275 3.279 -1.025) 4.120 12.048 ( 3.685 -1.553 0.449) 4.024 12.159 ( 5.014 2.796 4.066) 7.035 12.374 ( -0.554 -0.355 1.767) 1.885 12.630 ( 4.382 12.313 3.689) 13.580 12.778 ( 0.086 6.542 3.793) 7.562 16.065 ( 1.114 -1.094 -0.943) 1.824 16.100 ( 0.154 -0.961 -1.201) 1.546 16.979 ( 0.504 6.639 4.339) 7.947 17.109 ( -0.076 9.091 0.192) 9.094 17.543 ( -2.448 -0.534 9.463) 9.789 17.856 ( -9.558 8.386 -6.317) 14.198 18.664 ( 12.381 -14.869 -9.236) 21.440 19.173 ( -8.444 -14.722 -0.922) 16.997 ======================= Grid point 327 (158/170) ======================= q-point: ( 0.45 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.007 ( 4.896 1.388 3.059) 5.938 2.126 ( -4.116 2.904 -3.058) 5.893 2.239 ( 9.272 6.570 10.211) 15.278 2.446 ( -2.560 6.526 -3.233) 7.720 2.759 ( 15.749 -1.374 -7.816) 17.635 2.898 ( 8.140 1.045 9.202) 12.330 2.996 ( -15.694 -2.450 2.285) 16.048 3.149 ( -2.132 -0.179 -9.626) 9.860 3.315 ( -6.284 0.140 4.216) 7.568 3.392 ( -6.556 3.848 -3.031) 8.184 3.785 ( 2.908 13.138 3.891) 14.007 3.876 ( -0.672 12.070 -6.030) 13.509 4.038 ( 5.373 -1.037 0.866) 5.541 4.176 ( -6.629 -1.775 -2.760) 7.397 4.740 ( 7.667 -5.984 1.588) 9.855 4.762 ( 2.074 -0.081 2.415) 3.184 4.782 ( 0.657 -4.003 8.344) 9.278 4.969 ( -3.549 -9.548 -11.986) 15.730 5.297 ( 9.871 4.022 -6.770) 12.628 5.366 ( -2.001 -5.950 5.334) 8.238 5.428 ( -6.591 -0.571 0.307) 6.623 5.452 ( -3.332 -7.997 -3.011) 9.171 6.086 ( 3.772 -2.896 4.293) 6.406 6.270 ( -11.743 1.597 -2.745) 12.165 6.351 ( 4.027 -8.277 0.407) 9.213 6.419 ( -2.031 -3.884 -1.076) 4.513 6.771 ( 6.042 -7.443 9.555) 13.535 6.925 ( -1.619 -7.806 -1.007) 8.036 7.027 ( 0.864 -8.321 0.157) 8.367 7.103 ( -1.024 0.720 -4.933) 5.090 7.284 ( 2.428 8.051 2.217) 8.696 7.359 ( -4.010 7.468 -1.268) 8.571 7.496 ( -0.273 4.162 3.523) 5.460 7.580 ( -3.522 3.544 -4.878) 6.983 8.164 ( 3.364 6.439 -0.446) 7.278 8.192 ( -1.787 4.876 1.639) 5.446 9.108 ( 3.214 -6.677 -0.880) 7.462 9.176 ( -4.531 -7.347 -1.154) 8.709 9.611 ( 2.429 -5.899 3.409) 7.233 9.702 ( -2.836 -5.666 -3.394) 7.189 10.081 ( 0.912 0.210 -1.325) 1.622 10.085 ( 0.474 0.975 -1.259) 1.662 11.285 ( 0.453 6.456 3.807) 7.508 11.336 ( -0.760 5.544 -3.298) 6.495 11.580 ( 0.758 2.445 3.687) 4.489 11.634 ( -0.751 2.944 -2.335) 3.832 11.984 ( 4.558 2.447 1.338) 5.343 12.061 ( -1.809 0.825 -1.180) 2.312 12.277 ( 4.554 0.379 2.320) 5.125 12.356 ( -2.853 -1.005 -0.160) 3.030 12.735 ( 3.363 12.915 2.512) 13.580 12.791 ( -1.730 10.903 0.632) 11.058 16.076 ( 0.929 -1.497 -0.260) 1.781 16.089 ( -0.345 -1.444 -0.547) 1.582 17.035 ( 1.177 7.166 3.850) 8.219 17.097 ( -1.139 8.504 -1.905) 8.789 17.597 ( -2.419 -0.412 7.459) 7.853 17.670 ( -2.620 1.772 -6.677) 7.389 18.809 ( 13.082 -12.633 -3.654) 18.549 18.998 ( -11.186 -13.734 -0.176) 17.714 ======================= Grid point 333 (159/170) ======================= q-point: ( 0.00 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 153 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.003 ( -0.584 4.919 -6.096) 7.855 2.003 ( 0.584 4.919 6.096) 7.855 2.430 ( 1.714 5.996 -7.897) 10.063 2.430 ( -1.714 5.996 7.897) 10.063 2.593 ( -2.316 2.447 -10.226) 10.767 2.593 ( 2.316 2.447 10.226) 10.767 2.883 ( -6.128 -3.943 -4.646) 8.642 2.883 ( 6.128 -3.943 4.646) 8.642 3.169 ( 2.366 -10.603 -3.014) 11.274 3.169 ( -2.366 -10.603 3.014) 11.274 4.038 ( -5.042 10.105 -6.554) 13.057 4.038 ( 5.042 10.105 6.554) 13.057 4.467 ( -2.908 7.055 -1.813) 7.844 4.467 ( 2.908 7.055 1.813) 7.844 4.983 ( 1.443 2.200 -1.215) 2.898 4.983 ( -1.443 2.200 1.215) 2.898 5.093 ( 8.853 -1.228 -12.975) 15.755 5.093 ( -8.853 -1.228 12.975) 15.755 5.473 ( 7.377 -2.973 -4.869) 9.326 5.473 ( -7.377 -2.973 4.869) 9.326 5.626 ( 4.005 -3.584 -4.412) 6.954 5.626 ( -4.005 -3.584 4.412) 6.954 6.133 ( 0.691 7.217 -4.681) 8.630 6.133 ( -0.691 7.217 4.681) 8.630 6.521 ( 2.059 1.628 -3.132) 4.087 6.521 ( -2.059 1.628 3.132) 4.087 6.662 ( -5.010 1.491 0.367) 5.241 6.662 ( 5.010 1.491 -0.367) 5.241 7.128 ( 1.216 1.357 -6.894) 7.131 7.128 ( -1.216 1.357 6.894) 7.131 7.299 ( -5.485 -3.088 0.639) 6.326 7.299 ( 5.485 -3.088 -0.639) 6.326 7.673 ( -1.674 2.660 -2.279) 3.882 7.673 ( 1.674 2.660 2.279) 3.882 7.837 ( -5.444 -12.437 -2.858) 13.874 7.837 ( 5.444 -12.437 2.858) 13.874 9.369 ( -2.359 -2.085 -2.227) 3.857 9.369 ( 2.359 -2.085 2.227) 3.857 9.735 ( -1.043 -0.248 -0.990) 1.460 9.735 ( 1.043 -0.248 0.990) 1.460 10.328 ( 0.167 8.917 -5.333) 10.391 10.328 ( -0.167 8.917 5.333) 10.391 11.273 ( 1.591 -1.913 -5.037) 5.617 11.273 ( -1.591 -1.913 5.037) 5.617 11.578 ( 0.308 0.633 -2.335) 2.439 11.578 ( -0.308 0.633 2.335) 2.439 11.796 ( 1.048 -2.770 -0.975) 3.118 11.796 ( -1.048 -2.770 0.975) 3.118 12.044 ( 5.367 -3.723 -4.050) 7.686 12.044 ( -5.367 -3.723 4.050) 7.686 12.360 ( 0.284 3.359 -3.550) 4.896 12.360 ( -0.284 3.359 3.550) 4.896 16.139 ( -0.710 1.712 -0.100) 1.856 16.139 ( 0.710 1.712 0.100) 1.856 16.947 ( -1.707 -1.697 -4.625) 5.214 16.947 ( 1.707 -1.697 4.625) 5.214 17.400 ( -7.454 -5.185 -0.500) 9.093 17.400 ( 7.454 -5.185 0.500) 9.093 19.449 ( 0.521 4.810 -10.056) 11.159 19.449 ( -0.521 4.810 10.056) 11.159 ======================= Grid point 335 (160/170) ======================= q-point: ( 0.09 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.932 ( 1.037 6.618 -6.282) 9.183 2.077 ( 0.514 2.637 3.168) 4.154 2.277 ( 1.219 10.364 -15.619) 18.785 2.411 ( -3.175 4.069 1.540) 5.386 2.580 ( 2.931 2.143 -2.128) 4.208 2.715 ( 4.606 0.089 0.501) 4.634 2.825 ( -0.969 -1.862 5.001) 5.424 3.090 ( 7.262 -5.165 9.755) 13.212 3.214 ( -0.242 -8.213 7.161) 10.899 3.219 ( 4.078 -11.601 0.743) 12.319 3.824 ( -6.540 15.467 -8.684) 18.906 4.074 ( -2.477 4.603 -3.288) 6.175 4.426 ( -1.666 6.813 0.711) 7.050 4.537 ( -0.177 6.011 5.245) 7.980 4.926 ( -4.947 0.779 -2.336) 5.526 4.946 ( -3.586 -1.637 -2.701) 4.778 5.001 ( -1.043 4.330 -13.370) 14.093 5.094 ( -3.078 -2.727 7.285) 8.366 5.297 ( -12.194 -0.942 7.072) 14.127 5.535 ( 6.174 1.578 -8.419) 10.559 5.637 ( -2.242 -5.215 3.441) 6.638 5.768 ( 11.374 -6.552 -0.685) 13.144 6.090 ( -2.094 8.223 -1.073) 8.553 6.173 ( -0.834 5.349 -2.868) 6.127 6.427 ( -4.693 -0.391 -8.248) 9.498 6.486 ( -1.189 -1.359 3.451) 3.895 6.579 ( -5.230 3.910 0.504) 6.549 6.697 ( 2.746 -1.000 -4.149) 5.074 7.079 ( -5.005 0.224 0.355) 5.023 7.117 ( -1.482 0.456 2.208) 2.698 7.332 ( 5.578 2.449 2.583) 6.617 7.427 ( 9.254 -4.089 -2.897) 10.524 7.619 ( -3.953 -1.127 0.469) 4.137 7.717 ( -1.290 -5.206 2.624) 5.971 7.785 ( 1.145 0.402 3.594) 3.793 7.986 ( 4.852 -9.947 6.510) 12.840 9.311 ( -1.687 0.140 -1.899) 2.544 9.437 ( 2.102 -4.560 1.351) 5.199 9.701 ( -1.770 0.180 -1.142) 2.114 9.770 ( 2.304 -0.948 0.935) 2.661 10.206 ( -6.419 7.129 -5.359) 10.988 10.315 ( -6.795 6.167 2.398) 9.484 11.247 ( 1.442 -0.366 -4.006) 4.273 11.331 ( 0.192 -2.268 5.149) 5.630 11.511 ( -2.913 1.444 -1.436) 3.554 11.607 ( 1.535 0.120 0.120) 1.544 11.717 ( -3.235 -2.132 -2.671) 4.706 11.809 ( 2.745 -1.817 -1.457) 3.600 12.064 ( 0.085 -1.809 5.003) 5.321 12.118 ( 5.536 -3.969 -2.341) 7.202 12.406 ( 7.266 5.128 -0.008) 8.893 12.449 ( 4.346 2.010 4.685) 6.699 16.118 ( -1.096 1.640 -0.791) 2.126 16.142 ( 0.067 1.171 -0.685) 1.358 16.891 ( -0.567 1.351 -0.158) 1.474 17.046 ( 2.730 -2.151 4.375) 5.587 17.350 ( 0.719 -1.275 1.133) 1.851 17.611 ( 14.124 -8.995 3.225) 17.053 19.236 ( -9.775 6.563 -11.666) 16.575 19.465 ( -8.199 0.848 4.878) 9.578 ======================= Grid point 336 (161/170) ======================= q-point: ( 0.18 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.889 ( 3.033 8.850 -6.703) 11.509 2.054 ( 0.054 8.674 -4.457) 9.752 2.247 ( 6.110 6.732 -1.346) 9.191 2.412 ( -1.835 3.598 4.937) 6.379 2.572 ( 5.266 -0.144 -7.905) 9.499 2.782 ( 2.173 -5.525 -3.197) 6.743 2.924 ( 4.627 3.809 7.085) 9.280 3.214 ( -2.367 -6.279 -1.921) 6.979 3.261 ( -0.650 -7.102 4.691) 8.537 3.348 ( 4.545 -4.630 8.870) 10.990 3.736 ( 4.122 12.128 0.095) 12.809 3.972 ( -2.385 0.438 -5.462) 5.976 4.386 ( -4.024 7.887 0.831) 8.893 4.559 ( -8.763 4.604 7.757) 12.576 4.720 ( -5.159 -0.809 -9.449) 10.796 4.848 ( -3.902 2.303 -4.458) 6.357 4.876 ( -0.572 5.075 -5.681) 7.639 5.115 ( -5.220 -6.131 2.109) 8.323 5.238 ( -2.039 -1.121 7.885) 8.221 5.526 ( 2.748 4.745 -8.140) 9.814 5.631 ( -1.967 -6.603 1.632) 7.081 5.888 ( 3.286 -6.052 -5.947) 9.098 5.955 ( -9.022 3.142 -1.375) 9.652 6.084 ( -0.887 1.987 -5.018) 5.469 6.230 ( -3.989 -1.417 -7.440) 8.560 6.494 ( -3.945 -0.280 -0.845) 4.044 6.590 ( 1.425 -2.398 7.727) 8.215 6.702 ( 2.424 -1.036 -2.180) 3.421 7.010 ( -2.376 0.838 0.833) 2.654 7.140 ( 1.396 -0.643 -0.288) 1.564 7.436 ( 0.034 0.799 3.971) 4.051 7.511 ( 4.435 -3.764 -2.879) 6.490 7.561 ( -2.555 0.176 1.746) 3.100 7.733 ( -0.022 -0.392 2.384) 2.417 7.912 ( 5.890 4.481 5.788) 9.395 8.127 ( 3.270 -5.428 5.324) 8.276 9.245 ( -2.843 1.290 -3.955) 5.039 9.440 ( -2.466 -5.831 -0.961) 6.403 9.634 ( -4.365 1.199 -1.773) 4.861 9.841 ( 2.877 -2.553 1.517) 4.135 10.035 ( -5.561 3.985 -3.380) 7.631 10.180 ( -6.815 -0.680 -3.338) 7.619 11.228 ( 1.252 3.450 -1.195) 3.860 11.398 ( 0.449 -1.416 5.185) 5.394 11.484 ( 0.155 1.795 0.283) 1.824 11.592 ( 0.079 -0.936 -3.484) 3.608 11.749 ( 4.658 0.289 5.085) 6.901 11.860 ( 3.716 -1.702 0.257) 4.095 12.093 ( 2.937 1.836 -2.919) 4.529 12.207 ( 2.830 -3.576 4.458) 6.378 12.552 ( 8.385 6.271 0.981) 10.517 12.601 ( 6.670 2.284 4.864) 8.566 16.088 ( -0.973 1.075 -1.177) 1.867 16.128 ( -0.423 0.278 -1.182) 1.285 16.927 ( 1.663 4.588 4.233) 6.460 17.136 ( 2.104 -0.679 4.003) 4.572 17.419 ( 4.661 1.905 1.156) 5.166 17.911 ( 15.535 -10.590 3.745) 19.170 18.867 ( -15.841 6.312 -13.668) 21.854 19.308 ( -13.418 -4.791 0.937) 14.279 ======================= Grid point 337 (162/170) ======================= q-point: ( 0.27 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.894 ( 4.951 8.171 -3.581) 10.203 2.068 ( 4.103 13.981 1.237) 14.623 2.357 ( 4.536 -2.148 -0.292) 5.028 2.420 ( -0.698 7.030 2.142) 7.382 2.599 ( 8.340 3.579 -8.194) 12.227 2.744 ( -0.892 -0.232 -2.123) 2.314 3.073 ( 3.215 0.781 5.049) 6.036 3.171 ( 1.162 -2.949 2.116) 3.811 3.295 ( -2.528 -8.282 4.857) 9.928 3.487 ( 3.207 -9.410 0.583) 9.958 3.843 ( -2.253 4.678 0.823) 5.258 3.895 ( 6.020 5.094 -0.457) 7.899 4.296 ( -9.732 5.912 -0.406) 11.394 4.439 ( -5.242 4.109 4.185) 7.866 4.624 ( -3.026 10.805 -4.050) 11.929 4.730 ( -2.669 -1.208 -2.434) 3.810 4.810 ( 0.753 4.151 -7.503) 8.608 5.030 ( -4.203 -9.617 0.000) 10.495 5.317 ( -2.161 -2.766 4.741) 5.899 5.422 ( -0.970 4.449 -9.858) 10.859 5.585 ( -4.907 -6.057 -0.703) 7.827 5.684 ( -5.323 -3.189 -11.621) 13.173 5.867 ( -4.891 -5.351 2.374) 7.628 6.083 ( 2.385 -1.844 0.839) 3.130 6.210 ( 3.425 -0.803 2.860) 4.534 6.432 ( -2.260 -6.200 -1.235) 6.714 6.640 ( -2.419 -2.671 3.273) 4.868 6.735 ( 1.002 0.564 2.794) 3.021 6.976 ( -0.939 -2.890 -4.520) 5.446 7.186 ( 1.047 -0.748 5.975) 6.112 7.391 ( -3.812 0.116 -2.467) 4.542 7.548 ( 1.253 4.281 -0.014) 4.460 7.567 ( 0.055 1.924 0.144) 1.930 7.750 ( -0.879 0.740 0.889) 1.453 8.083 ( 5.762 5.121 5.227) 9.314 8.213 ( 2.092 -1.207 1.917) 3.083 9.125 ( -3.876 0.058 -5.611) 6.820 9.326 ( -7.136 -5.989 -3.988) 10.134 9.539 ( -3.476 0.785 -1.635) 3.921 9.809 ( -4.647 -2.594 -2.280) 5.790 10.020 ( 3.362 -0.026 0.473) 3.395 10.072 ( -0.521 -2.903 -3.504) 4.580 11.280 ( 2.791 6.171 3.427) 7.591 11.433 ( -0.657 -1.495 1.003) 1.916 11.514 ( 0.626 1.599 3.249) 3.675 11.603 ( 3.452 2.271 0.747) 4.199 11.896 ( 4.066 -0.253 3.485) 5.361 11.925 ( 4.332 -2.162 -0.058) 4.842 12.137 ( 5.038 4.984 0.012) 7.087 12.293 ( 1.298 -3.427 3.916) 5.364 12.705 ( 7.785 8.138 2.100) 11.456 12.773 ( 6.654 4.241 4.915) 9.296 16.061 ( -0.445 0.239 -1.180) 1.284 16.104 ( -0.655 -0.584 -1.279) 1.551 17.023 ( 1.808 6.002 6.026) 8.696 17.205 ( 1.668 1.730 2.188) 3.250 17.502 ( 2.440 3.529 2.222) 4.832 18.192 ( 14.003 -11.662 0.801) 18.240 18.414 ( -17.952 6.473 -13.560) 23.410 19.081 ( -12.206 -10.532 -0.919) 16.148 ======================= Grid point 338 (163/170) ======================= q-point: ( 0.36 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.967 ( 4.947 5.985 0.981) 7.827 2.196 ( 4.881 12.781 6.336) 15.077 2.300 ( -2.053 0.187 -5.524) 5.896 2.532 ( 5.206 4.228 3.149) 7.409 2.646 ( 8.994 4.593 -7.619) 12.651 2.779 ( 4.950 4.214 3.112) 7.207 3.112 ( -3.975 -3.054 -1.906) 5.362 3.196 ( -1.050 -3.151 -2.984) 4.465 3.302 ( -3.963 -6.239 6.841) 10.072 3.473 ( -0.334 -8.845 1.422) 8.965 3.885 ( 2.675 10.149 6.252) 12.216 3.981 ( 1.425 3.553 -0.470) 3.857 4.129 ( -6.452 3.102 -1.712) 7.361 4.393 ( -7.452 -0.350 -0.583) 7.483 4.524 ( -0.342 8.059 -3.248) 8.695 4.691 ( -0.709 -1.048 0.344) 1.311 4.783 ( 4.780 5.281 -3.380) 7.884 4.961 ( -1.752 -8.941 -5.777) 10.789 5.206 ( -4.297 -5.936 -5.784) 9.336 5.341 ( -1.390 -1.983 -3.768) 4.479 5.465 ( -4.873 -0.264 -2.295) 5.393 5.552 ( -2.090 -0.463 -2.199) 3.069 5.864 ( -2.678 -10.152 5.986) 12.086 6.129 ( 1.049 -8.079 -0.278) 8.152 6.324 ( 1.383 -2.924 3.402) 4.694 6.419 ( 2.173 -2.428 4.174) 5.295 6.626 ( -1.897 3.502 1.304) 4.191 6.779 ( -1.911 -4.635 4.649) 6.838 6.898 ( -0.382 -4.051 -3.493) 5.362 7.275 ( -1.607 -0.855 -4.364) 4.728 7.302 ( 1.526 5.746 3.746) 7.027 7.534 ( -1.426 4.095 -0.911) 4.431 7.561 ( -1.108 4.101 0.361) 4.263 7.708 ( -3.311 -0.547 -2.193) 4.009 8.208 ( 3.771 4.661 2.298) 6.421 8.254 ( 1.415 1.965 0.507) 2.474 9.017 ( -1.650 -2.836 -4.056) 5.217 9.154 ( -6.400 -6.535 -4.203) 10.066 9.494 ( -0.694 -1.188 0.103) 1.379 9.697 ( -4.000 -4.955 -3.793) 7.412 10.065 ( 1.488 -0.353 -0.297) 1.558 10.076 ( 2.626 -0.359 -0.477) 2.693 11.366 ( 1.269 6.770 4.253) 8.095 11.434 ( 1.090 1.726 -0.664) 2.147 11.572 ( 0.714 2.727 4.750) 5.523 11.687 ( 3.593 3.005 1.198) 4.835 11.930 ( 3.387 -1.718 -3.601) 5.234 12.015 ( 1.488 -1.794 3.434) 4.151 12.244 ( 4.602 4.634 2.399) 6.958 12.340 ( 0.245 -1.791 2.045) 2.729 12.861 ( 6.814 10.143 3.003) 12.583 12.927 ( 4.682 7.406 4.424) 9.816 16.047 ( 0.183 -0.615 -0.821) 1.042 16.078 ( -0.671 -1.196 -0.998) 1.696 17.103 ( -0.060 5.826 4.681) 7.474 17.240 ( 1.202 3.806 -0.292) 4.002 17.553 ( -0.874 1.755 4.642) 5.039 17.973 ( -12.932 -0.344 -14.242) 19.241 18.416 ( 10.946 -5.958 0.839) 12.491 18.895 ( -8.949 -12.750 -0.657) 15.591 ======================= Grid point 339 (164/170) ======================= q-point: ( 0.45 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.071 ( 3.851 4.561 4.083) 7.232 2.186 ( -3.251 2.621 -4.984) 6.502 2.389 ( 5.507 7.622 10.020) 13.741 2.567 ( -1.114 4.245 -6.250) 7.637 2.739 ( 10.783 0.577 -5.387) 12.068 2.875 ( -5.440 -4.018 -2.611) 7.249 2.992 ( 2.304 3.221 7.718) 8.674 3.152 ( -3.819 -0.108 -4.379) 5.811 3.322 ( 2.772 1.094 5.052) 5.866 3.461 ( -6.340 2.621 0.392) 6.872 3.967 ( 2.325 1.167 -4.076) 4.836 3.991 ( -3.189 3.604 4.356) 6.491 4.056 ( 2.733 3.173 2.766) 5.019 4.221 ( -6.454 3.065 -6.673) 9.776 4.566 ( 3.132 -4.664 7.588) 9.441 4.737 ( -0.785 -3.549 -0.941) 3.755 4.784 ( 3.228 -4.349 -9.670) 11.083 4.841 ( -2.276 2.294 -0.278) 3.243 5.165 ( 1.590 -8.160 0.851) 8.357 5.241 ( -4.951 -9.119 -2.260) 10.620 5.438 ( 3.882 5.308 -2.227) 6.944 5.496 ( -4.494 2.914 1.179) 5.484 5.919 ( 3.076 -10.806 4.513) 12.108 6.058 ( -5.582 -12.645 -4.083) 14.413 6.390 ( 4.320 3.321 2.171) 5.866 6.477 ( -3.342 4.134 1.112) 5.431 6.658 ( 3.134 -1.951 3.150) 4.853 6.742 ( -4.434 -7.226 0.194) 8.481 6.955 ( 5.188 -0.893 4.714) 7.066 7.126 ( -4.616 0.678 -8.439) 9.642 7.416 ( 3.352 3.172 4.670) 6.565 7.498 ( -1.787 5.726 -1.479) 6.178 7.550 ( -1.134 3.177 2.473) 4.183 7.607 ( -2.548 -0.874 -4.909) 5.600 8.266 ( 2.377 4.014 -0.850) 4.741 8.275 ( -0.484 3.627 1.524) 3.963 8.983 ( 1.194 -5.418 -1.082) 5.653 9.031 ( -3.800 -6.752 -1.967) 7.993 9.517 ( 1.661 -3.320 2.177) 4.304 9.593 ( -3.090 -5.045 -3.633) 6.942 10.089 ( 0.812 0.402 0.529) 1.049 10.097 ( 0.750 0.238 -0.645) 1.018 11.419 ( -0.830 6.423 4.522) 7.899 11.442 ( 1.910 5.305 -3.225) 6.495 11.646 ( 1.062 3.897 5.025) 6.447 11.708 ( -0.008 4.107 -2.951) 5.057 11.975 ( 5.078 -3.531 -1.250) 6.311 12.034 ( -2.760 -3.537 1.516) 4.736 12.323 ( 1.955 3.670 1.641) 4.470 12.351 ( -0.355 1.174 -0.056) 1.227 12.984 ( 4.147 11.314 1.329) 12.123 13.013 ( 0.454 10.400 2.091) 10.618 16.048 ( 0.557 -1.221 -0.232) 1.362 16.059 ( -0.622 -1.427 -0.421) 1.613 17.151 ( 0.647 4.341 4.300) 6.145 17.223 ( -1.108 3.788 -3.518) 5.287 17.592 ( -1.539 -0.114 6.346) 6.531 17.688 ( -3.912 -0.657 -9.361) 10.167 18.594 ( 9.869 -7.619 -0.150) 12.468 18.748 ( -8.579 -10.641 -0.074) 13.668 ======================= Grid point 345 (165/170) ======================= q-point: ( 0.00 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 153 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.055 ( -0.243 0.778 -2.741) 2.859 2.055 ( 0.243 0.778 2.741) 2.859 2.544 ( 2.933 4.904 -7.354) 9.313 2.544 ( -2.933 4.904 7.354) 9.313 2.617 ( 0.349 -0.571 -6.592) 6.626 2.617 ( -0.349 -0.571 6.592) 6.626 2.804 ( -4.458 -2.425 0.083) 5.075 2.804 ( 4.458 -2.425 -0.083) 5.075 3.034 ( 1.578 -3.522 -3.027) 4.905 3.034 ( -1.578 -3.522 3.027) 4.905 4.133 ( -1.834 1.348 -2.020) 3.043 4.133 ( 1.834 1.348 2.020) 3.043 4.588 ( -1.132 3.336 -2.954) 4.598 4.588 ( 1.132 3.336 2.954) 4.598 4.959 ( 0.010 -1.809 -3.455) 3.899 4.959 ( -0.010 -1.809 3.455) 3.899 5.216 ( 11.671 9.562 -8.002) 17.079 5.216 ( -11.671 9.562 8.002) 17.079 5.387 ( -2.001 -5.818 -3.382) 7.020 5.387 ( 2.001 -5.818 3.382) 7.020 5.609 ( -1.140 0.681 -1.765) 2.209 5.609 ( 1.140 0.681 1.765) 2.209 6.209 ( 0.006 1.037 -1.957) 2.215 6.209 ( -0.006 1.037 1.957) 2.215 6.554 ( -1.047 1.367 -0.521) 1.799 6.554 ( 1.047 1.367 0.521) 1.799 6.687 ( 1.193 0.980 -2.798) 3.196 6.687 ( -1.193 0.980 2.798) 3.196 7.142 ( 0.601 -1.767 -2.167) 2.860 7.142 ( -0.601 -1.767 2.167) 2.860 7.304 ( 0.114 6.288 -4.421) 7.687 7.304 ( -0.114 6.288 4.421) 7.687 7.518 ( -2.724 -12.520 -3.824) 13.372 7.518 ( 2.724 -12.520 3.824) 13.372 7.772 ( -0.409 1.264 -0.198) 1.343 7.772 ( 0.409 1.264 0.198) 1.343 9.333 ( -0.737 -1.127 -0.739) 1.536 9.333 ( 0.737 -1.127 0.739) 1.536 9.738 ( -0.448 0.220 -0.344) 0.607 9.738 ( 0.448 0.220 0.344) 0.607 10.456 ( -0.294 3.479 -2.246) 4.152 10.456 ( 0.294 3.479 2.246) 4.152 11.249 ( 0.506 -0.630 -1.958) 2.119 11.249 ( -0.506 -0.630 1.958) 2.119 11.589 ( -0.012 0.297 -1.375) 1.407 11.589 ( 0.012 0.297 1.375) 1.407 11.769 ( -1.592 -0.062 0.018) 1.594 11.769 ( 1.592 -0.062 -0.018) 1.594 11.965 ( 3.073 -2.996 -2.290) 4.865 11.965 ( -3.073 -2.996 2.290) 4.865 12.421 ( 0.133 1.918 -0.945) 2.142 12.421 ( -0.133 1.918 0.945) 2.142 16.165 ( -0.293 0.744 -0.046) 0.801 16.165 ( 0.293 0.744 0.046) 0.801 16.921 ( -0.728 -0.773 -1.884) 2.162 16.921 ( 0.728 -0.773 1.884) 2.162 17.325 ( -2.526 -2.035 -0.074) 3.244 17.325 ( 2.526 -2.035 0.074) 3.244 19.514 ( 0.002 1.724 -3.510) 3.911 19.514 ( -0.002 1.724 3.510) 3.911 ======================= Grid point 347 (166/170) ======================= q-point: ( 0.09 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.028 ( -0.206 3.580 0.401) 3.609 2.085 ( 0.033 -1.777 2.605) 3.154 2.450 ( -0.483 6.420 -9.459) 11.442 2.516 ( -2.877 3.978 -3.421) 5.984 2.578 ( -0.163 0.290 -0.222) 0.400 2.672 ( 1.895 -4.062 0.819) 4.557 2.850 ( 5.676 3.856 3.150) 7.551 2.955 ( 8.730 -6.922 3.487) 11.674 3.076 ( 4.422 -2.863 0.593) 5.301 3.091 ( 2.238 -4.047 5.373) 7.089 4.021 ( -5.854 5.625 -2.957) 8.640 4.093 ( -5.347 -1.952 -2.111) 6.071 4.551 ( -0.242 6.083 -1.466) 6.261 4.642 ( 1.148 -0.657 1.421) 1.941 4.880 ( -3.443 2.662 -5.370) 6.913 4.973 ( -0.361 -3.753 -0.561) 3.812 5.069 ( -14.552 5.587 7.460) 17.281 5.156 ( -9.307 1.179 -0.073) 9.381 5.319 ( -1.725 7.558 -0.780) 7.791 5.515 ( -1.902 -8.246 0.796) 8.500 5.586 ( 8.189 3.340 -6.753) 11.127 5.661 ( 10.625 -4.316 -4.425) 12.292 6.210 ( -1.036 3.527 -0.352) 3.693 6.239 ( -2.881 1.034 -1.051) 3.236 6.434 ( -6.846 2.507 -6.479) 9.753 6.484 ( -3.769 -0.475 -1.557) 4.106 6.619 ( -7.076 -0.082 0.296) 7.082 6.640 ( -2.073 -2.898 -0.529) 3.602 7.076 ( -5.228 1.224 1.511) 5.578 7.136 ( -0.080 -2.105 -3.715) 4.271 7.361 ( 5.857 1.041 1.242) 6.077 7.441 ( 6.753 8.552 4.047) 11.624 7.470 ( 1.329 -7.969 0.917) 8.131 7.632 ( 2.907 -8.660 3.923) 9.941 7.820 ( 3.721 1.414 3.819) 5.516 7.848 ( 5.648 -2.055 4.015) 7.228 9.319 ( -0.772 0.953 0.010) 1.226 9.358 ( 0.355 -3.101 1.093) 3.307 9.721 ( -0.964 1.482 -0.509) 1.840 9.749 ( 0.779 -1.221 0.241) 1.469 10.325 ( -9.091 4.582 -4.854) 11.278 10.375 ( -9.516 -0.071 -1.958) 9.716 11.261 ( 2.084 1.429 -0.244) 2.539 11.293 ( 1.594 -1.734 3.306) 4.059 11.553 ( -0.504 2.559 -2.553) 3.650 11.597 ( 1.061 -1.493 -2.891) 3.423 11.715 ( -2.047 1.916 1.057) 2.996 11.766 ( 0.603 -2.554 0.295) 2.641 12.021 ( 3.644 -1.149 2.979) 4.845 12.043 ( 5.925 -3.051 -0.462) 6.681 12.483 ( 6.515 2.462 1.229) 7.073 12.494 ( 5.821 1.345 2.302) 6.402 16.146 ( -1.221 1.071 -0.826) 1.822 16.156 ( -0.757 0.120 -0.795) 1.104 16.933 ( 1.380 2.818 3.019) 4.354 16.994 ( 2.535 -3.041 4.699) 6.144 17.356 ( 5.311 2.213 0.723) 5.798 17.446 ( 10.252 -6.891 1.521) 12.446 19.362 ( -10.546 5.664 -6.599) 13.669 19.447 ( -9.818 -2.714 -0.751) 10.213 ======================= Grid point 348 (167/170) ======================= q-point: ( 0.18 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.058 ( 1.428 7.526 0.977) 7.723 2.146 ( 1.875 -0.193 5.819) 6.116 2.357 ( 0.867 4.624 -7.235) 8.630 2.441 ( -1.090 -2.875 1.073) 3.257 2.595 ( 2.857 4.472 -1.754) 5.589 2.689 ( 2.945 -4.271 -3.870) 6.472 2.992 ( 5.832 3.550 2.514) 7.275 3.080 ( 3.464 -5.775 -0.412) 6.747 3.159 ( 3.807 -1.010 -0.359) 3.955 3.226 ( 5.488 -6.442 3.429) 9.131 3.935 ( -2.183 5.714 1.896) 6.404 3.981 ( -3.635 -0.162 -1.185) 3.827 4.523 ( -1.802 6.697 -0.931) 6.998 4.649 ( -1.593 -5.447 -1.788) 5.950 4.728 ( -9.701 10.657 1.519) 14.491 4.924 ( -8.730 3.222 1.327) 9.400 4.931 ( -1.398 -6.107 -4.316) 7.608 5.002 ( -9.378 -1.216 1.406) 9.560 5.279 ( -0.916 7.221 1.162) 7.371 5.462 ( -3.975 -8.848 1.301) 9.786 5.654 ( 6.674 5.925 -8.008) 11.991 5.773 ( 5.372 -5.850 -6.170) 10.057 6.037 ( -10.949 4.394 -5.522) 13.026 6.094 ( -5.561 -1.103 -7.007) 9.013 6.245 ( -4.758 3.906 -4.297) 7.507 6.388 ( -7.296 -8.831 -2.148) 11.655 6.593 ( -1.981 2.297 7.370) 7.970 6.652 ( -1.003 -3.237 5.608) 6.553 7.033 ( 0.369 0.761 -2.730) 2.858 7.070 ( -0.688 -3.873 -3.360) 5.173 7.451 ( 3.746 4.079 0.204) 5.542 7.538 ( 4.363 -3.267 -0.193) 5.454 7.581 ( 3.579 6.404 3.586) 8.165 7.701 ( -0.015 -4.258 3.882) 5.762 7.973 ( 6.865 2.094 5.899) 9.290 8.023 ( 7.112 -3.791 5.405) 9.704 9.279 ( -3.587 2.278 -1.846) 4.633 9.341 ( -3.335 -4.044 -0.859) 5.312 9.687 ( -2.619 3.862 -1.018) 4.776 9.771 ( 0.476 -4.218 0.274) 4.254 10.105 ( -7.823 2.933 -4.621) 9.547 10.152 ( -9.029 -1.944 -5.006) 10.505 11.302 ( 2.183 3.471 1.322) 4.308 11.360 ( 1.381 -2.434 2.911) 4.038 11.537 ( 0.532 3.036 0.257) 3.093 11.579 ( 1.379 -1.001 -1.370) 2.186 11.770 ( 3.744 1.762 4.240) 5.924 11.815 ( 3.289 -2.554 1.486) 4.421 12.110 ( 5.471 0.556 -0.741) 5.549 12.140 ( 4.742 -2.636 1.563) 5.646 12.639 ( 8.975 2.516 2.037) 9.542 12.649 ( 8.256 1.503 3.268) 9.006 16.110 ( -1.535 1.052 -1.168) 2.197 16.126 ( -1.310 -0.478 -1.182) 1.828 17.022 ( 2.526 4.657 5.738) 7.810 17.099 ( 2.890 -2.945 5.119) 6.575 17.493 ( 9.097 6.243 0.273) 11.036 17.674 ( 13.392 -11.638 1.363) 17.794 19.031 ( -17.332 8.928 -8.279) 21.181 19.192 ( -16.300 -7.035 -3.456) 18.087 ======================= Grid point 349 (168/170) ======================= q-point: ( 0.27 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.073 ( 2.129 9.497 -2.102) 9.957 2.245 ( 2.070 -6.815 -0.295) 7.129 2.341 ( 1.498 11.491 5.222) 12.710 2.501 ( 0.359 -2.095 6.306) 6.655 2.660 ( 8.240 3.135 -2.495) 9.163 2.714 ( 6.190 -2.218 -3.531) 7.463 3.088 ( 3.727 0.744 -0.025) 3.801 3.115 ( 3.438 -2.235 -1.129) 4.253 3.170 ( -1.063 -1.333 -0.647) 1.824 3.270 ( 0.119 -9.932 -4.190) 10.780 3.964 ( 0.402 5.152 4.506) 6.856 3.997 ( 2.720 2.547 3.760) 5.294 4.425 ( -9.368 7.619 -2.934) 12.427 4.508 ( -8.161 0.947 0.092) 8.216 4.698 ( -2.447 0.727 4.569) 5.233 4.764 ( -5.884 -2.662 -3.361) 7.281 4.871 ( -4.334 -0.821 1.434) 4.639 4.904 ( -1.083 1.435 -4.163) 4.535 5.290 ( -1.937 2.172 0.040) 2.910 5.394 ( -6.089 -6.186 -0.774) 8.714 5.564 ( -1.193 2.678 -10.216) 10.628 5.621 ( -3.961 -3.130 -12.492) 13.474 5.855 ( -7.601 4.855 -0.173) 9.021 6.000 ( -2.948 -7.185 -0.422) 7.778 6.222 ( 2.871 1.799 2.472) 4.194 6.291 ( -0.683 -5.771 0.536) 5.836 6.630 ( -2.754 1.435 5.894) 6.662 6.689 ( -3.863 -4.071 6.648) 8.700 6.985 ( 1.784 4.112 -5.978) 7.471 7.097 ( 3.467 -6.269 0.504) 7.182 7.486 ( 2.303 6.925 -3.211) 7.973 7.586 ( 2.732 -1.655 -1.907) 3.720 7.638 ( -0.259 4.225 1.685) 4.556 7.716 ( -3.074 -3.614 2.698) 5.458 8.151 ( 5.884 2.077 4.878) 7.920 8.181 ( 5.300 -1.472 3.329) 6.429 9.149 ( -6.396 2.365 -4.842) 8.363 9.218 ( -7.167 -4.591 -4.172) 9.479 9.598 ( -4.383 4.813 -2.799) 7.086 9.712 ( -4.756 -6.158 -3.563) 8.557 10.029 ( 1.190 0.747 0.123) 1.410 10.043 ( -0.181 -0.716 -0.735) 1.042 11.370 ( 2.916 2.638 2.965) 4.925 11.404 ( 1.423 -1.329 1.652) 2.554 11.576 ( 1.165 4.101 3.617) 5.591 11.629 ( 3.220 -0.429 2.332) 3.999 11.883 ( 3.272 -0.598 0.288) 3.338 11.892 ( 3.892 -1.269 2.909) 5.022 12.202 ( 6.044 1.948 0.268) 6.356 12.236 ( 4.232 -2.004 2.003) 5.093 12.822 ( 9.170 3.470 3.006) 10.255 12.839 ( 8.803 1.664 4.299) 9.937 16.072 ( -1.291 0.758 -1.122) 1.871 16.089 ( -1.361 -0.869 -1.165) 1.991 17.133 ( 2.047 4.743 5.825) 7.786 17.201 ( 2.551 -1.984 3.937) 5.093 17.620 ( 5.816 8.987 -2.039) 10.898 17.868 ( 9.127 -15.773 -4.171) 18.694 18.647 ( -16.148 12.424 -4.932) 20.963 18.875 ( -15.064 -10.681 -2.665) 18.657 ======================= Grid point 350 (169/170) ======================= q-point: ( 0.36 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.104 ( 2.749 7.357 0.338) 7.861 2.235 ( 0.895 -5.319 -3.081) 6.212 2.446 ( 0.445 10.712 6.461) 12.518 2.573 ( 1.393 -1.297 3.205) 3.728 2.743 ( 7.053 4.423 -6.776) 10.734 2.815 ( 7.478 -1.795 -3.201) 8.330 3.070 ( -3.067 1.947 -2.732) 4.545 3.156 ( 0.677 -2.514 0.457) 2.644 3.214 ( 3.270 -1.824 3.623) 5.210 3.268 ( 5.113 -9.159 6.355) 12.265 4.040 ( 0.062 5.254 4.886) 7.175 4.067 ( 0.049 2.744 1.892) 3.334 4.216 ( -9.571 6.200 -2.907) 11.769 4.342 ( -10.850 -5.019 -0.305) 11.959 4.649 ( -1.360 4.116 -8.506) 9.547 4.687 ( 1.350 -0.085 -3.891) 4.119 4.823 ( -3.838 -1.712 -1.413) 4.434 4.863 ( -2.904 -1.644 4.762) 5.815 5.153 ( -5.036 1.341 -6.534) 8.357 5.228 ( -6.775 -5.721 -5.386) 10.375 5.511 ( 1.305 1.220 -1.767) 2.513 5.534 ( 0.976 -1.210 0.067) 1.556 5.759 ( -3.979 2.597 0.901) 4.836 5.922 ( -4.361 -11.159 -1.168) 12.038 6.331 ( 3.847 2.255 4.320) 6.209 6.380 ( 5.065 -2.210 5.097) 7.518 6.653 ( -0.373 0.398 2.716) 2.770 6.684 ( -3.527 -3.171 4.483) 6.526 6.964 ( 1.278 8.007 -2.431) 8.465 7.147 ( 1.442 -9.321 -0.788) 9.465 7.456 ( -0.991 8.269 -2.972) 8.842 7.586 ( 0.739 -2.101 -3.449) 4.106 7.632 ( -0.270 2.356 -0.823) 2.510 7.661 ( -5.185 -1.863 1.080) 5.614 8.270 ( 3.527 1.705 2.006) 4.401 8.280 ( 3.033 0.579 1.843) 3.596 8.994 ( -4.568 0.660 -4.438) 6.403 9.044 ( -6.137 -4.270 -4.680) 8.820 9.512 ( -2.281 2.744 -1.757) 3.977 9.592 ( -3.675 -5.097 -3.586) 7.234 10.067 ( 1.614 0.303 0.860) 1.854 10.072 ( 1.926 -0.184 0.708) 2.060 11.452 ( 1.742 2.180 3.745) 4.671 11.470 ( 3.665 0.819 1.846) 4.185 11.649 ( 1.495 4.913 4.717) 6.973 11.718 ( 3.441 -0.822 2.738) 4.474 11.903 ( 1.577 0.331 -3.361) 3.727 11.955 ( 0.170 -3.921 1.327) 4.143 12.311 ( 5.000 1.924 1.424) 5.544 12.326 ( 3.417 -0.031 2.031) 3.975 13.010 ( 8.125 4.599 3.622) 10.014 13.032 ( 7.256 2.458 4.687) 8.981 16.044 ( -0.677 0.251 -0.763) 1.051 16.056 ( -1.017 -0.960 -0.835) 1.629 17.206 ( -0.256 4.355 3.404) 5.533 17.263 ( 0.926 -1.167 1.189) 1.907 17.628 ( -0.303 6.393 -2.913) 7.032 17.812 ( -3.524 -11.462 -11.168) 16.386 18.480 ( -2.024 8.563 2.308) 9.097 18.670 ( -7.689 -10.310 0.460) 12.869 ======================= Grid point 351 (170/170) ======================= q-point: ( 0.45 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.162 ( 1.913 3.938 2.128) 4.867 2.209 ( -0.581 -0.597 -2.216) 2.368 2.516 ( 0.808 5.012 4.831) 7.008 2.586 ( -0.280 -1.848 -3.654) 4.104 2.776 ( 4.224 1.933 -3.459) 5.792 2.808 ( -0.413 -2.119 -3.093) 3.772 3.070 ( 1.948 3.956 1.763) 4.749 3.131 ( -2.417 -2.102 -1.412) 3.501 3.377 ( 7.973 4.404 6.922) 11.440 3.463 ( 1.900 -2.906 6.900) 7.724 3.983 ( -4.638 1.898 -2.084) 5.428 4.013 ( -6.004 -0.066 -2.615) 6.549 4.121 ( 1.222 2.321 -0.040) 2.623 4.189 ( -5.435 -4.588 -1.906) 7.364 4.591 ( 3.415 5.201 -1.280) 6.352 4.699 ( -0.187 -2.186 -5.877) 6.273 4.715 ( 1.115 0.231 -0.504) 1.245 4.824 ( -7.734 -5.499 2.394) 9.787 5.076 ( -0.314 -0.681 0.160) 0.766 5.107 ( -2.201 -3.901 -2.340) 5.054 5.531 ( 2.974 3.749 -1.436) 4.996 5.555 ( -1.534 2.695 2.131) 3.763 5.755 ( 1.990 -3.659 1.530) 4.437 5.835 ( -4.184 -9.428 -1.686) 10.452 6.440 ( 3.333 2.090 3.308) 5.140 6.484 ( 0.378 -2.128 2.005) 2.948 6.676 ( 2.397 1.529 -1.125) 3.058 6.692 ( -1.856 0.457 3.285) 3.800 6.984 ( 2.118 4.277 2.444) 5.362 7.092 ( -3.631 -4.669 -4.887) 7.672 7.439 ( 0.742 2.020 1.998) 2.937 7.513 ( -3.007 -4.201 -4.097) 6.594 7.619 ( -0.086 2.404 -0.433) 2.444 7.622 ( -0.497 2.334 -0.104) 2.388 8.324 ( 1.742 1.735 -0.021) 2.459 8.328 ( 0.509 1.384 1.184) 1.891 8.910 ( -1.007 -1.586 -1.522) 2.418 8.928 ( -2.659 -3.306 -2.106) 4.737 9.483 ( -0.062 -0.078 0.178) 0.204 9.512 ( -1.867 -2.916 -2.091) 4.045 10.095 ( 0.606 0.209 0.532) 0.833 10.098 ( 0.647 -0.105 -0.007) 0.655 11.517 ( 0.743 3.286 3.051) 4.545 11.530 ( 1.832 2.386 -0.380) 3.033 11.731 ( 1.632 4.782 4.535) 6.789 11.782 ( 0.785 2.312 -0.438) 2.481 11.886 ( 2.384 -3.368 -2.365) 4.756 11.934 ( -2.899 -5.622 -0.228) 6.330 12.384 ( 1.959 1.810 0.494) 2.712 12.386 ( 1.232 1.427 1.014) 2.141 13.152 ( 4.091 4.932 1.581) 6.600 13.162 ( 2.371 3.913 2.435) 5.183 16.032 ( -0.018 -0.307 -0.234) 0.386 16.037 ( -0.500 -0.748 -0.312) 0.952 17.215 ( -0.683 2.417 1.571) 2.962 17.249 ( -1.435 -0.717 -2.129) 2.666 17.599 ( -0.884 1.104 1.055) 1.765 17.643 ( -2.137 -3.083 -5.943) 7.028 18.529 ( 3.176 0.582 1.297) 3.480 18.591 ( -3.864 -5.380 0.706) 6.662 =================== 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 3/35640 10.0 1256.547 1635.132 1291.201 0.000 -6.330 0.000 3/35640 20.0 97.764 110.225 93.705 0.000 7.883 0.000 3/35640 30.0 30.385 34.013 29.921 0.000 1.821 0.000 3/35640 40.0 15.314 16.977 15.358 0.000 0.766 0.000 3/35640 50.0 9.629 10.582 9.777 0.000 0.435 0.000 3/35640 60.0 6.852 7.478 7.019 0.000 0.290 0.000 3/35640 70.0 5.271 5.722 5.434 0.000 0.213 0.000 3/35640 80.0 4.274 4.620 4.425 0.000 0.168 0.000 3/35640 90.0 3.596 3.875 3.734 0.000 0.138 0.000 3/35640 100.0 3.108 3.341 3.234 0.000 0.118 0.000 3/35640 110.0 2.742 2.941 2.857 0.000 0.103 0.000 3/35640 120.0 2.458 2.632 2.562 0.000 0.091 0.000 3/35640 130.0 2.231 2.385 2.326 0.000 0.082 0.000 3/35640 140.0 2.046 2.185 2.133 0.000 0.075 0.000 3/35640 150.0 1.891 2.018 1.971 0.000 0.069 0.000 3/35640 160.0 1.761 1.878 1.834 0.000 0.064 0.000 3/35640 170.0 1.650 1.758 1.717 0.000 0.059 0.000 3/35640 180.0 1.553 1.654 1.615 0.000 0.056 0.000 3/35640 190.0 1.468 1.563 1.525 0.000 0.052 0.000 3/35640 200.0 1.393 1.483 1.446 0.000 0.049 0.000 3/35640 210.0 1.326 1.411 1.375 0.000 0.046 0.000 3/35640 220.0 1.266 1.347 1.311 0.000 0.044 0.000 3/35640 230.0 1.211 1.289 1.254 0.000 0.042 0.000 3/35640 240.0 1.162 1.236 1.202 0.000 0.040 0.000 3/35640 250.0 1.116 1.188 1.154 0.000 0.038 0.000 3/35640 260.0 1.075 1.144 1.110 0.000 0.037 0.000 3/35640 270.0 1.036 1.103 1.069 0.000 0.035 0.000 3/35640 280.0 1.001 1.065 1.032 0.000 0.034 0.000 3/35640 290.0 0.968 1.030 0.997 0.000 0.032 0.000 3/35640 300.0 0.937 0.997 0.964 0.000 0.031 0.000 3/35640 310.0 0.908 0.966 0.934 0.000 0.030 0.000 3/35640 320.0 0.881 0.937 0.906 0.000 0.029 0.000 3/35640 330.0 0.855 0.910 0.879 0.000 0.028 0.000 3/35640 340.0 0.831 0.885 0.854 0.000 0.027 0.000 3/35640 350.0 0.809 0.861 0.830 0.000 0.026 0.000 3/35640 360.0 0.787 0.838 0.808 0.000 0.025 0.000 3/35640 370.0 0.767 0.817 0.787 0.000 0.025 0.000 3/35640 380.0 0.748 0.796 0.766 0.000 0.024 0.000 3/35640 390.0 0.729 0.777 0.747 0.000 0.023 0.000 3/35640 400.0 0.712 0.758 0.729 0.000 0.023 0.000 3/35640 410.0 0.695 0.741 0.712 0.000 0.022 0.000 3/35640 420.0 0.680 0.724 0.696 0.000 0.022 0.000 3/35640 430.0 0.665 0.708 0.680 0.000 0.021 0.000 3/35640 440.0 0.650 0.693 0.665 0.000 0.021 0.000 3/35640 450.0 0.636 0.678 0.650 0.000 0.020 0.000 3/35640 460.0 0.623 0.664 0.637 0.000 0.020 0.000 3/35640 470.0 0.610 0.650 0.623 0.000 0.019 0.000 3/35640 480.0 0.598 0.637 0.611 0.000 0.019 0.000 3/35640 490.0 0.586 0.625 0.599 0.000 0.018 0.000 3/35640 500.0 0.575 0.613 0.587 0.000 0.018 0.000 3/35640 510.0 0.564 0.601 0.576 0.000 0.018 0.000 3/35640 520.0 0.554 0.590 0.565 0.000 0.017 0.000 3/35640 530.0 0.544 0.579 0.555 0.000 0.017 0.000 3/35640 540.0 0.534 0.569 0.545 0.000 0.017 0.000 3/35640 550.0 0.524 0.559 0.535 0.000 0.016 0.000 3/35640 560.0 0.515 0.549 0.526 0.000 0.016 0.000 3/35640 570.0 0.507 0.540 0.517 0.000 0.016 0.000 3/35640 580.0 0.498 0.531 0.508 0.000 0.015 0.000 3/35640 590.0 0.490 0.522 0.499 0.000 0.015 0.000 3/35640 600.0 0.482 0.514 0.491 0.000 0.015 0.000 3/35640 610.0 0.474 0.506 0.483 0.000 0.015 0.000 3/35640 620.0 0.467 0.498 0.476 0.000 0.014 0.000 3/35640 630.0 0.460 0.490 0.468 0.000 0.014 0.000 3/35640 640.0 0.453 0.483 0.461 0.000 0.014 0.000 3/35640 650.0 0.446 0.476 0.454 0.000 0.014 0.000 3/35640 660.0 0.439 0.469 0.447 0.000 0.013 0.000 3/35640 670.0 0.433 0.462 0.441 0.000 0.013 0.000 3/35640 680.0 0.427 0.455 0.434 0.000 0.013 0.000 3/35640 690.0 0.421 0.449 0.428 0.000 0.013 0.000 3/35640 700.0 0.415 0.442 0.422 0.000 0.013 0.000 3/35640 710.0 0.409 0.436 0.416 0.000 0.012 0.000 3/35640 720.0 0.404 0.430 0.411 0.000 0.012 0.000 3/35640 730.0 0.398 0.425 0.405 0.000 0.012 0.000 3/35640 740.0 0.393 0.419 0.400 0.000 0.012 0.000 3/35640 750.0 0.388 0.414 0.395 0.000 0.012 0.000 3/35640 760.0 0.383 0.408 0.389 0.000 0.012 0.000 3/35640 770.0 0.378 0.403 0.384 0.000 0.011 0.000 3/35640 780.0 0.373 0.398 0.380 0.000 0.011 0.000 3/35640 790.0 0.369 0.393 0.375 0.000 0.011 0.000 3/35640 800.0 0.364 0.388 0.370 0.000 0.011 0.000 3/35640 810.0 0.360 0.384 0.366 0.000 0.011 0.000 3/35640 820.0 0.355 0.379 0.361 0.000 0.011 0.000 3/35640 830.0 0.351 0.375 0.357 0.000 0.011 0.000 3/35640 840.0 0.347 0.370 0.353 0.000 0.010 0.000 3/35640 850.0 0.343 0.366 0.349 0.000 0.010 0.000 3/35640 860.0 0.339 0.362 0.345 0.000 0.010 0.000 3/35640 870.0 0.335 0.358 0.341 0.000 0.010 0.000 3/35640 880.0 0.332 0.354 0.337 0.000 0.010 0.000 3/35640 890.0 0.328 0.350 0.333 0.000 0.010 0.000 3/35640 900.0 0.324 0.346 0.330 0.000 0.010 0.000 3/35640 910.0 0.321 0.342 0.326 0.000 0.010 0.000 3/35640 920.0 0.317 0.339 0.322 0.000 0.010 0.000 3/35640 930.0 0.314 0.335 0.319 0.000 0.009 0.000 3/35640 940.0 0.311 0.331 0.316 0.000 0.009 0.000 3/35640 950.0 0.307 0.328 0.312 0.000 0.009 0.000 3/35640 960.0 0.304 0.325 0.309 0.000 0.009 0.000 3/35640 970.0 0.301 0.321 0.306 0.000 0.009 0.000 3/35640 980.0 0.298 0.318 0.303 0.000 0.009 0.000 3/35640 990.0 0.295 0.315 0.300 0.000 0.009 0.000 3/35640 1000.0 0.292 0.312 0.297 0.000 0.009 0.000 3/35640 Thermal conductivity related properties were written into "kappa-m1196.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 19:37:01]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|