----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 21:25:04]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 2] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) Number of symmetry operations in supercell: 32 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.834259870006468 -4.858654840000001 0.000000000000000 b 2.834259870006468 4.858654840000001 0.000000000000000 c -1.974290341066733 0.000000000000000 5.232702677807261 Atomic positions (fractional): *1 Na 0.66634210248515 0.33365789751485 0.00000000000000 22.990 *2 Na 0.82784170708254 0.17215829291746 0.50000000000000 22.990 3 Na 0.33365789751485 0.66634210248515 0.00000000000000 22.990 4 Na 0.17215829291746 0.82784170708254 0.50000000000000 22.990 *5 Na 0.50000000000000 0.50000000000000 0.50000000000000 22.990 *6 Re 0.00000000000000 0.00000000000000 0.00000000000000 186.207 *7 O 0.79598100356697 0.79598100356697 0.20465190776690 15.999 8 O 0.20401899643303 0.20401899643303 0.79534809223310 15.999 *9 O 0.92979990308352 0.65188444505779 0.78576943191596 15.999 10 O 0.34811555494221 0.07020009691648 0.21423056808404 15.999 11 O 0.07020009691648 0.34811555494221 0.21423056808404 15.999 12 O 0.65188444505779 0.92979990308352 0.78576943191596 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.668519740012935 0.000000000000000 0.000000000000000 b 0.000000000000000 9.717309680000001 0.000000000000000 c -1.974290341066733 0.000000000000000 5.232702677807261 Atomic positions (fractional): *1 Na 0.50000000000000 0.83365789751485 0.00000000000000 22.990 > 1 *2 Na 0.50000000000000 0.67215829291746 0.50000000000000 22.990 > 2 3 Na 0.50000000000000 0.16634210248515 0.00000000000000 22.990 > 3 4 Na 0.50000000000000 0.32784170708254 0.50000000000000 22.990 > 4 *5 Na 0.50000000000000 0.00000000000000 0.50000000000000 22.990 > 5 6 Na 0.00000000000000 0.33365789751485 0.00000000000000 22.990 > 1 7 Na 0.00000000000000 0.17215829291746 0.50000000000000 22.990 > 2 8 Na 0.00000000000000 0.66634210248515 0.00000000000000 22.990 > 3 9 Na 0.00000000000000 0.82784170708254 0.50000000000000 22.990 > 4 10 Na 0.00000000000000 0.50000000000000 0.50000000000000 22.990 > 5 *11 Re 0.00000000000000 0.00000000000000 0.00000000000000 186.207 > 6 12 Re 0.50000000000000 0.50000000000000 0.00000000000000 186.207 > 6 *13 O 0.79598100356697 0.00000000000000 0.20465190776690 15.999 > 7 14 O 0.20401899643303 0.00000000000000 0.79534809223310 15.999 > 8 *15 O 0.79084217407065 0.86104227098714 0.78576943191596 15.999 > 9 16 O 0.20915782592935 0.86104227098714 0.21423056808404 15.999 > 10 17 O 0.20915782592935 0.13895772901286 0.21423056808404 15.999 > 11 18 O 0.79084217407065 0.13895772901286 0.78576943191596 15.999 > 12 19 O 0.29598100356697 0.50000000000000 0.20465190776690 15.999 > 7 20 O 0.70401899643303 0.50000000000000 0.79534809223310 15.999 > 8 21 O 0.29084217407065 0.36104227098714 0.78576943191596 15.999 > 9 22 O 0.70915782592935 0.36104227098714 0.21423056808404 15.999 > 10 23 O 0.70915782592935 0.63895772901286 0.21423056808404 15.999 > 11 24 O 0.29084217407065 0.63895772901286 0.78576943191596 15.999 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.337039480025870 0.000000000000000 0.000000000000000 b 0.000000000000000 9.717309680000001 0.000000000000000 c -3.948580682133466 0.000000000000000 10.465405355614521 Atomic positions (fractional): *1 Na 0.25000000000000 0.83365789751485 0.00000000000000 22.990 > 1 2 Na 0.75000000000000 0.83365789751485 0.00000000000000 22.990 > 1 3 Na 0.25000000000000 0.83365789751485 0.50000000000000 22.990 > 1 4 Na 0.75000000000000 0.83365789751485 0.50000000000000 22.990 > 1 *5 Na 0.25000000000000 0.67215829291746 0.25000000000000 22.990 > 2 6 Na 0.75000000000000 0.67215829291746 0.25000000000000 22.990 > 2 7 Na 0.25000000000000 0.67215829291746 0.75000000000000 22.990 > 2 8 Na 0.75000000000000 0.67215829291746 0.75000000000000 22.990 > 2 9 Na 0.25000000000000 0.16634210248515 0.00000000000000 22.990 > 3 10 Na 0.75000000000000 0.16634210248515 0.00000000000000 22.990 > 3 11 Na 0.25000000000000 0.16634210248515 0.50000000000000 22.990 > 3 12 Na 0.75000000000000 0.16634210248515 0.50000000000000 22.990 > 3 13 Na 0.25000000000000 0.32784170708254 0.25000000000000 22.990 > 4 14 Na 0.75000000000000 0.32784170708254 0.25000000000000 22.990 > 4 15 Na 0.25000000000000 0.32784170708254 0.75000000000000 22.990 > 4 16 Na 0.75000000000000 0.32784170708254 0.75000000000000 22.990 > 4 *17 Na 0.25000000000000 0.00000000000000 0.25000000000000 22.990 > 5 18 Na 0.75000000000000 0.00000000000000 0.25000000000000 22.990 > 5 19 Na 0.25000000000000 0.00000000000000 0.75000000000000 22.990 > 5 20 Na 0.75000000000000 0.00000000000000 0.75000000000000 22.990 > 5 21 Na 0.00000000000000 0.33365789751485 0.00000000000000 22.990 > 1 22 Na 0.50000000000000 0.33365789751485 0.00000000000000 22.990 > 1 23 Na 0.00000000000000 0.33365789751485 0.50000000000000 22.990 > 1 24 Na 0.50000000000000 0.33365789751485 0.50000000000000 22.990 > 1 25 Na 0.00000000000000 0.17215829291746 0.25000000000000 22.990 > 2 26 Na 0.50000000000000 0.17215829291746 0.25000000000000 22.990 > 2 27 Na 0.00000000000000 0.17215829291746 0.75000000000000 22.990 > 2 28 Na 0.50000000000000 0.17215829291746 0.75000000000000 22.990 > 2 29 Na 0.00000000000000 0.66634210248515 0.00000000000000 22.990 > 3 30 Na 0.50000000000000 0.66634210248515 0.00000000000000 22.990 > 3 31 Na 0.00000000000000 0.66634210248515 0.50000000000000 22.990 > 3 32 Na 0.50000000000000 0.66634210248515 0.50000000000000 22.990 > 3 33 Na 0.00000000000000 0.82784170708254 0.25000000000000 22.990 > 4 34 Na 0.50000000000000 0.82784170708254 0.25000000000000 22.990 > 4 35 Na 0.00000000000000 0.82784170708254 0.75000000000000 22.990 > 4 36 Na 0.50000000000000 0.82784170708254 0.75000000000000 22.990 > 4 37 Na 0.00000000000000 0.50000000000000 0.25000000000000 22.990 > 5 38 Na 0.50000000000000 0.50000000000000 0.25000000000000 22.990 > 5 39 Na 0.00000000000000 0.50000000000000 0.75000000000000 22.990 > 5 40 Na 0.50000000000000 0.50000000000000 0.75000000000000 22.990 > 5 *41 Re 0.00000000000000 0.00000000000000 0.00000000000000 186.207 > 6 42 Re 0.50000000000000 0.00000000000000 0.00000000000000 186.207 > 6 43 Re 0.00000000000000 0.00000000000000 0.50000000000000 186.207 > 6 44 Re 0.50000000000000 0.00000000000000 0.50000000000000 186.207 > 6 45 Re 0.25000000000000 0.50000000000000 0.00000000000000 186.207 > 6 46 Re 0.75000000000000 0.50000000000000 0.00000000000000 186.207 > 6 47 Re 0.25000000000000 0.50000000000000 0.50000000000000 186.207 > 6 48 Re 0.75000000000000 0.50000000000000 0.50000000000000 186.207 > 6 *49 O 0.39799050178349 0.00000000000000 0.10232595388345 15.999 > 7 50 O 0.89799050178349 0.00000000000000 0.10232595388345 15.999 > 7 51 O 0.39799050178349 0.00000000000000 0.60232595388345 15.999 > 7 52 O 0.89799050178349 0.00000000000000 0.60232595388345 15.999 > 7 53 O 0.10200949821651 0.00000000000000 0.39767404611655 15.999 > 8 54 O 0.60200949821651 0.00000000000000 0.39767404611655 15.999 > 8 55 O 0.10200949821651 0.00000000000000 0.89767404611655 15.999 > 8 56 O 0.60200949821651 0.00000000000000 0.89767404611655 15.999 > 8 *57 O 0.39542108703533 0.86104227098714 0.39288471595798 15.999 > 9 58 O 0.89542108703533 0.86104227098714 0.39288471595798 15.999 > 9 59 O 0.39542108703533 0.86104227098714 0.89288471595798 15.999 > 9 60 O 0.89542108703533 0.86104227098714 0.89288471595798 15.999 > 9 61 O 0.10457891296467 0.86104227098714 0.10711528404202 15.999 > 10 62 O 0.60457891296467 0.86104227098714 0.10711528404202 15.999 > 10 63 O 0.10457891296467 0.86104227098714 0.60711528404202 15.999 > 10 64 O 0.60457891296467 0.86104227098714 0.60711528404202 15.999 > 10 65 O 0.10457891296467 0.13895772901286 0.10711528404202 15.999 > 11 66 O 0.60457891296467 0.13895772901286 0.10711528404202 15.999 > 11 67 O 0.10457891296467 0.13895772901286 0.60711528404202 15.999 > 11 68 O 0.60457891296467 0.13895772901286 0.60711528404202 15.999 > 11 69 O 0.39542108703533 0.13895772901286 0.39288471595798 15.999 > 12 70 O 0.89542108703533 0.13895772901286 0.39288471595798 15.999 > 12 71 O 0.39542108703533 0.13895772901286 0.89288471595798 15.999 > 12 72 O 0.89542108703533 0.13895772901286 0.89288471595798 15.999 > 12 73 O 0.14799050178349 0.50000000000000 0.10232595388345 15.999 > 7 74 O 0.64799050178349 0.50000000000000 0.10232595388345 15.999 > 7 75 O 0.14799050178349 0.50000000000000 0.60232595388345 15.999 > 7 76 O 0.64799050178349 0.50000000000000 0.60232595388345 15.999 > 7 77 O 0.35200949821651 0.50000000000000 0.39767404611655 15.999 > 8 78 O 0.85200949821651 0.50000000000000 0.39767404611655 15.999 > 8 79 O 0.35200949821651 0.50000000000000 0.89767404611655 15.999 > 8 80 O 0.85200949821651 0.50000000000000 0.89767404611655 15.999 > 8 81 O 0.14542108703533 0.36104227098714 0.39288471595798 15.999 > 9 82 O 0.64542108703533 0.36104227098714 0.39288471595798 15.999 > 9 83 O 0.14542108703533 0.36104227098714 0.89288471595798 15.999 > 9 84 O 0.64542108703533 0.36104227098714 0.89288471595798 15.999 > 9 85 O 0.35457891296467 0.36104227098714 0.10711528404202 15.999 > 10 86 O 0.85457891296467 0.36104227098714 0.10711528404202 15.999 > 10 87 O 0.35457891296467 0.36104227098714 0.60711528404202 15.999 > 10 88 O 0.85457891296467 0.36104227098714 0.60711528404202 15.999 > 10 89 O 0.35457891296467 0.63895772901286 0.10711528404202 15.999 > 11 90 O 0.85457891296467 0.63895772901286 0.10711528404202 15.999 > 11 91 O 0.35457891296467 0.63895772901286 0.60711528404202 15.999 > 11 92 O 0.85457891296467 0.63895772901286 0.60711528404202 15.999 > 11 93 O 0.14542108703533 0.63895772901286 0.39288471595798 15.999 > 12 94 O 0.64542108703533 0.63895772901286 0.39288471595798 15.999 > 12 95 O 0.14542108703533 0.63895772901286 0.89288471595798 15.999 > 12 96 O 0.64542108703533 0.63895772901286 0.89288471595798 15.999 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.7736800 0.0000000 -0.0203433 0.0000000 3.7372121 0.0000000 -0.0203415 0.0000000 3.6514445 -------------------------- Born effective charges -------------------------- 1 Na 1.2369734 0.0000000 0.0269220 0.0000000 1.2207030 0.0000000 -0.0075426 0.0000000 0.4943492 2 Na 0.7911089 0.0000000 -0.0630348 0.0000000 1.2110201 0.0000000 -0.0250232 0.0000000 1.4881905 3 Na 1.2369734 0.0000000 0.0269220 0.0000000 1.2207030 0.0000000 -0.0075426 0.0000000 0.4943492 4 Na 0.7911089 0.0000000 -0.0630348 0.0000000 1.2110201 0.0000000 -0.0250232 0.0000000 1.4881905 5 Na 1.3708124 0.0000000 0.0871018 0.0000000 0.5620425 0.0000000 0.0681165 0.0000000 1.4628332 6 Re 6.7105454 0.0000000 0.0173369 0.0000000 6.7506906 0.0000000 0.0322037 0.0000000 6.2820302 7 O -2.8396283 0.0000000 1.0915790 0.0000000 -1.1523898 0.0000000 1.0019240 0.0000000 -1.9163808 8 O -2.8396283 0.0000000 1.0915790 0.0000000 -1.1523898 0.0000000 1.0019240 0.0000000 -1.9163808 9 O -1.6145664 -0.7147628 -0.5538428 -0.6755249 -2.4678499 -0.9623421 -0.5097591 -0.8707188 -1.9692953 10 O -1.6145664 0.7147628 -0.5538428 0.6755249 -2.4678499 0.9623421 -0.5097591 0.8707188 -1.9692953 11 O -1.6145664 -0.7147628 -0.5538428 -0.6755249 -2.4678499 -0.9623421 -0.5097591 -0.8707188 -1.9692953 12 O -1.6145664 0.7147628 -0.5538428 0.6755249 -2.4678499 0.9623421 -0.5097591 0.8707188 -1.9692953 ---------------------------------------------------------------------------- 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: 288/288 Permutation basis: 6444/6444 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1438 Number of blocks in projector: 1438 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: 340 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 240 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 240 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 206 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 206 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 206 Use standard eigh solver. Tree of FC basis block matrices: - (1438, 1405), data: False |-- (206, 200), data: True |-- (206, 200), data: True |-- (206, 200), data: True |-- (240, 238), data: True |-- (240, 238), data: True |-- (340, 329), data: True ----- Solver_atoms: 1 -- 96 / 96 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 100 / 400 - Time: 1.607 Solver_block: 200 / 400 - Time: 1.621 Solver_block: 300 / 400 - Time: 1.622 Solver_block: 400 / 400 - Time: 1.617 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 6.503 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 288/288 Permutation basis: 6444/6444 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1438 Number of blocks in projector: 1438 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: 340 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 240 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 240 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 206 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 206 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 206 Use standard eigh solver. Tree of FC basis block matrices: - (1438, 1405), data: False |-- (206, 200), data: True |-- (206, 200), data: True |-- (206, 200), data: True |-- (240, 238), data: True |-- (240, 238), data: True |-- (340, 329), data: True Max drift after symmetrization by symfc projector: -0.00000000 (xx) -0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 21:25:25]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 21:25:26]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 2] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.834259870006468 -4.858654840000001 0.000000000000000 b 2.834259870006468 4.858654840000001 0.000000000000000 c -1.974290341066733 0.000000000000000 5.232702677807261 Atomic positions (fractional): 1 Na 0.66634210248515 0.33365789751485 0.00000000000000 22.990 2 Na 0.82784170708254 0.17215829291746 0.50000000000000 22.990 3 Na 0.33365789751485 0.66634210248515 0.00000000000000 22.990 4 Na 0.17215829291746 0.82784170708254 0.50000000000000 22.990 5 Na 0.50000000000000 0.50000000000000 0.50000000000000 22.990 6 Re 0.00000000000000 0.00000000000000 0.00000000000000 186.207 7 O 0.79598100356697 0.79598100356697 0.20465190776690 15.999 8 O 0.20401899643303 0.20401899643303 0.79534809223310 15.999 9 O 0.92979990308352 0.65188444505779 0.78576943191596 15.999 10 O 0.34811555494221 0.07020009691648 0.21423056808404 15.999 11 O 0.07020009691648 0.34811555494221 0.21423056808404 15.999 12 O 0.65188444505779 0.92979990308352 0.78576943191596 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.337039480025870 0.000000000000000 0.000000000000000 b 0.000000000000000 9.717309680000001 0.000000000000000 c -3.948580682133466 0.000000000000000 10.465405355614521 Atomic positions (fractional): 1 Na 0.25000000000000 0.83365789751485 0.00000000000000 22.990 > 1 2 Na 0.75000000000000 0.83365789751485 0.00000000000000 22.990 > 1 3 Na 0.25000000000000 0.83365789751485 0.50000000000000 22.990 > 1 4 Na 0.75000000000000 0.83365789751485 0.50000000000000 22.990 > 1 5 Na 0.25000000000000 0.67215829291746 0.25000000000000 22.990 > 5 6 Na 0.75000000000000 0.67215829291746 0.25000000000000 22.990 > 5 7 Na 0.25000000000000 0.67215829291746 0.75000000000000 22.990 > 5 8 Na 0.75000000000000 0.67215829291746 0.75000000000000 22.990 > 5 9 Na 0.25000000000000 0.16634210248515 0.00000000000000 22.990 > 9 10 Na 0.75000000000000 0.16634210248515 0.00000000000000 22.990 > 9 11 Na 0.25000000000000 0.16634210248515 0.50000000000000 22.990 > 9 12 Na 0.75000000000000 0.16634210248515 0.50000000000000 22.990 > 9 13 Na 0.25000000000000 0.32784170708254 0.25000000000000 22.990 > 13 14 Na 0.75000000000000 0.32784170708254 0.25000000000000 22.990 > 13 15 Na 0.25000000000000 0.32784170708254 0.75000000000000 22.990 > 13 16 Na 0.75000000000000 0.32784170708254 0.75000000000000 22.990 > 13 17 Na 0.25000000000000 0.00000000000000 0.25000000000000 22.990 > 17 18 Na 0.75000000000000 0.00000000000000 0.25000000000000 22.990 > 17 19 Na 0.25000000000000 0.00000000000000 0.75000000000000 22.990 > 17 20 Na 0.75000000000000 0.00000000000000 0.75000000000000 22.990 > 17 21 Na 0.00000000000000 0.33365789751485 0.00000000000000 22.990 > 1 22 Na 0.50000000000000 0.33365789751485 0.00000000000000 22.990 > 1 23 Na 0.00000000000000 0.33365789751485 0.50000000000000 22.990 > 1 24 Na 0.50000000000000 0.33365789751485 0.50000000000000 22.990 > 1 25 Na 0.00000000000000 0.17215829291746 0.25000000000000 22.990 > 5 26 Na 0.50000000000000 0.17215829291746 0.25000000000000 22.990 > 5 27 Na 0.00000000000000 0.17215829291746 0.75000000000000 22.990 > 5 28 Na 0.50000000000000 0.17215829291746 0.75000000000000 22.990 > 5 29 Na 0.00000000000000 0.66634210248515 0.00000000000000 22.990 > 9 30 Na 0.50000000000000 0.66634210248515 0.00000000000000 22.990 > 9 31 Na 0.00000000000000 0.66634210248515 0.50000000000000 22.990 > 9 32 Na 0.50000000000000 0.66634210248515 0.50000000000000 22.990 > 9 33 Na 0.00000000000000 0.82784170708254 0.25000000000000 22.990 > 13 34 Na 0.50000000000000 0.82784170708254 0.25000000000000 22.990 > 13 35 Na 0.00000000000000 0.82784170708254 0.75000000000000 22.990 > 13 36 Na 0.50000000000000 0.82784170708254 0.75000000000000 22.990 > 13 37 Na 0.00000000000000 0.50000000000000 0.25000000000000 22.990 > 17 38 Na 0.50000000000000 0.50000000000000 0.25000000000000 22.990 > 17 39 Na 0.00000000000000 0.50000000000000 0.75000000000000 22.990 > 17 40 Na 0.50000000000000 0.50000000000000 0.75000000000000 22.990 > 17 41 Re 0.00000000000000 0.00000000000000 0.00000000000000 186.207 > 41 42 Re 0.50000000000000 0.00000000000000 0.00000000000000 186.207 > 41 43 Re 0.00000000000000 0.00000000000000 0.50000000000000 186.207 > 41 44 Re 0.50000000000000 0.00000000000000 0.50000000000000 186.207 > 41 45 Re 0.25000000000000 0.50000000000000 0.00000000000000 186.207 > 41 46 Re 0.75000000000000 0.50000000000000 0.00000000000000 186.207 > 41 47 Re 0.25000000000000 0.50000000000000 0.50000000000000 186.207 > 41 48 Re 0.75000000000000 0.50000000000000 0.50000000000000 186.207 > 41 49 O 0.39799050178349 0.00000000000000 0.10232595388345 15.999 > 49 50 O 0.89799050178349 0.00000000000000 0.10232595388345 15.999 > 49 51 O 0.39799050178349 0.00000000000000 0.60232595388345 15.999 > 49 52 O 0.89799050178349 0.00000000000000 0.60232595388345 15.999 > 49 53 O 0.10200949821651 0.00000000000000 0.39767404611655 15.999 > 53 54 O 0.60200949821651 0.00000000000000 0.39767404611655 15.999 > 53 55 O 0.10200949821651 0.00000000000000 0.89767404611655 15.999 > 53 56 O 0.60200949821651 0.00000000000000 0.89767404611655 15.999 > 53 57 O 0.39542108703533 0.86104227098714 0.39288471595798 15.999 > 57 58 O 0.89542108703533 0.86104227098714 0.39288471595798 15.999 > 57 59 O 0.39542108703533 0.86104227098714 0.89288471595798 15.999 > 57 60 O 0.89542108703533 0.86104227098714 0.89288471595798 15.999 > 57 61 O 0.10457891296467 0.86104227098714 0.10711528404202 15.999 > 61 62 O 0.60457891296467 0.86104227098714 0.10711528404202 15.999 > 61 63 O 0.10457891296467 0.86104227098714 0.60711528404202 15.999 > 61 64 O 0.60457891296467 0.86104227098714 0.60711528404202 15.999 > 61 65 O 0.10457891296467 0.13895772901286 0.10711528404202 15.999 > 65 66 O 0.60457891296467 0.13895772901286 0.10711528404202 15.999 > 65 67 O 0.10457891296467 0.13895772901286 0.60711528404202 15.999 > 65 68 O 0.60457891296467 0.13895772901286 0.60711528404202 15.999 > 65 69 O 0.39542108703533 0.13895772901286 0.39288471595798 15.999 > 69 70 O 0.89542108703533 0.13895772901286 0.39288471595798 15.999 > 69 71 O 0.39542108703533 0.13895772901286 0.89288471595798 15.999 > 69 72 O 0.89542108703533 0.13895772901286 0.89288471595798 15.999 > 69 73 O 0.14799050178349 0.50000000000000 0.10232595388345 15.999 > 49 74 O 0.64799050178349 0.50000000000000 0.10232595388345 15.999 > 49 75 O 0.14799050178349 0.50000000000000 0.60232595388345 15.999 > 49 76 O 0.64799050178349 0.50000000000000 0.60232595388345 15.999 > 49 77 O 0.35200949821651 0.50000000000000 0.39767404611655 15.999 > 53 78 O 0.85200949821651 0.50000000000000 0.39767404611655 15.999 > 53 79 O 0.35200949821651 0.50000000000000 0.89767404611655 15.999 > 53 80 O 0.85200949821651 0.50000000000000 0.89767404611655 15.999 > 53 81 O 0.14542108703533 0.36104227098714 0.39288471595798 15.999 > 57 82 O 0.64542108703533 0.36104227098714 0.39288471595798 15.999 > 57 83 O 0.14542108703533 0.36104227098714 0.89288471595798 15.999 > 57 84 O 0.64542108703533 0.36104227098714 0.89288471595798 15.999 > 57 85 O 0.35457891296467 0.36104227098714 0.10711528404202 15.999 > 61 86 O 0.85457891296467 0.36104227098714 0.10711528404202 15.999 > 61 87 O 0.35457891296467 0.36104227098714 0.60711528404202 15.999 > 61 88 O 0.85457891296467 0.36104227098714 0.60711528404202 15.999 > 61 89 O 0.35457891296467 0.63895772901286 0.10711528404202 15.999 > 65 90 O 0.85457891296467 0.63895772901286 0.10711528404202 15.999 > 65 91 O 0.35457891296467 0.63895772901286 0.60711528404202 15.999 > 65 92 O 0.85457891296467 0.63895772901286 0.60711528404202 15.999 > 65 93 O 0.14542108703533 0.63895772901286 0.39288471595798 15.999 > 69 94 O 0.64542108703533 0.63895772901286 0.39288471595798 15.999 > 69 95 O 0.14542108703533 0.63895772901286 0.89288471595798 15.999 > 69 96 O 0.64542108703533 0.63895772901286 0.89288471595798 15.999 > 69 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.7736800 0.0000000 -0.0203433 0.0000000 3.7372121 0.0000000 -0.0203415 0.0000000 3.6514445 -------------------------- Born effective charges -------------------------- 1 Na 1.2369734 0.0000000 0.0269220 0.0000000 1.2207030 0.0000000 -0.0075426 0.0000000 0.4943492 2 Na 0.7911089 0.0000000 -0.0630348 0.0000000 1.2110201 0.0000000 -0.0250232 0.0000000 1.4881905 3 Na 1.2369734 0.0000000 0.0269220 0.0000000 1.2207030 0.0000000 -0.0075426 0.0000000 0.4943492 4 Na 0.7911089 0.0000000 -0.0630348 0.0000000 1.2110201 0.0000000 -0.0250232 0.0000000 1.4881905 5 Na 1.3708124 0.0000000 0.0871018 0.0000000 0.5620425 0.0000000 0.0681165 0.0000000 1.4628332 6 Re 6.7105454 0.0000000 0.0173369 0.0000000 6.7506906 0.0000000 0.0322037 0.0000000 6.2820302 7 O -2.8396283 0.0000000 1.0915790 0.0000000 -1.1523898 0.0000000 1.0019240 0.0000000 -1.9163808 8 O -2.8396283 0.0000000 1.0915790 0.0000000 -1.1523898 0.0000000 1.0019240 0.0000000 -1.9163808 9 O -1.6145664 -0.7147628 -0.5538428 -0.6755249 -2.4678499 -0.9623421 -0.5097591 -0.8707188 -1.9692953 10 O -1.6145664 0.7147628 -0.5538428 0.6755249 -2.4678499 0.9623421 -0.5097591 0.8707188 -1.9692953 11 O -1.6145664 -0.7147628 -0.5538428 -0.6755249 -2.4678499 -0.9623421 -0.5097591 -0.8707188 -1.9692953 12 O -1.6145664 0.7147628 -0.5538428 0.6755249 -2.4678499 0.9623421 -0.5097591 0.8707188 -1.9692953 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Computing fc3[ 5, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Computing fc3[ 41, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] 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] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Computing fc3[ 57, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000005 (yxy) -0.00000005 (yxy) -0.00000005 (yyx) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000001 (zx) -0.00000001 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 21:25:41]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 21:25:41]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 2] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.834259870006468 -4.858654840000001 0.000000000000000 b 2.834259870006468 4.858654840000001 0.000000000000000 c -1.974290341066733 0.000000000000000 5.232702677807261 Atomic positions (fractional): 1 Na 0.66634210248515 0.33365789751485 0.00000000000000 22.990 2 Na 0.82784170708254 0.17215829291746 0.50000000000000 22.990 3 Na 0.33365789751485 0.66634210248515 0.00000000000000 22.990 4 Na 0.17215829291746 0.82784170708254 0.50000000000000 22.990 5 Na 0.50000000000000 0.50000000000000 0.50000000000000 22.990 6 Re 0.00000000000000 0.00000000000000 0.00000000000000 186.207 7 O 0.79598100356697 0.79598100356697 0.20465190776690 15.999 8 O 0.20401899643303 0.20401899643303 0.79534809223310 15.999 9 O 0.92979990308352 0.65188444505779 0.78576943191596 15.999 10 O 0.34811555494221 0.07020009691648 0.21423056808404 15.999 11 O 0.07020009691648 0.34811555494221 0.21423056808404 15.999 12 O 0.65188444505779 0.92979990308352 0.78576943191596 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.337039480025870 0.000000000000000 0.000000000000000 b 0.000000000000000 9.717309680000001 0.000000000000000 c -3.948580682133466 0.000000000000000 10.465405355614521 Atomic positions (fractional): 1 Na 0.25000000000000 0.83365789751485 0.00000000000000 22.990 > 1 2 Na 0.75000000000000 0.83365789751485 0.00000000000000 22.990 > 1 3 Na 0.25000000000000 0.83365789751485 0.50000000000000 22.990 > 1 4 Na 0.75000000000000 0.83365789751485 0.50000000000000 22.990 > 1 5 Na 0.25000000000000 0.67215829291746 0.25000000000000 22.990 > 5 6 Na 0.75000000000000 0.67215829291746 0.25000000000000 22.990 > 5 7 Na 0.25000000000000 0.67215829291746 0.75000000000000 22.990 > 5 8 Na 0.75000000000000 0.67215829291746 0.75000000000000 22.990 > 5 9 Na 0.25000000000000 0.16634210248515 0.00000000000000 22.990 > 9 10 Na 0.75000000000000 0.16634210248515 0.00000000000000 22.990 > 9 11 Na 0.25000000000000 0.16634210248515 0.50000000000000 22.990 > 9 12 Na 0.75000000000000 0.16634210248515 0.50000000000000 22.990 > 9 13 Na 0.25000000000000 0.32784170708254 0.25000000000000 22.990 > 13 14 Na 0.75000000000000 0.32784170708254 0.25000000000000 22.990 > 13 15 Na 0.25000000000000 0.32784170708254 0.75000000000000 22.990 > 13 16 Na 0.75000000000000 0.32784170708254 0.75000000000000 22.990 > 13 17 Na 0.25000000000000 0.00000000000000 0.25000000000000 22.990 > 17 18 Na 0.75000000000000 0.00000000000000 0.25000000000000 22.990 > 17 19 Na 0.25000000000000 0.00000000000000 0.75000000000000 22.990 > 17 20 Na 0.75000000000000 0.00000000000000 0.75000000000000 22.990 > 17 21 Na 0.00000000000000 0.33365789751485 0.00000000000000 22.990 > 1 22 Na 0.50000000000000 0.33365789751485 0.00000000000000 22.990 > 1 23 Na 0.00000000000000 0.33365789751485 0.50000000000000 22.990 > 1 24 Na 0.50000000000000 0.33365789751485 0.50000000000000 22.990 > 1 25 Na 0.00000000000000 0.17215829291746 0.25000000000000 22.990 > 5 26 Na 0.50000000000000 0.17215829291746 0.25000000000000 22.990 > 5 27 Na 0.00000000000000 0.17215829291746 0.75000000000000 22.990 > 5 28 Na 0.50000000000000 0.17215829291746 0.75000000000000 22.990 > 5 29 Na 0.00000000000000 0.66634210248515 0.00000000000000 22.990 > 9 30 Na 0.50000000000000 0.66634210248515 0.00000000000000 22.990 > 9 31 Na 0.00000000000000 0.66634210248515 0.50000000000000 22.990 > 9 32 Na 0.50000000000000 0.66634210248515 0.50000000000000 22.990 > 9 33 Na 0.00000000000000 0.82784170708254 0.25000000000000 22.990 > 13 34 Na 0.50000000000000 0.82784170708254 0.25000000000000 22.990 > 13 35 Na 0.00000000000000 0.82784170708254 0.75000000000000 22.990 > 13 36 Na 0.50000000000000 0.82784170708254 0.75000000000000 22.990 > 13 37 Na 0.00000000000000 0.50000000000000 0.25000000000000 22.990 > 17 38 Na 0.50000000000000 0.50000000000000 0.25000000000000 22.990 > 17 39 Na 0.00000000000000 0.50000000000000 0.75000000000000 22.990 > 17 40 Na 0.50000000000000 0.50000000000000 0.75000000000000 22.990 > 17 41 Re 0.00000000000000 0.00000000000000 0.00000000000000 186.207 > 41 42 Re 0.50000000000000 0.00000000000000 0.00000000000000 186.207 > 41 43 Re 0.00000000000000 0.00000000000000 0.50000000000000 186.207 > 41 44 Re 0.50000000000000 0.00000000000000 0.50000000000000 186.207 > 41 45 Re 0.25000000000000 0.50000000000000 0.00000000000000 186.207 > 41 46 Re 0.75000000000000 0.50000000000000 0.00000000000000 186.207 > 41 47 Re 0.25000000000000 0.50000000000000 0.50000000000000 186.207 > 41 48 Re 0.75000000000000 0.50000000000000 0.50000000000000 186.207 > 41 49 O 0.39799050178349 0.00000000000000 0.10232595388345 15.999 > 49 50 O 0.89799050178349 0.00000000000000 0.10232595388345 15.999 > 49 51 O 0.39799050178349 0.00000000000000 0.60232595388345 15.999 > 49 52 O 0.89799050178349 0.00000000000000 0.60232595388345 15.999 > 49 53 O 0.10200949821651 0.00000000000000 0.39767404611655 15.999 > 53 54 O 0.60200949821651 0.00000000000000 0.39767404611655 15.999 > 53 55 O 0.10200949821651 0.00000000000000 0.89767404611655 15.999 > 53 56 O 0.60200949821651 0.00000000000000 0.89767404611655 15.999 > 53 57 O 0.39542108703533 0.86104227098714 0.39288471595798 15.999 > 57 58 O 0.89542108703533 0.86104227098714 0.39288471595798 15.999 > 57 59 O 0.39542108703533 0.86104227098714 0.89288471595798 15.999 > 57 60 O 0.89542108703533 0.86104227098714 0.89288471595798 15.999 > 57 61 O 0.10457891296467 0.86104227098714 0.10711528404202 15.999 > 61 62 O 0.60457891296467 0.86104227098714 0.10711528404202 15.999 > 61 63 O 0.10457891296467 0.86104227098714 0.60711528404202 15.999 > 61 64 O 0.60457891296467 0.86104227098714 0.60711528404202 15.999 > 61 65 O 0.10457891296467 0.13895772901286 0.10711528404202 15.999 > 65 66 O 0.60457891296467 0.13895772901286 0.10711528404202 15.999 > 65 67 O 0.10457891296467 0.13895772901286 0.60711528404202 15.999 > 65 68 O 0.60457891296467 0.13895772901286 0.60711528404202 15.999 > 65 69 O 0.39542108703533 0.13895772901286 0.39288471595798 15.999 > 69 70 O 0.89542108703533 0.13895772901286 0.39288471595798 15.999 > 69 71 O 0.39542108703533 0.13895772901286 0.89288471595798 15.999 > 69 72 O 0.89542108703533 0.13895772901286 0.89288471595798 15.999 > 69 73 O 0.14799050178349 0.50000000000000 0.10232595388345 15.999 > 49 74 O 0.64799050178349 0.50000000000000 0.10232595388345 15.999 > 49 75 O 0.14799050178349 0.50000000000000 0.60232595388345 15.999 > 49 76 O 0.64799050178349 0.50000000000000 0.60232595388345 15.999 > 49 77 O 0.35200949821651 0.50000000000000 0.39767404611655 15.999 > 53 78 O 0.85200949821651 0.50000000000000 0.39767404611655 15.999 > 53 79 O 0.35200949821651 0.50000000000000 0.89767404611655 15.999 > 53 80 O 0.85200949821651 0.50000000000000 0.89767404611655 15.999 > 53 81 O 0.14542108703533 0.36104227098714 0.39288471595798 15.999 > 57 82 O 0.64542108703533 0.36104227098714 0.39288471595798 15.999 > 57 83 O 0.14542108703533 0.36104227098714 0.89288471595798 15.999 > 57 84 O 0.64542108703533 0.36104227098714 0.89288471595798 15.999 > 57 85 O 0.35457891296467 0.36104227098714 0.10711528404202 15.999 > 61 86 O 0.85457891296467 0.36104227098714 0.10711528404202 15.999 > 61 87 O 0.35457891296467 0.36104227098714 0.60711528404202 15.999 > 61 88 O 0.85457891296467 0.36104227098714 0.60711528404202 15.999 > 61 89 O 0.35457891296467 0.63895772901286 0.10711528404202 15.999 > 65 90 O 0.85457891296467 0.63895772901286 0.10711528404202 15.999 > 65 91 O 0.35457891296467 0.63895772901286 0.60711528404202 15.999 > 65 92 O 0.85457891296467 0.63895772901286 0.60711528404202 15.999 > 65 93 O 0.14542108703533 0.63895772901286 0.39288471595798 15.999 > 69 94 O 0.64542108703533 0.63895772901286 0.39288471595798 15.999 > 69 95 O 0.14542108703533 0.63895772901286 0.89288471595798 15.999 > 69 96 O 0.64542108703533 0.63895772901286 0.89288471595798 15.999 > 69 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.7736800 0.0000000 -0.0203433 0.0000000 3.7372121 0.0000000 -0.0203415 0.0000000 3.6514445 -------------------------- Born effective charges -------------------------- 1 Na 1.2369734 0.0000000 0.0269220 0.0000000 1.2207030 0.0000000 -0.0075426 0.0000000 0.4943492 2 Na 0.7911089 0.0000000 -0.0630348 0.0000000 1.2110201 0.0000000 -0.0250232 0.0000000 1.4881905 3 Na 1.2369734 0.0000000 0.0269220 0.0000000 1.2207030 0.0000000 -0.0075426 0.0000000 0.4943492 4 Na 0.7911089 0.0000000 -0.0630348 0.0000000 1.2110201 0.0000000 -0.0250232 0.0000000 1.4881905 5 Na 1.3708124 0.0000000 0.0871018 0.0000000 0.5620425 0.0000000 0.0681165 0.0000000 1.4628332 6 Re 6.7105454 0.0000000 0.0173369 0.0000000 6.7506906 0.0000000 0.0322037 0.0000000 6.2820302 7 O -2.8396283 0.0000000 1.0915790 0.0000000 -1.1523898 0.0000000 1.0019240 0.0000000 -1.9163808 8 O -2.8396283 0.0000000 1.0915790 0.0000000 -1.1523898 0.0000000 1.0019240 0.0000000 -1.9163808 9 O -1.6145664 -0.7147628 -0.5538428 -0.6755249 -2.4678499 -0.9623421 -0.5097591 -0.8707188 -1.9692953 10 O -1.6145664 0.7147628 -0.5538428 0.6755249 -2.4678499 0.9623421 -0.5097591 0.8707188 -1.9692953 11 O -1.6145664 -0.7147628 -0.5538428 -0.6755249 -2.4678499 -0.9623421 -0.5097591 -0.8707188 -1.9692953 12 O -1.6145664 0.7147628 -0.5538428 0.6755249 -2.4678499 0.9623421 -0.5097591 0.8707188 -1.9692953 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000005 (yxy) -0.00000005 (yxy) -0.00000005 (yyx) 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 11 10 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.79, Number of G-points: 311, Lambda: 0.16 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/336) ======================= 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 1.852 ( 0.000 0.000 0.000) 0.000 4.347 ( 0.000 0.000 0.000) 0.000 4.848 ( 0.000 0.000 0.000) 0.000 5.000 ( 0.000 0.000 0.000) 0.000 5.693 ( 0.000 0.000 0.000) 0.000 5.734 ( 0.000 0.000 0.000) 0.000 6.116 ( 0.000 0.000 0.000) 0.000 6.480 ( 0.000 0.000 0.000) 0.000 6.514 ( 0.000 0.000 0.000) 0.000 7.005 ( 0.000 0.000 0.000) 0.000 7.257 ( 0.000 0.000 0.000) 0.000 7.412 ( 0.000 0.000 0.000) 0.000 7.524 ( 0.000 0.000 0.000) 0.000 7.530 ( 0.000 0.000 0.000) 0.000 8.180 ( 0.000 0.000 0.000) 0.000 8.290 ( 0.000 0.000 0.000) 0.000 8.305 ( 0.000 0.000 0.000) 0.000 8.833 ( 0.000 0.000 0.000) 0.000 9.368 ( 0.000 0.000 0.000) 0.000 9.917 ( 0.000 0.000 0.000) 0.000 10.026 ( 0.000 0.000 0.000) 0.000 11.266 ( 0.000 0.000 0.000) 0.000 11.314 ( 0.000 0.000 0.000) 0.000 11.512 ( 0.000 0.000 0.000) 0.000 13.644 ( 0.000 0.000 0.000) 0.000 13.920 ( 0.000 0.000 0.000) 0.000 14.207 ( 0.000 0.000 0.000) 0.000 16.501 ( 0.000 0.000 0.000) 0.000 16.510 ( 0.000 0.000 0.000) 0.000 16.708 ( 0.000 0.000 0.000) 0.000 17.225 ( 0.000 0.000 0.000) 0.000 17.886 ( 0.000 0.000 0.000) 0.000 22.540 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/336) ======================= 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.493 ( 17.417 -11.311 17.862) 27.393 0.613 ( 21.990 -16.493 16.659) 32.142 1.009 ( 43.358 -23.247 12.469) 50.753 2.274 ( 27.707 22.259 -42.966) 55.760 4.387 ( 0.953 3.544 9.444) 10.133 4.877 ( -7.556 -12.863 -8.134) 16.992 5.052 ( 2.043 0.551 6.187) 6.539 5.600 ( -9.236 5.747 4.120) 11.632 5.713 ( -4.726 -2.162 3.537) 6.287 6.134 ( 5.156 6.041 -4.663) 9.210 6.399 ( -9.205 -4.088 -10.280) 14.391 6.615 ( 5.195 2.580 1.805) 6.075 7.035 ( -2.547 -3.940 5.359) 7.123 7.191 ( -6.298 5.272 5.043) 9.638 7.387 ( -0.572 5.089 -1.238) 5.268 7.541 ( -4.224 -6.511 -1.836) 7.975 7.610 ( 5.796 -7.934 -13.035) 16.323 8.195 ( -11.664 1.688 11.030) 16.142 8.391 ( 5.730 -5.151 1.870) 7.928 8.617 ( 8.253 14.310 19.373) 25.460 8.825 ( -1.787 -0.191 2.641) 3.194 9.403 ( 2.684 -0.440 2.097) 3.434 9.893 ( -1.660 -0.606 -5.560) 5.834 10.024 ( -3.193 -4.178 -0.540) 5.286 11.313 ( 2.389 0.668 -1.220) 2.764 11.480 ( 1.540 -3.496 -5.726) 6.883 13.274 ( -8.177 -1.910 5.507) 10.042 13.657 ( 1.290 -0.709 -1.368) 2.010 13.934 ( 1.960 1.637 1.086) 2.776 14.197 ( -0.939 0.798 0.585) 1.364 16.453 ( -2.449 0.155 -0.878) 2.607 16.666 ( 5.566 -9.482 -1.377) 11.080 17.249 ( 0.864 -5.776 -3.826) 6.982 17.804 ( -14.461 -1.508 30.807) 34.066 20.614 ( 14.198 13.007 -28.158) 34.113 22.544 ( 1.199 0.112 -1.831) 2.191 ======================= Grid point 2 (3/336) ======================= 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.984 ( 16.595 -11.088 19.028) 27.575 1.208 ( 21.373 -16.421 13.643) 30.209 1.954 ( 38.724 -20.238 12.802) 45.530 2.237 ( 12.445 11.651 -22.775) 28.449 4.426 ( 1.702 5.916 8.746) 10.695 4.856 ( -2.937 -10.638 -6.077) 12.599 5.087 ( -2.253 1.053 5.057) 5.636 5.378 ( -11.627 8.860 4.584) 15.320 5.676 ( -5.717 -2.406 5.998) 8.628 6.084 ( 0.264 7.943 -7.925) 11.224 6.228 ( -5.777 -1.271 -7.690) 9.702 6.710 ( 6.794 3.481 2.418) 8.008 6.964 ( -8.789 3.777 4.480) 10.564 7.116 ( -3.315 0.375 1.219) 3.551 7.266 ( -6.607 2.556 2.209) 7.421 7.582 ( 4.071 -3.552 -3.235) 6.297 7.704 ( 4.681 -6.334 -9.666) 12.469 8.083 ( -8.397 0.465 10.609) 13.537 8.529 ( 4.973 -1.605 -2.282) 5.702 8.735 ( 9.661 9.960 10.513) 17.408 8.827 ( -1.920 -1.392 8.443) 8.770 9.461 ( 1.710 0.005 2.652) 3.155 9.802 ( -3.495 0.398 -9.334) 9.975 10.032 ( -1.017 -6.012 -1.322) 6.239 11.345 ( 1.636 -1.276 -0.200) 2.084 11.529 ( 2.981 -4.500 -1.423) 5.582 13.181 ( -5.849 0.140 -0.544) 5.876 13.668 ( 0.756 0.325 -1.790) 1.970 13.952 ( 1.842 2.361 -0.168) 3.000 14.171 ( -1.460 1.573 1.305) 2.512 16.434 ( 1.105 -0.305 -1.732) 2.077 16.872 ( 10.932 -6.678 0.023) 12.810 17.303 ( 0.581 -9.722 -7.107) 12.057 17.762 ( -10.927 0.226 21.110) 23.772 20.517 ( 3.929 12.674 -12.120) 17.971 22.552 ( 1.818 0.222 -3.352) 3.820 ======================= Grid point 3 (4/336) ======================= 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.451 ( 13.646 -10.123 20.660) 26.749 1.758 ( 19.225 -15.470 9.419) 26.413 2.184 ( 8.017 7.859 -17.486) 20.780 2.755 ( 30.227 -14.948 12.089) 35.822 4.413 ( -1.149 8.014 5.574) 9.829 4.887 ( -3.025 -5.006 -2.299) 6.284 4.987 ( -8.643 -1.625 -2.834) 9.239 5.184 ( -7.491 5.393 8.848) 12.786 5.664 ( -0.425 1.794 5.597) 5.893 5.937 ( -5.820 2.293 -4.308) 7.595 6.148 ( -1.365 1.418 -2.394) 3.099 6.685 ( -2.422 8.799 -3.275) 9.696 6.885 ( -3.247 2.833 1.138) 4.456 7.024 ( -0.917 3.302 3.558) 4.940 7.240 ( -1.615 -2.550 5.041) 5.875 7.654 ( -0.522 -6.842 -1.313) 6.986 7.749 ( 5.242 -1.253 -11.441) 12.647 8.053 ( -3.769 -2.267 7.877) 9.022 8.534 ( 0.929 3.010 -6.139) 6.900 8.787 ( 1.758 8.117 8.562) 11.928 8.969 ( 5.601 -3.917 12.161) 13.950 9.468 ( -2.243 1.257 2.171) 3.365 9.697 ( -0.870 0.329 -9.677) 9.721 10.071 ( 0.065 -5.351 -2.728) 6.007 11.387 ( 1.078 -1.944 2.162) 3.101 11.645 ( 5.274 -6.676 -0.241) 8.511 13.089 ( -3.670 0.814 -2.304) 4.409 13.651 ( -0.441 1.937 -1.304) 2.376 13.937 ( -0.189 2.358 -2.167) 3.208 14.142 ( -1.061 2.002 1.586) 2.765 16.475 ( 4.159 -1.929 -2.514) 5.229 17.120 ( 13.331 -2.675 0.055) 13.597 17.353 ( -0.875 -10.993 -8.524) 13.938 17.718 ( -9.720 -1.317 19.278) 21.630 20.363 ( -0.601 13.244 -6.687) 14.849 22.555 ( 1.641 0.320 -4.089) 4.417 ======================= Grid point 4 (5/336) ======================= 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.823 ( 4.968 -6.471 21.725) 23.206 2.120 ( 9.835 -0.390 -14.064) 17.166 2.249 ( 14.972 -8.292 2.479) 17.293 3.318 ( 17.968 -7.953 8.941) 21.588 4.293 ( -6.205 8.747 0.929) 10.765 4.757 ( -9.841 -3.401 -0.065) 10.412 4.879 ( -4.036 6.876 -2.060) 8.235 5.196 ( 0.856 -7.048 6.791) 9.824 5.672 ( 3.589 7.969 1.064) 8.804 5.825 ( -6.276 -2.351 -0.663) 6.735 6.138 ( -0.587 -2.191 4.324) 4.883 6.536 ( -2.921 8.083 -2.389) 8.921 6.742 ( -4.614 3.369 -7.749) 9.628 7.087 ( 2.224 1.618 8.442) 8.879 7.282 ( 1.956 0.343 3.750) 4.243 7.667 ( -4.140 -7.849 -2.080) 9.115 7.784 ( 5.318 0.125 -7.266) 9.005 8.076 ( -1.256 -2.681 3.497) 4.582 8.457 ( -1.952 3.759 -4.397) 6.105 8.797 ( 2.667 5.770 5.400) 8.341 9.122 ( -0.789 -4.991 6.363) 8.126 9.428 ( 0.373 3.165 2.785) 4.232 9.658 ( 1.147 0.209 -5.200) 5.329 10.088 ( -0.611 -3.421 -3.810) 5.157 11.439 ( 0.968 -1.978 2.996) 3.719 11.800 ( 5.381 -6.562 0.460) 8.499 13.025 ( -1.567 0.810 -2.152) 2.782 13.607 ( -1.234 2.622 -0.719) 2.986 13.884 ( -1.676 1.891 -2.371) 3.465 14.120 ( -0.447 1.656 0.852) 1.915 16.563 ( 5.507 -2.779 -2.598) 6.693 17.305 ( 9.149 1.685 -2.549) 9.646 17.369 ( -2.749 -5.817 -3.072) 7.129 17.738 ( -4.560 -6.762 13.784) 16.016 20.188 ( -2.315 10.997 -3.822) 11.870 22.549 ( 0.969 0.322 -3.485) 3.632 ======================= Grid point 5 (6/336) ======================= 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.949 ( -1.286 -0.292 6.777) 6.904 2.212 ( 6.592 -1.331 -4.796) 8.260 2.531 ( 6.662 -4.999 2.103) 8.591 3.586 ( 5.477 -1.978 3.324) 6.705 4.122 ( -4.674 4.201 -0.760) 6.330 4.694 ( -4.197 -4.769 1.755) 6.591 4.751 ( -1.038 6.336 -1.864) 6.685 5.325 ( 2.012 -4.702 3.467) 6.178 5.637 ( 1.397 5.844 -1.862) 6.290 5.773 ( -2.756 -1.858 0.552) 3.369 6.200 ( 0.284 -2.979 4.431) 5.346 6.431 ( -1.133 4.093 -1.117) 4.392 6.626 ( -1.634 1.589 -4.644) 5.174 7.127 ( 0.102 0.415 2.740) 2.774 7.324 ( 1.472 1.245 1.966) 2.754 7.669 ( -0.939 -3.208 -1.232) 3.563 7.819 ( 1.629 -0.914 -1.677) 2.510 8.089 ( -0.547 -0.809 0.259) 1.010 8.378 ( -1.363 1.859 -1.457) 2.727 8.825 ( 2.129 2.465 2.116) 3.884 9.120 ( -3.420 -2.532 -0.214) 4.261 9.466 ( 2.419 1.515 3.357) 4.406 9.649 ( 0.444 0.169 -1.607) 1.675 10.078 ( -0.630 -1.240 -2.135) 2.548 11.480 ( 0.437 -0.877 1.375) 1.689 11.915 ( 2.335 -2.814 0.346) 3.673 12.997 ( -0.297 0.314 -0.844) 0.948 13.567 ( -0.704 1.291 -0.244) 1.491 13.836 ( -0.967 0.769 -0.978) 1.576 14.108 ( -0.121 0.632 0.186) 0.670 16.646 ( 2.878 -1.451 -1.255) 3.459 17.343 ( -1.601 -3.653 -4.797) 6.239 17.368 ( 2.003 3.819 3.780) 5.735 17.824 ( -0.099 -4.157 4.349) 6.017 20.065 ( -1.245 4.461 -1.330) 4.819 22.541 ( 0.289 0.142 -1.391) 1.428 ======================= Grid point 12 (7/336) ======================= q-point: ( 0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.944 ( 28.161 -0.000 4.236) 28.478 0.968 ( 20.400 -0.000 21.490) 29.630 1.754 ( 43.609 -0.000 20.112) 48.023 2.382 ( 9.426 -0.000 -31.430) 32.813 4.514 ( 3.912 -0.000 12.223) 12.834 4.703 ( -2.585 0.000 -7.783) 8.201 5.100 ( -3.196 0.000 5.091) 6.011 5.500 ( -11.974 0.000 7.206) 13.975 5.606 ( -7.619 0.000 6.351) 9.918 6.183 ( -8.677 0.000 -9.127) 12.593 6.211 ( 5.425 -0.000 -9.105) 10.599 6.743 ( 7.229 -0.000 2.806) 7.755 6.980 ( -3.810 0.000 1.492) 4.092 7.124 ( -8.548 0.000 6.544) 10.766 7.301 ( -11.015 0.000 3.770) 11.642 7.526 ( 1.680 -0.000 -0.414) 1.730 7.645 ( 11.345 -0.000 -14.651) 18.530 8.100 ( -9.663 0.000 11.782) 15.238 8.497 ( 7.569 -0.000 2.627) 8.012 8.800 ( -1.212 0.000 4.176) 4.348 8.866 ( 3.738 -0.000 12.892) 13.423 9.459 ( 2.152 -0.000 2.037) 2.963 9.829 ( -0.454 0.000 -9.648) 9.659 9.942 ( -3.192 0.000 0.138) 3.195 11.357 ( 4.422 -0.000 -3.648) 5.733 11.458 ( 1.807 -0.000 -3.310) 3.771 13.165 ( -6.476 0.000 -0.261) 6.481 13.676 ( 1.906 -0.000 -0.646) 2.012 13.988 ( 1.764 -0.000 0.299) 1.789 14.188 ( -1.767 0.000 2.364) 2.952 16.411 ( 0.464 -0.000 -5.133) 5.153 16.804 ( 12.812 -0.000 3.624) 13.315 17.201 ( 1.565 -0.000 -7.498) 7.660 17.769 ( -10.803 0.000 23.063) 25.468 20.659 ( 2.556 -0.000 -15.037) 15.252 22.554 ( 1.869 -0.000 -3.460) 3.933 ======================= Grid point 13 (8/336) ======================= q-point: ( 0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.366 ( 20.463 1.549 16.032) 26.042 1.500 ( 22.893 -11.399 9.568) 27.305 2.313 ( 5.861 4.488 -21.470) 22.704 2.547 ( 35.404 -6.084 17.604) 40.005 4.563 ( 0.599 7.887 0.869) 7.957 4.740 ( 3.965 -8.636 2.651) 9.865 4.966 ( -14.813 -0.563 0.118) 14.824 5.315 ( -11.199 6.084 7.176) 14.626 5.606 ( -2.794 -4.773 10.550) 11.911 5.988 ( -8.991 1.743 -4.661) 10.276 6.205 ( 2.701 2.988 -9.386) 10.214 6.816 ( 0.480 4.795 -3.178) 5.772 6.918 ( -2.665 0.486 -0.875) 2.847 7.078 ( -2.753 2.540 8.698) 9.470 7.169 ( -6.203 -4.577 6.062) 9.806 7.540 ( -2.564 -3.673 0.524) 4.510 7.736 ( 9.091 -0.451 -13.120) 15.968 8.043 ( -4.809 0.458 9.443) 10.607 8.573 ( 2.379 0.987 -5.356) 5.943 8.868 ( 1.214 -0.654 12.320) 12.397 8.941 ( 1.401 1.952 6.692) 7.110 9.483 ( -0.098 0.362 1.232) 1.288 9.752 ( 1.238 4.817 -7.704) 9.170 9.951 ( -0.250 -6.559 -1.218) 6.676 11.400 ( 4.664 3.262 -1.398) 5.861 11.517 ( 3.858 -6.540 -1.838) 7.813 13.066 ( -5.667 -1.693 -2.633) 6.474 13.695 ( 1.608 1.738 -0.768) 2.489 13.985 ( -0.135 1.929 -2.388) 3.073 14.170 ( -1.954 0.888 2.991) 3.681 16.412 ( 2.583 -3.244 -7.391) 8.475 17.079 ( 16.537 -1.142 5.940) 17.608 17.199 ( 2.009 -4.223 -10.366) 11.372 17.727 ( -10.394 0.735 20.700) 23.174 20.552 ( -3.429 5.826 -7.911) 10.405 22.559 ( 1.867 0.130 -4.648) 5.010 ======================= Grid point 14 (9/336) ======================= q-point: ( 0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.741 ( 11.699 -1.508 18.922) 22.297 1.995 ( 19.635 -9.153 5.565) 22.367 2.251 ( 7.816 3.711 -17.631) 19.640 3.172 ( 22.448 -6.402 12.518) 26.488 4.457 ( -5.671 7.866 -1.475) 9.809 4.692 ( -13.056 -2.933 -2.555) 13.623 4.935 ( 5.743 -2.263 0.713) 6.214 5.147 ( -8.273 3.114 10.407) 13.655 5.680 ( -3.876 -6.156 9.656) 12.090 5.827 ( -5.300 2.408 -1.552) 6.024 6.152 ( 1.004 3.231 -5.607) 6.549 6.696 ( -2.701 8.533 -1.809) 9.131 6.799 ( -6.359 2.179 -6.896) 9.631 7.082 ( -0.858 -2.509 3.226) 4.176 7.283 ( 5.403 -0.490 10.444) 11.768 7.526 ( -4.466 -6.053 2.178) 7.831 7.773 ( 2.798 -0.756 -7.326) 7.878 8.052 ( 0.835 -0.055 3.318) 3.422 8.522 ( -1.590 2.805 -5.078) 6.015 8.882 ( -0.694 3.042 0.638) 3.185 9.028 ( -0.234 -4.532 6.895) 8.254 9.484 ( 1.344 2.430 2.529) 3.755 9.709 ( 2.848 5.270 -2.590) 6.527 10.001 ( 0.063 -5.935 -2.663) 6.505 11.439 ( 3.608 2.232 1.320) 4.444 11.667 ( 6.975 -7.471 -0.792) 10.251 12.986 ( -4.944 -3.387 -3.188) 6.788 13.682 ( 0.650 4.049 -0.374) 4.118 13.931 ( -1.392 2.576 -3.176) 4.319 14.143 ( -2.061 0.849 1.590) 2.738 16.466 ( 4.278 -6.282 -8.394) 11.324 17.208 ( 1.899 -5.607 -12.581) 13.904 17.392 ( 16.325 3.281 7.681) 18.338 17.689 ( -8.214 -0.507 20.435) 22.030 20.357 ( -7.988 6.661 -5.461) 11.747 22.555 ( 1.359 0.241 -4.668) 4.868 ======================= Grid point 15 (10/336) ======================= q-point: ( 0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.937 ( -1.557 -0.623 13.895) 13.996 2.229 ( 12.426 2.545 -12.244) 17.630 2.436 ( 14.598 -5.045 2.815) 15.699 3.512 ( 6.995 -4.593 4.760) 9.627 4.225 ( -11.155 5.573 -0.126) 12.470 4.599 ( -2.759 -4.491 -1.727) 5.546 4.885 ( -2.326 7.225 -3.474) 8.348 5.228 ( 3.570 -4.234 10.786) 12.124 5.653 ( -9.605 -6.680 0.780) 11.725 5.787 ( 1.914 4.501 2.796) 5.633 6.136 ( 0.431 -1.467 -0.199) 1.542 6.576 ( -0.723 9.649 -0.345) 9.683 6.654 ( -3.987 0.688 -6.446) 7.610 7.106 ( -0.339 -2.915 -1.667) 3.375 7.350 ( -1.564 1.694 3.204) 3.947 7.608 ( 4.397 -3.905 7.903) 9.851 7.768 ( -2.305 -2.861 0.242) 3.682 8.085 ( 2.078 0.296 -1.135) 2.386 8.432 ( -2.163 3.165 -3.233) 5.015 8.833 ( -2.414 -1.311 -6.159) 6.744 9.084 ( 1.550 -1.280 2.886) 3.517 9.504 ( 0.683 2.197 1.829) 2.939 9.695 ( 1.736 4.693 0.689) 5.051 10.035 ( 0.531 -3.459 -0.756) 3.581 11.485 ( 3.024 1.506 1.112) 3.556 11.843 ( 6.904 -4.768 0.386) 8.399 12.932 ( -4.798 -5.639 -2.849) 7.933 13.642 ( 0.186 5.302 0.223) 5.310 13.870 ( -0.801 2.436 -2.223) 3.394 14.111 ( -2.032 -0.186 0.090) 2.043 16.550 ( 3.691 -7.509 -8.244) 11.746 17.212 ( 2.077 -5.917 -13.977) 15.319 17.516 ( -2.319 7.657 16.075) 17.956 17.813 ( 10.248 1.678 11.669) 15.621 20.130 ( -10.264 2.494 -4.455) 11.464 22.545 ( 0.743 0.212 -3.126) 3.220 ======================= Grid point 16 (11/336) ======================= q-point: (-0.55 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.944 ( -2.429 -0.513 3.003) 3.896 2.278 ( 3.200 5.196 -5.998) 8.556 2.617 ( 3.496 3.826 0.832) 5.249 3.565 ( -4.381 -3.450 -3.039) 6.351 4.085 ( -2.892 -0.516 2.153) 3.642 4.633 ( 1.853 -4.881 -0.037) 5.221 4.796 ( 1.851 4.851 -4.297) 6.740 5.348 ( 0.364 -1.840 6.401) 6.670 5.558 ( -7.278 -3.735 -2.193) 8.470 5.800 ( 2.719 2.738 1.778) 4.249 6.169 ( -0.582 -4.913 -0.756) 5.005 6.474 ( -1.271 6.492 -2.726) 7.155 6.615 ( 1.619 0.537 2.186) 2.773 7.099 ( -0.839 -2.456 -6.439) 6.942 7.309 ( -2.872 0.009 0.757) 2.970 7.730 ( 3.233 2.597 2.818) 5.014 7.780 ( -2.710 -4.096 9.045) 10.292 8.105 ( 1.993 0.543 -0.154) 2.071 8.377 ( 0.123 1.331 -1.549) 2.046 8.759 ( -3.708 -3.625 -8.409) 9.879 9.160 ( 6.021 1.217 1.176) 6.255 9.452 ( -4.356 -0.006 -5.406) 6.943 9.687 ( 0.793 4.123 3.992) 5.793 10.082 ( 1.627 -0.872 3.417) 3.884 11.510 ( 2.134 2.164 -1.323) 3.314 11.949 ( 3.123 0.982 0.072) 3.275 12.907 ( -4.452 -8.165 -1.851) 9.482 13.605 ( 0.922 4.409 1.050) 4.625 13.845 ( 1.251 1.550 -0.443) 2.041 14.087 ( -1.676 -1.465 -0.407) 2.263 16.598 ( -0.357 -5.564 -6.457) 8.531 17.223 ( 2.808 -6.344 -14.038) 15.659 17.481 ( -5.369 5.561 16.478) 18.201 17.987 ( 11.071 12.357 6.031) 17.654 19.965 ( -8.573 -6.004 -2.415) 10.741 22.540 ( 0.167 -0.010 -0.486) 0.514 ======================= Grid point 17 (12/336) ======================= q-point: (-0.45 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.914 ( 0.033 1.360 -9.741) 9.835 2.158 ( -8.079 6.830 3.681) 11.202 2.470 ( -9.308 13.235 -4.366) 16.759 3.418 ( -11.864 1.859 -6.661) 13.732 4.150 ( 3.823 -6.468 0.682) 7.545 4.747 ( 5.530 -6.437 0.144) 8.488 4.808 ( 6.712 1.885 -3.833) 7.956 5.334 ( -2.600 5.930 1.881) 6.742 5.495 ( -5.961 -8.960 -0.725) 10.786 5.847 ( 3.828 0.765 1.143) 4.067 6.180 ( 1.447 -0.413 -6.590) 6.760 6.421 ( -1.441 -2.700 1.667) 3.485 6.700 ( 4.735 -0.752 6.763) 8.290 7.039 ( -3.428 -2.988 -10.254) 11.217 7.282 ( -0.383 0.583 0.113) 0.706 7.741 ( -5.437 -2.907 8.540) 10.533 7.812 ( 3.213 5.878 2.327) 7.091 8.134 ( 2.168 2.501 0.932) 3.438 8.397 ( 1.403 -2.284 2.224) 3.483 8.690 ( -3.074 -4.784 -9.100) 10.730 9.200 ( -0.961 3.175 -6.593) 7.381 9.370 ( 0.711 -3.143 -4.625) 5.636 9.694 ( 0.558 3.908 7.449) 8.430 10.131 ( 1.077 1.107 4.721) 4.967 11.494 ( 1.262 3.357 -3.975) 5.354 11.915 ( -2.370 6.042 -1.441) 6.649 12.927 ( -2.238 -9.207 -0.289) 9.480 13.608 ( 1.997 2.230 2.142) 3.681 13.872 ( 2.696 0.606 1.113) 2.979 14.082 ( -0.969 -2.389 -0.363) 2.603 16.562 ( -4.231 -2.273 -4.189) 6.373 17.232 ( -1.648 -5.018 -7.024) 8.788 17.460 ( -0.626 3.143 7.160) 7.845 17.994 ( 6.456 19.394 0.693) 20.452 19.957 ( -3.709 -13.506 1.576) 14.094 22.543 ( -0.539 -0.264 1.984) 2.073 ======================= Grid point 18 (13/336) ======================= q-point: (-0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.701 ( -4.555 14.831 -22.450) 27.289 2.055 ( -13.253 -0.980 5.707) 14.462 2.075 ( -12.096 14.460 -0.390) 18.856 3.043 ( -20.813 13.935 -6.979) 26.001 4.267 ( 2.813 -7.478 -4.675) 9.257 4.903 ( 6.315 -2.384 -4.677) 8.212 4.933 ( 9.482 -6.337 1.962) 11.572 5.232 ( -1.307 8.502 0.911) 8.650 5.515 ( -3.801 -11.986 0.367) 12.579 5.921 ( 4.426 -0.367 1.878) 4.822 6.170 ( 4.499 2.970 -4.912) 7.293 6.498 ( 0.612 -10.451 2.751) 10.824 6.831 ( 3.641 -2.408 1.777) 4.713 6.953 ( -2.519 -4.163 -4.299) 6.493 7.278 ( 1.609 1.910 -2.100) 3.262 7.699 ( -8.579 -1.516 8.215) 11.974 7.834 ( 5.544 6.733 1.377) 8.830 8.126 ( 1.920 4.865 -1.898) 5.564 8.466 ( -0.727 -4.224 5.792) 7.205 8.639 ( -3.153 -6.513 -9.612) 12.031 9.032 ( -6.578 2.371 -11.330) 13.314 9.434 ( 3.640 -2.413 -3.629) 5.678 9.733 ( 2.309 3.708 10.549) 11.417 10.146 ( -0.112 2.731 3.605) 4.524 11.450 ( 1.153 3.949 -4.766) 6.296 11.769 ( -5.782 6.905 -2.582) 9.369 13.002 ( 1.187 -8.145 0.632) 8.255 13.643 ( 1.579 0.740 3.225) 3.666 13.918 ( 2.247 0.550 1.613) 2.820 14.097 ( 0.244 -2.674 -0.283) 2.700 16.478 ( -4.597 -0.891 -2.963) 5.541 17.154 ( -8.853 0.301 2.262) 9.142 17.484 ( 3.869 1.697 -3.205) 5.303 17.886 ( 4.552 17.285 -4.160) 18.352 20.090 ( -0.414 -15.340 5.730) 16.381 22.548 ( -1.312 -0.370 3.212) 3.489 ======================= Grid point 19 (14/336) ======================= q-point: (-0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.300 ( -7.168 20.626 -20.411) 29.891 1.539 ( -18.381 18.499 -15.835) 30.510 2.052 ( -10.996 -7.005 14.670) 19.626 2.424 ( -26.852 27.258 -4.497) 38.526 4.317 ( 0.579 -5.786 -7.302) 9.335 4.953 ( 1.345 -2.121 -4.916) 5.520 5.140 ( 3.203 7.358 6.445) 10.292 5.207 ( 8.952 -8.104 -3.090) 12.464 5.601 ( 0.424 -10.871 0.128) 10.880 5.991 ( 0.329 -1.128 3.108) 3.323 6.253 ( 10.190 1.476 2.445) 10.582 6.603 ( -2.648 -8.315 -1.069) 8.792 6.853 ( 3.720 -6.434 -6.384) 9.797 7.056 ( 2.288 -6.176 6.842) 9.497 7.264 ( 1.674 2.254 -4.040) 4.920 7.618 ( -5.896 0.581 4.758) 7.599 7.849 ( 1.929 7.993 3.179) 8.815 8.112 ( 5.521 3.472 -5.835) 8.751 8.496 ( -5.262 -6.290 1.092) 8.273 8.575 ( -6.757 -4.441 -3.136) 8.673 8.865 ( -2.443 1.930 -10.079) 10.548 9.451 ( -0.714 -1.218 -3.584) 3.851 9.826 ( 4.711 2.600 9.588) 10.995 10.124 ( -0.521 3.800 1.834) 4.251 11.408 ( 1.384 4.300 -3.205) 5.539 11.601 ( -5.884 3.850 -2.972) 7.634 13.118 ( 4.361 -6.224 -0.115) 7.601 13.670 ( -0.932 -0.085 3.908) 4.018 13.946 ( 1.770 1.990 1.184) 2.914 14.133 ( 1.169 -2.383 0.014) 2.654 16.413 ( -2.662 -1.671 -2.474) 4.000 16.995 ( -8.889 5.201 3.596) 10.909 17.474 ( 0.423 5.633 -2.373) 6.126 17.812 ( 6.751 7.554 -9.897) 14.163 20.266 ( -0.779 -13.138 9.255) 16.089 22.546 ( -1.654 -0.334 3.030) 3.468 ======================= Grid point 20 (15/336) ======================= q-point: (-0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.854 ( -9.824 21.541 -18.477) 30.032 0.981 ( -11.725 23.680 -17.061) 31.453 1.664 ( -24.993 40.188 0.230) 47.327 1.990 ( -16.850 -7.501 13.647) 22.944 4.321 ( -0.316 -3.765 -5.401) 6.591 4.954 ( -0.638 -3.657 -3.954) 5.424 5.132 ( 4.127 9.066 5.353) 11.309 5.453 ( 9.201 -9.763 -1.588) 13.510 5.700 ( 1.740 -5.915 -1.480) 6.341 5.999 ( -4.221 -4.876 3.939) 7.557 6.463 ( 11.261 1.994 7.732) 13.805 6.562 ( -3.672 -3.016 -3.341) 5.809 7.029 ( 8.621 -10.646 -3.710) 14.192 7.096 ( -2.985 -0.662 -3.434) 4.598 7.277 ( -2.106 -4.466 4.251) 6.516 7.608 ( 4.758 0.569 2.260) 5.298 7.778 ( -2.594 9.106 4.907) 10.664 8.185 ( 10.451 0.375 -10.054) 14.507 8.388 ( -12.802 -7.033 -4.349) 15.240 8.494 ( -4.931 3.342 2.819) 6.590 8.799 ( -0.654 -2.200 -5.804) 6.242 9.410 ( -2.127 0.071 -2.153) 3.027 9.921 ( 3.412 2.295 5.615) 6.960 10.093 ( 0.186 3.105 0.500) 3.150 11.364 ( -0.067 5.221 -1.157) 5.348 11.498 ( -2.818 -0.927 -2.124) 3.649 13.247 ( 6.158 -4.272 -2.158) 7.799 13.657 ( -3.864 -1.122 3.200) 5.142 13.960 ( 2.937 4.256 1.360) 5.347 14.172 ( 0.906 -1.798 0.275) 2.032 16.400 ( -0.446 -3.599 -1.794) 4.046 16.851 ( -2.883 8.118 3.458) 9.283 17.371 ( -3.693 6.272 -1.917) 7.526 17.831 ( 8.145 1.345 -12.088) 14.638 20.399 ( -4.183 -8.995 11.761) 15.386 22.540 ( -1.165 -0.251 1.840) 2.192 ======================= Grid point 21 (16/336) ======================= q-point: (-0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.423 ( 0.000 22.943 0.000) 22.943 0.583 ( 0.000 30.721 0.000) 30.721 0.982 ( 0.000 51.121 0.000) 51.121 1.854 ( 0.000 0.264 0.000) 0.264 4.326 ( -0.000 -2.174 -0.000) 2.174 4.967 ( -0.000 -3.439 -0.000) 3.439 5.150 ( 0.000 4.800 0.000) 4.800 5.617 ( -0.000 -7.737 -0.000) 7.737 5.738 ( -0.000 -0.716 -0.000) 0.716 6.029 ( -0.000 -7.528 -0.000) 7.528 6.504 ( -0.000 -0.975 -0.000) 0.975 6.623 ( 0.000 1.636 0.000) 1.636 7.030 ( 0.000 1.118 0.000) 1.118 7.198 ( -0.000 -6.865 -0.000) 6.865 7.300 ( -0.000 -6.722 -0.000) 6.722 7.655 ( 0.000 9.024 0.000) 9.024 7.829 ( -0.000 -10.486 -0.000) 10.486 8.160 ( -0.000 -1.388 -0.000) 1.388 8.351 ( 0.000 3.888 0.000) 3.888 8.358 ( 0.000 4.650 0.000) 4.650 8.801 ( -0.000 -3.199 -0.000) 3.199 9.378 ( 0.000 0.714 0.000) 0.714 9.942 ( 0.000 2.474 0.000) 2.474 10.084 ( 0.000 1.042 0.000) 1.042 11.307 ( 0.000 4.225 0.000) 4.225 11.491 ( -0.000 -2.130 -0.000) 2.130 13.343 ( -0.000 -3.679 -0.000) 3.679 13.633 ( -0.000 -1.213 -0.000) 1.213 13.963 ( 0.000 4.086 0.000) 4.086 14.195 ( -0.000 -1.201 -0.000) 1.201 16.437 ( -0.000 -5.304 -0.000) 5.304 16.797 ( 0.000 6.808 0.000) 6.808 17.263 ( 0.000 4.046 0.000) 4.046 17.875 ( -0.000 -1.090 -0.000) 1.090 20.435 ( -0.000 -2.843 -0.000) 2.843 22.538 ( -0.000 -0.175 -0.000) 0.175 ======================= Grid point 24 (17/336) ======================= q-point: ( 0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.748 ( 11.560 -0.000 16.627) 20.251 1.883 ( 25.123 -0.000 7.356) 26.178 2.293 ( 5.942 -0.000 -19.468) 20.355 3.109 ( 24.061 -0.000 14.416) 28.050 4.540 ( -3.630 0.000 -7.216) 8.078 4.667 ( -17.398 0.000 -2.075) 17.521 4.889 ( 9.890 -0.000 9.222) 13.523 5.205 ( -10.278 0.000 7.307) 12.611 5.598 ( -6.404 0.000 10.867) 12.614 5.849 ( -5.723 0.000 0.460) 5.742 6.196 ( 2.102 -0.000 -9.924) 10.144 6.809 ( -1.615 0.000 -3.489) 3.845 6.813 ( -7.643 0.000 -4.485) 8.862 7.028 ( -3.291 0.000 -0.838) 3.396 7.273 ( 8.087 -0.000 16.482) 18.360 7.470 ( -5.612 0.000 3.756) 6.752 7.766 ( 2.681 -0.000 -8.085) 8.518 8.056 ( 1.145 -0.000 3.048) 3.256 8.550 ( -1.483 0.000 -5.049) 5.262 8.913 ( -4.195 0.000 -4.118) 5.879 8.977 ( 2.464 -0.000 9.766) 10.072 9.507 ( 1.620 -0.000 2.157) 2.697 9.808 ( 4.026 -0.000 -0.484) 4.055 9.900 ( -0.256 0.000 -2.577) 2.590 11.504 ( 2.316 -0.000 -0.062) 2.316 11.551 ( 9.979 -0.000 -1.003) 10.030 12.948 ( -5.764 0.000 -3.129) 6.558 13.724 ( 1.288 -0.000 -0.853) 1.545 13.959 ( -1.572 0.000 -3.357) 3.707 14.152 ( -2.915 0.000 2.083) 3.583 16.395 ( 4.162 -0.000 -9.854) 10.697 17.156 ( 3.188 -0.000 -12.574) 12.972 17.428 ( 20.807 -0.000 9.687) 22.951 17.686 ( -10.672 0.000 20.503) 23.114 20.422 ( -10.519 0.000 -6.093) 12.156 22.557 ( 1.520 -0.000 -5.123) 5.344 ======================= Grid point 25 (18/336) ======================= q-point: ( 0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.933 ( -0.350 0.142 13.638) 13.644 2.284 ( 16.236 2.952 -6.705) 17.812 2.349 ( 16.843 -3.937 -3.399) 17.628 3.448 ( 8.362 -1.841 7.106) 11.127 4.294 ( -17.023 1.610 -0.928) 17.125 4.543 ( 0.051 -1.352 -5.747) 5.905 4.996 ( -0.717 3.536 -5.615) 6.674 5.195 ( 3.779 0.683 17.730) 18.141 5.508 ( -12.516 -6.380 5.496) 15.085 5.828 ( -0.848 0.293 5.724) 5.794 6.166 ( 2.735 2.793 -8.053) 8.951 6.644 ( -8.571 -1.070 -5.763) 10.384 6.742 ( -0.044 6.466 -1.939) 6.751 7.030 ( 1.231 -3.969 -4.109) 5.844 7.388 ( -5.311 1.942 6.113) 8.327 7.525 ( 6.192 -3.725 15.332) 16.949 7.743 ( -0.704 -0.240 -2.637) 2.739 8.093 ( 2.591 0.333 -1.758) 3.149 8.475 ( -3.820 1.193 -2.338) 4.635 8.806 ( -3.076 -0.939 -10.430) 10.915 9.066 ( 3.719 -0.607 3.209) 4.949 9.535 ( -0.288 0.926 1.090) 1.459 9.813 ( 1.873 7.260 1.182) 7.590 9.945 ( 1.499 -6.156 1.171) 6.443 11.530 ( 3.280 2.536 -0.320) 4.158 11.753 ( 11.255 -3.798 1.159) 11.935 12.842 ( -6.783 -2.950 -3.367) 8.127 13.721 ( 0.360 2.480 -0.444) 2.545 13.910 ( -1.021 1.355 -2.718) 3.204 14.106 ( -3.492 -0.233 0.236) 3.508 16.428 ( 5.031 -4.000 -10.350) 12.183 17.137 ( 3.320 -2.010 -14.213) 14.733 17.622 ( -9.306 3.109 19.874) 22.164 17.847 ( 21.701 1.285 12.222) 24.939 20.160 ( -16.195 0.773 -6.229) 17.369 22.548 ( 1.018 0.105 -4.169) 4.293 ======================= Grid point 26 (19/336) ======================= q-point: ( 0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.938 ( -4.630 -0.107 6.546) 8.019 2.380 ( 9.556 4.929 -10.794) 15.236 2.660 ( 12.926 0.647 3.721) 13.466 3.503 ( -4.888 -2.335 -1.295) 5.569 4.071 ( -9.423 -1.167 1.421) 9.601 4.560 ( 2.751 -3.024 -3.496) 5.379 4.890 ( -0.474 5.188 -6.094) 8.018 5.310 ( -3.879 -1.844 7.652) 8.775 5.464 ( -2.960 -5.155 6.758) 9.000 5.851 ( 0.097 0.390 5.279) 5.295 6.126 ( 0.461 2.525 -5.452) 6.026 6.518 ( -5.043 -3.078 -6.922) 9.101 6.687 ( 1.917 6.755 1.360) 7.152 7.048 ( 0.648 -2.511 -7.199) 7.652 7.324 ( -4.200 1.283 5.181) 6.792 7.668 ( -5.422 -5.197 8.812) 11.579 7.788 ( 8.146 1.907 5.750) 10.152 8.110 ( 1.376 0.138 -0.763) 1.580 8.398 ( -3.466 0.371 -0.236) 3.494 8.716 ( -0.656 -0.810 -12.075) 12.120 9.161 ( 6.433 -0.706 -0.387) 6.483 9.459 ( -6.150 0.537 -6.381) 8.878 9.792 ( 1.737 6.575 4.286) 8.038 10.040 ( 1.804 -3.642 5.438) 6.789 11.553 ( 2.908 2.095 -2.211) 4.211 11.960 ( 9.991 0.323 1.678) 10.136 12.748 ( -7.830 -7.385 -3.529) 11.327 13.690 ( -0.229 3.828 0.454) 3.861 13.881 ( 1.043 1.792 -1.212) 2.402 14.059 ( -2.909 -1.365 -0.519) 3.255 16.487 ( 3.699 -5.154 -9.561) 11.474 17.128 ( 3.266 -3.668 -14.875) 15.665 17.560 ( -9.165 2.909 18.761) 21.082 18.221 ( 21.014 10.698 11.516) 26.242 19.855 ( -17.927 -5.163 -5.921) 19.572 22.540 ( 0.475 0.043 -1.922) 1.980 ======================= Grid point 27 (20/336) ======================= q-point: (-0.55 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.903 ( -3.509 -1.246 2.129) 4.289 2.335 ( 0.654 9.963 -9.057) 13.481 2.713 ( -1.126 12.025 -1.320) 12.150 3.391 ( -8.300 -3.826 -5.397) 10.614 4.041 ( -0.287 -5.403 1.857) 5.720 4.642 ( 4.773 -4.974 -1.741) 7.110 4.838 ( 3.364 1.897 -7.088) 8.072 5.273 ( -8.604 -8.975 2.452) 12.672 5.486 ( -0.921 4.897 5.457) 7.390 5.889 ( 3.091 2.969 2.616) 5.021 6.099 ( -0.198 -4.717 -3.700) 5.998 6.429 ( -3.550 0.272 -4.735) 5.925 6.709 ( 3.186 1.650 4.832) 6.019 6.997 ( -2.730 -1.030 -9.391) 9.834 7.302 ( -0.098 1.358 2.657) 2.985 7.659 ( -7.156 -4.960 9.036) 12.549 7.910 ( 6.387 4.210 1.561) 7.807 8.150 ( 1.543 -0.521 5.440) 5.679 8.362 ( -2.438 -1.972 2.076) 3.761 8.648 ( 0.883 0.479 -12.149) 12.190 9.240 ( -2.262 1.229 -5.818) 6.362 9.310 ( 0.189 -3.114 -7.851) 8.448 9.794 ( 1.529 6.378 7.662) 10.086 10.125 ( 0.908 -1.877 5.945) 6.300 11.549 ( 1.753 2.229 -5.024) 5.769 12.038 ( 2.770 7.298 -0.912) 7.859 12.719 ( -4.112 -12.134 -2.087) 12.980 13.661 ( 0.015 2.880 1.818) 3.406 13.898 ( 3.226 1.652 0.337) 3.640 14.037 ( -1.586 -2.114 0.047) 2.643 16.507 ( 0.313 -2.929 -7.754) 8.295 17.131 ( 1.942 -5.246 -12.535) 13.727 17.510 ( -5.859 2.306 13.187) 14.613 18.393 ( 10.974 21.799 6.594) 25.280 19.688 ( -9.937 -15.106 -1.195) 18.121 22.540 ( -0.208 -0.157 0.625) 0.677 ======================= Grid point 28 (21/336) ======================= q-point: (-0.45 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.866 ( -1.565 0.278 -5.266) 5.500 2.121 ( -7.627 12.785 -4.861) 15.661 2.421 ( -11.379 18.840 -6.806) 23.038 3.224 ( -10.387 4.699 -4.109) 12.118 4.132 ( 2.674 -7.026 -1.846) 7.741 4.783 ( 6.947 -7.426 -2.815) 10.551 4.867 ( 4.332 -2.717 -6.537) 8.299 5.255 ( -7.697 -12.357 3.097) 14.884 5.428 ( -0.780 9.334 5.141) 10.685 5.928 ( 4.431 1.907 0.290) 4.833 6.170 ( 4.537 -5.865 -4.271) 8.557 6.365 ( -1.940 -1.455 -0.412) 2.460 6.798 ( 2.036 -1.813 7.319) 7.810 6.886 ( -4.560 -1.951 -8.826) 10.124 7.314 ( 2.052 1.812 -0.532) 2.789 7.644 ( -7.180 -3.987 9.203) 12.335 7.952 ( 5.982 5.599 -2.619) 8.602 8.199 ( 0.141 2.140 6.449) 6.796 8.379 ( -2.715 -4.763 4.641) 7.183 8.580 ( 0.110 0.551 -11.458) 11.471 9.053 ( -8.133 -0.079 -10.657) 13.406 9.382 ( 4.251 -2.900 -4.681) 6.956 9.821 ( 2.559 5.516 9.646) 11.403 10.171 ( -0.272 -0.170 4.360) 4.372 11.510 ( 0.795 2.205 -6.858) 7.247 11.914 ( -5.430 8.637 -4.230) 11.044 12.816 ( 2.604 -10.996 -0.034) 11.301 13.658 ( -0.526 0.664 3.096) 3.210 13.948 ( 4.304 2.043 1.384) 4.961 14.049 ( 0.124 -2.204 0.905) 2.385 16.463 ( -2.019 -0.374 -6.001) 6.343 17.117 ( -3.339 -4.093 -4.603) 7.007 17.496 ( 0.483 0.880 1.646) 1.928 18.267 ( -1.495 21.521 0.688) 21.584 19.798 ( 1.746 -15.845 5.526) 16.872 22.542 ( -0.987 -0.301 2.302) 2.523 ======================= Grid point 29 (22/336) ======================= q-point: (-0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.699 ( -1.209 20.010 -18.292) 27.138 1.811 ( -16.827 6.182 -8.558) 19.864 2.058 ( -8.517 12.318 4.927) 15.766 2.888 ( -14.582 20.620 -1.297) 25.288 4.207 ( 1.676 -6.008 -5.245) 8.150 4.869 ( 0.599 -5.540 -10.327) 11.735 5.008 ( 7.866 -10.422 -0.398) 13.064 5.304 ( -3.752 -8.179 8.389) 12.302 5.381 ( 0.908 3.783 3.360) 5.140 5.996 ( 3.437 0.855 0.937) 3.664 6.276 ( 9.320 -0.481 -3.487) 9.962 6.420 ( 1.474 -8.922 0.954) 9.093 6.764 ( -3.441 -2.702 -5.940) 7.377 6.925 ( -0.778 -7.073 8.034) 10.732 7.313 ( 1.436 2.402 -3.400) 4.404 7.611 ( -5.172 -1.355 5.425) 7.617 7.980 ( 5.478 5.867 -1.971) 8.265 8.196 ( 0.945 4.795 2.344) 5.420 8.368 ( -6.965 -5.962 -1.705) 9.326 8.531 ( -0.910 -0.999 -0.744) 1.543 8.885 ( -5.361 0.123 -8.983) 10.462 9.416 ( 0.337 -2.358 -4.265) 4.885 9.890 ( 4.159 3.978 8.985) 10.670 10.173 ( -1.020 1.363 2.061) 2.674 11.462 ( 0.519 1.134 -6.530) 6.648 11.701 ( -7.501 6.852 -4.750) 11.215 12.981 ( 6.443 -7.697 0.048) 10.038 13.655 ( -3.127 -1.308 3.544) 4.904 14.007 ( 4.779 3.483 1.949) 6.227 14.088 ( 1.330 -1.992 1.296) 2.723 16.396 ( -2.027 0.148 -4.540) 4.974 17.043 ( -6.724 -0.359 1.569) 6.914 17.514 ( 3.722 0.720 -7.022) 7.980 18.032 ( -5.196 13.806 -1.163) 14.797 20.037 ( 5.371 -11.387 8.331) 15.097 22.540 ( -1.415 -0.310 2.601) 2.977 ======================= Grid point 30 (23/336) ======================= q-point: (-0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.255 ( -13.485 21.020 -14.210) 28.734 1.441 ( -2.242 23.356 -13.022) 26.835 1.933 ( -7.565 1.500 7.836) 10.995 2.388 ( -13.295 35.325 0.951) 37.756 4.243 ( 0.571 -4.617 -4.316) 6.346 4.856 ( -1.701 -6.142 -6.047) 8.785 5.232 ( 6.163 -11.632 -1.440) 13.242 5.327 ( 3.304 9.023 7.272) 12.050 5.470 ( -1.498 -15.919 2.039) 16.119 5.997 ( -0.947 2.766 0.279) 2.937 6.458 ( 6.155 -3.654 0.879) 7.211 6.507 ( 5.561 -2.022 -0.493) 5.938 6.801 ( 3.458 -11.999 -2.874) 12.814 6.989 ( -6.530 -8.428 5.714) 12.096 7.274 ( -0.390 2.207 -3.588) 4.231 7.600 ( 0.794 -0.812 2.285) 2.552 7.949 ( -0.771 8.876 0.223) 8.912 8.186 ( 1.069 -0.463 -8.481) 8.561 8.315 ( -0.864 -1.574 3.491) 3.926 8.529 ( -3.087 0.485 5.312) 6.163 8.762 ( -4.119 -1.447 -7.825) 8.960 9.399 ( -1.404 -1.248 -2.403) 3.050 9.972 ( 3.895 2.951 5.860) 7.630 10.143 ( -1.291 2.112 -0.040) 2.476 11.433 ( 0.058 -0.937 -4.192) 4.296 11.516 ( -4.733 5.738 -2.886) 7.978 13.151 ( 6.926 -5.371 -0.888) 8.810 13.623 ( -5.034 -2.273 2.817) 6.201 14.053 ( 4.063 4.653 1.748) 6.419 14.135 ( 1.246 -1.644 1.129) 2.352 16.353 ( -0.932 -1.084 -2.654) 3.015 16.954 ( -3.784 2.616 2.516) 5.244 17.477 ( -0.545 5.020 -6.802) 8.471 17.877 ( -1.532 4.031 -2.215) 4.847 20.250 ( 3.542 -7.453 7.305) 11.021 22.535 ( -1.051 -0.266 1.700) 2.016 ======================= Grid point 31 (24/336) ======================= q-point: (-0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.858 ( 0.000 23.271 0.000) 23.271 1.139 ( 0.000 28.366 0.000) 28.366 1.867 ( 0.000 1.536 0.000) 1.536 1.885 ( 0.000 44.641 0.000) 44.641 4.270 ( -0.000 -3.672 -0.000) 3.672 4.877 ( -0.000 -5.833 -0.000) 5.833 5.274 ( 0.000 7.637 0.000) 7.637 5.427 ( -0.000 -11.339 -0.000) 11.339 5.610 ( -0.000 -14.043 -0.000) 14.043 5.959 ( 0.000 1.492 0.000) 1.492 6.477 ( -0.000 -1.953 -0.000) 1.953 6.644 ( 0.000 0.164 0.000) 0.164 6.976 ( -0.000 -6.757 -0.000) 6.757 6.986 ( -0.000 -15.068 -0.000) 15.068 7.242 ( 0.000 0.480 0.000) 0.480 7.672 ( -0.000 -5.472 -0.000) 5.472 7.834 ( 0.000 9.917 0.000) 9.917 8.141 ( -0.000 -0.633 -0.000) 0.633 8.392 ( 0.000 0.389 0.000) 0.389 8.453 ( 0.000 5.093 0.000) 5.093 8.727 ( -0.000 -4.218 -0.000) 4.218 9.384 ( -0.000 -0.286 -0.000) 0.286 9.999 ( 0.000 3.360 0.000) 3.360 10.110 ( 0.000 1.615 0.000) 1.615 11.413 ( 0.000 6.701 0.000) 6.701 11.438 ( -0.000 -3.357 -0.000) 3.357 13.261 ( -0.000 -4.710 -0.000) 4.710 13.601 ( -0.000 -2.161 -0.000) 2.161 14.053 ( 0.000 4.986 0.000) 4.986 14.166 ( -0.000 -1.699 -0.000) 1.699 16.356 ( -0.000 -2.899 -0.000) 2.899 16.907 ( 0.000 4.223 0.000) 4.223 17.370 ( 0.000 7.094 0.000) 7.094 17.856 ( -0.000 -0.562 -0.000) 0.562 20.359 ( -0.000 -5.064 -0.000) 5.064 22.534 ( -0.000 -0.247 -0.000) 0.247 ======================= Grid point 36 (25/336) ======================= q-point: ( 0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.938 ( -5.251 0.000 7.100) 8.831 2.433 ( 11.188 -0.000 -12.571) 16.828 2.659 ( 17.112 -0.000 5.425) 17.951 3.483 ( -5.188 0.000 -0.177) 5.191 4.056 ( -11.771 0.000 0.918) 11.807 4.528 ( 2.586 -0.000 -5.269) 5.869 4.954 ( -0.143 0.000 -8.710) 8.711 5.283 ( -13.983 0.000 4.543) 14.702 5.413 ( 6.705 -0.000 16.637) 17.937 5.838 ( -2.227 0.000 5.921) 6.326 6.191 ( 3.913 -0.000 -7.756) 8.688 6.457 ( -8.265 0.000 -6.086) 10.264 6.766 ( 1.434 -0.000 -4.031) 4.279 7.020 ( 1.838 -0.000 -3.838) 4.255 7.340 ( -5.330 0.000 7.580) 9.266 7.612 ( -4.223 0.000 8.684) 9.656 7.807 ( 8.173 -0.000 5.458) 9.828 8.112 ( 1.078 -0.000 -1.381) 1.752 8.397 ( -5.512 0.000 0.817) 5.573 8.714 ( 1.390 -0.000 -13.050) 13.124 9.151 ( 6.437 -0.000 -1.264) 6.560 9.465 ( -6.863 0.000 -6.550) 9.487 9.889 ( 2.692 -0.000 0.383) 2.719 9.974 ( 1.039 -0.000 10.022) 10.075 11.575 ( 2.468 -0.000 -3.113) 3.973 11.963 ( 14.215 -0.000 3.029) 14.534 12.672 ( -9.717 0.000 -4.287) 10.621 13.729 ( -0.672 0.000 -0.080) 0.677 13.899 ( 0.584 -0.000 -1.354) 1.475 14.045 ( -3.236 0.000 -0.517) 3.277 16.435 ( 5.593 -0.000 -10.149) 11.588 17.093 ( 3.199 -0.000 -15.150) 15.485 17.588 ( -10.398 0.000 19.685) 22.262 18.330 ( 25.690 -0.000 13.276) 28.918 19.801 ( -22.638 0.000 -7.598) 23.879 22.541 ( 0.579 -0.000 -2.460) 2.527 ======================= Grid point 37 (26/336) ======================= q-point: (-0.64 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.886 ( -5.212 -0.448 4.327) 6.789 2.478 ( 5.291 4.385 -11.388) 13.301 2.888 ( 9.264 5.589 1.917) 10.988 3.318 ( -12.027 -2.882 -5.721) 13.627 3.960 ( -2.783 -2.604 2.123) 4.363 4.565 ( 3.743 -2.616 -3.250) 5.605 4.891 ( 1.721 3.098 -11.145) 11.694 5.122 ( -11.889 -5.935 2.677) 13.555 5.573 ( 3.102 3.672 12.675) 13.556 5.860 ( -0.354 -4.108 5.372) 6.772 6.150 ( 0.833 8.121 -6.516) 10.445 6.358 ( -4.036 -7.052 -4.738) 9.406 6.754 ( 2.042 2.099 -4.173) 5.098 6.998 ( -2.736 0.483 -2.695) 3.870 7.324 ( -0.722 0.748 4.265) 4.389 7.581 ( -6.439 -2.632 8.247) 10.789 7.963 ( 7.505 1.411 2.046) 7.906 8.136 ( 1.029 -0.527 5.321) 5.445 8.328 ( -4.891 -1.218 2.891) 5.811 8.677 ( 3.667 1.451 -12.138) 12.762 9.249 ( 4.350 -0.361 -2.865) 5.221 9.267 ( -7.773 -0.908 -12.374) 14.641 9.915 ( 2.334 5.802 5.149) 8.101 10.064 ( -0.085 -4.068 8.742) 9.643 11.575 ( 1.362 0.657 -6.002) 6.190 12.182 ( 11.122 6.931 1.581) 13.200 12.507 ( -9.129 -8.889 -4.519) 13.519 13.703 ( -1.715 1.334 0.825) 2.324 13.916 ( 2.216 0.248 0.158) 2.236 14.013 ( -0.740 -0.458 0.373) 0.947 16.467 ( 4.251 -1.158 -8.998) 10.019 17.057 ( 2.212 -2.231 -14.426) 14.765 17.542 ( -8.135 0.944 16.476) 18.399 18.753 ( 20.709 14.081 11.202) 27.433 19.419 ( -20.811 -11.412 -5.838) 24.442 22.538 ( -0.034 -0.050 -0.180) 0.190 ======================= Grid point 38 (27/336) ======================= q-point: (-0.55 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.839 ( -4.502 -1.529 2.473) 5.359 2.369 ( -1.173 10.970 -12.002) 16.303 2.760 ( -8.613 16.962 -5.848) 19.902 3.218 ( -2.813 -4.931 -2.659) 6.269 4.012 ( 2.129 -5.265 0.594) 5.710 4.655 ( 4.532 -5.767 -2.244) 7.670 4.833 ( 1.458 -0.409 -11.041) 11.144 5.036 ( -9.572 -9.972 0.612) 13.836 5.608 ( 1.284 8.895 10.091) 13.513 5.968 ( 3.446 -3.932 4.902) 7.167 6.059 ( 1.697 2.650 -6.417) 7.147 6.347 ( -1.571 -3.546 -2.437) 4.581 6.762 ( 1.567 -0.911 -0.144) 1.819 6.893 ( -6.427 1.568 -3.074) 7.295 7.341 ( 1.667 1.016 0.114) 1.955 7.565 ( -5.991 -3.853 9.222) 11.652 8.037 ( 6.118 3.290 -4.174) 8.103 8.210 ( 0.096 -0.283 10.869) 10.873 8.303 ( -3.440 -3.110 3.946) 6.089 8.633 ( 2.066 3.829 -11.095) 11.917 9.034 ( -9.669 -1.557 -11.291) 14.947 9.334 ( 4.634 -1.999 -5.013) 7.113 9.931 ( 2.094 6.013 7.615) 9.926 10.138 ( -0.599 -3.233 5.844) 6.706 11.534 ( -0.174 0.588 -8.446) 8.469 12.084 ( -7.593 9.036 -5.188) 12.893 12.612 ( 7.857 -10.208 0.403) 12.888 13.668 ( -2.688 0.392 1.982) 3.363 13.964 ( 2.840 -0.581 1.007) 3.069 14.034 ( 2.516 0.682 2.156) 3.383 16.467 ( 1.489 0.659 -7.346) 7.524 17.028 ( -0.476 -4.405 -10.450) 11.350 17.518 ( -2.994 1.166 9.243) 9.785 18.655 ( -10.534 19.141 -1.297) 21.887 19.501 ( 8.614 -15.471 6.999) 19.041 22.537 ( -0.746 -0.164 1.625) 1.795 ======================= Grid point 39 (28/336) ======================= q-point: (-0.45 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.785 ( -5.981 -1.741 -0.419) 6.244 2.091 ( -6.489 17.346 -14.237) 23.359 2.392 ( -8.937 18.826 -5.001) 21.431 3.159 ( -3.454 8.206 -0.177) 8.905 4.095 ( 1.932 -5.729 -2.495) 6.540 4.763 ( 2.552 -5.964 -10.070) 11.979 4.825 ( 1.896 -7.924 -4.087) 9.115 5.025 ( -6.891 -14.457 3.697) 16.436 5.594 ( 2.079 12.383 9.843) 15.954 6.026 ( 4.726 2.901 -0.846) 5.610 6.157 ( 6.046 -9.208 -2.646) 11.329 6.359 ( 2.373 -1.093 0.198) 2.620 6.747 ( -7.489 0.389 -3.140) 8.130 6.811 ( -0.904 -4.550 4.425) 6.411 7.346 ( 0.928 1.127 -2.823) 3.178 7.567 ( -4.113 -3.128 6.851) 8.581 8.072 ( 6.282 3.977 -5.024) 8.973 8.255 ( -1.198 0.368 9.069) 9.155 8.287 ( -5.564 -1.994 1.185) 6.028 8.549 ( 0.100 3.168 -6.482) 7.216 8.868 ( -6.171 -1.906 -7.975) 10.262 9.371 ( 1.142 -2.253 -4.610) 5.257 9.968 ( 2.790 4.356 7.686) 9.264 10.173 ( -0.970 -1.390 2.717) 3.202 11.464 ( -1.545 -0.432 -9.192) 9.331 11.834 ( -8.944 6.704 -4.873) 12.194 12.847 ( 10.746 -6.180 0.347) 12.401 13.630 ( -4.492 -1.220 2.671) 5.366 14.022 ( 2.320 -1.459 1.049) 2.934 14.098 ( 4.786 2.507 3.299) 6.331 16.420 ( -0.345 2.276 -5.556) 6.014 16.990 ( -3.930 -4.542 -4.330) 7.405 17.536 ( 2.962 1.576 0.133) 3.357 18.278 ( -14.879 11.714 -1.737) 19.016 19.844 ( 11.819 -8.961 8.336) 17.014 22.535 ( -1.182 -0.201 2.215) 2.519 ======================= Grid point 40 (29/336) ======================= q-point: (-0.36 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.576 ( -13.021 10.283 -8.299) 18.551 1.794 ( 0.594 15.680 -8.182) 17.696 2.103 ( -4.537 16.767 0.774) 17.387 2.940 ( -5.207 22.938 0.894) 23.538 4.150 ( 0.888 -5.215 -2.990) 6.077 4.742 ( -1.767 -5.672 -7.341) 9.444 4.984 ( 4.748 -13.577 -2.553) 14.608 5.123 ( -3.797 -18.100 4.479) 19.028 5.561 ( 2.153 13.157 6.692) 14.917 6.053 ( 1.537 2.785 -0.783) 3.276 6.332 ( 6.433 -8.413 -2.532) 10.889 6.473 ( 8.271 -2.623 1.850) 8.872 6.639 ( -4.880 -4.950 -2.690) 7.453 6.847 ( -5.301 -5.931 6.019) 9.975 7.311 ( -0.782 1.475 -4.370) 4.678 7.578 ( -0.836 -1.755 3.199) 3.744 8.092 ( 3.179 5.874 -2.480) 7.124 8.174 ( -5.590 -0.560 -4.701) 7.325 8.303 ( 1.808 -0.000 7.171) 7.396 8.528 ( 0.116 0.001 1.116) 1.122 8.747 ( -5.350 -0.350 -6.189) 8.188 9.368 ( -0.709 -1.942 -2.694) 3.396 10.025 ( 2.996 2.625 5.598) 6.871 10.167 ( -1.337 0.381 -0.059) 1.391 11.393 ( -2.326 -2.190 -6.595) 7.328 11.642 ( -4.244 6.568 -2.125) 8.104 13.059 ( 8.968 -4.282 -0.467) 9.949 13.579 ( -5.406 -2.247 2.357) 6.312 14.073 ( 1.331 -1.763 0.596) 2.288 14.163 ( 4.004 3.670 2.675) 6.054 16.362 ( -0.605 2.033 -3.144) 3.793 16.946 ( -3.569 -3.102 -0.550) 4.760 17.563 ( 4.440 4.335 -4.576) 7.710 17.977 ( -10.522 6.148 0.352) 12.191 20.117 ( 7.227 -6.614 5.746) 11.358 22.531 ( -0.917 -0.186 1.535) 1.798 ======================= Grid point 41 (30/336) ======================= q-point: (-0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.270 ( 0.000 19.557 0.000) 19.557 1.613 ( 0.000 20.619 0.000) 20.619 1.948 ( 0.000 9.162 0.000) 9.162 2.622 ( 0.000 33.289 0.000) 33.289 4.192 ( -0.000 -4.624 -0.000) 4.624 4.760 ( -0.000 -6.417 -0.000) 6.417 5.155 ( -0.000 -14.350 -0.000) 14.350 5.283 ( -0.000 -19.284 -0.000) 19.284 5.485 ( 0.000 11.766 0.000) 11.766 6.024 ( 0.000 4.107 0.000) 4.107 6.426 ( -0.000 -3.685 -0.000) 3.685 6.615 ( -0.000 -3.672 -0.000) 3.672 6.698 ( -0.000 -13.760 -0.000) 13.760 6.844 ( -0.000 -5.859 -0.000) 5.859 7.270 ( 0.000 1.670 0.000) 1.670 7.607 ( -0.000 -2.272 -0.000) 2.272 8.013 ( 0.000 8.643 0.000) 8.643 8.132 ( -0.000 -0.322 -0.000) 0.322 8.375 ( -0.000 -1.853 -0.000) 1.853 8.527 ( 0.000 2.031 0.000) 2.031 8.668 ( -0.000 -1.172 -0.000) 1.172 9.367 ( -0.000 -1.452 -0.000) 1.452 10.056 ( 0.000 2.438 0.000) 2.438 10.138 ( 0.000 1.260 0.000) 1.260 11.374 ( -0.000 -3.142 -0.000) 3.142 11.543 ( 0.000 6.848 0.000) 6.848 13.177 ( -0.000 -4.035 -0.000) 4.035 13.555 ( -0.000 -2.542 -0.000) 2.542 14.101 ( -0.000 -1.098 -0.000) 1.098 14.172 ( 0.000 3.494 0.000) 3.494 16.335 ( 0.000 0.579 0.000) 0.579 16.937 ( -0.000 -1.132 -0.000) 1.132 17.517 ( 0.000 8.214 0.000) 8.214 17.864 ( 0.000 1.470 0.000) 1.470 20.253 ( -0.000 -6.003 -0.000) 6.003 22.530 ( -0.000 -0.202 -0.000) 0.202 ======================= Grid point 48 (31/336) ======================= q-point: (-0.64 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.824 ( -5.044 0.000 3.254) 6.003 2.479 ( 0.563 -0.000 -12.324) 12.337 3.007 ( -16.435 0.000 -8.416) 18.464 3.085 ( 8.716 -0.000 0.532) 8.733 3.958 ( 1.940 -0.000 1.640) 2.540 4.595 ( 3.696 -0.000 -2.203) 4.303 4.848 ( 0.991 -0.000 -16.391) 16.421 4.920 ( -11.196 0.000 3.841) 11.837 5.721 ( 2.925 -0.000 11.226) 11.601 5.870 ( 2.612 -0.000 3.648) 4.487 6.209 ( 1.603 -0.000 -4.508) 4.785 6.218 ( -2.603 0.000 -1.453) 2.981 6.761 ( 2.371 -0.000 -6.153) 6.594 6.912 ( -8.078 0.000 1.171) 8.163 7.351 ( 1.241 -0.000 0.509) 1.341 7.524 ( -5.508 0.000 8.916) 10.480 8.069 ( 6.249 -0.000 -4.613) 7.767 8.206 ( 0.707 -0.000 12.218) 12.239 8.272 ( -3.773 0.000 3.403) 5.081 8.677 ( 2.855 -0.000 -9.989) 10.389 9.014 ( -10.629 0.000 -12.144) 16.139 9.315 ( 4.737 -0.000 -5.001) 6.888 10.020 ( 3.217 -0.000 3.388) 4.672 10.075 ( -2.177 0.000 9.834) 10.072 11.539 ( -0.496 0.000 -9.023) 9.036 12.196 ( -14.502 0.000 -6.788) 16.012 12.489 ( 16.034 -0.000 1.939) 16.151 13.672 ( -3.595 0.000 1.477) 3.886 13.954 ( 2.085 -0.000 1.130) 2.372 14.045 ( 3.573 -0.000 2.346) 4.274 16.476 ( 3.258 -0.000 -7.678) 8.341 16.982 ( -0.129 0.000 -12.103) 12.104 17.531 ( -4.055 0.000 11.725) 12.406 18.892 ( -26.069 0.000 -6.636) 26.900 19.300 ( 23.390 -0.000 11.839) 26.215 22.536 ( -0.656 0.000 1.375) 1.523 ======================= Grid point 50 (32/336) ======================= q-point: (-0.55 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.759 ( -5.530 -0.764 1.183) 5.706 2.330 ( -5.314 7.048 -13.419) 16.062 2.680 ( -10.408 9.852 -5.714) 15.428 3.218 ( 5.609 -0.293 -0.197) 5.620 4.011 ( 1.794 -2.626 -0.202) 3.187 4.654 ( 3.051 -3.934 -3.060) 5.844 4.745 ( -1.625 -1.271 -13.364) 13.522 4.818 ( -8.246 -6.647 2.977) 11.002 5.794 ( 4.105 7.717 9.042) 12.576 6.004 ( 6.738 -6.155 1.766) 9.295 6.127 ( 2.078 7.736 -2.132) 8.289 6.284 ( 0.509 -7.166 0.969) 7.249 6.757 ( -10.877 0.456 1.870) 11.046 6.770 ( 1.686 -0.379 -3.785) 4.161 7.358 ( 0.369 0.266 -2.470) 2.511 7.513 ( -3.527 -1.964 7.913) 8.884 8.126 ( 6.181 1.692 -5.928) 8.730 8.231 ( -3.931 -1.129 0.841) 4.175 8.280 ( -1.807 -0.148 12.567) 12.697 8.624 ( -0.492 3.388 -8.578) 9.236 8.823 ( -6.207 -2.256 -7.472) 9.972 9.339 ( 1.567 -0.935 -4.769) 5.106 10.050 ( 1.131 4.340 5.902) 7.413 10.126 ( -0.276 -3.495 4.088) 5.386 11.456 ( -2.314 -0.257 -10.367) 10.626 11.928 ( -11.345 2.835 -4.883) 12.673 12.763 ( 14.752 -2.515 0.440) 14.971 13.613 ( -5.253 -0.466 2.221) 5.722 13.999 ( 1.998 -0.742 1.245) 2.469 14.134 ( 5.401 1.068 3.493) 6.521 16.464 ( 1.230 1.771 -5.778) 6.168 16.910 ( -2.766 -2.906 -7.902) 8.863 17.561 ( 2.039 0.818 5.085) 5.540 18.441 ( -21.737 4.856 -3.458) 22.540 19.719 ( 17.210 -3.780 8.826) 19.707 22.533 ( -1.037 -0.067 1.992) 2.247 ======================= Grid point 51 (33/336) ======================= q-point: (-0.45 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.656 ( -6.951 1.036 -2.580) 7.487 2.074 ( -4.257 12.336 -7.982) 15.298 2.431 ( -3.685 15.178 -2.519) 15.820 3.238 ( 1.554 9.293 0.364) 9.429 4.056 ( 0.602 -4.345 -1.389) 4.602 4.656 ( -1.694 -3.219 -8.596) 9.334 4.755 ( 2.954 -10.033 -4.046) 11.214 4.825 ( -5.332 -12.263 5.088) 14.307 5.812 ( 2.990 12.568 7.064) 14.724 6.103 ( 1.897 2.946 -2.031) 4.050 6.190 ( 9.094 -6.052 -1.811) 11.073 6.394 ( 3.965 -6.005 3.212) 7.881 6.582 ( -11.157 -1.764 0.586) 11.311 6.785 ( -0.431 -0.917 0.820) 1.304 7.328 ( -1.058 0.392 -3.934) 4.093 7.535 ( -1.142 -2.439 4.392) 5.152 8.148 ( -1.173 0.181 -3.302) 3.509 8.182 ( 1.920 1.538 -4.452) 5.087 8.309 ( -2.475 0.433 11.076) 11.357 8.543 ( -0.482 1.484 -4.765) 5.014 8.740 ( -3.048 -0.527 -3.265) 4.497 9.334 ( -0.312 -1.494 -2.960) 3.330 10.069 ( 0.950 2.006 4.616) 5.122 10.159 ( -0.149 -1.032 0.699) 1.255 11.362 ( -2.730 -1.099 -7.415) 7.978 11.743 ( -5.205 3.881 -1.941) 6.777 12.996 ( 10.889 -2.357 -0.550) 11.155 13.544 ( -5.742 -1.386 2.145) 6.284 14.041 ( 1.181 -1.329 0.741) 1.926 14.220 ( 4.121 2.164 2.664) 5.363 16.419 ( -0.038 3.455 -3.302) 4.779 16.863 ( -2.963 -4.852 -3.309) 6.578 17.633 ( 6.587 2.829 -0.309) 7.175 18.082 ( -15.620 4.423 -0.366) 16.238 20.013 ( 9.255 -4.174 5.046) 11.338 22.528 ( -0.813 -0.085 1.414) 1.633 ======================= Grid point 52 (34/336) ======================= q-point: (-0.36 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.530 ( 0.000 7.528 0.000) 7.528 1.904 ( 0.000 13.039 0.000) 13.039 2.236 ( 0.000 18.240 0.000) 18.240 3.111 ( 0.000 18.771 0.000) 18.771 4.100 ( -0.000 -5.023 -0.000) 5.023 4.651 ( -0.000 -4.868 -0.000) 4.868 4.891 ( -0.000 -12.848 -0.000) 12.848 4.929 ( -0.000 -17.465 -0.000) 17.465 5.731 ( 0.000 14.079 0.000) 14.079 6.088 ( 0.000 2.514 0.000) 2.514 6.342 ( -0.000 -4.808 -0.000) 4.808 6.489 ( -0.000 -6.782 -0.000) 6.782 6.530 ( -0.000 -6.886 -0.000) 6.886 6.783 ( -0.000 -0.874 -0.000) 0.874 7.294 ( 0.000 0.857 0.000) 0.857 7.565 ( -0.000 -2.441 -0.000) 2.441 8.107 ( 0.000 0.279 0.000) 0.279 8.165 ( 0.000 4.757 0.000) 4.757 8.339 ( -0.000 -1.672 -0.000) 1.672 8.526 ( -0.000 -1.051 -0.000) 1.051 8.688 ( 0.000 2.247 0.000) 2.247 9.335 ( -0.000 -1.755 -0.000) 1.755 10.086 ( 0.000 0.839 0.000) 0.839 10.155 ( 0.000 0.600 0.000) 0.600 11.327 ( -0.000 -1.862 -0.000) 1.862 11.657 ( 0.000 4.998 0.000) 4.998 13.115 ( -0.000 -2.594 -0.000) 2.594 13.511 ( -0.000 -2.092 -0.000) 2.092 14.067 ( -0.000 -1.770 -0.000) 1.770 14.240 ( 0.000 3.070 0.000) 3.070 16.374 ( 0.000 3.324 0.000) 3.324 16.875 ( -0.000 -4.913 -0.000) 4.913 17.661 ( 0.000 6.721 0.000) 6.721 17.903 ( 0.000 2.348 0.000) 2.348 20.147 ( -0.000 -5.036 -0.000) 5.036 22.527 ( -0.000 -0.108 -0.000) 0.108 ======================= Grid point 61 (35/336) ======================= q-point: (-0.55 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.662 ( -5.529 0.000 -1.532) 5.738 2.197 ( -5.351 0.000 -7.983) 9.610 2.588 ( -4.016 0.000 -2.461) 4.710 3.317 ( 5.086 -0.000 -0.283) 5.094 4.011 ( 0.120 -0.000 -0.479) 0.494 4.628 ( -2.191 0.000 -9.272) 9.527 4.648 ( 1.261 -0.000 -3.630) 3.843 4.707 ( -4.513 0.000 4.481) 6.359 5.953 ( 5.077 -0.000 4.839) 7.014 6.125 ( 10.421 -0.000 0.619) 10.440 6.163 ( -2.026 0.000 -2.717) 3.390 6.291 ( 3.663 -0.000 5.127) 6.301 6.568 ( -12.893 0.000 1.269) 12.956 6.783 ( 1.413 -0.000 -1.648) 2.171 7.330 ( -1.150 0.000 -3.706) 3.881 7.508 ( -1.153 0.000 4.958) 5.090 8.146 ( -4.194 0.000 -2.013) 4.652 8.198 ( 6.115 -0.000 -6.166) 8.684 8.314 ( -3.697 0.000 12.284) 12.829 8.563 ( -2.417 0.000 -7.353) 7.740 8.733 ( -0.971 0.000 -1.462) 1.755 9.319 ( -0.211 0.000 -3.096) 3.104 10.093 ( -1.389 0.000 3.701) 3.953 10.143 ( 1.835 -0.000 1.520) 2.383 11.352 ( -2.768 0.000 -7.624) 8.111 11.780 ( -5.684 0.000 -1.867) 5.983 12.974 ( 11.703 -0.000 -0.659) 11.722 13.530 ( -5.902 0.000 2.104) 6.266 14.028 ( 1.197 -0.000 0.763) 1.419 14.240 ( 4.102 -0.000 2.669) 4.894 16.460 ( 0.381 -0.000 -3.167) 3.190 16.808 ( -2.900 0.000 -4.404) 5.273 17.661 ( 7.100 -0.000 1.397) 7.236 18.126 ( -17.258 0.000 -0.905) 17.282 19.972 ( 9.995 -0.000 4.831) 11.101 22.528 ( -0.773 0.000 1.370) 1.573 ======================= Grid point 63 (36/336) ======================= q-point: (-0.45 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.598 ( 0.000 1.178 0.000) 1.178 2.099 ( 0.000 6.199 0.000) 6.199 2.508 ( 0.000 8.651 0.000) 8.651 3.334 ( 0.000 5.619 0.000) 5.619 4.021 ( -0.000 -2.726 -0.000) 2.726 4.588 ( -0.000 -1.743 -0.000) 1.743 4.680 ( -0.000 -7.688 -0.000) 7.688 4.713 ( -0.000 -5.300 -0.000) 5.300 5.975 ( 0.000 9.950 0.000) 9.950 6.118 ( 0.000 0.759 0.000) 0.759 6.271 ( -0.000 -2.248 -0.000) 2.248 6.381 ( -0.000 -6.302 -0.000) 6.302 6.426 ( -0.000 -1.889 -0.000) 1.889 6.787 ( 0.000 0.563 0.000) 0.563 7.303 ( 0.000 0.158 0.000) 0.158 7.523 ( -0.000 -1.544 -0.000) 1.544 8.102 ( -0.000 -0.277 -0.000) 0.277 8.229 ( 0.000 1.726 0.000) 1.726 8.319 ( -0.000 -0.467 -0.000) 0.467 8.513 ( -0.000 -0.259 -0.000) 0.259 8.722 ( 0.000 1.009 0.000) 1.009 9.309 ( -0.000 -0.831 -0.000) 0.831 10.093 ( 0.000 0.047 0.000) 0.047 10.162 ( 0.000 0.160 0.000) 0.160 11.305 ( -0.000 -0.543 -0.000) 0.543 11.722 ( 0.000 1.824 0.000) 1.824 13.082 ( -0.000 -0.881 -0.000) 0.881 13.482 ( -0.000 -0.818 -0.000) 0.818 14.043 ( -0.000 -0.695 -0.000) 0.695 14.279 ( 0.000 1.088 0.000) 1.088 16.439 ( 0.000 2.711 0.000) 2.711 16.785 ( -0.000 -3.484 -0.000) 3.484 17.752 ( 0.000 2.631 0.000) 2.631 17.938 ( 0.000 1.068 0.000) 1.068 20.078 ( -0.000 -2.004 -0.000) 2.004 22.526 ( -0.000 -0.030 -0.000) 0.030 ======================= Grid point 125 (37/336) ======================= q-point: ( 0.00 0.00 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.485 ( -7.052 0.000 25.082) 26.054 0.603 ( 14.036 -0.000 30.485) 33.561 1.032 ( -0.819 0.000 52.346) 52.353 2.056 ( -42.737 0.000 0.310) 42.738 4.541 ( 3.195 -0.000 0.415) 3.222 4.729 ( -2.916 0.000 -9.947) 10.366 5.081 ( 4.711 -0.000 5.984) 7.616 5.668 ( 5.361 -0.000 -2.566) 5.944 5.692 ( 4.726 -0.000 -4.251) 6.356 6.188 ( -7.256 0.000 -4.080) 8.324 6.424 ( -11.092 0.000 -4.351) 11.915 6.531 ( 6.078 -0.000 2.304) 6.500 7.057 ( 4.041 -0.000 3.382) 5.269 7.278 ( -1.168 0.000 1.503) 1.903 7.330 ( 7.249 -0.000 -4.853) 8.724 7.596 ( -2.615 0.000 4.533) 5.233 7.741 ( -21.145 0.000 1.684) 21.212 8.307 ( 3.684 -0.000 1.760) 4.083 8.315 ( 2.542 -0.000 -0.192) 2.549 8.791 ( 1.679 -0.000 -1.727) 2.409 8.924 ( 19.085 -0.000 -2.491) 19.247 9.444 ( 0.039 -0.000 6.319) 6.320 9.902 ( -7.308 0.000 -4.375) 8.518 9.994 ( 1.001 -0.000 -3.117) 3.274 11.273 ( -1.274 0.000 0.422) 1.342 11.295 ( -2.166 0.000 -2.046) 2.979 13.356 ( 5.505 -0.000 -6.251) 8.330 13.658 ( -0.897 0.000 1.353) 1.623 13.918 ( 0.460 -0.000 -0.417) 0.621 14.280 ( 1.217 -0.000 6.894) 7.000 16.500 ( -7.034 0.000 -0.151) 7.036 16.513 ( 5.827 -0.000 0.227) 5.831 16.981 ( 55.244 -0.000 0.222) 55.244 17.223 ( -4.295 0.000 -0.195) 4.299 20.931 ( -32.337 0.000 0.033) 32.337 22.545 ( -2.248 0.000 0.485) 2.300 ======================= Grid point 126 (38/336) ======================= q-point: ( 0.09 0.00 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.836 ( 10.696 -22.647 18.202) 30.961 1.157 ( 16.619 -8.999 29.608) 35.125 1.517 ( 26.300 -4.722 35.308) 44.279 1.872 ( 5.750 -0.009 -1.296) 5.894 4.539 ( 1.838 6.252 3.150) 7.238 4.695 ( -1.796 -9.708 -8.407) 12.967 5.176 ( 2.333 1.190 6.362) 6.880 5.651 ( -2.579 8.016 0.687) 8.449 5.743 ( 1.100 -1.836 -0.391) 2.175 6.016 ( -2.279 6.032 -8.038) 10.305 6.231 ( -10.586 -3.972 -5.903) 12.755 6.653 ( 6.928 1.537 3.218) 7.792 7.074 ( -2.680 -0.920 -1.102) 3.040 7.287 ( 0.913 1.267 3.895) 4.196 7.351 ( -2.898 9.534 -2.000) 10.163 7.541 ( -1.125 -4.991 3.273) 6.074 7.559 ( -9.018 -5.056 0.697) 10.362 8.329 ( -3.986 1.652 4.843) 6.486 8.380 ( 5.187 -0.354 -5.272) 7.404 8.801 ( 6.112 7.579 6.371) 11.635 8.968 ( 1.184 4.480 6.408) 7.908 9.505 ( 1.537 -0.508 7.103) 7.285 9.756 ( -5.798 -0.619 -8.210) 10.070 9.981 ( -1.683 -3.451 -3.650) 5.298 11.288 ( -0.098 -4.467 -2.195) 4.978 11.395 ( 6.038 -5.901 -1.828) 8.638 13.254 ( -7.129 0.746 -6.082) 9.400 13.658 ( 0.249 0.672 1.154) 1.358 13.930 ( 1.559 1.007 -1.709) 2.523 14.272 ( -2.469 3.892 7.303) 8.636 16.418 ( -5.397 -3.945 -2.468) 7.126 16.667 ( 10.173 -3.119 1.273) 10.717 17.172 ( -3.640 -6.341 -4.125) 8.395 17.767 ( 30.556 -4.494 -14.214) 33.999 20.530 ( -12.102 8.902 8.442) 17.233 22.520 ( -0.941 0.227 -0.940) 1.349 ======================= Grid point 127 (39/336) ======================= q-point: ( 0.18 0.00 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.340 ( 14.754 -17.557 15.434) 27.643 1.620 ( 10.140 -11.120 25.892) 29.948 1.931 ( 8.251 3.028 -6.848) 11.142 2.308 ( 33.578 -10.735 22.841) 42.005 4.506 ( -1.116 1.751 -3.447) 4.025 4.755 ( 3.371 -5.067 -1.324) 6.228 5.161 ( -7.812 1.722 2.516) 8.386 5.492 ( -6.551 9.943 6.974) 13.799 5.728 ( -0.506 3.649 -1.769) 4.087 5.925 ( 1.051 3.605 -8.583) 9.368 6.122 ( -4.713 -5.790 -1.988) 7.726 6.724 ( 2.199 5.156 0.158) 5.608 6.990 ( -6.196 1.430 -2.328) 6.771 7.164 ( -3.821 8.553 3.249) 9.915 7.326 ( -0.164 0.546 3.680) 3.723 7.506 ( -0.158 -3.824 -5.125) 6.396 7.619 ( -0.170 -6.007 1.417) 6.174 8.240 ( -5.739 3.151 4.495) 7.942 8.397 ( 3.447 1.163 -9.061) 9.764 8.918 ( 5.801 8.801 6.082) 12.170 9.015 ( 2.557 -3.572 10.353) 11.246 9.569 ( -1.742 -1.109 6.812) 7.118 9.626 ( -1.839 2.335 -6.782) 7.404 9.980 ( -0.594 -5.389 -4.025) 6.752 11.345 ( 2.076 -6.009 -0.801) 6.408 11.524 ( 3.497 -6.485 1.886) 7.605 13.103 ( -5.618 0.373 -6.975) 8.964 13.662 ( 0.582 1.692 0.986) 2.043 13.919 ( 0.231 1.434 -3.023) 3.354 14.236 ( -2.193 4.144 5.261) 7.047 16.378 ( -2.356 -5.329 -3.682) 6.892 16.900 ( 14.094 -1.408 2.687) 14.417 17.165 ( -2.973 -10.651 -7.062) 13.120 18.011 ( 4.642 -1.224 5.437) 7.253 20.366 ( -1.042 11.969 -2.627) 12.298 22.498 ( -0.309 0.076 -2.326) 2.348 ======================= Grid point 128 (40/336) ======================= q-point: ( 0.27 0.00 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.760 ( 12.294 -6.469 0.421) 13.899 1.983 ( 8.607 -4.831 3.603) 10.507 2.039 ( 7.052 -9.114 22.502) 25.281 3.015 ( 26.714 -9.483 13.936) 31.588 4.435 ( -2.975 2.501 -3.540) 5.257 4.822 ( 0.332 -0.373 -2.997) 3.038 4.950 ( -12.475 1.769 -1.792) 12.726 5.379 ( -5.800 4.033 11.280) 13.309 5.674 ( 4.180 9.268 -4.728) 11.212 5.851 ( -2.804 0.256 -5.022) 5.757 6.152 ( -0.619 -6.825 3.014) 7.487 6.617 ( -3.312 9.422 -3.491) 10.580 6.812 ( -8.149 4.389 -4.336) 10.221 7.149 ( 1.178 0.601 3.111) 3.381 7.343 ( 1.204 3.040 6.968) 7.697 7.523 ( 2.746 -3.312 -11.696) 12.462 7.672 ( 0.613 -3.430 4.026) 5.324 8.172 ( -2.611 1.437 2.069) 3.628 8.376 ( 1.847 1.153 -7.504) 7.814 8.869 ( -2.844 3.439 -2.238) 4.992 9.188 ( 1.706 -4.598 10.047) 11.180 9.489 ( -2.089 4.389 0.101) 4.862 9.658 ( 2.043 0.440 6.093) 6.441 10.002 ( 0.425 -4.338 -3.873) 5.831 11.441 ( 2.025 -5.045 2.325) 5.913 11.667 ( 3.865 -8.023 3.748) 9.662 12.992 ( -2.397 -0.046 -7.636) 8.004 13.650 ( -0.238 3.092 1.072) 3.281 13.877 ( -1.082 1.125 -3.672) 3.990 14.189 ( -2.130 3.576 3.170) 5.232 16.402 ( 0.989 -7.337 -4.581) 8.706 17.111 ( 5.749 -1.936 -3.645) 7.077 17.228 ( 6.846 -8.345 -1.554) 10.905 18.080 ( -4.560 -0.248 17.228) 17.823 20.209 ( 0.166 12.823 -8.388) 15.323 22.484 ( 0.533 -0.441 -3.202) 3.276 ======================= Grid point 129 (41/336) ======================= q-point: ( 0.36 0.00 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.813 ( 4.594 3.384 -14.755) 15.820 2.264 ( 4.829 -7.678 21.467) 23.304 2.388 ( 9.578 -10.015 10.724) 17.522 3.464 ( 12.769 -4.980 5.718) 14.851 4.303 ( -6.420 7.524 0.744) 9.919 4.708 ( -7.884 -4.922 -4.900) 10.507 4.793 ( -3.881 4.959 -6.148) 8.800 5.393 ( -0.501 -0.430 12.554) 12.571 5.626 ( 4.130 8.726 -4.697) 10.736 5.773 ( -3.169 -0.541 -5.099) 6.028 6.217 ( -2.144 -4.922 2.174) 5.792 6.465 ( -0.863 8.109 -4.744) 9.434 6.659 ( -3.977 2.139 0.102) 4.517 7.144 ( -2.860 -2.157 -2.721) 4.499 7.369 ( 0.680 4.669 3.120) 5.657 7.534 ( 4.847 -2.645 -8.957) 10.522 7.761 ( 4.417 0.780 5.514) 7.108 8.142 ( -0.877 0.589 0.063) 1.058 8.349 ( -0.089 0.004 -3.733) 3.734 8.780 ( -2.859 -1.822 -7.864) 8.564 9.224 ( -6.060 -2.968 6.252) 9.199 9.472 ( 2.049 3.685 1.009) 4.336 9.716 ( 0.652 0.724 7.758) 7.819 10.034 ( 1.879 -1.928 -0.192) 2.699 11.512 ( -0.433 -2.706 4.000) 4.849 11.829 ( 3.859 -7.058 3.380) 8.725 12.939 ( 0.535 -1.199 -6.689) 6.817 13.612 ( -0.961 3.737 1.047) 3.998 13.829 ( -1.097 0.440 -3.191) 3.403 14.145 ( -1.683 2.029 1.695) 3.134 16.485 ( 3.130 -8.905 -4.959) 10.662 17.127 ( -1.801 -7.734 -9.598) 12.457 17.440 ( 11.988 3.265 5.077) 13.422 18.088 ( -8.398 1.208 21.084) 22.727 20.047 ( 0.479 9.107 -10.662) 14.031 22.489 ( 1.467 -1.144 -2.645) 3.233 ======================= Grid point 130 (42/336) ======================= q-point: ( 0.45 0.00 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.747 ( 2.765 2.875 -15.805) 16.301 2.462 ( -2.859 -4.514 18.226) 18.993 2.603 ( 1.779 -2.620 5.657) 6.483 3.594 ( -0.573 -1.504 -2.355) 2.852 4.159 ( -3.498 5.483 4.430) 7.869 4.634 ( -1.157 2.344 -7.554) 7.994 4.691 ( -1.654 -5.369 -3.879) 6.827 5.418 ( -1.489 6.680 3.659) 7.761 5.629 ( 2.157 -1.266 2.697) 3.678 5.704 ( 0.330 1.830 -7.351) 7.583 6.165 ( -3.825 0.174 -6.540) 7.579 6.404 ( 1.423 2.519 -1.482) 3.251 6.668 ( 1.523 -1.793 7.166) 7.542 7.080 ( -4.064 -2.783 -6.905) 8.482 7.325 ( -1.689 0.863 -3.045) 3.587 7.607 ( 6.394 0.456 -3.530) 7.318 7.825 ( 4.422 7.447 2.695) 9.071 8.150 ( 0.792 -0.686 3.435) 3.591 8.335 ( -0.934 -2.285 -1.031) 2.675 8.722 ( -1.810 -5.308 -10.619) 12.009 9.190 ( -3.539 1.090 6.305) 7.312 9.435 ( -3.260 -1.052 -5.489) 6.470 9.761 ( -0.272 1.084 8.951) 9.020 10.098 ( 3.064 0.766 4.987) 5.903 11.521 ( -2.789 -0.441 2.867) 4.024 11.933 ( 0.775 -2.506 1.850) 3.210 12.944 ( 1.739 -2.541 -4.342) 5.324 13.577 ( -0.179 2.317 1.142) 2.589 13.808 ( 0.649 -0.636 -2.017) 2.212 14.121 ( -1.128 0.271 1.163) 1.642 16.588 ( 1.887 -8.976 -4.327) 10.142 17.106 ( -1.463 -7.327 -10.789) 13.123 17.584 ( 7.807 9.179 9.237) 15.183 18.026 ( -10.226 5.593 16.501) 20.202 19.957 ( 2.674 0.780 -9.793) 10.181 22.521 ( 1.997 -1.738 -0.682) 2.733 ======================= Grid point 131 (43/336) ======================= q-point: (-0.45 0.00 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.653 ( -0.223 1.947 -16.147) 16.266 2.464 ( -9.215 4.357 8.805) 13.469 2.548 ( -11.575 0.483 8.724) 14.503 3.481 ( -9.134 2.490 -6.770) 11.639 4.165 ( 2.210 -2.304 2.427) 4.010 4.603 ( 6.294 1.642 -6.546) 9.228 4.742 ( 2.163 -7.066 -2.087) 7.679 5.296 ( -2.958 10.904 -0.723) 11.321 5.631 ( -2.345 -1.460 -6.675) 7.224 5.731 ( 6.413 1.268 0.601) 6.565 6.077 ( -1.957 -1.769 -5.819) 6.389 6.441 ( 3.691 -2.522 -0.086) 4.471 6.779 ( 2.803 -2.541 8.878) 9.650 6.985 ( -4.649 -3.528 -10.969) 12.425 7.278 ( -1.575 -0.025 -2.660) 3.091 7.666 ( 4.734 3.297 -1.086) 5.870 7.821 ( 5.567 9.396 -0.624) 10.939 8.179 ( -4.010 -0.611 7.628) 8.639 8.373 ( 3.549 -3.801 -1.086) 5.313 8.683 ( -2.370 -6.756 -10.322) 12.562 9.131 ( -3.292 5.066 -2.819) 6.667 9.379 ( -2.739 -5.474 -1.259) 6.249 9.796 ( -0.754 1.291 9.000) 9.124 10.158 ( 1.743 2.868 6.508) 7.322 11.476 ( -3.770 0.771 1.249) 4.046 11.915 ( -3.678 2.344 0.413) 4.381 12.980 ( 1.814 -2.959 -2.069) 4.041 13.586 ( 1.487 -0.135 1.533) 2.140 13.841 ( 2.807 -1.889 -0.773) 3.471 14.115 ( -0.911 -0.789 0.895) 1.501 16.630 ( -3.730 -6.665 -2.760) 8.121 17.111 ( 2.561 -6.938 -11.138) 13.370 17.638 ( 2.344 10.882 13.169) 17.244 17.846 ( -10.621 11.947 7.042) 17.468 20.010 ( 5.810 -7.824 -6.739) 11.849 22.571 ( 1.486 -1.895 1.588) 2.885 ======================= Grid point 132 (44/336) ======================= q-point: (-0.36 0.00 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.484 ( -7.969 2.510 -12.260) 14.837 2.136 ( -19.911 12.674 -3.042) 23.798 2.481 ( -9.809 -5.070 16.029) 19.464 3.159 ( -18.597 11.056 -6.450) 22.576 4.236 ( 1.048 -6.997 -5.714) 9.094 4.723 ( 10.956 -1.428 -3.270) 11.523 4.868 ( 6.767 -7.297 -1.658) 10.089 5.144 ( -0.874 13.156 -0.064) 13.186 5.556 ( 0.365 2.185 -10.135) 10.374 5.841 ( 7.393 -1.011 1.156) 7.551 6.094 ( 1.186 -6.722 -0.054) 6.826 6.560 ( 5.283 -6.922 0.095) 8.708 6.836 ( -6.863 -5.830 -7.509) 11.725 6.939 ( 6.577 0.550 2.491) 7.055 7.229 ( -2.037 2.124 -1.910) 3.509 7.688 ( 3.861 5.892 0.324) 7.052 7.832 ( 5.573 6.504 -1.963) 8.787 8.122 ( -8.696 -0.653 7.437) 11.461 8.483 ( 5.732 -3.355 -1.009) 6.718 8.646 ( -2.963 -7.090 -9.146) 11.946 8.962 ( -6.124 4.659 -9.387) 12.138 9.430 ( 0.785 -4.351 3.889) 5.888 9.822 ( -0.359 1.476 6.894) 7.059 10.170 ( -0.574 4.645 5.737) 7.404 11.418 ( -3.297 0.211 1.309) 3.554 11.797 ( -6.529 4.258 0.147) 7.796 13.031 ( 2.400 -2.581 -0.969) 3.655 13.637 ( 2.295 -1.178 2.071) 3.308 13.908 ( 2.836 -2.421 -0.182) 3.733 14.114 ( -0.601 -0.990 0.198) 1.175 16.571 ( -7.188 -4.157 -1.682) 8.472 17.169 ( 3.493 -6.131 -9.635) 11.942 17.553 ( -13.279 9.332 6.164) 17.362 17.643 ( 3.099 16.537 6.639) 18.088 20.188 ( 7.609 -12.575 -3.698) 15.157 22.615 ( -0.055 -1.579 3.123) 3.500 ======================= Grid point 133 (45/336) ======================= q-point: (-0.27 0.00 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.213 ( -16.152 3.192 -1.882) 16.571 1.617 ( -25.900 12.387 -5.083) 29.156 2.505 ( -8.279 -5.399 10.431) 14.369 2.614 ( -26.507 15.984 2.035) 31.020 4.257 ( 0.002 -6.574 -9.643) 11.671 4.863 ( 5.262 -2.466 -3.872) 6.983 5.039 ( 4.084 8.544 -2.877) 9.897 5.077 ( 10.114 -3.567 1.647) 10.851 5.506 ( 5.333 4.105 -9.842) 11.923 6.024 ( 9.852 -4.664 4.821) 11.919 6.210 ( 2.058 -8.301 3.524) 9.249 6.707 ( -6.765 -4.591 -10.491) 13.301 6.731 ( 7.249 -7.861 -0.687) 10.715 7.096 ( 8.674 0.089 5.419) 10.228 7.145 ( -1.590 5.008 -4.313) 6.798 7.681 ( 1.224 5.776 1.041) 5.996 7.846 ( 5.139 4.389 -4.510) 8.125 8.026 ( -9.776 -1.321 8.689) 13.146 8.566 ( -0.554 -3.085 -4.169) 5.216 8.627 ( 1.502 -5.308 -5.758) 7.974 8.765 ( -6.013 4.136 -7.669) 10.587 9.493 ( -1.077 -2.414 4.685) 5.380 9.849 ( 2.279 1.529 2.733) 3.873 10.128 ( -2.136 5.751 4.758) 7.764 11.389 ( -2.582 -1.293 2.811) 4.030 11.654 ( -6.746 2.879 0.668) 7.365 13.091 ( 3.327 -1.732 -1.352) 3.987 13.693 ( 1.775 -0.170 2.712) 3.245 13.952 ( 0.009 -1.660 -0.673) 1.792 14.123 ( 1.033 -0.959 -0.705) 1.576 16.486 ( -6.159 -3.528 -1.235) 7.205 17.126 ( -9.056 4.303 -0.779) 10.057 17.352 ( 1.258 3.606 -10.474) 11.148 17.573 ( -0.610 13.829 8.224) 16.101 20.426 ( 7.764 -14.196 -0.677) 16.194 22.633 ( -1.851 -1.081 3.712) 4.287 ======================= Grid point 134 (46/336) ======================= q-point: (-0.18 0.00 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.918 ( -20.743 1.976 11.272) 23.690 1.055 ( -27.572 9.794 1.176) 29.283 1.861 ( -33.723 28.797 3.284) 44.467 2.630 ( -8.626 -19.212 13.178) 24.842 4.263 ( 2.002 -3.563 -6.831) 7.960 4.912 ( 3.635 1.688 -0.203) 4.013 4.994 ( 2.097 6.930 -4.832) 8.704 5.311 ( 12.150 -6.055 -2.839) 13.868 5.538 ( 9.256 3.520 -7.693) 12.540 6.226 ( -2.161 -9.750 6.696) 12.024 6.373 ( 10.353 -2.785 6.575) 12.577 6.589 ( -4.395 -2.414 -8.692) 10.035 6.916 ( 6.641 -3.949 -1.190) 7.817 7.049 ( -0.402 0.400 -4.719) 4.753 7.259 ( 9.234 1.791 -0.173) 9.407 7.635 ( -0.463 6.083 2.318) 6.526 7.881 ( 7.646 1.877 -6.014) 9.908 7.966 ( -7.522 -3.385 13.552) 15.865 8.483 ( -4.319 2.508 -5.968) 7.782 8.592 ( -8.824 -1.405 -1.870) 9.129 8.711 ( 4.927 -1.675 -4.804) 7.082 9.485 ( -4.400 -0.304 4.353) 6.197 9.904 ( 4.998 1.159 -0.470) 5.152 10.064 ( -2.352 5.208 3.504) 6.703 11.376 ( -3.833 -1.871 2.652) 5.022 11.557 ( -4.348 -0.521 1.693) 4.695 13.146 ( 3.863 0.030 -2.850) 4.801 13.719 ( 0.051 1.958 2.808) 3.423 13.938 ( -1.296 -0.160 -1.265) 1.818 14.153 ( 1.990 -0.978 -1.192) 2.518 16.437 ( -2.956 -3.635 -1.225) 4.843 16.893 ( -9.156 9.479 1.624) 13.278 17.281 ( 0.579 2.742 -19.766) 19.964 17.461 ( -2.558 13.026 4.889) 14.147 20.696 ( 7.661 -16.135 3.549) 18.210 22.622 ( -3.108 -0.734 3.541) 4.768 ======================= Grid point 135 (47/336) ======================= q-point: (-0.09 0.00 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.543 ( -26.383 -3.004 10.162) 28.432 0.772 ( -14.870 10.173 31.679) 36.444 1.091 ( -31.314 28.181 22.007) 47.529 2.675 ( -23.228 -27.366 -8.630) 36.918 4.354 ( 7.738 -5.189 2.839) 9.740 4.895 ( 1.877 11.945 -9.304) 15.257 4.978 ( 3.761 -0.982 2.208) 4.470 5.533 ( 11.310 -4.088 -3.290) 12.468 5.621 ( 8.309 1.265 -5.656) 10.130 6.239 ( -7.325 -6.872 4.805) 11.134 6.504 ( -1.423 -1.661 -6.723) 7.070 6.559 ( 0.436 1.993 5.284) 5.664 6.944 ( 6.099 2.105 -2.216) 6.822 7.170 ( 4.704 -10.061 0.866) 11.140 7.325 ( 5.438 4.395 -5.912) 9.156 7.603 ( 0.476 5.858 3.798) 6.997 7.962 ( 3.290 0.845 -6.364) 7.213 8.114 ( 9.700 -11.830 19.988) 25.171 8.344 ( -4.944 2.513 -3.640) 6.634 8.469 ( -2.704 3.032 9.132) 9.994 8.766 ( 3.245 -1.261 -3.602) 5.010 9.441 ( -3.426 0.501 4.794) 5.913 9.957 ( 1.127 -0.045 -0.077) 1.130 10.008 ( 0.427 4.118 -0.694) 4.198 11.329 ( -5.058 -2.832 -0.059) 5.797 11.502 ( -5.938 1.144 -3.519) 6.997 13.192 ( 6.979 2.812 -0.092) 7.525 13.691 ( -1.745 3.002 1.449) 3.763 13.921 ( 0.374 0.903 -0.250) 1.009 14.189 ( 2.103 -1.084 0.810) 2.500 16.449 ( 1.728 -2.638 -1.048) 3.323 16.713 ( -0.760 13.322 2.984) 13.674 16.946 ( -14.920 18.034 -27.899) 36.417 17.324 ( -5.002 7.025 3.333) 9.246 21.019 ( 5.654 -21.774 1.313) 22.534 22.591 ( -3.797 -0.550 2.184) 4.415 ======================= Grid point 137 (48/336) ======================= q-point: ( 0.09 0.09 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.148 ( 23.019 -0.000 15.777) 27.906 1.509 ( 10.837 -0.000 28.627) 30.610 1.965 ( 9.892 -0.000 -10.307) 14.286 2.211 ( 34.031 -0.000 26.618) 43.205 4.516 ( -1.606 0.000 -11.581) 11.692 4.709 ( 5.379 -0.000 7.550) 9.270 5.176 ( -7.921 0.000 2.996) 8.469 5.630 ( -10.905 0.000 6.384) 12.636 5.708 ( -0.263 0.000 3.228) 3.238 5.998 ( 4.523 -0.000 -12.988) 13.753 6.049 ( -6.345 0.000 -4.012) 7.507 6.779 ( 4.287 -0.000 1.817) 4.656 6.980 ( -6.289 0.000 -1.104) 6.385 7.310 ( -4.618 0.000 11.926) 12.789 7.316 ( -10.182 0.000 -2.511) 10.487 7.420 ( 6.659 -0.000 -9.977) 11.995 7.570 ( 1.048 -0.000 5.523) 5.621 8.281 ( -7.103 0.000 7.110) 10.050 8.407 ( 3.860 -0.000 -11.006) 11.663 8.958 ( 5.511 -0.000 11.382) 12.646 9.027 ( -1.938 0.000 1.169) 2.263 9.553 ( -0.935 0.000 6.776) 6.840 9.679 ( 1.678 -0.000 -4.210) 4.532 9.901 ( -1.955 0.000 -4.227) 4.657 11.283 ( 4.852 -0.000 -3.913) 6.233 11.455 ( 3.595 -0.000 2.661) 4.472 13.099 ( -6.961 0.000 -5.981) 9.177 13.680 ( 1.083 -0.000 0.965) 1.450 13.940 ( 0.846 -0.000 -4.232) 4.316 14.282 ( -3.618 0.000 6.625) 7.548 16.307 ( -2.560 0.000 -5.274) 5.862 16.888 ( 15.595 -0.000 4.774) 16.309 17.065 ( -2.004 0.000 -6.644) 6.939 17.997 ( 6.799 -0.000 2.736) 7.329 20.490 ( -2.603 0.000 -1.984) 3.272 22.499 ( -0.505 0.000 -2.432) 2.484 ======================= Grid point 138 (49/336) ======================= q-point: ( 0.18 0.09 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.641 ( 22.340 -4.143 13.023) 26.188 1.843 ( 11.226 -5.230 12.795) 17.807 2.023 ( 3.452 1.282 1.655) 4.037 2.890 ( 29.676 -3.422 17.327) 34.534 4.438 ( -0.371 -0.830 -10.114) 10.155 4.837 ( 4.887 1.160 3.414) 6.073 4.965 ( -16.934 0.097 -0.006) 16.934 5.465 ( -10.268 3.799 8.594) 13.919 5.754 ( 1.240 -0.657 2.794) 3.126 5.905 ( -3.034 5.672 -5.009) 8.153 6.035 ( 1.643 -5.462 -5.216) 7.730 6.765 ( -2.105 5.657 -2.015) 6.363 6.864 ( -7.525 0.722 -2.925) 8.106 7.132 ( -7.850 -1.642 -2.894) 8.526 7.375 ( 3.365 -0.082 10.828) 11.340 7.496 ( 7.110 1.250 -8.084) 10.838 7.616 ( -0.382 -2.606 6.619) 7.124 8.206 ( -5.643 1.656 6.427) 8.711 8.386 ( 3.020 0.004 -12.704) 13.058 8.915 ( -6.732 1.228 -8.288) 10.748 9.111 ( 1.812 -2.711 10.608) 11.098 9.557 ( -1.771 1.507 5.798) 6.247 9.719 ( 5.499 6.428 3.710) 9.237 9.896 ( 0.525 -6.663 -3.573) 7.579 11.383 ( 7.759 -1.136 -0.937) 7.897 11.542 ( 2.205 -4.391 4.939) 6.967 12.970 ( -4.813 -1.194 -7.027) 8.600 13.697 ( 1.005 1.459 1.049) 2.059 13.907 ( -0.464 1.292 -5.040) 5.224 14.243 ( -4.120 1.769 4.129) 6.095 16.273 ( 0.031 -4.709 -6.645) 8.145 17.016 ( -0.904 -3.748 -8.582) 9.408 17.204 ( 19.397 0.965 6.628) 20.521 18.071 ( -3.340 -0.435 14.649) 15.031 20.388 ( -3.491 5.344 -8.023) 10.253 22.478 ( 0.293 -0.155 -3.719) 3.734 ======================= Grid point 139 (50/336) ======================= q-point: ( 0.27 0.09 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.887 ( 7.218 4.267 -13.938) 16.266 2.152 ( 10.978 -4.822 17.037) 20.834 2.217 ( 10.110 -7.215 16.971) 21.031 3.378 ( 15.963 -3.555 8.370) 18.372 4.388 ( -0.901 1.060 -5.388) 5.565 4.645 ( -16.810 -0.883 -1.465) 16.897 4.878 ( -0.392 3.388 -6.718) 7.535 5.400 ( -2.418 1.580 14.970) 15.246 5.736 ( -7.059 -2.877 -2.487) 8.018 5.800 ( 3.417 8.962 -3.984) 10.386 6.103 ( 0.378 -6.752 1.572) 6.943 6.625 ( -3.717 8.175 -5.838) 10.711 6.708 ( -5.383 2.687 -1.386) 6.174 7.057 ( -5.079 -6.678 -4.884) 9.708 7.476 ( -0.638 6.137 -1.015) 6.253 7.510 ( 8.119 0.429 0.110) 8.131 7.731 ( 3.870 -4.037 9.890) 11.362 8.156 ( -3.056 1.004 4.196) 5.287 8.354 ( 1.858 0.372 -10.289) 10.462 8.744 ( -5.873 -1.781 -12.536) 13.957 9.169 ( -3.574 -2.536 7.508) 8.694 9.550 ( -0.769 3.490 1.971) 4.081 9.750 ( 2.431 3.205 2.727) 4.860 9.986 ( 3.776 -3.242 4.255) 6.548 11.495 ( 4.008 1.121 3.788) 5.627 11.688 ( 5.533 -7.690 3.677) 10.162 12.884 ( -3.196 -3.409 -7.295) 8.663 13.691 ( 0.286 3.660 1.294) 3.892 13.852 ( -0.553 1.638 -4.670) 4.980 14.177 ( -4.142 1.291 1.728) 4.670 16.313 ( 2.325 -8.167 -7.100) 11.069 16.992 ( -0.571 -5.334 -9.808) 11.179 17.543 ( 20.160 5.822 7.708) 22.355 18.094 ( -7.546 -0.668 21.197) 22.510 20.190 ( -6.661 5.739 -11.450) 14.437 22.472 ( 1.409 -0.644 -3.772) 4.078 ======================= Grid point 140 (51/336) ======================= q-point: ( 0.36 0.09 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.825 ( 3.318 4.931 -15.842) 16.920 2.387 ( 0.569 -3.095 19.782) 20.031 2.547 ( 11.193 -3.555 7.450) 13.908 3.551 ( 0.128 -2.115 -0.651) 2.217 4.260 ( -9.432 4.451 3.616) 11.039 4.523 ( -1.125 -7.637 -5.599) 9.536 4.746 ( -2.194 4.893 -10.421) 11.720 5.486 ( 0.537 1.103 15.004) 15.054 5.613 ( -7.344 -1.354 -3.491) 8.244 5.765 ( 4.248 6.187 -5.167) 9.112 6.142 ( -2.761 -3.166 -1.594) 4.493 6.482 ( -1.378 3.861 -5.323) 6.719 6.655 ( 0.210 1.265 4.105) 4.300 7.001 ( -4.349 -5.452 -8.573) 11.052 7.385 ( -1.583 5.608 -2.385) 6.296 7.620 ( 7.226 0.563 -2.722) 7.742 7.887 ( 2.924 -0.923 11.317) 11.725 8.145 ( -0.149 0.266 4.408) 4.418 8.314 ( 0.408 0.501 -6.698) 6.729 8.627 ( -2.811 -4.498 -12.958) 14.001 9.181 ( -1.926 -1.843 6.896) 7.393 9.450 ( -5.680 2.240 -7.748) 9.864 9.791 ( 2.017 1.992 5.834) 6.486 10.106 ( 3.866 0.123 8.800) 9.612 11.534 ( -0.222 1.702 3.988) 4.341 11.866 ( 5.968 -4.326 2.275) 7.715 12.842 ( -2.956 -6.828 -6.281) 9.737 13.660 ( 0.290 5.152 1.515) 5.378 13.815 ( 0.890 1.188 -3.267) 3.588 14.118 ( -3.249 -0.432 0.590) 3.330 16.401 ( 2.766 -9.820 -6.850) 12.289 16.977 ( -0.076 -5.744 -10.327) 11.817 17.786 ( 11.525 11.461 11.332) 19.814 18.113 ( -4.003 2.702 19.500) 20.089 19.964 ( -7.510 0.091 -12.634) 14.697 22.492 ( 2.278 -1.239 -2.187) 3.392 ======================= Grid point 141 (52/336) ======================= q-point: (-0.55 0.09 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.725 ( 2.437 5.193 -16.865) 17.814 2.465 ( -6.957 -1.034 16.877) 18.284 2.651 ( -1.643 6.805 2.244) 7.352 3.475 ( -7.462 -2.147 -5.688) 9.625 4.148 ( -4.398 -0.596 3.333) 5.550 4.582 ( 2.906 -5.238 -5.877) 8.392 4.663 ( 3.558 0.055 -7.127) 7.966 5.490 ( -3.230 5.628 -1.732) 6.717 5.526 ( -5.317 -2.966 7.430) 9.606 5.773 ( 5.176 2.672 -3.411) 6.750 6.076 ( -1.623 0.065 -7.917) 8.081 6.434 ( -0.458 0.346 -1.396) 1.510 6.729 ( 2.839 -1.472 8.181) 8.783 6.917 ( -3.602 -4.027 -11.474) 12.682 7.310 ( -0.456 3.727 -2.078) 4.291 7.702 ( 5.979 0.781 -2.981) 6.726 7.942 ( -1.336 2.136 6.347) 6.828 8.197 ( 0.683 2.568 7.622) 8.072 8.306 ( 3.397 -2.424 -3.577) 5.496 8.566 ( -2.065 -5.393 -10.994) 12.419 9.215 ( -1.847 3.241 1.563) 4.045 9.280 ( -4.712 -4.503 -7.711) 10.096 9.835 ( 1.145 2.642 7.171) 7.728 10.200 ( 1.843 1.605 8.946) 9.274 11.510 ( -2.164 2.462 1.675) 3.681 11.949 ( 1.233 1.610 -0.121) 2.031 12.844 ( -2.621 -10.229 -4.077) 11.319 13.639 ( 1.730 4.532 2.191) 5.323 13.825 ( 3.111 0.267 -1.647) 3.530 14.090 ( -2.153 -1.741 0.598) 2.833 16.476 ( -0.175 -8.674 -5.852) 10.465 16.983 ( 1.997 -6.355 -10.304) 12.269 17.825 ( -5.310 8.521 18.256) 20.834 18.123 ( 4.563 16.545 7.768) 18.839 19.845 ( -3.190 -9.543 -9.767) 14.022 22.537 ( 2.129 -1.621 0.197) 2.683 ======================= Grid point 142 (53/336) ======================= q-point: (-0.45 0.09 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.587 ( -0.248 7.551 -16.709) 18.338 2.385 ( -17.221 8.300 0.245) 19.118 2.430 ( -9.288 5.170 12.452) 16.372 3.301 ( -10.787 3.490 -4.710) 12.277 4.140 ( -0.603 -3.778 -2.622) 4.638 4.651 ( 6.275 -5.544 -8.463) 11.905 4.764 ( 7.149 -4.437 -0.414) 8.424 5.380 ( -0.440 10.453 0.557) 10.477 5.498 ( -5.366 -5.525 1.133) 7.785 5.829 ( 5.320 -0.380 -1.958) 5.682 6.040 ( 3.076 -0.036 -6.280) 6.993 6.442 ( -0.635 -5.583 -0.267) 5.626 6.767 ( -1.777 -0.507 -8.422) 8.622 6.910 ( 3.192 -3.923 5.229) 7.275 7.269 ( 0.166 2.714 -1.926) 3.332 7.761 ( 5.277 2.369 -3.299) 6.659 7.914 ( -4.873 0.484 6.059) 7.791 8.174 ( -0.239 6.626 1.484) 6.794 8.416 ( 5.223 -3.616 1.340) 6.492 8.519 ( -2.913 -5.928 -8.796) 11.000 9.031 ( -7.387 2.292 -10.303) 12.883 9.348 ( 2.515 -4.107 3.835) 6.157 9.867 ( 1.113 3.077 6.553) 7.325 10.237 ( -0.707 2.655 6.988) 7.509 11.452 ( -2.271 2.687 0.158) 3.522 11.877 ( -4.674 4.796 -2.445) 7.129 12.899 ( -0.722 -10.666 -1.927) 10.863 13.662 ( 3.300 2.838 3.102) 5.345 13.880 ( 3.972 -0.358 -0.426) 4.010 14.085 ( -1.199 -1.993 0.626) 2.409 16.474 ( -4.077 -5.467 -4.522) 8.183 17.039 ( 3.902 -7.392 -9.446) 12.614 17.701 ( -12.977 7.252 14.768) 20.955 18.034 ( 4.579 23.052 2.372) 23.621 19.926 ( 3.231 -15.247 -4.595) 16.249 22.584 ( 0.751 -1.567 2.146) 2.761 ======================= Grid point 143 (54/336) ======================= q-point: (-0.36 0.09 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.367 ( -4.658 12.109 -11.245) 17.169 1.891 ( -23.093 15.946 -7.165) 28.963 2.374 ( -10.303 -4.090 15.960) 19.432 2.967 ( -17.709 16.516 -0.565) 24.222 4.153 ( 1.185 -4.508 -6.944) 8.363 4.763 ( 4.971 -7.275 -7.494) 11.567 4.940 ( 8.572 -6.865 -1.524) 11.088 5.294 ( 2.028 13.336 3.362) 13.902 5.495 ( -0.387 -5.939 -3.129) 6.724 5.942 ( 6.476 -3.416 1.236) 7.425 6.101 ( 6.279 -2.742 -2.010) 7.140 6.510 ( -1.181 -11.424 -2.274) 11.708 6.691 ( 1.150 -0.324 -9.278) 9.355 7.059 ( 3.963 -3.842 8.654) 10.265 7.227 ( 0.475 3.810 -3.466) 5.172 7.763 ( 0.043 4.029 -2.473) 4.728 7.879 ( -3.690 -2.528 5.267) 6.910 8.098 ( 0.246 9.063 -1.922) 9.268 8.463 ( -4.048 -6.521 -6.928) 10.340 8.543 ( 3.989 -3.615 0.651) 5.423 8.850 ( -5.359 3.461 -6.695) 9.248 9.437 ( 0.504 -3.350 4.371) 5.530 9.897 ( 2.624 3.297 3.993) 5.805 10.215 ( -2.589 3.521 4.475) 6.255 11.404 ( -0.926 2.004 0.715) 2.321 11.712 ( -7.760 3.970 -3.159) 9.271 12.988 ( 1.536 -8.605 -1.299) 8.837 13.716 ( 2.827 1.534 3.788) 4.969 13.936 ( 2.799 0.474 0.133) 2.842 14.097 ( 0.368 -1.729 0.024) 1.768 16.416 ( -4.722 -3.423 -3.220) 6.662 17.096 ( 0.278 -5.513 -6.955) 8.879 17.487 ( -9.299 8.796 4.003) 13.411 17.896 ( 1.176 19.516 3.574) 19.875 20.139 ( 6.245 -15.799 -0.804) 17.007 22.610 ( -1.166 -1.208 3.072) 3.501 ======================= Grid point 144 (55/336) ======================= q-point: (-0.27 0.09 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.103 ( -6.090 16.251 -1.952) 17.464 1.319 ( -23.047 17.279 -1.624) 28.851 2.346 ( -13.002 -8.724 13.567) 20.717 2.429 ( -23.555 28.563 5.033) 37.363 4.188 ( 3.158 -4.102 -5.619) 7.641 4.840 ( 1.917 -6.192 -4.591) 7.943 5.136 ( 8.918 -5.300 -5.004) 11.518 5.237 ( 3.864 8.702 1.793) 9.689 5.555 ( 4.660 -3.481 -4.785) 7.532 6.055 ( -1.627 -6.757 3.822) 7.931 6.295 ( 13.304 -4.762 1.073) 14.171 6.518 ( -3.273 -5.661 -6.447) 9.183 6.782 ( 8.040 -7.920 -1.272) 11.357 7.091 ( -4.311 1.353 -4.200) 6.169 7.265 ( 6.550 -0.613 4.004) 7.702 7.691 ( -4.403 1.079 2.531) 5.192 7.891 ( -0.983 -1.181 2.233) 2.711 8.013 ( 2.754 7.905 -3.780) 9.185 8.408 ( -5.114 -5.583 -5.454) 9.331 8.627 ( 0.833 -1.390 2.978) 3.390 8.714 ( -2.484 3.483 -4.610) 6.289 9.468 ( -2.892 -1.588 4.832) 5.851 9.943 ( 4.533 2.794 1.231) 5.465 10.150 ( -3.371 3.790 1.850) 5.399 11.391 ( 0.263 2.481 1.719) 3.030 11.547 ( -7.163 0.384 -2.048) 7.460 13.087 ( 3.571 -5.753 -2.087) 7.085 13.749 ( -0.993 0.239 3.481) 3.628 13.963 ( 2.851 3.232 0.520) 4.341 14.127 ( 1.564 -1.681 -0.943) 2.482 16.368 ( -2.580 -3.091 -1.949) 4.474 17.022 ( -6.839 2.749 -1.969) 7.629 17.341 ( -0.573 5.169 -6.801) 8.561 17.755 ( 0.124 16.099 2.113) 16.238 20.385 ( 4.841 -15.805 2.034) 16.655 22.607 ( -2.677 -0.849 3.003) 4.111 ======================= Grid point 145 (56/336) ======================= q-point: (-0.18 0.09 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.792 ( -4.369 22.883 -0.968) 23.316 0.993 ( -7.776 15.196 29.016) 33.665 1.767 ( -23.453 38.710 10.402) 46.440 2.255 ( -22.250 -13.135 10.000) 27.705 4.270 ( 4.610 -4.018 -0.159) 6.117 4.908 ( 2.354 -4.759 -0.097) 5.310 5.121 ( 2.555 10.191 -7.217) 12.746 5.397 ( 9.336 -9.660 -4.233) 14.085 5.635 ( 5.860 -1.382 -4.798) 7.699 6.071 ( -7.252 -8.643 3.005) 11.676 6.463 ( 1.063 -2.309 -5.799) 6.332 6.567 ( 6.409 -2.144 2.962) 7.378 6.972 ( -1.839 -4.717 -4.884) 7.035 7.004 ( 8.499 -3.662 -0.401) 9.263 7.366 ( 1.737 -0.474 0.405) 1.846 7.663 ( -1.016 0.729 3.864) 4.061 7.899 ( -4.357 -6.496 5.720) 9.690 8.019 ( 7.392 3.327 -3.810) 8.957 8.349 ( -1.515 -0.662 -2.870) 3.312 8.560 ( -5.984 4.665 5.116) 9.151 8.726 ( 3.319 -2.811 -1.113) 4.490 9.451 ( -3.006 0.280 5.317) 6.114 9.986 ( 1.942 2.672 0.716) 3.380 10.069 ( -2.037 2.550 -2.272) 3.977 11.350 ( -1.052 4.691 -0.784) 4.871 11.489 ( -1.956 -2.159 2.043) 3.558 13.186 ( 5.869 -3.107 -3.143) 7.347 13.718 ( -4.728 -0.663 2.214) 5.262 13.977 ( 2.875 4.869 0.054) 5.655 14.160 ( 1.257 -1.835 -0.913) 2.405 16.377 ( 0.847 -3.695 -0.453) 3.818 16.879 ( -3.449 6.002 -1.093) 7.008 17.227 ( 1.135 8.527 -10.851) 13.848 17.621 ( 3.335 18.009 -4.791) 18.932 20.591 ( -3.273 -19.040 4.907) 19.933 22.580 ( -3.295 -0.572 1.973) 3.883 ======================= Grid point 146 (57/336) ======================= q-point: (-0.09 0.09 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.791 ( 23.179 20.878 18.493) 36.265 1.002 ( -1.389 23.216 27.713) 36.179 1.199 ( -9.674 28.018 31.849) 43.508 1.981 ( -23.776 -3.346 6.970) 25.001 4.404 ( 3.861 -6.039 4.844) 8.651 4.916 ( -2.018 8.511 -12.830) 15.528 5.061 ( 3.789 -1.030 3.445) 5.224 5.574 ( 4.266 -8.769 -4.257) 10.641 5.705 ( 4.826 -0.285 -3.264) 5.833 6.042 ( -7.215 -9.619 -0.479) 12.034 6.460 ( -3.561 1.162 -5.410) 6.580 6.550 ( -0.407 1.809 -0.334) 1.884 7.042 ( 5.092 -4.348 -1.304) 6.821 7.184 ( 5.227 -5.087 4.052) 8.344 7.354 ( -2.117 -1.751 -2.515) 3.725 7.615 ( -3.630 4.428 1.305) 5.873 7.783 ( -14.535 0.247 -0.105) 14.538 8.259 ( 12.561 -4.850 2.865) 13.766 8.347 ( 2.321 2.413 -2.272) 4.046 8.543 ( -0.506 -13.624 8.401) 16.014 8.837 ( 6.572 -1.620 5.131) 8.494 9.454 ( -0.062 0.779 6.340) 6.387 9.914 ( -6.093 2.033 -3.277) 7.211 10.036 ( 1.123 2.179 -4.002) 4.693 11.311 ( 2.095 4.254 0.424) 4.761 11.459 ( -1.051 6.628 -2.701) 7.234 13.298 ( 4.593 -4.533 -4.957) 8.137 13.662 ( -3.531 -0.731 1.670) 3.974 13.942 ( -1.252 3.302 -1.251) 3.747 14.208 ( 0.669 -3.900 3.682) 5.405 16.450 ( 1.892 -4.422 1.290) 4.980 16.729 ( -5.843 9.604 -5.236) 12.401 17.230 ( 15.523 7.085 -3.635) 17.446 17.472 ( 18.657 27.403 -16.555) 37.055 20.633 ( -20.344 -19.728 9.060) 29.751 22.543 ( -2.292 -0.218 0.451) 2.346 ======================= Grid point 149 (58/336) ======================= q-point: ( 0.18 0.18 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.948 ( 6.133 -0.000 -14.948) 16.157 2.076 ( 22.277 -0.000 12.146) 25.373 2.159 ( 3.557 -0.000 23.770) 24.034 3.344 ( 17.215 -0.000 9.576) 19.699 4.385 ( 1.484 -0.000 -8.796) 8.920 4.647 ( -20.482 0.000 0.169) 20.483 4.910 ( 1.360 -0.000 -5.884) 6.040 5.427 ( -2.801 0.000 14.296) 14.568 5.696 ( -8.650 0.000 -0.243) 8.653 5.930 ( -0.094 0.000 7.037) 7.038 5.996 ( 3.915 -0.000 -10.213) 10.938 6.721 ( -9.340 0.000 -4.291) 10.279 6.742 ( -2.084 0.000 -3.573) 4.137 6.964 ( -4.650 0.000 -5.548) 7.239 7.505 ( 9.337 -0.000 -7.586) 12.030 7.594 ( -4.635 0.000 8.291) 9.498 7.643 ( 6.233 -0.000 12.334) 13.820 8.170 ( -4.425 0.000 6.502) 7.865 8.357 ( 3.767 -0.000 -14.094) 14.589 8.725 ( -7.212 0.000 -13.330) 15.156 9.142 ( -2.654 0.000 7.528) 7.982 9.581 ( -1.522 0.000 3.464) 3.784 9.804 ( 0.506 -0.000 -5.982) 6.003 9.937 ( 6.831 -0.000 11.447) 13.330 11.551 ( 12.399 -0.000 0.790) 12.424 11.567 ( -0.385 0.000 6.684) 6.695 12.847 ( -4.439 0.000 -7.155) 8.420 13.727 ( 0.786 -0.000 1.208) 1.442 13.871 ( -0.477 0.000 -5.354) 5.375 14.190 ( -5.324 0.000 1.733) 5.599 16.228 ( 2.524 -0.000 -7.226) 7.654 16.942 ( 0.395 -0.000 -9.601) 9.609 17.606 ( 23.499 -0.000 8.614) 25.028 18.082 ( -8.060 0.000 20.273) 21.816 20.246 ( -9.594 0.000 -11.592) 15.047 22.466 ( 1.398 -0.000 -4.193) 4.420 ======================= Grid point 150 (59/336) ======================= q-point: ( 0.27 0.18 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.904 ( 2.673 2.723 -14.934) 15.414 2.352 ( 2.567 -0.745 19.450) 19.633 2.482 ( 17.330 -2.527 9.152) 19.760 3.528 ( 1.292 -0.485 1.072) 1.747 4.312 ( -14.327 1.225 2.683) 14.627 4.414 ( 0.466 -3.289 -7.321) 8.040 4.818 ( -2.673 2.279 -12.626) 13.106 5.510 ( -4.997 1.737 8.625) 10.118 5.566 ( -2.649 -2.685 7.229) 8.153 5.910 ( 1.999 7.671 -1.109) 8.005 6.053 ( 0.620 -5.664 -1.196) 5.822 6.526 ( -8.199 1.042 -5.062) 9.692 6.689 ( -0.330 1.118 -3.405) 3.599 6.916 ( -0.102 -2.606 -7.768) 8.194 7.509 ( -2.157 6.741 0.862) 7.130 7.608 ( 4.780 -2.594 -4.088) 6.804 7.834 ( 2.937 -2.790 15.671) 16.186 8.156 ( -1.128 0.554 5.884) 6.017 8.332 ( 2.898 0.622 -11.437) 11.815 8.568 ( -2.975 -1.574 -12.454) 12.901 9.145 ( -1.663 -1.300 5.044) 5.468 9.489 ( -7.436 1.273 -6.883) 10.212 9.826 ( 4.134 1.290 1.056) 4.457 10.104 ( 3.926 -0.221 12.935) 13.520 11.575 ( -1.097 2.010 5.270) 5.746 11.789 ( 12.202 -3.074 2.370) 12.804 12.738 ( -5.699 -3.262 -7.171) 9.723 13.733 ( 0.128 2.155 1.642) 2.712 13.839 ( 1.070 0.961 -4.349) 4.580 14.110 ( -4.863 -0.297 0.134) 4.874 16.262 ( 4.141 -4.154 -6.826) 9.000 16.903 ( 0.817 -2.046 -10.140) 10.377 17.985 ( 9.612 9.077 14.403) 19.550 18.106 ( 4.194 -3.562 17.659) 18.496 19.965 ( -14.668 -0.003 -13.845) 20.170 22.476 ( 2.453 -0.442 -3.092) 3.972 ======================= Grid point 151 (60/336) ======================= q-point: ( 0.36 0.18 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.821 ( 2.441 4.273 -14.646) 15.450 2.459 ( -3.185 0.299 15.154) 15.488 2.746 ( 8.552 2.942 4.781) 10.230 3.440 ( -9.213 -1.028 -4.890) 10.481 4.124 ( -9.607 -1.717 3.546) 10.383 4.476 ( 4.846 -4.955 -4.891) 8.483 4.686 ( -0.031 1.740 -13.635) 13.746 5.386 ( -10.716 -5.619 0.478) 12.109 5.651 ( 1.269 5.408 11.688) 12.940 5.871 ( 4.108 7.004 -3.825) 8.976 6.048 ( -3.361 -2.102 -3.564) 5.331 6.422 ( -3.444 -1.956 -2.497) 4.682 6.696 ( 1.710 -3.083 0.855) 3.628 6.878 ( 0.930 0.801 -10.359) 10.431 7.410 ( -2.623 6.490 1.671) 7.197 7.684 ( 4.371 -3.005 -3.875) 6.569 7.933 ( -2.542 -1.407 8.864) 9.328 8.220 ( 3.361 -0.232 9.575) 10.151 8.306 ( 2.576 1.037 -7.896) 8.370 8.499 ( 0.251 -1.287 -9.792) 9.879 9.180 ( 0.066 -3.638 -0.598) 3.687 9.285 ( -8.315 1.976 -7.274) 11.223 9.886 ( 3.387 2.489 3.458) 5.443 10.218 ( 0.914 0.364 11.993) 12.033 11.552 ( -2.597 1.692 2.614) 4.055 11.986 ( 8.927 2.333 0.779) 9.259 12.650 ( -6.509 -9.194 -6.149) 12.834 13.717 ( -0.011 3.300 2.293) 4.019 13.843 ( 3.405 1.201 -2.622) 4.462 14.057 ( -2.842 -1.547 0.183) 3.241 16.337 ( 3.579 -5.584 -5.926) 8.894 16.885 ( 1.466 -3.788 -10.078) 10.866 17.951 ( -11.443 4.783 21.437) 24.766 18.410 ( 19.098 12.709 7.992) 24.293 19.672 ( -13.543 -8.133 -12.806) 20.336 22.513 ( 2.604 -0.918 -0.864) 2.893 ======================= Grid point 152 (61/336) ======================= q-point: (-0.55 0.18 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( 3.176 6.504 -15.175) 16.813 2.416 ( -11.036 2.287 11.992) 16.457 2.688 ( -6.878 14.386 -0.967) 15.975 3.296 ( -6.601 -3.340 -3.712) 8.278 4.072 ( -2.811 -3.693 0.707) 4.694 4.558 ( 4.459 -4.017 -9.084) 10.888 4.673 ( 4.837 -5.011 -6.191) 9.319 5.300 ( -8.589 -9.062 0.463) 12.494 5.635 ( -0.628 10.248 8.319) 13.215 5.860 ( 4.435 5.288 -4.182) 8.070 6.014 ( 0.699 -3.804 -5.308) 6.567 6.374 ( -3.029 -1.548 -2.147) 4.023 6.790 ( -0.160 -4.618 -5.637) 7.288 6.821 ( 3.403 1.452 1.205) 3.891 7.336 ( -0.999 4.352 0.118) 4.467 7.756 ( 2.894 -3.300 -1.470) 4.629 7.912 ( -4.577 0.843 3.717) 5.956 8.292 ( 2.296 3.204 -0.950) 4.054 8.356 ( 4.228 -2.424 5.526) 7.368 8.453 ( -0.466 0.222 -8.401) 8.417 9.039 ( -8.524 -1.475 -12.606) 15.289 9.287 ( 2.655 -2.201 4.582) 5.735 9.929 ( 2.638 3.308 4.067) 5.869 10.270 ( -1.709 0.818 9.115) 9.310 11.495 ( -3.237 1.636 0.161) 3.630 11.994 ( -0.803 7.934 -3.609) 8.753 12.667 ( -1.070 -13.419 -2.691) 13.727 13.711 ( 0.553 2.140 3.154) 3.851 13.891 ( 5.068 1.054 -1.027) 5.278 14.048 ( -0.761 -1.673 0.914) 2.052 16.386 ( 0.606 -3.727 -4.732) 6.053 16.907 ( 2.875 -6.192 -9.225) 11.476 17.821 ( -13.417 5.390 17.636) 22.806 18.469 ( 5.599 22.964 1.015) 23.659 19.622 ( -0.116 -17.178 -5.336) 17.988 22.559 ( 1.470 -1.124 1.305) 2.264 ======================= Grid point 153 (62/336) ======================= q-point: (-0.45 0.18 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.606 ( 3.193 11.646 -14.348) 18.754 2.150 ( -20.903 9.872 -1.574) 23.170 2.418 ( -9.725 10.280 9.532) 17.062 3.180 ( -7.434 5.882 -0.252) 9.483 4.081 ( 0.550 -3.479 -3.601) 5.037 4.623 ( 4.764 -6.899 -9.807) 12.902 4.799 ( 5.083 -8.370 -3.068) 10.262 5.296 ( -4.710 -11.917 1.596) 12.913 5.563 ( 0.309 13.470 6.268) 14.860 5.898 ( 6.113 -0.779 -2.534) 6.663 6.070 ( 5.577 -3.002 -5.153) 8.165 6.348 ( -1.090 -4.183 -2.137) 4.822 6.710 ( -0.443 2.205 -8.854) 9.136 6.961 ( 2.021 -6.402 8.774) 11.048 7.290 ( -0.069 2.956 -2.077) 3.613 7.798 ( -7.803 -4.432 6.204) 10.910 7.848 ( 4.578 3.996 -6.042) 8.569 8.280 ( 2.499 8.484 -1.194) 8.924 8.356 ( -5.059 -3.767 -7.052) 9.461 8.483 ( 3.817 -2.665 3.134) 5.612 8.877 ( -5.464 -0.623 -7.033) 8.928 9.375 ( 1.234 -3.114 4.370) 5.506 9.963 ( 3.038 3.555 3.178) 5.654 10.261 ( -3.468 1.392 5.526) 6.671 11.433 ( -2.634 0.732 -0.245) 2.745 11.819 ( -6.747 7.521 -5.255) 11.389 12.800 ( 3.832 -10.838 -1.130) 11.551 13.727 ( -0.445 -0.149 3.701) 3.731 13.963 ( 5.411 1.407 -0.046) 5.591 14.069 ( 1.125 -0.723 1.044) 1.697 16.371 ( -1.636 -1.164 -3.356) 3.911 16.969 ( 2.229 -7.431 -7.419) 10.735 17.641 ( -11.285 7.328 9.838) 16.669 18.264 ( -3.797 19.143 -0.517) 19.523 19.847 ( 8.638 -15.253 -0.544) 17.538 22.590 ( -0.444 -0.987 2.526) 2.749 ======================= Grid point 154 (63/336) ======================= q-point: (-0.36 0.18 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.444 ( 3.614 17.984 -9.814) 20.804 1.654 ( -20.120 17.330 -1.145) 26.579 2.274 ( -11.814 2.069 13.998) 18.433 2.906 ( -12.432 20.476 2.916) 24.131 4.117 ( 2.958 -3.501 -3.883) 6.007 4.706 ( 2.715 -7.743 -5.739) 10.013 4.954 ( 6.292 -11.233 -4.984) 13.806 5.382 ( -1.326 -13.398 1.616) 13.560 5.472 ( 0.694 13.358 2.013) 13.526 5.992 ( 2.876 -1.238 -0.570) 3.182 6.208 ( 11.717 -5.136 -3.550) 13.276 6.393 ( 1.671 -5.642 -3.455) 6.824 6.674 ( 1.463 -3.152 -3.177) 4.708 7.058 ( -3.211 -4.759 2.973) 6.465 7.266 ( 1.447 0.837 0.584) 1.771 7.703 ( -7.027 0.080 4.029) 8.100 7.891 ( 5.292 1.150 -5.520) 7.733 8.166 ( -2.803 7.081 -4.307) 8.749 8.324 ( -0.220 -2.672 -3.351) 4.292 8.577 ( 2.263 -2.790 3.536) 5.041 8.765 ( -5.259 1.167 -3.099) 6.214 9.428 ( -1.550 -2.547 5.206) 5.999 10.002 ( 4.085 3.287 1.378) 5.421 10.204 ( -4.389 1.956 1.987) 5.200 11.406 ( -1.277 -1.099 1.720) 2.408 11.616 ( -5.955 6.707 -4.019) 9.828 12.959 ( 6.110 -7.361 -1.657) 9.709 13.728 ( -3.753 -1.920 3.474) 5.463 14.031 ( 4.878 2.299 0.399) 5.407 14.104 ( 2.243 0.209 0.040) 2.253 16.336 ( -1.190 -0.255 -1.579) 1.993 16.995 ( -2.045 -4.613 -4.824) 6.981 17.475 ( -3.929 8.145 1.638) 9.190 18.033 ( -5.649 13.420 1.434) 14.631 20.119 ( 8.051 -12.661 -0.046) 15.004 22.592 ( -2.126 -0.724 2.609) 3.443 ======================= Grid point 155 (64/336) ======================= q-point: (-0.27 0.18 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.223 ( -2.416 20.919 -0.457) 21.063 1.340 ( 0.606 21.278 13.909) 25.428 2.132 ( -15.533 -0.234 11.835) 19.529 2.461 ( -13.635 33.054 6.003) 36.257 4.197 ( 4.300 -3.794 -0.320) 5.743 4.797 ( 2.828 -6.828 0.162) 7.392 5.141 ( 6.711 -12.213 -7.634) 15.889 5.357 ( 0.027 10.252 -4.033) 11.017 5.501 ( -0.458 -13.045 0.099) 13.053 5.995 ( -1.621 0.552 -0.116) 1.717 6.428 ( 2.215 -1.506 -4.248) 5.022 6.468 ( 12.028 -7.859 -2.012) 14.509 6.781 ( 1.723 -11.140 0.201) 11.274 6.992 ( -3.895 -1.533 -3.961) 5.762 7.322 ( -0.673 -2.776 6.347) 6.960 7.658 ( -1.526 -0.746 3.471) 3.864 7.889 ( 0.601 3.586 -5.249) 6.385 8.077 ( 1.193 2.439 -1.959) 3.348 8.336 ( 2.520 -0.467 -3.843) 4.619 8.623 ( -8.050 2.031 3.008) 8.830 8.673 ( 2.923 -2.338 1.553) 4.053 9.444 ( -2.316 -1.055 6.079) 6.590 10.043 ( 3.279 3.112 0.795) 4.590 10.111 ( -4.412 1.936 -2.402) 5.383 11.435 ( 0.106 -2.547 4.874) 5.501 11.474 ( -1.249 7.066 -1.635) 7.359 13.106 ( 6.650 -4.847 -3.088) 8.789 13.684 ( -6.323 -2.514 2.848) 7.376 14.072 ( 2.996 3.846 0.202) 4.879 14.128 ( 1.143 -0.695 -1.953) 2.367 16.333 ( 0.853 -0.825 0.632) 1.344 16.941 ( -3.148 0.510 -3.036) 4.403 17.382 ( 2.134 8.764 -2.509) 9.363 17.869 ( -1.949 9.398 1.022) 9.653 20.311 ( 1.124 -11.899 -1.074) 12.000 22.570 ( -2.826 -0.495 1.724) 3.348 ======================= Grid point 156 (65/336) ======================= q-point: (-0.18 0.18 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.192 ( 15.879 19.287 16.734) 30.069 1.315 ( 4.054 19.056 26.713) 33.063 1.871 ( -12.927 20.391 5.031) 24.662 2.041 ( -7.202 22.412 10.550) 25.796 4.315 ( 3.982 -4.235 4.138) 7.136 4.930 ( 4.155 -4.785 4.453) 7.745 5.139 ( -1.671 7.091 -11.960) 14.004 5.369 ( 3.208 -11.591 -5.179) 13.094 5.603 ( -0.868 -11.782 -1.503) 11.910 5.952 ( -1.935 0.913 -0.967) 2.348 6.461 ( 2.439 -0.714 -2.661) 3.679 6.572 ( -3.464 -0.401 -3.315) 4.811 6.887 ( 4.203 -11.022 -4.624) 12.670 7.042 ( 0.385 -10.308 2.515) 10.617 7.336 ( -2.771 0.357 5.371) 6.054 7.662 ( -3.493 -1.801 -0.737) 3.998 7.808 ( -1.433 5.676 -2.135) 6.231 8.177 ( 11.684 -2.955 3.602) 12.579 8.354 ( 1.898 -1.963 -7.252) 7.749 8.467 ( -8.801 2.303 4.237) 10.035 8.805 ( 5.960 -1.960 7.538) 9.807 9.464 ( -0.315 0.064 6.875) 6.882 9.963 ( -6.712 2.815 -3.810) 8.215 10.078 ( 2.398 2.341 -2.948) 4.464 11.418 ( 2.182 6.751 0.529) 7.115 11.504 ( 1.913 -0.228 5.729) 6.044 13.210 ( 2.932 -4.670 -4.954) 7.413 13.630 ( -4.143 -2.348 2.271) 5.276 14.029 ( -1.919 5.369 -2.382) 6.179 14.147 ( 0.347 -2.902 -0.353) 2.944 16.385 ( 2.140 -2.112 2.910) 4.184 16.855 ( -2.275 4.433 -4.047) 6.419 17.372 ( 8.141 8.799 -0.141) 11.988 17.804 ( 6.259 9.290 -4.952) 12.248 20.346 ( -9.270 -11.650 -0.714) 14.905 22.538 ( -2.186 -0.297 0.367) 2.236 ======================= Grid point 157 (66/336) ======================= q-point: (-0.09 0.18 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.323 ( 3.120 23.667 21.039) 31.820 1.439 ( 7.608 16.653 28.790) 34.119 1.720 ( 22.197 13.577 4.265) 26.367 1.934 ( 7.218 13.297 12.289) 19.492 4.443 ( 2.392 -4.646 5.945) 7.915 4.880 ( -2.456 9.471 -11.771) 15.307 5.132 ( 3.262 -3.180 6.320) 7.791 5.458 ( -4.003 -12.099 -1.158) 12.796 5.683 ( -0.045 -9.818 -2.966) 10.256 5.923 ( 0.905 -0.547 -4.502) 4.625 6.326 ( -9.954 5.030 -4.833) 12.155 6.609 ( 4.977 -3.242 2.206) 6.336 7.012 ( 1.474 -8.024 -5.172) 9.659 7.126 ( -5.182 -12.037 3.136) 13.475 7.320 ( -0.538 2.575 3.546) 4.415 7.573 ( -5.089 0.600 -0.816) 5.189 7.716 ( -0.455 8.928 -2.046) 9.171 8.291 ( -6.076 -2.127 1.708) 6.660 8.376 ( 3.621 -1.606 -8.294) 9.192 8.576 ( 13.350 -10.238 12.507) 20.964 8.946 ( 3.202 0.068 8.503) 9.086 9.516 ( 1.462 0.469 7.316) 7.475 9.784 ( -7.691 2.160 -8.174) 11.430 10.051 ( 0.177 3.594 -3.548) 5.054 11.393 ( 0.787 6.598 1.563) 6.826 11.532 ( 2.506 6.185 1.032) 6.753 13.207 ( -4.137 -4.379 -6.508) 8.868 13.635 ( 0.283 -1.663 0.968) 1.945 13.937 ( -1.659 2.469 -1.199) 3.207 14.188 ( -0.567 -4.319 3.039) 5.312 16.441 ( -0.856 -0.901 2.414) 2.715 16.778 ( 4.962 6.644 -3.417) 8.968 17.355 ( -0.749 11.606 -2.628) 11.923 17.876 ( 14.769 5.321 -5.784) 16.730 20.302 ( -7.779 -12.842 1.857) 15.129 22.515 ( -0.884 -0.294 -0.904) 1.298 ======================= Grid point 161 (67/336) ======================= q-point: ( 0.27 0.27 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.864 ( 1.688 -0.000 -13.090) 13.198 2.465 ( -1.121 0.000 14.017) 14.062 2.769 ( 13.076 -0.000 5.934) 14.359 3.434 ( -10.492 0.000 -4.708) 11.500 4.104 ( -11.423 0.000 3.630) 11.986 4.425 ( 5.099 -0.000 -5.164) 7.257 4.707 ( -1.054 0.000 -16.049) 16.084 5.328 ( -12.247 0.000 0.990) 12.287 5.706 ( 3.706 -0.000 11.693) 12.267 5.929 ( -4.514 0.000 1.553) 4.774 6.056 ( 5.096 -0.000 -5.539) 7.526 6.381 ( -6.812 0.000 0.235) 6.816 6.659 ( 0.916 -0.000 -6.280) 6.346 6.897 ( 3.542 -0.000 -8.844) 9.527 7.504 ( -6.881 0.000 8.349) 10.819 7.624 ( 5.190 -0.000 -7.746) 9.324 7.919 ( -0.324 0.000 8.182) 8.189 8.217 ( 2.530 -0.000 9.328) 9.664 8.310 ( 1.911 -0.000 -9.440) 9.631 8.498 ( 2.459 -0.000 -7.821) 8.199 9.143 ( -0.606 0.000 -2.583) 2.653 9.304 ( -8.590 0.000 -5.993) 10.474 9.912 ( 4.524 -0.000 1.198) 4.680 10.220 ( 0.157 -0.000 13.813) 13.814 11.568 ( -3.360 0.000 2.903) 4.440 12.015 ( 14.392 -0.000 2.155) 14.553 12.553 ( -9.666 0.000 -7.708) 12.363 13.750 ( -0.757 0.000 2.243) 2.367 13.856 ( 3.175 -0.000 -2.950) 4.334 14.041 ( -2.905 0.000 -0.049) 2.905 16.283 ( 5.167 -0.000 -5.647) 7.655 16.849 ( 1.209 -0.000 -10.054) 10.126 17.997 ( -13.445 0.000 22.603) 26.299 18.541 ( 27.033 -0.000 8.522) 28.344 19.585 ( -20.278 0.000 -14.580) 24.976 22.504 ( 2.776 -0.000 -1.260) 3.048 ======================= Grid point 162 (68/336) ======================= q-point: (-0.64 0.27 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.810 ( 2.311 2.235 -11.310) 11.758 2.466 ( -6.825 1.994 8.850) 11.353 2.918 ( 3.439 8.850 1.171) 9.567 3.205 ( -11.634 -5.143 -5.084) 13.698 4.014 ( -3.824 -1.906 3.113) 5.287 4.495 ( 5.069 -2.354 -4.551) 7.207 4.611 ( 1.558 -1.273 -15.953) 16.080 5.167 ( -11.132 -4.178 2.214) 12.094 5.769 ( 0.594 5.161 5.642) 7.669 5.899 ( -0.174 -5.369 -2.112) 5.772 6.043 ( 2.410 9.027 -4.429) 10.340 6.338 ( -3.218 -3.252 3.399) 5.699 6.676 ( 2.419 -3.981 -2.010) 5.074 6.882 ( 2.302 2.195 -9.095) 9.635 7.420 ( -5.122 3.710 4.395) 7.702 7.673 ( 1.213 -3.977 -0.973) 4.270 7.934 ( -0.176 0.903 0.877) 1.271 8.286 ( 0.671 -1.184 -6.972) 7.103 8.330 ( 3.489 -0.714 9.389) 10.042 8.509 ( 3.481 3.010 -3.715) 5.914 8.998 ( -8.562 -1.849 -14.594) 17.021 9.264 ( 1.145 -0.487 4.691) 4.853 9.979 ( 3.843 1.618 1.092) 4.310 10.274 ( -2.990 -0.122 11.615) 11.994 11.512 ( -4.322 0.321 0.157) 4.337 12.174 ( 4.146 10.931 -2.665) 11.991 12.416 ( -2.722 -12.876 -4.155) 13.801 13.740 ( -1.604 0.898 2.898) 3.432 13.902 ( 4.222 0.067 -1.555) 4.500 14.030 ( 0.904 -0.288 1.188) 1.520 16.339 ( 4.189 -1.210 -4.233) 6.077 16.823 ( 1.647 -2.471 -9.255) 9.720 17.893 ( -13.937 2.011 19.166) 23.783 18.879 ( 10.557 20.201 1.048) 22.817 19.287 ( -6.298 -18.124 -6.881) 20.383 22.544 ( 1.887 -0.407 0.828) 2.101 ======================= Grid point 163 (69/336) ======================= q-point: (-0.55 0.27 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.759 ( 3.084 4.614 -9.829) 11.287 2.296 ( -13.938 6.721 2.396) 15.658 2.688 ( -10.252 15.509 0.230) 18.593 3.190 ( -0.213 -4.350 -0.229) 4.361 4.023 ( 0.051 -2.468 0.384) 2.499 4.529 ( 3.758 -2.717 -11.993) 12.858 4.639 ( 3.359 -7.916 -5.875) 10.415 5.086 ( -8.531 -9.104 3.608) 12.988 5.763 ( 2.312 6.255 4.236) 7.900 5.943 ( 0.921 -0.129 -5.205) 5.288 5.990 ( 5.373 2.418 -2.443) 6.378 6.338 ( -0.105 0.653 1.579) 1.711 6.739 ( 0.370 -0.992 -3.839) 3.983 6.852 ( 0.182 -3.161 0.701) 3.243 7.340 ( -2.799 2.327 -0.329) 3.655 7.707 ( -3.633 -4.485 4.207) 7.143 7.921 ( 3.157 3.150 -5.357) 6.970 8.262 ( -1.596 -3.161 -6.538) 7.435 8.442 ( 1.648 -0.373 9.985) 10.127 8.468 ( 1.332 6.939 -5.843) 9.168 8.834 ( -5.348 -3.555 -8.890) 10.967 9.327 ( 1.163 -1.828 4.568) 5.055 10.023 ( 3.479 2.608 1.078) 4.479 10.271 ( -4.634 -0.137 7.674) 8.966 11.435 ( -4.490 -0.230 -0.899) 4.585 11.975 ( -8.329 8.199 -5.641) 12.977 12.603 ( 9.261 -9.494 -1.184) 13.315 13.722 ( -2.687 -0.209 3.433) 4.365 13.965 ( 3.822 -0.833 -0.904) 4.015 14.079 ( 4.121 1.265 2.184) 4.832 16.370 ( 1.732 0.709 -2.724) 3.305 16.840 ( 1.888 -5.679 -7.416) 9.530 17.751 ( -11.665 4.180 12.702) 17.745 18.589 ( -12.645 14.673 -4.513) 19.889 19.581 ( 15.311 -12.455 0.885) 19.757 22.575 ( 0.095 -0.545 2.181) 2.250 ======================= Grid point 164 (70/336) ======================= q-point: (-0.45 0.27 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.692 ( 1.598 7.416 -8.251) 11.209 1.957 ( -13.323 15.095 0.743) 20.147 2.424 ( -9.364 12.622 7.914) 17.597 3.167 ( -2.504 7.238 0.897) 7.711 4.057 ( 1.827 -2.744 -1.291) 3.540 4.570 ( 3.598 -6.207 -7.658) 10.494 4.743 ( 3.149 -10.663 -5.340) 12.334 5.110 ( -5.345 -13.962 4.290) 15.554 5.725 ( 0.495 12.674 1.932) 12.830 5.971 ( 6.432 -1.098 -3.790) 7.546 6.091 ( 6.432 -5.732 -3.809) 9.420 6.363 ( 4.219 1.408 0.498) 4.475 6.660 ( -3.296 1.301 -5.108) 6.217 6.937 ( -2.197 -7.491 6.214) 9.978 7.283 ( -1.091 0.756 -2.262) 2.623 7.684 ( -6.038 -2.067 5.069) 8.150 7.930 ( 6.641 2.726 -8.573) 11.182 8.195 ( -5.262 -2.642 -6.771) 8.973 8.379 ( 1.438 7.061 -2.085) 7.502 8.535 ( 1.657 -1.645 6.394) 6.806 8.756 ( -4.191 -1.961 -3.899) 6.050 9.380 ( -0.811 -2.350 5.417) 5.960 10.059 ( 3.522 2.643 0.491) 4.431 10.225 ( -5.144 0.312 3.394) 6.171 11.377 ( -3.287 -1.492 1.040) 3.757 11.753 ( -6.196 7.068 -3.404) 9.997 12.827 ( 10.255 -6.373 -2.053) 12.247 13.693 ( -4.900 -1.613 3.471) 6.218 14.023 ( 2.658 -1.595 -0.956) 3.244 14.149 ( 4.993 3.012 1.648) 6.059 16.358 ( 0.519 2.425 -0.846) 2.620 16.883 ( 0.169 -6.671 -4.718) 8.173 17.616 ( -5.160 6.386 5.443) 9.851 18.252 ( -12.707 9.817 -0.057) 16.058 19.912 ( 12.640 -9.222 -1.293) 15.700 22.581 ( -1.661 -0.463 2.376) 2.936 ======================= Grid point 165 (71/336) ======================= q-point: (-0.36 0.27 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.539 ( -4.089 12.134 1.693) 12.916 1.733 ( 3.456 19.426 5.842) 20.578 2.223 ( -9.879 10.074 10.256) 17.443 2.974 ( -5.883 20.858 2.398) 21.804 4.126 ( 3.219 -3.811 0.664) 5.032 4.665 ( 3.892 -6.858 -0.460) 7.899 4.886 ( 4.834 -13.695 -6.680) 15.985 5.206 ( -4.063 -16.796 3.014) 17.541 5.583 ( -1.575 13.100 -4.795) 14.038 6.033 ( 2.504 2.179 -0.713) 3.395 6.283 ( 10.150 -9.809 -2.973) 14.425 6.431 ( 5.603 0.760 -4.553) 7.259 6.607 ( -3.132 -6.596 -0.772) 7.342 6.939 ( -6.698 -3.907 1.345) 7.870 7.287 ( 1.059 -1.073 3.182) 3.521 7.642 ( -3.807 -1.177 3.225) 5.126 7.959 ( 6.031 3.048 -9.469) 11.633 8.102 ( -2.362 0.049 -2.451) 3.404 8.348 ( 1.483 2.038 -4.211) 4.907 8.615 ( -0.755 -1.851 8.727) 8.953 8.670 ( -2.798 1.105 -2.307) 3.791 9.415 ( -1.629 -1.893 6.632) 7.087 10.093 ( 3.338 2.085 -0.228) 3.942 10.140 ( -5.471 1.150 -0.983) 5.677 11.385 ( -0.216 -2.279 5.669) 6.114 11.613 ( -1.618 6.978 -0.781) 7.206 13.017 ( 8.776 -4.423 -3.269) 10.357 13.636 ( -6.738 -2.441 2.991) 7.765 14.066 ( 1.314 -2.040 -1.319) 2.762 14.183 ( 2.441 4.050 -0.666) 4.775 16.348 ( 1.193 2.371 1.694) 3.149 16.904 ( -1.017 -4.100 -2.507) 4.913 17.546 ( 2.524 8.293 1.018) 8.728 18.009 ( -9.212 6.007 3.384) 11.507 20.123 ( 5.150 -8.409 -4.881) 11.003 22.562 ( -2.477 -0.336 1.571) 2.953 ======================= Grid point 166 (72/336) ======================= q-point: (-0.27 0.27 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.495 ( 7.796 13.228 16.336) 22.419 1.700 ( 7.140 19.345 12.553) 24.141 2.034 ( -8.815 10.268 8.381) 15.918 2.662 ( -3.073 30.833 3.980) 31.240 4.233 ( 3.004 -4.696 4.085) 6.911 4.821 ( 5.532 -6.188 6.043) 10.267 5.053 ( 4.569 -13.970 -8.516) 16.987 5.302 ( -5.486 -13.856 -1.681) 14.997 5.395 ( -2.108 7.452 -6.655) 10.211 6.016 ( 0.515 4.513 -0.975) 4.646 6.438 ( 1.836 -2.142 0.410) 2.851 6.510 ( 2.730 -5.890 -7.617) 10.008 6.658 ( 1.022 -12.230 -2.496) 12.524 6.883 ( -4.634 -5.115 2.299) 7.275 7.343 ( 0.987 -0.078 5.123) 5.218 7.614 ( -3.812 -2.567 0.474) 4.620 7.934 ( 3.770 6.269 -8.273) 11.043 8.136 ( 5.865 -1.836 1.707) 6.378 8.319 ( -1.350 -1.203 -5.519) 5.807 8.528 ( -5.585 3.428 1.560) 6.736 8.769 ( 5.958 -1.691 8.919) 10.858 9.453 ( -0.445 -1.134 7.534) 7.632 10.011 ( -6.528 2.296 -4.482) 8.245 10.118 ( 2.445 1.703 -1.965) 3.569 11.482 ( 3.674 -1.453 9.968) 10.723 11.551 ( 1.489 6.892 1.122) 7.139 13.128 ( 2.279 -3.903 -4.602) 6.450 13.582 ( -3.863 -2.699 2.166) 5.186 14.088 ( -0.059 -2.163 -1.184) 2.466 14.134 ( -1.841 4.327 -3.365) 5.782 16.377 ( 2.107 1.288 4.396) 5.042 16.898 ( -0.086 0.156 -2.925) 2.931 17.549 ( 7.161 9.676 1.921) 12.190 17.901 ( -1.786 2.535 3.524) 4.694 20.165 ( -4.368 -8.156 -8.112) 12.305 22.533 ( -2.011 -0.232 0.294) 2.045 ======================= Grid point 167 (73/336) ======================= q-point: (-0.18 0.27 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.687 ( 11.230 8.353 20.197) 24.573 1.733 ( 6.142 19.697 20.186) 28.864 1.868 ( -1.920 11.075 3.277) 11.708 2.445 ( 11.879 31.358 7.371) 34.333 4.350 ( 1.275 -5.536 6.359) 8.527 4.988 ( 2.192 -1.134 3.214) 4.052 5.116 ( 2.027 3.029 -8.487) 9.237 5.218 ( -4.561 -12.002 -3.268) 13.248 5.439 ( -0.554 -13.655 -1.688) 13.770 5.966 ( -0.031 3.776 -3.214) 4.958 6.400 ( -7.261 2.600 -2.973) 8.265 6.521 ( 0.177 -6.627 0.750) 6.671 6.817 ( 3.867 -11.574 -4.433) 12.983 6.919 ( -1.665 -8.717 2.427) 9.200 7.363 ( -0.884 1.591 3.499) 3.944 7.567 ( -3.647 -1.297 -1.584) 4.182 7.875 ( 2.227 7.659 -6.323) 10.179 8.250 ( -4.615 -2.411 -3.016) 6.017 8.297 ( 5.337 -4.988 -2.781) 7.816 8.511 ( 6.244 1.527 8.920) 10.995 8.937 ( 5.309 -1.050 9.816) 11.209 9.515 ( 0.898 -0.760 8.120) 8.205 9.834 ( -7.572 3.120 -8.200) 11.589 10.109 ( 0.846 2.412 -3.348) 4.212 11.524 ( 0.875 6.670 3.492) 7.579 11.612 ( 4.992 3.080 7.662) 9.649 13.110 ( -4.681 -5.378 -5.499) 9.004 13.600 ( 1.273 -2.043 0.530) 2.465 14.009 ( -3.987 4.581 -2.545) 6.585 14.113 ( -0.346 -3.655 -0.402) 3.693 16.432 ( 1.278 0.473 5.497) 5.663 16.876 ( 3.609 3.643 -4.506) 6.826 17.570 ( 2.990 10.696 2.003) 11.286 17.939 ( 5.823 1.801 2.897) 6.748 20.087 ( -7.196 -10.080 -7.742) 14.606 22.510 ( -0.782 -0.188 -0.894) 1.202 ======================= Grid point 168 (74/336) ======================= q-point: (-0.09 0.27 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.698 ( 4.944 17.960 10.426) 21.347 1.871 ( 9.221 7.616 8.624) 14.745 1.894 ( 6.023 7.888 15.772) 18.635 2.605 ( 27.663 19.715 14.044) 36.758 4.437 ( -1.612 -5.542 4.203) 7.139 4.880 ( -0.188 7.267 -9.505) 11.966 5.105 ( -7.895 -4.560 0.195) 9.119 5.310 ( -0.315 -8.662 7.881) 11.715 5.555 ( 1.677 -12.412 -4.402) 13.275 5.911 ( -0.850 0.919 -5.493) 5.634 6.240 ( -5.150 6.324 1.657) 8.322 6.589 ( -1.731 -9.387 -1.520) 9.666 6.890 ( -3.077 -8.004 -6.238) 10.604 7.023 ( 2.482 -6.421 6.983) 9.805 7.335 ( -2.313 1.185 1.927) 3.235 7.532 ( 1.251 -0.248 -3.675) 3.889 7.768 ( -1.903 8.516 -4.494) 9.815 8.194 ( -3.332 -1.690 0.750) 3.810 8.358 ( 3.119 -3.191 -7.223) 8.490 8.754 ( 7.556 -6.778 10.141) 14.348 9.072 ( 4.906 1.785 11.004) 12.179 9.575 ( -2.778 -0.671 6.820) 7.394 9.633 ( -4.244 2.817 -8.066) 9.540 10.064 ( 0.078 3.519 -4.431) 5.660 11.481 ( -0.355 7.736 3.295) 8.416 11.660 ( 3.655 7.399 3.833) 9.099 13.055 ( -3.448 -4.971 -6.732) 9.051 13.630 ( 0.146 -1.409 -0.024) 1.417 13.917 ( -2.021 1.505 -1.938) 3.179 14.152 ( -0.650 -4.567 2.348) 5.177 16.452 ( 0.091 2.670 1.360) 2.998 16.936 ( 10.350 2.172 -1.631) 10.701 17.428 ( -3.042 15.559 -5.395) 16.747 18.032 ( 1.365 1.073 9.874) 10.026 20.103 ( -0.230 -14.855 -6.249) 16.117 22.498 ( 0.055 0.010 -2.043) 2.043 ======================= Grid point 173 (75/336) ======================= q-point: (-0.64 0.36 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.798 ( 1.350 -0.000 -6.563) 6.700 2.369 ( -10.248 0.000 0.785) 10.278 2.893 ( -14.721 0.000 -2.142) 14.876 3.091 ( 6.772 -0.000 0.291) 6.779 3.998 ( 0.077 -0.000 2.474) 2.475 4.527 ( 2.065 -0.000 -16.157) 16.288 4.535 ( 3.981 -0.000 -4.259) 5.829 4.995 ( -9.908 0.000 4.327) 10.812 5.851 ( 3.538 -0.000 -4.842) 5.996 5.852 ( 1.771 -0.000 2.472) 3.040 6.105 ( 2.965 -0.000 -7.478) 8.044 6.331 ( -1.548 0.000 12.040) 12.139 6.701 ( 3.406 -0.000 0.656) 3.469 6.843 ( -1.988 0.000 -8.445) 8.676 7.366 ( -5.131 0.000 0.915) 5.212 7.658 ( -1.854 0.000 3.555) 4.009 7.953 ( 3.313 -0.000 -4.981) 5.982 8.230 ( -1.632 0.000 -7.498) 7.674 8.432 ( 2.874 -0.000 8.123) 8.616 8.556 ( 0.667 -0.000 -0.748) 1.002 8.784 ( -5.618 0.000 -11.367) 12.680 9.310 ( 0.974 -0.000 4.645) 4.746 10.050 ( 3.819 -0.000 -0.478) 3.848 10.267 ( -5.352 0.000 9.256) 10.692 11.432 ( -5.001 0.000 -1.114) 5.124 12.070 ( -12.753 0.000 -5.764) 13.995 12.496 ( 15.054 -0.000 -1.113) 15.095 13.721 ( -3.525 0.000 3.386) 4.888 13.954 ( 3.403 -0.000 -1.103) 3.577 14.094 ( 4.964 -0.000 2.371) 5.501 16.381 ( 3.476 -0.000 -2.218) 4.123 16.782 ( 1.221 -0.000 -7.616) 7.714 17.791 ( -11.757 0.000 13.653) 18.017 18.748 ( -21.059 0.000 -7.404) 22.323 19.443 ( 22.940 -0.000 2.841) 23.116 22.570 ( 0.295 -0.000 2.066) 2.087 ======================= Grid point 175 (76/336) ======================= q-point: (-0.55 0.36 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.761 ( -2.569 1.270 -1.825) 3.398 2.174 ( -7.734 6.626 -1.617) 10.312 2.654 ( -9.421 8.876 3.359) 13.373 3.204 ( 5.185 -1.312 -1.060) 5.452 4.022 ( 0.526 -0.924 1.453) 1.800 4.493 ( 3.486 -1.741 -9.888) 10.628 4.585 ( 2.535 -5.258 -5.235) 7.840 4.912 ( -7.486 -6.002 5.360) 10.991 5.881 ( 4.362 3.533 0.179) 5.616 5.935 ( 6.605 -2.683 -5.897) 9.251 6.079 ( 2.851 3.621 -5.511) 7.185 6.392 ( 0.570 0.847 9.143) 9.199 6.704 ( -4.669 3.030 -5.135) 7.573 6.801 ( -0.181 -6.208 3.552) 7.155 7.292 ( -2.433 0.211 -3.007) 3.874 7.644 ( -4.372 -1.533 5.243) 6.997 7.977 ( 5.751 1.738 -8.525) 10.430 8.146 ( -3.324 -1.770 -8.160) 8.986 8.497 ( -0.721 3.611 -5.149) 6.331 8.519 ( -0.642 0.628 11.564) 11.598 8.705 ( -1.100 -2.703 -5.244) 6.001 9.347 ( -0.597 -0.987 5.434) 5.555 10.096 ( 3.241 1.140 -1.224) 3.647 10.222 ( -5.800 -0.276 5.567) 8.044 11.358 ( -3.734 -0.520 0.894) 3.875 11.854 ( -8.387 3.059 -2.631) 9.307 12.737 ( 14.077 -2.731 -2.790) 14.608 13.672 ( -5.504 -0.570 3.522) 6.559 13.999 ( 2.541 -0.752 -1.185) 2.903 14.189 ( 5.286 1.152 1.916) 5.739 16.409 ( 1.981 2.194 0.052) 2.956 16.776 ( 0.505 -3.796 -4.794) 6.135 17.700 ( -5.447 2.374 7.121) 9.275 18.385 ( -17.790 3.868 -1.219) 18.246 19.787 ( 16.380 -3.656 -1.750) 16.874 22.575 ( -1.396 -0.155 2.277) 2.675 ======================= Grid point 176 (77/336) ======================= q-point: (-0.45 0.36 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.677 ( -4.306 3.582 4.150) 6.971 2.037 ( 0.890 12.295 4.780) 13.222 2.461 ( -5.505 12.780 5.512) 14.967 3.231 ( 1.440 7.044 -1.011) 7.260 4.060 ( 1.128 -2.977 1.848) 3.681 4.558 ( 5.265 -4.179 -1.389) 6.864 4.663 ( 3.063 -9.182 -5.081) 10.932 4.925 ( -5.549 -11.929 4.453) 13.890 5.822 ( -0.540 11.282 -6.335) 12.950 6.056 ( 6.384 0.136 -1.372) 6.531 6.134 ( 8.371 -5.473 -4.340) 10.902 6.434 ( 0.758 -0.903 1.246) 1.716 6.553 ( -7.416 0.413 -3.494) 8.208 6.859 ( -3.164 -4.167 4.309) 6.778 7.273 ( 1.586 -0.556 -0.238) 1.698 7.610 ( -4.941 -1.940 3.214) 6.206 8.003 ( 6.652 1.910 -10.019) 12.177 8.084 ( -0.780 -1.613 -5.373) 5.664 8.401 ( -2.893 2.898 -3.154) 5.169 8.588 ( -0.389 -0.918 10.248) 10.296 8.685 ( 0.123 0.377 -2.680) 2.709 9.380 ( -1.187 -1.572 6.809) 7.088 10.121 ( 2.363 0.907 -1.952) 3.197 10.154 ( -5.484 0.314 1.386) 5.665 11.354 ( 0.042 -0.993 6.408) 6.484 11.720 ( -3.112 4.191 -0.121) 5.222 12.949 ( 11.058 -2.709 -3.820) 12.008 13.599 ( -7.026 -1.429 3.072) 7.800 14.032 ( 1.284 -1.383 -1.692) 2.534 14.243 ( 2.316 2.268 -0.318) 3.257 16.412 ( 1.525 3.959 2.655) 5.005 16.809 ( 0.512 -5.348 -1.487) 5.574 17.674 ( 2.878 4.959 2.648) 6.316 18.099 ( -14.108 3.509 3.165) 14.878 19.998 ( 7.638 -4.816 -6.519) 11.137 22.557 ( -2.254 -0.154 1.502) 2.713 ======================= Grid point 177 (78/336) ======================= q-point: (-0.36 0.36 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.661 ( 2.096 4.719 10.336) 11.554 2.012 ( 4.484 14.414 12.574) 19.646 2.306 ( -1.210 16.444 6.839) 17.851 3.110 ( -1.002 16.797 0.074) 16.827 4.138 ( 1.313 -5.293 3.809) 6.652 4.716 ( 7.036 -4.597 6.526) 10.641 4.794 ( 4.326 -12.527 -6.003) 14.549 4.995 ( -4.805 -15.458 2.310) 16.352 5.619 ( -3.230 13.226 -10.066) 16.932 6.091 ( 1.084 3.116 0.044) 3.299 6.324 ( 4.896 -8.968 -4.101) 11.009 6.441 ( -1.326 -1.478 -4.099) 4.555 6.474 ( 0.167 -6.841 -1.481) 7.002 6.838 ( -4.005 -0.605 3.701) 5.487 7.331 ( 2.797 -0.989 2.234) 3.714 7.563 ( -4.736 -2.963 -0.341) 5.597 8.019 ( 5.534 2.888 -11.258) 12.873 8.104 ( 4.072 -1.627 -0.997) 4.496 8.317 ( -3.452 0.922 -1.934) 4.063 8.588 ( -2.766 3.000 3.299) 5.247 8.743 ( 5.135 -1.190 7.488) 9.157 9.426 ( -0.429 -1.597 7.825) 7.997 10.049 ( -5.351 1.807 -3.914) 6.871 10.135 ( 1.262 0.052 -1.925) 2.302 11.458 ( 4.045 -0.972 12.624) 13.292 11.667 ( 1.270 5.107 1.226) 5.403 13.067 ( 2.508 -2.565 -4.314) 5.611 13.535 ( -3.703 -2.164 2.028) 4.745 14.045 ( 0.003 -1.988 -2.230) 2.987 14.209 ( -2.097 3.241 -2.959) 4.864 16.428 ( 1.966 3.837 5.601) 7.068 16.866 ( 1.929 -3.282 -0.528) 3.843 17.715 ( 5.693 7.527 3.667) 10.125 17.930 ( -5.302 0.993 3.935) 6.677 20.036 ( -2.219 -5.585 -11.013) 12.546 22.530 ( -1.866 -0.114 0.263) 1.888 ======================= Grid point 178 (79/336) ======================= q-point: (-0.27 0.36 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.743 ( 3.126 0.461 6.020) 6.799 2.060 ( 6.684 16.504 20.628) 27.251 2.206 ( 3.970 20.127 10.079) 22.857 2.948 ( 4.694 21.032 2.008) 21.643 4.233 ( -0.426 -6.853 5.393) 8.731 4.913 ( 4.107 -6.347 3.822) 8.471 4.955 ( 4.711 -10.573 1.605) 11.686 5.065 ( -4.046 -14.000 -3.476) 14.981 5.394 ( -2.018 9.813 -8.613) 13.212 6.039 ( -2.189 3.676 -2.613) 5.013 6.358 ( -4.879 -9.897 -1.336) 11.115 6.415 ( -3.223 -1.159 -0.891) 3.539 6.627 ( 7.772 -7.779 -3.966) 11.690 6.828 ( 0.031 -1.277 3.625) 3.843 7.375 ( 0.112 -0.220 1.353) 1.375 7.522 ( -2.696 -3.488 -2.943) 5.300 7.990 ( 3.482 4.478 -10.429) 11.872 8.193 ( 3.450 -3.149 -4.553) 6.523 8.249 ( -3.176 -0.398 0.693) 3.275 8.573 ( 3.089 4.482 7.833) 9.538 8.909 ( 6.039 -1.983 10.001) 11.850 9.489 ( 0.108 -1.756 8.299) 8.483 9.898 ( -6.044 3.644 -7.474) 10.280 10.134 ( 0.534 0.041 -3.387) 3.429 11.598 ( 0.566 1.265 12.691) 12.767 11.694 ( 8.112 5.743 4.048) 10.732 13.020 ( -7.142 -4.009 -4.486) 9.338 13.561 ( 2.495 -2.028 0.443) 3.245 14.046 ( -1.070 -2.576 -2.056) 3.465 14.097 ( -4.215 3.593 -3.634) 6.624 16.466 ( 1.483 3.092 7.581) 8.320 16.914 ( 4.045 0.504 -3.081) 5.110 17.717 ( -2.967 3.898 9.242) 10.460 17.985 ( 10.479 4.326 1.434) 11.427 19.924 ( -8.320 -7.407 -13.300) 17.349 22.508 ( -0.659 -0.071 -0.831) 1.063 ======================= Grid point 179 (80/336) ======================= q-point: (-0.18 0.36 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.794 ( 2.049 -1.621 -4.426) 5.139 2.111 ( 3.275 18.339 21.696) 28.597 2.206 ( 9.262 18.621 14.779) 25.514 2.965 ( 16.710 16.650 6.869) 24.569 4.307 ( -3.301 -8.119 4.929) 10.055 4.973 ( -4.601 0.623 -7.057) 8.448 4.980 ( -5.706 -8.362 -2.008) 10.321 5.191 ( 7.089 -5.339 4.425) 9.917 5.352 ( 2.322 -5.445 -1.108) 6.022 5.940 ( -3.422 2.124 -4.683) 6.177 6.345 ( -3.689 4.409 3.640) 6.804 6.384 ( -3.653 -11.641 -1.746) 12.325 6.740 ( 1.262 -7.096 -7.789) 10.612 6.931 ( 5.713 -3.295 7.429) 9.935 7.357 ( -2.776 1.020 0.765) 3.055 7.503 ( 0.594 -2.851 -5.469) 6.196 7.911 ( -0.835 6.355 -7.822) 10.113 8.173 ( -1.751 -0.667 -1.458) 2.375 8.279 ( 3.191 -4.735 -6.095) 8.351 8.696 ( 5.261 0.450 12.430) 13.505 9.082 ( 6.411 -0.497 10.867) 12.627 9.546 ( -2.821 -2.241 6.978) 7.853 9.712 ( -4.547 5.133 -7.828) 10.407 10.109 ( 0.099 1.108 -4.703) 4.832 11.609 ( -1.443 5.457 7.542) 9.420 11.798 ( 5.965 7.459 5.842) 11.196 12.935 ( -4.805 -7.206 -5.010) 10.006 13.611 ( 1.372 -0.725 -0.827) 1.759 13.965 ( -4.025 3.060 -2.328) 5.566 14.070 ( -0.086 -3.930 -0.208) 3.937 16.499 ( 0.965 2.843 5.920) 6.637 16.973 ( 7.858 1.597 -3.867) 8.902 17.658 ( -4.763 6.465 4.536) 9.223 18.091 ( 4.752 7.199 5.873) 10.435 19.837 ( -2.765 -13.226 -11.190) 17.544 22.499 ( 0.388 0.120 -1.636) 1.686 ======================= Grid point 180 (81/336) ======================= q-point: (-0.09 0.36 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.802 ( 3.960 -1.067 -11.363) 12.081 2.150 ( 4.837 13.700 21.532) 25.975 2.284 ( 8.855 14.684 13.752) 21.980 3.207 ( 20.061 9.604 9.350) 24.126 4.328 ( -6.095 -8.184 1.816) 10.365 4.841 ( -3.660 -0.272 -7.858) 8.673 4.906 ( -8.384 -1.680 -2.050) 8.793 5.331 ( 0.803 -1.596 9.339) 9.509 5.482 ( 5.139 -9.889 -3.200) 11.594 5.849 ( -2.658 0.135 -5.398) 6.019 6.276 ( -2.370 5.592 5.562) 8.235 6.429 ( -1.574 -9.758 -3.957) 10.647 6.721 ( -4.518 -4.880 -5.819) 8.837 7.114 ( 5.417 -2.635 7.774) 9.835 7.301 ( -1.942 -0.993 -0.030) 2.182 7.543 ( 4.917 -1.690 -7.144) 8.836 7.766 ( -3.133 6.260 -4.128) 8.127 8.153 ( -0.661 -0.778 -1.664) 1.952 8.339 ( 2.768 -3.007 -4.383) 5.993 8.810 ( -0.197 -1.983 5.870) 6.199 9.252 ( 5.187 1.870 11.074) 12.371 9.446 ( -6.899 -0.149 -4.068) 8.011 9.665 ( 0.694 1.015 5.738) 5.868 10.063 ( 0.041 2.221 -4.746) 5.240 11.555 ( -2.286 6.565 5.207) 8.686 11.821 ( 3.619 8.203 3.834) 9.751 12.939 ( 0.503 -5.896 -6.077) 8.482 13.610 ( -1.175 -0.732 -0.200) 1.399 13.879 ( -2.499 1.237 -2.448) 3.711 14.117 ( -0.045 -4.031 1.849) 4.436 16.514 ( 2.534 4.624 0.471) 5.294 17.099 ( 9.702 -1.079 -1.633) 9.897 17.476 ( -4.584 13.681 -4.382) 15.079 18.093 ( -5.282 2.529 15.723) 16.778 19.940 ( 4.035 -15.288 -9.321) 18.354 22.494 ( 0.903 0.628 -2.312) 2.561 ======================= Grid point 186 (82/336) ======================= q-point: (-0.55 0.45 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.706 ( -4.577 0.000 5.565) 7.205 2.159 ( 0.072 -0.000 4.283) 4.284 2.600 ( -4.829 0.000 3.828) 6.162 3.283 ( 5.420 -0.000 -2.949) 6.170 4.030 ( -0.351 0.000 2.505) 2.529 4.519 ( 5.786 -0.000 -1.844) 6.073 4.572 ( 2.562 -0.000 -4.123) 4.854 4.806 ( -6.101 0.000 5.098) 7.951 5.945 ( 3.195 -0.000 -6.110) 6.895 6.042 ( 10.676 -0.000 -6.308) 12.401 6.091 ( 1.901 -0.000 -3.295) 3.804 6.420 ( -3.585 0.000 4.777) 5.973 6.567 ( -9.503 0.000 -2.100) 9.732 6.812 ( 0.982 -0.000 3.738) 3.865 7.267 ( 1.611 -0.000 -1.394) 2.130 7.588 ( -5.281 0.000 3.245) 6.198 8.028 ( 6.495 -0.000 -10.220) 12.109 8.060 ( -0.128 0.000 -6.159) 6.160 8.432 ( -5.126 0.000 -2.832) 5.856 8.580 ( -0.262 0.000 10.752) 10.755 8.687 ( 2.018 -0.000 -2.864) 3.503 9.364 ( -1.045 0.000 6.816) 6.895 10.129 ( 1.809 -0.000 -2.950) 3.461 10.156 ( -5.350 0.000 2.707) 5.996 11.345 ( 0.153 -0.000 6.681) 6.683 11.760 ( -3.844 0.000 0.198) 3.849 12.922 ( 12.098 -0.000 -4.146) 12.789 13.585 ( -7.166 0.000 3.117) 7.814 14.018 ( 1.329 -0.000 -1.788) 2.228 14.265 ( 2.248 -0.000 -0.218) 2.258 16.461 ( 1.654 -0.000 3.328) 3.716 16.746 ( 1.010 -0.000 -1.366) 1.699 17.721 ( 3.045 -0.000 3.112) 4.354 18.133 ( -15.852 0.000 2.871) 16.110 19.951 ( 8.537 -0.000 -6.955) 11.011 22.556 ( -2.177 0.000 1.486) 2.636 ======================= Grid point 188 (83/336) ======================= q-point: (-0.45 0.45 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.707 ( -0.901 0.944 9.482) 9.571 2.215 ( 4.492 6.174 12.321) 14.495 2.554 ( 0.795 7.970 4.506) 9.190 3.302 ( 1.174 4.428 -2.983) 5.466 4.054 ( -0.223 -2.824 3.404) 4.428 4.620 ( 3.308 -5.156 -3.389) 7.001 4.658 ( 8.153 -1.623 7.040) 10.893 4.778 ( -4.499 -6.493 3.312) 8.566 5.848 ( -2.175 9.657 -11.224) 14.965 6.127 ( 1.283 0.256 -1.349) 1.879 6.163 ( 4.096 -6.711 -6.137) 9.974 6.399 ( 0.035 -1.562 -2.512) 2.958 6.424 ( -4.918 -0.587 2.266) 5.446 6.839 ( -0.827 0.255 3.966) 4.060 7.314 ( 3.362 -0.626 -0.144) 3.423 7.513 ( -5.599 -1.772 -0.954) 5.950 8.054 ( 5.548 1.185 -10.274) 11.736 8.077 ( 4.295 -1.183 -3.886) 5.911 8.337 ( -4.571 0.751 -0.577) 4.668 8.640 ( 0.431 2.182 8.564) 8.848 8.719 ( 3.144 -1.284 2.635) 4.298 9.402 ( -0.298 -0.776 7.868) 7.911 10.079 ( -4.172 1.222 -1.775) 4.695 10.125 ( 0.006 -0.803 -3.483) 3.574 11.446 ( 4.135 -0.260 13.752) 14.363 11.734 ( 0.996 1.875 1.429) 2.559 13.035 ( 2.970 -0.897 -4.247) 5.259 13.506 ( -3.739 -0.833 1.971) 4.308 14.019 ( 0.008 -0.739 -2.523) 2.629 14.250 ( -2.185 1.130 -2.855) 3.769 16.500 ( 1.510 2.948 6.343) 7.156 16.799 ( 3.450 -2.863 1.408) 4.700 17.815 ( 3.194 2.813 4.925) 6.509 17.943 ( -5.152 0.408 1.986) 5.536 19.963 ( -1.352 -2.077 -11.789) 12.047 22.528 ( -1.790 -0.028 0.261) 1.809 ======================= Grid point 189 (84/336) ======================= q-point: (-0.36 0.45 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.744 ( -0.358 -0.099 5.682) 5.694 2.334 ( 8.165 11.611 18.332) 23.185 2.537 ( 5.416 13.955 7.728) 16.846 3.219 ( -0.678 8.380 -1.293) 8.506 4.107 ( -1.526 -5.891 3.767) 7.157 4.727 ( 4.106 -8.890 -4.215) 10.661 4.810 ( -3.511 -10.673 1.083) 11.288 4.874 ( 8.057 -2.332 12.559) 15.102 5.615 ( -3.767 12.183 -11.677) 17.291 6.074 ( -4.662 -2.310 -5.745) 7.751 6.204 ( -3.289 -3.691 0.914) 5.028 6.357 ( -1.685 -4.539 -0.328) 4.852 6.544 ( 10.044 -1.438 -2.199) 10.382 6.840 ( -0.350 1.612 4.761) 5.039 7.361 ( 1.580 -1.038 -1.210) 2.245 7.448 ( -3.050 -3.845 -4.640) 6.754 8.046 ( 3.714 1.836 -12.059) 12.751 8.145 ( 3.939 -1.985 -4.255) 6.128 8.260 ( -4.473 1.030 1.211) 4.747 8.668 ( 2.936 5.446 8.779) 10.740 8.859 ( 5.764 -3.381 9.300) 11.452 9.458 ( -0.316 -1.391 8.094) 8.219 9.967 ( -4.060 3.737 -5.906) 8.083 10.111 ( -0.496 -2.239 -4.079) 4.680 11.608 ( 2.046 0.140 16.817) 16.942 11.788 ( 8.361 3.711 2.746) 9.551 12.963 ( -9.270 -2.051 -3.651) 10.173 13.528 ( 3.455 -1.334 0.426) 3.728 14.004 ( -0.978 -1.586 -3.014) 3.543 14.153 ( -4.740 2.125 -3.904) 6.498 16.536 ( 1.019 3.798 8.821) 9.658 16.900 ( 5.212 -1.616 0.256) 5.463 17.733 ( -10.612 -0.735 10.157) 14.708 18.087 ( 17.940 5.127 -0.124) 18.659 19.813 ( -9.813 -4.233 -15.307) 18.668 22.507 ( -0.572 -0.005 -0.752) 0.945 ======================= Grid point 190 (85/336) ======================= q-point: (-0.27 0.45 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.764 ( 0.500 -1.316 -1.219) 1.862 2.426 ( 3.744 14.762 18.828) 24.217 2.560 ( 8.289 18.131 10.804) 22.675 3.180 ( 5.863 6.000 2.283) 8.695 4.149 ( -4.251 -8.192 3.114) 9.740 4.807 ( -3.740 -8.959 -0.858) 9.746 4.885 ( 1.979 -8.898 -5.369) 10.579 5.084 ( 4.908 -3.704 11.505) 13.045 5.414 ( -0.082 8.385 -7.994) 11.585 5.974 ( -4.634 0.017 -5.500) 7.192 6.193 ( -3.951 -6.639 1.375) 7.847 6.387 ( 0.163 -0.824 3.085) 3.198 6.658 ( 4.976 -0.894 -7.037) 8.665 6.896 ( 4.369 -0.708 7.435) 8.652 7.367 ( -0.865 -0.029 -0.439) 0.970 7.430 ( 0.147 -4.535 -7.286) 8.583 7.995 ( 0.910 2.646 -11.204) 11.548 8.165 ( 0.004 -0.644 -4.393) 4.440 8.207 ( -0.345 -2.006 -1.960) 2.825 8.747 ( 3.347 4.239 12.619) 13.726 9.057 ( 7.602 -2.153 11.115) 13.637 9.502 ( -2.764 -2.183 7.008) 7.843 9.815 ( -3.621 5.818 -7.189) 9.931 10.100 ( -0.216 -2.107 -4.999) 5.429 11.680 ( -1.665 2.319 12.005) 12.340 11.934 ( 9.577 6.730 5.682) 13.011 12.807 ( -9.493 -6.044 -3.808) 11.880 13.600 ( 3.323 -0.449 -0.396) 3.376 13.986 ( -1.812 -1.934 -2.669) 3.762 14.040 ( -3.173 1.692 -2.334) 4.288 16.563 ( 0.081 3.796 9.135) 9.892 16.992 ( 6.955 0.457 -3.133) 7.642 17.666 ( -9.131 -3.365 12.182) 15.592 18.298 ( 15.045 12.649 0.223) 19.657 19.613 ( -8.539 -10.503 -14.901) 20.131 22.502 ( 0.631 0.148 -1.226) 1.387 ======================= Grid point 191 (86/336) ======================= q-point: (-0.18 0.45 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.773 ( 2.219 -1.508 -7.659) 8.115 2.430 ( 0.980 15.021 19.237) 24.427 2.572 ( 6.048 15.799 8.735) 19.039 3.324 ( 11.864 2.119 5.838) 13.392 4.160 ( -6.102 -9.101 1.481) 11.057 4.778 ( -6.684 -5.079 -2.352) 8.719 4.898 ( -1.924 -0.850 -4.916) 5.347 5.251 ( 4.414 -7.280 3.031) 9.037 5.387 ( 3.706 0.465 0.160) 3.739 5.866 ( -3.700 1.330 -5.437) 6.710 6.215 ( -3.103 -7.815 0.763) 8.443 6.416 ( 2.439 4.474 4.910) 7.076 6.648 ( -0.713 -1.977 -8.412) 8.671 7.062 ( 6.472 -2.848 9.067) 11.498 7.305 ( -4.017 1.095 -2.232) 4.724 7.478 ( 5.446 -4.651 -6.675) 9.791 7.873 ( -3.847 4.490 -9.327) 11.043 8.142 ( -0.294 -0.342 -2.412) 2.454 8.265 ( 4.538 -4.516 -3.902) 7.497 8.814 ( -0.659 2.166 10.959) 11.190 9.264 ( 7.718 -0.234 10.934) 13.385 9.451 ( -7.989 -0.154 -0.705) 8.022 9.708 ( -0.359 3.889 0.833) 3.993 10.080 ( -0.129 -0.672 -5.017) 5.063 11.665 ( -3.987 4.729 8.551) 10.554 11.978 ( 2.500 8.809 2.976) 9.628 12.785 ( 0.046 -9.910 -3.473) 10.501 13.619 ( 0.231 1.424 -0.877) 1.688 13.913 ( -3.362 1.955 -2.358) 4.548 14.045 ( 1.148 -3.364 0.765) 3.636 16.586 ( 1.386 3.340 6.122) 7.110 17.088 ( 8.071 -0.085 -3.949) 8.986 17.614 ( -8.672 0.071 8.812) 12.364 18.257 ( -2.435 15.638 1.381) 15.886 19.648 ( 5.757 -15.953 -9.789) 19.582 22.506 ( 1.273 0.626 -1.315) 1.934 ======================= Grid point 192 (87/336) ======================= q-point: (-0.09 0.45 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.767 ( 3.032 -1.478 -12.684) 13.124 2.435 ( 0.257 10.242 18.615) 21.248 2.578 ( 3.771 10.145 7.936) 13.421 3.525 ( 9.006 0.456 3.829) 9.797 4.149 ( -5.699 -7.898 1.366) 9.835 4.690 ( -5.107 -3.983 -5.931) 8.782 4.812 ( -3.864 3.916 -2.545) 6.062 5.363 ( 0.336 -4.524 2.666) 5.262 5.500 ( 6.681 -5.092 -0.010) 8.400 5.773 ( -2.659 0.546 -5.411) 6.054 6.230 ( -3.041 -4.617 -1.075) 5.632 6.411 ( 0.540 4.720 -0.689) 4.800 6.625 ( 0.116 -2.020 -0.253) 2.039 7.165 ( -1.721 1.024 0.482) 2.060 7.294 ( 2.872 -3.728 2.861) 5.508 7.571 ( 6.023 -0.570 -8.336) 10.300 7.733 ( -1.983 -0.615 -4.047) 4.548 8.135 ( 0.615 -0.073 -1.227) 1.375 8.341 ( 2.244 -1.420 -1.319) 2.966 8.814 ( -1.523 2.175 1.097) 2.873 9.271 ( -8.639 2.065 1.815) 9.065 9.435 ( 4.137 -0.406 3.223) 5.260 9.715 ( -0.422 0.654 7.538) 7.578 10.057 ( 0.687 0.383 -2.085) 2.228 11.583 ( -4.634 4.503 4.768) 8.030 11.945 ( 0.662 5.429 2.447) 5.991 12.892 ( 4.464 -6.367 -3.972) 8.732 13.588 ( -1.381 1.436 0.045) 1.993 13.840 ( -1.731 1.539 -2.226) 3.213 14.101 ( 0.668 -2.627 1.710) 3.205 16.614 ( 3.503 4.676 0.850) 5.904 17.191 ( 5.326 -0.709 -5.255) 7.515 17.484 ( -4.555 5.715 2.406) 7.693 18.086 ( -10.094 3.039 12.098) 16.046 19.861 ( 8.727 -10.596 -8.483) 16.137 22.513 ( 1.598 1.320 -1.167) 2.379 ======================= Grid point 199 (88/336) ======================= q-point: ( 0.55 -0.45 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.743 ( -1.303 0.000 5.983) 6.123 2.451 ( 8.693 -0.000 17.667) 19.690 2.678 ( 5.987 -0.000 6.340) 8.720 3.292 ( -2.928 0.000 -2.657) 3.954 4.045 ( -1.799 0.000 3.007) 3.504 4.637 ( 4.376 -0.000 -2.685) 5.134 4.703 ( -2.932 0.000 1.274) 3.196 4.854 ( 8.275 -0.000 13.645) 15.958 5.772 ( -4.621 0.000 -12.815) 13.623 5.990 ( -6.248 0.000 -8.560) 10.598 6.212 ( 2.916 -0.000 2.746) 4.006 6.293 ( -5.658 0.000 0.965) 5.739 6.538 ( 10.962 -0.000 -1.122) 11.019 6.859 ( -0.491 0.000 5.123) 5.146 7.349 ( 2.452 -0.000 -2.515) 3.513 7.406 ( -3.607 0.000 -5.362) 6.462 8.065 ( 3.592 -0.000 -12.291) 12.805 8.123 ( 3.772 -0.000 -3.981) 5.484 8.272 ( -4.403 0.000 1.148) 4.550 8.750 ( 2.243 -0.000 11.255) 11.477 8.798 ( 6.367 -0.000 6.867) 9.364 9.444 ( -0.396 0.000 8.006) 8.016 10.020 ( -2.380 0.000 -3.843) 4.520 10.072 ( -1.835 0.000 -5.757) 6.043 11.609 ( 2.349 -0.000 17.824) 17.978 11.824 ( 8.628 -0.000 2.566) 9.001 12.944 ( -10.096 0.000 -3.317) 10.626 13.515 ( 3.816 -0.000 0.401) 3.837 13.989 ( -1.035 0.000 -3.267) 3.427 14.173 ( -4.808 0.000 -3.976) 6.239 16.578 ( 0.497 -0.000 9.110) 9.124 16.879 ( 6.060 -0.000 2.265) 6.470 17.723 ( -12.500 0.000 8.547) 15.143 18.139 ( 19.927 -0.000 0.190) 19.927 19.772 ( -10.559 0.000 -15.718) 18.936 22.507 ( -0.543 0.000 -0.716) 0.899 ======================= Grid point 201 (89/336) ======================= q-point: (-0.36 0.55 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.747 ( -0.354 -0.443 0.323) 0.652 2.632 ( 3.393 6.225 16.691) 18.135 2.837 ( 11.692 9.701 9.884) 18.124 3.211 ( -3.820 -1.234 -0.716) 4.078 4.028 ( -4.280 -3.839 1.630) 5.976 4.677 ( -2.311 -4.059 0.058) 4.671 4.739 ( 6.499 -4.791 -4.025) 9.022 5.048 ( 3.319 -0.749 15.023) 15.403 5.576 ( -3.636 7.098 -12.577) 14.893 5.892 ( -4.687 -6.009 -6.396) 9.949 6.199 ( -1.310 5.243 3.440) 6.407 6.314 ( 1.025 -5.995 2.324) 6.511 6.688 ( 9.458 2.328 -4.081) 10.560 6.889 ( 0.031 -0.380 7.454) 7.464 7.352 ( 1.352 -1.846 -7.017) 7.380 7.366 ( 0.328 -1.028 -3.029) 3.216 8.022 ( 0.922 0.638 -12.594) 12.644 8.138 ( 2.462 -1.251 -7.780) 8.256 8.208 ( -4.046 0.666 2.008) 4.566 8.827 ( 1.300 3.350 12.019) 12.545 9.009 ( 9.591 -2.321 11.601) 15.230 9.472 ( -2.808 -0.871 7.096) 7.681 9.925 ( -2.030 5.671 -6.239) 8.672 10.034 ( -1.194 -4.544 -5.706) 7.392 11.705 ( -1.605 0.595 14.296) 14.398 12.030 ( 13.382 2.904 5.486) 14.752 12.723 ( -14.506 -2.517 -3.300) 15.089 13.594 ( 4.767 -0.183 0.181) 4.774 13.953 ( -1.250 -1.009 -3.403) 3.763 14.070 ( -4.220 0.959 -2.890) 5.204 16.625 ( -1.027 2.127 10.839) 11.094 16.993 ( 6.879 -0.190 -0.637) 6.911 17.602 ( -10.605 -2.309 10.575) 15.153 18.490 ( 24.399 6.244 1.317) 25.220 19.462 ( -16.109 -4.827 -17.532) 24.293 22.504 ( 0.756 0.067 -0.967) 1.230 ======================= Grid point 202 (90/336) ======================= q-point: (-0.27 0.55 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.752 ( 1.903 -0.709 -4.787) 5.200 2.671 ( -1.131 9.791 17.061) 19.703 2.863 ( 1.178 14.744 4.444) 15.444 3.288 ( 6.717 -5.392 4.427) 9.684 4.009 ( -4.460 -6.468 0.581) 7.878 4.679 ( -3.352 -4.844 0.437) 5.907 4.860 ( 5.380 -2.657 -5.687) 8.267 5.140 ( -0.750 -3.839 6.713) 7.770 5.434 ( 0.072 3.600 -6.779) 7.676 5.845 ( -3.073 -4.183 -6.257) 8.129 6.168 ( -0.148 3.696 4.494) 5.821 6.417 ( 3.435 -4.625 3.377) 6.678 6.702 ( 1.903 7.352 -5.198) 9.203 6.995 ( 4.231 -4.884 7.041) 9.557 7.329 ( -3.012 1.169 -2.443) 4.051 7.394 ( 5.581 -3.647 -6.677) 9.436 7.923 ( -3.252 1.098 -12.325) 12.794 8.143 ( 1.253 0.188 -4.086) 4.277 8.192 ( 2.618 -2.596 -1.427) 3.953 8.869 ( -1.675 3.023 12.168) 12.650 9.252 ( 9.219 -0.941 11.165) 14.509 9.438 ( -6.838 -0.877 3.183) 7.593 9.807 ( -0.990 6.345 -3.363) 7.249 10.034 ( -0.259 -4.198 -5.092) 6.604 11.727 ( -3.997 1.988 11.115) 11.978 12.154 ( 3.132 9.849 2.021) 10.531 12.588 ( -3.962 -10.725 -2.065) 11.618 13.650 ( 2.479 1.557 0.070) 2.928 13.926 ( -1.638 -0.810 -2.861) 3.395 14.011 ( -0.398 -0.076 -0.111) 0.420 16.642 ( -1.662 2.576 10.568) 11.004 17.090 ( 7.455 0.189 -4.777) 8.856 17.551 ( -9.307 -4.472 13.259) 16.806 18.612 ( 1.236 20.586 -5.905) 21.452 19.338 ( 4.801 -17.391 -9.469) 20.376 22.516 ( 1.538 0.394 -0.533) 1.675 ======================= Grid point 203 (91/336) ======================= q-point: (-0.18 0.55 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.756 ( 3.051 0.038 -9.220) 9.712 2.627 ( -4.992 9.724 15.316) 18.816 2.754 ( -3.498 8.008 4.612) 9.881 3.477 ( 6.423 -4.631 3.020) 8.475 4.025 ( -0.876 -5.455 0.714) 5.571 4.642 ( -4.429 -1.454 -2.343) 5.217 4.860 ( -0.196 1.893 -3.498) 3.982 5.255 ( 4.027 -7.050 -0.387) 8.129 5.401 ( 0.255 -4.476 -4.779) 6.553 5.791 ( -1.579 -0.124 -5.174) 5.411 6.173 ( -0.159 1.105 4.028) 4.180 6.543 ( 4.849 0.902 5.749) 7.574 6.588 ( -1.541 4.920 -7.946) 9.472 7.159 ( 2.750 -4.309 7.404) 8.997 7.248 ( -1.274 0.699 -2.956) 3.294 7.504 ( 7.450 -4.807 -5.670) 10.524 7.754 ( -6.248 1.746 -11.842) 13.503 8.144 ( 1.539 1.090 0.094) 1.888 8.291 ( 5.551 -3.639 -2.276) 7.016 8.866 ( -2.638 3.042 7.925) 8.890 9.300 ( -9.276 0.949 -0.441) 9.335 9.439 ( 5.523 0.400 5.789) 8.011 9.752 ( -0.520 3.603 4.030) 5.431 10.039 ( 0.112 -2.565 -2.572) 3.634 11.667 ( -6.634 4.046 6.866) 10.369 12.042 ( -4.636 5.206 0.209) 6.974 12.728 ( 6.537 -10.128 -1.340) 12.129 13.646 ( 0.350 3.908 0.168) 3.927 13.875 ( -1.486 1.750 -2.157) 3.150 14.052 ( 2.034 -2.384 1.684) 3.558 16.666 ( -0.007 1.253 8.073) 8.169 17.173 ( 7.028 -0.531 -7.230) 10.097 17.519 ( -8.920 -2.089 12.355) 15.381 18.252 ( -14.253 13.377 -6.286) 20.533 19.656 ( 16.914 -10.981 -4.662) 20.698 22.536 ( 1.764 1.056 0.200) 2.066 ======================= Grid point 204 (92/336) ======================= q-point: (-0.09 -0.45 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.726 ( 1.977 0.611 -13.262) 13.423 2.537 ( -7.830 3.038 10.681) 13.587 2.658 ( -7.310 3.409 8.684) 11.852 3.572 ( -1.121 -4.010 -2.511) 4.862 4.092 ( 3.622 -1.355 3.121) 4.969 4.575 ( -0.742 -1.598 -5.865) 6.124 4.808 ( -0.350 5.134 -2.123) 5.567 5.284 ( -4.198 -6.465 -1.791) 7.914 5.535 ( 8.561 -10.413 -6.850) 15.121 5.736 ( -1.155 3.012 -1.878) 3.733 6.161 ( -2.585 1.121 -0.245) 2.829 6.451 ( 0.537 7.139 -3.713) 8.065 6.678 ( 4.778 -1.246 5.045) 7.060 7.130 ( -3.735 2.894 -2.391) 5.295 7.314 ( 1.068 -1.410 0.354) 1.803 7.608 ( -0.431 -0.724 -6.668) 6.721 7.649 ( 6.157 -8.747 -4.309) 11.532 8.170 ( 1.247 1.433 3.810) 4.257 8.365 ( 2.307 0.288 -0.817) 2.465 8.817 ( -1.276 4.631 -3.988) 6.243 9.161 ( -6.469 -1.281 1.239) 6.710 9.477 ( -1.237 2.828 -0.493) 3.126 9.757 ( -1.176 0.933 8.454) 8.587 10.073 ( 1.731 -2.132 2.733) 3.874 11.552 ( -6.089 2.884 3.027) 7.386 11.956 ( -3.871 0.056 1.255) 4.069 12.906 ( 6.254 -5.976 -1.749) 8.825 13.602 ( -0.587 4.446 0.623) 4.528 13.837 ( 0.766 2.294 -1.445) 2.818 14.107 ( 0.823 -1.251 1.564) 2.165 16.698 ( 0.371 2.281 3.198) 3.945 17.205 ( 2.594 2.444 -10.836) 11.407 17.480 ( -2.551 -1.918 9.456) 9.980 17.952 ( -14.374 -1.002 4.864) 15.208 19.931 ( 12.543 -1.971 -5.888) 13.995 22.554 ( 1.733 1.710 0.940) 2.610 ======================= Grid point 212 (93/336) ======================= q-point: ( 0.64 -0.36 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.745 ( 1.895 -0.000 -3.746) 4.198 2.768 ( -1.885 0.000 16.066) 16.177 3.066 ( -9.679 0.000 -1.347) 9.772 3.174 ( 13.644 -0.000 8.404) 16.025 3.943 ( -3.638 0.000 0.312) 3.651 4.627 ( -1.939 0.000 1.185) 2.273 4.829 ( 10.497 -0.000 -5.781) 11.984 5.106 ( -4.759 0.000 8.477) 9.722 5.480 ( -2.714 0.000 -11.275) 11.597 5.785 ( -1.575 0.000 -3.754) 4.071 6.287 ( 0.439 -0.000 3.519) 3.546 6.296 ( 3.731 -0.000 3.373) 5.030 6.837 ( 9.581 -0.000 -4.338) 10.517 6.892 ( -3.751 0.000 6.390) 7.410 7.345 ( -2.256 0.000 -0.297) 2.276 7.354 ( 6.257 -0.000 -7.959) 10.124 7.930 ( -3.003 0.000 -12.978) 13.321 8.139 ( 5.470 -0.000 -8.952) 10.491 8.174 ( -2.176 0.000 3.398) 4.035 8.902 ( -2.344 0.000 12.113) 12.338 9.240 ( 10.160 -0.000 11.385) 15.259 9.428 ( -6.518 0.000 4.453) 7.894 9.927 ( 0.020 -0.000 -4.630) 4.630 9.934 ( -1.310 0.000 -5.062) 5.229 11.744 ( -3.878 0.000 11.921) 12.536 12.301 ( 13.998 -0.000 3.484) 14.425 12.433 ( -16.309 0.000 -3.393) 16.658 13.667 ( 3.639 -0.000 0.858) 3.738 13.912 ( -0.608 0.000 -3.119) 3.178 14.015 ( -1.543 0.000 -0.627) 1.665 16.669 ( -3.375 0.000 12.402) 12.853 17.093 ( 7.327 -0.000 -4.570) 8.635 17.502 ( -8.836 0.000 12.566) 15.362 18.980 ( 28.842 -0.000 2.290) 28.933 19.004 ( -22.014 0.000 -18.650) 28.853 22.520 ( 1.634 -0.000 -0.236) 1.651 ======================= Grid point 214 (94/336) ======================= q-point: (-0.27 -0.36 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.761 ( 3.673 0.274 -6.581) 7.542 2.772 ( -7.474 4.879 15.585) 17.959 2.854 ( -12.085 2.350 -0.450) 12.320 3.400 ( 7.569 -2.488 2.569) 8.371 3.948 ( 2.727 -2.392 1.108) 3.793 4.617 ( -1.837 -1.081 1.939) 2.881 4.930 ( 4.827 6.044 -6.187) 9.905 5.095 ( 3.006 -9.052 -3.070) 10.019 5.362 ( -5.815 -0.436 -7.036) 9.138 5.763 ( 0.036 -1.594 -4.070) 4.371 6.270 ( 0.991 7.282 5.765) 9.341 6.444 ( 5.311 -6.786 1.807) 8.805 6.780 ( -1.620 10.358 -1.098) 10.541 7.020 ( 5.361 -8.814 1.218) 10.388 7.284 ( -3.456 1.601 -0.421) 3.833 7.436 ( 6.680 -2.041 -5.383) 8.819 7.776 ( -5.739 0.534 -12.902) 14.131 8.173 ( 1.987 1.861 1.627) 3.171 8.224 ( 6.670 -3.050 -3.822) 8.271 8.912 ( -3.621 1.504 10.233) 10.959 9.308 ( -9.082 0.078 0.711) 9.110 9.444 ( 6.503 0.094 6.741) 9.367 9.847 ( -0.340 6.088 -0.020) 6.097 9.961 ( -0.094 -5.529 -2.047) 5.897 11.721 ( -6.179 1.538 8.920) 10.960 12.137 ( -12.802 4.094 -2.318) 13.639 12.558 ( 10.642 -6.379 0.358) 12.413 13.709 ( 1.815 2.179 1.275) 3.109 13.892 ( -0.028 0.095 -2.421) 2.423 14.022 ( 1.693 -0.696 1.350) 2.275 16.676 ( -4.535 0.147 12.610) 13.401 17.171 ( 7.805 0.083 -9.379) 12.202 17.467 ( -7.834 -2.097 15.334) 17.346 18.484 ( -21.610 8.417 -16.129) 28.248 19.480 ( 25.637 -6.276 0.172) 26.394 22.550 ( 1.879 0.404 1.018) 2.175 ======================= Grid point 215 (95/336) ======================= q-point: (-0.18 -0.36 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.758 ( 2.336 2.162 -8.918) 9.469 2.570 ( -15.488 0.641 0.508) 15.510 2.720 ( -10.999 2.763 14.991) 18.797 3.481 ( -1.583 -4.371 -3.645) 5.907 4.082 ( 10.167 -0.416 2.699) 10.528 4.587 ( -1.402 2.193 -1.375) 2.944 4.883 ( 2.718 3.690 -5.105) 6.860 5.202 ( -8.004 -2.221 -3.627) 9.064 5.309 ( 9.770 -12.504 -10.314) 18.926 5.755 ( 0.542 -0.603 -3.863) 3.947 6.243 ( -1.259 6.846 6.331) 9.409 6.576 ( 4.317 -0.067 -4.582) 6.296 6.673 ( 2.410 6.185 2.186) 6.988 7.150 ( -2.831 -3.366 3.325) 5.514 7.265 ( 5.126 -1.905 -0.093) 5.470 7.480 ( -3.330 -5.421 -9.107) 11.109 7.643 ( 2.567 1.329 -7.787) 8.306 8.201 ( 0.684 1.867 5.275) 5.638 8.343 ( 6.794 -2.186 -3.472) 7.937 8.888 ( -2.133 2.773 3.326) 4.827 9.149 ( -8.739 -0.143 -2.724) 9.155 9.522 ( 0.572 1.707 2.205) 2.847 9.805 ( -1.026 4.260 5.356) 6.920 10.010 ( 0.567 -4.614 1.972) 5.050 11.623 ( -7.544 4.176 4.957) 9.946 11.940 ( -9.181 -1.574 0.146) 9.316 12.775 ( 8.952 -6.475 -0.609) 11.065 13.699 ( 0.244 4.852 1.347) 5.041 13.880 ( 1.410 1.887 -1.503) 2.795 14.079 ( 2.103 -1.510 1.472) 2.978 16.688 ( -4.041 -2.141 10.845) 11.770 17.226 ( 7.451 0.663 -12.502) 14.569 17.457 ( -7.212 -1.413 15.046) 16.745 17.998 ( -19.856 4.508 -10.311) 22.823 19.890 ( 20.492 -2.108 -2.227) 20.720 22.581 ( 1.576 1.069 2.172) 2.889 ======================= Grid point 216 (96/336) ======================= q-point: (-0.09 -0.36 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.664 ( -3.491 2.970 -11.364) 12.253 2.341 ( -16.824 -6.878 0.124) 18.176 2.597 ( -11.688 3.555 15.684) 19.881 3.382 ( -12.420 -7.025 -8.135) 16.425 4.252 ( 8.982 6.216 1.665) 11.050 4.574 ( 5.730 -0.595 -3.935) 6.977 4.874 ( 4.101 6.378 -3.370) 8.298 5.099 ( -6.368 -9.689 -3.597) 12.140 5.512 ( 7.888 -10.246 -12.321) 17.861 5.755 ( 2.511 0.990 -0.360) 2.723 6.170 ( -2.200 7.672 2.608) 8.397 6.547 ( 4.638 8.083 -2.197) 9.575 6.783 ( 6.460 -1.697 4.199) 7.889 7.061 ( -6.179 3.795 -5.282) 8.971 7.284 ( -4.243 -0.148 -3.364) 5.417 7.519 ( 4.876 -11.845 -0.200) 12.811 7.708 ( 6.928 -1.783 -4.487) 8.445 8.201 ( -4.754 1.429 8.402) 9.759 8.426 ( 5.798 1.568 -2.672) 6.574 8.805 ( -2.169 5.924 -7.351) 9.687 9.040 ( -4.848 -4.284 -4.029) 7.622 9.475 ( -2.530 4.479 1.122) 5.265 9.796 ( -1.703 1.536 7.853) 8.181 10.088 ( 0.779 -4.730 4.962) 6.900 11.495 ( -5.995 3.034 2.474) 7.160 11.853 ( -6.763 -4.340 1.580) 8.190 12.950 ( 6.284 -4.739 -0.626) 7.896 13.652 ( -0.234 5.742 1.174) 5.865 13.887 ( 2.940 2.764 -0.678) 4.092 14.117 ( 0.485 -0.474 0.725) 0.993 16.688 ( -5.442 -0.749 5.300) 7.633 17.225 ( 4.954 4.817 -13.049) 14.766 17.473 ( -2.007 -5.359 9.993) 11.515 17.684 ( -16.161 -5.596 1.102) 17.138 20.131 ( 13.477 5.004 -4.114) 14.954 22.604 ( 0.901 1.564 2.870) 3.390 ======================= Grid point 225 (97/336) ======================= q-point: (-0.27 -0.27 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.782 ( 3.018 -0.000 -6.507) 7.173 2.573 ( -19.453 0.000 -3.258) 19.724 2.748 ( -11.559 0.000 17.159) 20.689 3.438 ( -1.856 0.000 -4.813) 5.159 4.076 ( 12.425 -0.000 2.953) 12.771 4.614 ( -0.538 0.000 3.475) 3.516 4.949 ( 0.121 -0.000 -11.172) 11.172 5.147 ( 13.912 -0.000 -9.159) 16.656 5.185 ( -10.141 0.000 -4.647) 11.155 5.745 ( 1.160 -0.000 -3.881) 4.050 6.338 ( -2.536 0.000 7.303) 7.731 6.528 ( 8.987 -0.000 -0.495) 9.000 6.794 ( -1.192 0.000 -1.235) 1.716 7.057 ( 2.432 -0.000 1.298) 2.757 7.263 ( 1.698 -0.000 -0.076) 1.700 7.434 ( -3.861 0.000 -8.319) 9.171 7.657 ( 1.730 -0.000 -8.231) 8.411 8.226 ( -1.082 0.000 8.015) 8.088 8.313 ( 9.955 -0.000 -6.661) 11.978 8.915 ( -2.769 0.000 5.883) 6.502 9.149 ( -9.401 0.000 -3.588) 10.062 9.538 ( 1.349 -0.000 2.866) 3.167 9.900 ( 0.548 -0.000 0.368) 0.660 9.913 ( -1.186 0.000 5.050) 5.188 11.672 ( -6.698 0.000 6.916) 9.628 11.918 ( -13.067 0.000 -1.169) 13.119 12.708 ( 10.255 -0.000 -0.466) 10.266 13.751 ( 0.566 -0.000 2.067) 2.143 13.898 ( 2.044 -0.000 -1.591) 2.590 14.062 ( 2.434 -0.000 1.125) 2.681 16.662 ( -6.519 0.000 13.187) 14.710 17.233 ( 8.544 -0.000 -13.224) 15.744 17.439 ( -7.013 0.000 16.813) 18.217 18.051 ( -22.776 0.000 -15.274) 27.423 19.868 ( 23.873 -0.000 -0.610) 23.881 22.591 ( 1.530 -0.000 2.631) 3.044 ======================= Grid point 226 (98/336) ======================= q-point: (-0.18 -0.27 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.737 ( -4.001 3.369 -5.320) 7.461 2.231 ( -22.076 -3.974 -1.883) 22.509 2.651 ( -10.897 1.684 15.782) 19.252 3.273 ( -14.672 -3.479 -10.310) 18.267 4.342 ( 17.239 2.299 3.647) 17.770 4.612 ( 0.763 4.230 0.239) 4.305 4.879 ( -1.558 -6.053 -13.865) 15.209 5.036 ( -2.648 3.437 -1.261) 4.518 5.332 ( 10.880 -7.183 -11.654) 17.487 5.758 ( 3.427 -0.170 -2.077) 4.011 6.310 ( -2.106 5.344 6.433) 8.625 6.675 ( 9.108 2.283 -2.774) 9.792 6.775 ( 3.707 3.441 0.820) 5.124 7.074 ( -3.606 -3.265 0.645) 4.907 7.249 ( -9.777 -2.594 -10.793) 14.792 7.361 ( 7.296 -2.921 1.617) 8.024 7.700 ( 5.975 0.188 -4.121) 7.261 8.224 ( -5.479 0.828 9.481) 10.982 8.436 ( 9.040 -0.112 -5.077) 10.369 8.891 ( -1.384 2.839 -2.265) 3.886 8.979 ( -7.700 -2.106 -6.540) 10.320 9.535 ( -1.960 1.678 2.290) 3.450 9.861 ( -1.425 5.274 4.329) 6.970 9.982 ( -0.741 -6.387 5.287) 8.324 11.580 ( -6.513 4.966 4.863) 9.525 11.758 ( -9.392 -5.020 1.979) 10.832 12.866 ( 8.049 -2.956 -0.635) 8.598 13.747 ( -0.684 3.258 2.114) 3.943 13.929 ( 3.270 1.318 -1.018) 3.670 14.103 ( 1.596 -0.686 -0.064) 1.738 16.641 ( -6.684 -2.412 11.198) 13.262 17.281 ( 8.379 1.318 -14.608) 16.892 17.430 ( -6.696 -0.417 14.666) 16.128 17.625 ( -19.722 -1.150 -9.628) 21.977 20.195 ( 18.374 1.718 -2.518) 18.625 22.625 ( 0.573 0.615 3.638) 3.734 ======================= Grid point 227 (99/336) ======================= q-point: (-0.09 -0.27 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.508 ( -14.700 4.634 -4.171) 15.968 1.930 ( -23.347 -9.470 -0.970) 25.213 2.580 ( -5.799 4.534 13.839) 15.675 2.943 ( -25.148 -9.978 -8.960) 28.500 4.407 ( 0.267 11.090 -7.555) 13.421 4.722 ( 13.905 -0.871 0.724) 13.951 4.893 ( -1.401 -13.533 -2.191) 13.780 5.015 ( 7.292 7.587 -4.114) 11.298 5.448 ( 4.641 -7.408 -13.120) 15.765 5.859 ( 9.456 0.680 1.630) 9.619 6.259 ( -0.086 9.067 4.962) 10.337 6.704 ( 5.972 8.479 -1.440) 10.470 6.908 ( 9.565 -2.219 -0.189) 9.821 6.939 ( -8.648 4.268 -6.060) 11.390 7.152 ( -3.720 -7.118 -3.250) 8.664 7.538 ( 5.942 -7.621 2.651) 10.021 7.767 ( 5.467 -0.734 -4.915) 7.389 8.149 ( -9.919 1.498 10.633) 14.618 8.533 ( 6.976 1.788 -3.126) 7.851 8.755 ( -4.314 3.404 -9.783) 11.220 8.885 ( -4.406 -2.365 -8.029) 9.459 9.502 ( -1.033 3.032 4.161) 5.251 9.825 ( -1.270 2.159 4.086) 4.792 10.062 ( -1.291 -6.660 6.038) 9.082 11.460 ( -5.040 4.723 3.815) 7.891 11.705 ( -6.808 -5.777 3.075) 9.443 13.008 ( 6.062 -3.360 -0.565) 6.954 13.703 ( -0.836 4.657 1.716) 5.033 13.956 ( 2.570 2.254 -0.886) 3.531 14.121 ( 0.501 -0.175 -0.745) 0.915 16.604 ( -7.096 -0.784 5.009) 8.721 17.252 ( -4.027 2.158 -7.660) 8.919 17.362 ( -2.216 -6.217 -10.779) 12.639 17.467 ( -6.385 -5.441 13.652) 16.023 20.382 ( 12.478 7.676 -2.940) 14.941 22.640 ( -0.676 1.036 3.930) 4.120 ======================= Grid point 237 (100/336) ======================= q-point: (-0.18 -0.18 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.587 ( -15.920 0.000 0.644) 15.933 1.813 ( -25.526 0.000 0.342) 25.528 2.622 ( -4.501 0.000 9.444) 10.461 2.846 ( -26.734 0.000 -7.935) 27.886 4.622 ( -8.106 0.000 -16.449) 18.338 4.655 ( 8.652 -0.000 4.625) 9.811 4.712 ( 12.163 -0.000 2.201) 12.360 5.107 ( 7.668 -0.000 -4.356) 8.819 5.354 ( 5.660 -0.000 -13.178) 14.342 5.865 ( 10.463 -0.000 1.496) 10.569 6.358 ( -0.408 0.000 6.858) 6.870 6.852 ( 11.311 -0.000 -1.204) 11.375 6.859 ( 4.996 -0.000 -0.658) 5.039 6.996 ( -10.588 0.000 -10.155) 14.671 7.008 ( -1.647 0.000 -1.893) 2.509 7.467 ( 5.290 -0.000 2.895) 6.031 7.766 ( 5.185 -0.000 -4.460) 6.839 8.164 ( -9.877 0.000 11.592) 15.229 8.549 ( 8.016 -0.000 -4.203) 9.051 8.770 ( -8.291 0.000 -11.434) 14.124 8.879 ( -0.747 0.000 -5.539) 5.589 9.532 ( -1.777 0.000 4.229) 4.587 9.882 ( -0.508 0.000 -4.411) 4.440 9.961 ( -2.912 0.000 12.848) 13.174 11.565 ( -4.122 0.000 6.286) 7.517 11.594 ( -8.323 0.000 3.484) 9.023 12.967 ( 6.861 -0.000 -0.881) 6.917 13.756 ( -1.862 0.000 2.417) 3.051 13.979 ( 2.618 -0.000 -1.639) 3.088 14.116 ( 1.253 -0.000 -1.525) 1.974 16.583 ( -6.603 0.000 8.846) 11.038 17.258 ( -17.390 0.000 -7.132) 18.796 17.330 ( 7.731 -0.000 -15.393) 17.225 17.412 ( -6.372 0.000 13.464) 14.896 20.457 ( 14.829 -0.000 -2.642) 15.063 22.650 ( -0.901 0.000 4.249) 4.344 ======================= Grid point 238 (101/336) ======================= q-point: (-0.09 -0.18 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.245 ( -23.561 4.714 6.161) 24.805 1.440 ( -27.240 -6.512 1.523) 28.049 2.264 ( -34.861 -11.114 -10.416) 38.044 2.708 ( -0.711 6.637 17.042) 18.303 4.385 ( -3.879 5.851 -13.011) 14.784 4.780 ( 2.300 -7.918 2.982) 8.768 4.943 ( 9.565 -0.237 -2.885) 9.993 5.196 ( 10.727 5.505 -4.807) 12.980 5.401 ( 7.296 -5.360 -10.124) 13.582 6.087 ( 14.090 1.751 5.718) 15.307 6.358 ( -1.792 5.502 6.557) 8.745 6.762 ( -6.045 2.691 -12.232) 13.907 6.886 ( 3.326 7.243 2.307) 8.297 7.029 ( 0.557 -7.500 -1.920) 7.761 7.066 ( 11.909 -2.090 -2.119) 12.275 7.559 ( 1.794 -4.714 1.451) 5.248 7.814 ( 5.276 0.160 -6.279) 8.203 8.063 ( -11.096 1.563 13.976) 17.914 8.566 ( -6.338 -2.030 -5.833) 8.850 8.660 ( 5.950 -0.077 -7.612) 9.662 8.785 ( -4.645 3.411 -7.837) 9.728 9.523 ( -2.657 0.827 4.851) 5.592 9.850 ( 2.072 1.369 -2.616) 3.607 10.016 ( -2.549 -5.085 8.737) 10.425 11.460 ( -5.112 5.435 4.837) 8.892 11.585 ( -4.361 -4.567 4.993) 8.051 13.072 ( 5.599 -2.003 -1.616) 6.162 13.724 ( -2.058 1.916 2.160) 3.545 13.979 ( -0.416 0.884 -2.721) 2.891 14.133 ( 2.003 0.191 -1.378) 2.439 16.525 ( -5.520 0.505 3.353) 6.478 17.001 ( -13.601 -4.919 -1.296) 14.521 17.335 ( 5.199 -0.377 -18.042) 18.780 17.406 ( -5.436 -3.775 10.669) 12.555 20.631 ( 11.777 6.426 -0.653) 13.432 22.648 ( -2.244 0.471 4.209) 4.793 ======================= Grid point 249 (102/336) ======================= q-point: (-0.09 -0.09 0.10) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.928 ( -25.469 0.000 15.972) 30.063 1.004 ( -27.887 0.000 9.718) 29.532 1.514 ( -43.280 0.000 -1.736) 43.315 2.883 ( 3.762 -0.000 11.353) 11.960 4.302 ( 0.567 -0.000 -7.897) 7.917 4.809 ( 2.857 -0.000 2.934) 4.095 4.982 ( 0.754 -0.000 -6.694) 6.737 5.379 ( 12.069 -0.000 -4.705) 12.954 5.486 ( 11.226 -0.000 -6.033) 12.745 6.354 ( -6.507 0.000 6.108) 8.925 6.376 ( 12.828 -0.000 10.693) 16.700 6.616 ( -4.328 0.000 -10.082) 10.972 6.916 ( 0.073 -0.000 -4.950) 4.950 7.108 ( 8.031 -0.000 3.922) 8.937 7.208 ( 9.775 -0.000 -5.849) 11.391 7.540 ( -0.457 0.000 0.492) 0.672 7.876 ( 7.469 -0.000 -6.156) 9.679 8.017 ( -7.479 0.000 20.122) 21.467 8.404 ( -5.844 0.000 -4.268) 7.236 8.651 ( -8.999 0.000 -7.894) 11.971 8.728 ( 5.441 -0.000 -4.607) 7.129 9.486 ( -5.072 0.000 3.973) 6.443 9.898 ( 5.726 -0.000 -4.131) 7.061 9.998 ( -3.159 0.000 7.445) 8.088 11.420 ( -5.602 0.000 2.866) 6.292 11.557 ( -2.020 0.000 5.202) 5.581 13.123 ( 3.672 -0.000 -3.222) 4.885 13.702 ( -2.761 0.000 1.969) 3.391 13.943 ( -1.507 0.000 -3.095) 3.442 14.163 ( 2.260 -0.000 -1.289) 2.601 16.475 ( -2.754 0.000 0.680) 2.837 16.775 ( -11.217 0.000 1.254) 11.287 17.224 ( -3.345 0.000 -25.207) 25.428 17.354 ( -5.615 0.000 6.544) 8.623 20.879 ( 14.187 -0.000 3.219) 14.548 22.631 ( -3.178 0.000 3.887) 5.021 ======================= Grid point 250 (103/336) ======================= q-point: ( 0.00 0.00 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.952 ( -5.654 0.000 23.616) 24.283 1.145 ( 13.889 -0.000 25.741) 29.249 1.941 ( -8.790 0.000 34.885) 35.975 2.103 ( -13.296 0.000 11.700) 17.711 4.498 ( -2.837 0.000 -14.055) 14.338 4.556 ( 8.456 -0.000 1.432) 8.576 5.198 ( 5.659 -0.000 6.111) 8.329 5.588 ( 6.633 -0.000 -6.006) 8.948 5.593 ( 8.502 -0.000 -5.407) 10.075 6.100 ( -9.863 0.000 -3.741) 10.549 6.360 ( -12.873 0.000 -1.834) 13.003 6.609 ( 6.647 -0.000 5.386) 8.555 7.033 ( 2.778 -0.000 -6.295) 6.881 7.284 ( -0.684 0.000 -1.444) 1.598 7.318 ( 10.456 -0.000 3.601) 11.058 7.666 ( -2.493 0.000 2.849) 3.786 7.786 ( -16.997 0.000 2.857) 17.236 8.245 ( 0.651 -0.000 -6.961) 6.991 8.355 ( 6.765 -0.000 3.208) 7.487 8.854 ( 12.538 -0.000 -4.712) 13.395 8.855 ( 4.609 -0.000 8.420) 9.599 9.543 ( 2.821 -0.000 2.621) 3.851 9.790 ( -11.702 0.000 -6.949) 13.610 9.933 ( 0.298 -0.000 -2.108) 2.129 11.239 ( -4.131 0.000 -3.698) 5.544 11.285 ( 1.547 -0.000 0.903) 1.791 13.223 ( 0.682 -0.000 -6.974) 7.007 13.692 ( -1.388 0.000 2.036) 2.465 13.902 ( -0.231 0.000 -1.296) 1.317 14.434 ( 1.627 -0.000 8.437) 8.592 16.496 ( -9.272 0.000 -0.169) 9.274 16.517 ( 7.344 -0.000 0.246) 7.348 16.991 ( 29.300 -0.000 0.888) 29.314 17.217 ( -8.173 0.000 -0.424) 8.184 20.932 ( -10.461 0.000 0.056) 10.461 22.555 ( -3.544 0.000 0.413) 3.568 ======================= Grid point 251 (104/336) ======================= q-point: ( 0.09 0.00 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.212 ( 7.750 -16.231 20.436) 27.224 1.658 ( 24.242 -4.894 22.427) 33.386 1.826 ( -6.899 -0.967 4.817) 8.470 2.330 ( 7.739 -1.715 36.217) 37.075 4.388 ( -1.899 -3.138 -13.899) 14.375 4.688 ( 6.344 0.458 3.368) 7.197 5.285 ( 0.189 0.824 4.926) 4.998 5.599 ( 5.387 7.869 -6.215) 11.383 5.707 ( 6.824 -1.590 -4.732) 8.455 5.880 ( -10.660 5.450 -2.977) 12.337 6.191 ( -9.832 -4.823 1.236) 11.020 6.733 ( 5.186 2.904 4.690) 7.571 7.018 ( -0.584 -0.332 -4.451) 4.502 7.234 ( -0.744 5.308 -6.147) 8.156 7.400 ( -1.723 0.801 3.006) 3.556 7.572 ( -10.795 -0.086 2.449) 11.070 7.652 ( -1.020 -1.517 6.562) 6.812 8.201 ( 1.092 1.814 -11.353) 11.549 8.413 ( -1.335 1.380 3.896) 4.344 8.929 ( 8.212 7.782 0.339) 11.319 9.038 ( 4.660 -4.113 6.659) 9.109 9.591 ( -0.090 2.324 -3.227) 3.978 9.641 ( -0.647 -2.819 0.838) 3.011 9.909 ( -2.703 -3.289 -2.641) 5.010 11.219 ( -0.331 -7.586 -4.403) 8.777 11.403 ( 8.330 -3.576 1.588) 9.203 13.119 ( -5.881 1.958 -6.983) 9.338 13.690 ( -0.207 0.493 2.015) 2.085 13.888 ( -0.504 -0.242 -2.333) 2.399 14.427 ( -3.881 5.134 7.913) 10.200 16.371 ( -8.236 -5.514 -2.202) 10.153 16.702 ( 13.341 -0.579 2.139) 13.524 17.094 ( -6.897 -5.491 -3.977) 9.671 17.569 ( 33.999 -5.275 -6.343) 34.986 20.683 ( -15.238 9.159 6.357) 18.881 22.506 ( -2.623 0.111 -0.528) 2.678 ======================= Grid point 252 (105/336) ======================= q-point: ( 0.18 0.00 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.596 ( 7.696 -7.894 10.104) 14.954 1.848 ( 3.708 -8.612 6.368) 11.334 2.168 ( 13.661 -6.077 21.937) 26.548 2.765 ( 19.830 -4.874 22.980) 30.742 4.326 ( -0.721 -5.023 -12.443) 13.438 4.783 ( 3.992 1.730 1.783) 4.702 5.194 ( -11.897 3.176 1.306) 12.383 5.568 ( 6.751 10.143 -7.018) 14.061 5.665 ( -7.256 6.236 4.601) 10.616 5.773 ( 3.018 -0.766 -6.994) 7.656 6.157 ( -4.306 -8.108 4.409) 10.184 6.731 ( -2.086 7.407 0.694) 7.726 6.933 ( -6.139 5.384 -3.162) 8.756 7.122 ( -0.075 1.340 -6.763) 6.895 7.374 ( -5.052 -5.741 -5.784) 9.588 7.480 ( 0.769 6.781 8.768) 11.110 7.718 ( 1.476 -0.621 7.484) 7.653 8.115 ( 0.768 2.750 -12.226) 12.555 8.383 ( -2.845 0.719 3.664) 4.694 8.880 ( -4.475 1.780 -8.791) 10.024 9.217 ( 5.376 -4.198 9.456) 11.660 9.563 ( 2.773 6.768 0.733) 7.351 9.696 ( 0.963 -1.910 4.014) 4.549 9.906 ( -0.129 -5.286 -2.181) 5.720 11.307 ( 3.947 -8.908 -2.482) 10.054 11.601 ( 7.140 -6.912 5.306) 11.265 12.953 ( -5.943 2.015 -7.763) 9.982 13.694 ( 0.208 1.699 2.118) 2.723 13.856 ( -1.505 -0.073 -3.124) 3.468 14.345 ( -4.552 5.783 5.517) 9.198 16.309 ( -5.105 -7.868 -3.256) 9.928 16.961 ( 14.322 0.825 2.918) 14.640 17.041 ( -2.773 -9.398 -5.359) 11.168 18.041 ( 21.247 -5.419 -0.583) 21.935 20.381 ( -12.324 13.772 2.677) 18.674 22.462 ( -2.033 -0.211 -1.415) 2.486 ======================= Grid point 253 (106/336) ======================= q-point: ( 0.27 0.00 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.656 ( 0.652 2.772 -5.000) 5.754 2.190 ( 12.157 -12.852 12.886) 21.887 2.493 ( 4.577 -5.872 22.095) 23.315 3.249 ( 18.787 -5.753 9.579) 21.859 4.308 ( 0.720 -4.581 -8.450) 9.639 4.769 ( -2.145 4.424 -3.783) 6.204 4.916 ( -16.514 3.825 -1.161) 16.991 5.527 ( 6.128 8.275 -9.145) 13.771 5.603 ( -1.778 4.368 11.386) 12.324 5.748 ( -1.343 0.411 -5.031) 5.223 6.223 ( -1.736 -8.022 3.333) 8.858 6.550 ( -6.863 10.905 -3.749) 13.419 6.763 ( -4.276 5.431 -0.755) 6.953 7.094 ( -0.816 -1.971 -6.937) 7.258 7.300 ( -3.363 -5.508 -11.472) 13.163 7.509 ( 3.729 8.833 8.663) 12.922 7.809 ( 4.271 1.740 9.344) 10.420 8.052 ( 2.443 1.342 -10.161) 10.536 8.364 ( -2.015 -0.751 2.686) 3.441 8.717 ( -7.691 -3.068 -10.913) 13.699 9.345 ( -1.304 -4.874 6.373) 8.128 9.522 ( -0.650 7.084 0.268) 7.118 9.754 ( 1.437 -2.428 2.139) 3.541 9.990 ( 5.470 -1.653 4.375) 7.197 11.456 ( 5.348 -6.734 -0.251) 8.603 11.809 ( 3.370 -8.131 10.375) 13.605 12.821 ( -1.834 0.531 -9.432) 9.623 13.680 ( -0.629 3.469 1.774) 3.947 13.810 ( -1.916 -0.305 -3.133) 3.685 14.251 ( -4.138 4.278 2.938) 6.637 16.318 ( -1.369 -9.747 -3.773) 10.541 16.990 ( -3.924 -8.615 -6.912) 11.721 17.278 ( 17.314 1.414 4.526) 17.952 18.354 ( 8.301 -4.024 11.211) 14.519 20.066 ( -8.516 14.588 -6.281) 18.022 22.436 ( -0.520 -1.162 -1.696) 2.121 ======================= Grid point 254 (107/336) ======================= q-point: ( 0.36 0.00 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.578 ( -0.397 3.619 -9.436) 10.114 2.531 ( 8.723 -6.876 9.563) 14.657 2.713 ( 0.687 -5.766 18.906) 19.777 3.522 ( 5.806 -2.837 0.124) 6.464 4.319 ( 0.308 0.997 0.043) 1.044 4.610 ( -6.860 3.771 -4.830) 9.198 4.649 ( -10.116 -1.531 -7.955) 12.960 5.492 ( 5.003 9.386 -6.845) 12.649 5.598 ( 0.154 5.659 -1.478) 5.850 5.713 ( -2.585 -2.563 7.009) 7.898 6.200 ( -8.313 -0.851 -2.493) 8.720 6.374 ( 0.332 4.624 -5.029) 6.840 6.717 ( 1.979 2.794 3.840) 5.144 7.030 ( -4.911 -3.735 -7.340) 9.589 7.232 ( -0.796 -3.100 -12.401) 12.808 7.547 ( 4.121 5.151 5.558) 8.626 7.884 ( 3.577 7.786 3.504) 9.257 8.070 ( 6.308 -0.290 -1.994) 6.622 8.364 ( -1.494 -2.169 2.040) 3.331 8.586 ( -6.173 -6.306 -9.291) 12.814 9.358 ( -5.246 0.342 5.386) 7.527 9.414 ( -4.507 -0.650 -6.130) 7.637 9.815 ( 1.925 -1.630 1.951) 3.189 10.138 ( 6.542 1.465 9.819) 11.889 11.569 ( 1.894 -2.832 1.711) 3.813 11.962 ( -1.099 -5.803 10.817) 12.325 12.788 ( 3.292 -2.726 -8.568) 9.575 13.636 ( -1.154 3.961 1.109) 4.272 13.769 ( -1.001 -0.214 -2.976) 3.147 14.179 ( -2.834 1.600 1.719) 3.681 16.396 ( 1.353 -11.183 -3.942) 11.935 16.965 ( -3.914 -8.543 -7.233) 11.858 17.546 ( 15.886 6.042 5.778) 17.952 18.502 ( -5.047 1.142 21.383) 22.001 19.793 ( -1.922 8.837 -15.504) 17.949 22.453 ( 1.663 -2.331 -1.035) 3.045 ======================= Grid point 255 (108/336) ======================= q-point: (-0.55 0.00 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.481 ( -0.303 1.716 -11.069) 11.206 2.667 ( -1.187 1.812 4.817) 5.282 2.836 ( -5.070 -4.261 15.814) 17.145 3.515 ( -4.680 -0.411 -5.053) 6.900 4.249 ( -5.424 4.272 2.115) 7.221 4.478 ( -0.449 2.600 -6.145) 6.688 4.596 ( 1.170 -8.952 -5.594) 10.621 5.410 ( -0.600 10.047 -2.859) 10.463 5.511 ( 3.182 7.102 -11.675) 14.031 5.742 ( -1.745 -0.132 5.273) 5.556 6.064 ( -6.508 -2.810 -1.460) 7.238 6.362 ( 3.226 0.593 -3.257) 4.623 6.777 ( 6.244 3.957 -0.213) 7.396 6.927 ( -9.157 -7.676 -5.757) 13.264 7.207 ( 1.863 -2.862 -6.859) 7.662 7.609 ( 4.309 2.242 3.003) 5.711 7.844 ( 3.385 10.963 -1.504) 11.572 8.199 ( 8.227 1.201 2.912) 8.809 8.373 ( -2.906 -3.350 2.781) 5.234 8.520 ( -4.002 -7.728 -8.208) 11.963 9.191 ( -7.196 4.309 -9.394) 12.593 9.401 ( -3.517 -5.947 5.184) 8.638 9.860 ( 1.368 -0.239 0.881) 1.645 10.266 ( 3.705 2.836 10.829) 11.791 11.585 ( -3.051 0.005 3.445) 4.602 12.005 ( -4.130 -1.559 6.251) 7.652 12.855 ( 4.369 -4.989 -4.262) 7.883 13.601 ( 0.245 2.562 1.163) 2.824 13.756 ( 1.671 -0.817 -3.467) 3.934 14.149 ( -1.787 -0.399 1.687) 2.490 16.503 ( 0.889 -11.532 -4.058) 12.257 16.941 ( -2.531 -6.873 -6.336) 9.685 17.732 ( 12.044 10.596 6.756) 17.406 18.399 ( -16.904 9.925 20.847) 28.615 19.703 ( 6.571 -2.878 -16.223) 17.738 22.516 ( 3.095 -3.012 0.141) 4.321 ======================= Grid point 256 (109/336) ======================= q-point: (-0.45 0.00 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.413 ( -1.249 -2.358 -8.250) 8.671 2.505 ( -14.080 9.113 0.200) 16.773 2.815 ( -10.977 -1.870 12.858) 17.009 3.371 ( -8.182 3.217 -3.241) 9.370 4.143 ( -4.009 -1.374 -6.141) 7.461 4.507 ( 6.752 -2.149 -2.522) 7.521 4.701 ( 5.136 -5.861 -1.565) 7.948 5.271 ( -0.976 12.233 -1.874) 12.414 5.425 ( 3.161 7.272 -12.173) 14.528 5.751 ( 2.826 0.129 -0.556) 2.884 6.042 ( -2.743 -7.271 2.502) 8.164 6.420 ( 4.662 -2.782 -2.351) 5.916 6.747 ( -5.300 -3.786 -13.035) 14.572 6.903 ( 3.916 0.011 2.652) 4.729 7.239 ( 0.020 -2.749 -0.176) 2.754 7.667 ( 3.117 1.529 1.664) 3.850 7.801 ( 6.156 11.910 -1.606) 13.502 8.304 ( 0.939 1.050 3.591) 3.857 8.368 ( -0.934 -3.752 0.792) 3.947 8.495 ( -2.050 -7.428 -7.877) 11.019 8.981 ( -6.417 3.592 -9.741) 12.206 9.455 ( -0.623 -4.980 6.253) 8.018 9.869 ( 0.364 1.303 -1.366) 1.922 10.326 ( -0.143 3.630 9.358) 10.038 11.537 ( -5.112 0.162 4.875) 7.066 11.944 ( -6.960 1.059 3.343) 7.794 12.943 ( 2.904 -4.294 -1.279) 5.339 13.616 ( 2.303 0.432 1.452) 2.757 13.798 ( 4.457 -1.724 -3.826) 6.121 14.140 ( -1.639 -0.849 1.651) 2.476 16.557 ( -3.982 -9.541 -4.367) 11.223 16.958 ( 1.767 -5.729 -4.602) 7.558 17.803 ( 6.169 15.484 5.689) 17.612 18.086 ( -19.821 11.874 14.864) 27.473 19.831 ( 10.561 -10.273 -11.090) 18.441 22.597 ( 2.751 -2.834 1.032) 4.082 ======================= Grid point 257 (110/336) ======================= q-point: (-0.36 0.00 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.375 ( -6.225 -6.597 0.082) 9.071 2.095 ( -23.170 10.668 -0.555) 25.514 2.721 ( -8.861 0.135 7.722) 11.754 3.130 ( -15.178 10.026 4.742) 18.798 4.080 ( -1.029 -4.364 -9.738) 10.720 4.654 ( 7.708 -5.742 -3.446) 10.211 4.838 ( 7.010 -4.044 -2.132) 8.369 5.153 ( 2.377 13.707 0.886) 13.940 5.340 ( 3.744 6.149 -11.309) 13.406 5.859 ( 9.486 -2.760 0.957) 9.925 6.134 ( 1.194 -9.855 3.846) 10.646 6.527 ( 5.755 -4.604 -4.490) 8.630 6.615 ( -6.546 -7.745 -11.195) 15.106 7.005 ( 8.402 3.281 0.268) 9.024 7.224 ( -3.537 0.947 1.887) 4.119 7.697 ( 1.471 1.641 1.181) 2.500 7.789 ( 6.155 10.892 -2.165) 12.697 8.251 ( -9.652 -5.091 4.359) 11.751 8.429 ( 3.460 -2.756 -5.432) 7.006 8.496 ( 0.693 -4.069 -4.602) 6.182 8.817 ( -3.910 4.368 -4.603) 7.454 9.543 ( 1.116 -3.848 6.634) 7.750 9.831 ( 0.093 3.113 -4.739) 5.671 10.311 ( -3.322 4.047 7.284) 8.971 11.496 ( -4.769 -1.556 5.965) 7.794 11.820 ( -9.123 0.991 3.218) 9.725 13.011 ( 2.391 -2.575 -0.802) 3.604 13.675 ( 3.344 -0.489 1.652) 3.762 13.867 ( 4.588 -1.599 -4.171) 6.403 14.128 ( -1.598 -0.329 1.221) 2.037 16.512 ( -6.788 -6.486 -3.992) 10.202 17.030 ( 3.066 -4.736 -4.035) 6.936 17.612 ( -11.597 17.958 2.724) 21.550 17.869 ( -5.660 9.839 12.462) 16.857 20.067 ( 12.097 -12.710 -8.125) 19.337 22.659 ( 1.012 -2.092 1.324) 2.675 ======================= Grid point 258 (111/336) ======================= q-point: (-0.27 0.00 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.300 ( -16.569 -8.238 5.306) 19.250 1.646 ( -21.252 8.877 11.841) 25.897 2.545 ( -13.963 15.205 1.124) 20.674 2.832 ( -16.098 0.311 12.505) 20.387 4.080 ( 3.259 -3.966 -8.021) 9.523 4.789 ( 5.093 -5.143 -3.455) 8.021 4.940 ( 6.171 3.237 -6.489) 9.522 5.118 ( 4.882 4.430 0.850) 6.647 5.325 ( 8.509 4.761 -8.007) 12.617 6.119 ( 14.192 -6.663 5.055) 16.473 6.272 ( 0.026 -10.591 2.643) 10.916 6.497 ( -1.899 -2.847 -9.256) 9.868 6.706 ( 6.883 -10.230 -3.204) 12.740 7.038 ( 0.563 6.268 -5.582) 8.412 7.194 ( 2.786 2.715 2.799) 4.793 7.697 ( 0.733 4.320 0.438) 4.403 7.765 ( 4.882 6.892 -2.232) 8.736 8.190 ( -9.401 -8.153 6.858) 14.208 8.429 ( -2.576 -5.299 -7.575) 9.596 8.556 ( 6.134 -0.120 -2.301) 6.552 8.711 ( -2.702 5.266 0.826) 5.977 9.612 ( -2.552 -1.726 6.650) 7.329 9.786 ( 4.656 3.668 -7.211) 9.335 10.241 ( -5.311 3.891 5.534) 8.600 11.473 ( -5.236 -2.654 4.114) 7.168 11.695 ( -8.871 -1.108 5.000) 10.243 13.059 ( 2.682 -0.776 -1.947) 3.404 13.737 ( 2.520 0.098 1.568) 2.970 13.908 ( 2.312 -0.004 -3.767) 4.420 14.119 ( -0.041 -0.191 0.664) 0.692 16.440 ( -5.471 -4.650 -3.235) 7.875 17.045 ( -2.770 -0.822 -5.265) 6.006 17.289 ( -9.800 13.812 2.083) 17.063 17.749 ( -6.144 10.881 9.128) 15.475 20.348 ( 13.211 -13.413 -6.441) 19.897 22.682 ( -1.071 -1.347 1.204) 2.100 ======================= Grid point 259 (112/336) ======================= q-point: (-0.18 0.00 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.034 ( -24.580 -6.514 8.159) 26.705 1.472 ( -11.804 7.264 29.397) 32.501 2.048 ( -24.258 23.936 14.917) 37.201 2.716 ( -13.609 -9.350 -0.664) 16.525 4.176 ( 8.797 -3.041 -2.667) 9.682 4.831 ( 0.893 5.791 -10.741) 12.235 4.929 ( 5.003 1.195 0.969) 5.235 5.256 ( 10.091 -5.378 -3.138) 11.858 5.407 ( 10.168 2.680 -5.441) 11.839 6.305 ( -6.135 -9.236 -0.829) 11.119 6.407 ( 3.367 -6.145 -0.288) 7.013 6.548 ( 9.908 -3.803 4.681) 11.600 6.856 ( 1.943 1.410 -4.669) 5.250 6.970 ( 5.540 -4.705 -4.271) 8.430 7.226 ( 4.020 4.252 -3.084) 6.615 7.663 ( 3.523 7.845 0.207) 8.602 7.834 ( 7.947 1.048 2.045) 8.273 8.188 ( -7.310 -10.605 7.380) 14.846 8.365 ( -4.982 -2.970 -5.942) 8.304 8.630 ( -0.910 3.990 3.430) 5.340 8.655 ( 5.089 0.935 0.283) 5.181 9.567 ( -4.353 1.512 2.087) 5.059 9.840 ( 7.385 1.708 -3.330) 8.279 10.140 ( -6.730 2.957 3.361) 8.083 11.405 ( -7.564 -2.833 -0.137) 8.079 11.613 ( -7.471 -0.294 4.084) 8.519 13.095 ( 4.001 0.333 -2.853) 4.926 13.754 ( -0.925 1.093 0.808) 1.644 13.909 ( 1.691 1.731 -1.559) 2.879 14.152 ( 2.757 -1.253 2.066) 3.666 16.399 ( -1.817 -3.403 -2.495) 4.594 16.892 ( -8.059 4.383 -2.845) 9.605 17.050 ( -7.672 12.794 -2.578) 15.139 17.579 ( -8.859 9.095 6.201) 14.130 20.661 ( 13.575 -14.129 -5.166) 20.263 22.666 ( -2.926 -0.857 0.832) 3.161 ======================= Grid point 260 (113/336) ======================= q-point: (-0.09 0.00 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.884 ( -12.074 -8.821 21.514) 26.200 1.234 ( -17.798 25.189 20.284) 36.914 1.788 ( -9.587 4.699 41.957) 43.294 2.467 ( -23.172 -5.001 -7.963) 25.008 4.369 ( 10.882 -3.918 -0.113) 11.567 4.666 ( -1.920 7.556 -13.675) 15.741 5.055 ( 6.549 -1.397 4.961) 8.334 5.446 ( 9.694 -5.180 -5.509) 12.294 5.514 ( 9.159 1.764 -5.110) 10.635 6.240 ( -8.297 -5.278 -3.212) 10.345 6.474 ( 1.226 -4.302 2.052) 4.921 6.590 ( -8.205 2.527 -0.664) 8.611 6.960 ( 10.751 -1.439 1.244) 10.918 7.115 ( 10.002 -1.325 -4.675) 11.119 7.257 ( 3.512 -2.461 -1.508) 4.546 7.663 ( 2.649 5.068 2.222) 6.135 7.960 ( -0.464 0.612 3.971) 4.044 8.221 ( -0.431 -8.047 -0.443) 8.071 8.286 ( -2.166 -1.066 -3.854) 4.548 8.649 ( 5.162 -1.571 4.700) 7.156 8.759 ( 6.498 1.542 3.722) 7.645 9.518 ( -0.852 1.172 1.587) 2.149 9.911 ( 4.510 1.098 -2.067) 5.081 10.002 ( -9.109 1.534 -1.386) 9.341 11.311 ( -6.214 -3.004 -1.452) 7.053 11.441 ( -9.910 7.834 -2.281) 12.837 13.171 ( 6.821 -1.394 -3.256) 7.685 13.716 ( -2.560 0.856 1.528) 3.102 13.911 ( 0.829 1.266 -0.913) 1.768 14.276 ( 6.587 -3.224 7.481) 10.476 16.422 ( 3.312 -1.729 -1.638) 4.080 16.738 ( -12.458 10.970 -1.281) 16.649 16.765 ( 2.102 7.760 1.969) 8.277 17.385 ( -10.064 4.959 3.007) 11.616 20.932 ( 6.384 -11.355 -5.644) 14.197 22.616 ( -4.322 -0.343 0.542) 4.370 ======================= Grid point 262 (114/336) ======================= q-point: ( 0.09 0.09 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.494 ( 18.272 -0.000 19.238) 26.532 1.775 ( -0.983 0.000 1.336) 1.659 2.113 ( 15.655 -0.000 20.988) 26.183 2.723 ( 18.710 -0.000 25.130) 31.330 4.273 ( 0.039 -0.000 -13.289) 13.289 4.800 ( 4.431 -0.000 2.338) 5.010 5.222 ( -11.256 0.000 1.942) 11.422 5.695 ( 4.994 -0.000 -3.909) 6.342 5.709 ( -5.236 0.000 -9.470) 10.821 5.782 ( 1.479 -0.000 2.867) 3.226 6.054 ( -5.603 0.000 3.726) 6.729 6.819 ( -0.369 0.000 2.325) 2.354 6.944 ( -4.606 0.000 -2.673) 5.325 7.229 ( 1.493 -0.000 -10.507) 10.612 7.239 ( -11.819 0.000 -4.607) 12.686 7.562 ( 1.819 -0.000 13.932) 14.050 7.705 ( 1.123 -0.000 7.755) 7.836 8.150 ( 1.223 -0.000 -14.406) 14.458 8.386 ( -5.012 0.000 4.167) 6.518 8.900 ( -7.153 0.000 -12.297) 14.226 9.167 ( 5.330 -0.000 9.234) 10.662 9.675 ( 0.617 -0.000 3.985) 4.033 9.688 ( 10.708 -0.000 3.968) 11.419 9.804 ( -4.602 0.000 -4.207) 6.236 11.216 ( 6.752 -0.000 -2.809) 7.313 11.534 ( 7.413 -0.000 4.794) 8.828 12.971 ( -7.583 0.000 -6.635) 10.076 13.710 ( 0.719 -0.000 2.096) 2.215 13.859 ( -0.865 0.000 -3.831) 3.927 14.405 ( -6.313 0.000 5.744) 8.535 16.221 ( -4.885 0.000 -3.581) 6.057 16.950 ( -4.549 0.000 -5.363) 7.033 16.976 ( 18.232 -0.000 4.230) 18.716 17.985 ( 23.158 -0.000 -1.987) 23.243 20.517 ( -14.132 0.000 2.943) 14.435 22.460 ( -2.305 0.000 -1.579) 2.794 ======================= Grid point 263 (115/336) ======================= q-point: ( 0.18 0.09 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.734 ( 2.342 5.027 -2.715) 6.174 1.969 ( 17.278 -9.386 14.309) 24.318 2.420 ( 5.811 -1.878 23.125) 23.918 3.176 ( 20.151 -1.926 11.589) 23.325 4.231 ( 2.253 -2.584 -10.899) 11.425 4.825 ( -0.725 1.487 -4.696) 4.979 4.973 ( -18.563 1.750 1.069) 18.675 5.598 ( -1.894 1.012 -0.325) 2.172 5.718 ( 2.128 3.234 -1.873) 4.301 5.792 ( 0.829 5.837 -1.448) 6.071 6.064 ( -1.474 -7.939 4.216) 9.109 6.732 ( -5.859 7.206 -1.844) 9.469 6.830 ( -8.100 1.669 -0.516) 8.286 7.032 ( -8.278 -4.092 -6.646) 11.377 7.229 ( 4.500 -1.600 -12.624) 13.497 7.677 ( 2.891 8.239 11.719) 14.614 7.793 ( 3.273 -3.611 11.879) 12.840 8.083 ( 2.923 1.447 -14.405) 14.770 8.334 ( -4.915 -1.610 3.584) 6.292 8.682 ( -8.797 -0.835 -13.638) 16.251 9.272 ( -0.089 -2.366 5.896) 6.354 9.656 ( -4.636 5.610 -1.294) 7.392 9.715 ( 1.928 -1.200 -0.261) 2.286 9.941 ( 10.104 -2.934 7.853) 13.129 11.371 ( 10.869 -2.241 0.080) 11.098 11.688 ( 3.897 -3.831 9.403) 10.875 12.820 ( -5.323 -0.288 -7.975) 9.593 13.731 ( 0.715 1.474 2.221) 2.760 13.812 ( -1.381 0.351 -4.459) 4.681 14.312 ( -6.888 1.929 2.866) 7.706 16.170 ( -1.582 -4.833 -3.995) 6.467 16.873 ( -2.769 -3.226 -6.252) 7.560 17.322 ( 21.641 1.836 5.431) 22.387 18.285 ( 10.799 -2.454 7.970) 13.644 20.264 ( -13.145 5.763 -4.930) 15.175 22.421 ( -1.063 -0.422 -2.138) 2.424 ======================= Grid point 264 (116/336) ======================= q-point: ( 0.27 0.09 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.670 ( 0.282 5.362 -7.825) 9.490 2.397 ( 15.091 -6.835 11.716) 20.291 2.634 ( 1.608 -2.696 21.226) 21.456 3.473 ( 8.464 -1.878 1.296) 8.766 4.265 ( 4.697 -4.483 -6.947) 9.509 4.649 ( -18.921 2.110 0.467) 19.044 4.696 ( -5.596 2.815 -10.558) 12.276 5.618 ( 5.086 2.147 -3.035) 6.300 5.670 ( -5.843 -0.452 -2.959) 6.565 5.735 ( 1.773 9.554 8.315) 12.789 6.138 ( -1.914 -5.940 0.527) 6.263 6.508 ( -6.033 8.713 -6.350) 12.354 6.732 ( -3.480 -0.692 3.620) 5.068 6.927 ( -7.546 -7.126 -8.020) 13.116 7.237 ( 6.598 2.602 -14.033) 15.724 7.661 ( -0.510 6.678 6.543) 9.363 7.973 ( 4.983 1.233 10.243) 11.457 8.064 ( 5.606 -0.169 -7.065) 9.020 8.305 ( -3.462 -3.402 1.661) 5.130 8.503 ( -5.928 -2.432 -10.083) 11.947 9.291 ( -4.006 -3.813 4.154) 6.916 9.485 ( -6.901 4.375 -7.734) 11.251 9.783 ( 3.328 -1.484 1.917) 4.118 10.158 ( 8.239 0.564 10.595) 13.433 11.553 ( 8.600 1.030 2.211) 8.940 11.837 ( 0.301 -6.821 11.840) 13.667 12.724 ( -1.924 -3.183 -8.891) 9.638 13.718 ( -0.027 3.974 0.199) 3.979 13.772 ( -0.390 0.325 -2.396) 2.449 14.203 ( -5.914 0.882 0.845) 6.039 16.206 ( 1.282 -8.065 -3.838) 9.023 16.837 ( -1.858 -4.747 -6.348) 8.142 17.675 ( 22.140 6.572 5.857) 23.826 18.477 ( -0.170 -2.885 18.209) 18.437 19.943 ( -11.844 6.338 -13.774) 19.240 22.418 ( 1.275 -1.348 -1.750) 2.550 ======================= Grid point 265 (117/336) ======================= q-point: ( 0.36 0.09 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.561 ( 0.001 5.866 -10.679) 12.185 2.681 ( 7.373 -0.568 7.322) 10.406 2.772 ( -2.805 -2.512 17.895) 18.287 3.497 ( -4.334 -0.911 -4.572) 6.366 4.324 ( -5.909 3.113 -0.233) 6.682 4.409 ( -3.122 -8.205 -5.682) 10.457 4.531 ( -2.385 1.065 -8.963) 9.336 5.543 ( -6.526 0.491 -3.375) 7.364 5.625 ( 6.073 7.807 -8.370) 12.957 5.756 ( -1.211 3.389 11.064) 11.635 6.068 ( -5.912 1.685 -3.379) 7.015 6.389 ( 1.284 1.974 -5.622) 6.095 6.779 ( 1.532 -4.052 6.525) 7.832 6.807 ( -7.609 -5.085 -9.520) 13.205 7.221 ( 6.013 4.747 -11.799) 14.068 7.653 ( 1.151 2.402 3.602) 4.480 7.993 ( 2.979 5.137 -3.308) 6.797 8.201 ( 5.328 -2.838 5.337) 8.058 8.309 ( -0.946 -2.281 3.118) 3.978 8.411 ( -2.931 -2.904 -6.716) 7.882 9.230 ( -8.767 -2.193 -11.651) 14.745 9.334 ( -2.655 0.760 5.821) 6.442 9.852 ( 2.934 -0.458 0.724) 3.057 10.313 ( 4.455 2.047 10.635) 11.711 11.623 ( 0.693 3.955 4.569) 6.083 11.952 ( -0.654 -4.070 7.588) 8.635 12.714 ( -0.540 -8.521 -6.453) 10.703 13.685 ( 1.508 5.047 0.297) 5.276 13.756 ( 0.948 0.717 -2.361) 2.643 14.131 ( -3.758 -1.367 0.702) 4.060 16.300 ( 2.276 -9.443 -3.493) 10.323 16.824 ( -1.037 -5.260 -5.571) 7.732 17.953 ( 18.303 12.311 6.428) 22.976 18.523 ( -11.044 2.770 22.481) 25.200 19.660 ( -5.674 -1.483 -18.847) 19.738 22.466 ( 3.286 -2.224 -0.554) 4.006 ======================= Grid point 266 (118/336) ======================= q-point: (-0.55 0.09 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( 0.560 5.027 -11.208) 12.296 2.682 ( -7.065 9.134 0.496) 11.558 2.786 ( -9.115 -0.951 15.246) 17.789 3.382 ( -6.325 -1.451 -2.833) 7.081 4.146 ( -6.823 1.088 -5.655) 8.929 4.429 ( 1.279 -5.603 -6.562) 8.723 4.591 ( 6.547 -6.190 -1.465) 9.128 5.427 ( -3.909 1.361 -3.435) 5.379 5.569 ( 2.899 10.744 -5.374) 12.358 5.752 ( 0.079 0.356 0.413) 0.551 5.976 ( -2.245 0.182 0.518) 2.311 6.387 ( 1.447 -1.293 -3.497) 3.999 6.658 ( -6.093 -3.564 -13.567) 15.294 6.913 ( 4.531 -2.052 8.242) 9.626 7.215 ( 4.107 2.204 -6.331) 7.862 7.687 ( 2.376 0.369 1.095) 2.642 7.976 ( 3.621 6.100 -2.358) 7.475 8.261 ( -5.260 -5.481 1.109) 7.677 8.363 ( 1.142 0.801 -3.870) 4.114 8.384 ( 3.372 -1.442 2.760) 4.591 9.018 ( -7.757 -0.114 -11.714) 14.050 9.378 ( 0.291 -2.790 7.626) 8.126 9.889 ( 1.997 0.938 -1.046) 2.442 10.387 ( 0.218 2.773 8.733) 9.165 11.583 ( -3.802 4.225 5.546) 7.941 11.958 ( -4.210 0.834 2.018) 4.742 12.778 ( -0.617 -12.017 -2.260) 12.243 13.679 ( 3.046 5.055 1.818) 6.176 13.778 ( 4.352 -0.347 -3.424) 5.548 14.109 ( -2.339 -2.299 1.353) 3.548 16.387 ( -0.008 -8.153 -3.311) 8.799 16.845 ( 1.143 -5.905 -3.915) 7.177 18.098 ( 10.297 15.246 7.997) 20.061 18.315 ( -18.548 12.193 13.303) 25.878 19.617 ( 3.911 -12.312 -13.139) 18.426 22.546 ( 3.501 -2.478 0.671) 4.341 ======================= Grid point 267 (119/336) ======================= q-point: (-0.45 0.09 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.351 ( -0.460 3.577 -7.625) 8.434 2.328 ( -19.838 13.427 -2.347) 24.069 2.714 ( -10.048 0.422 12.993) 16.430 3.272 ( -7.879 4.071 2.344) 9.173 4.034 ( -1.607 -0.904 -8.050) 8.259 4.517 ( 5.047 -8.283 -4.699) 10.777 4.744 ( 5.867 -6.422 -2.173) 8.966 5.361 ( 0.930 3.001 -2.850) 4.242 5.464 ( 0.857 11.234 -4.398) 12.095 5.800 ( 5.389 -2.989 -1.024) 6.247 6.001 ( 1.628 -3.921 2.565) 4.960 6.406 ( -1.917 -7.145 -3.296) 8.098 6.537 ( -0.134 -0.540 -12.828) 12.840 7.056 ( 7.217 0.586 5.744) 9.243 7.214 ( -0.692 0.060 -2.157) 2.267 7.721 ( 2.031 0.868 -0.493) 2.263 7.962 ( 2.169 4.932 -0.989) 5.478 8.181 ( -7.625 -0.484 -0.337) 7.648 8.344 ( -0.983 -4.965 -8.115) 9.564 8.473 ( 4.491 0.750 2.552) 5.220 8.871 ( -3.790 0.866 -5.099) 6.412 9.472 ( 1.651 -3.413 7.649) 8.538 9.886 ( 1.635 2.691 -3.713) 4.868 10.379 ( -3.217 3.125 6.300) 7.733 11.517 ( -3.865 3.236 6.187) 7.980 11.842 ( -8.579 1.882 -0.148) 8.784 12.876 ( -0.056 -10.989 -0.207) 10.991 13.712 ( 4.385 3.322 1.786) 5.784 13.847 ( 5.781 -0.254 -3.116) 6.572 14.105 ( -1.826 -1.887 1.486) 3.017 16.401 ( -3.163 -5.014 -2.860) 6.582 16.922 ( 2.940 -6.494 -2.403) 7.523 17.930 ( -19.240 13.987 5.566) 24.429 18.103 ( 3.079 16.100 7.374) 17.974 19.802 ( 9.213 -15.319 -7.593) 19.422 22.619 ( 1.875 -2.070 1.318) 3.089 ======================= Grid point 268 (120/336) ======================= q-point: (-0.36 0.09 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.253 ( -4.961 3.406 -2.566) 6.542 1.867 ( -19.754 14.121 6.699) 25.189 2.627 ( -9.533 -0.377 9.322) 13.338 3.031 ( -15.617 14.117 7.393) 22.312 4.021 ( 3.678 -2.187 -6.170) 7.509 4.661 ( 5.364 -8.358 -2.998) 10.373 4.874 ( 5.861 -7.005 -5.055) 10.439 5.322 ( 0.976 13.698 -1.409) 13.805 5.384 ( 4.730 0.357 -7.087) 8.528 5.977 ( 9.054 -7.816 1.915) 12.114 6.105 ( 2.412 -6.500 2.379) 7.330 6.397 ( -2.384 -7.724 -8.001) 11.374 6.565 ( 7.677 -3.797 -4.463) 9.658 7.136 ( -2.488 3.720 -5.282) 6.923 7.205 ( 5.042 -0.661 5.343) 7.376 7.726 ( 0.783 1.484 -0.587) 1.777 7.940 ( 0.599 3.864 0.064) 3.910 8.060 ( -6.431 -0.612 -0.854) 6.516 8.323 ( -2.283 -5.795 -7.051) 9.408 8.553 ( 5.005 0.099 0.695) 5.054 8.797 ( -2.332 2.939 0.436) 3.777 9.566 ( -0.496 -2.918 7.897) 8.433 9.861 ( 3.909 4.071 -6.468) 8.584 10.310 ( -5.466 3.277 4.445) 7.769 11.479 ( -2.190 2.804 5.412) 6.477 11.678 ( -10.154 -0.167 1.358) 10.246 12.972 ( 1.017 -7.982 -0.341) 8.054 13.763 ( 3.221 1.513 0.433) 3.585 13.917 ( 5.306 1.417 -2.016) 5.850 14.103 ( -1.055 -1.335 0.925) 1.937 16.366 ( -3.330 -2.798 -1.720) 4.677 16.995 ( 0.356 -4.365 -2.574) 5.080 17.551 ( -13.475 13.428 1.781) 19.106 17.998 ( -3.010 14.940 6.465) 16.555 20.071 ( 10.706 -15.534 -5.616) 19.684 22.655 ( -0.507 -1.459 1.364) 2.060 ======================= Grid point 269 (121/336) ======================= q-point: (-0.27 0.09 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.060 ( -9.784 8.537 0.480) 12.993 1.622 ( -8.680 10.094 27.063) 30.160 2.483 ( -11.675 10.994 3.529) 16.421 2.635 ( -22.179 10.557 12.932) 27.760 4.116 ( 7.843 -2.927 -1.681) 8.538 4.800 ( 4.912 -5.839 -0.307) 7.636 4.995 ( 5.872 -3.228 -9.688) 11.780 5.206 ( 1.662 5.704 -3.949) 7.134 5.448 ( 7.407 0.401 -5.455) 9.208 6.115 ( -4.906 -9.451 1.467) 10.749 6.281 ( 9.004 -6.917 -1.625) 11.470 6.439 ( 4.837 -7.227 -1.139) 8.770 6.766 ( 11.368 -7.813 -0.760) 13.815 6.986 ( -6.562 3.057 -5.685) 9.204 7.301 ( 5.455 3.066 -1.239) 6.379 7.726 ( 0.346 0.517 1.152) 1.309 7.928 ( 3.235 3.365 0.672) 4.716 7.997 ( -5.635 -4.692 2.807) 7.851 8.291 ( -2.578 -4.443 -6.549) 8.324 8.639 ( 4.336 -0.273 1.109) 4.484 8.734 ( -2.444 3.794 3.391) 5.645 9.583 ( -3.777 -0.057 5.451) 6.632 9.884 ( 7.292 2.940 -5.241) 9.449 10.199 ( -7.349 3.095 2.458) 8.345 11.419 ( -3.370 4.423 -0.501) 5.583 11.586 ( -5.630 -2.274 7.235) 9.445 13.052 ( 2.411 -4.805 -1.827) 5.678 13.772 ( -0.877 0.225 -1.344) 1.620 13.962 ( 4.285 3.976 -0.655) 5.882 14.118 ( 0.679 -2.214 0.986) 2.517 16.345 ( -0.774 -1.832 -0.365) 2.022 16.954 ( -4.487 1.408 -3.209) 5.693 17.288 ( -5.957 12.040 0.010) 13.433 17.817 ( -5.574 14.809 3.378) 16.180 20.354 ( 8.833 -17.125 -4.078) 19.695 22.648 ( -2.649 -1.016 1.050) 3.025 ======================= Grid point 270 (122/336) ======================= q-point: (-0.18 0.09 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.934 ( 4.826 12.369 13.905) 19.225 1.628 ( -5.041 13.357 31.014) 34.143 2.061 ( -16.867 26.068 21.012) 37.490 2.361 ( -20.241 -4.139 3.112) 20.893 4.290 ( 9.039 -3.864 1.928) 10.017 4.838 ( 0.167 8.035 -12.920) 15.215 5.009 ( 5.070 -2.892 1.987) 6.166 5.301 ( 7.247 -9.139 -5.252) 12.792 5.538 ( 7.675 -0.019 -4.872) 9.091 6.088 ( -8.568 -8.885 -1.375) 12.419 6.394 ( 3.043 -3.672 -1.135) 4.902 6.601 ( -0.056 -2.864 1.472) 3.221 6.888 ( 1.465 -4.929 -3.500) 6.220 7.027 ( 11.506 -6.852 1.326) 13.457 7.301 ( 3.020 5.443 -5.630) 8.393 7.729 ( -1.769 0.797 1.869) 2.694 7.951 ( -10.444 -7.474 1.645) 12.948 8.048 ( 12.052 -1.352 4.135) 12.814 8.251 ( -0.956 -2.424 -6.682) 7.172 8.635 ( -4.443 -0.005 3.651) 5.750 8.788 ( 7.532 1.259 5.592) 9.465 9.549 ( -1.655 1.759 3.259) 4.056 9.945 ( 5.515 2.181 -3.095) 6.690 10.040 ( -9.805 2.412 -1.386) 10.192 11.331 ( -0.439 4.689 -0.819) 4.780 11.555 ( -4.094 3.647 3.616) 6.567 13.122 ( 3.865 -3.604 -4.054) 6.661 13.727 ( -3.157 -0.159 -0.611) 3.220 13.962 ( 1.101 4.060 -1.397) 4.433 14.193 ( 2.558 -4.848 4.599) 7.155 16.382 ( 3.273 -1.700 0.845) 3.784 16.841 ( -4.026 4.614 -1.311) 6.262 17.098 ( 1.653 16.621 -3.116) 16.991 17.586 ( -6.355 15.818 -0.735) 17.063 20.606 ( 1.841 -20.280 -1.459) 20.415 22.606 ( -3.937 -0.639 0.686) 4.047 ======================= Grid point 271 (123/336) ======================= q-point: (-0.09 0.09 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.158 ( 21.592 14.086 18.955) 31.999 1.395 ( -8.432 27.175 19.801) 34.665 1.963 ( -11.733 2.674 29.653) 32.001 2.119 ( -8.008 2.634 16.578) 18.598 4.462 ( 4.821 -2.788 -0.071) 5.569 4.647 ( 0.389 8.093 -12.412) 14.822 5.172 ( 6.126 -2.885 6.343) 9.278 5.464 ( 6.185 -9.547 -6.749) 13.227 5.629 ( 7.065 0.085 -4.259) 8.250 6.001 ( -10.142 -8.031 -3.059) 13.293 6.389 ( -7.764 2.045 -1.282) 8.130 6.596 ( 3.750 -0.996 3.999) 5.572 6.998 ( 2.719 -6.404 -3.208) 7.661 7.232 ( 3.798 -3.557 -5.379) 7.484 7.296 ( 5.083 -1.134 3.555) 6.306 7.675 ( -5.020 0.240 2.556) 5.639 7.793 ( -13.350 -0.064 1.036) 13.391 8.225 ( 0.849 -1.855 -8.256) 8.504 8.322 ( 9.763 -3.748 3.041) 10.891 8.669 ( 3.979 -8.689 5.824) 11.191 8.940 ( 7.712 2.349 5.672) 9.858 9.554 ( 1.801 1.173 2.519) 3.311 9.821 ( -11.034 2.800 -5.757) 12.757 9.965 ( 1.287 2.355 -2.665) 3.782 11.323 ( 4.643 4.591 0.711) 6.568 11.398 ( -4.501 12.464 -3.498) 13.706 13.176 ( 0.780 -4.389 -6.937) 8.246 13.690 ( -1.973 -0.527 1.548) 2.563 13.920 ( -0.917 2.172 -1.291) 2.688 14.332 ( 0.995 -8.328 8.069) 11.639 16.482 ( 4.378 -1.921 2.005) 5.184 16.653 ( -7.001 10.113 -2.569) 12.565 17.157 ( 26.473 12.991 -2.932) 29.634 17.323 ( -6.438 13.884 -3.457) 15.690 20.735 ( -9.817 -18.431 2.969) 21.092 22.552 ( -3.477 -0.282 0.387) 3.510 ======================= Grid point 274 (124/336) ======================= q-point: ( 0.18 0.18 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.732 ( -0.315 0.000 -7.050) 7.057 2.320 ( 18.451 -0.000 12.739) 22.421 2.609 ( 1.940 -0.000 22.000) 22.085 3.456 ( 9.628 -0.000 1.754) 9.786 4.216 ( 4.609 -0.000 -8.505) 9.673 4.674 ( -20.125 0.000 2.485) 20.278 4.721 ( -5.546 0.000 -12.869) 14.013 5.630 ( 3.923 -0.000 1.524) 4.209 5.663 ( -6.696 0.000 -2.189) 7.045 5.889 ( 3.387 -0.000 3.925) 5.184 6.028 ( -0.049 0.000 2.153) 2.153 6.667 ( -11.975 0.000 -1.972) 12.137 6.669 ( -4.723 0.000 -4.103) 6.257 6.838 ( -4.457 0.000 -6.438) 7.830 7.269 ( 8.801 -0.000 -13.024) 15.719 7.746 ( -4.133 0.000 5.921) 7.221 7.958 ( 6.135 -0.000 16.235) 17.356 8.069 ( 5.247 -0.000 -13.696) 14.666 8.267 ( -3.903 0.000 2.390) 4.577 8.485 ( -5.292 0.000 -9.456) 10.837 9.252 ( -3.981 0.000 3.061) 5.021 9.531 ( -7.923 0.000 -8.083) 11.319 9.768 ( 4.049 -0.000 2.026) 4.527 10.162 ( 9.337 -0.000 10.806) 14.281 11.578 ( 13.888 -0.000 2.075) 14.042 11.755 ( -1.691 0.000 12.520) 12.634 12.691 ( -4.087 0.000 -8.543) 9.471 13.766 ( 0.689 -0.000 2.741) 2.826 13.768 ( -0.317 0.000 -5.197) 5.207 14.211 ( -7.340 0.000 0.372) 7.350 16.126 ( 1.669 -0.000 -3.364) 3.755 16.792 ( -1.194 0.000 -6.000) 6.118 17.746 ( 25.070 -0.000 5.737) 25.718 18.440 ( 0.722 -0.000 16.596) 16.611 20.005 ( -15.384 0.000 -12.900) 20.077 22.405 ( 1.135 -0.000 -2.014) 2.312 ======================= Grid point 275 (125/336) ======================= q-point: ( 0.27 0.18 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.658 ( -0.320 3.398 -9.402) 10.002 2.657 ( 13.322 -1.273 8.784) 16.008 2.742 ( -1.893 -0.718 19.468) 19.573 3.490 ( -3.696 0.020 -4.785) 6.046 4.270 ( 4.818 -3.828 -6.871) 9.224 4.389 ( -15.411 1.643 3.562) 15.902 4.538 ( -5.071 -0.145 -15.288) 16.107 5.520 ( -9.832 -1.200 -0.449) 9.915 5.700 ( 5.575 1.083 -3.744) 6.802 5.905 ( 0.485 9.850 5.347) 11.218 6.052 ( -2.916 -4.565 -0.418) 5.433 6.456 ( -3.992 5.497 -3.830) 7.799 6.640 ( -2.742 -8.406 -2.318) 9.140 6.763 ( -1.819 -0.624 -5.175) 5.521 7.322 ( 9.120 3.944 -12.460) 15.937 7.691 ( -4.147 1.334 3.924) 5.863 8.058 ( 2.134 2.433 -2.398) 4.028 8.115 ( 1.656 -4.411 1.258) 4.877 8.266 ( 1.551 -1.883 0.963) 2.622 8.416 ( 0.799 1.414 0.908) 1.861 9.170 ( -7.524 -2.245 -6.978) 10.504 9.372 ( -5.216 1.525 -0.253) 5.440 9.847 ( 4.271 -0.148 0.440) 4.296 10.339 ( 4.910 0.680 10.279) 11.412 11.722 ( 0.068 5.989 8.384) 10.303 11.856 ( 6.078 -5.786 6.292) 10.488 12.587 ( -4.750 -3.924 -7.974) 10.077 13.747 ( 2.566 1.269 -4.281) 5.150 13.783 ( 0.036 1.670 2.479) 2.990 14.107 ( -5.309 -0.864 -0.483) 5.400 16.173 ( 3.783 -3.634 -2.369) 5.756 16.755 ( -0.500 -1.940 -5.264) 5.632 18.156 ( 24.458 7.664 5.326) 26.178 18.511 ( -7.699 -2.565 22.249) 23.683 19.648 ( -15.465 -0.071 -18.792) 24.337 22.437 ( 3.405 -0.812 -0.967) 3.632 ======================= Grid point 276 (126/336) ======================= q-point: (-0.64 0.18 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.558 ( 1.304 5.752 -11.002) 12.483 2.772 ( -8.841 0.168 14.110) 16.652 2.830 ( 3.746 5.236 4.583) 7.902 3.344 ( -8.638 -1.917 -3.817) 9.636 4.166 ( -9.638 0.487 -1.048) 9.707 4.340 ( 2.079 -2.559 -11.109) 11.588 4.468 ( 3.064 -6.592 -5.167) 8.919 5.387 ( -8.919 -3.279 0.333) 9.509 5.744 ( 6.741 3.732 -6.486) 10.071 5.798 ( -3.785 6.461 -1.204) 7.584 6.003 ( -3.974 1.174 0.662) 4.196 6.385 ( -0.287 2.410 -1.214) 2.714 6.626 ( -0.286 -0.944 -12.828) 12.865 6.805 ( 1.918 -7.740 7.495) 10.944 7.326 ( 6.479 7.957 -8.882) 13.571 7.669 ( -1.046 -2.522 1.073) 2.933 8.041 ( -0.700 1.767 -0.555) 1.980 8.159 ( 0.074 -4.883 -3.222) 5.850 8.313 ( 2.272 -1.784 -3.557) 4.583 8.468 ( 3.676 4.894 8.977) 10.865 8.981 ( -9.025 -3.010 -13.061) 16.159 9.353 ( -0.412 -0.267 7.173) 7.189 9.905 ( 3.499 0.668 -1.277) 3.785 10.427 ( 0.218 1.409 8.292) 8.414 11.667 ( -6.382 3.882 9.244) 11.885 11.992 ( 3.999 3.121 0.425) 5.090 12.542 ( -4.078 -11.908 -4.441) 13.348 13.768 ( 0.832 3.864 2.737) 4.808 13.782 ( 4.875 0.564 -3.763) 6.185 14.063 ( -2.256 -2.269 0.483) 3.236 16.266 ( 3.607 -4.539 -1.463) 5.979 16.751 ( 0.432 -3.753 -3.817) 5.370 18.341 ( -3.099 9.697 16.829) 19.669 18.529 ( 3.384 10.217 5.819) 12.235 19.388 ( -5.926 -11.212 -15.958) 20.383 22.509 ( 4.090 -1.421 0.411) 4.349 ======================= Grid point 277 (127/336) ======================= q-point: (-0.55 0.18 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.469 ( 3.435 7.570 -10.509) 13.399 2.552 ( -17.874 8.863 -0.296) 19.953 2.772 ( -6.683 6.742 10.888) 14.446 3.279 ( -3.914 -3.080 2.451) 5.551 4.036 ( -2.984 1.012 -5.284) 6.152 4.366 ( 3.849 -7.129 -7.444) 11.002 4.594 ( 4.444 -9.173 -3.838) 10.891 5.308 ( -5.976 -5.647 -0.167) 8.224 5.693 ( 1.683 9.166 -3.622) 9.998 5.775 ( 4.288 1.781 -4.030) 6.148 5.957 ( -1.048 -2.314 0.086) 2.542 6.345 ( -2.140 2.171 0.581) 3.103 6.555 ( 3.251 1.817 -14.288) 14.765 6.976 ( 2.319 -8.260 9.555) 12.841 7.286 ( 2.750 6.914 -4.993) 8.961 7.704 ( 1.834 -3.334 -2.099) 4.346 7.981 ( -5.888 0.098 0.620) 5.921 8.184 ( 1.585 -3.040 -5.102) 6.147 8.311 ( 0.747 2.741 -6.160) 6.784 8.513 ( 1.713 3.597 6.149) 7.327 8.844 ( -4.046 -3.590 -6.244) 8.261 9.421 ( 1.257 -1.982 8.193) 8.523 9.930 ( 3.039 1.995 -3.264) 4.886 10.426 ( -3.480 1.850 5.871) 7.071 11.581 ( -6.699 2.712 8.912) 11.474 11.918 ( -4.583 6.881 -3.646) 9.035 12.633 ( 0.770 -14.248 -0.591) 14.281 13.766 ( 1.104 2.228 1.857) 3.103 13.857 ( 6.845 0.836 -2.307) 7.272 14.068 ( -0.425 -1.662 1.239) 2.116 16.332 ( 1.098 -2.357 -0.764) 2.710 16.801 ( 2.093 -6.052 -1.796) 6.651 18.127 ( -20.673 7.790 11.728) 25.013 18.449 ( 3.324 19.488 -1.201) 19.806 19.500 ( 8.354 -16.787 -6.842) 19.960 22.585 ( 2.706 -1.465 1.345) 3.358 ======================= Grid point 278 (128/336) ======================= q-point: (-0.45 0.18 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.393 ( 3.843 9.981 -7.822) 13.251 2.141 ( -18.019 14.020 3.645) 23.120 2.656 ( -9.768 4.303 12.195) 16.206 3.218 ( -6.859 4.969 4.224) 9.465 3.999 ( 2.720 -0.191 -4.424) 5.197 4.491 ( 5.526 -9.259 -3.486) 11.332 4.715 ( 3.360 -9.717 -5.367) 11.598 5.305 ( -1.774 -8.045 -1.741) 8.420 5.582 ( 0.196 13.108 -4.878) 13.988 5.855 ( 6.825 -4.843 -1.602) 8.521 6.020 ( 3.411 -4.144 0.803) 5.427 6.302 ( 0.011 0.469 -2.506) 2.550 6.538 ( 4.965 0.131 -8.503) 9.848 7.107 ( -2.911 -5.973 4.757) 8.172 7.246 ( 3.703 4.275 -1.168) 5.776 7.747 ( 2.732 -0.921 -3.962) 4.900 7.875 ( -8.335 -2.818 1.028) 8.858 8.201 ( 3.920 5.062 -4.843) 8.028 8.216 ( -4.279 -1.509 -6.267) 7.737 8.562 ( 3.476 0.853 3.391) 4.931 8.809 ( -2.430 -1.585 -0.231) 2.910 9.511 ( 0.169 -2.801 8.495) 8.947 9.932 ( 3.948 3.365 -5.451) 7.525 10.361 ( -5.782 2.157 4.118) 7.419 11.526 ( -4.675 0.968 9.805) 10.906 11.728 ( -7.118 6.426 -3.863) 10.338 12.787 ( 3.186 -11.121 -0.032) 11.569 13.776 ( 0.160 0.191 0.630) 0.677 13.947 ( 6.339 0.711 -1.316) 6.514 14.086 ( 0.755 0.153 0.776) 1.093 16.342 ( -0.450 0.174 0.354) 0.599 16.891 ( 1.659 -6.469 -0.507) 6.697 17.775 ( -15.883 10.209 2.694) 19.072 18.285 ( -4.113 15.215 3.487) 16.142 19.784 ( 11.505 -14.890 -5.617) 19.637 22.630 ( 0.169 -1.133 1.549) 1.927 ======================= Grid point 279 (129/336) ======================= q-point: (-0.36 0.18 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.294 ( 3.253 14.738 -4.451) 15.736 1.852 ( -8.408 13.864 19.661) 25.485 2.522 ( -11.964 2.492 10.678) 16.228 2.991 ( -12.344 17.038 5.992) 21.876 4.073 ( 6.855 -1.709 -0.336) 7.073 4.660 ( 5.974 -8.671 0.511) 10.542 4.833 ( 4.418 -10.798 -7.168) 13.693 5.367 ( 1.194 -8.633 -3.850) 9.528 5.408 ( -2.070 11.775 -7.402) 14.062 5.997 ( 1.766 -3.359 1.045) 3.936 6.152 ( 9.446 -6.961 -2.007) 11.904 6.323 ( 3.249 -3.277 -3.281) 5.662 6.630 ( 6.722 -6.049 -1.636) 9.190 7.025 ( -7.115 0.638 -3.868) 8.124 7.326 ( 4.567 -0.307 2.412) 5.173 7.746 ( -0.062 1.962 -1.188) 2.295 7.816 ( -4.804 -6.389 -0.472) 8.008 8.106 ( -0.930 5.162 -1.616) 5.488 8.216 ( 1.597 -1.755 -6.139) 6.582 8.638 ( 3.734 0.164 2.660) 4.588 8.769 ( -3.875 0.142 2.657) 4.700 9.564 ( -2.409 -1.768 7.567) 8.136 9.944 ( 5.999 3.248 -5.944) 9.048 10.252 ( -7.675 2.497 2.350) 8.406 11.536 ( -2.149 -0.857 11.048) 11.288 11.552 ( -3.930 7.033 -2.505) 8.437 12.932 ( 4.267 -7.497 -1.035) 8.688 13.761 ( -2.748 -1.113 -0.631) 3.031 14.026 ( 4.793 0.518 -0.607) 4.859 14.093 ( 0.942 1.451 -0.717) 1.873 16.339 ( 0.654 1.264 1.985) 2.443 16.937 ( -1.574 -3.100 -0.673) 3.542 17.501 ( -6.940 10.607 0.513) 12.686 18.086 ( -6.281 13.280 3.480) 15.097 20.051 ( 8.356 -14.911 -6.117) 18.155 22.630 ( -2.227 -0.808 1.220) 2.664 ======================= Grid point 280 (130/336) ======================= q-point: (-0.27 0.18 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.244 ( 12.250 18.348 5.357) 22.703 1.834 ( -0.559 11.103 30.905) 32.844 2.342 ( -15.823 2.135 9.073) 18.364 2.602 ( -13.668 27.804 8.932) 32.244 4.229 ( 8.133 -2.821 3.436) 9.269 4.848 ( 6.794 -5.753 3.296) 9.493 4.949 ( 3.754 -7.956 -11.292) 14.314 5.231 ( -1.083 5.552 -7.056) 9.043 5.456 ( 1.710 -9.658 -4.414) 10.756 5.989 ( -3.226 -0.477 -0.927) 3.390 6.334 ( 6.371 -3.205 -3.662) 8.017 6.468 ( 7.243 -9.752 1.336) 12.221 6.770 ( -2.868 -9.399 -1.717) 9.976 6.932 ( 3.305 -1.491 -1.633) 3.977 7.378 ( 2.003 1.562 -2.110) 3.302 7.716 ( -3.307 -1.120 1.764) 3.912 7.801 ( -2.817 -4.936 -2.940) 6.398 8.094 ( 3.643 1.612 2.415) 4.658 8.215 ( 1.931 -0.154 -6.080) 6.381 8.641 ( -5.166 0.522 2.027) 5.574 8.800 ( 5.280 0.076 7.491) 9.165 9.570 ( -1.931 0.290 5.554) 5.887 9.980 ( 4.395 1.509 -5.119) 6.914 10.095 ( -8.751 3.333 -0.462) 9.376 11.452 ( 0.939 7.082 -0.548) 7.165 11.592 ( 0.406 1.281 10.144) 10.233 13.044 ( 3.891 -4.662 -3.594) 7.056 13.707 ( -4.563 -1.746 -0.563) 4.918 14.052 ( 1.319 5.121 -2.334) 5.780 14.107 ( 0.709 -4.217 0.942) 4.378 16.375 ( 3.279 1.135 3.646) 5.033 16.900 ( -3.134 1.358 -0.536) 3.457 17.353 ( 1.798 11.756 -1.009) 11.935 17.886 ( -3.936 14.267 -0.135) 14.800 20.245 ( 0.749 -17.508 -4.482) 18.088 22.595 ( -3.548 -0.579 0.735) 3.669 ======================= Grid point 281 (131/336) ======================= q-point: (-0.18 0.18 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.435 ( 23.330 15.152 12.298) 30.416 1.895 ( -2.046 18.973 23.746) 30.464 2.056 ( -19.220 7.306 12.857) 24.250 2.294 ( -1.412 20.103 19.168) 27.812 4.405 ( 6.325 -3.226 4.664) 8.495 4.814 ( -1.297 8.319 -15.737) 17.848 5.090 ( 7.359 -5.789 6.433) 11.360 5.261 ( 3.287 -10.509 -5.290) 12.216 5.545 ( 0.970 -10.073 -3.997) 10.880 5.913 ( -4.365 0.367 -3.052) 5.338 6.408 ( 0.580 -0.223 -0.973) 1.155 6.574 ( -1.149 -2.088 2.067) 3.154 6.813 ( 2.574 -11.471 -3.084) 12.154 7.079 ( 2.097 -10.777 1.375) 11.065 7.349 ( 1.386 3.836 -4.323) 5.943 7.663 ( -6.060 -1.609 0.781) 6.318 7.771 ( -3.561 -1.632 -1.795) 4.308 8.170 ( 1.366 -3.826 -8.364) 9.299 8.266 ( 8.153 -0.860 3.221) 8.808 8.590 ( -1.352 -0.618 7.818) 7.958 8.961 ( 7.436 0.102 8.254) 11.110 9.581 ( 0.892 1.406 3.713) 4.069 9.870 ( -10.591 2.021 -4.887) 11.838 10.013 ( 2.044 2.950 -3.433) 4.967 11.433 ( 4.007 6.896 1.052) 8.045 11.605 ( 0.574 8.579 4.060) 9.508 13.089 ( 0.324 -4.381 -7.217) 8.449 13.665 ( -2.818 -2.088 1.374) 3.767 13.983 ( -1.816 4.286 -2.203) 5.150 14.184 ( 0.311 -7.065 4.084) 8.166 16.464 ( 4.581 0.297 5.183) 6.924 16.794 ( -5.044 5.194 -2.026) 7.518 17.360 ( 11.942 10.400 -0.973) 15.866 17.684 ( 2.419 19.088 -7.350) 20.597 20.350 ( -8.380 -20.679 1.134) 22.341 22.545 ( -3.296 -0.383 0.325) 3.335 ======================= Grid point 282 (132/336) ======================= q-point: (-0.09 0.18 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.647 ( -4.123 23.617 11.440) 26.564 1.784 ( 18.335 5.823 11.150) 22.235 1.921 ( 0.508 12.717 16.644) 20.952 2.414 ( 10.063 8.341 30.829) 33.485 4.466 ( -1.239 3.226 -7.202) 7.989 4.695 ( 4.489 2.455 -3.054) 5.959 5.249 ( 0.058 -3.268 4.994) 5.969 5.397 ( 4.751 -12.523 -5.518) 14.486 5.630 ( -0.567 -10.504 -1.294) 10.598 5.822 ( -2.232 1.510 -5.395) 6.031 6.303 ( -7.316 5.989 2.004) 9.665 6.652 ( 2.797 -5.413 2.192) 6.476 6.929 ( 0.008 -10.021 -3.383) 10.576 7.149 ( -2.255 -5.294 -2.422) 6.243 7.347 ( 1.285 -1.932 1.354) 2.687 7.570 ( -7.099 -0.652 -1.397) 7.265 7.704 ( -1.866 3.356 1.683) 4.193 8.150 ( 0.268 -3.025 -10.572) 10.999 8.368 ( -0.466 -3.334 2.937) 4.467 8.779 ( 10.540 -6.176 6.993) 14.076 9.102 ( 5.149 2.277 8.274) 10.008 9.582 ( -1.820 1.675 -4.353) 5.007 9.690 ( -3.757 1.876 2.002) 4.652 9.976 ( -0.552 3.146 -3.554) 4.778 11.405 ( -0.623 9.596 -0.699) 9.642 11.548 ( 6.344 11.635 1.089) 13.297 13.053 ( -4.032 -4.671 -8.225) 10.283 13.669 ( -0.684 -1.772 2.119) 2.846 13.908 ( -1.997 2.108 -1.827) 3.431 14.286 ( -1.484 -8.487 6.394) 10.729 16.483 ( -5.818 4.625 1.592) 7.601 16.740 ( 9.523 3.460 -0.227) 10.134 17.282 ( -5.893 13.554 -4.889) 15.567 17.739 ( 26.703 11.535 -6.582) 29.823 20.391 ( -12.513 -19.956 5.669) 24.227 22.503 ( -2.429 -0.196 -0.389) 2.468 ======================= Grid point 286 (133/336) ======================= q-point: ( 0.27 0.27 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.619 ( 1.247 -0.000 -10.420) 10.494 2.773 ( -7.836 0.000 15.155) 17.061 2.880 ( 9.105 -0.000 5.538) 10.657 3.325 ( -11.421 0.000 -5.429) 12.646 4.163 ( -9.295 0.000 1.506) 9.417 4.351 ( 4.363 -0.000 -1.895) 4.757 4.372 ( -1.682 0.000 -18.227) 18.305 5.351 ( -10.525 0.000 1.868) 10.689 5.770 ( 5.599 -0.000 -4.168) 6.980 5.874 ( -6.675 0.000 -5.743) 8.806 6.009 ( -1.644 0.000 -1.577) 2.278 6.453 ( -0.067 0.000 2.267) 2.268 6.590 ( 3.205 -0.000 0.964) 3.347 6.716 ( 0.266 -0.000 -6.543) 6.548 7.430 ( 10.017 -0.000 -10.999) 14.877 7.622 ( -6.692 0.000 2.978) 7.325 8.063 ( -4.671 0.000 5.972) 7.582 8.102 ( 4.479 -0.000 -10.180) 11.122 8.298 ( 3.913 -0.000 -1.304) 4.125 8.521 ( 4.165 -0.000 9.679) 10.537 8.945 ( -9.745 0.000 -13.861) 16.944 9.352 ( -1.194 0.000 6.531) 6.639 9.912 ( 4.099 -0.000 -1.456) 4.350 10.440 ( 0.186 -0.000 8.125) 8.127 11.705 ( -9.461 0.000 11.540) 14.922 12.043 ( 13.307 -0.000 0.889) 13.337 12.405 ( -9.276 0.000 -6.987) 11.612 13.789 ( 5.089 -0.000 -4.031) 6.492 13.807 ( -0.678 0.000 3.491) 3.556 14.038 ( -1.768 0.000 -0.233) 1.783 16.223 ( 5.102 -0.000 -0.601) 5.137 16.715 ( 0.078 -0.000 -3.881) 3.882 18.433 ( -16.544 0.000 22.467) 27.901 18.646 ( 26.623 -0.000 2.248) 26.717 19.262 ( -16.241 0.000 -18.619) 24.707 22.495 ( 4.310 -0.000 0.319) 4.322 ======================= Grid point 287 (134/336) ======================= q-point: (-0.64 0.27 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.583 ( 4.472 3.629 -10.336) 11.832 2.645 ( -15.388 1.999 5.916) 16.607 2.952 ( -0.967 10.321 3.783) 11.035 3.170 ( -6.358 -7.773 2.307) 10.304 4.063 ( -4.078 1.209 1.350) 4.462 4.279 ( 3.080 -1.677 -14.032) 14.464 4.437 ( 4.125 -6.070 -4.679) 8.703 5.216 ( -9.507 -3.060 2.383) 10.268 5.757 ( -1.186 1.604 -4.195) 4.646 5.840 ( 5.988 -0.261 -4.510) 7.500 5.931 ( -3.025 1.177 -7.189) 7.888 6.460 ( 1.154 6.653 6.930) 9.676 6.605 ( 3.403 5.039 -11.166) 12.714 6.783 ( 1.762 -11.563 5.464) 12.910 7.439 ( 0.680 8.797 -3.626) 9.540 7.597 ( 0.699 -7.602 -3.415) 8.363 8.004 ( -5.337 1.796 3.196) 6.475 8.111 ( 1.632 -3.278 -8.912) 9.635 8.362 ( 5.178 1.561 -2.199) 5.839 8.601 ( 0.362 4.984 7.080) 8.666 8.755 ( -5.221 -4.971 -8.727) 11.319 9.397 ( 0.485 -0.634 8.154) 8.193 9.957 ( 3.799 0.785 -3.148) 4.996 10.448 ( -3.729 0.574 5.790) 6.910 11.609 ( -9.733 0.506 10.097) 14.033 12.100 ( -2.496 11.977 -4.038) 12.883 12.362 ( 3.445 -14.214 -1.623) 14.715 13.801 ( -1.139 1.508 2.799) 3.377 13.858 ( 5.328 -0.668 -2.752) 6.034 14.051 ( 2.330 -0.302 0.899) 2.515 16.308 ( 4.415 -0.439 1.029) 4.554 16.715 ( 0.851 -2.630 -1.993) 3.408 18.227 ( -20.606 2.775 13.499) 24.790 18.805 ( -1.941 17.881 -5.934) 18.940 19.180 ( 12.277 -16.874 -4.864) 21.427 22.566 ( 3.208 -0.523 1.385) 3.533 ======================= Grid point 288 (135/336) ======================= q-point: (-0.55 0.27 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.568 ( 6.928 7.427 -8.568) 13.288 2.354 ( -16.144 8.069 4.069) 18.501 2.796 ( -8.398 10.124 9.195) 16.049 3.213 ( -1.521 -4.964 2.855) 5.925 4.019 ( 0.996 2.340 -0.886) 2.694 4.336 ( 5.903 -6.709 -6.157) 10.852 4.532 ( 2.938 -8.877 -5.845) 11.027 5.143 ( -6.757 -7.543 1.031) 10.180 5.759 ( 3.961 2.412 -3.551) 5.841 5.816 ( 0.715 2.779 -9.588) 10.009 5.935 ( 4.437 -3.605 -0.098) 5.718 6.430 ( 0.417 11.304 6.344) 12.969 6.553 ( 3.957 1.184 -13.176) 13.808 6.950 ( -0.403 -10.593 6.620) 12.498 7.331 ( -2.853 4.546 -0.229) 5.371 7.671 ( 3.318 -5.316 -5.723) 8.487 7.898 ( -5.360 3.487 -0.150) 6.396 8.102 ( -1.716 -5.488 -7.509) 9.458 8.363 ( 2.252 6.859 -4.452) 8.482 8.584 ( 1.522 1.465 2.453) 3.237 8.750 ( -1.888 -4.170 1.640) 4.862 9.466 ( 0.018 -1.791 8.615) 8.799 9.982 ( 3.970 1.911 -4.772) 6.494 10.391 ( -6.064 1.007 4.324) 7.516 11.524 ( -7.897 -0.595 9.726) 12.543 11.888 ( -6.404 9.177 -2.896) 11.559 12.578 ( 8.137 -10.443 -1.130) 13.287 13.781 ( -2.180 0.452 2.110) 3.068 13.932 ( 4.165 -1.652 -2.292) 5.033 14.109 ( 4.431 1.588 0.807) 4.776 16.367 ( 2.456 2.126 2.457) 4.072 16.770 ( 1.557 -5.762 0.154) 5.970 17.925 ( -16.810 5.588 3.559) 18.069 18.545 ( -9.509 11.776 1.654) 15.227 19.530 ( 15.918 -11.463 -6.028) 20.522 22.614 ( 0.695 -0.596 1.723) 1.951 ======================= Grid point 289 (136/336) ======================= q-point: (-0.45 0.27 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.552 ( 7.412 11.635 -5.033) 14.685 2.107 ( -7.722 12.393 14.435) 20.532 2.622 ( -10.422 7.961 10.884) 17.043 3.195 ( -3.743 4.542 2.272) 6.309 4.055 ( 4.689 -0.040 1.410) 4.897 4.496 ( 7.362 -8.182 -0.254) 11.009 4.631 ( 2.954 -10.247 -5.945) 12.210 5.150 ( -4.133 -11.970 -1.137) 12.715 5.630 ( -1.604 10.601 -10.664) 15.122 5.927 ( 9.242 -4.911 -0.553) 10.481 6.042 ( 4.078 -3.986 -0.009) 5.703 6.366 ( 2.361 7.424 -2.961) 8.334 6.552 ( 1.710 -2.308 -4.333) 5.199 6.993 ( -5.271 -4.279 -0.159) 6.791 7.308 ( 0.468 -1.050 3.847) 4.015 7.718 ( 0.132 -4.211 -4.083) 5.867 7.799 ( -0.920 3.479 -2.452) 4.355 8.070 ( -3.106 -5.101 -5.468) 8.097 8.302 ( 2.158 6.964 -3.513) 8.093 8.638 ( 2.977 -0.408 1.809) 3.507 8.753 ( -3.061 -1.444 4.558) 5.677 9.525 ( -1.566 -2.186 8.247) 8.674 9.997 ( 4.469 2.274 -5.867) 7.718 10.290 ( -7.729 1.555 2.872) 8.390 11.497 ( -3.863 -1.685 9.662) 10.542 11.720 ( -2.887 8.764 0.968) 9.278 12.787 ( 8.324 -7.540 -1.704) 11.360 13.741 ( -4.386 -0.834 1.045) 4.585 13.991 ( 2.412 -2.512 -2.116) 4.075 14.156 ( 3.851 3.430 -0.845) 5.226 16.390 ( 2.026 3.920 4.159) 6.064 16.850 ( 0.356 -5.703 1.388) 5.881 17.673 ( -7.548 7.451 0.199) 10.608 18.304 ( -10.498 9.802 5.172) 15.266 19.806 ( 10.793 -10.967 -9.140) 17.897 22.618 ( -1.861 -0.470 1.386) 2.367 ======================= Grid point 290 (137/336) ======================= q-point: (-0.36 0.27 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.559 ( 11.070 14.253 2.284) 18.191 2.062 ( 0.957 12.730 24.403) 27.540 2.436 ( -11.914 7.781 10.791) 17.859 3.027 ( -6.457 16.564 3.247) 18.073 4.178 ( 6.114 -2.772 4.632) 8.156 4.713 ( 8.570 -7.884 3.077) 12.044 4.750 ( 4.255 -10.682 -5.533) 12.760 5.205 ( -3.423 -14.672 -3.512) 15.471 5.420 ( -2.928 11.525 -10.378) 15.783 6.036 ( 1.396 3.704 0.779) 4.034 6.208 ( 9.904 -10.308 -3.943) 14.829 6.364 ( 4.649 0.218 -2.287) 5.186 6.584 ( -2.838 -8.898 -1.638) 9.482 6.928 ( -2.917 -0.216 -1.158) 3.146 7.356 ( 0.258 -2.978 1.092) 3.182 7.691 ( -5.769 -2.297 1.641) 6.423 7.774 ( 3.722 1.610 -9.093) 9.956 8.064 ( 0.827 -3.597 -2.142) 4.267 8.267 ( 2.146 4.344 -1.844) 5.185 8.651 ( -2.980 0.581 1.025) 3.204 8.796 ( 3.645 -0.384 9.028) 9.743 9.559 ( -1.691 -1.349 7.028) 7.353 10.005 ( 2.295 1.228 -6.525) 7.025 10.153 ( -7.539 2.488 0.413) 7.950 11.536 ( 1.586 1.199 5.210) 5.576 11.659 ( 0.864 6.375 9.210) 11.234 12.954 ( 6.452 -4.787 -3.141) 8.626 13.672 ( -5.914 -1.841 0.396) 6.207 14.032 ( 0.833 -3.445 -1.741) 3.949 14.146 ( 0.701 4.379 -2.874) 5.285 16.425 ( 3.396 4.038 6.123) 8.083 16.890 ( -1.249 -2.261 1.304) 2.894 17.551 ( 2.091 9.271 -0.565) 9.521 18.099 ( -7.647 8.705 4.975) 12.609 19.963 ( 2.482 -12.510 -10.554) 16.554 22.586 ( -3.271 -0.364 0.778) 3.382 ======================= Grid point 291 (138/336) ======================= q-point: (-0.27 0.27 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.684 ( 14.395 10.567 7.212) 19.258 2.148 ( 2.967 12.134 27.270) 29.995 2.228 ( -10.280 11.366 11.046) 18.891 2.768 ( -3.000 24.635 7.091) 25.810 4.336 ( 4.701 -4.378 6.274) 8.980 4.845 ( 3.665 -7.090 -12.740) 15.033 4.973 ( 9.307 -5.823 8.596) 13.943 5.176 ( -5.302 0.124 -7.189) 8.933 5.315 ( -0.745 -9.466 -4.125) 10.353 5.980 ( -1.236 5.318 -2.819) 6.145 6.378 ( 4.977 -3.739 -2.972) 6.898 6.477 ( 1.231 -7.444 0.946) 7.605 6.609 ( -0.855 -10.097 -2.300) 10.391 6.921 ( -1.044 -4.474 1.935) 4.985 7.377 ( 0.400 -1.317 -3.030) 3.328 7.617 ( -6.657 -3.029 0.113) 7.315 7.763 ( 3.465 1.105 -8.513) 9.257 8.108 ( 1.819 -2.773 -4.875) 5.896 8.274 ( 2.102 1.219 1.418) 2.813 8.613 ( -0.325 2.672 7.262) 7.745 8.951 ( 6.815 -0.989 9.575) 11.794 9.593 ( 0.396 -0.334 5.713) 5.736 9.901 ( -8.454 1.724 -6.225) 10.640 10.066 ( 0.325 2.257 -3.396) 4.091 11.564 ( 4.427 6.549 1.301) 8.011 11.723 ( 2.981 4.631 12.840) 13.971 13.020 ( 0.331 -2.977 -6.480) 7.139 13.618 ( -3.345 -2.714 1.426) 4.538 14.066 ( -1.944 1.182 -2.601) 3.456 14.072 ( -0.515 -1.924 -0.908) 2.189 16.498 ( 4.387 3.367 8.109) 9.816 16.859 ( -2.954 1.933 -0.859) 3.634 17.560 ( 10.546 10.618 -0.585) 14.977 17.956 ( -1.649 9.833 0.667) 9.992 20.003 ( -6.498 -15.899 -7.415) 18.708 22.539 ( -3.079 -0.288 0.268) 3.104 ======================= Grid point 292 (139/336) ======================= q-point: (-0.18 0.27 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.803 ( -1.367 1.649 2.063) 2.974 2.077 ( 3.526 19.177 15.292) 24.780 2.223 ( 4.180 15.516 20.893) 26.358 2.680 ( 11.229 19.324 16.876) 28.006 4.458 ( 0.369 -3.839 3.580) 5.262 4.787 ( 1.125 5.136 -13.445) 14.436 5.132 ( -3.955 -9.603 -1.437) 10.484 5.207 ( 7.588 -5.496 3.407) 9.970 5.402 ( 0.510 -12.248 -0.944) 12.295 5.884 ( -1.714 4.409 -4.614) 6.608 6.390 ( -3.601 2.580 1.764) 4.769 6.527 ( -1.074 -8.058 -0.227) 8.132 6.718 ( 0.800 -11.158 -4.703) 12.135 7.002 ( 1.517 -7.873 4.976) 9.437 7.356 ( -0.072 0.982 -4.980) 5.077 7.540 ( -5.778 -2.686 -0.750) 6.416 7.755 ( 1.789 1.979 -5.546) 6.154 8.103 ( 0.478 -1.954 -8.366) 8.604 8.301 ( -0.812 -3.140 1.785) 3.702 8.730 ( 8.265 0.583 10.819) 13.628 9.120 ( 5.978 -0.138 9.139) 10.921 9.636 ( 0.874 2.843 -0.290) 2.988 9.704 ( -7.877 0.248 -0.822) 7.924 10.026 ( -0.023 2.138 -4.928) 5.372 11.570 ( 3.105 8.381 1.532) 9.068 11.766 ( 3.034 10.125 7.655) 13.051 12.964 ( -4.150 -4.302 -8.718) 10.571 13.628 ( -0.512 -2.373 2.010) 3.152 13.963 ( -3.335 3.480 -2.366) 5.370 14.135 ( -0.113 -7.321 2.717) 7.810 16.556 ( -1.448 4.021 7.076) 8.266 16.809 ( 4.643 3.333 -2.070) 6.079 17.557 ( -0.089 14.910 -3.155) 15.241 17.943 ( 15.097 9.019 -2.550) 17.770 20.003 ( -10.253 -20.210 -0.881) 22.679 22.500 ( -2.058 -0.109 -0.255) 2.076 ======================= Grid point 293 (140/336) ======================= q-point: (-0.09 0.27 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.697 ( -3.864 2.973 -1.631) 5.141 2.096 ( 7.090 16.344 13.490) 22.346 2.333 ( 8.185 10.905 21.375) 25.354 2.917 ( 20.374 11.161 16.813) 28.676 4.418 ( -2.840 3.084 -7.038) 8.193 4.749 ( 2.113 -1.135 -2.637) 3.565 5.095 ( -10.960 -7.404 -0.699) 13.244 5.379 ( 6.824 -8.986 -5.401) 12.509 5.526 ( -0.129 -7.984 5.327) 9.599 5.800 ( -1.096 2.099 -5.050) 5.578 6.304 ( -2.765 7.017 4.237) 8.650 6.564 ( -5.103 -10.204 -0.782) 11.436 6.766 ( -2.486 -10.352 -6.287) 12.364 7.124 ( 2.285 -1.127 0.284) 2.564 7.339 ( 1.186 -4.578 1.697) 5.024 7.466 ( -3.859 1.566 -4.958) 6.475 7.728 ( 0.415 0.893 1.478) 1.776 8.073 ( 0.753 -1.566 -9.308) 9.469 8.345 ( 0.055 -3.376 2.752) 4.356 8.857 ( -0.383 -0.059 -0.764) 0.856 9.273 ( 7.124 1.113 9.764) 12.138 9.508 ( -4.608 0.995 -1.919) 5.090 9.724 ( 1.368 0.487 5.315) 5.510 9.974 ( 0.378 2.525 -3.828) 4.601 11.504 ( 0.906 11.147 -0.613) 11.201 11.770 ( 4.793 10.271 7.452) 13.565 12.892 ( -3.180 -4.408 -9.193) 10.679 13.653 ( -0.642 -2.366 1.886) 3.093 13.874 ( -2.811 1.847 -2.343) 4.099 14.218 ( -1.502 -7.203 4.134) 8.439 16.459 ( -3.942 7.562 -0.541) 8.545 16.948 ( 11.958 -0.286 2.830) 12.292 17.299 ( -4.906 17.182 -7.631) 19.429 18.155 ( 16.365 5.822 3.336) 17.687 20.047 ( -8.571 -20.511 -0.015) 22.230 22.468 ( -1.342 0.448 -1.018) 1.743 ======================= Grid point 298 (141/336) ======================= q-point: (-0.64 0.36 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.641 ( 7.136 -0.000 -7.970) 10.698 2.430 ( -14.760 0.000 4.786) 15.516 2.955 ( -11.949 0.000 7.841) 14.292 3.104 ( 4.124 -0.000 1.289) 4.320 4.055 ( -0.631 0.000 3.589) 3.644 4.266 ( 6.529 -0.000 -10.310) 12.204 4.436 ( 3.438 -0.000 -5.892) 6.822 5.067 ( -8.375 0.000 1.948) 8.598 5.759 ( 3.771 -0.000 -3.302) 5.012 5.847 ( -0.973 0.000 -6.297) 6.371 5.918 ( 6.302 -0.000 -6.663) 9.171 6.547 ( 3.095 -0.000 -3.532) 4.696 6.646 ( -2.516 0.000 1.014) 2.713 6.765 ( 3.484 -0.000 4.444) 5.647 7.387 ( -8.520 0.000 1.631) 8.674 7.607 ( 6.999 -0.000 -7.280) 10.099 7.952 ( -5.459 0.000 3.556) 6.515 8.031 ( -0.773 0.000 -12.028) 12.053 8.436 ( 3.376 -0.000 -2.676) 4.308 8.609 ( -0.672 0.000 -6.503) 6.537 8.692 ( -0.894 0.000 9.185) 9.228 9.449 ( -0.161 0.000 8.560) 8.561 10.000 ( 3.928 -0.000 -4.557) 6.017 10.400 ( -6.181 0.000 4.508) 7.650 11.517 ( -8.488 0.000 9.388) 12.656 11.998 ( -10.242 0.000 -1.205) 10.313 12.457 ( 13.506 -0.000 -2.517) 13.738 13.788 ( -3.569 0.000 3.289) 4.853 13.912 ( 4.298 -0.000 -3.333) 5.439 14.126 ( 5.318 -0.000 0.856) 5.387 16.395 ( 4.131 -0.000 3.694) 5.542 16.708 ( 0.871 -0.000 -0.125) 0.880 17.978 ( -17.048 0.000 3.842) 17.475 18.671 ( -14.762 0.000 1.338) 14.823 19.407 ( 20.730 -0.000 -6.482) 21.720 22.608 ( 0.892 -0.000 1.796) 2.005 ======================= Grid point 300 (142/336) ======================= q-point: (-0.55 0.36 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.702 ( 6.838 4.053 -3.180) 8.562 2.279 ( -6.339 5.121 11.950) 14.464 2.783 ( -10.330 7.082 8.778) 15.294 3.190 ( 2.630 -2.956 -0.012) 3.956 4.071 ( 1.007 1.187 3.744) 4.055 4.378 ( 9.416 -3.699 -1.783) 10.273 4.480 ( 3.553 -4.904 -5.623) 8.264 4.981 ( -6.283 -5.046 0.520) 8.075 5.773 ( 0.565 4.172 -12.000) 12.717 5.846 ( 7.864 -2.776 -2.397) 8.677 5.999 ( 5.367 -0.913 0.197) 5.447 6.518 ( 0.942 1.908 -13.947) 14.109 6.556 ( -4.737 6.811 6.766) 10.705 6.875 ( -0.316 -6.976 2.802) 7.525 7.296 ( -3.544 -0.237 3.533) 5.009 7.660 ( 2.355 -1.755 -4.676) 5.521 7.867 ( -2.133 3.471 -2.203) 4.632 7.977 ( -0.900 -4.164 -7.629) 8.738 8.411 ( -0.634 3.855 -3.861) 5.493 8.617 ( 2.872 -1.476 -1.541) 3.578 8.733 ( -1.152 -0.469 8.743) 8.831 9.493 ( -1.317 -1.025 8.274) 8.441 10.026 ( 3.522 0.791 -5.648) 6.703 10.309 ( -7.825 0.494 3.379) 8.538 11.477 ( -3.396 -0.537 9.626) 10.222 11.849 ( -5.945 4.114 3.143) 7.883 12.675 ( 12.730 -3.651 -3.233) 13.632 13.732 ( -5.637 -0.214 2.403) 6.132 13.954 ( 2.816 -1.118 -3.421) 4.570 14.201 ( 4.101 1.280 -0.678) 4.349 16.468 ( 3.155 3.415 6.069) 7.645 16.748 ( 0.995 -4.135 1.820) 4.626 17.769 ( -7.820 2.669 -0.188) 8.265 18.438 ( -14.706 3.985 6.906) 16.728 19.657 ( 13.883 -4.384 -11.532) 18.573 22.613 ( -1.656 -0.147 1.500) 2.239 ======================= Grid point 301 (143/336) ======================= q-point: (-0.45 0.36 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.756 ( 6.526 6.719 3.676) 10.062 2.279 ( 2.214 9.420 19.373) 21.655 2.609 ( -8.212 9.361 8.786) 15.240 3.211 ( 0.059 3.722 -0.582) 3.767 4.128 ( 2.289 -2.237 5.215) 6.119 4.562 ( 4.758 -7.015 -4.650) 9.668 4.605 ( 10.693 -4.933 5.047) 12.812 4.960 ( -4.963 -10.146 -1.662) 11.416 5.628 ( -1.474 9.777 -11.990) 15.541 6.026 ( 9.548 -7.891 -3.534) 12.881 6.085 ( 3.522 0.939 2.235) 4.276 6.423 ( 0.782 4.204 -6.776) 8.012 6.466 ( -6.129 -3.014 -1.150) 6.926 6.904 ( -1.725 -2.268 0.658) 2.924 7.299 ( -0.797 -2.545 0.855) 2.801 7.641 ( -5.184 -2.483 -0.786) 5.801 7.821 ( 3.268 2.706 -7.863) 8.935 7.993 ( 2.797 -3.492 -3.381) 5.608 8.341 ( -1.004 3.069 -2.188) 3.900 8.663 ( 1.347 0.681 1.522) 2.144 8.788 ( 1.750 -0.464 9.653) 9.822 9.529 ( -1.384 -1.555 7.349) 7.639 10.026 ( 1.651 0.910 -6.698) 6.958 10.184 ( -8.000 0.925 0.863) 8.100 11.540 ( 3.382 -0.073 9.431) 10.019 11.776 ( -1.986 5.097 8.238) 9.889 12.874 ( 9.790 -3.398 -3.518) 10.943 13.644 ( -7.053 -1.032 1.411) 7.266 13.980 ( 1.174 -2.005 -3.549) 4.241 14.211 ( 0.430 2.442 -2.872) 3.794 16.517 ( 3.320 5.365 8.085) 10.256 16.823 ( 0.877 -4.449 2.989) 5.431 17.688 ( 2.598 5.096 -0.926) 5.795 18.221 ( -12.818 4.432 8.871) 16.207 19.781 ( 5.062 -6.761 -15.327) 17.500 22.581 ( -3.112 -0.149 0.829) 3.224 ======================= Grid point 302 (144/336) ======================= q-point: (-0.36 0.36 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.826 ( 3.924 4.994 7.067) 9.502 2.378 ( 5.391 11.721 22.796) 26.193 2.468 ( -2.178 13.041 9.389) 16.217 3.120 ( -1.212 12.349 1.150) 12.462 4.237 ( 1.608 -5.894 6.287) 8.766 4.674 ( 4.467 -8.740 -6.780) 11.929 4.881 ( 11.562 -3.875 9.544) 15.485 4.982 ( -4.281 -13.172 -3.407) 14.263 5.417 ( -3.059 11.425 -9.727) 15.314 6.068 ( -1.951 2.372 -2.779) 4.142 6.239 ( 6.926 -8.067 -1.856) 10.793 6.378 ( -3.162 -4.769 -4.691) 7.399 6.468 ( 3.461 -3.039 1.488) 4.840 6.891 ( -1.648 -0.037 1.915) 2.527 7.318 ( 0.949 -3.959 -4.151) 5.814 7.552 ( -8.056 -3.789 -0.633) 8.925 7.804 ( 4.466 2.687 -10.751) 11.948 8.061 ( 2.947 -2.363 -3.014) 4.832 8.300 ( -1.120 1.312 -0.023) 1.725 8.681 ( 2.266 4.399 7.501) 8.986 8.925 ( 5.728 -1.972 10.108) 11.784 9.572 ( -0.131 -1.640 6.314) 6.525 9.941 ( -5.618 2.531 -6.984) 9.314 10.087 ( -2.158 -0.093 -3.056) 3.742 11.660 ( 6.843 3.476 3.152) 8.297 11.799 ( 1.256 3.744 16.546) 17.010 12.975 ( 1.647 -1.890 -4.970) 5.566 13.570 ( -3.925 -2.196 1.445) 4.724 13.990 ( -0.108 -3.234 -3.202) 4.552 14.140 ( -2.880 3.144 -3.832) 5.732 16.582 ( 4.033 5.270 10.306) 12.257 16.869 ( -0.388 -0.784 1.081) 1.390 17.738 ( 11.456 7.933 -0.803) 13.958 18.069 ( -8.074 3.022 8.795) 12.315 19.764 ( -4.286 -9.506 -16.030) 19.123 22.535 ( -2.905 -0.130 0.239) 2.918 ======================= Grid point 303 (145/336) ======================= q-point: (-0.27 0.36 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.830 ( -4.330 1.385 3.871) 5.971 2.418 ( 5.878 16.712 11.728) 21.245 2.487 ( 4.620 13.574 20.491) 25.009 3.026 ( 5.625 15.030 6.249) 17.221 4.343 ( -1.674 -7.891 5.720) 9.889 4.771 ( 4.259 -6.628 -11.250) 13.734 4.973 ( -6.191 -9.542 -4.126) 12.100 5.152 ( 7.757 -1.701 9.740) 12.566 5.268 ( 1.339 1.847 -4.591) 5.126 5.968 ( -3.729 3.715 -3.887) 6.543 6.325 ( -4.126 -8.996 -1.211) 9.971 6.407 ( 2.929 -4.821 -2.641) 6.229 6.565 ( 1.706 -3.703 -0.582) 4.118 6.915 ( 2.890 -1.409 4.916) 5.874 7.345 ( 1.220 -2.311 -5.283) 5.894 7.469 ( -6.149 -4.800 -1.494) 7.943 7.787 ( 3.974 1.717 -10.195) 11.076 8.073 ( 0.368 -1.463 -6.321) 6.498 8.267 ( -2.595 -0.551 1.105) 2.874 8.779 ( 6.894 4.133 11.622) 14.131 9.105 ( 6.424 -1.479 10.051) 12.020 9.632 ( 0.488 -2.303 5.797) 6.257 9.754 ( -6.957 4.534 -7.040) 10.887 10.046 ( -0.536 -0.182 -5.364) 5.393 11.716 ( 4.813 6.989 2.216) 8.770 11.908 ( 3.247 5.189 14.700) 15.924 12.903 ( -6.388 -2.180 -7.295) 9.939 13.585 ( 0.738 -2.212 1.708) 2.891 14.001 ( -1.875 -3.138 -2.724) 4.559 14.042 ( -2.028 1.029 -1.479) 2.713 16.646 ( 0.339 5.596 10.991) 12.338 16.859 ( 2.781 2.028 -2.163) 4.065 17.816 ( 4.491 12.243 0.317) 13.045 18.051 ( 7.064 2.550 4.412) 8.710 19.670 ( -9.287 -14.780 -11.475) 20.890 22.499 ( -1.642 0.016 -0.144) 1.648 ======================= Grid point 304 (146/336) ======================= q-point: (-0.18 0.36 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.733 ( -5.719 1.293 -1.948) 6.179 2.418 ( 4.798 17.471 11.894) 21.673 2.552 ( 4.994 12.122 18.302) 22.513 3.135 ( 15.175 10.327 9.975) 20.891 4.381 ( -5.604 -6.959 2.221) 9.207 4.756 ( 0.303 0.694 -11.537) 11.562 4.942 ( -6.089 -8.222 -1.615) 10.358 5.246 ( 3.812 -4.945 -3.719) 7.268 5.397 ( 4.567 -4.985 6.405) 9.313 5.851 ( -3.759 3.017 -3.298) 5.840 6.337 ( -3.033 -8.547 -2.115) 9.312 6.441 ( -2.166 2.272 4.918) 5.834 6.584 ( -0.495 -7.836 -8.169) 11.331 7.071 ( 7.413 -3.163 6.132) 10.127 7.306 ( -2.443 -0.177 -5.376) 5.907 7.444 ( -1.285 -3.592 -1.022) 3.950 7.755 ( 0.240 1.626 -7.156) 7.343 8.049 ( 0.960 -1.320 -8.014) 8.179 8.274 ( 0.383 -3.428 2.609) 4.325 8.888 ( 1.521 3.237 5.585) 6.632 9.276 ( 7.087 -0.300 8.782) 11.289 9.556 ( -7.900 2.599 -1.594) 8.468 9.717 ( 2.752 -0.452 4.504) 5.298 10.008 ( 0.393 0.840 -5.040) 5.125 11.703 ( 1.139 9.812 2.026) 10.083 11.952 ( 1.564 8.502 10.403) 13.526 12.799 ( -3.359 -5.139 -8.524) 10.505 13.617 ( -0.118 -1.255 1.134) 1.696 13.916 ( -3.759 2.206 -2.750) 5.154 14.090 ( 0.786 -6.119 2.166) 6.539 16.595 ( -2.806 7.272 3.192) 8.423 16.950 ( 8.694 0.316 2.557) 9.067 17.636 ( -4.860 17.406 -6.004) 19.043 18.238 ( 11.375 3.112 7.701) 14.085 19.658 ( -5.331 -20.131 -6.619) 21.852 22.478 ( -0.486 0.596 -0.538) 0.939 ======================= Grid point 305 (147/336) ======================= q-point: (-0.09 0.36 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.631 ( -2.481 -0.079 -6.633) 7.082 2.432 ( 7.027 12.992 10.844) 18.324 2.635 ( 3.296 9.101 19.094) 21.407 3.367 ( 14.758 5.782 6.581) 17.161 4.339 ( -4.599 -3.091 -0.903) 5.614 4.687 ( -3.118 -2.894 -7.055) 8.238 4.854 ( -9.793 -2.521 -3.562) 10.722 5.360 ( 5.932 -8.338 -6.631) 12.193 5.521 ( 1.057 -5.278 4.828) 7.230 5.762 ( -2.850 1.887 -0.614) 3.473 6.348 ( -8.007 -6.572 -1.490) 10.465 6.362 ( -0.310 3.709 -0.097) 3.724 6.633 ( 1.493 -7.990 -3.666) 8.917 7.131 ( -0.798 2.467 -5.445) 6.031 7.351 ( 2.080 -4.734 5.109) 7.269 7.410 ( 0.364 1.995 -6.939) 7.230 7.746 ( 1.634 -4.131 2.409) 5.054 8.036 ( 2.533 -0.477 -7.485) 7.916 8.346 ( 1.457 -2.566 2.563) 3.908 8.799 ( -5.963 5.594 -5.884) 10.073 9.421 ( 0.641 -3.345 0.938) 3.533 9.433 ( -3.361 3.886 7.062) 8.733 9.784 ( 1.856 0.518 3.828) 4.286 10.009 ( 3.546 0.725 1.218) 3.819 11.611 ( -0.429 9.477 0.594) 9.505 11.959 ( 0.708 7.312 10.861) 13.113 12.785 ( 2.252 -3.555 -9.367) 10.269 13.624 ( -1.418 -1.917 1.349) 2.739 13.827 ( -2.899 1.503 -2.830) 4.321 14.163 ( -0.639 -4.836 2.737) 5.594 16.498 ( -0.124 9.078 -1.740) 9.244 17.099 ( 4.053 0.812 0.442) 4.157 17.373 ( 1.373 13.115 -4.485) 13.929 18.406 ( 2.984 1.088 15.560) 15.881 19.756 ( -0.609 -17.632 -9.495) 20.035 22.462 ( 0.382 1.591 -0.947) 1.890 ======================= Grid point 311 (148/336) ======================= q-point: (-0.55 0.45 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.817 ( 4.363 -0.000 4.992) 6.630 2.374 ( 2.796 -0.000 17.637) 17.858 2.715 ( -7.495 0.000 7.262) 10.436 3.228 ( 3.491 -0.000 -2.107) 4.078 4.105 ( -0.204 0.000 5.288) 5.292 4.492 ( 4.356 -0.000 -4.288) 6.112 4.558 ( 13.047 -0.000 5.699) 14.238 4.861 ( -5.673 0.000 -0.506) 5.695 5.739 ( 0.988 -0.000 -13.213) 13.250 5.936 ( 7.091 -0.000 -3.896) 8.091 6.092 ( 5.288 -0.000 2.928) 6.045 6.422 ( -5.387 0.000 -7.800) 9.479 6.498 ( -5.062 0.000 -0.863) 5.135 6.872 ( 0.850 -0.000 1.473) 1.700 7.274 ( -1.239 0.000 0.490) 1.332 7.615 ( -5.381 0.000 -1.151) 5.503 7.853 ( 2.050 -0.000 -7.179) 7.466 7.953 ( 4.644 -0.000 -3.913) 6.072 8.371 ( -2.643 0.000 -2.852) 3.888 8.671 ( 4.525 -0.000 2.169) 5.018 8.782 ( 0.120 -0.000 9.729) 9.730 9.512 ( -1.252 0.000 7.307) 7.413 10.035 ( 1.704 -0.000 -6.564) 6.781 10.192 ( -8.530 0.000 0.984) 8.587 11.540 ( 3.926 -0.000 10.166) 10.898 11.827 ( -3.410 0.000 8.808) 9.445 12.840 ( 11.469 -0.000 -3.957) 12.132 13.635 ( -7.533 0.000 1.860) 7.759 13.960 ( 1.419 -0.000 -4.189) 4.423 14.234 ( 0.306 -0.000 -2.829) 2.846 16.585 ( 2.991 -0.000 9.585) 10.041 16.763 ( 2.056 -0.000 2.938) 3.586 17.737 ( 2.785 -0.000 -1.193) 3.030 18.263 ( -15.174 0.000 10.249) 18.311 19.717 ( 6.355 -0.000 -17.088) 18.231 22.580 ( -3.061 0.000 0.853) 3.178 ======================= Grid point 313 (149/336) ======================= q-point: (-0.45 0.45 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.885 ( -0.808 1.519 8.316) 8.492 2.549 ( 6.729 5.366 20.713) 22.430 2.663 ( 0.433 6.297 6.431) 9.011 3.245 ( 1.028 2.233 -2.237) 3.323 4.144 ( -0.894 -3.118 5.708) 6.565 4.555 ( 4.190 -3.463 -3.654) 6.550 4.793 ( -4.344 -5.205 -2.167) 7.117 4.839 ( 13.438 -1.414 10.882) 17.349 5.615 ( -2.307 7.884 -11.931) 14.485 5.999 ( -0.711 -6.190 -5.440) 8.272 6.190 ( 4.510 0.497 3.508) 5.735 6.305 ( -3.401 -2.087 -7.293) 8.313 6.469 ( 2.456 1.181 2.576) 3.750 6.891 ( 0.675 -0.119 1.067) 1.268 7.258 ( 0.697 -1.910 -5.464) 5.830 7.492 ( -9.158 -2.025 -1.164) 9.451 7.846 ( 3.974 1.433 -10.249) 11.085 8.024 ( 4.045 -1.218 -2.463) 4.890 8.318 ( -2.213 0.532 -1.001) 2.486 8.766 ( 5.249 4.088 8.069) 10.458 8.876 ( 3.497 -2.913 10.102) 11.080 9.545 ( -0.241 -0.894 6.069) 6.139 9.990 ( -2.091 2.187 -7.297) 7.900 10.068 ( -5.586 -1.423 -2.462) 6.268 11.698 ( 8.767 0.863 5.902) 10.604 11.855 ( -1.036 1.749 16.302) 16.429 12.950 ( 3.162 -0.727 -4.064) 5.200 13.541 ( -4.497 -0.831 1.492) 4.811 13.950 ( 0.013 -1.100 -4.605) 4.734 14.181 ( -3.174 1.119 -4.039) 5.257 16.676 ( 2.876 3.806 11.761) 12.691 16.838 ( 2.611 -1.974 2.633) 4.201 17.841 ( 12.624 2.812 -1.293) 12.997 18.096 ( -13.246 0.475 12.601) 18.288 19.647 ( -2.651 -3.110 -20.566) 20.968 22.534 ( -2.814 -0.028 0.230) 2.824 ======================= Grid point 314 (150/336) ======================= q-point: (-0.36 0.45 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.854 ( -6.358 1.022 5.490) 8.462 2.674 ( 6.066 10.284 10.364) 15.811 2.731 ( 7.779 11.203 16.978) 21.778 3.207 ( 0.604 4.655 0.565) 4.728 4.193 ( -3.537 -7.090 4.959) 9.347 4.641 ( 4.506 -5.758 -5.634) 9.231 4.779 ( -3.691 -9.070 -3.297) 10.332 5.124 ( 10.553 -0.795 12.397) 16.300 5.408 ( -3.667 9.319 -9.475) 13.786 5.964 ( -5.671 -5.052 -4.099) 8.630 6.216 ( -2.058 -0.961 -1.391) 2.663 6.310 ( 4.193 -4.264 -4.570) 7.526 6.553 ( 4.624 1.043 3.708) 6.018 6.923 ( 3.054 1.406 3.659) 4.969 7.284 ( 3.667 -3.406 -6.372) 8.103 7.374 ( -7.478 -4.717 -2.440) 9.172 7.822 ( 3.085 1.827 -11.074) 11.640 8.045 ( 0.096 -1.403 -5.359) 5.540 8.270 ( -2.908 0.519 0.258) 2.965 8.872 ( 6.186 5.521 11.519) 14.193 9.060 ( 6.785 -3.356 11.023) 13.372 9.589 ( -0.528 -1.881 4.823) 5.204 9.846 ( -4.480 5.066 -6.751) 9.555 10.016 ( -1.661 -2.982 -5.381) 6.372 11.821 ( 6.071 4.016 2.439) 7.677 11.971 ( 3.330 1.879 18.134) 18.533 12.878 ( -8.494 -0.662 -4.765) 9.762 13.549 ( 2.247 -1.436 1.511) 3.065 13.933 ( -0.642 -2.694 -4.201) 5.032 14.084 ( -3.830 1.814 -3.121) 5.263 16.751 ( 1.044 4.924 13.516) 14.423 16.885 ( 2.718 0.792 -1.336) 3.130 17.972 ( -6.201 2.633 11.526) 13.351 18.082 ( 16.014 2.980 1.171) 16.331 19.462 ( -9.668 -7.406 -20.232) 23.615 22.500 ( -1.331 0.058 -0.063) 1.333 ======================= Grid point 315 (151/336) ======================= q-point: (-0.27 0.45 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.754 ( -6.303 1.010 0.017) 6.384 2.725 ( 4.684 13.984 10.324) 18.002 2.785 ( 3.432 13.231 13.233) 19.025 3.255 ( 7.520 2.014 5.466) 9.512 4.213 ( -6.876 -9.477 3.553) 12.236 4.719 ( 3.402 -4.513 -10.329) 11.774 4.791 ( -3.036 -7.938 -0.949) 8.551 5.219 ( -2.551 1.870 -2.774) 4.207 5.351 ( 5.593 -0.152 4.474) 7.164 5.878 ( -5.592 -1.451 -3.432) 6.720 6.201 ( -1.300 -3.426 -0.702) 3.731 6.394 ( 4.288 -5.700 -5.711) 9.138 6.582 ( -0.128 5.256 2.340) 5.755 7.035 ( 7.473 -0.667 6.652) 10.027 7.287 ( -2.738 -2.803 -6.907) 7.941 7.358 ( 0.877 -4.416 -0.561) 4.537 7.779 ( 0.853 0.906 -10.853) 10.924 8.017 ( 0.569 -1.972 -7.597) 7.870 8.237 ( -1.273 -0.639 2.289) 2.696 8.965 ( 2.027 4.603 8.510) 9.886 9.265 ( 7.737 -0.995 9.938) 12.634 9.572 ( -6.863 -0.729 0.200) 6.904 9.743 ( 1.667 3.414 -0.203) 3.805 9.997 ( 0.249 -2.124 -4.841) 5.292 11.861 ( 1.762 6.744 5.478) 8.865 12.078 ( 1.941 5.011 10.302) 11.619 12.711 ( -7.984 -4.041 -5.883) 10.709 13.607 ( 2.114 0.064 0.851) 2.279 13.923 ( -2.004 -2.275 -3.780) 4.846 14.020 ( -0.328 -0.452 0.364) 0.667 16.735 ( -2.426 7.532 6.409) 10.184 16.954 ( 6.070 -0.053 2.332) 6.503 17.880 ( -7.406 6.581 6.230) 11.703 18.314 ( 13.485 6.939 3.290) 15.518 19.317 ( -5.350 -15.947 -14.782) 22.393 22.489 ( 0.268 0.524 -0.108) 0.599 ======================= Grid point 316 (152/336) ======================= q-point: (-0.18 0.45 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.646 ( -3.472 1.481 -5.473) 6.648 2.678 ( 1.402 13.191 7.438) 15.208 2.819 ( 2.340 10.006 15.321) 18.448 3.425 ( 9.281 -0.135 4.258) 10.212 4.203 ( -7.321 -9.392 3.270) 12.349 4.666 ( -4.077 -0.372 -8.619) 9.542 4.809 ( -1.291 -2.883 -3.667) 4.840 5.221 ( 3.272 -6.719 -5.645) 9.366 5.427 ( -0.360 -3.787 0.319) 3.817 5.792 ( -3.761 0.225 -0.282) 3.779 6.218 ( -0.864 -3.430 0.076) 3.538 6.473 ( -0.490 -2.233 -8.995) 9.281 6.513 ( 2.380 3.656 3.528) 5.611 7.185 ( 2.065 2.936 -2.020) 4.119 7.254 ( 2.639 -5.347 4.552) 7.502 7.413 ( 2.045 -2.543 -2.550) 4.141 7.692 ( -3.186 -1.164 -7.758) 8.467 8.023 ( 3.691 -1.188 -7.205) 8.182 8.286 ( 2.542 -3.084 3.453) 5.282 8.916 ( -4.320 6.584 -0.987) 7.936 9.390 ( -1.606 -0.117 -0.487) 1.683 9.480 ( -1.659 0.805 7.936) 8.147 9.786 ( 2.614 0.306 3.609) 4.467 10.013 ( 2.564 -0.615 -0.005) 2.637 11.794 ( -3.988 9.500 3.740) 10.961 12.073 ( -2.043 5.103 8.332) 9.982 12.686 ( 2.580 -6.967 -6.588) 9.929 13.620 ( 0.065 1.369 0.640) 1.512 13.856 ( -3.007 1.203 -3.506) 4.773 14.078 ( 1.790 -3.929 2.482) 4.980 16.659 ( 0.172 8.323 0.943) 8.378 17.079 ( 4.972 -1.926 3.987) 6.658 17.662 ( -6.509 14.782 -4.380) 16.735 18.404 ( -3.110 -0.073 14.099) 14.438 19.434 ( 8.465 -16.326 -12.409) 22.185 22.493 ( 1.343 1.531 -0.124) 2.040 ======================= Grid point 317 (153/336) ======================= q-point: (-0.09 0.45 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.552 ( -1.187 0.856 -9.374) 9.488 2.650 ( 1.060 5.982 6.471) 8.876 2.843 ( -0.907 7.704 15.960) 17.745 3.552 ( 3.355 -0.464 -1.016) 3.536 4.218 ( -3.893 -7.963 5.668) 10.521 4.545 ( -4.905 -2.139 -8.377) 9.940 4.732 ( -3.088 4.928 -5.955) 8.324 5.330 ( 4.213 -7.824 -5.723) 10.570 5.452 ( -0.477 -9.628 -6.536) 11.647 5.753 ( -2.328 0.762 3.848) 4.561 6.202 ( -4.776 0.863 -0.379) 4.869 6.360 ( -1.271 2.708 -3.759) 4.804 6.632 ( 6.649 -5.053 -1.972) 8.581 7.111 ( -2.629 5.253 -2.512) 6.389 7.306 ( -3.475 2.776 -6.663) 8.011 7.475 ( 6.898 -2.349 1.977) 7.551 7.703 ( 0.642 -10.743 0.064) 10.763 8.075 ( 6.479 0.127 -3.122) 7.193 8.372 ( 1.792 -1.242 2.896) 3.625 8.728 ( -5.899 8.445 -7.131) 12.529 9.298 ( -7.165 -3.081 -2.436) 8.171 9.490 ( -2.227 4.304 3.748) 6.126 9.834 ( 1.377 0.399 2.327) 2.733 10.110 ( 4.911 -1.479 8.394) 9.837 11.656 ( -4.535 6.289 2.527) 8.155 12.042 ( -3.474 2.844 8.229) 9.374 12.790 ( 7.408 -3.162 -6.084) 10.094 13.602 ( -1.229 0.903 1.137) 1.902 13.785 ( -1.234 1.409 -3.592) 4.051 14.142 ( 0.122 -2.364 2.342) 3.330 16.596 ( 2.316 9.775 -2.190) 10.282 17.109 ( -3.438 4.532 -4.352) 7.162 17.504 ( 4.984 3.399 1.896) 6.323 18.422 ( -11.892 -6.990 20.950) 25.083 19.636 ( 10.669 -7.660 -14.939) 19.891 22.500 ( 2.195 2.617 -0.095) 3.418 ======================= Grid point 324 (154/336) ======================= q-point: ( 0.55 -0.45 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.864 ( -7.081 0.000 6.201) 9.412 2.778 ( 5.749 -0.000 9.281) 10.918 2.847 ( 10.037 -0.000 16.631) 19.425 3.239 ( -1.623 0.000 -2.038) 2.606 4.119 ( -4.120 0.000 4.470) 6.079 4.583 ( 4.033 -0.000 -3.648) 5.438 4.687 ( -3.032 0.000 -2.643) 4.022 5.118 ( 11.186 -0.000 13.092) 17.220 5.521 ( -5.437 0.000 -12.169) 13.329 5.881 ( -5.124 0.000 -2.698) 5.791 6.228 ( 0.556 -0.000 -7.998) 8.017 6.263 ( 2.034 -0.000 2.232) 3.020 6.570 ( 5.839 -0.000 4.801) 7.559 6.940 ( 3.859 -0.000 2.939) 4.850 7.247 ( 4.398 -0.000 -7.148) 8.392 7.323 ( -8.475 0.000 -2.848) 8.941 7.842 ( 2.513 -0.000 -10.986) 11.270 8.029 ( 0.006 -0.000 -5.076) 5.076 8.276 ( -2.774 0.000 -0.133) 2.777 8.963 ( 2.858 -0.000 10.516) 10.897 8.990 ( 9.930 -0.000 12.288) 15.799 9.570 ( -0.524 0.000 4.470) 4.500 9.930 ( -1.772 0.000 -8.848) 9.024 9.951 ( -4.143 0.000 -3.181) 5.224 11.860 ( 6.792 -0.000 2.381) 7.197 11.988 ( 2.982 -0.000 19.089) 19.320 12.873 ( -9.250 0.000 -3.557) 9.911 13.535 ( 2.895 -0.000 1.448) 3.237 13.908 ( -0.729 0.000 -5.058) 5.110 14.101 ( -3.986 0.000 -3.329) 5.193 16.803 ( 0.883 -0.000 14.211) 14.238 16.891 ( 3.454 -0.000 -0.519) 3.492 17.974 ( -12.397 0.000 16.546) 20.675 18.128 ( 21.778 -0.000 -1.400) 21.823 19.392 ( -10.305 0.000 -23.306) 25.482 22.500 ( -1.217 0.000 -0.032) 1.217 ======================= Grid point 326 (155/336) ======================= q-point: (-0.36 0.55 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.769 ( -6.641 0.471 1.571) 6.841 2.902 ( 5.022 4.955 10.230) 12.427 3.034 ( 4.635 11.572 9.417) 15.622 3.218 ( 0.786 -5.320 2.905) 6.112 4.073 ( -6.621 -4.421 2.991) 8.504 4.635 ( 3.856 -3.128 -6.637) 8.289 4.673 ( 0.492 -3.649 -0.622) 3.734 5.263 ( -6.030 1.568 1.806) 6.487 5.374 ( 2.797 1.716 -3.138) 4.541 5.810 ( -4.558 -3.501 -2.437) 6.243 6.205 ( 2.372 1.845 -4.658) 5.543 6.310 ( 2.694 -2.872 -1.999) 4.416 6.681 ( 5.404 3.921 4.744) 8.190 7.030 ( 2.506 -0.304 7.012) 7.453 7.214 ( -2.185 -3.022 -6.184) 7.221 7.304 ( 4.784 -1.575 -3.952) 6.402 7.792 ( -0.040 0.453 -11.384) 11.393 7.987 ( -0.110 -1.020 -7.237) 7.310 8.236 ( -1.965 0.204 1.370) 2.404 9.041 ( 1.000 2.811 9.162) 9.636 9.239 ( 9.491 -1.397 11.698) 15.128 9.556 ( -4.822 -0.558 0.850) 4.928 9.826 ( 0.084 4.885 -4.484) 6.632 9.932 ( -0.094 -4.332 -3.214) 5.395 11.946 ( 0.920 2.268 9.000) 9.326 12.143 ( 6.341 1.910 7.402) 9.932 12.656 ( -14.030 -1.687 -3.342) 14.521 13.613 ( 4.494 0.306 1.534) 4.758 13.875 ( -0.462 -1.718 -4.649) 4.978 14.032 ( -2.101 0.629 -1.006) 2.413 16.860 ( -1.480 5.129 10.355) 11.651 16.941 ( 3.641 -1.532 0.101) 3.952 17.903 ( -10.587 -1.225 18.265) 21.147 18.483 ( 24.149 7.797 -2.066) 25.460 19.078 ( -12.768 -8.444 -21.678) 26.539 22.496 ( 0.705 0.210 0.146) 0.750 ======================= Grid point 327 (156/336) ======================= q-point: (-0.27 0.55 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.676 ( -3.010 1.498 -3.168) 4.620 2.910 ( -3.960 10.894 3.998) 12.262 2.985 ( 0.600 6.952 11.725) 13.644 3.372 ( 5.888 -4.570 3.877) 8.402 4.044 ( -5.314 -6.741 3.230) 9.171 4.650 ( -1.412 -1.425 -4.571) 4.992 4.746 ( 4.541 -3.168 -4.428) 7.090 5.113 ( -4.777 -4.303 -7.540) 9.909 5.394 ( -2.407 -0.168 -0.446) 2.454 5.760 ( -3.225 -2.772 -2.793) 5.088 6.220 ( 3.520 2.246 0.277) 4.184 6.384 ( 5.106 -3.604 -5.698) 8.457 6.681 ( -0.263 10.563 3.290) 11.067 7.117 ( 0.082 -9.295 4.096) 10.158 7.239 ( 5.139 2.411 -2.162) 6.075 7.357 ( 2.199 -2.487 -0.219) 3.327 7.688 ( -4.197 0.151 -11.768) 12.495 7.992 ( 5.036 -1.854 -7.837) 9.498 8.248 ( 1.340 -1.034 3.835) 4.192 9.028 ( -3.343 4.805 3.072) 6.611 9.402 ( -2.539 0.977 -1.921) 3.331 9.470 ( 0.119 -1.353 7.340) 7.465 9.810 ( 2.452 2.276 0.898) 3.464 9.980 ( 2.281 -2.772 1.818) 4.024 11.938 ( -5.609 5.098 10.027) 12.569 12.179 ( -1.743 7.069 1.643) 7.464 12.532 ( -1.340 -9.167 -3.681) 9.969 13.664 ( 2.521 2.812 1.068) 3.924 13.857 ( -0.987 -1.232 -4.259) 4.542 14.029 ( 1.358 -1.215 1.790) 2.555 16.812 ( -0.489 7.893 3.184) 8.525 17.032 ( 2.391 -3.343 4.222) 5.892 17.839 ( -9.346 3.408 11.883) 15.498 18.475 ( -8.489 8.502 -5.043) 13.030 19.149 ( 17.409 -13.988 -10.451) 24.657 22.516 ( 2.064 0.941 0.509) 2.325 ======================= Grid point 328 (157/336) ======================= q-point: (-0.18 -0.45 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( -0.172 3.640 -6.834) 7.744 2.754 ( -7.404 4.933 2.790) 9.324 2.984 ( -3.108 6.833 13.779) 15.692 3.493 ( 1.703 -5.119 -1.377) 5.568 4.081 ( -0.266 -5.870 5.291) 7.907 4.547 ( -4.884 2.472 -6.900) 8.808 4.783 ( 1.565 0.362 -4.361) 4.647 5.161 ( 5.651 -11.596 -9.086) 15.779 5.307 ( -6.819 -3.775 -5.163) 9.350 5.732 ( -1.567 -2.373 -1.909) 3.425 6.258 ( 1.861 4.346 4.675) 6.649 6.422 ( 0.834 1.716 -8.110) 8.331 6.598 ( 2.672 3.722 -0.871) 4.664 7.208 ( 0.383 4.036 -0.036) 4.055 7.273 ( 0.526 -6.357 3.403) 7.229 7.458 ( 7.116 -1.071 -0.762) 7.236 7.537 ( -6.344 -4.528 -8.157) 11.282 8.070 ( 7.829 -0.682 -5.466) 9.573 8.334 ( 3.218 -2.299 4.422) 5.932 8.886 ( -5.554 8.011 -4.363) 10.680 9.256 ( -8.767 -1.662 -4.542) 10.012 9.548 ( 0.240 1.869 5.586) 5.896 9.840 ( 1.531 0.612 1.393) 2.158 10.078 ( 3.274 -2.005 8.367) 9.205 11.792 ( -9.219 7.714 5.593) 13.258 12.079 ( -5.831 1.507 4.454) 7.491 12.675 ( 8.464 -8.342 -3.696) 12.446 13.661 ( 0.848 4.649 1.190) 4.873 13.813 ( -0.579 1.329 -4.203) 4.446 14.094 ( 1.814 -2.602 2.380) 3.965 16.760 ( 1.839 7.953 0.641) 8.188 17.108 ( -0.374 -3.313 1.796) 3.788 17.660 ( -6.608 10.422 -0.179) 12.342 18.276 ( -16.124 -7.349 10.704) 20.702 19.509 ( 20.697 -5.890 -10.532) 23.958 22.545 ( 2.704 2.051 0.768) 3.480 ======================= Grid point 329 (158/336) ======================= q-point: (-0.09 -0.45 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.512 ( -0.017 4.840 -8.535) 9.812 2.625 ( -9.637 -2.539 2.655) 10.313 2.923 ( -8.031 4.624 13.619) 16.473 3.484 ( -5.363 -4.224 -5.713) 8.902 4.185 ( 1.400 -2.035 5.082) 5.650 4.439 ( 0.798 -0.421 -7.013) 7.071 4.740 ( 0.940 5.826 -4.605) 7.485 5.235 ( -4.846 -8.726 -3.711) 10.649 5.325 ( 7.219 -11.695 -12.484) 18.567 5.727 ( -0.286 -1.792 -1.076) 2.110 6.181 ( -5.571 8.930 2.618) 10.845 6.384 ( 4.152 2.925 -2.920) 5.858 6.691 ( 7.953 -3.832 -4.388) 9.858 7.075 ( -8.483 7.467 -3.253) 11.760 7.275 ( -0.051 3.451 -2.904) 4.511 7.559 ( 4.593 -6.347 1.317) 7.944 7.612 ( 3.982 -9.696 0.183) 10.484 8.185 ( 8.292 -0.430 -1.494) 8.437 8.405 ( 0.067 0.066 3.831) 3.832 8.680 ( -4.851 8.962 -7.565) 12.692 9.113 ( -7.807 -3.768 -7.417) 11.409 9.510 ( -3.137 5.190 4.143) 7.345 9.859 ( 0.495 -0.235 0.299) 0.625 10.211 ( 2.426 -3.017 11.021) 11.681 11.626 ( -7.264 4.428 4.537) 9.641 12.012 ( -6.087 -0.705 4.978) 7.895 12.859 ( 8.104 -4.404 -2.547) 9.569 13.623 ( -0.516 4.685 1.363) 4.906 13.784 ( 2.305 1.908 -4.251) 5.199 14.142 ( 0.005 -1.195 1.962) 2.297 16.705 ( 0.499 9.457 -2.031) 9.686 17.052 ( -3.431 3.828 -5.818) 7.764 17.591 ( 2.693 -3.267 4.760) 6.370 18.184 ( -18.389 -12.163 16.383) 27.469 19.754 ( 15.735 2.222 -12.005) 19.917 22.572 ( 2.922 2.867 0.887) 4.188 ======================= Grid point 337 (159/336) ======================= q-point: ( 0.64 -0.36 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.692 ( -2.626 0.000 -2.017) 3.311 3.042 ( 1.116 -0.000 11.710) 11.763 3.043 ( -10.339 0.000 -0.707) 10.364 3.311 ( 7.346 -0.000 5.711) 9.304 3.976 ( -3.968 0.000 3.149) 5.065 4.630 ( 1.116 -0.000 -1.713) 2.045 4.715 ( 7.728 -0.000 -5.286) 9.363 5.072 ( -10.982 0.000 -9.305) 14.394 5.396 ( -2.888 0.000 -0.266) 2.901 5.728 ( -2.232 0.000 -2.898) 3.657 6.249 ( 6.458 -0.000 -8.186) 10.426 6.350 ( 3.609 -0.000 3.471) 5.007 6.852 ( 7.745 -0.000 6.616) 10.186 6.956 ( -8.844 0.000 -0.757) 8.877 7.268 ( 8.654 -0.000 0.154) 8.656 7.329 ( 0.354 -0.000 -1.568) 1.607 7.689 ( -4.029 0.000 -12.013) 12.670 7.971 ( 5.284 -0.000 -7.978) 9.569 8.240 ( 0.721 -0.000 3.570) 3.642 9.076 ( -3.173 0.000 4.944) 5.875 9.413 ( -2.869 0.000 -2.422) 3.755 9.453 ( 1.148 -0.000 6.718) 6.815 9.846 ( 2.183 -0.000 -4.042) 4.594 9.938 ( 2.298 -0.000 6.312) 6.717 11.982 ( -6.119 0.000 12.662) 14.063 12.315 ( 11.406 -0.000 -1.952) 11.572 12.378 ( -15.939 0.000 -1.948) 16.058 13.698 ( 3.832 -0.000 2.216) 4.426 13.836 ( 0.300 -0.000 -4.924) 4.933 14.021 ( 0.373 -0.000 1.092) 1.154 16.942 ( -3.965 0.000 15.725) 16.217 16.948 ( 4.076 -0.000 -7.629) 8.649 17.853 ( -9.796 0.000 20.457) 22.681 18.613 ( -19.146 0.000 -21.401) 28.716 18.974 ( 29.413 -0.000 -2.776) 29.544 22.525 ( 2.330 -0.000 0.746) 2.446 ======================= Grid point 339 (160/336) ======================= q-point: (-0.27 -0.36 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.660 ( 1.706 2.091 -3.971) 4.801 2.821 ( -14.396 1.938 -0.126) 14.526 3.077 ( -4.751 2.685 12.954) 14.056 3.407 ( 1.136 -2.862 -1.922) 3.630 4.005 ( 3.392 -2.145 4.856) 6.300 4.619 ( -0.999 3.654 -2.400) 4.484 4.789 ( 3.353 2.605 -6.707) 7.938 4.933 ( 1.250 -11.247 -10.765) 15.619 5.283 ( -8.323 -0.070 -4.403) 9.416 5.692 ( -0.484 -1.318 -3.967) 4.208 6.317 ( 7.755 1.325 -5.065) 9.356 6.431 ( 2.692 0.445 2.778) 3.894 6.750 ( -4.226 9.431 -2.962) 10.750 7.076 ( 5.055 -10.386 5.107) 12.630 7.288 ( -2.184 2.397 0.668) 3.311 7.413 ( 4.629 -1.970 3.006) 5.860 7.528 ( -4.715 0.695 -12.706) 13.570 8.055 ( 9.582 -0.679 -7.259) 12.040 8.302 ( 2.769 -0.872 5.448) 6.174 9.005 ( -5.240 3.847 -0.388) 6.512 9.230 ( -9.963 -0.970 -7.991) 12.809 9.566 ( 2.328 0.272 6.046) 6.484 9.858 ( 1.886 0.906 -1.962) 2.868 10.040 ( 2.031 -1.541 11.275) 11.560 11.909 ( -9.779 3.591 10.447) 14.754 12.115 ( -11.800 2.230 0.370) 12.014 12.524 ( 11.268 -5.977 -3.504) 13.228 13.744 ( 2.195 3.309 2.074) 4.480 13.823 ( 1.183 -0.297 -4.592) 4.751 14.055 ( 1.750 -1.286 1.720) 2.770 16.898 ( -0.819 6.848 4.427) 8.196 17.020 ( 0.185 -5.607 1.346) 5.769 17.804 ( -9.376 3.830 14.996) 18.096 18.187 ( -19.091 -1.849 -11.964) 22.606 19.424 ( 26.658 -2.639 -5.647) 27.377 22.573 ( 3.015 0.776 1.278) 3.365 ======================= Grid point 340 (161/336) ======================= q-point: (-0.18 -0.36 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.634 ( 2.304 6.914 -3.923) 8.276 2.576 ( -16.350 -2.510 1.400) 16.600 2.995 ( -11.011 2.774 11.039) 15.837 3.379 ( -6.315 -5.534 -5.699) 10.148 4.167 ( 9.669 -0.450 5.804) 11.287 4.493 ( -1.587 6.521 -7.818) 10.304 4.791 ( 2.177 -1.369 -4.024) 4.775 5.058 ( 1.025 -9.687 -11.433) 15.020 5.153 ( -0.468 -5.079 -5.128) 7.233 5.690 ( 1.414 -1.721 -3.483) 4.134 6.354 ( -2.639 8.153 4.904) 9.873 6.442 ( 6.750 2.178 -7.548) 10.357 6.670 ( 4.335 2.376 -2.937) 5.750 7.172 ( -6.431 0.542 -1.261) 6.576 7.317 ( -4.062 0.186 -2.764) 4.917 7.330 ( 3.557 -9.039 0.976) 9.762 7.569 ( 6.570 -0.329 1.030) 6.658 8.179 ( 9.783 -0.176 -5.220) 11.090 8.388 ( 1.456 -1.361 5.688) 6.027 8.839 ( -5.529 7.568 -6.169) 11.221 9.050 ( -9.005 -3.219 -7.593) 12.210 9.585 ( -1.567 2.646 4.006) 5.051 9.858 ( 0.310 0.231 -2.078) 2.114 10.156 ( 0.656 -2.679 12.569) 12.868 11.740 ( -9.790 7.142 7.084) 14.036 11.980 ( -8.384 -2.732 4.386) 9.848 12.739 ( 10.174 -6.665 -2.646) 12.447 13.735 ( 0.262 5.963 2.145) 6.342 13.818 ( 2.993 1.539 -4.987) 6.017 14.107 ( 1.062 -2.263 1.330) 2.831 16.847 ( -2.066 5.727 3.435) 6.990 17.058 ( 0.186 -2.451 -3.413) 4.206 17.629 ( -8.290 6.400 0.274) 10.476 17.967 ( -16.740 -10.758 9.839) 22.199 19.782 ( 21.619 0.855 -8.373) 23.200 22.617 ( 2.831 1.749 1.444) 3.628 ======================= Grid point 341 (162/336) ======================= q-point: (-0.09 -0.36 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.537 ( -2.221 10.123 -1.987) 10.552 2.355 ( -18.829 -6.846 1.272) 20.076 2.839 ( -12.072 0.052 7.233) 14.073 3.263 ( -12.047 -7.226 -1.648) 14.144 4.220 ( -1.116 7.126 -6.531) 9.731 4.517 ( 11.582 -0.522 -0.371) 11.600 4.804 ( 4.029 4.034 -3.610) 6.748 5.040 ( -3.116 -11.310 -3.027) 12.115 5.268 ( 6.038 -8.840 -11.812) 15.941 5.741 ( 5.511 -0.890 -1.159) 5.702 6.221 ( -2.493 10.875 2.682) 11.475 6.499 ( 6.866 5.239 -3.043) 9.157 6.744 ( 5.597 -2.167 -7.976) 9.982 6.977 ( -7.033 5.821 -2.764) 9.539 7.252 ( -3.673 -3.095 0.068) 4.803 7.551 ( 7.185 -10.283 2.247) 12.744 7.664 ( 3.965 -0.871 0.819) 4.141 8.296 ( 6.230 0.197 -1.330) 6.373 8.415 ( -2.022 0.980 3.834) 4.444 8.642 ( -3.976 7.670 -8.076) 11.827 8.906 ( -6.743 -3.868 -8.558) 11.561 9.546 ( -1.253 4.372 4.781) 6.599 9.843 ( -0.809 -1.335 -2.935) 3.324 10.255 ( -1.181 -3.859 10.597) 11.340 11.585 ( -7.143 5.199 6.542) 10.992 11.911 ( -7.770 -2.659 4.910) 9.568 12.926 ( 7.161 -4.870 -1.484) 8.786 13.679 ( -0.251 6.237 1.504) 6.420 13.836 ( 4.712 2.062 -4.718) 6.980 14.136 ( -0.614 -1.290 1.111) 1.810 16.720 ( -7.048 7.163 -2.143) 10.275 17.044 ( 2.976 3.120 -5.732) 7.173 17.556 ( -4.391 -9.689 3.945) 11.346 17.884 ( -15.009 -9.418 13.812) 22.467 19.993 ( 15.991 6.848 -9.511) 19.826 22.646 ( 2.112 2.280 1.364) 3.394 ======================= Grid point 350 (163/336) ======================= q-point: (-0.27 -0.27 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.711 ( 4.468 -0.000 -1.250) 4.639 2.547 ( -19.536 0.000 0.850) 19.554 3.021 ( -12.588 0.000 9.156) 15.566 3.322 ( -6.542 0.000 -5.364) 8.460 4.162 ( 12.440 -0.000 5.816) 13.732 4.651 ( 1.119 -0.000 0.099) 1.124 4.678 ( -4.257 0.000 -14.689) 15.294 4.965 ( 11.645 -0.000 -9.140) 14.803 5.111 ( -8.089 0.000 -4.678) 9.344 5.673 ( 2.058 -0.000 -3.970) 4.472 6.438 ( 11.255 -0.000 -7.248) 13.387 6.457 ( -3.307 0.000 4.616) 5.679 6.731 ( 1.104 -0.000 -4.635) 4.764 7.093 ( -1.051 0.000 1.666) 1.970 7.288 ( -10.489 0.000 -7.753) 13.043 7.323 ( 3.896 -0.000 5.819) 7.002 7.568 ( 6.930 -0.000 0.168) 6.932 8.178 ( 10.944 -0.000 -7.020) 13.002 8.372 ( 1.362 -0.000 6.801) 6.936 8.933 ( -5.073 0.000 -2.290) 5.566 9.000 ( -10.202 0.000 -10.984) 14.991 9.609 ( -0.655 0.000 4.033) 4.086 9.863 ( 0.515 -0.000 -4.339) 4.369 10.127 ( -0.444 0.000 14.341) 14.348 11.841 ( -9.073 0.000 10.890) 14.175 11.928 ( -11.417 0.000 2.114) 11.611 12.667 ( 11.385 -0.000 -3.399) 11.882 13.801 ( 0.599 -0.000 2.974) 3.033 13.833 ( 3.639 -0.000 -5.263) 6.399 14.079 ( 1.226 -0.000 0.502) 1.325 16.910 ( -8.509 0.000 11.287) 14.135 17.019 ( 6.349 -0.000 -7.969) 10.189 17.782 ( -18.566 0.000 -11.378) 21.775 17.782 ( -9.309 0.000 16.965) 19.351 19.789 ( 23.794 -0.000 -6.904) 24.775 22.634 ( 2.808 -0.000 1.649) 3.257 ======================= Grid point 351 (164/336) ======================= q-point: (-0.18 -0.27 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.733 ( -0.396 8.129 4.060) 9.095 2.247 ( -21.327 -4.186 3.436) 22.004 2.808 ( -15.060 -2.336 -3.227) 15.578 3.163 ( -13.402 -2.522 3.322) 14.036 4.388 ( 6.040 9.004 -3.702) 11.456 4.505 ( 6.546 -0.314 -5.597) 8.618 4.734 ( 1.252 -9.447 -2.939) 9.973 4.980 ( 0.024 4.053 -3.724) 5.504 5.116 ( 7.152 -6.842 -9.738) 13.885 5.726 ( 6.968 -0.487 -1.363) 7.116 6.400 ( -1.596 6.375 2.988) 7.219 6.583 ( 11.855 2.537 -5.859) 13.465 6.729 ( 3.202 1.474 -5.844) 6.825 7.057 ( -7.272 1.544 -2.512) 7.847 7.106 ( -5.841 -8.275 -3.296) 10.651 7.451 ( 5.686 -1.419 6.062) 8.431 7.663 ( 4.257 0.229 0.963) 4.370 8.306 ( 9.775 0.585 -5.948) 11.457 8.413 ( -2.336 -0.609 7.603) 7.977 8.755 ( -7.456 3.638 -9.875) 12.897 8.851 ( -5.189 -1.751 -5.997) 8.121 9.606 ( -1.158 1.736 3.919) 4.440 9.825 ( -1.336 -0.441 -5.697) 5.868 10.195 ( -2.509 -2.015 12.681) 13.083 11.712 ( -8.134 7.522 8.168) 13.765 11.837 ( -8.218 -5.344 6.889) 11.982 12.831 ( 9.003 -3.590 -2.733) 10.071 13.794 ( -0.899 4.467 2.493) 5.194 13.864 ( 4.652 0.751 -5.590) 7.311 14.101 ( 0.262 -1.791 -0.245) 1.826 16.805 ( -9.272 1.899 3.869) 10.225 17.073 ( 5.523 0.423 -6.861) 8.818 17.461 ( -14.524 -1.316 -1.919) 14.710 17.749 ( -10.223 -4.332 14.000) 17.868 20.081 ( 19.461 2.426 -8.584) 21.408 22.677 ( 1.773 0.881 1.554) 2.517 ======================= Grid point 352 (165/336) ======================= q-point: (-0.09 -0.27 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.574 ( -10.546 12.929 9.257) 19.081 1.945 ( -25.177 -5.264 2.392) 25.832 2.630 ( -11.007 -10.468 -4.905) 15.963 2.994 ( -15.712 -2.385 11.464) 19.596 4.199 ( -2.721 7.723 -12.695) 15.107 4.722 ( 11.348 1.692 -1.187) 11.534 4.838 ( 3.775 -8.424 -4.159) 10.125 4.985 ( 5.617 0.832 0.949) 5.757 5.216 ( 5.656 -6.511 -10.344) 13.468 5.895 ( 13.380 1.076 2.349) 13.628 6.338 ( 1.330 10.712 3.502) 11.348 6.612 ( 1.107 4.871 -8.567) 9.917 6.743 ( 4.188 4.486 -7.608) 9.774 6.961 ( 1.641 -1.074 -0.027) 1.961 7.131 ( -2.412 -9.136 0.282) 9.454 7.589 ( 3.914 -6.286 1.576) 7.571 7.711 ( 1.967 0.343 0.113) 2.000 8.336 ( -5.609 4.006 6.324) 9.354 8.450 ( 6.523 -0.137 -3.596) 7.450 8.577 ( -4.569 1.949 -7.264) 8.800 8.751 ( -3.900 -0.891 -5.510) 6.809 9.606 ( 0.313 2.633 5.623) 6.217 9.776 ( -1.130 -2.488 -6.704) 7.240 10.236 ( -3.954 -3.583 9.048) 10.504 11.576 ( -6.415 6.360 7.066) 11.469 11.791 ( -7.940 -2.319 6.669) 10.625 12.980 ( 6.259 -4.273 -2.140) 7.875 13.739 ( -0.608 5.345 1.747) 5.656 13.894 ( 3.857 0.879 -5.340) 6.646 14.115 ( -0.434 -1.534 0.119) 1.598 16.624 ( -8.739 4.820 -2.873) 10.386 17.093 ( 2.941 1.945 -6.325) 7.242 17.323 ( -12.214 -11.589 3.950) 17.295 17.721 ( -8.443 -5.799 12.378) 16.066 20.262 ( 15.788 7.686 -8.668) 19.583 22.693 ( 0.416 1.361 1.331) 1.948 ======================= Grid point 362 (166/336) ======================= q-point: (-0.18 -0.18 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.739 ( -13.071 0.000 13.052) 18.472 1.895 ( -23.529 0.000 7.817) 24.794 2.479 ( -16.249 0.000 -12.506) 20.504 2.988 ( -11.568 0.000 11.894) 16.591 4.301 ( -5.735 0.000 -16.490) 17.459 4.702 ( 8.935 -0.000 -0.251) 8.938 4.741 ( 8.555 -0.000 0.655) 8.580 5.037 ( 5.720 -0.000 -2.481) 6.235 5.131 ( 6.817 -0.000 -9.263) 11.501 5.904 ( 14.868 -0.000 2.738) 15.118 6.457 ( 1.439 -0.000 3.636) 3.911 6.687 ( -2.925 0.000 -11.931) 12.284 6.778 ( 13.750 -0.000 -5.615) 14.852 6.970 ( -1.607 0.000 1.660) 2.311 6.976 ( -3.736 0.000 -1.581) 4.057 7.534 ( 1.836 -0.000 2.843) 3.384 7.719 ( 2.192 -0.000 0.254) 2.207 8.392 ( -6.491 0.000 11.219) 12.962 8.431 ( 9.746 -0.000 -6.983) 11.990 8.575 ( -7.300 0.000 -8.242) 11.011 8.765 ( -2.671 0.000 -5.704) 6.298 9.632 ( -0.128 0.000 5.220) 5.221 9.750 ( -1.598 0.000 -8.270) 8.423 10.198 ( -4.430 0.000 10.318) 11.229 11.674 ( -8.030 0.000 4.390) 9.152 11.743 ( -6.067 0.000 11.894) 13.352 12.926 ( 7.235 -0.000 -3.152) 7.892 13.809 ( -2.223 0.000 2.937) 3.683 13.896 ( 3.365 -0.000 -6.633) 7.438 14.093 ( 0.708 -0.000 -0.960) 1.193 16.672 ( -9.059 0.000 -0.920) 9.106 17.109 ( 3.187 -0.000 -7.720) 8.352 17.212 ( -14.452 0.000 3.519) 14.875 17.664 ( -8.839 0.000 12.429) 15.252 20.337 ( 17.616 -0.000 -8.947) 19.758 22.706 ( 0.221 -0.000 1.327) 1.345 ======================= Grid point 363 (167/336) ======================= q-point: (-0.09 -0.18 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.509 ( -24.241 10.954 9.946) 28.400 1.542 ( -21.201 -2.421 16.651) 27.066 2.198 ( -23.888 -15.601 3.232) 28.714 2.912 ( -5.102 4.316 5.443) 8.619 4.151 ( 1.053 2.718 -10.417) 10.817 4.800 ( 3.036 -6.309 -3.407) 7.786 4.852 ( 5.134 1.648 -3.954) 6.687 5.137 ( 9.861 2.262 -1.714) 10.261 5.244 ( 10.271 -3.058 -5.839) 12.204 6.207 ( 19.036 2.494 6.883) 20.396 6.456 ( -1.467 6.878 3.474) 7.843 6.534 ( -3.502 1.639 -10.305) 11.007 6.896 ( 2.575 7.919 -1.887) 8.538 6.920 ( 4.209 -3.556 -6.373) 8.424 7.090 ( 6.442 -8.006 0.979) 10.323 7.562 ( 0.121 -4.842 -1.435) 5.052 7.750 ( 2.775 0.778 0.363) 2.905 8.321 ( -7.208 5.667 10.345) 13.823 8.462 ( -4.441 -3.232 -2.407) 5.997 8.549 ( 8.282 0.042 -4.402) 9.379 8.670 ( -4.057 1.070 -4.149) 5.901 9.623 ( -4.967 -0.241 3.271) 5.952 9.739 ( 5.803 -1.151 -5.592) 8.141 10.180 ( -5.498 -2.048 6.961) 9.103 11.552 ( -7.480 3.856 3.756) 9.216 11.708 ( -6.985 0.256 7.667) 10.374 13.022 ( 5.315 -2.729 -3.255) 6.804 13.769 ( -2.085 2.433 2.382) 3.992 13.900 ( 1.295 -0.851 -4.985) 5.220 14.113 ( 1.817 -0.445 -0.249) 1.887 16.517 ( -6.246 2.767 -3.704) 7.770 17.032 ( -10.316 -1.760 -0.151) 10.466 17.088 ( -5.110 -5.801 -3.704) 8.572 17.611 ( -8.712 -3.729 10.533) 14.168 20.538 ( 17.001 5.758 -7.801) 19.571 22.701 ( -1.313 0.587 1.071) 1.793 ======================= Grid point 374 (168/336) ======================= q-point: (-0.09 -0.09 0.20) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.264 ( -23.848 0.000 15.818) 28.617 1.266 ( -23.881 0.000 16.382) 28.960 1.793 ( -23.032 0.000 27.754) 36.066 2.833 ( -9.779 0.000 -9.064) 13.334 4.209 ( 9.967 -0.000 -3.011) 10.412 4.736 ( -1.449 0.000 -10.418) 10.518 4.937 ( 5.815 -0.000 2.195) 6.215 5.312 ( 12.017 -0.000 -2.931) 12.369 5.378 ( 10.714 -0.000 -5.067) 11.852 6.402 ( -6.086 0.000 -4.987) 7.868 6.481 ( -1.665 0.000 1.135) 2.015 6.578 ( 14.790 -0.000 10.028) 17.870 6.813 ( -1.335 0.000 -5.191) 5.360 7.061 ( 6.568 -0.000 -9.647) 11.670 7.170 ( 8.603 -0.000 1.156) 8.681 7.549 ( 3.434 -0.000 0.682) 3.501 7.839 ( 7.087 -0.000 2.245) 7.434 8.332 ( -5.157 0.000 8.370) 9.832 8.358 ( -3.808 0.000 -1.479) 4.085 8.584 ( -3.770 0.000 1.038) 3.910 8.655 ( 6.750 -0.000 -1.340) 6.881 9.547 ( -4.054 0.000 0.293) 4.064 9.823 ( 6.802 -0.000 -1.999) 7.090 10.107 ( -6.638 0.000 4.049) 7.776 11.461 ( -7.677 0.000 1.283) 7.784 11.604 ( -10.654 0.000 -0.109) 10.655 13.076 ( 5.792 -0.000 -2.133) 6.172 13.746 ( -3.280 0.000 2.424) 4.079 13.892 ( 1.419 -0.000 -2.157) 2.582 14.164 ( 4.141 -0.000 2.382) 4.777 16.440 ( -1.997 0.000 -3.567) 4.088 16.844 ( -12.850 0.000 5.140) 13.840 16.897 ( -9.622 0.000 -9.238) 13.339 17.496 ( -10.159 0.000 7.580) 12.675 20.809 ( 17.713 -0.000 -7.246) 19.138 22.675 ( -2.952 0.000 0.655) 3.024 ======================= Grid point 375 (169/336) ======================= q-point: ( 0.00 0.00 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.375 ( -3.762 0.000 20.206) 20.553 1.568 ( 12.788 -0.000 18.205) 22.247 2.109 ( -15.983 0.000 3.938) 16.461 2.721 ( 1.106 -0.000 30.530) 30.550 4.209 ( -2.320 0.000 -15.504) 15.677 4.610 ( 9.727 -0.000 4.481) 10.710 5.306 ( 5.416 -0.000 4.996) 7.368 5.469 ( 6.201 -0.000 -6.682) 9.116 5.486 ( 5.415 -0.000 -4.271) 6.897 6.075 ( -9.154 0.000 0.921) 9.201 6.358 ( -10.830 0.000 1.550) 10.940 6.716 ( 7.596 -0.000 5.292) 9.258 6.878 ( 4.652 -0.000 -8.824) 9.975 7.216 ( -0.863 0.000 -5.453) 5.521 7.401 ( 7.688 -0.000 3.891) 8.616 7.710 ( -0.567 0.000 1.938) 2.019 7.839 ( -14.055 0.000 2.394) 14.258 8.095 ( -3.037 0.000 -7.706) 8.283 8.424 ( 8.052 -0.000 3.733) 8.875 8.753 ( 9.244 -0.000 -5.495) 10.754 9.052 ( 4.971 -0.000 10.239) 11.382 9.530 ( 6.449 -0.000 -2.781) 7.023 9.655 ( -12.698 0.000 -6.778) 14.394 9.937 ( -1.285 0.000 2.025) 2.398 11.159 ( -5.072 0.000 -4.485) 6.771 11.306 ( 2.366 -0.000 1.161) 2.636 13.105 ( -0.512 0.000 -5.144) 5.170 13.730 ( -1.325 0.000 1.875) 2.296 13.873 ( -0.639 0.000 -1.584) 1.708 14.581 ( 1.266 -0.000 6.629) 6.749 16.493 ( -8.954 0.000 -0.142) 8.955 16.522 ( 7.056 -0.000 0.163) 7.058 17.017 ( 21.487 -0.000 1.846) 21.566 17.205 ( -11.271 0.000 -0.870) 11.305 20.933 ( -3.035 0.000 0.069) 3.036 22.558 ( -3.464 0.000 -0.047) 3.465 ======================= Grid point 376 (170/336) ======================= q-point: ( 0.09 0.00 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.584 ( 6.274 -9.863 17.477) 21.026 1.868 ( 0.877 -2.087 3.919) 4.526 2.073 ( 13.851 -4.103 16.566) 21.980 2.913 ( 2.791 0.072 23.126) 23.294 4.113 ( -0.493 -3.539 -13.866) 14.319 4.757 ( 5.456 0.965 3.577) 6.595 5.358 ( -2.506 1.001 2.552) 3.714 5.445 ( 4.178 8.054 -8.520) 12.447 5.583 ( 4.973 -5.175 -5.862) 9.267 5.917 ( -6.648 8.154 4.668) 11.510 6.253 ( -7.818 -5.919 4.736) 10.890 6.810 ( 2.872 5.225 2.285) 6.385 6.918 ( 3.049 -4.164 -5.149) 7.290 7.094 ( -4.606 7.256 -8.361) 11.991 7.407 ( -8.594 -3.392 -1.484) 9.357 7.661 ( -0.936 9.320 5.748) 10.990 7.778 ( 1.067 -2.185 6.324) 6.775 7.999 ( -2.230 0.743 -8.654) 8.967 8.476 ( -1.333 1.487 2.474) 3.180 8.808 ( 0.322 0.523 -9.502) 9.522 9.198 ( 5.189 -3.122 6.461) 8.855 9.529 ( 4.698 4.452 -1.485) 6.641 9.639 ( 4.296 -4.324 -1.621) 6.307 9.914 ( -4.031 -2.322 2.444) 5.255 11.142 ( 1.142 -7.773 -3.123) 8.455 11.432 ( 10.130 -3.419 1.177) 10.756 13.008 ( -5.996 2.632 -4.382) 7.879 13.730 ( -0.032 0.499 2.032) 2.093 13.847 ( -1.696 -0.610 -1.766) 2.523 14.556 ( -4.921 4.914 5.355) 8.777 16.338 ( -10.105 -5.630 -1.222) 11.632 16.743 ( 15.666 -0.709 1.950) 15.803 17.021 ( -9.099 -4.072 -3.706) 10.635 17.499 ( 30.435 -4.386 -1.567) 30.790 20.770 ( -12.771 8.197 2.934) 15.457 22.502 ( -3.576 0.046 0.144) 3.579 ======================= Grid point 377 (171/336) ======================= q-point: ( 0.18 0.00 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.709 ( -3.182 3.202 3.241) 5.557 2.053 ( 9.457 -14.431 12.449) 21.276 2.528 ( 17.252 -6.070 15.521) 23.987 3.109 ( 8.480 -1.530 11.616) 14.463 4.093 ( 1.831 -5.989 -10.803) 12.487 4.782 ( -1.535 2.204 -2.731) 3.830 5.213 ( -13.069 3.850 0.513) 13.634 5.390 ( 5.063 7.700 -7.816) 12.084 5.658 ( 3.324 -2.344 -4.766) 6.266 5.809 ( -1.468 7.875 7.937) 11.276 6.254 ( -4.931 -7.756 5.337) 10.628 6.748 ( -5.587 8.604 0.845) 10.294 6.854 ( -4.015 9.268 -6.152) 11.827 6.967 ( 1.147 -2.650 -7.859) 8.372 7.244 ( -11.710 -5.588 -6.836) 14.666 7.643 ( 4.163 11.475 5.557) 13.412 7.872 ( 4.734 0.952 7.761) 9.140 7.926 ( -0.722 -0.003 -4.959) 5.012 8.429 ( -3.318 1.217 -0.037) 3.534 8.678 ( -7.672 -3.415 -9.569) 12.731 9.339 ( 3.114 -5.338 2.973) 6.857 9.551 ( 1.666 5.374 -4.376) 7.128 9.747 ( 4.078 -0.603 4.018) 5.757 9.931 ( 2.951 -4.080 3.487) 6.125 11.275 ( 6.035 -8.588 -0.488) 10.508 11.695 ( 13.031 -8.665 3.908) 16.130 12.834 ( -7.898 3.730 -4.182) 9.684 13.735 ( 0.084 1.908 1.959) 2.735 13.808 ( -2.577 -0.936 -1.736) 3.245 14.431 ( -6.738 5.928 3.252) 9.546 16.261 ( -6.478 -8.295 -1.694) 10.660 16.919 ( -5.720 -6.190 -4.829) 9.713 17.047 ( 17.945 -0.986 3.420) 18.294 18.021 ( 28.227 -6.791 -1.379) 29.065 20.430 ( -17.968 13.843 2.090) 22.778 22.449 ( -3.084 -0.459 0.231) 3.126 ======================= Grid point 378 (172/336) ======================= q-point: ( 0.27 0.00 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.605 ( -4.750 5.633 -0.745) 7.406 2.417 ( 10.874 -10.490 9.918) 18.074 2.852 ( 5.787 -4.137 15.568) 17.116 3.345 ( 11.213 -4.180 -0.119) 11.968 4.154 ( 4.541 -7.398 -6.781) 11.016 4.640 ( -7.704 2.455 -9.764) 12.678 4.922 ( -16.506 6.322 1.312) 17.724 5.368 ( 5.718 7.189 -6.680) 11.358 5.633 ( -0.739 5.832 -4.487) 7.396 5.839 ( 1.589 -0.199 10.310) 10.434 6.269 ( -4.830 -5.897 1.729) 7.816 6.468 ( -11.399 11.407 -4.660) 16.786 6.753 ( 2.673 9.314 -2.194) 9.935 6.955 ( -0.483 -3.688 -5.426) 6.579 7.090 ( -8.366 -7.115 -10.266) 15.033 7.624 ( 2.571 7.439 2.026) 8.127 7.900 ( 0.503 2.330 -1.731) 2.946 8.008 ( 8.248 4.195 8.473) 12.546 8.357 ( -3.336 -1.809 -4.978) 6.259 8.571 ( -6.201 -5.162 -1.805) 8.268 9.405 ( -4.776 -1.473 -5.107) 7.146 9.442 ( -1.744 -0.701 -2.894) 3.451 9.798 ( 0.348 -0.752 2.998) 3.110 10.121 ( 10.720 -0.680 7.646) 13.185 11.453 ( 7.068 -5.508 0.193) 8.963 12.022 ( 9.100 -10.688 10.624) 17.605 12.662 ( -4.658 2.697 -6.243) 8.243 13.704 ( -2.109 2.605 0.426) 3.379 13.770 ( -1.850 0.389 -0.818) 2.060 14.293 ( -5.761 3.843 1.335) 7.053 16.266 ( -2.368 -9.988 -1.597) 10.389 16.874 ( -4.317 -7.668 -5.026) 10.134 17.369 ( 18.642 1.592 4.661) 19.281 18.497 ( 21.513 -7.597 3.370) 23.062 19.977 ( -19.999 16.449 -2.862) 26.053 22.425 ( -1.213 -1.609 0.614) 2.106 ======================= Grid point 379 (173/336) ======================= q-point: ( 0.36 0.00 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.459 ( -4.667 5.634 -3.187) 7.979 2.678 ( 6.282 -4.107 5.480) 9.293 3.017 ( 0.808 -3.015 12.020) 12.419 3.476 ( 1.965 -2.816 -4.111) 5.357 4.271 ( 2.946 -4.896 -5.242) 7.754 4.428 ( -5.990 -2.488 -11.013) 12.781 4.630 ( -12.631 6.138 3.094) 14.380 5.344 ( 5.306 7.726 -7.749) 12.162 5.504 ( -2.514 8.899 -4.774) 10.407 5.887 ( -4.353 2.538 6.003) 7.837 6.202 ( -9.783 -1.556 4.221) 10.768 6.252 ( 1.118 1.700 -7.728) 7.991 6.701 ( 5.072 10.279 -6.229) 13.045 6.933 ( -8.135 -7.715 -5.780) 12.614 7.037 ( 2.627 -6.644 -3.300) 7.870 7.629 ( 2.816 3.226 1.769) 4.633 7.864 ( 0.766 6.005 -0.702) 6.095 8.136 ( 8.157 4.889 3.478) 10.126 8.325 ( -0.405 -3.885 -3.554) 5.281 8.534 ( -5.543 -5.109 2.644) 7.989 9.199 ( -8.548 2.248 -12.575) 15.370 9.467 ( -2.385 -5.045 2.839) 6.261 9.826 ( 1.135 -0.455 0.038) 1.223 10.322 ( 7.661 0.900 8.202) 11.260 11.585 ( 4.289 -2.302 0.287) 4.876 12.223 ( -5.099 -3.849 15.562) 16.822 12.632 ( 7.125 -4.366 -7.356) 11.133 13.646 ( -2.033 1.798 -0.124) 2.717 13.719 ( -1.423 2.485 -2.153) 3.583 14.207 ( -3.205 0.559 1.103) 3.435 16.343 ( 0.401 -11.020 -1.531) 11.133 16.858 ( -3.053 -7.169 -3.714) 8.632 17.653 ( 16.421 5.133 5.213) 17.977 18.864 ( 7.928 -4.371 14.285) 16.912 19.487 ( -14.086 13.068 -14.369) 23.993 22.452 ( 1.410 -2.798 1.000) 3.290 ======================= Grid point 380 (174/336) ======================= q-point: (-0.55 0.00 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.341 ( -2.342 1.393 -3.708) 4.602 2.724 ( -4.285 3.487 0.828) 5.586 3.069 ( -4.919 -1.650 6.796) 8.550 3.449 ( -3.388 -0.285 0.088) 3.401 4.126 ( -8.122 -0.065 -11.976) 14.471 4.457 ( -3.515 -3.702 -2.528) 5.696 4.534 ( 6.232 -2.754 2.531) 7.268 5.288 ( 3.170 8.699 -10.621) 14.089 5.361 ( 0.162 10.537 -1.971) 10.721 5.765 ( -4.129 4.203 -1.011) 5.978 6.126 ( -7.027 -3.938 4.203) 9.086 6.282 ( 3.975 -2.679 -4.154) 6.343 6.634 ( -0.397 3.284 -9.676) 10.226 6.853 ( -1.344 -2.897 -5.345) 6.227 7.174 ( 3.996 -7.078 3.637) 8.904 7.667 ( 2.884 1.292 1.502) 3.499 7.814 ( 2.147 8.653 0.376) 8.923 8.221 ( 6.027 1.273 -3.033) 6.866 8.353 ( 2.005 -0.093 -0.583) 2.090 8.500 ( -7.702 -6.232 2.399) 10.194 8.978 ( -6.647 2.047 -10.556) 12.641 9.496 ( -1.430 -4.322 2.985) 5.443 9.836 ( 0.672 0.525 -2.046) 2.217 10.437 ( 2.694 1.746 6.164) 6.950 11.633 ( -0.254 -0.421 1.332) 1.420 12.178 ( -9.650 0.405 11.198) 14.788 12.804 ( 7.305 -6.857 -0.606) 10.037 13.617 ( 0.422 1.397 0.309) 1.492 13.675 ( 1.435 1.081 -4.751) 5.079 14.181 ( -1.755 -0.901 1.548) 2.508 16.441 ( -0.283 -10.568 -2.490) 10.861 16.870 ( -0.866 -5.745 -0.871) 5.875 17.848 ( 11.720 9.060 5.350) 15.750 18.756 ( -23.677 14.310 13.668) 30.857 19.383 ( 13.521 -8.087 -14.687) 21.538 22.525 ( 3.102 -3.197 0.828) 4.531 ======================= Grid point 381 (175/336) ======================= q-point: (-0.45 0.00 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.334 ( 0.011 -6.747 -0.898) 6.806 2.496 ( -15.648 7.855 -0.682) 17.523 2.974 ( -9.325 2.685 4.027) 10.506 3.407 ( -4.286 2.084 6.718) 8.237 3.963 ( -4.392 -1.994 -10.898) 11.918 4.477 ( 3.210 -4.344 -1.590) 5.631 4.680 ( 5.566 -4.449 -1.328) 7.248 5.183 ( 3.277 8.542 -8.463) 12.463 5.276 ( 1.715 11.557 -0.962) 11.723 5.736 ( 3.993 0.108 0.170) 3.998 6.119 ( -2.191 -6.416 3.926) 7.835 6.341 ( 3.699 -3.513 -6.072) 7.930 6.513 ( -6.303 -4.316 -10.511) 12.993 6.890 ( 6.566 1.263 -2.251) 7.055 7.287 ( -0.141 -3.171 4.105) 5.189 7.702 ( 2.465 1.770 0.317) 3.051 7.786 ( 3.598 8.475 1.557) 9.337 8.269 ( 3.022 -1.375 -5.766) 6.653 8.344 ( -2.627 -0.499 -3.303) 4.250 8.455 ( -4.540 -5.729 1.448) 7.452 8.844 ( -1.964 3.056 -3.477) 5.028 9.545 ( 1.508 -3.073 1.979) 3.954 9.808 ( -1.095 1.683 -3.026) 3.632 10.456 ( -1.367 2.327 3.997) 4.823 11.618 ( -3.259 -0.760 2.572) 4.220 12.075 ( -10.844 0.101 10.435) 15.050 12.941 ( 3.180 -3.837 0.963) 5.076 13.637 ( 2.620 0.366 0.731) 2.744 13.696 ( 5.318 -0.760 -6.553) 8.474 14.173 ( -1.641 -0.578 1.655) 2.402 16.476 ( -3.737 -7.740 -3.849) 9.417 16.934 ( 1.970 -4.602 1.687) 5.283 17.893 ( 1.433 13.208 3.855) 13.833 18.316 ( -19.129 12.184 7.947) 24.032 19.635 ( 13.389 -11.053 -8.160) 19.184 22.607 ( 2.977 -2.614 -0.024) 3.962 ======================= Grid point 382 (176/336) ======================= q-point: (-0.36 0.00 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.415 ( -4.846 -13.515 2.253) 14.534 2.162 ( -16.177 7.763 8.431) 19.825 2.795 ( -8.941 7.670 1.794) 11.916 3.305 ( -11.787 5.624 11.191) 17.198 3.902 ( 1.673 -2.696 -7.961) 8.570 4.592 ( 6.422 -5.056 -3.662) 8.956 4.772 ( 4.485 -2.345 -4.325) 6.658 5.157 ( 5.033 4.520 -6.906) 9.667 5.182 ( 1.932 11.539 2.032) 11.875 5.894 ( 11.653 -4.793 2.926) 12.935 6.221 ( 1.413 -8.374 4.676) 9.695 6.361 ( -0.695 -4.077 -9.769) 10.609 6.465 ( 2.381 -8.021 -6.785) 10.772 6.964 ( 5.745 3.137 -3.473) 7.410 7.269 ( -3.343 2.837 1.630) 4.677 7.710 ( 1.926 4.275 -1.778) 5.014 7.773 ( 1.825 5.853 2.260) 6.535 8.272 ( -3.329 -7.419 -1.620) 8.292 8.307 ( -1.464 -4.671 -5.015) 7.008 8.477 ( 2.230 -0.510 1.091) 2.534 8.789 ( -0.245 4.663 0.777) 4.734 9.620 ( 4.980 -0.379 -1.918) 5.350 9.740 ( -3.360 1.555 -0.525) 3.739 10.410 ( -3.961 2.732 3.203) 5.780 11.580 ( -5.149 -2.087 1.938) 5.884 11.961 ( -11.894 -1.175 11.248) 16.412 12.998 ( 1.712 -0.517 -1.037) 2.067 13.693 ( 2.991 -1.401 0.173) 3.307 13.763 ( 6.707 -0.238 -5.922) 8.951 14.157 ( -1.575 0.328 1.722) 2.356 16.435 ( -4.943 -4.479 -3.781) 7.668 17.004 ( 0.753 -2.052 0.141) 2.190 17.664 ( -13.165 13.546 2.778) 19.093 18.078 ( -7.585 9.347 9.521) 15.347 19.911 ( 13.933 -11.720 -7.587) 19.724 22.661 ( 1.604 -1.621 -1.113) 2.537 ======================= Grid point 383 (177/336) ======================= q-point: (-0.27 0.00 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.379 ( -17.157 -12.709 4.898) 21.906 2.030 ( -6.534 4.073 24.510) 25.691 2.555 ( -9.583 12.971 -0.364) 16.132 3.063 ( -19.266 5.754 11.463) 23.145 3.976 ( 8.387 -2.095 -2.469) 8.991 4.679 ( 4.643 1.104 -10.274) 11.328 4.839 ( 5.484 -1.226 -1.810) 5.903 5.111 ( 2.060 1.534 -0.887) 2.718 5.239 ( 8.423 3.624 -0.489) 9.183 6.213 ( 14.420 -9.714 4.696) 18.010 6.269 ( -3.439 -7.580 -3.478) 9.021 6.402 ( 3.235 -5.888 -0.722) 6.757 6.619 ( 10.613 -8.173 -4.968) 14.287 6.930 ( -1.143 5.764 -5.581) 8.105 7.199 ( -0.317 4.476 -2.162) 4.981 7.662 ( 2.906 8.212 -3.057) 9.232 7.798 ( 3.513 1.503 4.329) 5.774 8.289 ( -4.530 -6.026 0.111) 7.540 8.299 ( -5.172 -10.901 -2.133) 12.253 8.557 ( 7.554 1.531 2.257) 8.031 8.743 ( -0.616 5.539 1.837) 5.868 9.606 ( 0.209 4.864 -8.073) 9.427 9.751 ( 2.687 -1.611 5.145) 6.024 10.320 ( -6.332 2.852 2.809) 7.492 11.503 ( -8.001 -2.867 -0.309) 8.504 11.853 ( -11.343 -0.655 9.926) 15.087 13.005 ( 2.311 1.415 -4.068) 4.888 13.747 ( 1.054 -2.640 -0.293) 2.858 13.834 ( 5.988 1.454 -3.356) 7.017 14.152 ( 0.506 0.233 2.658) 2.716 16.376 ( -3.144 -2.165 -3.149) 4.949 16.964 ( -4.214 2.156 -3.934) 6.155 17.360 ( -12.565 11.150 4.836) 17.481 17.916 ( -10.244 8.235 8.596) 15.705 20.218 ( 15.886 -12.214 -6.543) 21.080 22.675 ( -0.076 -0.856 -1.846) 2.036 ======================= Grid point 384 (178/336) ======================= q-point: (-0.18 0.00 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.262 ( -16.186 -11.566 14.090) 24.378 1.965 ( -13.936 18.476 19.996) 30.585 2.357 ( -3.295 4.187 15.405) 16.301 2.752 ( -21.168 2.459 7.018) 22.436 4.162 ( 12.027 -1.960 1.429) 12.269 4.572 ( -0.892 7.532 -15.357) 17.128 4.975 ( 7.777 -2.687 3.339) 8.880 5.203 ( 6.620 -4.927 -1.600) 8.406 5.345 ( 8.233 2.234 -0.906) 8.579 6.251 ( -4.681 -6.865 -2.157) 8.585 6.424 ( 0.116 -8.076 -0.439) 8.089 6.634 ( 8.807 -8.618 3.354) 12.771 6.789 ( 5.051 3.108 -1.586) 6.139 6.867 ( 9.293 -0.745 -5.913) 11.040 7.154 ( 2.657 1.993 -4.354) 5.477 7.649 ( 5.604 6.404 -1.285) 8.606 7.919 ( 9.109 0.586 5.641) 10.731 8.254 ( -4.186 -4.632 -5.502) 8.322 8.263 ( -11.336 -9.789 1.121) 15.019 8.687 ( 1.880 5.083 0.646) 5.458 8.721 ( 6.621 -0.127 7.901) 10.309 9.516 ( 0.050 4.084 -6.026) 7.279 9.846 ( 4.335 -0.139 3.054) 5.305 10.177 ( -10.101 2.396 0.435) 10.390 11.386 ( -8.811 -3.122 -1.386) 9.450 11.686 ( -12.464 5.817 3.041) 14.086 13.022 ( 4.523 -0.152 -4.718) 6.538 13.765 ( -1.724 -2.051 0.766) 2.787 13.878 ( 3.510 2.217 -1.878) 4.556 14.233 ( 5.805 -2.280 5.776) 8.500 16.350 ( 0.731 -0.643 -2.502) 2.684 16.829 ( -4.280 3.833 -2.845) 6.411 17.078 ( -13.131 12.017 3.056) 18.060 17.695 ( -14.190 6.013 6.042) 16.553 20.561 ( 15.971 -12.047 -4.510) 20.508 22.656 ( -1.669 -0.478 -1.800) 2.501 ======================= Grid point 385 (179/336) ======================= q-point: (-0.09 0.00 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.286 ( -5.593 -9.420 19.655) 22.502 1.595 ( -14.365 22.612 17.030) 31.744 2.387 ( -15.630 0.077 0.481) 15.637 2.529 ( -4.387 0.661 32.254) 32.557 4.351 ( 1.205 0.072 -10.081) 10.153 4.422 ( 8.132 3.355 -2.686) 9.198 5.154 ( 8.064 -1.753 5.137) 9.720 5.350 ( 6.819 -5.631 -3.738) 9.601 5.437 ( 7.339 3.090 -2.609) 8.379 6.192 ( -8.460 -5.374 -1.321) 10.109 6.499 ( -2.935 -5.447 0.415) 6.202 6.602 ( -1.270 3.850 2.182) 4.604 6.865 ( 5.336 2.210 -8.819) 10.542 7.118 ( 13.866 -6.747 1.750) 15.520 7.225 ( 7.009 -0.608 -1.152) 7.129 7.686 ( 3.915 2.501 0.343) 4.659 8.048 ( -8.733 -0.322 3.590) 9.447 8.188 ( -4.116 -2.467 -5.111) 7.011 8.209 ( 7.462 -4.827 -0.197) 8.889 8.676 ( 2.726 1.100 -1.106) 3.140 8.901 ( 6.820 0.549 10.738) 12.732 9.478 ( 3.295 1.979 -4.797) 6.147 9.912 ( -0.530 -0.063 0.685) 0.868 9.949 ( -11.944 2.349 -3.085) 12.557 11.282 ( -5.574 -1.309 -1.768) 5.992 11.407 ( -11.058 8.891 -1.258) 14.245 13.087 ( 4.601 -1.983 -4.781) 6.925 13.748 ( -2.445 -0.610 1.678) 3.027 13.886 ( 1.005 1.180 -1.648) 2.262 14.431 ( 7.954 -4.121 7.901) 11.944 16.390 ( 5.710 0.174 -1.706) 5.961 16.751 ( -12.357 5.704 1.523) 13.695 16.800 ( 3.855 6.653 1.650) 7.864 17.438 ( -14.980 3.334 2.448) 15.540 20.850 ( 9.225 -8.194 -2.870) 12.668 22.613 ( -2.964 -0.228 -0.920) 3.112 ======================= Grid point 387 (180/336) ======================= q-point: ( 0.09 0.09 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.805 ( -4.446 0.000 2.109) 4.921 1.843 ( 15.601 -0.000 16.217) 22.503 2.471 ( 18.985 -0.000 15.431) 24.465 3.098 ( 7.072 -0.000 12.805) 14.628 4.034 ( 2.131 -0.000 -10.893) 11.100 4.804 ( -1.477 0.000 -2.548) 2.945 5.247 ( -12.310 0.000 0.369) 12.316 5.487 ( 2.808 -0.000 -8.875) 9.308 5.605 ( 5.634 -0.000 -4.904) 7.469 5.932 ( -2.445 0.000 9.121) 9.443 6.143 ( -5.506 0.000 4.998) 7.436 6.864 ( -4.379 0.000 2.290) 4.942 6.875 ( -0.091 0.000 -4.431) 4.432 7.007 ( -0.676 0.000 -12.694) 12.712 7.160 ( -15.728 0.000 -3.668) 16.150 7.816 ( 0.334 -0.000 -1.470) 1.508 7.825 ( 6.649 -0.000 13.221) 14.799 7.928 ( -0.174 0.000 -2.973) 2.978 8.437 ( -4.985 0.000 0.309) 4.995 8.646 ( -8.203 0.000 -11.959) 14.502 9.282 ( 3.757 -0.000 2.637) 4.590 9.609 ( -1.096 0.000 -7.739) 7.816 9.789 ( 16.383 -0.000 6.152) 17.500 9.836 ( -5.382 0.000 4.381) 6.939 11.191 ( 9.445 -0.000 0.513) 9.459 11.612 ( 12.607 -0.000 2.824) 12.920 12.870 ( -9.080 0.000 -3.448) 9.712 13.754 ( 0.952 -0.000 2.345) 2.531 13.800 ( -2.494 0.000 -2.316) 3.403 14.491 ( -8.510 0.000 3.004) 9.025 16.174 ( -6.069 0.000 -1.263) 6.199 16.859 ( -5.792 0.000 -4.147) 7.123 17.044 ( 20.158 -0.000 2.778) 20.349 17.952 ( 28.673 -0.000 -1.360) 28.705 20.564 ( -18.983 0.000 1.655) 19.055 22.445 ( -3.448 0.000 0.155) 3.451 ======================= Grid point 388 (181/336) ======================= q-point: ( 0.18 0.09 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.722 ( -3.861 5.238 1.498) 6.677 2.237 ( 16.057 -7.024 12.087) 21.290 2.797 ( 8.379 -1.566 16.134) 18.247 3.295 ( 10.894 -1.248 0.111) 10.966 4.048 ( 4.585 -3.185 -7.392) 9.263 4.675 ( -8.162 1.103 -10.648) 13.462 4.996 ( -17.277 1.771 0.853) 17.388 5.481 ( 4.737 4.029 -6.365) 8.899 5.656 ( 1.999 -1.502 -4.413) 5.072 5.932 ( 0.363 7.969 10.267) 13.001 6.137 ( -4.147 -7.612 3.968) 9.533 6.679 ( -10.588 9.933 -4.063) 15.076 6.838 ( -3.145 0.343 0.766) 3.255 6.905 ( -10.257 -5.303 -5.830) 12.935 6.986 ( 2.445 -0.615 -12.329) 12.585 7.735 ( -0.741 3.290 -8.323) 8.980 7.944 ( 1.667 2.897 4.256) 5.412 8.047 ( 7.973 -0.469 13.054) 15.303 8.324 ( -6.214 -1.194 -7.082) 9.497 8.502 ( -5.013 -1.960 -1.870) 5.698 9.331 ( -1.593 -2.713 0.056) 3.147 9.488 ( -4.136 1.849 -10.882) 11.787 9.797 ( -1.553 0.442 4.298) 4.591 10.095 ( 13.645 -1.460 7.611) 15.692 11.395 ( 12.391 -1.052 2.529) 12.691 11.860 ( 10.701 -5.272 7.446) 14.063 12.697 ( -8.397 0.959 -3.984) 9.344 13.735 ( -2.868 0.754 -2.595) 3.940 13.784 ( 0.874 0.711 2.284) 2.546 14.346 ( -9.078 1.577 0.560) 9.231 16.124 ( -2.131 -4.309 -0.770) 4.869 16.778 ( -3.171 -2.575 -3.746) 5.543 17.405 ( 22.756 1.454 3.125) 23.015 18.383 ( 22.172 -3.662 2.266) 22.587 20.193 ( -22.898 6.096 -2.608) 23.839 22.404 ( -1.895 -0.585 0.480) 2.041 ======================= Grid point 389 (182/336) ======================= q-point: ( 0.27 0.09 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.595 ( -4.830 7.545 -0.268) 8.963 2.590 ( 12.405 -4.919 7.756) 15.435 2.978 ( 1.784 -1.193 14.110) 14.272 3.423 ( 4.287 -2.265 -6.099) 7.792 4.147 ( 6.260 -6.310 -4.720) 10.064 4.429 ( -10.322 1.459 -14.464) 17.829 4.709 ( -16.148 2.108 2.766) 16.519 5.474 ( 5.197 5.731 -7.826) 11.004 5.615 ( -3.391 2.415 -2.728) 4.977 5.937 ( -0.738 4.315 7.017) 8.270 6.149 ( -4.501 -3.798 2.246) 6.303 6.380 ( -7.357 9.999 -6.214) 13.882 6.760 ( -9.996 -6.987 -6.434) 13.789 6.843 ( -0.355 -2.708 4.657) 5.399 6.974 ( 7.059 3.253 -12.807) 14.981 7.672 ( 1.067 1.055 -5.950) 6.136 7.953 ( 1.024 4.162 2.631) 5.029 8.182 ( 0.396 -0.574 -2.220) 2.327 8.275 ( 3.364 -1.680 5.013) 6.267 8.467 ( -2.943 -1.333 3.841) 5.019 9.209 ( -10.018 -1.428 -12.151) 15.813 9.415 ( -0.398 -0.296 0.611) 0.787 9.815 ( 1.042 -0.540 1.370) 1.804 10.330 ( 8.999 -0.002 6.996) 11.399 11.591 ( 10.138 2.414 1.949) 10.602 12.103 ( 1.412 -7.827 14.639) 16.660 12.569 ( -2.497 -1.992 -6.596) 7.329 13.670 ( -1.590 0.882 -3.248) 3.722 13.786 ( 0.004 3.601 1.792) 4.023 14.207 ( -6.662 -0.343 -0.311) 6.678 16.169 ( 1.082 -6.960 -0.106) 7.044 16.752 ( -1.646 -3.972 -2.426) 4.937 17.760 ( 22.492 5.444 2.879) 23.320 18.749 ( 13.229 -6.267 8.525) 16.939 19.704 ( -23.839 8.835 -9.353) 27.090 22.410 ( 0.940 -1.618 1.010) 2.126 ======================= Grid point 390 (183/336) ======================= q-point: ( 0.36 0.09 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.437 ( -4.302 7.640 -2.188) 9.037 2.778 ( 3.741 1.992 2.465) 4.903 3.044 ( -3.601 -0.931 8.105) 8.918 3.420 ( -2.545 -2.325 -1.039) 3.600 4.146 ( -7.640 2.114 -14.235) 16.293 4.300 ( 2.043 -9.070 -4.637) 10.390 4.527 ( -6.376 -1.066 3.733) 7.465 5.429 ( 1.411 6.261 -9.430) 11.406 5.521 ( 0.079 5.631 -1.441) 5.813 5.840 ( -7.279 3.916 -0.170) 8.267 6.093 ( -5.492 -0.217 2.028) 5.859 6.269 ( 3.364 2.059 -5.003) 6.371 6.603 ( -10.114 -4.067 -8.164) 13.619 6.911 ( 6.154 4.330 0.079) 7.525 7.038 ( 6.098 -5.205 -1.793) 8.216 7.672 ( 1.805 -0.834 -2.599) 3.272 7.939 ( 1.707 4.897 0.488) 5.209 8.177 ( 1.125 -3.564 -6.018) 7.084 8.364 ( -2.271 -3.952 4.157) 6.169 8.466 ( 1.561 5.488 6.004) 8.282 8.985 ( -8.613 -1.544 -12.023) 14.870 9.437 ( 0.214 -1.629 3.614) 3.970 9.840 ( 1.386 0.012 -1.294) 1.897 10.463 ( 3.685 0.978 4.763) 6.101 11.683 ( 4.592 5.524 1.723) 7.388 12.165 ( -9.343 -2.155 13.638) 16.671 12.619 ( 3.331 -11.080 -2.871) 11.921 13.644 ( 2.518 0.952 -3.808) 4.664 13.743 ( -0.086 5.550 0.289) 5.558 14.146 ( -3.386 -2.704 0.823) 4.410 16.269 ( 2.133 -7.487 0.122) 7.786 16.768 ( -0.351 -4.771 -0.111) 4.786 18.037 ( 18.668 10.479 2.309) 21.532 18.942 ( -13.464 3.407 20.634) 24.873 19.262 ( -3.150 -2.691 -22.180) 22.564 22.472 ( 3.322 -2.354 1.217) 4.249 ======================= Grid point 391 (184/336) ======================= q-point: (-0.55 0.09 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.315 ( -1.633 4.021 -2.676) 5.099 2.658 ( -10.827 9.060 -2.622) 14.359 2.999 ( -7.008 0.492 6.439) 9.529 3.417 ( -2.613 -1.112 6.867) 7.431 3.950 ( -3.937 0.670 -12.244) 12.879 4.361 ( 0.280 -7.586 -1.760) 7.793 4.574 ( 3.229 -6.815 -0.825) 7.586 5.309 ( -0.717 5.092 -9.390) 10.706 5.485 ( 3.373 9.047 -1.825) 9.827 5.738 ( -1.187 0.381 -0.133) 1.254 6.038 ( -3.269 -2.422 2.571) 4.813 6.299 ( 4.458 -0.865 -7.502) 8.770 6.430 ( -9.019 -2.604 -6.704) 11.536 6.974 ( 9.603 6.552 -2.777) 11.953 7.187 ( 2.178 -6.894 4.994) 8.787 7.699 ( 1.160 -1.496 -0.905) 2.098 7.928 ( 2.932 5.111 -0.993) 5.976 8.201 ( 1.437 -3.942 -6.048) 7.361 8.298 ( -10.013 -3.390 -1.891) 10.739 8.484 ( 3.807 6.408 3.565) 8.262 8.859 ( -2.885 -1.700 -4.112) 5.303 9.497 ( 2.351 -1.848 4.083) 5.061 9.835 ( 0.321 1.279 -3.337) 3.588 10.494 ( -0.684 1.655 2.660) 3.207 11.671 ( -0.153 6.199 2.545) 6.703 12.071 ( -11.821 -0.505 9.975) 15.476 12.770 ( 0.651 -13.075 1.443) 13.171 13.688 ( 6.511 0.513 -4.818) 8.116 13.707 ( 2.300 5.188 -0.085) 5.675 14.139 ( -2.168 -2.821 1.718) 3.952 16.352 ( 0.291 -5.312 -0.308) 5.329 16.835 ( 1.580 -5.596 2.630) 6.382 18.159 ( 8.491 14.903 -0.312) 17.155 18.538 ( -23.580 10.888 6.709) 26.825 19.404 ( 10.081 -13.394 -7.044) 18.183 22.560 ( 3.734 -2.254 0.759) 4.427 ======================= Grid point 392 (185/336) ======================= q-point: (-0.45 0.09 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.276 ( -1.125 -1.156 -1.184) 2.001 2.340 ( -14.494 10.773 4.399) 18.587 2.890 ( -8.604 3.521 5.507) 10.805 3.393 ( -7.066 2.842 9.333) 12.046 3.874 ( 2.399 -0.321 -7.406) 7.792 4.467 ( 4.624 -8.006 -1.233) 9.327 4.681 ( 3.227 -7.213 -3.932) 8.826 5.232 ( 2.836 2.832 -8.781) 9.653 5.407 ( 0.349 11.025 -2.543) 11.319 5.798 ( 5.543 -4.788 0.864) 7.375 6.090 ( 1.043 -5.670 5.730) 8.128 6.277 ( -3.398 -4.042 -11.082) 12.276 6.365 ( 3.969 -1.743 -3.262) 5.425 7.049 ( 8.220 5.878 -3.837) 10.809 7.261 ( -2.582 -3.258 4.406) 6.058 7.716 ( 0.075 -1.047 -1.036) 1.475 7.926 ( 3.290 4.714 -1.213) 5.875 8.142 ( -8.083 -2.736 -3.726) 9.311 8.219 ( -1.015 -4.664 -4.553) 6.597 8.518 ( 4.269 3.585 2.757) 6.220 8.836 ( -0.528 0.292 0.204) 0.637 9.595 ( 4.703 -1.715 3.827) 6.301 9.784 ( -1.092 2.855 -4.748) 5.647 10.456 ( -3.438 2.135 2.160) 4.587 11.611 ( -2.062 5.435 2.126) 6.190 11.935 ( -13.325 -1.563 10.274) 16.899 12.890 ( -0.458 -10.286 1.377) 10.388 13.707 ( 3.203 1.827 -3.329) 4.967 13.781 ( 8.563 2.294 -2.536) 9.221 14.139 ( -2.137 -2.000 1.965) 3.525 16.371 ( -1.634 -2.116 -0.194) 2.680 16.937 ( 1.779 -4.900 3.094) 6.062 17.926 ( -14.732 13.776 -2.965) 20.386 18.279 ( -4.633 11.893 8.202) 15.171 19.665 ( 11.116 -14.301 -6.233) 19.155 22.630 ( 2.315 -1.557 -0.167) 2.795 ======================= Grid point 393 (186/336) ======================= q-point: (-0.36 0.09 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.238 ( -6.149 -1.653 1.488) 6.539 2.141 ( -6.724 8.065 19.816) 22.427 2.728 ( -8.953 6.200 2.289) 11.128 3.218 ( -15.439 9.047 10.527) 20.761 3.946 ( 8.590 -0.892 -1.137) 8.711 4.621 ( 6.797 -6.423 -3.102) 9.853 4.771 ( 3.664 -6.290 -4.173) 8.390 5.201 ( 1.449 5.796 -7.346) 9.469 5.313 ( 2.457 4.234 -2.485) 5.490 6.006 ( 9.170 -10.929 1.122) 14.311 6.144 ( -3.041 -4.675 -0.430) 5.594 6.285 ( 3.011 -6.729 -2.001) 7.638 6.496 ( 11.245 -4.828 -2.425) 12.475 7.032 ( -1.275 5.028 -5.314) 7.426 7.252 ( 0.141 1.457 -0.698) 1.621 7.715 ( -0.124 -0.761 -1.603) 1.779 7.920 ( 4.004 7.144 -0.298) 8.195 8.077 ( -6.224 -8.390 1.956) 10.628 8.208 ( -2.243 -4.477 -4.738) 6.894 8.595 ( 6.174 2.217 3.989) 7.678 8.815 ( -1.296 1.993 0.534) 2.437 9.696 ( -3.244 2.731 -1.880) 4.639 9.720 ( 7.537 0.164 0.111) 7.540 10.372 ( -6.075 2.598 2.185) 6.959 11.520 ( -4.254 4.750 -0.290) 6.383 11.824 ( -10.600 -2.179 12.028) 16.180 12.964 ( 0.114 -5.950 -0.989) 6.033 13.722 ( 2.135 -0.151 -4.020) 4.554 13.878 ( 7.893 3.010 -2.013) 8.684 14.136 ( -1.703 -1.803 2.360) 3.424 16.355 ( -1.117 0.176 0.571) 1.267 16.980 ( -1.677 -0.820 -0.293) 1.890 17.575 ( -12.531 11.235 1.702) 16.916 18.115 ( -7.541 12.630 5.449) 15.687 19.953 ( 12.247 -15.474 -6.212) 20.689 22.658 ( 0.204 -0.895 -1.024) 1.375 ======================= Grid point 394 (187/336) ======================= q-point: (-0.27 0.09 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.169 ( -4.202 1.843 10.130) 11.121 2.180 ( -2.195 6.443 29.008) 29.796 2.516 ( -8.133 9.715 0.424) 12.677 2.880 ( -21.468 11.893 12.033) 27.333 4.128 ( 11.278 -1.397 2.831) 11.711 4.691 ( 3.016 2.601 -13.766) 14.330 4.893 ( 6.196 -6.069 1.941) 8.887 5.139 ( 1.646 0.057 -2.146) 2.705 5.368 ( 6.196 -0.715 -2.502) 6.720 6.095 ( -5.755 -8.214 -2.803) 10.413 6.271 ( 5.423 -7.794 0.271) 9.499 6.449 ( 9.729 -10.113 1.321) 14.095 6.759 ( 13.913 -7.050 0.251) 15.599 6.890 ( -5.533 4.113 -4.062) 8.002 7.223 ( 2.055 4.479 -6.352) 8.039 7.713 ( 1.437 -0.018 -2.412) 2.808 7.954 ( 3.984 0.158 1.856) 4.398 8.074 ( -5.728 -5.748 4.137) 9.108 8.176 ( -2.797 -3.780 -4.833) 6.743 8.717 ( 3.705 -0.386 6.659) 7.631 8.774 ( 1.685 3.803 1.055) 4.291 9.602 ( -1.210 4.475 -3.925) 6.074 9.842 ( 6.035 -0.279 1.856) 6.320 10.227 ( -10.141 2.814 0.331) 10.529 11.400 ( -3.994 4.483 -0.755) 6.051 11.757 ( -7.573 1.923 9.058) 11.962 12.998 ( 1.430 -2.780 -4.182) 5.221 13.727 ( -0.138 -1.740 -2.167) 2.782 13.936 ( 4.441 3.820 -2.116) 6.228 14.173 ( 1.324 -4.036 4.134) 5.927 16.355 ( 1.666 1.424 1.243) 2.519 16.909 ( -2.701 3.811 -2.069) 5.109 17.317 ( -9.379 12.209 2.684) 15.628 17.869 ( -11.016 12.344 2.264) 16.699 20.270 ( 11.323 -17.946 -4.105) 21.613 22.645 ( -1.697 -0.602 -1.294) 2.217 ======================= Grid point 395 (188/336) ======================= q-point: (-0.18 0.09 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.247 ( 7.664 4.595 17.307) 19.478 2.061 ( -12.014 24.478 15.173) 31.205 2.400 ( -11.256 1.663 5.609) 12.686 2.576 ( -8.942 5.716 25.447) 27.572 4.336 ( 9.269 -1.199 1.749) 9.509 4.543 ( -0.017 8.072 -14.746) 16.811 5.085 ( 7.809 -5.419 3.886) 10.269 5.228 ( 4.898 -6.709 -1.303) 8.408 5.467 ( 6.565 -0.731 -2.077) 6.924 6.039 ( -8.735 -8.743 -3.209) 12.769 6.400 ( 3.681 -4.906 1.447) 6.301 6.645 ( -0.974 -0.873 3.133) 3.395 6.823 ( 3.463 -6.871 -3.630) 8.508 7.030 ( 10.926 -3.438 -1.848) 11.602 7.194 ( 4.942 0.207 -4.300) 6.554 7.721 ( 0.241 -0.013 -2.296) 2.309 7.966 ( -11.954 -9.562 -0.454) 15.315 8.113 ( 0.785 -3.195 -3.934) 5.129 8.160 ( 7.981 1.312 4.116) 9.075 8.698 ( -2.447 0.693 1.927) 3.191 8.922 ( 9.277 1.490 9.248) 13.183 9.538 ( 1.383 3.932 -3.883) 5.696 9.928 ( 3.322 0.885 1.005) 3.581 9.995 ( -13.700 2.848 -3.204) 14.355 11.324 ( 0.912 5.415 0.023) 5.491 11.604 ( -8.719 10.647 1.404) 13.833 13.028 ( 2.227 -3.775 -5.456) 6.998 13.725 ( -1.532 -1.813 0.593) 2.447 13.929 ( 0.882 3.241 -2.044) 3.931 14.308 ( 3.779 -8.008 6.596) 11.042 16.405 ( 5.731 1.829 1.475) 6.194 16.841 ( -2.311 4.605 0.897) 5.230 17.064 ( -2.119 16.912 -1.068) 17.078 17.572 ( -12.383 11.301 -0.662) 16.778 20.578 ( 6.073 -19.454 -1.090) 20.409 22.605 ( -2.944 -0.500 -0.782) 3.086 ======================= Grid point 396 (189/336) ======================= q-point: (-0.09 0.09 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.503 ( 14.845 8.849 16.727) 24.052 1.750 ( -4.433 20.795 16.387) 26.845 2.139 ( -14.893 3.363 4.943) 16.048 2.720 ( 1.506 0.230 29.008) 29.048 4.275 ( -2.163 6.434 -15.351) 16.785 4.599 ( 9.243 -0.941 3.992) 10.112 5.269 ( 6.451 -4.707 1.929) 8.215 5.355 ( 3.737 -6.330 -2.414) 7.737 5.554 ( 6.336 1.715 -3.227) 7.314 5.956 ( -9.663 -9.492 -1.211) 13.599 6.408 ( -6.859 3.311 3.017) 8.192 6.676 ( 4.528 -3.281 3.756) 6.736 6.915 ( 4.493 0.420 -5.386) 7.026 7.105 ( 0.185 -6.785 -6.726) 9.556 7.376 ( 8.133 -5.329 3.730) 10.414 7.675 ( -5.625 -2.321 -2.065) 6.426 7.828 ( -9.982 -1.803 2.184) 10.376 8.068 ( -2.332 -2.352 -7.257) 7.977 8.388 ( 8.604 -3.448 3.512) 9.913 8.725 ( 5.932 -1.440 0.055) 6.105 9.090 ( 6.470 2.885 9.370) 11.746 9.525 ( 1.838 0.571 -4.500) 4.894 9.717 ( -9.245 5.279 -4.835) 11.693 9.957 ( -0.527 1.183 1.529) 2.003 11.311 ( 1.319 13.545 -3.324) 14.009 11.354 ( -2.226 6.206 0.302) 6.600 13.055 ( -0.741 -4.806 -5.322) 7.209 13.722 ( -1.221 -0.965 1.731) 2.327 13.891 ( -0.941 1.906 -1.675) 2.707 14.481 ( 0.884 -9.354 6.965) 11.695 16.523 ( 8.236 1.610 2.102) 8.651 16.621 ( -10.967 9.501 -1.121) 14.553 17.124 ( 23.051 10.849 -0.686) 25.486 17.272 ( -11.849 7.719 -2.214) 14.314 20.774 ( -3.494 -16.038 1.455) 16.478 22.555 ( -3.378 -0.317 -0.058) 3.394 ======================= Grid point 399 (190/336) ======================= q-point: ( 0.18 0.18 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.679 ( -5.561 0.000 1.207) 5.690 2.533 ( 15.490 -0.000 8.696) 17.764 2.968 ( 2.298 -0.000 14.825) 15.002 3.401 ( 5.113 -0.000 -7.206) 8.836 4.082 ( 5.838 -0.000 -4.705) 7.498 4.448 ( -9.925 0.000 -15.172) 18.129 4.725 ( -17.823 0.000 2.274) 17.968 5.536 ( 4.820 -0.000 -6.813) 8.345 5.622 ( -3.154 0.000 -2.624) 4.103 6.023 ( -4.093 0.000 -1.202) 4.266 6.077 ( 0.864 -0.000 10.343) 10.379 6.567 ( -13.848 0.000 -8.657) 16.331 6.600 ( -5.262 0.000 -2.132) 5.678 6.799 ( -2.792 0.000 2.338) 3.641 7.032 ( 8.254 -0.000 -11.472) 14.133 7.677 ( 0.557 -0.000 -11.183) 11.197 8.003 ( -0.242 0.000 5.381) 5.387 8.167 ( -2.451 0.000 -3.799) 4.521 8.249 ( 3.146 -0.000 7.037) 7.708 8.466 ( 0.655 -0.000 5.409) 5.449 9.186 ( -9.992 0.000 -10.696) 14.637 9.421 ( -0.449 0.000 -1.836) 1.890 9.810 ( 0.914 -0.000 1.855) 2.068 10.329 ( 9.790 -0.000 6.523) 11.764 11.630 ( 13.602 -0.000 3.303) 13.997 12.008 ( 2.681 -0.000 12.541) 12.825 12.552 ( -6.295 0.000 -4.992) 8.034 13.679 ( -1.403 0.000 -4.008) 4.246 13.824 ( 1.008 -0.000 3.044) 3.206 14.202 ( -8.436 0.000 -1.256) 8.529 16.101 ( 1.602 -0.000 0.727) 1.759 16.714 ( -1.305 0.000 -2.097) 2.470 17.819 ( 25.278 -0.000 1.767) 25.340 18.681 ( 13.422 -0.000 7.320) 15.289 19.790 ( -26.223 0.000 -8.245) 27.488 22.394 ( 0.766 -0.000 1.019) 1.275 ======================= Grid point 400 (191/336) ======================= q-point: ( 0.27 0.18 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.566 ( -5.768 4.490 -0.218) 7.312 2.794 ( 10.478 0.014 5.015) 11.617 3.034 ( -3.777 -0.215 7.818) 8.685 3.383 ( -2.265 -1.162 -3.364) 4.218 4.161 ( 3.902 -2.953 -4.696) 6.782 4.201 ( -7.132 0.997 -15.300) 16.911 4.493 ( -12.667 -1.724 3.564) 13.271 5.511 ( -5.348 2.346 -2.674) 6.423 5.574 ( 3.963 0.794 -5.982) 7.219 5.907 ( -7.392 2.693 -2.848) 8.367 6.081 ( -5.198 -1.093 0.231) 5.317 6.338 ( -2.217 3.073 -9.508) 10.235 6.573 ( -1.766 1.589 1.088) 2.613 6.824 ( -0.587 -7.298 7.750) 10.662 7.092 ( 10.439 4.372 -11.284) 15.982 7.640 ( 1.253 -1.757 -8.017) 8.302 8.005 ( -0.874 2.009 2.388) 3.240 8.128 ( 0.545 -1.384 -3.967) 4.236 8.301 ( -2.149 -1.900 4.612) 5.431 8.562 ( 5.097 3.229 9.470) 11.229 8.942 ( -10.717 -1.989 -13.720) 17.523 9.427 ( 0.606 0.047 3.064) 3.123 9.840 ( 2.035 -0.021 -0.836) 2.201 10.474 ( 4.387 0.201 3.825) 5.824 11.816 ( 9.891 7.142 2.626) 12.479 12.087 ( -6.819 -5.489 15.738) 18.008 12.458 ( -3.413 -4.744 -5.048) 7.723 13.657 ( 2.594 0.396 -4.838) 5.504 13.837 ( 0.214 3.432 2.682) 4.361 14.094 ( -4.762 -2.145 -0.786) 5.281 16.172 ( 3.962 -2.688 2.125) 5.238 16.704 ( -0.358 -1.864 0.006) 1.899 18.205 ( 24.512 5.944 -0.201) 25.223 18.898 ( 2.079 -4.056 14.909) 15.590 19.285 ( -24.291 2.195 -16.053) 29.199 22.441 ( 3.459 -0.855 1.466) 3.853 ======================= Grid point 401 (192/336) ======================= q-point: (-0.64 0.18 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.431 ( -2.951 6.527 -2.304) 7.525 2.818 ( -6.999 7.622 -3.249) 10.846 2.997 ( -2.721 -0.835 5.733) 6.401 3.370 ( -3.452 -3.451 7.263) 8.751 3.992 ( -2.830 3.628 -13.448) 14.214 4.223 ( -0.241 -6.249 -1.645) 6.467 4.437 ( -1.494 -7.206 0.023) 7.359 5.369 ( -6.806 1.373 -4.447) 8.245 5.596 ( 5.290 3.305 -7.341) 9.634 5.757 ( -4.868 1.593 -0.788) 5.182 5.995 ( -5.591 -2.855 -1.426) 6.438 6.285 ( 3.532 -0.939 -14.027) 14.495 6.495 ( -2.176 9.614 4.098) 10.675 6.983 ( 2.023 -9.544 9.562) 13.661 7.152 ( 10.151 6.125 -8.018) 14.312 7.646 ( 0.274 -3.940 -3.947) 5.584 7.976 ( -1.265 0.780 -2.182) 2.640 8.140 ( 0.290 -2.301 -2.354) 3.304 8.282 ( -2.503 1.278 0.387) 2.837 8.607 ( 0.050 5.892 2.417) 6.369 8.792 ( -2.938 -4.785 -3.993) 6.890 9.476 ( 2.170 -0.537 5.059) 5.531 9.855 ( 1.698 0.838 -3.187) 3.707 10.516 ( -0.178 0.713 1.599) 1.759 11.835 ( 1.252 10.624 5.241) 11.912 12.060 ( -9.873 -0.525 8.802) 13.238 12.499 ( -1.365 -14.751 0.104) 14.814 13.695 ( 5.880 0.429 -5.314) 7.937 13.813 ( 1.254 5.218 1.730) 5.639 14.077 ( -1.645 -3.506 0.961) 3.991 16.281 ( 3.931 -2.380 2.955) 5.463 16.741 ( 0.728 -3.975 2.601) 4.806 18.439 ( 14.898 14.482 -3.620) 21.090 18.702 ( -26.303 6.230 4.566) 27.413 19.146 ( 5.740 -13.619 -4.527) 15.457 22.527 ( 4.335 -1.269 1.385) 4.725 ======================= Grid point 402 (193/336) ======================= q-point: (-0.55 0.18 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.340 ( 1.402 6.408 -3.160) 7.281 2.541 ( -12.688 9.974 1.221) 16.185 2.955 ( -5.976 3.983 6.742) 9.850 3.391 ( -4.990 -3.290 8.344) 10.264 3.897 ( 3.106 3.230 -6.921) 8.245 4.306 ( 3.068 -8.680 -0.098) 9.206 4.516 ( 1.722 -9.716 -3.780) 10.567 5.243 ( -3.586 -1.566 -7.241) 8.231 5.560 ( 1.006 5.390 -9.327) 10.820 5.736 ( 1.816 -1.718 0.573) 2.565 5.990 ( -0.201 -5.355 3.973) 6.671 6.252 ( 2.356 0.311 -15.360) 15.543 6.418 ( 1.328 8.559 4.403) 9.716 7.148 ( 1.122 -7.546 7.765) 10.886 7.182 ( 5.638 6.809 -5.081) 10.197 7.668 ( -0.342 -4.572 -2.335) 5.145 7.914 ( -4.120 -2.108 -5.258) 7.004 8.139 ( -2.041 -3.577 -1.746) 4.474 8.214 ( 0.467 6.821 -3.384) 7.629 8.576 ( 0.912 1.646 1.861) 2.646 8.814 ( 0.312 -1.803 1.492) 2.361 9.565 ( 3.281 -1.452 6.092) 7.070 9.837 ( 1.257 2.520 -5.473) 6.155 10.488 ( -2.972 1.283 1.350) 3.507 11.768 ( -0.853 10.270 5.706) 11.780 11.911 ( -13.483 -0.193 6.707) 15.060 12.647 ( 0.568 -14.941 1.914) 15.074 13.738 ( 3.612 1.566 -4.693) 6.126 13.836 ( 5.978 2.810 0.065) 6.606 14.095 ( -0.871 -2.356 1.477) 2.913 16.358 ( 2.020 0.526 3.407) 3.995 16.832 ( 1.780 -5.827 4.542) 7.600 18.154 ( -19.408 9.948 -6.533) 22.767 18.519 ( 0.433 13.810 6.028) 15.075 19.384 ( 9.310 -15.504 -4.618) 18.665 22.606 ( 2.997 -1.048 0.707) 3.252 ======================= Grid point 403 (194/336) ======================= q-point: (-0.45 0.18 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.304 ( 3.424 7.457 -1.407) 8.325 2.320 ( -7.161 10.383 14.351) 19.106 2.830 ( -8.355 5.557 5.854) 11.617 3.336 ( -9.142 2.503 7.384) 12.015 3.949 ( 8.194 1.469 0.122) 8.326 4.470 ( 6.368 -9.122 -0.195) 11.127 4.617 ( 2.432 -9.771 -3.823) 10.770 5.208 ( 0.647 -5.268 -7.796) 9.432 5.423 ( -2.581 6.994 -10.213) 12.645 5.851 ( 7.367 -5.525 1.526) 9.334 6.088 ( 0.150 -3.842 4.831) 6.174 6.195 ( 2.544 -0.090 -8.238) 8.623 6.451 ( 6.972 0.940 -0.403) 7.046 7.105 ( -5.696 1.648 -2.747) 6.535 7.266 ( 4.823 0.943 0.652) 4.957 7.681 ( -0.452 -3.235 -3.484) 4.776 7.859 ( -4.286 -5.896 -1.076) 7.368 8.115 ( -2.993 -2.531 -4.856) 6.240 8.155 ( 2.711 6.686 0.351) 7.224 8.624 ( 3.491 0.325 3.772) 5.150 8.828 ( -0.705 -0.021 1.235) 1.422 9.664 ( 0.448 -2.500 7.032) 7.476 9.797 ( 4.122 4.370 -7.611) 9.696 10.415 ( -5.613 2.009 1.866) 6.247 11.665 ( -3.133 9.732 -0.905) 10.264 11.783 ( -9.233 -1.598 13.832) 16.707 12.799 ( 1.700 -11.118 1.034) 11.295 13.734 ( 1.429 1.404 -4.538) 4.961 13.924 ( 6.789 0.986 -1.345) 6.991 14.103 ( -1.048 -0.929 1.150) 1.812 16.386 ( 1.265 3.076 4.219) 5.372 16.930 ( 0.289 -4.376 3.454) 5.583 17.766 ( -13.928 8.909 -1.568) 16.608 18.371 ( -5.874 14.350 3.981) 16.008 19.656 ( 10.343 -15.904 -7.077) 20.248 22.644 ( 0.542 -0.621 -0.186) 0.845 ======================= Grid point 404 (195/336) ======================= q-point: (-0.36 0.18 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.302 ( 6.877 10.927 4.961) 13.832 2.304 ( -0.316 7.674 25.318) 26.457 2.661 ( -9.308 6.739 4.279) 12.262 3.127 ( -14.072 11.712 7.501) 19.785 4.113 ( 10.494 -0.182 4.484) 11.414 4.634 ( 5.286 -7.131 -7.768) 11.795 4.754 ( 5.788 -8.618 2.650) 10.714 5.227 ( 0.720 5.763 -7.893) 9.799 5.278 ( -1.475 -7.078 -6.424) 9.672 6.012 ( 0.775 -0.526 -0.187) 0.955 6.131 ( 6.216 -6.778 0.076) 9.197 6.285 ( 5.904 -6.777 -0.675) 9.013 6.610 ( 8.173 -7.389 -0.315) 11.022 6.961 ( -6.427 2.805 -2.351) 7.396 7.295 ( 3.122 2.908 -5.415) 6.894 7.680 ( -0.364 -3.125 -4.251) 5.289 7.844 ( -6.008 -6.166 1.320) 8.710 8.074 ( -1.115 -2.679 -3.310) 4.402 8.162 ( 3.714 4.963 2.116) 6.550 8.702 ( 1.067 -1.272 4.142) 4.462 8.829 ( 2.275 2.216 3.603) 4.803 9.661 ( -2.836 1.405 0.817) 3.269 9.844 ( 6.880 0.806 -2.314) 7.303 10.281 ( -9.586 2.800 0.503) 9.999 11.524 ( -2.506 7.524 -0.302) 7.936 11.781 ( -2.815 1.607 13.351) 13.739 12.912 ( 2.091 -6.380 -1.537) 6.888 13.708 ( -0.590 -0.247 -3.985) 4.036 14.002 ( 5.187 1.793 -2.349) 5.969 14.099 ( -1.572 -2.418 1.653) 3.324 16.408 ( 2.749 4.299 5.017) 7.156 16.949 ( -1.527 0.135 0.896) 1.775 17.518 ( -7.692 9.349 2.265) 12.317 18.130 ( -8.333 14.731 0.544) 16.934 19.923 ( 7.963 -18.446 -6.473) 21.108 22.635 ( -1.704 -0.426 -0.739) 1.905 ======================= Grid point 405 (196/336) ======================= q-point: (-0.27 0.18 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.415 ( 14.706 12.047 11.552) 22.245 2.394 ( -2.365 10.399 24.775) 26.973 2.467 ( -9.727 5.956 5.492) 12.659 2.800 ( -12.439 17.405 11.155) 24.127 4.316 ( 9.658 -0.972 5.070) 10.951 4.644 ( 1.132 0.550 -15.737) 15.787 4.978 ( 8.630 -5.662 5.676) 11.779 5.140 ( 0.369 -0.683 -1.716) 1.884 5.362 ( 2.023 -10.932 -4.442) 11.972 5.952 ( -4.359 0.630 -2.581) 5.105 6.308 ( 6.227 -5.368 0.498) 8.236 6.505 ( 8.291 -11.250 2.154) 14.140 6.729 ( -5.309 -6.375 -1.984) 8.530 6.929 ( 6.969 -3.584 1.280) 7.941 7.256 ( 2.093 3.992 -9.241) 10.282 7.678 ( -1.029 -4.084 -4.537) 6.190 7.795 ( -7.752 -6.882 0.559) 10.381 8.066 ( -0.890 -2.317 -4.442) 5.088 8.217 ( 5.959 3.711 4.613) 8.400 8.703 ( -2.593 0.154 3.800) 4.603 8.948 ( 8.367 1.180 8.648) 12.091 9.607 ( -0.311 3.092 -1.977) 3.684 9.919 ( 2.142 -1.524 -0.590) 2.695 10.066 ( -11.155 4.350 -2.696) 12.273 11.455 ( 2.422 7.697 0.896) 8.119 11.778 ( -1.749 7.947 8.618) 11.853 12.960 ( 0.896 -3.388 -5.246) 6.309 13.686 ( -1.402 -2.185 -0.875) 2.739 14.000 ( 0.772 4.128 -2.991) 5.156 14.156 ( 0.399 -7.819 3.690) 8.655 16.465 ( 5.703 4.519 5.409) 9.066 16.915 ( -2.337 2.920 1.641) 4.084 17.345 ( -0.996 12.728 0.273) 12.769 17.845 ( -7.700 16.526 -4.130) 18.694 20.175 ( 2.718 -22.443 -2.469) 22.741 22.596 ( -2.954 -0.460 -0.605) 3.050 ======================= Grid point 406 (197/336) ======================= q-point: (-0.18 0.18 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.667 ( 18.212 8.893 11.534) 23.319 2.215 ( -15.202 18.956 12.236) 27.205 2.253 ( -4.528 14.637 8.741) 17.639 2.755 ( 2.493 4.566 23.405) 23.976 4.402 ( 0.071 5.416 -10.776) 12.060 4.591 ( 6.585 0.504 -0.985) 6.677 5.144 ( 4.904 -6.497 -2.257) 8.447 5.249 ( 3.821 -5.914 5.038) 8.658 5.480 ( 2.597 -10.807 -2.176) 11.326 5.849 ( -5.335 0.203 -3.049) 6.149 6.432 ( 1.569 -1.555 2.774) 3.546 6.615 ( -3.075 -3.345 1.725) 4.860 6.773 ( 3.261 -11.879 -0.933) 12.354 7.075 ( 1.531 -2.499 -3.691) 4.713 7.240 ( 5.194 -4.330 -3.677) 7.697 7.636 ( -5.328 -2.244 -4.412) 7.273 7.754 ( -4.742 -5.893 0.303) 7.570 8.032 ( -1.268 -1.115 -5.575) 5.825 8.331 ( 5.016 -2.033 3.197) 6.286 8.725 ( 4.005 1.409 5.497) 6.946 9.128 ( 7.310 0.993 9.236) 11.821 9.564 ( 0.078 3.264 -4.665) 5.694 9.808 ( -9.099 3.305 -2.206) 9.929 9.967 ( 0.358 0.385 -1.009) 1.138 11.457 ( 4.675 7.055 1.299) 8.563 11.652 ( -1.457 18.106 1.034) 18.194 12.956 ( -1.670 -5.035 -6.213) 8.170 13.691 ( -1.034 -2.292 1.506) 2.931 13.941 ( -1.471 3.281 -2.230) 4.232 14.282 ( 0.251 -10.960 5.504) 12.267 16.575 ( 8.392 4.084 6.069) 11.133 16.776 ( -10.130 6.450 0.017) 12.009 17.342 ( 14.321 11.031 -0.767) 18.093 17.531 ( -3.972 18.946 -8.345) 21.080 20.384 ( -4.536 -24.233 2.163) 24.749 22.548 ( -3.180 -0.422 -0.075) 3.208 ======================= Grid point 407 (198/336) ======================= q-point: (-0.09 0.18 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.782 ( -5.348 5.740 4.367) 8.978 2.025 ( 4.172 16.355 12.727) 21.139 2.232 ( 14.256 13.205 14.895) 24.484 2.923 ( 4.568 1.778 20.368) 20.949 4.229 ( -0.869 8.089 -13.836) 16.050 4.725 ( 4.985 -2.298 2.874) 6.196 5.271 ( 4.759 -9.404 -6.363) 12.311 5.317 ( -4.737 -4.268 2.311) 6.782 5.611 ( 4.099 -5.981 -1.976) 7.515 5.769 ( -3.695 -1.985 0.928) 4.296 6.376 ( -5.852 5.896 5.028) 9.710 6.684 ( 1.243 -8.161 0.962) 8.311 6.872 ( -4.343 -11.748 -3.098) 12.903 7.027 ( 1.498 3.724 -8.761) 9.637 7.414 ( 4.213 -9.419 4.814) 11.386 7.495 ( -9.228 -1.103 -5.650) 10.876 7.770 ( 0.650 -2.701 4.116) 4.966 7.983 ( -1.465 -0.672 -6.308) 6.511 8.419 ( 0.084 -4.289 1.982) 4.725 8.812 ( 2.112 1.481 -2.752) 3.772 9.266 ( 6.215 2.475 8.017) 10.441 9.488 ( -0.008 1.204 -3.949) 4.129 9.719 ( 1.690 3.801 -0.015) 4.159 9.948 ( -1.858 0.492 0.646) 2.028 11.374 ( -2.383 13.685 -2.047) 14.041 11.575 ( 11.503 12.926 1.499) 17.368 12.922 ( -5.084 -5.963 -5.135) 9.369 13.709 ( -0.466 -1.770 1.969) 2.688 13.872 ( -2.362 2.056 -1.672) 3.550 14.403 ( -2.719 -10.279 5.353) 11.904 16.494 ( -10.687 9.333 -0.363) 14.194 16.773 ( 13.635 2.571 3.393) 14.284 17.176 ( -8.888 12.306 -5.959) 16.308 17.647 ( 28.956 10.697 -3.153) 31.029 20.487 ( -11.884 -20.933 4.043) 24.409 22.500 ( -3.155 -0.071 0.198) 3.162 ======================= Grid point 411 (199/336) ======================= q-point: (-0.73 0.27 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.501 ( -3.652 0.000 -1.754) 4.052 2.914 ( -11.744 0.000 -2.216) 11.951 2.971 ( 7.253 -0.000 3.504) 8.055 3.327 ( -5.730 0.000 7.259) 9.248 4.044 ( -0.447 0.000 -14.994) 15.001 4.158 ( -1.294 0.000 -0.850) 1.548 4.353 ( -4.403 0.000 1.327) 4.598 5.377 ( -9.926 0.000 -1.138) 9.991 5.626 ( 6.613 -0.000 -10.435) 12.354 5.780 ( -6.328 0.000 -2.125) 6.675 5.957 ( -6.712 0.000 -1.580) 6.895 6.275 ( 3.774 -0.000 -15.957) 16.398 6.679 ( 3.728 -0.000 5.961) 7.031 6.804 ( -1.758 0.000 10.901) 11.042 7.231 ( 11.576 -0.000 -9.256) 14.821 7.594 ( -0.986 0.000 -5.000) 5.096 7.981 ( -2.796 0.000 -2.801) 3.957 8.119 ( -0.362 0.000 -0.553) 0.661 8.303 ( 0.865 -0.000 2.793) 2.924 8.691 ( -8.148 0.000 -11.879) 14.405 8.712 ( 3.693 -0.000 8.866) 9.604 9.472 ( 1.800 -0.000 5.187) 5.490 9.864 ( 2.274 -0.000 -3.078) 3.826 10.523 ( 0.053 -0.000 1.191) 1.192 11.984 ( -12.595 0.000 16.451) 20.718 12.056 ( 11.431 -0.000 0.547) 11.445 12.309 ( -8.155 0.000 -2.675) 8.583 13.700 ( 5.957 -0.000 -5.339) 7.999 13.872 ( -0.577 0.000 3.048) 3.103 14.033 ( -0.481 0.000 -0.203) 0.522 16.259 ( 5.522 -0.000 4.376) 7.045 16.701 ( 0.185 -0.000 2.353) 2.360 18.625 ( 24.617 -0.000 -4.423) 25.011 18.758 ( -28.840 0.000 -1.087) 28.860 18.972 ( -1.704 0.000 0.891) 1.922 22.515 ( 4.562 -0.000 1.627) 4.844 ======================= Grid point 413 (200/336) ======================= q-point: (-0.64 0.27 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.450 ( 1.964 3.758 -3.511) 5.505 2.681 ( -12.293 4.179 0.717) 13.003 3.047 ( 0.647 5.186 4.286) 6.759 3.286 ( -7.584 -6.265 8.105) 12.746 3.993 ( 4.920 5.898 -6.634) 10.149 4.164 ( 0.384 -5.979 1.343) 6.139 4.355 ( 0.784 -5.942 -3.499) 6.941 5.203 ( -9.178 -1.659 -5.141) 10.650 5.627 ( 3.366 1.914 -14.449) 14.959 5.723 ( -0.367 -0.063 1.410) 1.458 5.908 ( -0.928 -2.693 3.697) 4.667 6.253 ( 5.571 -0.146 -18.074) 18.913 6.655 ( 1.060 14.596 6.511) 16.018 6.945 ( -0.593 -12.838 9.319) 15.875 7.324 ( 8.569 6.450 -6.360) 12.469 7.559 ( -3.300 -5.648 -1.365) 6.682 7.897 ( -2.971 -0.146 -8.660) 9.157 8.091 ( -3.731 -1.354 0.760) 4.041 8.330 ( 2.923 4.499 -0.772) 5.420 8.563 ( -1.798 -2.081 -4.283) 5.090 8.797 ( 1.052 -0.083 6.183) 6.272 9.544 ( 2.168 -0.641 6.646) 7.020 9.871 ( 2.400 1.021 -5.308) 5.914 10.504 ( -2.604 0.410 0.947) 2.801 11.862 ( -13.365 0.161 14.439) 19.676 12.049 ( -2.223 13.911 -0.784) 14.110 12.353 ( 3.413 -15.795 0.855) 16.183 13.764 ( 5.706 0.973 -5.164) 7.757 13.868 ( -0.462 0.562 2.067) 2.191 14.064 ( 2.574 -0.811 0.483) 2.741 16.378 ( 5.118 1.065 6.186) 8.099 16.742 ( 0.752 -3.033 4.451) 5.439 18.282 ( -23.015 3.515 -7.287) 24.396 18.793 ( 3.373 15.265 2.897) 15.900 19.090 ( 9.120 -15.778 -2.851) 18.446 22.592 ( 3.408 -0.359 1.236) 3.643 ======================= Grid point 414 (201/336) ======================= q-point: (-0.55 0.27 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.456 ( 7.579 7.205 -2.919) 10.857 2.498 ( -7.069 7.673 11.342) 15.411 2.955 ( -6.600 8.095 6.400) 12.249 3.297 ( -5.227 -6.323 5.345) 9.791 4.014 ( 6.742 5.690 1.721) 8.989 4.301 ( 6.418 -8.399 1.160) 10.634 4.429 ( 2.296 -9.383 -4.035) 10.469 5.082 ( -5.347 -6.201 -7.643) 11.201 5.538 ( 0.798 4.648 -14.222) 14.984 5.780 ( 4.527 -2.486 2.466) 5.723 5.997 ( 2.857 -4.162 6.124) 7.936 6.228 ( 4.917 0.984 -16.677) 17.414 6.574 ( 0.671 11.900 4.919) 12.894 7.042 ( -5.897 -8.202 2.621) 10.437 7.330 ( 4.163 5.585 -0.821) 7.014 7.581 ( -0.785 -6.741 -2.827) 7.352 7.810 ( -1.158 -0.163 -6.387) 6.494 8.042 ( -4.951 -3.412 -1.304) 6.153 8.302 ( 2.276 7.148 -1.567) 7.664 8.594 ( 2.130 -3.317 0.769) 4.016 8.833 ( 0.065 0.629 4.842) 4.884 9.621 ( 0.251 -1.865 7.064) 7.311 9.863 ( 3.674 2.490 -7.085) 8.360 10.445 ( -5.121 1.137 1.885) 5.574 11.730 ( -11.931 -1.143 8.158) 14.498 11.901 ( -1.504 11.903 6.406) 13.600 12.571 ( 5.947 -12.371 0.636) 13.741 13.773 ( 0.831 2.651 -3.372) 4.369 13.899 ( 1.969 -3.093 -0.813) 3.756 14.112 ( 3.123 1.245 -0.351) 3.381 16.462 ( 3.600 4.605 7.379) 9.414 16.831 ( 0.913 -5.616 5.266) 7.753 17.898 ( -15.117 4.915 -3.878) 16.362 18.636 ( -7.412 13.315 5.193) 16.100 19.371 ( 11.710 -13.962 -9.591) 20.593 22.635 ( 0.806 -0.283 0.438) 0.960 ======================= Grid point 415 (202/336) ======================= q-point: (-0.45 0.27 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.520 ( 11.555 10.894 1.492) 15.951 2.463 ( -0.349 8.630 21.161) 22.855 2.794 ( -8.961 7.712 6.737) 13.608 3.258 ( -6.676 1.767 4.088) 8.025 4.124 ( 7.940 1.527 5.846) 9.978 4.483 ( 5.483 -8.013 -4.790) 10.827 4.582 ( 7.546 -9.281 3.875) 12.574 5.053 ( -2.661 -11.240 -8.412) 14.289 5.402 ( -0.438 8.248 -11.411) 14.086 5.946 ( 8.713 -6.557 2.485) 11.184 6.090 ( -0.006 0.151 2.816) 2.820 6.215 ( 5.930 -0.503 -8.960) 10.756 6.536 ( 0.300 0.964 1.092) 1.487 6.975 ( -6.329 -1.761 -1.003) 6.645 7.335 ( 0.647 1.654 -2.448) 3.025 7.602 ( 0.117 -4.632 -6.068) 7.634 7.787 ( -1.571 -0.249 0.119) 1.595 7.995 ( -2.729 -4.850 -3.227) 6.433 8.273 ( 2.366 5.673 0.631) 6.179 8.670 ( 2.007 -2.081 2.955) 4.134 8.863 ( 1.709 1.508 5.975) 6.395 9.655 ( -2.465 -1.537 4.491) 5.349 9.872 ( 4.965 1.800 -6.152) 8.108 10.327 ( -9.047 2.047 0.927) 9.322 11.621 ( -4.631 2.111 2.939) 5.878 11.866 ( 0.725 7.799 13.326) 15.458 12.769 ( 5.985 -8.428 -0.263) 10.340 13.719 ( -2.281 1.386 -3.218) 4.181 13.956 ( 1.264 -4.631 -1.557) 5.047 14.125 ( 1.773 3.051 -1.954) 4.033 16.511 ( 3.601 6.447 8.175) 11.016 16.913 ( -0.143 -3.744 4.205) 5.632 17.664 ( -6.811 6.083 0.528) 9.147 18.398 ( -9.129 13.374 2.967) 16.462 19.599 ( 7.413 -15.646 -11.347) 20.700 22.629 ( -1.711 -0.183 -0.274) 1.742 ======================= Grid point 416 (203/336) ======================= q-point: (-0.36 0.27 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.649 ( 14.774 11.901 6.746) 20.135 2.550 ( 2.066 8.059 24.803) 26.161 2.606 ( -10.005 8.294 6.792) 14.663 3.099 ( -7.287 12.033 4.101) 14.653 4.292 ( 7.313 -1.864 6.719) 10.105 4.570 ( 2.998 -6.348 -10.152) 12.343 4.857 ( 11.495 -6.752 7.888) 15.491 5.094 ( -2.376 -14.507 -6.526) 16.084 5.245 ( -1.075 8.573 -7.072) 11.166 6.030 ( -2.021 5.666 -1.995) 6.338 6.175 ( 7.984 -8.519 0.561) 11.689 6.333 ( 7.507 -6.198 -1.255) 9.815 6.564 ( -3.035 -8.420 0.335) 8.957 6.917 ( -0.322 0.213 0.428) 0.577 7.292 ( -1.108 -0.350 -6.870) 6.968 7.604 ( 0.979 -3.226 -7.469) 8.195 7.720 ( -7.063 -1.412 -0.038) 7.203 8.016 ( 1.246 -3.149 -2.869) 4.439 8.281 ( 2.374 2.904 2.249) 4.374 8.716 ( 0.707 1.445 5.551) 5.779 8.962 ( 6.199 0.287 8.737) 10.717 9.642 ( -1.229 0.380 0.802) 1.516 9.892 ( 0.841 -0.930 -4.260) 4.441 10.139 ( -9.916 3.120 -1.930) 10.573 11.581 ( 1.844 5.243 1.847) 5.856 11.916 ( 2.679 7.195 14.351) 16.275 12.896 ( 3.157 -3.688 -3.231) 5.832 13.653 ( -2.954 -1.064 -1.753) 3.596 14.008 ( 0.180 -5.987 -1.236) 6.116 14.089 ( -0.638 3.238 -2.389) 4.074 16.571 ( 5.503 6.636 8.633) 12.200 16.943 ( -1.778 0.012 3.823) 4.216 17.547 ( 0.229 8.888 0.726) 8.920 18.144 ( -6.602 14.742 -1.409) 16.214 19.772 ( 1.071 -19.961 -8.339) 21.659 22.589 ( -3.012 -0.255 -0.441) 3.055 ======================= Grid point 417 (204/336) ======================= q-point: (-0.27 0.27 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.825 ( 11.163 7.728 7.375) 15.451 2.414 ( -6.968 10.975 8.492) 15.528 2.606 ( -2.154 13.325 18.714) 23.074 2.935 ( 1.233 14.009 10.167) 17.354 4.436 ( 3.077 -1.658 0.576) 3.542 4.588 ( 3.690 -2.393 -10.101) 11.017 5.097 ( -1.894 -0.428 -0.960) 2.166 5.126 ( 6.140 -5.871 5.703) 10.232 5.229 ( 2.983 -11.785 -3.407) 12.625 5.922 ( -2.518 5.935 -2.555) 6.935 6.345 ( 5.225 -7.284 -1.927) 9.169 6.492 ( -2.302 -10.459 0.843) 10.743 6.596 ( 0.759 -5.991 1.314) 6.180 6.971 ( 2.047 -4.317 3.500) 5.922 7.239 ( 1.089 0.053 -9.579) 9.641 7.602 ( -2.195 -0.612 -5.224) 5.699 7.634 ( -3.183 -6.404 -2.139) 7.465 8.020 ( -0.485 -0.593 -4.019) 4.091 8.310 ( 0.643 -0.463 1.926) 2.083 8.773 ( 5.002 3.629 8.299) 10.348 9.132 ( 6.941 -0.308 9.362) 11.659 9.624 ( 0.889 2.562 -2.786) 3.888 9.819 ( -8.251 -1.285 -1.606) 8.504 9.993 ( -1.968 2.061 -4.025) 4.931 11.590 ( 4.533 6.830 1.421) 8.319 11.947 ( 2.553 12.805 10.151) 16.539 12.889 ( -2.521 -1.832 -6.938) 7.606 13.641 ( -1.023 -2.934 1.191) 3.328 14.002 ( -2.026 2.495 -3.387) 4.670 14.094 ( -0.239 -8.334 2.340) 8.659 16.673 ( 7.943 6.212 9.338) 13.743 16.869 ( -8.073 3.797 2.243) 9.199 17.543 ( 10.497 10.348 -0.842) 14.764 17.889 ( -1.869 17.867 -7.650) 19.525 19.915 ( -5.483 -24.821 -1.707) 25.476 22.541 ( -2.969 -0.313 -0.087) 2.986 ======================= Grid point 418 (205/336) ======================= q-point: (-0.18 0.27 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.845 ( -7.169 2.617 2.105) 7.917 2.337 ( 4.029 15.663 11.364) 19.766 2.541 ( 6.361 17.043 13.822) 22.847 3.006 ( 7.797 7.511 14.337) 17.965 4.374 ( -0.763 5.983 -11.946) 13.382 4.667 ( 3.291 -4.355 0.558) 5.487 5.109 ( -1.257 -7.484 -0.310) 7.595 5.204 ( -2.550 -7.114 -2.313) 7.903 5.429 ( 6.087 -9.331 1.635) 11.260 5.827 ( -1.140 5.239 -0.409) 5.377 6.438 ( -2.332 -1.095 2.056) 3.296 6.504 ( -1.045 -10.881 -2.226) 11.155 6.659 ( -4.816 -8.295 -0.855) 9.629 7.063 ( 2.575 -1.747 -1.436) 3.427 7.246 ( 3.980 -4.500 -2.397) 6.468 7.498 ( -6.265 -0.428 -4.650) 7.814 7.690 ( 2.424 -5.321 -0.737) 5.893 7.977 ( -1.388 -0.106 -4.690) 4.892 8.340 ( -0.190 -3.543 2.007) 4.077 8.866 ( 3.275 4.123 2.857) 5.991 9.281 ( 5.556 -0.080 7.450) 9.294 9.557 ( -1.003 4.922 -3.515) 6.130 9.756 ( -0.547 -0.584 2.287) 2.423 9.945 ( -0.688 -0.010 -3.009) 3.086 11.584 ( 1.992 9.427 -0.086) 9.636 11.893 ( 5.387 18.120 5.524) 19.694 12.811 ( -5.178 -5.092 -6.556) 9.784 13.666 ( -0.632 -2.603 1.847) 3.254 13.918 ( -3.039 2.562 -2.175) 4.530 14.203 ( -0.416 -10.478 3.798) 11.153 16.658 ( -9.913 8.115 2.032) 12.972 16.835 ( 10.877 3.947 6.118) 13.089 17.454 ( -5.972 16.461 -7.374) 19.000 17.868 ( 23.681 12.088 -4.437) 26.956 20.032 ( -10.911 -26.483 3.085) 28.809 22.500 ( -2.468 0.016 0.287) 2.485 ======================= Grid point 419 (206/336) ======================= q-point: (-0.09 0.27 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.685 ( -8.523 0.243 -0.092) 8.527 2.333 ( 6.434 14.849 10.677) 19.388 2.681 ( 11.359 9.334 15.352) 21.256 3.173 ( 11.545 5.590 8.445) 15.358 4.233 ( 1.031 8.064 -10.133) 12.991 4.721 ( -1.872 -4.503 -2.604) 5.529 5.089 ( -12.836 -9.242 0.080) 15.818 5.250 ( 4.876 -6.505 -5.621) 9.883 5.577 ( 2.138 -8.304 -2.029) 8.812 5.794 ( 0.676 4.039 5.258) 6.664 6.373 ( -4.193 3.607 2.354) 6.012 6.566 ( -8.960 -8.901 0.967) 12.667 6.641 ( -0.190 -12.533 -6.869) 14.293 7.033 ( -0.107 3.604 -6.635) 7.551 7.326 ( -6.637 2.314 -8.860) 11.309 7.440 ( 5.217 -8.496 6.619) 11.967 7.803 ( 4.038 -5.688 5.103) 8.643 7.930 ( -0.424 0.200 -4.970) 4.992 8.386 ( -0.202 -3.167 0.754) 3.261 8.768 ( -6.590 5.903 -5.992) 10.686 9.417 ( 4.360 -0.296 4.139) 6.019 9.497 ( -0.712 2.903 -1.645) 3.412 9.779 ( 1.275 1.366 2.244) 2.920 9.962 ( 4.373 0.032 2.433) 5.004 11.480 ( 1.201 12.240 -1.533) 12.394 11.915 ( 10.813 13.876 6.823) 18.869 12.741 ( -5.632 -5.826 -5.803) 9.967 13.689 ( -0.922 -2.757 1.753) 3.395 13.834 ( -3.375 1.753 -1.670) 4.153 14.292 ( -2.899 -8.333 3.201) 9.386 16.440 ( -6.330 9.892 -1.235) 11.809 17.021 ( 7.263 2.892 3.067) 8.398 17.163 ( -0.074 13.148 -4.926) 14.040 18.176 ( 26.416 8.991 -0.800) 27.916 20.075 ( -15.510 -23.198 2.285) 27.999 22.462 ( -2.118 0.838 0.437) 2.320 ======================= Grid point 424 (207/336) ======================= q-point: (-0.64 0.36 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.530 ( 8.393 -0.000 -3.287) 9.014 2.575 ( -7.014 0.000 10.841) 12.912 3.121 ( -11.776 0.000 7.846) 14.150 3.142 ( 2.365 -0.000 2.560) 3.485 4.139 ( -0.019 0.000 5.253) 5.253 4.161 ( 12.092 -0.000 -0.187) 12.093 4.325 ( 2.600 -0.000 -5.236) 5.846 5.019 ( -7.077 0.000 -7.388) 10.230 5.583 ( 2.130 -0.000 -15.157) 15.306 5.756 ( 2.778 -0.000 2.673) 3.855 5.957 ( 3.803 -0.000 6.178) 7.254 6.233 ( 5.662 -0.000 -18.640) 19.481 6.821 ( 2.676 -0.000 0.732) 2.775 6.838 ( -8.109 0.000 9.029) 12.136 7.442 ( -6.057 0.000 3.837) 7.170 7.460 ( 7.747 -0.000 -7.190) 10.570 7.815 ( 0.381 -0.000 -9.465) 9.473 8.007 ( -6.359 0.000 0.772) 6.405 8.387 ( 1.111 -0.000 -1.952) 2.247 8.542 ( 2.967 -0.000 -0.452) 3.002 8.842 ( 0.022 -0.000 6.410) 6.410 9.602 ( 0.034 -0.000 6.999) 6.999 9.887 ( 3.490 -0.000 -6.908) 7.740 10.456 ( -4.923 0.000 1.950) 5.295 11.718 ( -11.694 0.000 9.217) 14.890 12.056 ( -6.764 0.000 8.100) 10.553 12.414 ( 12.107 -0.000 -1.805) 12.240 13.828 ( 4.922 -0.000 -5.326) 7.252 13.837 ( -3.886 0.000 1.681) 4.234 14.126 ( 4.425 -0.000 -0.697) 4.480 16.520 ( 5.293 -0.000 9.342) 10.738 16.763 ( 0.264 -0.000 5.016) 5.023 17.944 ( -15.571 0.000 -4.689) 16.262 18.798 ( -13.063 0.000 9.644) 16.237 19.204 ( 17.298 -0.000 -14.452) 22.541 22.633 ( 0.904 -0.000 0.669) 1.125 ======================= Grid point 426 (208/336) ======================= q-point: (-0.55 0.36 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.670 ( 12.393 4.394 0.060) 13.149 2.590 ( -0.443 3.999 19.296) 19.711 2.941 ( -10.075 6.766 6.914) 13.967 3.215 ( -0.503 -4.428 2.672) 5.196 4.167 ( 2.275 2.369 6.271) 7.079 4.367 ( 5.449 -3.464 -4.581) 7.917 4.432 ( 12.816 -5.622 5.649) 15.092 4.901 ( -4.238 -4.334 -8.762) 10.655 5.519 ( 2.158 3.612 -12.778) 13.452 5.847 ( 5.089 -3.124 2.172) 6.354 6.074 ( 4.451 -0.853 6.749) 8.129 6.213 ( 5.388 -0.418 -16.734) 17.585 6.647 ( -8.922 8.198 3.461) 12.601 6.892 ( -2.171 -6.106 -0.590) 6.507 7.361 ( -5.082 1.013 1.077) 5.293 7.532 ( 4.194 -2.297 -7.104) 8.563 7.810 ( 3.006 1.901 -2.609) 4.411 7.910 ( -5.556 -3.575 -1.928) 6.883 8.355 ( -0.707 2.585 -1.689) 3.168 8.634 ( 5.269 -1.288 3.988) 6.733 8.884 ( 0.809 0.607 6.899) 6.973 9.626 ( -2.065 -1.035 5.127) 5.623 9.898 ( 3.546 0.809 -7.080) 7.960 10.354 ( -9.000 0.710 1.235) 9.112 11.633 ( -4.126 -0.006 5.855) 7.162 12.013 ( -2.342 5.689 13.396) 14.741 12.628 ( 11.347 -5.215 -1.441) 12.571 13.753 ( -4.977 1.831 -0.430) 5.321 13.877 ( 2.171 -3.128 -4.312) 5.752 14.169 ( 2.398 1.287 -2.441) 3.656 16.634 ( 4.327 5.786 10.927) 13.099 16.824 ( 0.668 -4.895 5.264) 7.220 17.741 ( -6.485 2.100 -0.796) 6.862 18.601 ( -12.949 6.941 8.350) 16.899 19.368 ( 10.151 -7.690 -17.896) 21.965 22.628 ( -1.720 -0.038 -0.008) 1.720 ======================= Grid point 427 (209/336) ======================= q-point: (-0.45 0.36 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.831 ( 12.204 7.038 4.409) 14.762 2.694 ( 2.359 6.483 21.472) 22.553 2.764 ( -7.852 7.831 7.450) 13.359 3.223 ( -1.921 1.843 2.078) 3.377 4.248 ( 2.580 -2.451 6.789) 7.665 4.458 ( 4.494 -5.003 -6.071) 9.060 4.754 ( 14.925 -3.828 9.521) 18.112 4.856 ( -2.836 -9.369 -8.288) 12.826 5.417 ( 0.144 8.205 -9.122) 12.270 5.984 ( 3.463 -7.310 -1.259) 8.186 6.156 ( 3.803 3.178 2.586) 5.590 6.241 ( 4.687 -4.192 -8.066) 10.227 6.491 ( -5.371 1.228 3.079) 6.312 6.898 ( -0.498 -2.321 -0.623) 2.454 7.266 ( -5.467 -1.678 -3.973) 6.964 7.555 ( 1.605 -1.981 -7.148) 7.589 7.730 ( -5.932 1.761 -2.939) 6.850 7.952 ( 3.984 -3.348 -1.693) 5.473 8.322 ( -0.409 1.402 0.023) 1.460 8.755 ( 5.237 2.409 7.908) 9.786 8.958 ( 3.647 -0.643 8.383) 9.165 9.628 ( -1.616 -1.339 2.479) 3.248 9.889 ( 0.804 0.412 -6.862) 6.921 10.179 ( -10.582 1.207 -1.513) 10.758 11.646 ( 2.518 1.874 3.372) 4.607 12.046 ( 1.606 6.055 16.840) 17.967 12.824 ( 7.868 -3.627 -1.772) 8.843 13.648 ( -5.648 0.322 -0.967) 5.739 13.906 ( 0.471 -4.249 -3.875) 5.770 14.146 ( -0.719 2.297 -3.563) 4.300 16.703 ( 4.727 7.190 10.319) 13.436 16.914 ( 0.187 -3.111 6.563) 7.265 17.674 ( 1.625 4.576 0.337) 4.868 18.379 ( -9.768 9.871 5.815) 15.056 19.454 ( 2.074 -13.163 -17.368) 21.891 22.586 ( -3.081 -0.081 -0.326) 3.100 ======================= Grid point 428 (210/336) ======================= q-point: (-0.36 0.36 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.949 ( 4.132 5.382 5.882) 8.980 2.618 ( -1.922 9.997 6.995) 12.352 2.809 ( 2.374 9.636 19.690) 22.049 3.163 ( -0.089 8.271 3.522) 8.990 4.358 ( 0.762 -5.946 5.025) 7.822 4.517 ( 3.706 -3.889 -9.095) 10.563 4.882 ( -2.751 -13.315 -4.361) 14.279 5.073 ( 13.438 -2.603 8.388) 16.054 5.272 ( -1.717 9.349 -5.076) 10.775 6.006 ( -2.295 0.227 -3.499) 4.190 6.224 ( 3.890 -2.440 -1.888) 4.965 6.288 ( -2.855 -10.212 -2.913) 10.997 6.526 ( 4.886 -1.379 4.525) 6.801 6.930 ( 1.385 -1.286 2.870) 3.436 7.199 ( -0.832 -3.594 -7.238) 8.124 7.525 ( -5.789 -4.912 -3.042) 8.179 7.625 ( 0.535 2.481 -7.429) 7.850 8.001 ( 0.691 -1.422 -3.206) 3.575 8.307 ( -1.200 0.083 0.814) 1.452 8.858 ( 6.157 5.247 9.840) 12.738 9.115 ( 6.511 -1.690 9.806) 11.891 9.640 ( 0.877 -0.965 0.375) 1.357 9.808 ( -5.721 0.732 -6.107) 8.400 10.019 ( -5.192 0.404 -3.982) 6.556 11.698 ( 5.353 4.418 1.617) 7.126 12.130 ( 2.881 7.002 16.369) 18.035 12.881 ( -0.993 0.436 -5.057) 5.172 13.590 ( -1.894 -2.300 0.767) 3.077 13.932 ( -0.528 -6.075 -2.950) 6.774 14.075 ( -2.306 2.385 -2.676) 4.263 16.791 ( 6.497 5.751 8.983) 12.490 16.927 ( -4.802 2.616 7.043) 8.917 17.714 ( 11.027 7.513 -1.231) 13.400 18.175 ( -5.095 12.459 0.267) 13.463 19.490 ( -5.437 -19.751 -10.914) 23.212 22.537 ( -2.812 -0.144 -0.098) 2.818 ======================= Grid point 429 (211/336) ======================= q-point: (-0.27 0.36 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.896 ( -8.672 2.801 2.794) 9.532 2.611 ( 6.869 13.212 8.273) 17.034 2.811 ( 0.353 12.448 13.456) 18.334 3.173 ( 6.991 8.269 7.858) 13.379 4.405 ( -1.771 -3.427 -3.071) 4.931 4.564 ( 2.610 -5.402 -5.738) 8.302 4.931 ( -4.946 -11.897 -0.984) 12.922 5.162 ( -0.421 3.551 -3.322) 4.881 5.314 ( 8.480 -2.880 3.508) 9.618 5.924 ( -2.754 4.016 0.215) 4.875 6.292 ( -1.115 -10.939 -5.169) 12.150 6.313 ( -1.682 -8.464 -3.230) 9.214 6.618 ( 0.271 1.519 4.942) 5.177 7.006 ( 4.314 -2.209 3.655) 6.071 7.211 ( 2.926 -1.682 -6.426) 7.258 7.455 ( -6.158 -5.025 -1.269) 8.049 7.615 ( 4.050 -1.308 -7.194) 8.359 7.971 ( -1.986 -0.650 -4.215) 4.705 8.295 ( -1.415 -1.337 1.826) 2.669 8.958 ( 4.200 5.477 6.035) 9.169 9.279 ( 5.602 -0.206 7.756) 9.570 9.645 ( -0.905 4.263 -4.009) 5.921 9.703 ( -1.644 -4.133 1.894) 4.835 9.949 ( -0.636 -0.043 -4.096) 4.145 11.740 ( 5.287 7.213 0.341) 8.950 12.174 ( 1.670 10.839 12.705) 16.784 12.757 ( -6.946 -0.285 -7.600) 10.300 13.617 ( 0.214 -2.503 1.549) 2.952 13.940 ( -2.915 -2.137 -3.262) 4.869 14.047 ( 0.497 -4.137 1.439) 4.409 16.790 ( -7.253 5.529 0.298) 9.125 16.925 ( 7.167 6.029 12.640) 15.732 17.758 ( 1.514 15.216 -6.029) 16.437 18.074 ( 13.887 9.560 -2.606) 17.059 19.536 ( -10.205 -25.605 -2.238) 27.654 22.501 ( -1.748 0.116 0.376) 1.791 ======================= Grid point 430 (212/336) ======================= q-point: (-0.18 0.36 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.709 ( -10.774 2.071 -0.983) 11.015 2.606 ( 3.578 14.480 7.796) 16.830 2.850 ( 5.972 8.546 13.188) 16.812 3.296 ( 10.721 6.161 5.584) 13.567 4.349 ( -0.990 2.586 -6.141) 6.736 4.608 ( -1.831 -6.945 -3.342) 7.922 4.912 ( -8.843 -8.687 -1.918) 12.544 5.156 ( 2.193 -3.384 -4.096) 5.748 5.439 ( 2.245 -5.683 -2.761) 6.705 5.875 ( -1.210 3.515 6.037) 7.090 6.291 ( -5.251 -8.601 -3.123) 10.550 6.401 ( 2.969 -12.151 -8.380) 15.057 6.557 ( -6.143 5.350 4.753) 9.432 7.083 ( 2.004 1.446 -4.477) 5.113 7.280 ( 5.711 -4.009 1.166) 7.074 7.392 ( -3.420 -0.238 -3.117) 4.633 7.684 ( 2.789 -6.242 0.018) 6.837 7.925 ( -0.524 -0.842 -4.685) 4.789 8.325 ( 0.946 -2.914 2.338) 3.854 8.893 ( -5.188 7.294 -3.486) 9.606 9.391 ( 2.699 -0.779 2.234) 3.589 9.580 ( -1.397 3.567 1.991) 4.317 9.765 ( 2.088 -2.598 1.301) 3.578 9.966 ( 4.971 0.626 1.727) 5.300 11.706 ( 1.322 11.500 -1.285) 11.647 12.167 ( 3.490 11.661 11.029) 16.426 12.637 ( -4.470 -4.626 -7.560) 9.926 13.642 ( -0.755 -2.042 1.147) 2.461 13.865 ( -4.011 1.081 -2.377) 4.786 14.140 ( 0.897 -7.317 2.640) 7.830 16.615 ( -5.280 8.656 -0.443) 10.149 17.073 ( 7.185 3.069 8.980) 11.903 17.473 ( -5.004 18.692 -9.763) 21.674 18.331 ( 23.101 6.976 1.299) 24.166 19.599 ( -12.524 -26.701 0.295) 29.494 22.479 ( -0.874 1.002 0.705) 1.505 ======================= Grid point 431 (213/336) ======================= q-point: (-0.09 0.36 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.540 ( -7.321 -1.053 -3.221) 8.068 2.607 ( 5.529 9.876 7.122) 13.373 2.945 ( 3.650 5.719 13.206) 14.847 3.433 ( 9.013 4.250 -0.006) 9.965 4.287 ( 2.726 5.568 -4.153) 7.462 4.576 ( -6.103 -4.975 -5.925) 9.855 4.785 ( -13.213 -6.471 -2.475) 14.919 5.233 ( 4.559 -6.972 -5.704) 10.096 5.484 ( -1.225 -8.642 -5.571) 10.355 5.879 ( -1.571 1.561 9.021) 9.289 6.265 ( -3.269 -6.484 -5.782) 9.283 6.383 ( -9.443 3.430 1.515) 10.161 6.548 ( 4.947 -10.316 -5.667) 12.768 7.044 ( 0.915 5.115 -2.128) 5.615 7.207 ( -5.774 5.364 -10.996) 13.529 7.495 ( 5.043 -5.960 6.370) 10.077 7.800 ( 0.264 -8.456 1.580) 8.606 7.949 ( 6.200 -1.717 -0.547) 6.456 8.372 ( 0.673 -0.412 -0.676) 1.039 8.688 ( -6.845 7.307 -3.491) 10.604 9.358 ( -5.918 -2.631 -7.673) 10.041 9.540 ( -1.363 5.558 3.093) 6.505 9.809 ( 1.141 -0.175 0.685) 1.343 10.121 ( 9.353 -0.278 8.394) 12.570 11.601 ( 1.348 9.995 -1.213) 10.158 12.208 ( 2.200 7.896 14.118) 16.325 12.605 ( 1.941 -3.068 -8.900) 9.612 13.651 ( -1.607 -2.490 1.219) 3.204 13.775 ( -3.891 0.815 -2.483) 4.687 14.211 ( -1.283 -4.690 2.007) 5.260 16.465 ( -1.636 10.550 -1.435) 10.772 17.049 ( -5.475 9.957 -5.606) 12.670 17.377 ( 11.452 3.527 4.861) 12.931 18.634 ( 18.475 6.313 6.700) 20.641 19.607 ( -14.107 -22.161 -4.897) 26.723 22.461 ( -0.062 2.184 0.856) 2.347 ======================= Grid point 437 (214/336) ======================= q-point: (-0.55 0.45 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.899 ( 10.858 -0.000 3.907) 11.539 2.760 ( 2.572 -0.000 19.836) 20.002 2.851 ( -7.894 0.000 7.352) 10.787 3.224 ( 1.013 -0.000 2.067) 2.302 4.221 ( -0.192 0.000 6.237) 6.240 4.406 ( 5.408 -0.000 -4.693) 7.161 4.719 ( 16.914 -0.000 10.443) 19.878 4.767 ( -3.202 0.000 -8.656) 9.229 5.505 ( 1.834 -0.000 -10.144) 10.308 5.905 ( 2.910 -0.000 -0.022) 2.910 6.187 ( 4.215 -0.000 6.394) 7.659 6.191 ( 3.418 -0.000 -13.653) 14.074 6.531 ( -7.899 0.000 3.704) 8.724 6.862 ( 0.991 -0.000 -1.765) 2.024 7.248 ( -7.050 0.000 -3.031) 7.673 7.536 ( 1.045 -0.000 -6.303) 6.389 7.753 ( -6.217 0.000 -4.407) 7.620 7.914 ( 6.192 -0.000 -1.054) 6.281 8.334 ( -1.386 0.000 -0.815) 1.608 8.784 ( 8.118 -0.000 9.370) 12.398 8.949 ( 1.607 -0.000 7.754) 7.919 9.612 ( -1.687 0.000 2.690) 3.176 9.895 ( 1.002 -0.000 -7.460) 7.527 10.189 ( -11.151 0.000 -1.376) 11.235 11.662 ( 3.088 -0.000 4.012) 5.063 12.109 ( -0.297 0.000 17.871) 17.873 12.784 ( 10.723 -0.000 -1.763) 10.867 13.654 ( -7.400 0.000 0.223) 7.403 13.864 ( 1.487 -0.000 -5.728) 5.918 14.168 ( -0.884 0.000 -3.740) 3.843 16.822 ( 4.175 -0.000 14.917) 15.490 16.835 ( 1.428 -0.000 3.736) 4.000 17.716 ( 2.179 -0.000 0.115) 2.182 18.481 ( -12.772 0.000 11.374) 17.102 19.321 ( 3.953 -0.000 -23.655) 23.983 22.585 ( -3.112 0.000 -0.286) 3.125 ======================= Grid point 439 (215/336) ======================= q-point: (-0.45 0.45 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.021 ( 0.512 2.048 5.892) 6.259 2.760 ( -0.067 4.372 4.450) 6.239 2.955 ( 4.986 4.838 19.152) 20.373 3.240 ( -0.125 1.057 2.207) 2.451 4.256 ( -1.862 -3.576 5.261) 6.628 4.463 ( 4.199 -1.697 -6.291) 7.752 4.701 ( -2.098 -5.112 -5.951) 8.121 5.049 ( 15.117 -0.366 10.082) 18.175 5.429 ( -1.777 5.740 -6.716) 9.012 5.933 ( -0.813 -4.316 -3.249) 5.463 6.144 ( -3.012 -4.171 -7.572) 9.154 6.254 ( 1.687 2.111 2.278) 3.534 6.537 ( 5.732 1.568 4.818) 7.650 6.898 ( 3.232 -1.756 0.970) 3.804 7.142 ( -2.688 -1.815 -5.954) 6.781 7.460 ( -7.639 -1.833 -2.617) 8.280 7.667 ( 0.978 1.434 -8.508) 8.683 7.975 ( 1.673 -0.932 -2.731) 3.335 8.310 ( -1.621 0.100 0.249) 1.643 8.961 ( 7.492 5.323 11.097) 14.409 9.064 ( 5.394 -3.751 9.657) 11.680 9.613 ( -0.060 -1.092 0.965) 1.458 9.833 ( -2.385 1.225 -8.439) 8.855 10.014 ( -7.911 -0.533 -3.293) 8.585 11.752 ( 6.217 1.406 1.814) 6.627 12.218 ( 1.021 2.407 18.365) 18.550 12.889 ( 1.982 0.282 -2.269) 3.026 13.560 ( -3.451 -0.779 0.606) 3.589 13.852 ( 0.043 -2.250 -5.406) 5.856 14.108 ( -2.760 0.954 -3.323) 4.424 16.866 ( 1.808 1.952 3.372) 4.295 16.969 ( 1.557 1.534 15.337) 15.492 17.811 ( 11.846 2.661 -1.392) 12.221 18.346 ( -9.683 5.173 11.693) 16.039 19.215 ( -3.768 -8.371 -23.167) 24.920 22.535 ( -2.734 -0.033 -0.109) 2.736 ======================= Grid point 440 (216/336) ======================= q-point: (-0.36 0.45 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.945 ( -9.929 2.165 3.775) 10.841 2.809 ( 8.338 7.566 5.180) 12.393 3.032 ( 0.897 10.981 12.196) 16.435 3.262 ( 2.825 1.024 5.311) 6.102 4.281 ( -4.947 -7.377 3.295) 9.473 4.495 ( 3.670 -2.302 -8.507) 9.546 4.723 ( -1.135 -8.952 -2.385) 9.333 5.259 ( -0.997 4.136 -4.351) 6.086 5.314 ( 5.348 3.071 4.923) 7.891 5.915 ( -4.673 -4.700 -1.922) 6.901 6.116 ( -1.129 -7.043 -6.242) 9.478 6.250 ( 0.965 1.505 -2.433) 3.020 6.663 ( 5.454 2.887 7.035) 9.358 6.991 ( 5.117 0.149 3.397) 6.144 7.157 ( 5.071 -3.738 -5.719) 8.509 7.341 ( -8.128 -5.520 -1.736) 9.977 7.629 ( 2.257 1.595 -8.963) 9.379 7.954 ( -2.353 -1.031 -4.021) 4.771 8.283 ( -1.936 -0.174 1.258) 2.316 9.063 ( 4.198 5.488 7.458) 10.167 9.264 ( 7.080 -1.653 9.813) 12.213 9.631 ( -2.028 -3.008 -0.221) 3.634 9.715 ( -0.923 3.195 -6.589) 7.381 9.933 ( -1.231 -1.576 -2.519) 3.216 11.846 ( 7.420 3.854 0.213) 8.364 12.298 ( -0.981 3.232 15.352) 15.719 12.789 ( -8.716 2.675 -4.536) 10.183 13.579 ( 2.148 -1.477 1.437) 2.976 13.850 ( -0.438 -4.704 -4.282) 6.376 14.042 ( -1.846 1.073 -1.063) 2.385 16.858 ( -2.307 2.021 -0.982) 3.220 17.049 ( 2.002 6.082 16.992) 18.158 17.995 ( 14.033 9.231 -3.895) 17.243 18.226 ( -0.659 6.903 5.833) 9.062 19.111 ( -9.632 -18.533 -13.662) 24.958 22.503 ( -1.213 0.112 0.434) 1.293 ======================= Grid point 441 (217/336) ======================= q-point: (-0.27 0.45 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.755 ( -11.165 2.602 -0.207) 11.466 2.865 ( 3.158 12.452 5.074) 13.812 3.005 ( 2.936 8.147 9.541) 12.885 3.362 ( 5.798 0.601 4.657) 7.461 4.280 ( -6.359 -8.367 2.930) 10.910 4.525 ( 3.424 -2.033 -8.973) 9.817 4.762 ( -3.003 -7.549 -2.589) 8.527 5.127 ( -4.326 0.155 -4.382) 6.160 5.385 ( 1.088 -0.031 -3.248) 3.425 5.868 ( -6.086 -4.713 1.933) 7.936 6.162 ( 1.769 -7.212 -4.120) 8.492 6.252 ( 3.457 -0.272 -5.128) 6.190 6.684 ( -2.070 7.733 5.940) 9.969 7.098 ( 5.878 0.780 -2.566) 6.460 7.220 ( 2.829 -3.330 2.335) 4.955 7.339 ( 0.200 -5.603 -2.304) 6.062 7.604 ( 0.827 -1.801 -6.115) 6.428 7.900 ( -1.460 -1.628 -4.521) 5.022 8.286 ( 0.394 -1.301 2.758) 3.075 9.032 ( -3.598 7.250 -1.101) 8.168 9.392 ( 1.761 0.628 1.490) 2.391 9.592 ( -2.842 -2.549 3.332) 5.067 9.728 ( 4.397 -0.349 -2.365) 5.005 9.974 ( 5.004 -0.015 3.570) 6.147 11.897 ( 5.088 8.579 -0.830) 10.009 12.310 ( -3.814 3.363 12.902) 13.868 12.591 ( -7.169 -0.116 -6.470) 9.658 13.623 ( 1.334 0.180 0.493) 1.434 13.851 ( -2.282 -2.958 -3.329) 5.004 14.045 ( 1.601 -2.333 1.803) 3.355 16.757 ( -3.266 6.303 -1.400) 7.235 17.137 ( 2.728 3.717 13.660) 14.417 17.832 ( -5.071 19.051 -9.131) 21.726 18.427 ( 19.283 3.278 4.852) 20.153 19.107 ( -9.463 -25.154 -5.429) 27.418 22.497 ( 0.253 0.825 0.942) 1.278 ======================= Grid point 442 (218/336) ======================= q-point: (-0.18 0.45 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.560 ( -7.891 2.823 -3.688) 9.156 2.791 ( -0.381 9.847 4.472) 10.822 3.062 ( 3.279 6.497 9.854) 12.250 3.470 ( 4.721 -0.793 0.194) 4.791 4.286 ( -3.992 -6.779 5.051) 9.349 4.500 ( -2.205 -0.430 -8.118) 8.423 4.716 ( -4.584 -2.048 -6.537) 8.243 5.103 ( 0.776 -7.296 -5.638) 9.253 5.347 ( -3.180 -4.823 -6.812) 8.932 5.833 ( -6.312 -6.126 1.871) 8.993 6.227 ( 2.773 -0.234 0.155) 2.788 6.315 ( 4.662 -5.030 -5.923) 9.062 6.550 ( -5.826 7.737 0.501) 9.698 7.127 ( 3.805 3.393 -1.630) 5.352 7.290 ( -2.626 3.315 -9.636) 10.523 7.393 ( 5.725 -5.636 7.071) 10.702 7.633 ( -1.449 -8.105 1.218) 8.323 7.916 ( 4.838 -2.198 -3.756) 6.507 8.348 ( 2.707 -1.746 2.469) 4.059 8.841 ( -6.795 8.808 -4.725) 12.086 9.321 ( -6.883 -1.534 -7.024) 9.953 9.615 ( -0.642 2.051 4.916) 5.365 9.789 ( 3.015 -1.475 -1.640) 3.736 10.122 ( 7.869 0.339 9.450) 12.301 11.812 ( -1.530 12.163 -1.046) 12.303 12.288 ( -6.209 0.837 12.712) 14.173 12.552 ( 5.467 -3.036 -6.756) 9.206 13.630 ( 0.211 0.619 -0.002) 0.654 13.791 ( -3.712 0.591 -2.745) 4.655 14.126 ( 1.830 -4.129 2.172) 5.011 16.647 ( -0.467 8.753 -1.119) 8.837 17.184 ( -2.433 3.944 3.221) 5.644 17.547 ( -0.303 14.444 -3.356) 14.831 18.705 ( 8.463 0.121 14.040) 16.394 19.191 ( -1.070 -20.618 -11.528) 23.646 22.502 ( 1.187 2.075 1.123) 2.641 ======================= Grid point 443 (219/336) ======================= q-point: (-0.09 0.45 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.417 ( -4.161 1.371 -4.853) 6.538 2.745 ( -0.910 3.251 3.371) 4.771 3.091 ( -0.264 4.792 9.187) 10.365 3.501 ( -0.766 -0.778 -3.230) 3.410 4.306 ( -5.073 -0.394 -2.737) 5.778 4.422 ( -1.787 -6.195 0.843) 6.502 4.594 ( -2.774 4.875 -7.708) 9.533 5.190 ( 4.360 -9.149 -7.772) 12.772 5.321 ( -3.177 -9.385 -5.935) 11.550 5.799 ( -5.815 -6.394 -0.216) 8.646 6.255 ( 0.444 4.965 3.978) 6.377 6.289 ( -5.195 2.910 -1.978) 6.274 6.523 ( 7.190 -6.523 -7.823) 12.468 7.079 ( -8.026 7.475 -7.107) 13.069 7.155 ( 4.283 5.684 -1.040) 7.193 7.563 ( 4.740 -4.049 4.297) 7.571 7.709 ( -0.686 -9.904 1.465) 10.036 8.050 ( 8.972 -3.946 0.003) 9.802 8.390 ( 1.176 2.203 -2.009) 3.205 8.644 ( -5.745 6.754 -0.312) 8.873 9.153 ( -8.730 -2.227 -10.938) 14.171 9.568 ( -3.144 4.997 2.755) 6.515 9.825 ( 1.504 -0.679 -1.525) 2.247 10.303 ( 6.220 -0.981 9.587) 11.470 11.680 ( -1.590 7.631 0.122) 7.795 12.245 ( -8.281 -0.860 11.704) 14.363 12.687 ( 11.394 0.108 -3.799) 12.011 13.623 ( -0.802 0.410 0.742) 1.167 13.708 ( -2.415 0.831 -4.044) 4.783 14.183 ( -0.123 -2.062 1.722) 2.689 16.555 ( 0.942 11.014 -1.740) 11.190 17.008 ( -5.812 8.286 -5.515) 11.526 17.593 ( 8.777 -0.654 6.914) 11.192 18.830 ( -12.109 -9.901 20.662) 25.915 19.301 ( 11.263 -4.574 -19.568) 23.036 22.509 ( 2.040 3.131 1.008) 3.871 ======================= Grid point 450 (220/336) ======================= q-point: ( 0.55 -0.45 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.967 ( -10.413 0.000 4.262) 11.251 2.883 ( 8.472 -0.000 3.568) 9.193 3.172 ( 5.615 -0.000 14.342) 15.402 3.239 ( -2.494 0.000 2.391) 3.455 4.201 ( -5.705 0.000 3.525) 6.706 4.473 ( 3.360 -0.000 -7.531) 8.247 4.634 ( -0.035 0.000 -2.528) 2.528 5.289 ( 5.587 -0.000 -0.238) 5.592 5.369 ( -2.966 0.000 0.838) 3.082 5.850 ( -4.509 0.000 -2.579) 5.194 6.048 ( 0.224 -0.000 -8.141) 8.144 6.279 ( 0.501 -0.000 -0.632) 0.807 6.700 ( 7.263 -0.000 8.180) 10.939 6.995 ( 7.532 -0.000 3.658) 8.373 7.109 ( 5.221 -0.000 -6.916) 8.666 7.286 ( -10.546 0.000 -1.757) 10.691 7.647 ( 1.629 -0.000 -9.296) 9.438 7.942 ( -2.424 0.000 -3.892) 4.585 8.282 ( -2.017 0.000 0.972) 2.239 9.133 ( 2.293 -0.000 6.706) 7.087 9.232 ( 9.597 -0.000 12.176) 15.503 9.602 ( -1.925 0.000 -1.191) 2.264 9.751 ( -1.018 0.000 -9.181) 9.237 9.911 ( -1.634 0.000 -0.524) 1.716 11.882 ( 8.273 -0.000 0.054) 8.274 12.324 ( -2.271 0.000 15.190) 15.359 12.819 ( -9.390 0.000 -1.978) 9.596 13.565 ( 3.436 -0.000 1.586) 3.785 13.804 ( -0.356 0.000 -5.606) 5.617 14.054 ( -2.191 0.000 -1.463) 2.635 16.876 ( -0.933 0.000 -0.750) 1.197 17.112 ( 0.756 -0.000 17.746) 17.762 18.081 ( 20.965 -0.000 -3.343) 21.230 18.309 ( -8.636 0.000 17.095) 19.153 18.915 ( -9.285 0.000 -25.627) 27.258 22.505 ( -1.016 0.000 0.452) 1.112 ======================= Grid point 452 (221/336) ======================= q-point: (-0.36 0.55 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.794 ( -11.035 1.267 0.790) 11.135 3.031 ( 7.921 4.474 3.987) 9.933 3.150 ( -4.248 6.279 4.379) 8.755 3.335 ( 3.263 -2.519 6.542) 7.732 4.140 ( -6.778 -4.724 3.997) 9.178 4.496 ( 4.910 -1.018 -7.548) 9.062 4.649 ( 0.603 -3.626 -2.179) 4.274 5.142 ( -10.474 0.806 -6.910) 12.574 5.411 ( -0.011 1.659 -0.978) 1.926 5.768 ( -5.656 -3.911 -2.895) 7.461 6.052 ( 4.036 -3.346 -7.851) 9.440 6.302 ( 4.259 2.536 1.140) 5.086 6.828 ( 3.721 6.448 8.954) 11.645 7.111 ( -2.262 -1.639 -4.777) 5.533 7.151 ( 3.101 -1.038 5.178) 6.124 7.226 ( 7.764 -4.929 -3.976) 10.019 7.597 ( -1.035 0.204 -8.259) 8.326 7.875 ( -2.255 -0.844 -4.362) 4.982 8.272 ( -0.124 -0.273 2.433) 2.452 9.143 ( -2.407 3.733 1.351) 4.642 9.405 ( 1.563 0.485 1.218) 2.040 9.530 ( -2.409 -2.580 1.190) 3.725 9.734 ( 3.691 0.339 -4.753) 6.027 9.968 ( 5.462 -0.354 6.380) 8.406 12.012 ( 9.545 3.283 -1.050) 10.148 12.330 ( -6.294 -0.014 10.666) 12.385 12.604 ( -13.499 0.595 -1.995) 13.659 13.644 ( 4.414 1.565 1.470) 4.908 13.781 ( -0.142 -3.184 -4.757) 5.726 14.032 ( -0.039 0.049 0.807) 0.810 16.839 ( -0.830 2.251 -2.844) 3.721 17.197 ( -1.562 2.063 16.535) 16.736 18.162 ( -5.591 14.485 2.449) 15.719 18.466 ( 18.577 1.704 4.424) 19.172 18.689 ( -8.132 -17.991 -16.654) 25.829 22.508 ( 0.918 0.320 1.076) 1.450 ======================= Grid point 453 (222/336) ======================= q-point: (-0.27 0.55 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.624 ( -6.524 3.243 -2.573) 7.727 2.964 ( -6.528 8.055 2.539) 10.675 3.168 ( 3.808 4.072 6.848) 8.831 3.417 ( 0.930 -3.691 0.343) 3.822 4.136 ( -4.224 -6.997 6.392) 10.376 4.526 ( 2.140 1.987 -7.202) 7.772 4.671 ( 0.989 -2.739 -4.977) 5.766 4.964 ( -7.065 -6.716 -7.199) 12.118 5.318 ( -5.326 0.869 -6.858) 8.726 5.710 ( -4.905 -5.756 -3.256) 8.234 6.132 ( 5.981 -5.213 -6.594) 10.317 6.370 ( 6.285 5.125 2.937) 8.625 6.728 ( -7.050 10.689 0.525) 12.815 7.145 ( 4.488 -3.616 1.391) 5.929 7.280 ( 2.968 -3.159 2.157) 4.841 7.330 ( 4.722 -0.041 -4.004) 6.191 7.529 ( -3.559 -2.887 -1.472) 4.814 7.871 ( 4.189 -2.163 -4.570) 6.566 8.320 ( 2.819 -1.074 3.475) 4.602 9.004 ( -6.165 8.020 -4.074) 10.905 9.287 ( -8.328 -2.322 -8.424) 12.071 9.618 ( 1.898 -1.060 6.529) 6.881 9.771 ( 3.588 -0.445 -3.816) 5.257 10.129 ( 6.769 0.294 11.089) 12.995 12.041 ( 0.165 11.753 0.086) 11.755 12.274 ( -7.626 -1.288 7.737) 10.940 12.466 ( -1.390 -6.340 -2.039) 6.803 13.670 ( 2.324 3.266 -1.370) 4.236 13.785 ( -0.780 -1.436 -2.028) 2.604 14.066 ( 1.895 -2.100 1.765) 3.334 16.784 ( 0.849 5.543 -2.314) 6.066 17.226 ( -3.874 1.107 10.409) 11.162 17.864 ( -6.911 18.303 -6.077) 20.486 18.561 ( -13.570 -15.868 11.581) 23.876 18.937 ( 24.582 -5.447 -10.913) 27.442 22.534 ( 2.134 1.262 1.322) 2.809 ======================= Grid point 454 (223/336) ======================= q-point: (-0.18 -0.45 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.496 ( -1.458 6.174 -4.112) 7.560 2.804 ( -8.401 2.942 2.360) 9.209 3.185 ( -2.105 4.741 6.336) 8.189 3.438 ( -2.467 -5.529 -3.264) 6.878 4.218 ( 0.164 -6.753 8.461) 10.827 4.400 ( -5.609 3.868 -8.433) 10.842 4.675 ( 3.142 2.387 -7.047) 8.077 4.981 ( 1.769 -12.809 -8.518) 15.484 5.198 ( -5.000 -3.484 -5.483) 8.197 5.680 ( -2.911 -5.738 -3.547) 7.347 6.245 ( 6.196 -4.261 -5.133) 9.105 6.403 ( -0.963 7.556 4.545) 8.870 6.531 ( -0.995 6.159 -4.713) 7.819 7.197 ( -5.993 4.563 -8.590) 11.425 7.249 ( 5.623 4.334 2.226) 7.440 7.423 ( 1.172 -10.794 0.417) 10.866 7.574 ( 1.815 -3.591 7.290) 8.326 7.983 ( 8.798 -3.201 -3.395) 9.959 8.402 ( 3.384 -0.433 1.951) 3.930 8.788 ( -6.563 8.380 -4.375) 11.508 9.114 ( -9.345 -2.319 -9.495) 13.523 9.638 ( -1.948 2.320 2.893) 4.189 9.805 ( 2.021 -1.245 -2.995) 3.822 10.289 ( 4.445 -0.427 10.917) 11.795 11.860 ( -6.181 11.257 1.500) 12.930 12.214 ( -7.862 -1.991 8.542) 11.778 12.614 ( 9.719 -7.456 -1.697) 12.367 13.664 ( 2.288 2.933 -2.695) 4.593 13.742 ( -2.221 2.855 -1.368) 3.867 14.133 ( 1.476 -3.094 1.498) 3.741 16.738 ( 2.360 8.236 -1.304) 8.666 17.133 ( -7.735 4.190 -2.737) 9.213 17.654 ( -0.794 7.634 4.048) 8.677 18.544 ( -18.124 -18.022 12.905) 28.632 19.285 ( 23.398 0.853 -11.061) 25.895 22.563 ( 2.631 2.440 1.023) 3.731 ======================= Grid point 455 (224/336) ======================= q-point: (-0.09 -0.45 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.406 ( 0.924 8.022 -2.868) 8.569 2.662 ( -11.107 -2.779 0.996) 11.493 3.093 ( -8.855 0.212 2.822) 9.296 3.420 ( -3.440 -3.204 1.152) 4.840 4.153 ( -7.649 3.135 -9.068) 12.271 4.412 ( 4.730 -4.243 3.634) 7.320 4.651 ( 4.383 5.936 -4.032) 8.408 5.088 ( 2.456 -12.564 -9.483) 15.931 5.183 ( -0.149 -7.588 -2.824) 8.097 5.686 ( 0.316 -4.025 -2.271) 4.632 6.237 ( -5.836 7.451 1.759) 9.627 6.336 ( 3.725 2.202 -2.133) 4.824 6.560 ( 6.541 -1.928 -7.790) 10.354 6.971 ( -7.300 7.504 -6.332) 12.235 7.283 ( 2.184 4.032 2.854) 5.401 7.573 ( 4.103 -10.779 -0.130) 11.534 7.680 ( 1.981 -2.570 6.134) 6.939 8.149 ( 8.849 -4.357 -2.096) 10.084 8.414 ( 0.218 3.923 -4.198) 5.750 8.618 ( -5.824 6.128 1.913) 8.668 8.930 ( -7.530 -2.542 -10.147) 12.889 9.578 ( -2.196 4.040 1.578) 4.861 9.818 ( 0.220 -1.374 -2.596) 2.945 10.403 ( 1.350 -1.746 7.563) 7.879 11.700 ( -4.655 6.503 2.429) 8.358 12.158 ( -8.557 -1.574 9.978) 13.238 12.829 ( 9.337 -4.262 -0.291) 10.267 13.649 ( -0.213 5.055 1.131) 5.184 13.679 ( 2.002 0.959 -6.312) 6.691 14.175 ( -0.217 -1.596 1.367) 2.113 16.647 ( -1.663 10.945 -3.853) 11.722 16.969 ( -2.495 4.354 -2.479) 5.597 17.715 ( 3.410 -4.806 7.992) 9.930 18.462 ( -20.881 -16.166 10.180) 28.302 19.522 ( 18.297 6.336 -10.347) 21.954 22.585 ( 2.897 3.037 0.433) 4.219 ======================= Grid point 463 (225/336) ======================= q-point: (-0.36 -0.36 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.658 ( -5.602 0.000 -1.824) 5.891 3.054 ( -11.308 0.000 2.074) 11.497 3.198 ( 5.801 -0.000 4.727) 7.483 3.379 ( -0.515 0.000 0.853) 0.997 4.065 ( -2.884 0.000 6.228) 6.863 4.549 ( 6.611 -0.000 -5.559) 8.637 4.639 ( 2.631 -0.000 -3.921) 4.722 4.893 ( -13.396 0.000 -8.759) 16.006 5.335 ( -6.676 0.000 -6.218) 9.123 5.650 ( -3.268 0.000 -5.228) 6.166 6.082 ( 7.029 -0.000 -7.102) 9.992 6.424 ( 6.253 -0.000 3.754) 7.293 6.890 ( -11.141 0.000 -4.580) 12.045 7.030 ( 6.265 -0.000 10.388) 12.132 7.281 ( 4.065 -0.000 -3.525) 5.381 7.314 ( 8.171 -0.000 0.314) 8.177 7.507 ( -4.563 0.000 -3.650) 5.843 7.849 ( 3.782 -0.000 -4.699) 6.032 8.310 ( 2.656 -0.000 3.563) 4.444 9.098 ( -5.053 0.000 -1.481) 5.266 9.250 ( -9.853 0.000 -11.425) 15.087 9.604 ( 3.355 -0.000 6.758) 7.545 9.767 ( 3.452 -0.000 -4.369) 5.568 10.132 ( 6.448 -0.000 12.000) 13.623 12.194 ( 7.676 -0.000 3.446) 8.414 12.262 ( -4.145 0.000 2.560) 4.872 12.361 ( -14.773 0.000 0.018) 14.773 13.729 ( 0.265 -0.000 -5.937) 5.943 13.745 ( 4.166 -0.000 2.627) 4.925 14.047 ( 0.966 -0.000 1.377) 1.682 16.839 ( 1.794 -0.000 -3.520) 3.951 17.235 ( -5.828 0.000 12.947) 14.198 18.195 ( -8.550 0.000 12.862) 15.444 18.237 ( -14.913 0.000 -15.628) 21.601 18.900 ( 27.475 -0.000 -3.419) 27.686 22.546 ( 2.485 -0.000 1.394) 2.850 ======================= Grid point 464 (226/336) ======================= q-point: (-0.27 -0.36 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.600 ( 1.927 3.629 -2.580) 4.852 2.847 ( -14.358 1.325 2.841) 14.696 3.249 ( -5.865 1.709 3.084) 6.843 3.340 ( -1.072 -3.359 -3.032) 4.650 4.128 ( 3.717 -2.518 7.696) 8.910 4.522 ( -3.907 8.866 -7.137) 12.034 4.683 ( 2.421 -1.757 -5.462) 6.228 4.744 ( 1.732 -10.717 -8.558) 13.823 5.171 ( -7.590 -0.240 -6.102) 9.741 5.601 ( -0.343 -2.288 -5.057) 5.561 6.182 ( 9.072 -1.874 -6.229) 11.163 6.509 ( 2.443 3.091 2.463) 4.647 6.670 ( -6.824 6.389 -4.035) 10.182 7.179 ( 0.010 -6.121 3.567) 7.085 7.305 ( -4.217 0.334 -8.068) 9.110 7.313 ( 3.890 1.838 1.168) 4.458 7.531 ( 4.158 -1.342 8.463) 9.525 7.936 ( 9.038 -1.503 -4.974) 10.425 8.391 ( 3.989 -0.462 3.521) 5.341 8.940 ( -7.411 7.326 -6.181) 12.116 9.053 ( -9.074 -4.485 -8.700) 13.347 9.660 ( -0.225 0.358 3.235) 3.262 9.787 ( 1.932 -0.534 -4.181) 4.637 10.285 ( 3.129 -0.090 11.946) 12.350 12.074 ( -10.312 10.266 4.474) 15.223 12.179 ( -8.728 -1.969 7.395) 11.608 12.449 ( 11.344 -8.126 -3.281) 14.334 13.701 ( 1.892 0.926 -6.394) 6.732 13.802 ( 1.583 2.574 2.390) 3.853 14.080 ( 1.129 -2.009 0.792) 2.437 16.852 ( 3.792 3.442 -2.164) 5.559 17.167 ( -9.039 0.234 3.593) 9.730 17.857 ( -10.458 12.267 -1.450) 16.185 18.217 ( -12.751 -15.326 8.671) 21.741 19.299 ( 25.298 0.410 -6.034) 26.011 22.595 ( 2.989 0.919 1.032) 3.293 ======================= Grid point 465 (227/336) ======================= q-point: (-0.18 -0.36 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.596 ( 5.903 10.408 -0.634) 11.983 2.624 ( -15.900 -1.395 3.136) 16.266 3.051 ( -15.547 -4.507 -4.689) 16.852 3.362 ( -2.051 -1.993 4.446) 5.286 4.243 ( -2.721 5.424 -3.686) 7.100 4.356 ( 5.567 -0.611 -1.321) 5.754 4.708 ( 2.542 -1.690 -5.110) 5.952 4.866 ( 5.163 -8.481 -7.316) 12.333 5.073 ( -2.715 -4.143 -2.555) 5.573 5.623 ( 3.443 -2.487 -2.920) 5.154 6.315 ( 9.306 -0.434 -5.717) 10.930 6.417 ( -5.291 7.482 1.666) 9.314 6.583 ( 2.825 3.319 -6.082) 7.483 7.095 ( -6.802 5.072 -4.887) 9.792 7.247 ( -4.377 -9.204 -1.278) 10.272 7.435 ( 7.032 -0.519 5.397) 8.879 7.656 ( 3.424 -0.790 6.887) 7.732 8.081 ( 9.658 -2.769 -4.816) 11.142 8.463 ( 2.386 1.267 0.830) 2.825 8.723 ( -6.447 4.728 -4.664) 9.256 8.895 ( -8.334 -1.173 -7.359) 11.180 9.636 ( -1.857 1.970 -0.062) 2.708 9.790 ( -0.066 -1.350 -2.638) 2.964 10.375 ( -0.211 -1.107 8.747) 8.819 11.858 ( -7.923 9.494 4.232) 13.070 12.123 ( -8.072 -2.218 10.334) 13.299 12.692 ( 10.621 -8.452 -1.890) 13.704 13.694 ( 3.500 0.852 -7.522) 8.340 13.777 ( -0.320 6.966 2.025) 7.261 14.125 ( 0.493 -3.437 0.498) 3.508 16.832 ( -0.718 8.409 -2.981) 8.951 17.016 ( -5.244 0.374 -3.537) 6.337 17.681 ( -6.499 1.119 7.959) 10.336 18.182 ( -14.740 -12.860 8.776) 21.440 19.612 ( 20.924 3.256 -8.086) 22.667 22.633 ( 2.775 1.846 0.142) 3.336 ======================= Grid point 466 (228/336) ======================= q-point: (-0.09 -0.36 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.556 ( 2.863 15.706 2.549) 16.167 2.380 ( -19.370 -4.254 1.476) 19.887 2.869 ( -12.030 -9.222 -0.794) 15.179 3.354 ( -6.722 -2.912 8.522) 11.238 4.034 ( -4.877 5.718 -11.279) 13.553 4.522 ( 8.813 0.792 -0.857) 8.890 4.736 ( 4.185 0.685 -3.927) 5.780 4.990 ( 4.564 -9.744 -1.568) 10.874 5.110 ( 1.347 -6.678 -3.578) 7.694 5.728 ( 8.669 -0.681 0.533) 8.712 6.272 ( -1.058 9.572 2.583) 9.971 6.415 ( 5.269 3.792 -6.095) 8.905 6.556 ( 1.306 0.651 -10.165) 10.269 6.935 ( -1.813 4.962 -1.755) 5.566 7.265 ( -3.137 -6.993 0.757) 7.702 7.586 ( 5.407 -5.644 1.296) 7.922 7.729 ( 0.715 -0.164 4.959) 5.013 8.228 ( 8.212 -3.062 -4.144) 9.695 8.413 ( -1.623 4.957 -5.785) 7.789 8.592 ( -6.629 6.675 2.957) 9.861 8.766 ( -2.921 -4.216 -5.124) 7.250 9.596 ( 0.578 1.970 -1.135) 2.346 9.775 ( -2.012 -1.587 -1.495) 2.966 10.412 ( -2.383 -2.302 5.275) 6.229 11.695 ( -6.003 6.885 3.692) 9.852 12.067 ( -9.459 -0.790 11.370) 14.811 12.903 ( 7.005 -6.584 -0.977) 9.663 13.692 ( 1.691 3.495 -2.904) 4.848 13.729 ( 3.585 4.269 -3.382) 6.521 14.156 ( -0.741 -2.398 0.899) 2.666 16.629 ( -7.243 8.133 -6.498) 12.682 16.995 ( 2.108 1.785 -0.063) 2.763 17.677 ( -6.947 -9.475 8.047) 14.240 18.106 ( -13.475 -9.678 8.769) 18.766 19.810 ( 16.489 7.434 -8.666) 20.056 22.653 ( 2.330 2.110 -0.724) 3.225 ======================= Grid point 475 (229/336) ======================= q-point: (-0.27 -0.27 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.711 ( 9.412 -0.000 0.530) 9.427 2.610 ( -17.957 0.000 5.654) 18.826 2.990 ( -18.992 0.000 -9.358) 21.172 3.347 ( -1.848 0.000 5.700) 5.992 4.284 ( 10.831 -0.000 6.309) 12.534 4.404 ( -8.453 0.000 -14.251) 16.569 4.616 ( 2.684 -0.000 -3.495) 4.407 4.818 ( 9.451 -0.000 -5.792) 11.084 5.034 ( -5.068 0.000 -2.176) 5.516 5.599 ( 4.521 -0.000 -3.122) 5.494 6.305 ( 11.766 -0.000 -6.136) 13.269 6.500 ( -4.275 0.000 -0.122) 4.277 6.633 ( 0.665 -0.000 -5.641) 5.680 7.109 ( -4.624 0.000 0.331) 4.636 7.157 ( -7.427 0.000 -4.859) 8.875 7.446 ( 5.936 -0.000 5.915) 8.380 7.648 ( 4.126 -0.000 6.993) 8.120 8.053 ( 10.145 -0.000 -5.933) 11.752 8.472 ( 3.467 -0.000 3.361) 4.829 8.772 ( -9.468 0.000 -11.879) 15.190 8.884 ( -6.167 0.000 -2.002) 6.484 9.653 ( -1.579 0.000 -1.014) 1.876 9.776 ( -0.168 0.000 -2.446) 2.452 10.365 ( -0.974 0.000 9.267) 9.318 11.984 ( -9.885 0.000 3.278) 10.414 12.083 ( -8.345 0.000 13.599) 15.956 12.594 ( 12.331 -0.000 -3.896) 12.932 13.703 ( 3.577 -0.000 -7.936) 8.705 13.858 ( 0.716 -0.000 2.851) 2.940 14.079 ( 0.264 -0.000 -0.487) 0.554 16.934 ( 5.117 -0.000 -1.250) 5.267 16.997 ( -11.473 0.000 -4.024) 12.158 17.713 ( -14.068 0.000 5.971) 15.282 18.039 ( -8.864 0.000 9.019) 12.646 19.643 ( 21.889 -0.000 -7.292) 23.071 22.650 ( 2.739 -0.000 0.034) 2.739 ======================= Grid point 476 (230/336) ======================= q-point: (-0.18 -0.27 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.842 ( 8.273 11.371 5.727) 15.184 2.345 ( -20.512 0.595 5.939) 21.363 2.653 ( -18.178 -10.931 -7.422) 22.473 3.318 ( -7.880 -0.815 9.214) 12.152 4.156 ( -6.280 5.668 -14.413) 16.712 4.513 ( 11.899 -1.577 0.161) 12.004 4.675 ( 3.661 -4.492 -3.608) 6.826 4.916 ( 6.560 0.835 -1.890) 6.878 5.009 ( 0.722 -3.864 -0.646) 3.983 5.716 ( 10.998 -0.431 0.818) 11.037 6.436 ( 0.513 5.657 0.673) 5.720 6.466 ( 11.564 1.455 -6.504) 13.347 6.574 ( -0.699 1.952 -8.856) 9.096 7.019 ( -5.317 2.820 -1.254) 6.148 7.076 ( -4.221 -9.085 -0.701) 10.043 7.546 ( 2.643 -0.228 2.932) 3.954 7.730 ( 1.329 0.068 5.262) 5.428 8.187 ( 10.279 -1.173 -5.587) 11.758 8.504 ( -0.992 4.608 -1.584) 4.972 8.607 ( -4.031 -4.054 -2.247) 6.143 8.763 ( -5.999 2.566 -2.628) 7.034 9.613 ( -0.443 0.110 -4.622) 4.645 9.756 ( -1.986 -0.433 0.752) 2.168 10.378 ( -3.358 -1.037 6.178) 7.107 11.831 ( -8.021 5.729 4.062) 10.661 12.047 ( -8.309 -1.089 13.751) 16.103 12.772 ( 9.160 -5.171 -3.284) 11.020 13.719 ( 4.821 0.543 -8.384) 9.686 13.845 ( -0.636 5.322 2.157) 5.777 14.094 ( -0.040 -3.293 -0.431) 3.321 16.755 ( -10.162 4.320 -7.664) 13.442 17.003 ( 3.030 -0.508 -1.484) 3.412 17.554 ( -13.536 -3.421 10.288) 17.343 17.975 ( -8.951 -3.776 9.552) 13.624 19.906 ( 18.562 2.653 -8.857) 20.738 22.681 ( 1.976 0.812 -1.140) 2.422 ======================= Grid point 477 (231/336) ======================= q-point: (-0.09 -0.27 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.747 ( -7.797 20.626 5.796) 22.800 2.059 ( -17.025 -3.218 11.322) 20.697 2.568 ( -9.365 -16.630 -0.912) 19.108 3.223 ( -13.838 -2.585 11.486) 18.169 3.971 ( -0.126 4.178 -10.062) 10.895 4.645 ( 6.782 0.146 -7.736) 10.289 4.760 ( 4.969 -2.700 -2.848) 6.332 5.037 ( 4.951 -3.073 4.446) 7.329 5.080 ( 5.716 -3.440 -3.362) 7.471 5.959 ( 17.127 2.068 4.535) 17.837 6.400 ( 0.973 10.336 2.475) 10.672 6.428 ( -0.655 2.839 -8.534) 9.018 6.602 ( 8.704 5.440 -8.124) 13.090 6.932 ( -1.521 -0.269 -2.760) 3.163 7.137 ( -0.568 -10.668 0.029) 10.683 7.581 ( 0.107 -4.817 -2.200) 5.297 7.760 ( -0.164 0.562 4.031) 4.074 8.334 ( 9.360 0.347 -1.682) 9.516 8.395 ( -2.290 4.662 -4.223) 6.694 8.566 ( -6.552 6.082 3.353) 9.548 8.683 ( -0.196 -5.361 -1.200) 5.498 9.598 ( 1.840 -2.177 -7.371) 7.903 9.734 ( -2.086 0.548 4.045) 4.584 10.360 ( -4.620 -2.264 4.179) 6.628 11.670 ( -7.589 6.331 2.444) 10.180 11.977 ( -10.605 0.554 11.726) 15.820 12.929 ( 5.661 -6.071 -3.397) 8.969 13.742 ( 3.776 1.831 -3.629) 5.548 13.798 ( 1.565 4.247 -1.654) 4.819 14.124 ( -0.180 -2.952 0.833) 3.072 16.524 ( -7.317 4.443 -6.648) 10.839 17.015 ( -0.506 -0.524 -3.029) 3.116 17.448 ( -14.323 -8.764 8.102) 18.644 17.940 ( -8.530 -5.194 11.013) 14.867 20.089 ( 16.886 6.901 -8.733) 20.224 22.687 ( 1.100 1.057 -1.854) 2.401 ======================= Grid point 487 (232/336) ======================= q-point: (-0.18 -0.18 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.018 ( -9.017 0.000 15.621) 18.037 2.092 ( -20.796 0.000 12.223) 24.122 2.271 ( -6.232 0.000 -9.426) 11.300 3.202 ( -13.414 0.000 10.484) 17.025 4.020 ( -1.775 0.000 -12.058) 12.188 4.622 ( 5.251 -0.000 -8.267) 9.794 4.737 ( 6.869 -0.000 -0.761) 6.911 5.028 ( 3.969 -0.000 1.850) 4.379 5.038 ( 8.387 -0.000 -0.065) 8.387 5.977 ( 18.998 -0.000 4.994) 19.643 6.456 ( -0.575 0.000 -8.095) 8.116 6.534 ( -0.012 0.000 1.020) 1.020 6.652 ( 13.251 -0.000 -7.809) 15.381 6.947 ( -4.384 0.000 -1.387) 4.598 6.979 ( -0.125 0.000 -1.022) 1.029 7.542 ( -2.210 0.000 -2.265) 3.165 7.766 ( 0.049 -0.000 3.986) 3.986 8.334 ( 11.662 -0.000 -2.528) 11.933 8.462 ( -3.699 0.000 -3.428) 5.043 8.566 ( -1.284 0.000 5.800) 5.941 8.675 ( -5.141 0.000 -2.886) 5.896 9.571 ( 0.213 -0.000 -8.064) 8.067 9.741 ( -1.253 0.000 4.353) 4.530 10.337 ( -4.987 0.000 4.623) 6.800 11.746 ( -8.512 0.000 2.870) 8.982 11.982 ( -10.108 0.000 11.836) 15.565 12.854 ( 7.224 -0.000 -4.205) 8.359 13.755 ( 5.237 -0.000 -7.219) 8.919 13.862 ( -2.317 0.000 2.418) 3.350 14.081 ( 1.282 -0.000 -0.193) 1.297 16.572 ( -8.260 0.000 -7.867) 11.407 17.005 ( -0.891 0.000 -4.334) 4.425 17.361 ( -15.458 0.000 10.311) 18.581 17.890 ( -8.625 0.000 11.790) 14.608 20.156 ( 18.221 -0.000 -9.233) 20.427 22.697 ( 0.926 -0.000 -2.141) 2.333 ======================= Grid point 488 (233/336) ======================= q-point: (-0.09 -0.18 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.670 ( -22.719 17.017 9.248) 29.854 1.937 ( -14.845 -8.683 20.490) 26.751 2.304 ( -4.791 -9.681 5.998) 12.355 3.013 ( -17.312 -0.580 6.869) 18.634 4.011 ( 7.757 1.240 -3.836) 8.742 4.612 ( 0.524 -3.446 -12.936) 13.397 4.851 ( 7.373 0.343 1.266) 7.489 5.125 ( 6.850 1.315 0.585) 7.000 5.188 ( 8.922 -1.605 0.159) 9.066 6.343 ( 19.566 3.672 6.408) 20.913 6.369 ( 0.063 2.514 -4.891) 5.500 6.514 ( -0.427 5.284 1.420) 5.488 6.773 ( 10.445 3.638 -8.950) 14.228 6.841 ( -5.153 0.655 -3.483) 6.254 7.077 ( 4.617 -7.819 -2.419) 9.397 7.522 ( 1.628 -4.392 -2.145) 5.152 7.801 ( 2.506 0.467 4.099) 4.827 8.370 ( -2.831 3.233 -3.522) 5.556 8.485 ( -2.449 6.461 3.740) 7.857 8.543 ( 3.942 -0.329 1.838) 4.362 8.633 ( 0.302 -4.878 0.923) 4.974 9.532 ( -0.334 -2.471 -7.961) 8.342 9.772 ( 2.024 0.571 4.650) 5.104 10.276 ( -6.606 -1.439 3.344) 7.543 11.592 ( -9.496 4.607 0.611) 10.572 11.845 ( -13.645 -1.142 5.823) 14.880 12.950 ( 5.848 -2.762 -4.289) 7.761 13.798 ( 2.704 1.467 -1.365) 3.366 13.825 ( -0.146 0.653 -0.579) 0.885 14.133 ( 3.487 -1.154 2.384) 4.379 16.418 ( -4.231 1.624 -5.975) 7.500 16.926 ( -5.404 -1.262 -5.664) 7.929 17.191 ( -15.286 -5.623 7.406) 17.892 17.814 ( -11.648 -2.648 10.992) 16.233 20.384 ( 19.128 4.840 -7.453) 21.091 22.687 ( -0.207 0.363 -2.387) 2.423 ======================= Grid point 499 (234/336) ======================= q-point: (-0.09 -0.09 0.30) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.555 ( -20.197 0.000 13.847) 24.488 1.592 ( -20.342 0.000 17.020) 26.523 2.331 ( -1.402 0.000 23.798) 23.839 2.738 ( -19.864 0.000 2.123) 19.977 4.185 ( 12.975 -0.000 0.992) 13.013 4.488 ( -2.484 0.000 -14.765) 14.972 4.999 ( 8.439 -0.000 3.887) 9.291 5.268 ( 8.937 -0.000 -1.214) 9.019 5.309 ( 7.813 -0.000 -1.664) 7.989 6.320 ( -3.527 0.000 -1.728) 3.927 6.517 ( -0.708 0.000 0.713) 1.005 6.711 ( -7.622 0.000 -0.529) 7.640 6.764 ( 17.043 -0.000 2.790) 17.270 6.860 ( 9.749 -0.000 -9.088) 13.329 7.147 ( 8.272 -0.000 -3.256) 8.890 7.564 ( 6.616 -0.000 0.677) 6.650 7.918 ( 8.462 -0.000 5.257) 9.962 8.307 ( -4.416 0.000 -3.897) 5.889 8.369 ( -11.479 0.000 -1.527) 11.580 8.626 ( 1.672 -0.000 1.140) 2.024 8.722 ( 8.583 -0.000 8.236) 11.896 9.473 ( 0.418 -0.000 -6.485) 6.498 9.847 ( 3.652 -0.000 3.293) 4.917 10.151 ( -10.137 0.000 0.486) 10.148 11.463 ( -9.719 0.000 -1.155) 9.787 11.586 ( -16.910 0.000 -1.059) 16.943 13.021 ( 6.882 -0.000 -3.680) 7.804 13.789 ( -3.350 0.000 1.934) 3.868 13.856 ( 3.375 -0.000 -1.889) 3.868 14.255 ( 8.468 -0.000 6.481) 10.664 16.360 ( 0.423 -0.000 -4.415) 4.436 16.793 ( -5.440 0.000 -3.095) 6.259 16.945 ( -15.996 0.000 5.003) 16.760 17.641 ( -15.164 0.000 7.429) 16.886 20.680 ( 18.403 -0.000 -5.428) 19.187 22.661 ( -1.643 0.000 -2.028) 2.610 ======================= Grid point 500 (235/336) ======================= q-point: ( 0.00 0.00 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.700 ( -1.802 0.000 12.877) 13.003 1.833 ( 8.323 -0.000 9.373) 12.535 2.181 ( -9.211 0.000 3.145) 9.733 3.142 ( 0.691 -0.000 13.573) 13.591 3.942 ( -1.322 0.000 -11.234) 11.312 4.713 ( 7.599 -0.000 5.099) 9.151 5.375 ( 1.164 -0.000 -2.545) 2.799 5.381 ( 4.411 -0.000 2.660) 5.151 5.430 ( 1.874 -0.000 -1.630) 2.484 6.113 ( -5.788 0.000 2.409) 6.269 6.409 ( -7.818 0.000 3.407) 8.528 6.720 ( 5.116 -0.000 -7.147) 8.790 6.795 ( 7.580 -0.000 2.638) 8.026 7.099 ( -2.320 0.000 -5.723) 6.175 7.450 ( 3.822 -0.000 1.289) 4.034 7.747 ( 2.279 -0.000 1.846) 2.933 7.872 ( -7.880 0.000 1.022) 7.946 7.974 ( -4.741 0.000 -4.634) 6.630 8.487 ( 6.331 -0.000 2.530) 6.818 8.662 ( 4.261 -0.000 -3.594) 5.574 9.181 ( 1.810 -0.000 2.491) 3.079 9.508 ( 6.373 -0.000 1.350) 6.515 9.547 ( -8.472 0.000 -4.150) 9.434 9.979 ( -0.977 0.000 1.798) 2.046 11.079 ( -3.792 0.000 -3.421) 5.107 11.326 ( 1.683 -0.000 0.844) 1.883 13.031 ( -0.535 0.000 -2.624) 2.678 13.759 ( -0.794 0.000 1.090) 1.348 13.846 ( -0.503 0.000 -1.090) 1.201 14.679 ( 0.640 -0.000 3.509) 3.567 16.491 ( -5.694 0.000 -0.079) 5.694 16.524 ( 4.535 -0.000 0.063) 4.536 17.058 ( 16.370 -0.000 2.292) 16.530 17.183 ( -12.095 0.000 -1.436) 12.179 20.934 ( -0.478 0.000 0.060) 0.482 22.555 ( -2.119 0.000 -0.265) 2.135 ======================= Grid point 501 (236/336) ======================= q-point: ( 0.09 0.00 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.819 ( 0.741 0.832 5.087) 5.208 1.949 ( 2.740 -10.445 5.267) 12.014 2.322 ( 18.098 -3.530 9.186) 20.601 3.197 ( -0.734 1.122 7.210) 7.334 3.900 ( 1.216 -3.350 -7.128) 7.969 4.780 ( -0.206 1.489 -2.644) 3.042 5.333 ( 2.330 7.217 -2.385) 7.950 5.379 ( -5.475 0.601 -0.579) 5.538 5.505 ( 3.498 -6.075 -2.514) 7.448 6.020 ( -2.095 10.181 5.689) 11.850 6.360 ( -6.740 -7.160 6.371) 11.717 6.766 ( 4.269 -1.271 -5.316) 6.935 6.838 ( 0.081 4.158 -6.725) 7.907 6.974 ( -6.151 4.201 -1.190) 7.543 7.367 ( -12.195 -0.854 -2.521) 12.482 7.727 ( 1.175 9.162 -0.321) 9.243 7.877 ( 2.442 -0.651 4.114) 4.828 7.932 ( 1.957 0.444 2.641) 3.317 8.486 ( -3.924 1.919 -2.625) 5.096 8.645 ( -4.323 -3.081 -5.503) 7.646 9.247 ( 3.474 -3.882 -0.504) 5.234 9.517 ( 3.221 5.044 -1.299) 6.124 9.632 ( 8.737 -4.877 1.811) 10.169 9.962 ( -3.022 -1.503 2.059) 3.953 11.115 ( 4.189 -7.247 0.473) 8.384 11.441 ( 10.636 -3.688 -0.306) 11.261 12.954 ( -5.576 2.837 -1.246) 6.379 13.763 ( 0.518 0.584 1.380) 1.585 13.824 ( -2.011 -0.727 -0.556) 2.209 14.626 ( -5.862 4.497 1.931) 7.636 16.325 ( -10.653 -4.896 -0.073) 11.724 16.773 ( 17.130 -2.190 1.197) 17.311 16.951 ( -10.252 -2.994 -3.566) 11.260 17.489 ( 27.256 -3.357 0.127) 27.462 20.803 ( -11.496 7.332 0.803) 13.659 22.514 ( -3.161 0.044 1.136) 3.359 ======================= Grid point 502 (237/336) ======================= q-point: ( 0.18 0.00 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.743 ( -3.835 5.989 -0.007) 7.112 2.244 ( 10.399 -13.022 6.311) 17.820 2.760 ( 20.333 -7.227 8.373) 23.147 3.199 ( 0.329 0.445 -1.330) 1.441 3.954 ( 3.615 -5.767 -2.743) 7.339 4.653 ( -7.462 2.093 -10.267) 12.863 5.203 ( -12.021 3.209 -1.963) 12.596 5.306 ( 2.946 6.717 -1.927) 7.583 5.579 ( 1.949 -2.689 -4.121) 5.292 5.961 ( 1.694 8.954 8.061) 12.166 6.365 ( -6.660 -5.816 6.557) 11.008 6.662 ( -6.003 7.588 -10.373) 14.185 6.786 ( -2.101 6.859 1.382) 7.306 6.857 ( -0.290 -1.226 -4.523) 4.695 7.127 ( -14.271 -2.210 -5.191) 15.346 7.647 ( -1.328 3.888 -2.736) 4.936 7.940 ( 2.889 4.327 5.253) 7.394 8.029 ( 7.892 4.706 6.907) 11.495 8.339 ( -7.104 -1.245 -7.675) 10.532 8.600 ( -3.617 -4.505 0.491) 5.798 9.341 ( 3.363 -4.973 -2.513) 6.509 9.415 ( -6.506 1.698 -8.323) 10.700 9.847 ( 4.309 1.076 5.181) 6.824 10.002 ( 8.315 -3.671 3.844) 9.868 11.291 ( 7.454 -5.902 1.816) 9.680 11.740 ( 17.299 -10.799 0.833) 20.410 12.801 ( -8.474 4.401 0.536) 9.564 13.763 ( -1.322 1.550 1.019) 2.277 13.795 ( -1.622 -0.541 0.264) 1.730 14.464 ( -8.252 5.438 0.097) 9.883 16.246 ( -6.408 -7.378 0.183) 9.775 16.837 ( -5.641 -4.855 -3.529) 8.237 17.107 ( 18.803 -3.151 2.571) 19.238 17.985 ( 29.072 -6.006 -2.594) 29.799 20.457 ( -19.842 12.836 0.788) 23.645 22.474 ( -3.087 -0.486 2.308) 3.885 ======================= Grid point 503 (238/336) ======================= q-point: ( 0.27 0.00 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.605 ( -4.669 8.869 0.103) 10.024 2.544 ( 10.013 -8.426 3.173) 13.465 3.087 ( 3.211 -1.718 7.284) 8.144 3.251 ( 10.654 -6.929 -7.662) 14.840 4.080 ( 5.173 -6.874 -0.291) 8.608 4.416 ( -10.642 0.669 -12.681) 16.568 4.937 ( -14.063 5.262 -0.251) 15.018 5.270 ( 2.484 6.503 -4.260) 8.161 5.546 ( -0.652 5.362 -5.074) 7.411 6.003 ( 2.001 0.768 6.928) 7.252 6.266 ( -8.875 6.119 -3.008) 11.192 6.441 ( -10.683 2.357 3.937) 11.627 6.639 ( 1.732 10.860 -8.303) 13.779 6.900 ( -5.851 -6.641 -5.843) 10.605 6.955 ( -1.291 -4.294 0.658) 4.532 7.603 ( -0.221 -0.645 -2.178) 2.282 7.946 ( 0.472 6.150 4.790) 7.810 8.105 ( 3.665 5.152 -0.892) 6.385 8.278 ( 1.761 -1.198 0.632) 2.222 8.601 ( -3.440 -4.555 3.002) 6.450 9.191 ( -9.111 1.878 -13.159) 16.116 9.428 ( 1.154 -5.940 -1.116) 6.154 9.851 ( -1.894 0.414 2.106) 2.863 10.252 ( 11.744 -1.489 5.740) 13.156 11.462 ( 7.690 -2.662 0.577) 8.158 12.158 ( 17.802 -13.401 2.557) 22.429 12.625 ( -9.047 4.437 3.073) 10.534 13.708 ( -4.634 -0.179 0.518) 4.667 13.767 ( -1.118 3.885 -0.043) 4.043 14.299 ( -6.209 2.708 -0.701) 6.810 16.258 ( -2.186 -8.815 0.630) 9.104 16.806 ( -2.575 -5.678 -1.829) 6.497 17.447 ( 18.038 -1.451 3.191) 18.375 18.475 ( 26.342 -7.470 -5.524) 27.932 19.963 ( -24.930 15.660 1.354) 29.471 22.461 ( -1.549 -1.514 3.067) 3.755 ======================= Grid point 504 (239/336) ======================= q-point: ( 0.36 0.00 -0.60) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.439 ( -5.045 8.911 0.451) 10.250 2.727 ( 4.194 -2.360 -0.593) 4.849 3.099 ( 0.070 -1.950 -5.078) 5.440 3.452 ( 5.008 -4.805 3.717) 7.873 4.102 ( -8.647 -0.180 -11.888) 14.701 4.291 ( 2.522 -8.480 -2.191) 9.115 4.693 ( -9.910 4.981 2.405) 11.349 5.212 ( 1.796 6.833 -5.936) 9.227 5.430 ( -0.533 9.560 -3.508) 10.198 5.944 ( -10.382 7.576 1.415) 12.930 6.106 ( 0.162 -2.037 -5.165) 5.555 6.321 ( -7.860 -1.216 4.272) 9.028 6.558 ( 4.868 10.051 -7.218) 13.297 6.786 ( -6.749 -6.764 -5.371) 10.962 7.095 ( 5.332 -6.577 5.296) 9.987 7.619 ( 1.682 -1.882 -1.308) 2.843 7.910 ( -0.456 6.502 3.949) 7.622 8.102 ( 2.170 -0.243 -4.286) 4.810 8.345 ( 5.444 5.367 3.236) 8.301 8.588 ( -6.586 -5.207 1.633) 8.553 8.962 ( -7.027 1.145 -10.960) 13.070 9.478 ( -0.276 -4.709 -0.970) 4.815 9.832 ( -0.867 0.529 0.430) 1.103 10.434 ( 6.064 -0.439 3.522) 7.027 11.585 ( 5.269 -0.854 -0.185) 5.341 12.472 ( -4.582 3.246 0.351) 5.626 12.559 ( 10.603 -11.235 8.832) 17.795 13.634 ( -5.190 -1.264 -0.939) 5.424 13.689 ( -1.062 6.439 -0.968) 6.597 14.219 ( -2.531 -0.395 0.158) 2.566 16.332 ( 0.080 -8.977 0.175) 8.979 16.833 ( -0.385 -5.356 1.254) 5.514 17.736 ( 15.255 1.552 3.200) 15.664 18.864 ( 18.606 -6.676 -14.415) 24.465 19.430 ( -24.350 14.517 8.738) 29.665 22.490 ( 0.559 -2.318 2.819) 3.692 ======================= Grid point 505 (240/336) ======================= q-point: (-0.55 0.00 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.318 ( -2.340 2.837 0.496) 3.710 2.691 ( -5.739 2.755 -4.137) 7.592 3.095 ( -0.893 -0.952 -1.768) 2.198 3.538 ( -0.205 0.183 7.068) 7.073 3.890 ( -7.384 -1.922 -11.563) 13.854 4.391 ( 0.870 -6.025 -2.610) 6.624 4.596 ( -0.562 0.115 1.970) 2.052 5.123 ( 0.505 7.064 -6.309) 9.485 5.345 ( 2.403 9.515 -0.189) 9.816 5.766 ( -3.471 4.992 1.522) 6.268 6.103 ( -1.052 -4.744 -3.971) 6.276 6.252 ( -4.086 -2.539 -1.244) 4.969 6.472 ( -2.337 3.314 -7.080) 8.159 6.783 ( 2.350 -2.591 -0.454) 3.527 7.272 ( 4.485 -5.366 5.345) 8.802 7.658 ( 2.427 -0.056 -1.143) 2.683 7.872 ( 0.003 5.631 4.196) 7.023 8.128 ( 2.532 -2.321 -4.848) 5.942 8.354 ( 1.898 8.354 -1.698) 8.733 8.504 ( -8.772 -7.547 -1.596) 11.682 8.851 ( -0.920 1.385 -2.286) 2.826 9.503 ( 0.124 -2.802 -1.488) 3.175 9.815 ( -0.738 0.620 -0.131) 0.973 10.503 ( 1.205 0.444 1.296) 1.824 11.641 ( 1.287 -0.330 -0.128) 1.335 12.374 ( -7.211 1.481 7.440) 10.467 12.840 ( 7.348 -6.984 4.317) 11.018 13.564 ( -0.745 0.494 -4.893) 4.974 13.636 ( 0.227 2.638 0.211) 2.656 14.204 ( -1.079 -0.884 0.813) 1.615 16.404 ( -0.654 -6.981 -1.372) 7.144 16.906 ( 1.416 -4.453 4.087) 6.208 17.931 ( 9.681 4.773 3.142) 11.242 18.753 ( -15.469 9.569 -12.583) 22.117 19.318 ( 6.834 -4.347 7.093) 10.766 22.546 ( 1.888 -2.228 1.290) 3.192 ======================= Grid point 506 (241/336) ======================= q-point: (-0.45 0.00 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.336 ( 0.921 -7.710 0.275) 7.770 2.508 ( -9.608 4.845 2.518) 11.051 3.022 ( -6.771 4.230 1.924) 8.212 3.561 ( -0.954 2.284 7.961) 8.337 3.776 ( -2.178 -2.390 -7.882) 8.520 4.434 ( 2.659 -2.791 -2.903) 4.826 4.640 ( 2.939 -2.916 -2.337) 4.754 5.062 ( 2.625 3.596 -3.518) 5.675 5.294 ( 0.800 8.878 1.918) 9.118 5.772 ( 4.698 -0.615 3.051) 5.635 6.140 ( 2.776 -5.389 -3.795) 7.152 6.228 ( -0.861 -4.439 -2.505) 5.169 6.369 ( -4.047 -1.213 -4.333) 6.052 6.855 ( 4.853 0.486 -1.530) 5.111 7.353 ( -1.522 -0.028 2.067) 2.567 7.677 ( 2.448 2.417 -1.873) 3.917 7.855 ( -0.076 4.107 4.397) 6.017 8.156 ( 1.270 -3.617 -5.482) 6.690 8.276 ( -1.476 -0.401 -2.491) 2.923 8.476 ( -1.463 -2.615 0.744) 3.087 8.832 ( 0.394 2.532 0.914) 2.721 9.521 ( 1.912 -0.329 -3.096) 3.654 9.795 ( -1.442 0.233 1.042) 1.794 10.497 ( -1.453 1.193 0.916) 2.091 11.639 ( -2.279 -1.067 0.142) 2.520 12.290 ( -9.586 -0.298 10.300) 14.074 12.964 ( 1.505 -1.271 0.764) 2.113 13.567 ( 5.495 -0.333 -6.093) 8.212 13.644 ( 1.997 -0.225 0.053) 2.011 14.199 ( -0.973 -0.049 1.045) 1.429 16.417 ( -2.416 -3.475 -2.280) 4.807 16.987 ( 1.209 -2.144 2.546) 3.541 17.948 ( -4.260 7.381 1.856) 8.722 18.400 ( -10.225 8.503 2.743) 13.578 19.534 ( 10.219 -8.302 -3.259) 13.564 22.597 ( 1.985 -1.351 -0.992) 2.598 ======================= Grid point 507 (242/336) ======================= q-point: (-0.36 0.00 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.442 ( -3.161 -14.606 0.889) 14.970 2.398 ( -3.737 3.763 14.599) 15.533 2.831 ( -10.534 9.084 2.727) 14.175 3.493 ( -10.529 5.174 7.208) 13.769 3.807 ( 7.604 -1.693 -1.125) 7.871 4.479 ( 4.176 0.047 -8.111) 9.124 4.714 ( 5.165 -2.569 -1.149) 5.882 5.084 ( 2.643 0.430 -0.643) 2.754 5.246 ( 0.592 5.280 4.606) 7.032 5.955 ( 11.126 -7.594 2.249) 13.657 6.191 ( 0.489 -5.328 -4.944) 7.285 6.326 ( 0.367 -3.973 -5.979) 7.188 6.341 ( 6.771 -6.021 4.763) 10.236 6.884 ( 2.834 3.187 -4.900) 6.496 7.266 ( -5.140 4.438 -2.070) 7.099 7.654 ( 1.385 5.919 -3.091) 6.819 7.848 ( 0.277 2.229 4.661) 5.174 8.177 ( -0.220 -5.807 -5.697) 8.138 8.317 ( -1.077 -8.855 3.547) 9.599 8.504 ( 4.454 2.178 1.652) 5.226 8.812 ( -0.266 3.555 1.070) 3.722 9.521 ( 2.154 2.897 -4.981) 6.151 9.791 ( -0.479 -0.845 3.065) 3.215 10.450 ( -3.564 1.907 1.409) 4.280 11.589 ( -5.769 -2.014 -0.259) 6.116 12.189 ( -12.126 -0.740 11.226) 16.541 12.947 ( 0.134 3.066 -4.960) 5.833 13.655 ( 5.995 -3.428 -3.464) 7.726 13.697 ( 4.584 0.067 -0.940) 4.680 14.189 ( -0.473 0.782 1.545) 1.795 16.376 ( -2.621 -0.215 -2.361) 3.534 16.984 ( -1.901 1.788 -2.992) 3.970 17.724 ( -13.428 7.592 3.336) 15.782 18.263 ( -7.581 6.378 11.048) 14.839 19.777 ( 13.946 -10.408 -6.876) 18.711 22.620 ( 1.435 -0.412 -3.029) 3.377 ======================= Grid point 508 (243/336) ======================= q-point: (-0.27 0.00 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.493 ( -9.486 -14.540 6.203) 18.436 2.496 ( 3.457 0.350 19.896) 20.197 2.554 ( -12.780 14.471 4.125) 19.742 3.237 ( -17.857 6.920 5.777) 20.003 3.995 ( 11.748 -1.043 4.462) 12.610 4.433 ( 1.020 4.967 -13.639) 14.551 4.853 ( 8.236 -3.198 2.348) 9.142 5.120 ( 1.609 -2.015 2.237) 3.414 5.292 ( 4.015 1.465 5.447) 6.923 6.203 ( 0.789 -9.585 -2.689) 9.986 6.276 ( 5.147 -9.742 -0.900) 11.055 6.377 ( 8.736 -7.116 0.168) 11.269 6.580 ( 13.143 -3.228 0.873) 13.561 6.829 ( -0.407 5.278 -4.666) 7.057 7.124 ( -3.380 4.688 -5.195) 7.772 7.609 ( 3.301 6.453 -2.273) 7.596 7.894 ( 3.942 1.180 5.361) 6.758 8.180 ( -2.059 -6.109 -5.646) 8.570 8.352 ( -8.766 -10.311 1.172) 13.584 8.631 ( 10.496 3.508 4.320) 11.880 8.783 ( 0.312 2.827 3.581) 4.573 9.473 ( 0.583 4.915 -5.099) 7.106 9.835 ( 2.204 -0.931 3.199) 3.995 10.352 ( -7.497 2.399 0.469) 7.886 11.488 ( -8.689 -2.388 -0.958) 9.062 12.025 ( -14.706 3.869 7.545) 16.975 12.897 ( 2.711 2.171 -7.126) 7.927 13.745 ( 0.413 -5.705 0.332) 5.729 13.779 ( 7.617 2.073 -2.593) 8.310 14.211 ( 2.845 -0.181 3.261) 4.332 16.323 ( -0.612 1.984 -2.394) 3.169 16.880 ( -3.548 3.825 -4.583) 6.944 17.449 ( -14.445 8.872 3.641) 17.338 18.096 ( -15.333 5.123 10.541) 19.299 20.107 ( 18.374 -11.952 -5.167) 22.520 22.618 ( 0.852 0.006 -3.956) 4.047 ======================= Grid point 509 (244/336) ======================= q-point: (-0.18 0.00 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.521 ( -8.268 -11.637 11.955) 18.620 2.207 ( -14.072 19.608 6.789) 25.071 2.634 ( -4.815 1.533 13.603) 14.512 2.951 ( -11.588 2.716 10.651) 15.972 4.206 ( 5.511 0.135 -3.280) 6.415 4.306 ( 4.830 5.021 -5.021) 8.587 5.050 ( 9.180 -3.288 4.502) 10.740 5.211 ( 3.512 -4.589 2.183) 6.177 5.375 ( 4.376 2.349 4.056) 6.413 6.222 ( -6.975 -10.534 -2.498) 12.879 6.391 ( 5.585 -6.243 -0.799) 8.415 6.665 ( 6.851 -2.886 -2.143) 7.736 6.735 ( -1.382 3.143 -2.132) 4.041 6.824 ( 15.629 -2.385 0.951) 15.838 7.072 ( 5.461 -0.401 -3.453) 6.474 7.622 ( 5.504 3.725 -1.300) 6.772 8.025 ( 9.133 -0.191 5.128) 10.476 8.153 ( -4.583 -5.915 -5.024) 9.012 8.256 ( -11.786 -5.659 -1.501) 13.160 8.672 ( 1.157 4.873 -1.748) 5.304 8.925 ( 8.811 -1.034 12.661) 15.460 9.404 ( 0.970 4.828 -4.747) 6.840 9.903 ( 3.000 -0.274 2.139) 3.695 10.154 ( -13.540 2.597 -2.752) 14.059 11.360 ( -8.285 -1.657 -1.342) 8.555 11.725 ( -16.417 10.672 1.171) 19.615 12.927 ( 5.293 -1.779 -4.936) 7.453 13.782 ( -1.416 -3.126 0.741) 3.511 13.838 ( 3.840 1.892 -2.175) 4.802 14.347 ( 8.144 -3.640 5.621) 10.544 16.304 ( 3.220 2.804 -2.292) 4.846 16.789 ( -0.097 3.547 -1.190) 3.742 17.128 ( -16.318 10.016 1.788) 19.230 17.811 ( -20.226 4.004 6.005) 21.475 20.497 ( 17.973 -11.375 -2.249) 21.389 22.603 ( 0.212 -0.063 -3.463) 3.470 ======================= Grid point 510 (245/336) ======================= q-point: (-0.09 0.00 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.611 ( -1.405 -7.930 13.905) 16.069 1.866 ( -10.347 18.360 10.993) 23.770 2.415 ( -17.673 2.242 1.963) 17.923 3.015 ( 1.957 -1.035 17.730) 17.868 4.071 ( -2.944 3.329 -14.011) 14.699 4.510 ( 11.597 -0.631 7.444) 13.795 5.241 ( 6.941 -3.608 3.768) 8.683 5.322 ( 3.782 -3.681 0.848) 5.346 5.423 ( 3.448 4.568 1.135) 5.834 6.176 ( -8.098 -8.844 -1.188) 12.050 6.520 ( -2.165 -1.272 2.049) 3.241 6.646 ( 4.748 3.790 1.705) 6.310 6.699 ( 4.607 2.796 -7.312) 9.084 7.080 ( 4.920 -8.028 -4.291) 10.347 7.256 ( 14.933 -0.268 3.169) 15.267 7.686 ( 4.196 -0.376 -0.068) 4.213 8.046 ( -12.133 -3.993 -3.171) 13.161 8.094 ( -7.664 -1.991 -4.398) 9.057 8.264 ( 14.098 -0.733 5.225) 15.053 8.642 ( 1.575 2.754 -1.913) 3.704 9.117 ( 4.094 0.429 10.050) 10.860 9.394 ( 5.805 1.731 -2.272) 6.469 9.831 ( -17.078 1.560 -6.204) 18.237 9.967 ( 1.273 1.234 1.806) 2.531 11.231 ( -6.839 2.637 -3.609) 8.170 11.401 ( -10.316 6.438 0.661) 12.179 13.005 ( 4.085 -2.418 -3.534) 5.918 13.774 ( -1.999 -0.825 0.885) 2.336 13.853 ( 1.371 0.982 -1.699) 2.394 14.560 ( 7.560 -4.261 5.314) 10.176 16.358 ( 8.093 2.081 -1.524) 8.494 16.778 ( -15.097 5.005 1.030) 15.938 16.835 ( 7.117 4.140 2.205) 8.524 17.476 ( -19.744 2.406 1.435) 19.942 20.817 ( 10.811 -7.119 -0.861) 12.973 22.584 ( -0.807 -0.146 -1.958) 2.123 ======================= Grid point 512 (246/336) ======================= q-point: ( 0.09 0.09 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.841 ( -2.910 0.000 1.228) 3.159 2.073 ( 14.750 -0.000 6.848) 16.262 2.691 ( 21.413 -0.000 7.367) 22.645 3.207 ( -1.039 0.000 -0.458) 1.135 3.896 ( 3.738 -0.000 -2.458) 4.474 4.675 ( -7.927 0.000 -10.550) 13.196 5.229 ( -11.788 0.000 -2.272) 12.005 5.402 ( 2.065 -0.000 -1.415) 2.503 5.511 ( 4.177 -0.000 -5.168) 6.644 6.117 ( 0.913 -0.000 10.241) 10.282 6.248 ( -6.832 0.000 6.410) 9.368 6.750 ( -4.206 0.000 -13.214) 13.868 6.789 ( 2.928 -0.000 -4.255) 5.165 6.914 ( -4.862 0.000 2.665) 5.544 7.092 ( -17.927 0.000 -3.658) 18.296 7.679 ( -5.134 0.000 -6.733) 8.467 8.019 ( 3.246 -0.000 6.351) 7.133 8.052 ( 9.991 -0.000 10.248) 14.312 8.326 ( -9.335 0.000 -9.842) 13.565 8.551 ( -3.119 0.000 0.548) 3.167 9.287 ( 4.047 -0.000 -1.156) 4.209 9.436 ( -7.266 0.000 -10.330) 12.630 9.904 ( -4.144 0.000 2.502) 4.841 9.914 ( 18.337 -0.000 6.707) 19.525 11.237 ( 11.529 -0.000 4.059) 12.222 11.633 ( 15.982 -0.000 -0.504) 15.990 12.844 ( -9.108 0.000 0.525) 9.123 13.774 ( -3.598 0.000 -0.385) 3.618 13.794 ( 1.599 -0.000 1.758) 2.376 14.517 ( -10.151 0.000 -0.277) 10.155 16.173 ( -6.029 0.000 1.042) 6.118 16.792 ( -5.458 0.000 -2.837) 6.152 17.079 ( 21.002 -0.000 0.795) 21.017 17.925 ( 28.834 -0.000 -1.781) 28.889 20.580 ( -20.581 0.000 0.174) 20.582 22.469 ( -3.479 0.000 2.357) 4.202 ======================= Grid point 513 (247/336) ======================= q-point: ( 0.18 0.09 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.774 ( -3.252 6.977 3.407) 8.418 2.391 ( 15.150 -6.318 3.350) 16.753 3.044 ( 11.753 -2.016 9.896) 15.496 3.178 ( 3.751 -1.215 -11.717) 12.362 3.981 ( 5.163 -2.987 1.118) 6.069 4.433 ( -11.517 0.731 -13.901) 18.067 4.992 ( -14.904 1.092 -1.433) 15.013 5.385 ( 2.021 5.094 -4.536) 7.114 5.551 ( 2.308 -2.859 -6.936) 7.849 6.105 ( -2.739 8.172 8.308) 11.972 6.253 ( -4.976 -5.353 7.837) 10.716 6.573 ( -6.801 8.345 -6.255) 12.451 6.755 ( -8.958 -3.121 -8.732) 12.893 6.822 ( -0.821 2.430 -3.757) 4.549 6.878 ( -4.407 -3.233 1.677) 5.717 7.571 ( -3.042 -1.743 -6.651) 7.518 8.064 ( 0.750 5.212 5.845) 7.867 8.138 ( -4.365 -0.410 -7.102) 8.347 8.280 ( 7.837 0.010 8.538) 11.589 8.535 ( -1.683 -1.871 3.166) 4.044 9.206 ( -11.042 -0.277 -12.875) 16.964 9.357 ( 3.800 -1.405 -2.026) 4.530 9.858 ( -2.679 0.320 2.109) 3.424 10.222 ( 13.388 -1.298 5.450) 14.512 11.460 ( 12.325 1.327 3.870) 12.987 11.946 ( 17.668 -7.360 1.705) 19.215 12.685 ( -10.285 1.720 2.506) 10.724 13.702 ( -4.865 -0.143 -0.639) 4.909 13.826 ( 1.513 1.813 1.805) 2.972 14.333 ( -10.178 0.899 -1.891) 10.391 16.139 ( -1.653 -3.420 2.242) 4.411 16.733 ( -1.967 -2.022 -0.787) 2.929 17.437 ( 22.578 0.021 0.158) 22.578 18.368 ( 25.749 -3.304 -3.932) 26.257 20.167 ( -26.752 5.674 -0.085) 27.348 22.441 ( -2.184 -0.543 3.340) 4.027 ======================= Grid point 514 (248/336) ======================= q-point: ( 0.27 0.09 -0.60) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.641 ( -5.767 10.822 4.386) 13.024 2.670 ( 10.998 -3.668 0.345) 11.598 3.071 ( -1.368 -1.022 -8.557) 8.725 3.353 ( 8.913 -4.690 3.479) 10.656 4.095 ( -0.196 -1.794 -3.627) 4.051 4.170 ( -6.645 -2.867 -8.527) 11.184 4.743 ( -13.518 0.921 0.596) 13.562 5.333 ( 2.397 6.001 -7.143) 9.633 5.533 ( -0.240 0.926 -7.024) 7.089 6.024 ( -7.160 2.689 5.146) 9.218 6.160 ( -8.458 4.447 -2.156) 9.797 6.339 ( -8.872 3.459 0.292) 9.527 6.668 ( -7.665 -3.499 -1.085) 8.496 6.743 ( 7.937 7.187 -9.790) 14.508 6.964 ( 3.211 -7.128 5.975) 9.840 7.548 ( 0.567 -4.834 -5.297) 7.194 8.020 ( -0.637 4.178 -0.517) 4.257 8.090 ( -0.496 0.587 -0.008) 0.769 8.413 ( 1.994 -0.788 5.651) 6.044 8.554 ( 0.861 2.793 4.127) 5.057 8.955 ( -10.023 -1.717 -12.993) 16.499 9.416 ( 2.482 -1.790 -0.516) 3.103 9.836 ( -1.098 0.056 0.775) 1.345 10.421 ( 7.183 -0.828 2.605) 7.685 11.628 ( 9.781 4.769 1.927) 11.051 12.318 ( 13.376 -12.443 4.502) 18.816 12.526 ( -9.834 1.906 4.734) 11.080 13.620 ( -4.287 -0.274 -1.736) 4.634 13.812 ( -0.002 5.892 0.742) 5.938 14.193 ( -5.884 -2.052 -1.060) 6.321 16.199 ( 1.625 -5.032 3.075) 6.117 16.748 ( -0.010 -3.420 2.046) 3.986 17.781 ( 21.399 2.675 -0.775) 21.579 18.735 ( 18.454 -5.987 -9.759) 21.717 19.654 ( -28.332 8.672 4.043) 29.904 22.455 ( 0.233 -1.313 3.576) 3.817 ======================= Grid point 515 (249/336) ======================= q-point: ( 0.36 0.09 -0.60) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.458 ( -6.584 10.485 3.464) 12.856 2.749 ( -0.116 3.401 -5.823) 6.744 3.052 ( 1.568 -3.734 -4.079) 5.748 3.511 ( 2.343 -2.805 7.913) 8.717 3.882 ( -7.865 1.171 -12.286) 14.635 4.255 ( 2.031 -7.275 0.289) 7.559 4.581 ( -7.403 -1.845 1.771) 7.832 5.248 ( -0.015 6.504 -8.900) 11.023 5.473 ( 0.892 3.112 -5.429) 6.321 5.855 ( -8.706 4.401 1.831) 9.926 6.048 ( -2.120 -1.020 -1.654) 2.876 6.211 ( -6.327 -2.444 -3.715) 7.734 6.529 ( -6.067 4.277 -1.411) 7.556 6.817 ( 10.548 5.118 -2.963) 12.093 7.147 ( 4.452 -8.108 7.203) 11.723 7.596 ( 2.197 -5.490 -3.798) 7.028 7.978 ( 0.100 4.882 1.131) 5.013 8.088 ( 0.495 -1.269 -2.078) 2.485 8.393 ( -9.164 -3.073 -2.243) 9.922 8.539 ( 3.572 9.125 1.812) 9.965 8.826 ( -2.640 -3.801 -3.857) 6.024 9.467 ( 2.613 -0.967 0.027) 2.786 9.824 ( -0.663 0.287 -0.331) 0.795 10.506 ( 2.153 -0.165 0.266) 2.176 11.704 ( 5.331 6.677 0.773) 8.579 12.395 ( -9.767 0.782 7.608) 12.405 12.630 ( 5.896 -13.966 5.094) 15.993 13.565 ( -0.067 0.052 -4.022) 4.023 13.746 ( 0.414 7.487 -0.112) 7.499 14.161 ( -2.328 -3.611 0.715) 4.355 16.300 ( 2.562 -4.106 3.001) 5.694 16.818 ( 1.274 -4.541 4.953) 6.839 18.042 ( 16.598 6.595 -1.769) 17.948 18.832 ( -4.887 -1.225 -21.667) 22.245 19.295 ( -9.870 2.088 15.564) 18.548 22.510 ( 2.206 -1.577 2.599) 3.756 ======================= Grid point 516 (250/336) ======================= q-point: (-0.55 0.09 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.314 ( -3.566 4.650 1.580) 6.069 2.612 ( -5.972 6.038 -1.462) 8.618 3.064 ( -2.904 0.519 1.356) 3.247 3.586 ( -1.094 -0.435 8.931) 9.008 3.745 ( -0.169 -0.128 -8.242) 8.245 4.344 ( 1.671 -6.489 0.010) 6.701 4.559 ( -0.994 -5.455 -0.425) 5.561 5.132 ( -0.467 3.892 -8.114) 9.011 5.424 ( 0.149 3.741 -5.973) 7.049 5.761 ( -1.499 0.071 1.682) 2.254 6.062 ( 1.998 -3.193 -0.958) 3.886 6.141 ( -3.235 -4.868 -2.699) 6.438 6.398 ( -3.578 5.476 -0.361) 6.551 6.918 ( 9.423 5.625 -1.858) 11.130 7.302 ( 0.919 -5.293 5.200) 7.477 7.652 ( 1.255 -3.957 -3.147) 5.209 7.945 ( -0.270 3.172 1.810) 3.662 8.092 ( -0.138 -2.548 -5.201) 5.794 8.231 ( -7.595 -1.078 -3.481) 8.423 8.542 ( 3.706 6.097 2.972) 7.729 8.831 ( -0.096 -2.107 -0.413) 2.150 9.523 ( 4.364 0.519 -0.697) 4.449 9.801 ( -1.527 0.432 -0.117) 1.591 10.513 ( -0.642 0.549 0.026) 0.845 11.693 ( 1.073 6.761 0.530) 6.866 12.280 ( -11.526 -0.784 9.873) 15.196 12.823 ( -0.286 -12.467 3.618) 12.985 13.573 ( 4.776 0.689 -6.041) 7.732 13.709 ( 3.477 6.007 -0.294) 6.947 14.170 ( -1.624 -2.929 1.395) 3.628 16.374 ( 1.342 -1.002 2.572) 3.069 16.922 ( 1.769 -4.507 5.442) 7.284 18.108 ( 0.632 9.585 -4.503) 10.609 18.538 ( -9.429 5.443 -4.496) 11.779 19.378 ( 3.929 -7.843 2.578) 9.143 22.574 ( 2.637 -1.059 0.618) 2.909 ======================= Grid point 517 (251/336) ======================= q-point: (-0.45 0.09 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.280 ( -1.142 -2.388 1.276) 2.939 2.493 ( -3.475 6.304 10.645) 12.850 2.958 ( -7.873 5.043 2.650) 9.718 3.563 ( -7.864 1.415 6.399) 10.237 3.795 ( 9.181 0.740 0.376) 9.219 4.436 ( 3.774 -4.619 -2.551) 6.487 4.626 ( 2.681 -6.723 -1.064) 7.315 5.090 ( 2.435 -0.175 -5.399) 5.925 5.331 ( -2.839 2.829 -5.179) 6.549 5.820 ( 4.861 -5.446 0.577) 7.323 6.095 ( 0.357 -4.727 -4.986) 6.880 6.222 ( 1.886 -6.121 6.524) 9.142 6.326 ( 3.112 3.950 -1.026) 5.132 6.973 ( 5.969 6.119 -4.008) 9.441 7.307 ( -4.891 0.082 0.060) 4.892 7.671 ( -0.130 -2.749 -3.147) 4.181 7.936 ( 0.774 2.867 1.621) 3.384 8.063 ( -2.273 -4.583 -4.479) 6.799 8.179 ( -2.090 -3.602 0.861) 4.252 8.588 ( 6.037 4.984 4.553) 9.056 8.835 ( -0.786 -0.608 -0.957) 1.380 9.579 ( 5.530 3.127 -3.284) 7.152 9.776 ( -1.773 -0.634 2.342) 3.005 10.481 ( -2.716 1.380 0.815) 3.154 11.626 ( -2.322 5.889 0.364) 6.341 12.161 ( -12.592 -1.977 11.554) 17.204 12.907 ( -1.826 -7.427 -0.343) 7.656 13.610 ( 4.123 -0.189 -5.140) 6.592 13.748 ( 7.592 3.952 -1.689) 8.724 14.175 ( -1.733 -2.082 1.687) 3.191 16.394 ( 0.314 2.291 2.505) 3.409 16.990 ( -0.247 -1.388 1.055) 1.760 17.876 ( -11.639 8.293 -1.588) 14.379 18.402 ( -4.834 8.238 5.894) 11.223 19.561 ( 8.772 -12.276 -5.247) 15.974 22.613 ( 1.813 -0.251 -1.528) 2.384 ======================= Grid point 518 (252/336) ======================= q-point: (-0.36 0.09 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.313 ( -1.319 -4.115 5.643) 7.107 2.529 ( 2.225 3.528 17.549) 18.038 2.770 ( -9.533 8.985 4.504) 13.852 3.379 ( -14.588 7.017 5.454) 17.082 3.987 ( 12.147 0.405 5.269) 13.247 4.485 ( 2.893 -0.244 -9.667) 10.093 4.762 ( 6.318 -6.622 1.954) 9.359 5.109 ( 1.482 0.430 -2.136) 2.635 5.278 ( 0.167 -3.320 -0.613) 3.380 5.998 ( 5.421 -9.222 -1.741) 10.838 6.143 ( 2.277 -5.718 2.086) 6.498 6.266 ( 1.655 -4.356 -1.542) 4.908 6.500 ( 12.414 -4.554 2.624) 13.481 6.939 ( 0.511 6.327 -4.081) 7.547 7.193 ( -4.317 2.901 -4.719) 7.023 7.664 ( -0.272 -0.859 -3.040) 3.171 7.939 ( 1.708 1.599 1.573) 2.819 8.062 ( -1.713 -6.032 -4.406) 7.664 8.193 ( -3.245 -4.413 3.402) 6.448 8.708 ( 9.534 3.768 7.612) 12.768 8.806 ( -2.021 0.257 -1.147) 2.338 9.575 ( 2.205 5.655 -4.746) 7.705 9.809 ( 2.052 -1.799 3.659) 4.564 10.396 ( -6.848 2.250 0.168) 7.210 11.516 ( -4.746 5.268 0.270) 7.096 12.056 ( -11.031 -0.175 11.311) 15.801 12.910 ( -0.571 -1.812 -5.248) 5.581 13.654 ( 2.342 -3.168 -2.228) 4.526 13.831 ( 7.872 3.167 -2.852) 8.952 14.184 ( -0.781 -2.576 2.474) 3.656 16.384 ( 1.109 4.613 2.255) 5.253 16.948 ( -2.328 2.928 -2.984) 4.785 17.624 ( -10.520 9.203 2.359) 14.175 18.224 ( -12.921 8.521 7.076) 17.018 19.839 ( 13.502 -16.087 -5.936) 21.825 22.619 ( 0.678 0.171 -2.899) 2.982 ======================= Grid point 519 (253/336) ======================= q-point: (-0.27 0.09 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.393 ( 1.828 -1.684 11.911) 12.168 2.514 ( -8.012 11.944 0.519) 14.392 2.687 ( -0.588 4.458 22.484) 22.930 3.059 ( -16.982 9.092 5.919) 20.152 4.207 ( 10.324 0.293 3.561) 10.925 4.413 ( 1.107 4.829 -11.798) 12.796 4.964 ( 8.128 -5.655 4.452) 10.856 5.136 ( 2.090 -2.979 1.427) 3.909 5.365 ( 3.412 -4.767 2.187) 6.257 6.037 ( -5.730 -6.998 -2.781) 9.462 6.280 ( 5.571 -5.713 0.605) 8.002 6.474 ( 11.782 -12.602 1.386) 17.307 6.750 ( 8.369 -4.336 -2.491) 9.749 6.863 ( 1.472 4.438 2.229) 5.180 7.084 ( -0.281 2.772 -7.275) 7.790 7.657 ( 1.041 -0.661 -3.013) 3.255 7.973 ( -2.341 -6.730 -0.075) 7.126 8.051 ( -1.880 -3.790 -5.022) 6.566 8.195 ( -0.808 0.640 4.715) 4.826 8.752 ( -1.212 2.637 -1.524) 3.278 8.912 ( 9.789 0.310 11.664) 15.231 9.511 ( 0.619 5.975 -4.060) 7.250 9.892 ( 3.626 -1.076 2.147) 4.349 10.206 ( -12.921 2.874 -2.595) 13.488 11.399 ( -3.142 5.634 0.720) 6.491 11.905 ( -11.402 7.806 6.154) 15.126 12.892 ( 1.888 -1.715 -6.548) 7.027 13.710 ( 0.621 -4.163 0.184) 4.213 13.886 ( 4.436 3.085 -2.889) 6.128 14.255 ( 2.767 -5.923 4.073) 7.702 16.384 ( 3.882 5.741 1.602) 7.113 16.874 ( 0.645 4.986 -1.139) 5.155 17.357 ( -11.575 13.158 0.402) 17.529 17.924 ( -18.124 8.137 4.107) 20.287 20.205 ( 13.973 -18.974 -2.700) 23.718 22.603 ( -0.241 0.015 -2.947) 2.957 ======================= Grid point 520 (254/336) ======================= q-point: (-0.18 0.09 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.555 ( 8.341 1.474 14.167) 16.506 2.250 ( -7.733 19.825 5.587) 22.001 2.514 ( -19.316 9.609 6.013) 22.397 2.988 ( 1.225 -1.318 15.758) 15.861 4.176 ( -1.789 6.832 -13.968) 15.652 4.495 ( 10.329 -0.664 5.964) 11.946 5.134 ( 3.401 -6.110 1.973) 7.265 5.262 ( 6.556 -3.892 3.517) 8.396 5.470 ( 3.800 -1.320 2.328) 4.648 5.975 ( -7.955 -9.305 -3.428) 12.713 6.448 ( 5.919 -5.718 3.477) 8.935 6.709 ( -3.594 1.922 2.910) 5.008 6.745 ( 7.277 -4.166 -4.291) 9.419 6.935 ( 3.999 -1.312 -6.749) 7.954 7.179 ( 11.304 -7.464 2.320) 13.743 7.661 ( -0.853 -2.627 -3.614) 4.548 7.937 ( -9.339 -8.044 -2.321) 12.542 8.020 ( -3.008 -3.410 -4.388) 6.319 8.273 ( 8.543 1.558 5.796) 10.440 8.707 ( 0.394 3.403 -0.409) 3.451 9.128 ( 7.533 0.597 11.169) 13.485 9.454 ( 1.874 4.347 -3.749) 6.039 9.892 ( -11.651 4.667 -5.027) 13.521 9.979 ( -1.456 -0.753 1.243) 2.057 11.329 ( 1.506 7.439 0.380) 7.599 11.613 ( -12.422 14.981 -0.189) 19.462 12.931 ( 2.505 -4.862 -4.374) 7.003 13.743 ( -0.808 -2.479 0.944) 2.773 13.887 ( 1.281 2.550 -2.137) 3.565 14.422 ( 4.341 -9.641 4.908) 11.657 16.433 ( 8.090 5.752 1.311) 10.013 16.868 ( -0.343 4.752 1.991) 5.163 17.040 ( -4.681 15.771 -1.744) 16.543 17.567 ( -18.233 7.392 0.252) 19.676 20.567 ( 8.735 -18.794 -0.213) 20.726 22.579 ( -1.061 -0.314 -1.823) 2.133 ======================= Grid point 521 (255/336) ======================= q-point: (-0.09 0.09 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.771 ( 9.065 4.336 10.462) 14.506 2.000 ( -2.770 19.016 9.490) 21.433 2.225 ( -8.252 4.699 3.666) 10.179 3.119 ( 0.950 -2.076 12.801) 13.003 4.004 ( -1.224 6.179 -11.517) 13.127 4.692 ( 7.334 -1.995 4.470) 8.817 5.239 ( 1.934 -7.979 -1.691) 8.383 5.389 ( 2.588 -1.209 2.520) 3.809 5.519 ( 3.003 4.236 -0.358) 5.205 5.952 ( -5.751 -12.423 0.380) 13.695 6.494 ( -5.784 4.792 5.802) 9.491 6.715 ( 3.372 -3.962 -0.079) 5.203 6.797 ( 6.577 3.723 -6.836) 10.191 6.998 ( -1.658 -9.336 -3.672) 10.169 7.433 ( 7.271 -3.890 2.239) 8.545 7.626 ( -5.536 -8.735 -2.502) 10.639 7.860 ( -4.237 -2.724 1.061) 5.147 7.963 ( -3.138 -0.918 -3.621) 4.879 8.446 ( 5.475 -3.613 2.335) 6.963 8.705 ( 3.530 4.019 -1.420) 5.535 9.234 ( 3.213 4.603 4.303) 7.073 9.447 ( -0.306 -2.117 -2.367) 3.191 9.649 ( -3.207 6.697 -1.929) 7.672 9.991 ( -0.747 0.243 1.462) 1.660 11.243 ( -2.058 16.851 -2.998) 17.239 11.370 ( 0.970 4.519 0.774) 4.686 12.978 ( -0.717 -5.187 -2.720) 5.901 13.750 ( -0.670 -1.017 1.123) 1.657 13.862 ( -0.617 1.612 -1.219) 2.113 14.586 ( 0.472 -9.180 3.822) 9.955 16.558 ( 12.634 4.762 1.527) 13.587 16.603 ( -14.592 9.416 -0.753) 17.382 17.125 ( 17.018 7.216 0.552) 18.493 17.234 ( -11.694 5.467 -1.692) 13.019 20.795 ( -0.828 -14.445 0.719) 14.486 22.551 ( -2.070 -0.324 -0.265) 2.112 ======================= Grid point 524 (256/336) ======================= q-point: ( 0.18 0.18 -0.60) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.761 ( -6.979 0.000 6.826) 9.762 2.623 ( 14.998 -0.000 0.201) 14.999 3.061 ( -2.395 0.000 -10.907) 11.167 3.306 ( 10.314 -0.000 3.791) 10.988 4.062 ( 4.608 -0.000 3.045) 5.523 4.160 ( -11.440 0.000 -14.421) 18.407 4.748 ( -14.887 0.000 0.130) 14.888 5.408 ( 2.425 -0.000 -6.915) 7.328 5.515 ( 0.552 -0.000 -9.279) 9.295 6.058 ( -9.697 0.000 6.048) 11.429 6.198 ( -6.676 0.000 2.398) 7.093 6.393 ( -17.050 0.000 -8.728) 19.154 6.633 ( 3.539 -0.000 5.651) 6.668 6.840 ( 4.314 -0.000 -8.390) 9.434 6.863 ( 1.588 -0.000 3.377) 3.731 7.490 ( 0.130 -0.000 -7.009) 7.010 8.045 ( -0.269 0.000 -6.063) 6.069 8.121 ( -2.221 0.000 5.952) 6.353 8.387 ( -0.293 0.000 5.588) 5.596 8.598 ( 5.750 -0.000 7.010) 9.066 8.930 ( -11.996 0.000 -14.465) 18.793 9.402 ( 3.482 -0.000 -0.770) 3.566 9.836 ( -1.179 0.000 0.898) 1.482 10.412 ( 7.763 -0.000 2.282) 8.091 11.698 ( 12.176 -0.000 3.531) 12.678 12.175 ( 12.368 -0.000 4.143) 13.044 12.545 ( -10.601 0.000 4.469) 11.505 13.619 ( -3.950 0.000 -2.170) 4.507 13.875 ( 1.492 -0.000 2.163) 2.628 14.167 ( -8.155 0.000 -2.313) 8.477 16.151 ( 2.332 -0.000 4.341) 4.928 16.715 ( 0.009 -0.000 2.155) 2.155 17.811 ( 24.093 -0.000 -2.622) 24.235 18.673 ( 17.682 -0.000 -8.072) 19.437 19.737 ( -29.469 0.000 2.749) 29.597 22.443 ( 0.114 -0.000 3.866) 3.868 ======================= Grid point 525 (257/336) ======================= q-point: ( 0.27 0.18 -0.60) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.634 ( -9.690 6.128 6.479) 13.169 2.816 ( 7.750 3.477 -4.046) 9.409 2.962 ( -0.365 -4.885 -10.104) 11.228 3.461 ( 3.339 -1.739 7.648) 8.524 3.916 ( -7.014 1.577 -12.042) 14.025 4.152 ( 2.196 -3.062 2.634) 4.597 4.543 ( -11.498 -1.567 1.723) 11.731 5.366 ( 0.345 5.850 -9.971) 11.565 5.461 ( -0.877 -3.551 -9.396) 10.083 5.920 ( -10.464 2.020 4.024) 11.392 6.061 ( -6.407 2.203 -0.426) 6.788 6.147 ( -8.695 -3.864 -7.306) 11.996 6.663 ( -0.520 8.427 4.271) 9.462 6.913 ( 12.353 3.562 -6.063) 14.214 6.977 ( 2.793 -8.808 7.216) 11.724 7.497 ( 2.780 -3.708 -5.290) 7.033 8.035 ( 2.110 1.202 -3.672) 4.403 8.080 ( -4.942 0.150 2.451) 5.519 8.381 ( -3.723 1.031 3.260) 5.055 8.661 ( -4.256 2.847 -5.859) 7.781 8.748 ( 1.438 -2.658 0.766) 3.118 9.459 ( 3.742 -0.102 0.472) 3.773 9.827 ( -0.388 0.082 -0.394) 0.559 10.501 ( 2.840 -0.253 -0.400) 2.879 11.857 ( 9.381 7.514 1.764) 12.148 12.377 ( 0.568 -9.408 10.247) 13.923 12.407 ( -8.322 -0.589 2.698) 8.768 13.567 ( 0.560 0.113 -4.280) 4.318 13.877 ( 0.361 5.432 1.334) 5.605 14.082 ( -3.307 -3.944 -0.346) 5.159 16.250 ( 4.780 -1.254 5.962) 7.744 16.753 ( 0.849 -1.968 4.905) 5.353 18.150 ( 22.382 3.832 -5.472) 23.357 18.770 ( -0.176 -3.155 -19.587) 19.840 19.347 ( -19.846 2.074 14.185) 24.482 22.489 ( 2.403 -0.557 3.397) 4.198 ======================= Grid point 526 (258/336) ======================= q-point: (-0.64 0.18 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.450 ( -7.398 7.846 3.460) 11.325 2.727 ( -3.110 6.114 -4.768) 8.354 3.043 ( 2.927 -2.784 -0.203) 4.045 3.527 ( -3.758 -4.529 5.600) 8.124 3.796 ( 2.750 4.464 -4.645) 7.005 4.224 ( 0.808 -5.258 2.050) 5.701 4.449 ( -5.497 -5.683 1.299) 8.013 5.204 ( -4.829 3.603 -10.978) 12.523 5.430 ( 0.094 -1.996 -11.045) 11.224 5.783 ( -4.496 1.773 0.740) 4.889 6.015 ( -0.203 -1.765 0.554) 1.861 6.054 ( -3.960 -4.059 -2.363) 6.143 6.572 ( 0.041 11.886 1.374) 11.965 7.036 ( 11.088 5.998 -2.390) 12.830 7.156 ( 1.721 -9.773 6.608) 11.922 7.561 ( 2.567 -4.952 -3.470) 6.569 7.953 ( -8.343 -1.063 -1.137) 8.487 8.067 ( 2.031 -0.452 -4.958) 5.378 8.286 ( -3.270 5.929 0.130) 6.772 8.590 ( -1.489 -2.648 -0.344) 3.057 8.811 ( 2.789 1.356 2.037) 3.710 9.532 ( 5.037 0.339 0.984) 5.144 9.810 ( -0.967 0.460 -1.180) 1.593 10.518 ( 0.121 0.042 -0.654) 0.666 11.878 ( 4.367 12.327 1.015) 13.117 12.265 ( -12.995 -0.709 9.308) 16.001 12.548 ( -1.266 -15.729 5.009) 16.556 13.585 ( 5.282 0.533 -5.747) 7.824 13.833 ( 1.604 6.577 0.373) 6.780 14.098 ( -1.186 -4.488 1.142) 4.780 16.375 ( 4.857 0.742 6.742) 8.343 16.835 ( 1.344 -4.148 6.531) 7.852 18.297 ( 2.856 10.290 -10.093) 14.694 18.576 ( -2.972 -1.796 -11.846) 12.344 19.261 ( -5.151 -4.159 10.369) 12.302 22.558 ( 3.140 -0.542 1.862) 3.691 ======================= Grid point 527 (259/336) ======================= q-point: (-0.55 0.18 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.329 ( -0.766 6.094 1.444) 6.310 2.624 ( -1.956 7.234 7.074) 10.306 3.036 ( -3.829 3.565 2.477) 5.789 3.522 ( -5.857 -5.696 3.321) 8.819 3.851 ( 9.378 5.285 3.361) 11.277 4.320 ( 2.655 -7.027 1.036) 7.583 4.478 ( -0.050 -8.560 0.429) 8.570 5.065 ( -2.755 -2.411 -10.272) 10.905 5.352 ( -2.090 0.318 -11.266) 11.463 5.764 ( 2.560 -1.172 -0.685) 2.898 6.020 ( 0.901 -3.130 -5.610) 6.487 6.113 ( 1.271 -5.223 8.202) 9.807 6.478 ( 1.647 11.591 1.336) 11.783 7.102 ( 6.288 7.239 -3.282) 10.135 7.257 ( -2.694 -5.732 3.405) 7.191 7.602 ( 0.097 -3.934 -4.499) 5.977 7.858 ( -5.750 -6.213 0.054) 8.466 8.053 ( -0.036 -0.311 -6.543) 6.551 8.214 ( 0.510 6.244 2.631) 6.795 8.626 ( 1.532 -2.163 3.593) 4.465 8.837 ( 1.767 2.034 0.291) 2.710 9.623 ( 6.685 1.305 -0.280) 6.818 9.773 ( -2.350 0.391 -0.293) 2.400 10.502 ( -1.709 0.854 0.449) 1.963 11.798 ( -0.363 12.024 0.741) 12.053 12.124 ( -12.813 -1.689 11.208) 17.107 12.696 ( -0.836 -14.160 2.747) 14.448 13.629 ( 4.918 1.553 -5.928) 7.857 13.829 ( 4.704 4.249 -1.065) 6.428 14.122 ( -1.361 -3.180 1.350) 3.713 16.459 ( 3.406 4.384 6.990) 8.927 16.934 ( 0.813 -4.292 4.681) 6.403 18.021 ( -12.777 6.778 -5.356) 15.423 18.561 ( 2.294 8.428 -1.764) 8.911 19.333 ( 1.785 -11.632 -1.332) 11.843 22.611 ( 2.148 -0.053 -0.164) 2.155 ======================= Grid point 528 (260/336) ======================= q-point: (-0.45 0.18 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.332 ( 5.511 5.153 3.716) 8.410 2.628 ( 1.829 6.771 15.582) 17.088 2.914 ( -7.051 6.916 4.491) 10.850 3.455 ( -9.566 0.278 4.194) 10.449 4.018 ( 11.757 3.103 6.709) 13.888 4.424 ( 2.779 -5.682 -3.920) 7.442 4.611 ( 5.310 -9.137 2.034) 10.762 5.050 ( 1.015 -8.559 -7.731) 11.579 5.242 ( -2.522 1.926 -7.419) 8.069 5.878 ( 8.423 -4.526 -1.044) 9.619 6.052 ( 1.398 -4.210 -1.339) 4.633 6.206 ( -0.794 -2.857 4.413) 5.317 6.471 ( 6.583 3.361 2.096) 7.682 7.054 ( -2.281 5.201 -2.245) 6.107 7.231 ( -1.800 1.244 -3.652) 4.258 7.605 ( -1.095 -4.540 -4.030) 6.169 7.863 ( -3.378 -6.624 0.804) 7.479 8.006 ( -1.250 -1.969 -6.584) 6.984 8.211 ( 2.437 4.873 4.871) 7.308 8.715 ( 2.427 -2.905 5.287) 6.502 8.846 ( 3.208 3.917 1.289) 5.224 9.672 ( 2.470 4.442 -4.931) 7.082 9.769 ( 1.429 -2.431 3.798) 4.730 10.436 ( -5.819 2.018 0.102) 6.160 11.664 ( -3.718 9.592 1.158) 10.352 12.043 ( -7.297 -0.243 12.379) 14.371 12.809 ( 0.330 -8.769 -0.611) 8.797 13.637 ( 2.341 1.168 -4.691) 5.371 13.883 ( 6.383 1.787 -2.897) 7.234 14.129 ( -2.060 -2.690 1.439) 3.681 16.494 ( 2.851 6.954 6.613) 10.011 16.973 ( -0.673 -0.506 0.517) 0.988 17.776 ( -9.288 6.706 2.526) 11.731 18.412 ( -8.463 11.475 1.150) 14.304 19.525 ( 8.142 -17.077 -6.886) 20.133 22.624 ( 0.482 0.316 -1.793) 1.884 ======================= Grid point 529 (261/336) ======================= q-point: (-0.36 0.18 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( 10.385 6.350 8.708) 14.967 2.680 ( -1.605 7.648 5.240) 9.409 2.793 ( -2.760 6.271 17.738) 19.015 3.245 ( -14.259 8.763 4.179) 17.250 4.223 ( 10.611 1.367 5.495) 12.027 4.445 ( 0.967 -1.591 -9.320) 9.504 4.836 ( 9.720 -8.120 4.105) 13.314 5.119 ( 1.958 -1.558 -3.769) 4.525 5.192 ( -1.133 -9.353 -0.989) 9.473 5.993 ( 0.002 0.899 -0.516) 1.037 6.166 ( 5.263 -7.317 2.724) 9.416 6.267 ( 6.644 -7.681 -1.756) 10.306 6.625 ( 6.724 -6.525 1.967) 9.574 6.949 ( -3.444 3.875 1.388) 5.367 7.155 ( 0.164 4.089 -8.192) 9.157 7.600 ( -2.145 -5.006 -3.860) 6.675 7.844 ( -5.768 -5.460 -1.340) 8.054 7.989 ( -0.042 -3.334 -5.111) 6.102 8.248 ( 3.149 3.781 5.150) 7.123 8.766 ( -0.769 -0.400 1.825) 2.021 8.943 ( 8.761 2.397 8.917) 12.728 9.610 ( -0.636 4.305 -3.655) 5.683 9.857 ( 3.344 -2.583 1.496) 4.482 10.263 ( -11.750 3.165 -2.486) 12.420 11.542 ( -1.542 8.551 2.121) 8.944 12.016 ( -3.780 4.809 10.973) 12.563 12.854 ( 0.626 -2.945 -4.925) 5.773 13.647 ( 1.165 -2.036 -1.811) 2.963 13.940 ( 4.693 1.983 -3.769) 6.337 14.142 ( -1.575 -5.397 2.328) 6.085 16.515 ( 4.374 7.982 5.430) 10.598 16.957 ( 1.119 3.495 0.705) 3.737 17.582 ( -8.432 10.238 2.702) 13.536 18.117 ( -13.815 12.310 -0.603) 18.513 19.817 ( 9.321 -21.885 -4.770) 24.260 22.605 ( -0.816 0.179 -2.316) 2.462 ======================= Grid point 530 (262/336) ======================= q-point: (-0.27 0.18 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.642 ( 13.941 7.018 11.110) 19.158 2.518 ( -6.343 10.470 2.321) 12.459 2.789 ( -11.698 15.348 13.672) 23.650 2.999 ( -2.500 4.170 9.102) 10.320 4.286 ( 0.553 4.088 -11.895) 12.590 4.486 ( 7.826 -0.672 3.735) 8.698 5.057 ( 4.451 -1.757 2.829) 5.559 5.164 ( 5.925 -5.897 2.645) 8.768 5.319 ( 0.630 -13.909 0.428) 13.929 5.916 ( -5.027 2.617 -0.705) 5.711 6.320 ( 5.545 -7.752 0.046) 9.531 6.533 ( 10.129 -13.119 0.541) 16.583 6.715 ( -4.418 -3.325 0.805) 5.588 6.973 ( 5.490 -0.435 1.592) 5.732 7.080 ( 2.434 0.962 -6.407) 6.921 7.584 ( -2.792 -5.291 -4.926) 7.749 7.785 ( -7.091 -7.072 -1.664) 10.152 7.983 ( -0.279 -1.256 -3.925) 4.130 8.305 ( 3.767 1.535 3.983) 5.693 8.765 ( 1.549 3.136 2.641) 4.382 9.137 ( 8.331 0.388 10.592) 13.482 9.539 ( -0.287 4.327 -3.733) 5.722 9.927 ( 0.605 -3.716 0.270) 3.775 9.995 ( -12.610 5.028 -4.610) 14.336 11.485 ( 2.576 8.520 2.117) 9.149 11.910 ( -4.804 15.500 5.160) 17.028 12.850 ( 0.370 -3.204 -5.840) 6.671 13.686 ( 0.380 -3.394 0.680) 3.482 13.941 ( 1.198 2.902 -3.027) 4.361 14.228 ( 0.689 -10.394 3.382) 10.952 16.565 ( 7.768 8.015 4.541) 12.050 16.961 ( 0.729 4.897 3.575) 6.107 17.345 ( -4.016 15.323 -1.439) 15.906 17.756 ( -14.243 12.836 -3.872) 19.561 20.148 ( 5.663 -25.039 -0.730) 25.681 22.573 ( -1.478 -0.256 -1.620) 2.208 ======================= Grid point 531 (263/336) ======================= q-point: (-0.18 0.18 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.853 ( 9.178 4.727 7.286) 12.636 2.355 ( -5.229 8.969 4.659) 11.380 2.445 ( -5.324 25.555 8.639) 27.496 3.084 ( 1.894 -1.031 10.611) 10.828 4.142 ( -0.631 7.537 -12.094) 14.264 4.649 ( 6.262 -2.436 3.358) 7.512 5.114 ( 1.217 -4.439 -0.478) 4.628 5.336 ( 2.105 -4.689 3.319) 6.118 5.467 ( 2.362 -12.049 0.521) 12.289 5.817 ( -3.453 1.086 -0.223) 3.627 6.481 ( 3.171 -7.919 1.510) 8.663 6.642 ( -5.984 -1.382 1.831) 6.408 6.773 ( 3.774 -11.220 0.400) 11.844 6.925 ( 0.449 5.626 -9.241) 10.829 7.262 ( 7.309 -11.402 4.149) 14.165 7.527 ( -5.624 -2.785 -6.109) 8.758 7.758 ( -2.956 -7.535 -0.159) 8.095 7.956 ( -1.256 0.091 -2.475) 2.777 8.382 ( 2.307 -2.794 2.017) 4.147 8.793 ( 3.862 5.243 1.864) 6.774 9.292 ( 4.599 0.943 7.174) 8.573 9.466 ( -1.077 3.927 -4.620) 6.158 9.768 ( -4.299 5.527 -1.513) 7.164 9.962 ( -0.752 -3.261 -0.129) 3.349 11.479 ( 3.348 7.095 0.939) 7.902 11.657 ( -1.826 24.901 -0.245) 24.969 12.863 ( -1.443 -6.343 -3.337) 7.311 13.719 ( -0.338 -2.383 1.190) 2.685 13.902 ( -0.863 2.516 -1.662) 3.137 14.373 ( 0.171 -12.690 3.546) 13.177 16.669 ( 9.972 6.741 3.016) 12.409 16.801 ( -12.185 10.453 2.775) 16.293 17.324 ( 19.251 12.735 -1.987) 23.168 17.388 ( -13.180 11.658 -5.188) 18.345 20.422 ( -1.715 -24.430 1.612) 24.543 22.544 ( -1.949 -0.426 -0.265) 2.013 ======================= Grid point 532 (264/336) ======================= q-point: (-0.09 0.18 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.826 ( -8.018 1.385 -0.045) 8.137 2.229 ( 3.185 16.389 7.698) 18.385 2.469 ( 18.624 12.965 9.549) 24.620 3.168 ( 0.725 -1.399 5.765) 5.977 4.011 ( 1.168 7.721 -7.623) 10.912 4.733 ( -0.220 -3.160 -3.020) 4.377 5.194 ( 2.954 -6.692 -1.602) 7.488 5.340 ( -7.290 -4.337 0.060) 8.482 5.573 ( 1.940 -2.328 -1.555) 3.406 5.827 ( 1.032 -5.342 4.089) 6.806 6.482 ( -6.306 3.954 5.846) 9.464 6.669 ( 0.246 -10.903 -3.697) 11.515 6.800 ( -6.491 -4.837 -3.179) 8.697 6.885 ( 2.411 0.604 -4.938) 5.528 7.371 ( -11.082 -1.816 -6.465) 12.958 7.511 ( 6.215 -10.837 4.603) 13.313 7.839 ( 3.842 -5.231 2.879) 7.100 7.920 ( -1.328 -0.147 -0.365) 1.385 8.429 ( -1.610 -3.577 -1.249) 4.117 8.736 ( -4.045 6.061 -3.576) 8.117 9.362 ( 3.473 6.972 0.627) 7.814 9.434 ( 2.742 -3.024 -1.198) 4.254 9.729 ( 4.612 5.156 1.707) 7.125 9.972 ( -1.080 -1.462 1.323) 2.248 11.343 ( -2.061 14.306 -0.959) 14.486 11.597 ( 13.952 14.212 0.712) 19.929 12.861 ( -5.086 -6.566 -1.279) 8.403 13.740 ( -0.133 -1.878 1.251) 2.260 13.850 ( -2.217 1.874 -0.564) 2.957 14.478 ( -3.698 -10.538 2.244) 11.391 16.477 ( -11.472 10.009 -1.157) 15.268 16.853 ( 14.334 6.206 4.388) 16.225 17.066 ( -9.661 9.327 -5.153) 14.383 17.605 ( 27.401 8.584 -1.539) 28.755 20.543 ( -10.922 -19.815 1.864) 22.702 22.513 ( -2.651 -0.054 1.104) 2.872 ======================= Grid point 536 (265/336) ======================= q-point: ( 0.27 0.27 -0.60) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.535 ( -9.184 0.000 4.492) 10.224 2.805 ( -3.941 0.000 -6.102) 7.264 2.994 ( 8.791 -0.000 -1.554) 8.928 3.476 ( -5.728 0.000 4.739) 7.434 3.850 ( 4.536 -0.000 -3.527) 5.746 4.172 ( 0.202 -0.000 2.941) 2.947 4.385 ( -8.021 0.000 2.061) 8.282 5.246 ( -9.222 0.000 -11.922) 15.072 5.400 ( 2.881 -0.000 -12.128) 12.465 5.804 ( -5.782 0.000 0.118) 5.783 6.000 ( -3.826 0.000 6.123) 7.221 6.009 ( -0.872 0.000 -7.152) 7.205 6.741 ( 1.695 -0.000 -0.764) 1.860 7.007 ( 1.511 -0.000 8.822) 8.951 7.106 ( 11.864 -0.000 -3.078) 12.257 7.505 ( 2.854 -0.000 -2.652) 3.896 7.940 ( -10.575 0.000 -2.219) 10.805 8.064 ( 2.465 -0.000 -4.609) 5.227 8.379 ( -1.816 0.000 4.351) 4.715 8.519 ( -2.955 0.000 -5.559) 6.296 8.838 ( 3.081 -0.000 4.135) 5.157 9.535 ( 4.970 -0.000 1.403) 5.165 9.815 ( -0.567 0.000 -1.623) 1.719 10.518 ( 0.484 -0.000 -0.893) 1.016 12.065 ( 9.744 -0.000 0.359) 9.751 12.255 ( -13.510 0.000 7.166) 15.293 12.331 ( -5.742 0.000 8.259) 10.059 13.590 ( 5.538 -0.000 -5.713) 7.957 13.917 ( -0.613 0.000 1.478) 1.600 14.034 ( 0.347 -0.000 0.286) 0.450 16.385 ( 6.600 -0.000 8.648) 10.879 16.792 ( 0.718 -0.000 6.458) 6.498 18.471 ( -16.602 0.000 -16.801) 23.620 18.481 ( 21.470 -0.000 -10.410) 23.860 19.224 ( -10.273 0.000 13.877) 17.265 22.553 ( 3.327 -0.000 2.328) 4.060 ======================= Grid point 537 (266/336) ======================= q-point: (-0.64 0.27 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.438 ( -1.768 3.861 1.732) 4.587 2.740 ( -1.120 4.124 5.902) 7.287 3.093 ( 3.482 2.286 0.502) 4.195 3.394 ( -7.849 -5.742 2.272) 9.987 3.966 ( 10.525 5.372 4.513) 12.649 4.213 ( 1.166 -3.522 3.057) 4.807 4.330 ( -3.100 -5.976 1.494) 6.896 5.022 ( -8.578 -1.518 -12.723) 15.419 5.359 ( 1.573 0.344 -12.536) 12.639 5.755 ( 0.917 -0.111 -3.115) 3.249 5.981 ( 0.985 -1.034 -5.630) 5.808 6.039 ( 0.814 -2.246 9.671) 9.961 6.708 ( 2.204 10.602 -0.833) 10.861 7.099 ( -3.267 -8.112 6.039) 10.628 7.231 ( 8.618 4.296 -3.267) 10.169 7.534 ( -0.042 -2.839 -2.012) 3.480 7.777 ( -6.850 -2.115 -2.576) 7.617 8.045 ( -1.325 -0.264 -5.481) 5.645 8.344 ( 0.163 6.427 2.187) 6.791 8.536 ( 1.350 -5.678 1.209) 5.960 8.885 ( 1.709 1.836 2.973) 3.890 9.631 ( 5.537 -0.083 1.934) 5.866 9.785 ( -1.303 0.529 -2.769) 3.106 10.513 ( -0.917 0.294 0.352) 1.025 12.027 ( -9.824 7.716 2.479) 12.736 12.134 ( -2.270 6.832 8.362) 11.035 12.407 ( -0.217 -15.982 4.954) 16.733 13.653 ( 6.308 0.775 -6.019) 8.753 13.891 ( -0.837 2.030 0.325) 2.220 14.071 ( 1.663 -1.787 0.394) 2.473 16.539 ( 6.370 3.261 10.484) 12.693 16.852 ( 0.221 -3.356 5.806) 6.709 18.114 ( -15.230 2.709 -7.065) 17.006 18.697 ( 14.501 5.094 -12.201) 19.624 19.153 ( -8.636 -6.396 6.609) 12.616 22.611 ( 2.341 0.011 0.634) 2.425 ======================= Grid point 538 (267/336) ======================= q-point: (-0.55 0.27 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.451 ( 7.904 6.045 1.924) 10.135 2.763 ( 2.056 6.756 14.989) 16.569 3.043 ( -4.319 7.371 3.558) 9.254 3.382 ( -5.370 -7.614 2.819) 9.734 4.109 ( 9.788 6.684 7.703) 14.136 4.304 ( 2.672 -6.015 -0.604) 6.609 4.436 ( 5.149 -9.398 4.264) 11.533 4.880 ( -4.358 -7.495 -12.175) 14.947 5.300 ( 1.660 3.052 -9.752) 10.353 5.808 ( 6.777 -2.933 -3.568) 8.201 5.984 ( 1.026 -2.854 -4.874) 5.741 6.151 ( 1.859 -2.524 9.395) 9.905 6.627 ( 1.098 11.508 1.086) 11.612 7.072 ( -8.912 -4.394 1.527) 10.053 7.276 ( 4.404 4.332 -4.363) 7.563 7.520 ( -2.429 -4.214 -4.784) 6.823 7.761 ( 0.275 -3.921 1.231) 4.119 7.970 ( -4.002 -1.621 -6.490) 7.795 8.314 ( 1.218 5.262 2.509) 5.956 8.643 ( 3.651 -4.030 4.613) 7.131 8.913 ( 2.558 2.745 3.627) 5.218 9.725 ( -1.174 -1.829 3.358) 3.999 9.736 ( 3.957 2.187 -5.270) 6.944 10.468 ( -4.880 1.288 0.268) 5.055 11.815 ( -10.056 4.786 3.419) 11.650 12.100 ( -0.018 7.786 10.721) 13.250 12.600 ( 3.657 -12.931 2.013) 13.588 13.680 ( 3.018 2.842 -5.373) 6.786 13.881 ( 0.473 -1.871 -1.521) 2.457 14.103 ( 0.885 -0.130 -0.388) 0.975 16.636 ( 4.383 7.831 10.024) 13.454 16.926 ( 0.514 -4.323 3.970) 5.892 17.871 ( -9.868 3.435 2.488) 10.741 18.646 ( -2.495 13.331 -5.258) 14.546 19.212 ( 2.370 -16.115 -6.300) 17.464 22.630 ( 0.327 0.259 -0.984) 1.069 ======================= Grid point 539 (268/336) ======================= q-point: (-0.45 0.27 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.588 ( 13.969 7.753 4.876) 16.703 2.834 ( 2.283 8.746 12.343) 15.299 2.911 ( -5.958 6.329 9.901) 13.175 3.337 ( -7.771 0.575 3.724) 8.636 4.253 ( 7.572 1.672 5.633) 9.585 4.378 ( 1.653 -4.638 -4.013) 6.352 4.681 ( 11.444 -7.376 3.237) 13.995 4.892 ( 0.047 -13.772 -4.980) 14.645 5.238 ( 1.238 5.747 -5.234) 7.871 5.977 ( 9.900 -4.005 -6.400) 12.450 6.013 ( 1.364 -7.216 1.204) 7.442 6.220 ( 0.269 0.868 3.917) 4.021 6.578 ( 0.424 2.692 3.806) 4.681 6.978 ( -6.103 -1.450 1.865) 6.544 7.232 ( 0.178 4.266 -7.216) 8.384 7.495 ( -2.612 -5.492 -5.067) 7.916 7.782 ( -3.433 -1.357 -1.663) 4.049 7.919 ( 0.339 -4.176 -4.528) 6.169 8.312 ( 1.083 2.781 2.587) 3.950 8.762 ( 3.949 0.275 6.215) 7.369 8.982 ( 5.463 1.571 6.888) 8.930 9.665 ( -2.239 1.415 -2.777) 3.838 9.809 ( 2.815 -2.083 -0.679) 3.567 10.318 ( -10.863 2.433 -2.166) 11.341 11.678 ( -3.920 5.111 3.629) 7.393 12.123 ( 2.599 7.357 12.279) 14.548 12.764 ( 3.891 -6.819 -0.950) 7.908 13.645 ( -0.149 1.845 -3.655) 4.097 13.916 ( 1.252 -4.711 -2.863) 5.653 14.097 ( -0.714 0.661 -0.835) 1.282 16.673 ( 4.115 8.598 7.337) 12.028 16.993 ( 2.054 0.139 5.036) 5.441 17.729 ( -7.184 5.546 5.763) 10.751 18.377 ( -9.081 15.176 -4.928) 18.360 19.409 ( 5.166 -21.232 -8.231) 23.350 22.609 ( -1.334 0.246 -1.783) 2.241 ======================= Grid point 540 (269/336) ======================= q-point: (-0.36 0.27 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.789 ( 14.810 7.961 7.055) 18.235 2.704 ( -7.250 9.423 3.678) 12.445 2.959 ( 0.968 5.741 17.103) 18.067 3.172 ( -7.419 10.203 3.125) 12.997 4.317 ( 1.179 -0.575 -9.674) 9.762 4.456 ( 5.463 -2.478 4.352) 7.411 4.952 ( 9.241 -12.432 -1.322) 15.546 5.044 ( 3.746 -9.744 4.128) 11.226 5.170 ( -0.608 5.509 -0.514) 5.566 5.989 ( -1.903 1.656 -1.102) 2.753 6.185 ( 2.669 -4.296 -0.859) 5.131 6.304 ( 9.105 -10.955 -1.720) 14.348 6.617 ( -2.064 -4.691 4.959) 7.132 6.961 ( 1.197 -0.628 4.389) 4.592 7.138 ( -1.330 2.822 -8.364) 8.926 7.482 ( -0.933 -4.991 -5.232) 7.290 7.688 ( -7.405 -3.238 -3.293) 8.727 7.955 ( 1.794 -1.899 -3.156) 4.097 8.325 ( 0.754 0.664 1.957) 2.200 8.836 ( 4.235 4.531 6.185) 8.759 9.140 ( 7.398 -0.293 9.721) 12.219 9.603 ( -0.940 2.312 -3.231) 4.082 9.845 ( -1.495 -4.394 -1.791) 4.975 10.078 ( -11.271 3.556 -4.335) 12.589 11.626 ( 1.120 6.201 2.826) 6.906 12.164 ( 3.131 11.422 11.338) 16.396 12.815 ( 0.425 -0.910 -5.431) 5.523 13.629 ( -0.008 -2.163 -0.415) 2.202 13.959 ( 0.831 -3.528 -3.530) 5.060 14.077 ( -1.729 -3.073 0.710) 3.597 16.718 ( 6.510 7.812 5.479) 11.551 17.046 ( 1.195 4.166 7.855) 8.971 17.583 ( -3.980 9.941 2.253) 10.943 18.039 ( -8.871 16.898 -8.458) 20.875 19.662 ( 2.606 -26.215 -3.530) 26.580 22.570 ( -1.928 -0.096 -1.433) 2.404 ======================= Grid point 541 (270/336) ======================= q-point: (-0.27 0.27 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.948 ( 5.445 5.240 4.852) 8.980 2.544 ( -2.455 10.552 4.913) 11.895 2.872 ( -5.430 18.191 9.889) 21.406 3.108 ( 3.824 4.468 6.402) 8.693 4.247 ( 0.637 2.974 -11.983) 12.363 4.594 ( 3.961 -3.795 3.376) 6.441 5.103 ( 0.251 3.087 -0.450) 3.130 5.146 ( -3.421 -17.007 0.800) 17.366 5.249 ( 8.227 -5.909 2.381) 10.405 5.911 ( -1.639 6.516 1.622) 6.912 6.277 ( 2.186 -11.703 -4.845) 12.853 6.515 ( -2.120 -13.020 1.196) 13.245 6.647 ( 1.418 -1.754 3.352) 4.040 7.005 ( -0.714 1.668 -4.038) 4.427 7.113 ( 5.063 -3.456 1.022) 6.214 7.488 ( -0.430 -1.499 -5.091) 5.324 7.606 ( -4.569 -7.997 -1.880) 9.400 7.957 ( -0.617 -0.190 -2.379) 2.465 8.344 ( -0.066 -1.352 1.497) 2.018 8.899 ( 4.771 6.071 4.494) 8.934 9.295 ( 4.401 -0.102 6.906) 8.189 9.547 ( 0.112 3.870 -3.686) 5.345 9.812 ( -4.943 -2.629 0.380) 5.611 9.917 ( -2.121 0.515 -3.991) 4.549 11.614 ( 2.957 6.931 0.960) 7.596 12.104 ( 1.783 21.302 6.077) 22.224 12.768 ( -2.916 -3.044 -5.186) 6.683 13.664 ( 0.074 -3.261 1.140) 3.455 13.944 ( -1.189 1.188 -2.487) 3.002 14.142 ( -0.158 -10.895 2.221) 11.120 16.788 ( 4.909 5.469 2.201) 7.672 16.990 ( -5.616 10.109 10.221) 15.433 17.533 ( 8.324 10.026 -0.195) 13.033 17.690 ( -3.211 18.777 -11.919) 22.471 19.917 ( -2.806 -28.702 1.070) 28.859 22.537 ( -1.813 -0.320 -0.267) 1.861 ======================= Grid point 542 (271/336) ======================= q-point: (-0.18 0.27 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.866 ( -10.548 2.776 -0.473) 10.918 2.498 ( 3.926 13.010 5.344) 14.603 2.778 ( 9.669 16.983 10.644) 22.254 3.172 ( 4.002 2.591 2.930) 5.596 4.155 ( 1.747 6.652 -8.595) 11.008 4.667 ( -0.750 -4.058 -2.001) 4.587 5.108 ( 1.436 -1.903 -0.139) 2.388 5.184 ( -9.214 -12.641 0.318) 15.646 5.422 ( 3.671 -9.030 -1.977) 9.946 5.872 ( 2.741 6.509 3.930) 8.082 6.390 ( -0.293 -13.239 -5.586) 14.372 6.500 ( -8.561 -8.823 1.341) 12.367 6.690 ( -4.198 -1.697 3.377) 5.649 6.957 ( 2.813 3.676 -6.135) 7.685 7.250 ( 0.979 -7.446 -2.583) 7.942 7.424 ( -1.270 -0.982 0.149) 1.613 7.703 ( 4.512 -8.600 1.498) 9.826 7.921 ( -2.198 0.003 -1.265) 2.536 8.368 ( -0.372 -2.720 0.696) 2.832 8.860 ( -3.599 7.020 -2.348) 8.231 9.382 ( 2.906 -1.145 2.017) 3.718 9.501 ( 2.003 5.895 -2.470) 6.698 9.806 ( 1.885 1.795 3.650) 4.483 9.913 ( 1.524 -3.241 -0.410) 3.605 11.568 ( 0.067 9.932 -1.522) 10.048 11.970 ( 8.023 23.036 2.271) 24.498 12.732 ( -5.129 -6.547 -1.430) 8.438 13.694 ( -0.639 -2.915 0.955) 3.133 13.888 ( -2.619 1.859 -0.808) 3.312 14.262 ( -0.861 -11.754 2.004) 11.955 16.656 ( -10.151 8.336 -1.115) 13.182 17.002 ( 9.445 9.524 9.225) 16.279 17.295 ( -8.584 14.796 -8.114) 18.932 17.790 ( 26.162 10.592 -3.641) 28.458 20.093 ( -10.070 -27.294 2.855) 29.232 22.512 ( -1.823 0.047 1.060) 2.109 ======================= Grid point 543 (272/336) ======================= q-point: (-0.09 0.27 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.670 ( -9.357 -1.590 -2.091) 9.719 2.483 ( 6.399 12.200 4.679) 14.549 2.933 ( 13.439 9.484 10.871) 19.716 3.217 ( 5.317 3.331 -3.647) 7.257 4.089 ( 3.558 7.862 -3.781) 9.422 4.608 ( -6.314 -2.478 -8.771) 11.088 5.089 ( -12.447 -9.088 -0.594) 15.423 5.189 ( 2.082 -5.623 -1.357) 6.147 5.514 ( -0.108 -8.768 -3.695) 9.515 5.917 ( 4.815 4.075 5.939) 8.664 6.366 ( -8.823 -7.570 -3.626) 12.178 6.526 ( -1.936 -8.659 -2.771) 9.295 6.610 ( -8.912 -5.031 2.780) 10.605 6.937 ( 3.108 4.998 -2.940) 6.579 7.150 ( -8.420 0.410 -8.964) 12.305 7.547 ( 3.993 -5.692 4.140) 8.092 7.889 ( 0.009 -5.210 2.447) 5.756 7.899 ( 6.195 -4.850 2.639) 8.298 8.358 ( -2.659 0.424 -3.401) 4.338 8.698 ( -4.888 5.833 -0.819) 7.654 9.360 ( -5.158 -1.873 -8.893) 10.450 9.475 ( 2.179 6.562 -0.541) 6.935 9.849 ( 0.177 0.145 4.175) 4.182 10.036 ( 10.659 0.580 4.791) 11.701 11.452 ( 1.733 10.703 -1.449) 10.939 12.002 ( 16.003 16.129 1.888) 22.800 12.694 ( -7.432 -6.503 1.077) 9.934 13.716 ( -0.922 -3.267 0.903) 3.513 13.816 ( -3.957 1.476 -0.099) 4.225 14.330 ( -3.806 -8.243 0.695) 9.106 16.420 ( -6.583 10.273 -0.777) 12.226 16.971 ( -5.925 9.218 -5.561) 12.288 17.202 ( 13.372 7.150 6.113) 16.350 18.129 ( 28.997 8.694 -4.135) 30.553 20.120 ( -17.950 -22.436 2.263) 28.822 22.487 ( -2.044 0.900 2.187) 3.126 ======================= Grid point 548 (273/336) ======================= q-point: (-0.64 0.36 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.514 ( 8.097 -0.000 1.287) 8.198 2.835 ( 1.812 -0.000 15.558) 15.663 3.189 ( 3.948 -0.000 1.747) 4.317 3.223 ( -10.178 0.000 2.922) 10.589 4.240 ( 2.473 -0.000 1.999) 3.180 4.254 ( 15.354 -0.000 9.205) 17.902 4.268 ( -1.335 0.000 2.883) 3.177 4.806 ( -6.130 0.000 -13.786) 15.087 5.332 ( 3.254 -0.000 -10.376) 10.874 5.778 ( 5.524 -0.000 -4.951) 7.418 5.955 ( 0.487 -0.000 -5.888) 5.908 6.126 ( 2.810 -0.000 11.048) 11.400 6.796 ( 2.736 -0.000 -2.656) 3.813 6.970 ( -11.639 0.000 5.659) 12.942 7.340 ( 5.832 -0.000 -5.508) 8.022 7.466 ( -4.771 0.000 -3.094) 5.687 7.723 ( 2.167 -0.000 0.564) 2.240 7.954 ( -5.146 0.000 -6.231) 8.082 8.374 ( -1.316 0.000 0.429) 1.384 8.595 ( 6.530 -0.000 6.143) 8.965 8.940 ( 1.785 -0.000 4.038) 4.415 9.705 ( -0.401 0.000 3.609) 3.631 9.758 ( 2.667 -0.000 -5.951) 6.521 10.481 ( -4.537 0.000 0.370) 4.552 11.850 ( -12.935 0.000 5.705) 14.137 12.271 ( -3.565 0.000 12.018) 12.536 12.391 ( 11.531 -0.000 -0.726) 11.554 13.716 ( 5.208 -0.000 -5.988) 7.936 13.851 ( -4.282 0.000 -0.170) 4.285 14.106 ( 2.692 -0.000 -1.229) 2.960 16.745 ( 6.934 -0.000 13.941) 15.570 16.850 ( -0.986 0.000 2.774) 2.944 17.903 ( -10.334 0.000 2.308) 10.588 18.872 ( 13.473 -0.000 -19.730) 23.891 18.960 ( -13.401 0.000 6.021) 14.692 22.632 ( 0.268 -0.000 -0.691) 0.741 ======================= Grid point 550 (274/336) ======================= q-point: (-0.55 0.36 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.699 ( 14.574 3.368 2.631) 15.188 2.963 ( 2.825 3.568 18.257) 18.815 3.038 ( -8.641 6.708 3.360) 11.444 3.283 ( -0.649 -4.700 3.923) 6.157 4.267 ( 1.421 -0.741 -0.846) 1.812 4.315 ( 3.156 -0.915 4.157) 5.299 4.592 ( 15.230 -1.855 7.907) 17.261 4.692 ( -0.860 -6.575 -9.376) 11.484 5.328 ( 3.877 2.994 -6.639) 8.251 5.886 ( 9.234 -3.342 -3.084) 10.293 5.927 ( 0.060 -2.424 -7.695) 8.068 6.233 ( 2.098 0.226 8.641) 8.895 6.710 ( -6.000 9.681 3.424) 11.893 6.888 ( -5.428 -7.713 1.543) 9.557 7.312 ( -3.802 3.959 -5.350) 7.665 7.406 ( 0.345 -3.899 -6.069) 7.222 7.786 ( -0.318 1.645 -2.130) 2.710 7.841 ( -1.031 -3.817 -4.164) 5.742 8.347 ( -1.110 0.921 0.362) 1.487 8.773 ( 8.445 0.541 10.038) 13.129 9.000 ( 2.872 0.416 5.428) 6.155 9.668 ( -3.211 -0.415 -0.998) 3.388 9.789 ( 2.587 -0.233 -3.530) 4.383 10.349 ( -10.771 0.855 -1.951) 10.980 11.731 ( -5.172 1.068 5.152) 7.378 12.279 ( 1.848 7.528 12.589) 14.784 12.620 ( 9.991 -6.978 0.357) 12.192 13.708 ( -0.836 4.558 -3.938) 6.081 13.809 ( -1.803 -5.889 -2.634) 6.698 14.119 ( 0.739 0.925 -2.466) 2.735 16.819 ( 2.104 6.132 4.478) 7.879 16.963 ( 4.620 -2.846 12.272) 13.418 17.795 ( -6.617 1.659 6.898) 9.702 18.673 ( -7.082 16.004 -4.015) 17.955 19.036 ( 3.268 -18.069 -13.679) 22.898 22.613 ( -1.639 0.115 -1.488) 2.217 ======================= Grid point 551 (275/336) ======================= q-point: (-0.45 0.36 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.917 ( 13.894 5.250 4.224) 15.442 2.854 ( -8.759 6.032 3.357) 11.152 3.074 ( 3.160 6.147 15.695) 17.149 3.291 ( -2.730 2.622 4.736) 6.063 4.283 ( 1.015 -2.368 -7.400) 7.836 4.403 ( 2.714 -2.756 4.308) 5.790 4.699 ( 1.909 -11.247 -6.460) 13.110 4.945 ( 13.758 -2.201 9.772) 17.018 5.302 ( 1.887 6.867 -2.792) 7.650 5.917 ( -0.433 -5.637 -6.038) 8.271 6.090 ( 10.059 -8.218 -2.084) 13.155 6.249 ( -2.029 4.116 1.294) 4.768 6.591 ( -4.135 2.039 7.237) 8.580 6.919 ( 0.635 -4.034 3.679) 5.496 7.168 ( -6.014 0.586 -5.952) 8.481 7.417 ( 2.238 -1.764 -6.598) 7.187 7.656 ( -7.568 -0.583 -5.167) 9.182 7.915 ( 3.657 -2.134 -2.013) 4.688 8.332 ( -0.535 0.205 0.756) 0.949 8.931 ( 6.726 5.390 9.307) 12.685 9.119 ( 6.077 -2.037 8.756) 10.852 9.622 ( -1.474 -0.228 -2.293) 2.735 9.783 ( -1.681 -1.845 -4.493) 5.140 10.124 ( -12.043 1.421 -4.175) 12.826 11.709 ( 0.651 2.708 3.478) 4.456 12.342 ( 4.277 7.541 13.341) 15.910 12.794 ( 5.555 -1.697 -1.884) 6.106 13.619 ( -2.931 1.103 -1.626) 3.528 13.836 ( -0.614 -6.899 -3.439) 7.734 14.087 ( -1.125 1.498 -2.373) 3.023 16.838 ( 3.827 4.623 2.960) 6.691 17.114 ( 3.462 2.900 14.548) 15.233 17.719 ( -3.204 4.717 4.219) 7.093 18.371 ( -6.047 18.310 -7.674) 20.754 19.189 ( 0.308 -23.755 -8.993) 25.403 22.569 ( -2.275 0.000 -1.315) 2.628 ======================= Grid point 552 (276/336) ======================= q-point: (-0.36 0.36 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.043 ( 2.363 4.658 3.595) 6.341 2.720 ( -0.845 7.643 3.591) 8.487 3.108 ( -2.005 9.091 11.576) 14.855 3.244 ( 2.067 7.493 4.051) 8.765 4.259 ( 1.615 -0.996 -10.926) 11.089 4.501 ( 0.830 -5.769 4.071) 7.110 4.822 ( -0.396 -15.518 -2.079) 15.661 5.181 ( 6.782 -0.523 2.851) 7.375 5.232 ( 1.334 7.959 0.365) 8.078 5.950 ( 0.470 -5.682 -1.511) 5.898 6.157 ( -2.367 1.908 -4.114) 5.115 6.272 ( -0.402 -11.562 0.060) 11.569 6.626 ( 4.167 -0.063 5.160) 6.633 7.003 ( 0.275 -1.081 2.637) 2.864 7.080 ( 1.218 -2.033 -3.063) 3.873 7.443 ( 2.089 -4.026 -3.911) 5.989 7.514 ( -6.543 -0.696 -5.272) 8.432 7.945 ( -0.061 -1.013 -2.285) 2.500 8.328 ( -0.953 -0.452 1.138) 1.551 9.019 ( 5.227 6.605 6.287) 10.511 9.290 ( 5.393 -0.672 7.909) 9.596 9.598 ( 0.909 1.328 -3.328) 3.697 9.726 ( -4.608 -4.473 -2.856) 7.029 9.943 ( -4.939 1.032 -3.619) 6.210 11.724 ( 3.293 4.535 1.013) 5.696 12.406 ( 3.298 10.267 12.500) 16.509 12.772 ( -3.211 3.555 -6.537) 8.105 13.605 ( -0.063 -2.844 0.804) 2.956 13.876 ( -0.810 -7.802 -2.665) 8.284 14.046 ( -1.050 0.254 -0.520) 1.199 16.866 ( 0.913 2.925 1.234) 3.304 17.175 ( -0.030 9.043 15.627) 18.055 17.699 ( 7.039 7.274 -0.421) 10.131 18.052 ( -2.994 19.687 -11.821) 23.158 19.377 ( -3.781 -28.321 -1.655) 28.620 22.532 ( -1.711 -0.160 -0.281) 1.741 ======================= Grid point 553 (277/336) ======================= q-point: (-0.27 0.36 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.927 ( -11.660 3.600 0.196) 12.205 2.725 ( 6.476 10.686 3.523) 12.983 3.030 ( -0.395 10.406 9.730) 14.251 3.272 ( 6.239 6.793 1.643) 9.368 4.234 ( 3.238 1.704 -9.085) 9.794 4.568 ( -2.310 -6.771 1.181) 7.251 4.910 ( -6.076 -14.696 -1.100) 15.940 5.131 ( -2.034 3.581 -0.241) 4.125 5.306 ( 3.565 -2.739 -3.461) 5.674 5.991 ( 1.287 3.238 6.116) 7.039 6.147 ( 0.941 -9.630 -7.963) 12.531 6.290 ( -8.698 -11.408 -0.669) 14.362 6.714 ( 1.574 2.815 3.930) 5.084 6.990 ( 1.636 0.348 -3.472) 3.854 7.169 ( 4.384 -2.004 -0.661) 4.865 7.400 ( -4.520 -2.881 -2.824) 6.059 7.549 ( 5.526 -6.308 0.402) 8.395 7.915 ( -2.747 -0.714 -1.625) 3.271 8.330 ( -0.546 -1.359 1.597) 2.167 8.997 ( -2.776 7.551 -1.342) 8.156 9.376 ( 1.900 0.420 1.411) 2.404 9.584 ( 2.323 2.928 -2.523) 4.509 9.741 ( -0.544 -6.651 2.525) 7.135 9.916 ( 4.421 1.765 1.128) 4.892 11.728 ( 3.555 7.127 -1.617) 8.127 12.371 ( 1.766 18.083 6.255) 19.216 12.638 ( -6.480 -2.830 -3.271) 7.791 13.638 ( -0.349 -2.866 0.484) 2.927 13.893 ( -2.576 -2.741 -1.318) 3.985 14.078 ( 1.333 -6.240 1.374) 6.527 16.780 ( -6.809 5.020 -0.527) 8.476 17.195 ( 3.954 10.489 13.027) 17.186 17.597 ( -5.302 16.787 -9.455) 19.982 17.985 ( 21.681 10.124 -5.290) 24.506 19.554 ( -9.159 -29.544 2.877) 31.064 22.514 ( -0.954 0.139 1.020) 1.404 ======================= Grid point 554 (278/336) ======================= q-point: (-0.18 0.36 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.678 ( -13.001 2.158 -2.616) 13.436 2.707 ( 3.544 11.992 2.687) 12.790 3.065 ( 4.600 5.083 8.722) 11.094 3.326 ( 8.595 6.648 -2.161) 11.079 4.218 ( 4.313 5.336 -5.176) 8.594 4.554 ( -5.061 -4.026 -4.360) 7.800 4.878 ( -12.146 -12.245 -0.779) 17.265 5.106 ( -0.075 -3.085 -1.598) 3.475 5.346 ( -0.424 -7.569 -5.690) 9.478 6.023 ( 0.990 3.624 8.010) 8.847 6.173 ( -4.343 -8.527 -8.555) 12.836 6.294 ( -1.253 -12.876 -2.603) 13.196 6.641 ( -7.749 4.711 3.592) 9.754 7.008 ( 3.825 2.272 -2.338) 5.026 7.166 ( -1.778 1.623 -9.120) 9.432 7.450 ( 4.194 -4.956 5.298) 8.380 7.722 ( 4.891 -8.816 3.320) 10.615 7.874 ( -1.387 -1.238 -0.666) 1.975 8.352 ( 0.385 -0.910 0.208) 1.010 8.821 ( -6.192 7.369 -3.011) 10.085 9.333 ( -5.450 -0.969 -7.627) 9.424 9.583 ( 2.641 4.506 -1.154) 5.349 9.813 ( -0.434 -4.120 3.312) 5.304 10.058 ( 11.504 2.075 6.710) 13.478 11.663 ( 1.112 11.242 -3.010) 11.691 12.296 ( 8.490 13.998 -0.273) 16.374 12.579 ( -6.944 -5.167 3.843) 9.471 13.652 ( -1.225 -3.120 -0.200) 3.358 13.840 ( -4.434 0.630 0.105) 4.480 14.177 ( 0.807 -7.500 1.040) 7.614 16.603 ( -5.502 8.834 -0.504) 10.420 17.162 ( -4.798 10.274 -4.979) 12.384 17.386 ( 5.632 12.846 5.730) 15.152 18.288 ( 27.769 7.771 -5.294) 29.318 19.647 ( -15.526 -27.218 4.015) 31.591 22.506 ( -0.696 1.074 2.046) 2.414 ======================= Grid point 555 (279/336) ======================= q-point: (-0.09 0.36 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.489 ( -8.157 -2.969 -2.679) 9.085 2.692 ( 4.756 7.725 1.860) 9.260 3.119 ( 1.351 2.290 2.717) 3.801 3.392 ( 8.499 6.513 -1.895) 10.874 4.209 ( 3.778 6.179 -3.506) 8.046 4.422 ( -7.035 1.289 -9.099) 11.574 4.784 ( -12.526 -10.820 1.446) 16.615 5.150 ( 1.285 -6.353 -3.219) 7.237 5.378 ( -1.723 -10.391 -5.011) 11.664 6.018 ( -8.054 -5.499 4.623) 10.792 6.134 ( 1.572 0.710 -6.426) 6.654 6.410 ( 2.794 -11.558 -3.776) 12.476 6.471 ( -9.854 2.774 2.677) 10.581 7.006 ( -5.437 4.024 -8.609) 10.948 7.048 ( 4.251 6.083 1.335) 7.540 7.581 ( 2.702 -2.890 2.482) 4.670 7.838 ( -1.338 -6.229 3.821) 7.429 7.976 ( 8.010 -6.862 1.538) 10.659 8.325 ( -1.081 2.960 -3.285) 4.552 8.685 ( -3.468 4.432 2.307) 6.083 9.158 ( -8.993 -1.272 -12.273) 15.268 9.548 ( 0.038 6.057 -1.373) 6.211 9.835 ( -1.391 -1.527 1.620) 2.625 10.274 ( 10.599 1.032 6.866) 12.671 11.571 ( 2.662 8.740 -1.879) 9.327 12.383 ( 15.102 8.305 -3.260) 17.540 12.541 ( -7.556 -3.100 9.020) 12.168 13.662 ( -1.442 -4.203 -0.379) 4.459 13.746 ( -5.960 1.315 -0.009) 6.103 14.234 ( -1.269 -4.109 0.316) 4.312 16.447 ( -2.153 10.733 -0.615) 10.964 16.940 ( -4.276 8.430 -4.615) 10.519 17.503 ( 11.537 4.780 7.144) 14.387 18.621 ( 26.443 7.473 -7.636) 28.520 19.603 ( -21.824 -22.037 4.182) 31.296 22.495 ( -0.471 2.082 2.631) 3.389 ======================= Grid point 561 (280/336) ======================= q-point: (-0.55 0.45 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.969 ( 13.389 -0.000 3.299) 13.789 2.913 ( -9.672 0.000 2.501) 9.990 3.143 ( 3.023 -0.000 15.737) 16.025 3.305 ( 0.385 -0.000 5.791) 5.804 4.256 ( 0.888 -0.000 -5.804) 5.871 4.373 ( 1.522 -0.000 3.835) 4.126 4.589 ( 0.989 -0.000 -8.077) 8.137 4.930 ( 16.184 -0.000 11.021) 19.580 5.377 ( 3.196 -0.000 -3.192) 4.517 5.858 ( -1.013 0.000 -7.140) 7.211 6.001 ( 8.533 -0.000 -3.436) 9.199 6.293 ( -0.345 0.000 3.308) 3.326 6.639 ( -8.337 0.000 7.263) 11.057 6.857 ( 2.857 -0.000 2.749) 3.964 7.171 ( -8.391 0.000 -4.887) 9.710 7.404 ( 3.490 -0.000 -6.902) 7.735 7.653 ( -7.538 0.000 -6.217) 9.771 7.892 ( 4.650 -0.000 -1.298) 4.828 8.334 ( -0.833 0.000 0.401) 0.924 9.005 ( 10.089 -0.000 12.910) 16.385 9.080 ( 3.080 -0.000 5.972) 6.720 9.614 ( -1.880 0.000 -1.835) 2.627 9.769 ( -1.344 0.000 -5.736) 5.891 10.136 ( -12.586 0.000 -4.113) 13.241 11.733 ( 0.763 -0.000 3.762) 3.839 12.421 ( 1.943 -0.000 13.482) 13.621 12.769 ( 10.232 -0.000 0.024) 10.232 13.647 ( -6.822 0.000 -0.888) 6.880 13.753 ( 1.530 -0.000 -5.353) 5.567 14.103 ( -1.160 0.000 -2.861) 3.088 16.882 ( 2.111 -0.000 0.949) 2.314 17.143 ( 5.131 -0.000 18.199) 18.909 17.763 ( -2.623 0.000 4.714) 5.394 18.662 ( -8.046 0.000 6.733) 10.491 18.846 ( 2.063 -0.000 -24.962) 25.047 22.570 ( -2.406 0.000 -1.278) 2.724 ======================= Grid point 563 (281/336) ======================= q-point: (-0.45 0.45 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.109 ( 0.787 2.021 3.233) 3.893 2.817 ( -0.299 2.661 1.695) 3.170 3.247 ( 1.782 4.908 10.818) 12.012 3.328 ( -0.685 1.599 6.133) 6.375 4.231 ( 1.294 -1.377 -9.078) 9.273 4.412 ( -0.962 -2.877 3.072) 4.317 4.609 ( 1.458 -6.232 -3.497) 7.294 5.194 ( 9.300 1.131 4.858) 10.553 5.368 ( 0.118 4.846 -0.403) 4.864 5.825 ( -0.113 -4.593 -6.375) 7.858 6.078 ( -1.893 -5.716 -0.442) 6.037 6.256 ( -1.482 3.301 -1.579) 3.948 6.647 ( 5.585 1.618 6.024) 8.373 6.964 ( 4.535 -2.537 5.356) 7.463 7.040 ( -3.693 -1.297 -4.502) 5.966 7.392 ( -2.960 -1.148 -3.831) 4.976 7.521 ( -2.240 0.534 -6.674) 7.060 7.927 ( 0.384 -0.679 -2.053) 2.196 8.324 ( -1.153 -0.076 0.967) 1.507 9.136 ( 4.320 5.333 6.393) 9.379 9.258 ( 7.669 -2.725 10.447) 13.243 9.594 ( 0.375 -0.999 -2.229) 2.471 9.682 ( -4.399 -0.505 -7.315) 8.551 9.950 ( -6.175 0.003 -2.979) 6.856 11.780 ( 3.658 1.457 1.040) 4.072 12.510 ( 0.760 2.133 11.602) 11.821 12.855 ( 0.524 3.349 -1.539) 3.723 13.568 ( -1.589 -0.975 0.243) 1.880 13.755 ( -0.029 -3.884 -4.272) 5.773 14.061 ( -1.478 0.637 -1.516) 2.211 16.902 ( -0.540 0.896 1.041) 1.475 17.302 ( 2.555 3.816 17.677) 18.264 17.794 ( 7.376 2.640 -0.504) 7.851 18.432 ( -4.298 21.153 -6.419) 22.519 18.876 ( -4.189 -24.787 -7.780) 26.315 22.530 ( -1.660 -0.044 -0.298) 1.687 ======================= Grid point 564 (282/336) ======================= q-point: (-0.36 0.45 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.991 ( -12.265 2.886 0.967) 12.637 2.877 ( 8.762 5.340 1.954) 10.446 3.211 ( -3.009 9.015 7.091) 11.857 3.362 ( 2.693 2.128 3.509) 4.908 4.230 ( 3.256 -1.741 -7.448) 8.313 4.433 ( -3.539 -6.224 1.996) 7.433 4.676 ( -0.938 -9.450 -2.623) 9.852 5.196 ( -5.546 2.556 -2.678) 6.668 5.336 ( 1.725 5.012 -2.154) 5.722 5.864 ( -0.897 -9.806 -3.231) 10.364 6.059 ( -5.849 -7.000 0.112) 9.123 6.215 ( 2.111 4.367 -0.501) 4.877 6.785 ( 7.822 4.626 3.830) 9.862 6.992 ( 1.684 0.012 -1.992) 2.609 7.124 ( 5.781 -3.748 0.218) 6.893 7.302 ( -6.725 -5.255 -1.683) 8.699 7.505 ( 3.276 0.105 -2.675) 4.230 7.897 ( -3.147 -0.989 -1.798) 3.756 8.314 ( -0.963 -0.445 1.732) 2.031 9.133 ( -1.748 6.485 -0.135) 6.717 9.391 ( 1.183 0.896 0.982) 1.780 9.610 ( -0.951 -3.124 -0.560) 3.313 9.621 ( 2.756 -2.256 -1.851) 4.014 9.939 ( 5.054 0.595 3.061) 5.939 11.828 ( 5.452 3.532 -1.959) 6.785 12.543 ( -2.723 0.967 9.599) 10.025 12.703 ( -8.125 8.527 -4.179) 12.497 13.599 ( 1.742 -1.069 0.477) 2.098 13.783 ( -0.098 -6.686 -2.134) 7.019 14.039 ( 0.042 0.214 0.502) 0.547 16.848 ( -4.378 2.342 -0.018) 4.965 17.367 ( 0.414 7.114 13.877) 15.600 17.885 ( 6.638 12.082 -7.187) 15.546 18.188 ( 8.100 13.106 -6.785) 16.834 19.014 ( -8.004 -27.595 1.983) 28.801 22.517 ( -0.308 0.119 0.989) 1.042 ======================= Grid point 565 (283/336) ======================= q-point: (-0.27 0.45 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.737 ( -13.874 3.569 -1.885) 14.449 2.924 ( 3.073 10.625 1.207) 11.127 3.156 ( 1.476 4.992 5.538) 7.601 3.405 ( 3.578 1.281 -0.176) 3.804 4.274 ( 5.169 0.310 -3.604) 6.309 4.438 ( -4.797 -7.330 0.275) 8.764 4.688 ( -5.955 -7.588 -4.577) 10.676 5.056 ( -7.020 -2.701 -3.994) 8.516 5.275 ( -1.808 0.587 -6.104) 6.393 5.883 ( -8.367 -11.601 -1.191) 14.353 6.079 ( 0.660 -8.880 -2.407) 9.224 6.233 ( 6.006 7.241 1.223) 9.487 6.760 ( -4.875 7.954 0.813) 9.364 7.037 ( 5.253 1.327 -1.318) 5.576 7.192 ( 2.520 0.325 -7.255) 7.687 7.338 ( 2.874 -7.361 3.527) 8.653 7.589 ( 3.574 -4.817 4.038) 7.230 7.846 ( -2.594 -1.647 -1.185) 3.293 8.333 ( 1.065 -0.943 1.858) 2.340 8.970 ( -6.370 8.305 -4.381) 11.346 9.314 ( -6.290 -1.375 -7.953) 10.232 9.639 ( 2.965 1.688 -1.189) 3.614 9.719 ( 2.154 -5.180 3.654) 6.695 10.100 ( 10.718 2.005 8.024) 13.538 11.848 ( 4.930 7.957 -3.922) 10.149 12.464 ( -7.181 2.246 -6.514) 9.952 12.545 ( -2.912 3.065 10.621) 11.432 13.616 ( 0.108 -0.335 -1.119) 1.173 13.818 ( -1.978 -3.274 0.274) 3.835 14.076 ( 2.172 -2.923 1.179) 3.828 16.740 ( -3.647 5.623 -0.142) 6.703 17.330 ( -4.143 7.382 0.377) 8.474 17.683 ( -0.396 18.484 -0.160) 18.488 18.403 ( 25.076 4.065 -6.272) 26.166 19.133 ( -12.679 -26.828 6.311) 30.337 22.525 ( 0.525 0.875 1.926) 2.180 ======================= Grid point 566 (284/336) ======================= q-point: (-0.18 0.45 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.494 ( -9.454 3.042 -3.528) 10.539 2.842 ( -0.761 8.416 0.781) 8.486 3.178 ( 1.955 3.831 0.700) 4.358 3.454 ( 2.977 -0.374 -0.195) 3.007 4.305 ( 1.355 4.548 -5.717) 7.430 4.423 ( -2.052 -3.832 0.722) 4.407 4.587 ( -9.149 -7.208 -4.338) 12.429 5.014 ( -2.311 -8.833 -3.901) 9.929 5.223 ( -2.396 -4.871 -5.285) 7.577 5.828 ( -9.595 -10.858 -1.334) 14.552 6.182 ( 2.161 -7.922 -3.517) 8.933 6.274 ( 7.702 6.199 -0.587) 9.904 6.565 ( -9.572 6.763 0.753) 11.744 7.075 ( 0.793 3.769 -5.488) 6.705 7.152 ( 3.315 4.536 -1.634) 5.851 7.492 ( 3.409 -6.853 3.165) 8.283 7.712 ( -0.039 -6.137 6.667) 9.062 7.878 ( 5.256 -3.971 -0.537) 6.609 8.364 ( 1.167 1.001 -1.036) 1.854 8.780 ( -5.113 5.960 -1.451) 7.985 9.142 ( -9.090 -0.761 -10.804) 14.140 9.638 ( 0.352 3.393 -1.589) 3.763 9.791 ( 0.141 -3.023 1.636) 3.440 10.298 ( 9.090 1.568 7.938) 12.170 11.770 ( 0.638 11.959 -3.077) 12.365 12.386 ( 0.149 -4.031 -5.762) 7.034 12.568 ( 1.445 1.839 10.831) 11.081 13.606 ( -0.752 -1.230 -2.137) 2.578 13.776 ( -4.519 1.542 1.228) 4.931 14.154 ( 1.840 -4.158 0.656) 4.594 16.636 ( -0.915 8.959 -0.215) 9.008 17.108 ( -6.848 8.968 -8.226) 13.964 17.633 ( 4.861 9.354 9.431) 14.145 18.729 ( 24.705 2.994 -11.639) 27.473 19.174 ( -16.839 -22.292 9.989) 29.669 22.534 ( 0.705 1.989 2.183) 3.036 ======================= Grid point 567 (285/336) ======================= q-point: (-0.09 0.45 -0.60) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.354 ( -3.927 0.236 -2.235) 4.525 2.769 ( -2.275 2.528 -1.117) 3.579 3.143 ( -0.481 2.667 -4.028) 4.854 3.499 ( 0.871 -0.276 3.925) 4.030 4.126 ( -9.291 2.685 -11.726) 15.200 4.444 ( 4.120 6.935 -4.715) 9.344 4.555 ( -4.362 -9.180 5.566) 11.588 5.067 ( 0.456 -9.331 -4.528) 10.382 5.239 ( -0.337 -8.854 -2.319) 9.159 5.780 ( -6.974 -8.887 -0.609) 11.313 6.188 ( 0.393 3.684 -4.988) 6.213 6.372 ( -7.055 3.769 0.166) 8.001 6.394 ( 6.382 -5.018 -2.570) 8.515 6.921 ( -6.046 7.443 -5.590) 11.100 7.207 ( 6.130 5.377 3.650) 8.933 7.597 ( 2.106 -4.780 0.446) 5.242 7.796 ( -0.529 -4.998 6.636) 8.325 8.045 ( 7.774 -5.825 -1.014) 9.767 8.322 ( -0.443 2.700 -4.137) 4.960 8.688 ( -4.042 4.496 3.379) 6.926 8.931 ( -7.874 -1.320 -11.197) 13.752 9.571 ( -2.014 4.545 -1.764) 5.275 9.814 ( -0.244 -1.367 0.239) 1.410 10.440 ( 4.708 0.264 4.582) 6.575 11.666 ( 0.641 7.634 -1.323) 7.774 12.400 ( -3.073 -4.102 1.932) 5.477 12.699 ( 9.695 2.493 6.212) 11.781 13.594 ( -1.027 -2.846 -3.426) 4.571 13.678 ( -4.817 3.308 1.087) 5.944 14.204 ( 0.201 -2.032 0.442) 2.089 16.521 ( -1.007 10.747 -2.362) 11.049 16.937 ( -1.891 5.392 -1.128) 5.824 17.737 ( 8.028 1.890 7.301) 11.015 18.906 ( 3.026 -6.642 -19.846) 21.146 19.191 ( -3.820 -6.291 15.587) 17.237 22.537 ( 1.009 2.642 1.870) 3.390 ======================= Grid point 574 (286/336) ======================= q-point: ( 0.55 -0.45 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.021 ( -12.473 0.000 1.312) 12.542 2.926 ( 9.466 -0.000 1.192) 9.541 3.326 ( -4.458 0.000 5.747) 7.273 3.359 ( 2.055 -0.000 4.888) 5.303 4.201 ( 1.398 -0.000 -4.623) 4.830 4.374 ( -2.228 0.000 -0.364) 2.257 4.584 ( 0.982 -0.000 -2.921) 3.082 5.222 ( -6.665 0.000 -3.666) 7.606 5.406 ( 0.595 -0.000 -0.894) 1.073 5.754 ( -1.744 0.000 -4.897) 5.199 5.982 ( -4.599 0.000 -0.358) 4.613 6.269 ( 2.711 -0.000 0.551) 2.767 6.849 ( 12.287 -0.000 5.115) 13.309 6.994 ( 2.619 -0.000 -3.509) 4.379 7.058 ( 4.340 -0.000 0.664) 4.391 7.255 ( -8.614 0.000 -0.480) 8.627 7.509 ( 2.374 -0.000 -3.827) 4.504 7.886 ( -3.277 0.000 -1.850) 3.763 8.311 ( -1.128 0.000 1.702) 2.041 9.205 ( -1.202 0.000 0.767) 1.426 9.401 ( 0.961 -0.000 0.928) 1.336 9.547 ( -1.084 0.000 -0.216) 1.106 9.622 ( 2.599 -0.000 -3.733) 4.548 9.943 ( 5.442 -0.000 3.824) 6.651 11.861 ( 6.018 -0.000 -2.169) 6.396 12.547 ( -4.044 0.000 7.524) 8.542 12.793 ( -9.718 0.000 -0.976) 9.767 13.595 ( 4.620 -0.000 1.569) 4.879 13.708 ( -0.529 0.000 -3.803) 3.840 14.044 ( -0.373 0.000 0.310) 0.485 16.870 ( -3.572 0.000 0.174) 3.577 17.437 ( -0.712 0.000 13.500) 13.518 17.996 ( 17.307 -0.000 -5.450) 18.145 18.478 ( -6.881 0.000 -17.006) 18.346 18.588 ( -3.925 0.000 11.130) 11.802 22.518 ( -0.069 0.000 0.976) 0.979 ======================= Grid point 576 (287/336) ======================= q-point: (-0.36 0.55 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.792 ( -13.602 1.806 -1.098) 13.765 3.074 ( 8.182 4.551 0.928) 9.409 3.240 ( -5.663 3.027 4.396) 7.782 3.395 ( -0.155 -1.138 -0.711) 1.350 4.225 ( -0.872 -3.493 4.582) 5.828 4.361 ( 2.810 -1.047 -5.667) 6.411 4.586 ( -0.631 -3.096 -4.282) 5.321 5.018 ( -13.008 -1.037 -7.297) 14.951 5.330 ( -4.342 3.314 -5.347) 7.643 5.702 ( -6.144 -6.367 -2.483) 9.190 5.963 ( 1.435 -3.240 -2.079) 4.108 6.342 ( 6.213 3.434 2.248) 7.446 6.929 ( -3.574 9.481 -2.444) 10.423 7.061 ( 6.644 0.927 1.047) 6.790 7.130 ( 6.054 -7.938 -3.940) 10.732 7.226 ( 1.976 -2.272 1.985) 3.606 7.540 ( 1.658 -0.996 3.324) 3.846 7.820 ( -3.262 -0.861 -1.433) 3.665 8.321 ( 0.921 -0.331 2.276) 2.477 9.115 ( -5.329 6.198 -3.774) 9.003 9.271 ( -8.348 -3.061 -10.183) 13.519 9.642 ( 3.622 -2.052 6.292) 7.545 9.657 ( 3.668 0.017 -2.890) 4.670 10.126 ( 10.749 0.695 8.832) 13.929 11.947 ( 8.696 2.528 -5.045) 10.366 12.486 ( -8.062 1.220 3.556) 8.895 12.589 ( -11.348 0.541 1.294) 11.435 13.645 ( 1.353 3.233 -1.491) 3.809 13.733 ( 2.439 -5.015 0.450) 5.595 14.053 ( 0.766 -0.192 1.289) 1.511 16.811 ( -2.255 1.912 -0.088) 2.958 17.428 ( -5.233 2.800 2.788) 6.557 18.057 ( 0.135 20.668 -4.672) 21.190 18.391 ( 11.798 -8.682 -8.612) 16.993 18.714 ( -2.035 -13.601 11.410) 17.869 22.536 ( 1.246 0.337 1.857) 2.261 ======================= Grid point 577 (288/336) ======================= q-point: (-0.27 -0.45 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.571 ( -8.086 4.176 -3.010) 9.585 3.004 ( -5.953 8.531 1.169) 10.468 3.248 ( 3.005 2.830 0.332) 4.141 3.386 ( -2.088 -5.739 -2.058) 6.445 4.283 ( -2.802 -7.329 8.233) 11.373 4.393 ( 3.786 4.547 -5.884) 8.344 4.536 ( -2.032 -0.624 -8.873) 9.124 4.830 ( -7.918 -9.713 -7.204) 14.455 5.197 ( -4.812 1.023 -4.258) 6.506 5.650 ( -6.474 -7.627 -1.678) 10.144 6.045 ( 4.881 -5.195 -2.810) 7.662 6.402 ( 5.377 5.426 -0.675) 7.669 6.711 ( -9.127 8.081 -2.361) 12.417 7.150 ( 3.638 4.190 -1.420) 5.728 7.205 ( 5.291 0.790 -4.261) 6.839 7.338 ( 1.837 -8.354 3.344) 9.185 7.629 ( 1.935 -2.839 8.840) 9.484 7.816 ( 2.821 -2.568 -1.454) 4.082 8.369 ( 2.725 -0.212 1.324) 3.037 8.906 ( -7.209 7.099 -6.123) 11.826 9.114 ( -8.260 -2.596 -8.682) 12.261 9.677 ( 0.699 1.008 -1.522) 1.955 9.736 ( 2.023 -2.480 1.996) 3.772 10.327 ( 7.852 1.245 8.590) 11.705 11.989 ( 4.893 10.330 -4.476) 12.275 12.331 ( -5.515 -0.888 -1.977) 5.926 12.530 ( -3.826 -5.543 6.995) 9.710 13.613 ( -0.375 1.380 -3.019) 3.341 13.794 ( 0.342 0.324 2.042) 2.096 14.090 ( 1.609 -2.349 0.762) 2.948 16.768 ( 0.647 4.943 0.602) 5.021 17.249 ( -8.770 5.450 -8.868) 13.611 17.863 ( -1.464 15.275 7.485) 17.073 18.597 ( 0.167 -18.817 -9.372) 21.022 18.923 ( 11.131 -2.355 10.227) 15.298 22.565 ( 1.602 1.210 1.854) 2.733 ======================= Grid point 578 (289/336) ======================= q-point: (-0.18 -0.45 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.432 ( -0.520 6.906 -2.920) 7.515 2.830 ( -8.332 4.113 -0.207) 9.294 3.184 ( -4.639 1.004 -5.261) 7.086 3.441 ( 0.336 -5.144 3.619) 6.299 4.207 ( -9.138 6.085 -10.671) 15.310 4.377 ( -0.932 -8.240 4.952) 9.658 4.542 ( 6.967 2.971 -4.917) 9.030 4.855 ( 0.114 -12.653 -4.027) 13.279 5.131 ( -2.208 -3.038 -0.834) 3.847 5.631 ( -3.126 -6.723 -0.522) 7.432 6.157 ( 5.134 -4.549 -4.466) 8.185 6.409 ( 3.514 3.930 -4.667) 7.041 6.486 ( -8.014 7.879 -0.233) 11.241 7.059 ( -3.898 7.005 -3.805) 8.874 7.286 ( 5.406 2.174 1.035) 5.918 7.451 ( 1.017 -8.794 2.357) 9.161 7.737 ( 1.483 -1.827 9.069) 9.369 7.935 ( 7.632 -5.234 -2.002) 9.469 8.388 ( 0.727 3.278 -3.470) 4.828 8.743 ( -3.589 1.695 -0.761) 4.042 8.931 ( -9.000 1.148 -8.558) 12.472 9.634 ( -2.395 2.143 -2.254) 3.925 9.784 ( 0.809 -1.641 0.516) 1.901 10.447 ( 3.063 0.482 5.302) 6.143 11.858 ( -2.510 12.404 -1.375) 12.730 12.328 ( -0.637 -3.429 1.733) 3.895 12.644 ( 5.372 -7.637 4.654) 10.432 13.577 ( -0.258 0.347 -4.305) 4.327 13.760 ( -2.330 5.180 1.924) 5.997 14.149 ( 1.387 -3.569 0.223) 3.835 16.715 ( -0.203 9.398 -2.342) 9.687 17.023 ( -5.253 3.585 -5.657) 8.511 17.814 ( 0.862 6.507 10.000) 11.962 18.625 ( -12.195 -18.679 -4.893) 22.838 19.199 ( 16.935 2.938 3.100) 17.466 22.583 ( 1.445 2.083 1.038) 2.739 ======================= Grid point 579 (290/336) ======================= q-point: (-0.09 -0.45 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.377 ( 3.277 8.582 -0.979) 9.239 2.653 ( -10.924 -0.970 -1.823) 11.117 3.081 ( -5.876 -2.848 -1.394) 6.676 3.508 ( -0.347 -2.744 5.880) 6.499 3.948 ( -7.645 4.357 -10.870) 13.985 4.432 ( 0.939 -1.618 -2.371) 3.020 4.606 ( 5.071 1.285 -1.352) 5.403 4.974 ( 2.927 -8.940 -1.801) 9.578 5.176 ( 0.886 -7.293 2.510) 7.764 5.676 ( 1.785 -4.412 1.677) 5.046 6.194 ( 1.816 3.327 -5.934) 7.041 6.316 ( -4.372 4.586 -0.848) 6.392 6.418 ( 2.536 -0.991 -6.488) 7.036 6.894 ( -3.887 7.949 -1.279) 8.940 7.339 ( 1.689 0.657 2.380) 2.992 7.577 ( 3.678 -7.044 0.749) 7.982 7.809 ( -0.191 -1.095 6.920) 7.009 8.100 ( 7.286 -5.570 -3.085) 9.676 8.305 ( -1.050 3.545 -5.945) 7.001 8.662 ( -8.134 8.497 -0.216) 11.764 8.785 ( -0.668 -5.059 -2.851) 5.845 9.556 ( -1.858 2.441 -2.806) 4.158 9.801 ( -0.396 -0.834 0.405) 1.008 10.492 ( 0.016 -0.696 2.206) 2.313 11.717 ( -2.448 7.504 -0.256) 7.898 12.342 ( -4.637 -1.808 7.463) 8.970 12.850 ( 7.821 -5.782 2.173) 9.966 13.551 ( 1.287 -0.098 -5.817) 5.958 13.675 ( -1.821 5.787 1.222) 6.188 14.192 ( 0.165 -2.205 0.373) 2.242 16.554 ( -3.825 8.731 -5.679) 11.096 16.970 ( 0.984 2.064 1.987) 3.029 17.874 ( 2.198 -1.161 8.025) 8.401 18.522 ( -15.724 -13.798 -2.702) 21.093 19.418 ( 13.975 5.437 -0.797) 15.017 22.589 ( 1.571 2.186 -0.083) 2.693 ======================= Grid point 587 (291/336) ======================= q-point: (-0.36 -0.36 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.616 ( -7.005 0.000 -2.616) 7.478 3.119 ( -11.595 0.000 4.234) 12.344 3.245 ( 7.753 -0.000 0.896) 7.805 3.326 ( -5.287 0.000 -6.673) 8.513 4.209 ( -2.193 0.000 8.091) 8.383 4.444 ( 10.380 -0.000 -4.777) 11.427 4.542 ( 0.278 -0.000 -5.744) 5.751 4.714 ( -15.533 0.000 -10.907) 18.980 5.216 ( -6.816 0.000 -4.401) 8.113 5.571 ( -4.413 0.000 -1.521) 4.667 5.996 ( 5.539 -0.000 -2.533) 6.090 6.455 ( 4.619 -0.000 -1.503) 4.858 6.808 ( -9.728 0.000 -4.070) 10.545 7.191 ( 5.547 -0.000 -4.069) 6.879 7.218 ( 7.175 -0.000 7.198) 10.163 7.235 ( 0.370 -0.000 -3.424) 3.444 7.602 ( 2.354 -0.000 9.408) 9.697 7.790 ( 1.954 -0.000 -1.734) 2.612 8.366 ( 3.039 -0.000 2.021) 3.650 9.011 ( -10.604 0.000 -13.095) 16.850 9.055 ( -5.169 0.000 -2.614) 5.792 9.685 ( 0.692 -0.000 -1.237) 1.417 9.711 ( 2.912 -0.000 1.982) 3.522 10.339 ( 7.460 -0.000 8.825) 11.556 12.096 ( 12.481 -0.000 -7.037) 14.328 12.370 ( -13.211 0.000 0.641) 13.227 12.418 ( -6.064 0.000 6.378) 8.801 13.631 ( -1.445 0.000 -3.426) 3.718 13.794 ( 4.447 -0.000 2.386) 5.046 14.069 ( 0.386 -0.000 0.888) 0.969 16.815 ( 1.334 -0.000 0.853) 1.583 17.301 ( -9.446 0.000 -8.063) 12.419 18.158 ( -9.772 0.000 9.324) 13.506 18.251 ( -0.048 0.000 -6.841) 6.841 18.918 ( 18.508 -0.000 5.080) 19.192 22.577 ( 1.936 -0.000 1.734) 2.599 ======================= Grid point 588 (292/336) ======================= q-point: (-0.27 -0.36 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.551 ( 3.295 4.202 -2.749) 6.006 2.918 ( -12.977 4.479 3.694) 14.217 3.149 ( -12.205 -4.110 -8.324) 15.335 3.366 ( 4.842 -1.681 2.130) 5.551 4.269 ( 2.554 -2.992 5.152) 6.482 4.351 ( -10.258 8.536 -10.810) 17.174 4.554 ( 3.070 -3.055 -7.843) 8.959 4.638 ( 6.429 -7.613 -0.669) 9.987 5.104 ( -4.750 -0.431 -0.089) 4.770 5.541 ( -0.336 -2.597 -0.222) 2.628 6.093 ( 7.403 -1.834 -3.696) 8.475 6.462 ( 0.842 1.510 -7.576) 7.770 6.630 ( -6.971 5.628 -0.144) 8.960 7.164 ( -2.933 3.612 -1.769) 4.978 7.227 ( -2.883 -5.657 -1.161) 6.454 7.384 ( 8.201 0.330 4.208) 9.223 7.713 ( 2.732 -0.725 10.103) 10.491 7.862 ( 6.880 -2.245 -3.145) 7.891 8.428 ( 3.499 1.001 0.189) 3.645 8.765 ( -8.589 0.727 -10.275) 13.412 8.954 ( -5.955 0.811 -2.552) 6.529 9.656 ( -2.503 0.384 -2.476) 3.542 9.760 ( 1.685 -0.738 0.864) 2.032 10.455 ( 1.868 0.271 5.623) 5.931 12.103 ( -4.965 12.467 -0.426) 13.426 12.273 ( 2.157 -2.854 -0.048) 3.578 12.462 ( 2.310 -9.580 4.537) 10.849 13.587 ( -0.672 0.377 -4.500) 4.565 13.848 ( 1.657 3.341 2.191) 4.325 14.085 ( 0.351 -2.544 -0.108) 2.570 16.848 ( 2.932 4.105 0.862) 5.118 17.065 ( -9.926 0.889 -11.182) 14.979 17.983 ( -6.711 11.100 11.143) 17.100 18.288 ( -8.067 -15.972 -0.098) 17.893 19.241 ( 19.568 1.251 -0.098) 19.608 22.611 ( 1.714 0.789 0.560) 1.968 ======================= Grid point 589 (293/336) ======================= q-point: (-0.18 -0.36 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.583 ( 9.695 11.183 -1.472) 14.873 2.667 ( -15.234 2.816 0.646) 15.505 2.970 ( -12.822 -9.003 -1.174) 15.711 3.456 ( 1.602 -2.160 4.267) 5.044 4.054 ( -8.775 6.468 -11.459) 15.816 4.382 ( 5.412 -2.626 -1.115) 6.118 4.593 ( 3.457 -3.698 -6.372) 8.138 4.827 ( 7.587 -5.001 4.068) 9.956 5.082 ( -1.525 -2.990 3.784) 5.058 5.608 ( 5.205 -2.593 1.932) 6.128 6.207 ( 8.179 -0.785 -6.203) 10.295 6.385 ( -1.627 1.676 -8.290) 8.613 6.488 ( -2.903 7.598 0.369) 8.142 7.040 ( -5.075 6.631 -1.120) 8.425 7.237 ( -3.892 -9.746 -0.051) 10.494 7.514 ( 5.456 0.186 2.555) 6.028 7.802 ( 0.642 -0.113 7.856) 7.883 7.997 ( 8.559 -4.402 -3.814) 10.353 8.405 ( -0.543 6.098 -5.387) 8.155 8.669 ( -1.333 -6.246 -2.395) 6.821 8.809 ( -6.782 5.925 -1.060) 9.068 9.584 ( -3.007 0.522 -3.476) 4.626 9.787 ( 0.228 -0.570 1.016) 1.187 10.480 ( -1.291 -0.488 2.736) 3.064 11.900 ( -5.704 10.999 0.619) 12.405 12.312 ( -2.700 -1.305 7.307) 7.899 12.675 ( 8.179 -11.036 -0.069) 13.737 13.556 ( 1.500 0.325 -5.970) 6.164 13.810 ( -0.699 7.552 1.431) 7.718 14.127 ( 0.491 -4.414 -0.247) 4.448 16.717 ( -6.745 8.161 -9.061) 13.936 16.975 ( 0.799 -1.534 -0.295) 1.755 17.891 ( -6.071 2.833 12.073) 13.807 18.273 ( -10.299 -11.927 2.404) 15.941 19.502 ( 16.727 3.232 -3.850) 17.466 22.623 ( 1.356 1.356 -1.094) 2.208 ======================= Grid point 590 (294/336) ======================= q-point: (-0.09 -0.36 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.581 ( 5.908 16.984 -0.618) 17.993 2.440 ( -12.862 -2.103 5.584) 14.179 2.889 ( -10.450 -10.403 3.014) 15.050 3.509 ( -2.393 -2.973 7.105) 8.066 3.836 ( -3.485 4.125 -8.643) 10.191 4.453 ( 4.614 -0.431 -6.324) 7.840 4.654 ( 4.643 -1.470 -3.755) 6.150 5.001 ( 5.759 -2.736 2.895) 7.002 5.144 ( -0.172 -6.151 6.350) 8.843 5.775 ( 10.869 -0.223 4.180) 11.648 6.250 ( 4.353 5.191 -7.984) 10.471 6.311 ( 1.344 4.121 -3.971) 5.879 6.409 ( -0.398 3.668 -2.040) 4.216 6.901 ( -2.353 4.727 -2.227) 5.730 7.275 ( -3.362 -9.011 0.114) 9.619 7.588 ( 1.619 -4.348 -1.313) 4.821 7.831 ( -1.393 0.385 5.476) 5.664 8.165 ( 9.113 -2.814 -2.189) 9.786 8.306 ( 0.250 5.090 -3.916) 6.427 8.613 ( -6.747 8.537 -1.497) 10.984 8.744 ( 0.913 -6.009 2.285) 6.494 9.525 ( -0.820 -0.196 -4.261) 4.343 9.793 ( -0.787 0.000 1.805) 1.969 10.471 ( -2.380 -1.443 1.663) 3.242 11.727 ( -5.347 7.765 0.200) 9.430 12.290 ( -7.879 -0.272 10.320) 12.986 12.876 ( 4.798 -9.038 -2.499) 10.533 13.571 ( 5.669 0.008 -5.838) 8.138 13.730 ( -0.330 7.703 0.655) 7.738 14.168 ( -0.075 -3.303 0.399) 3.327 16.497 ( -5.833 4.817 -6.848) 10.204 16.998 ( 0.294 -0.877 -1.003) 1.364 17.837 ( -10.704 -4.416 8.121) 14.143 18.247 ( -7.026 -7.226 7.808) 12.749 19.672 ( 14.140 6.139 -6.301) 16.653 22.621 ( 1.400 1.162 -2.445) 3.048 ======================= Grid point 599 (295/336) ======================= q-point: (-0.27 -0.27 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.705 ( 13.547 -0.000 -1.796) 13.665 2.751 ( -15.515 0.000 8.551) 17.716 2.811 ( -18.119 0.000 -7.501) 19.610 3.436 ( 2.247 -0.000 3.242) 3.945 4.136 ( -10.420 0.000 -13.229) 16.840 4.354 ( 6.700 -0.000 -0.620) 6.728 4.528 ( 4.324 -0.000 -5.382) 6.903 4.790 ( 9.499 -0.000 4.679) 10.589 5.055 ( -2.469 0.000 4.448) 5.088 5.583 ( 6.386 -0.000 2.062) 6.710 6.196 ( 9.966 -0.000 -5.798) 11.531 6.399 ( -0.997 0.000 -10.713) 10.760 6.585 ( -3.472 0.000 2.050) 4.032 7.109 ( -5.646 0.000 -0.870) 5.713 7.114 ( -5.494 0.000 0.199) 5.497 7.522 ( 4.883 -0.000 1.685) 5.166 7.800 ( 1.053 -0.000 8.381) 8.447 7.953 ( 9.176 -0.000 -4.304) 10.135 8.496 ( 3.763 -0.000 -0.761) 3.839 8.576 ( -6.423 0.000 -7.971) 10.236 8.869 ( -5.275 0.000 0.297) 5.283 9.586 ( -3.561 0.000 -3.672) 5.116 9.782 ( 0.577 -0.000 1.226) 1.355 10.475 ( -1.910 0.000 2.896) 3.469 12.039 ( -8.966 0.000 2.180) 9.228 12.298 ( -1.703 0.000 6.682) 6.895 12.537 ( 10.193 -0.000 -1.451) 10.296 13.559 ( 1.406 -0.000 -6.047) 6.209 13.905 ( 0.782 -0.000 1.917) 2.070 14.064 ( -0.291 0.000 -1.004) 1.045 16.817 ( -10.637 0.000 -12.259) 16.230 16.939 ( 3.418 -0.000 0.549) 3.461 17.943 ( -14.611 0.000 15.362) 21.201 18.133 ( -2.512 0.000 2.405) 3.478 19.532 ( 17.567 -0.000 -4.609) 18.162 22.636 ( 1.283 -0.000 -1.462) 1.946 ======================= Grid point 600 (296/336) ======================= q-point: (-0.18 -0.27 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.885 ( 13.818 11.910 -2.246) 18.380 2.449 ( -16.917 4.136 6.288) 18.516 2.646 ( -15.282 -13.843 6.242) 21.544 3.466 ( -3.220 -1.254 6.080) 6.993 3.912 ( -5.261 2.964 -10.288) 11.929 4.433 ( 5.101 -1.152 -8.025) 9.579 4.610 ( 6.916 -1.989 -2.781) 7.715 4.967 ( 7.233 -0.823 7.290) 10.302 5.074 ( -0.694 -1.664 6.718) 6.955 5.769 ( 13.865 -0.231 4.735) 14.654 6.316 ( 6.409 2.256 -9.326) 11.538 6.342 ( 5.986 -0.415 -9.024) 10.837 6.531 ( -1.281 6.829 3.689) 7.866 6.987 ( -6.137 3.238 -2.599) 7.410 7.073 ( -4.444 -9.221 0.269) 10.240 7.543 ( -1.365 -0.984 -3.111) 3.537 7.840 ( -1.164 0.303 5.906) 6.027 8.119 ( 12.277 -1.422 -1.226) 12.420 8.426 ( -1.032 6.931 -3.214) 7.710 8.590 ( 1.379 -7.297 -1.946) 7.677 8.768 ( -5.964 4.286 2.080) 7.633 9.513 ( -2.515 -0.674 -4.227) 4.964 9.794 ( -0.184 0.046 1.960) 1.969 10.449 ( -3.179 -0.694 2.061) 3.852 11.880 ( -7.931 6.381 1.203) 10.250 12.282 ( -7.144 -0.471 9.207) 11.663 12.706 ( 7.772 -6.647 -3.790) 10.906 13.571 ( 5.075 -0.004 -6.109) 7.942 13.878 ( -0.711 6.604 1.157) 6.743 14.086 ( 0.495 -4.651 -0.368) 4.691 16.576 ( -8.424 2.764 -10.060) 13.409 16.970 ( 0.116 -1.403 -3.101) 3.405 17.783 ( -16.081 -1.398 12.448) 20.384 18.149 ( -3.242 -2.815 10.231) 11.096 19.753 ( 16.204 2.263 -7.569) 18.027 22.637 ( 1.063 0.461 -3.295) 3.492 ======================= Grid point 601 (297/336) ======================= q-point: (-0.09 -0.27 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.786 ( -4.553 20.700 -0.739) 21.207 2.353 ( -2.727 -1.224 17.153) 17.411 2.600 ( -13.115 -15.657 4.631) 20.942 3.403 ( -12.594 -3.669 6.498) 14.639 3.847 ( 5.766 2.181 -2.133) 6.523 4.447 ( 2.541 -2.600 -11.770) 12.319 4.732 ( 7.828 -0.159 -0.356) 7.838 5.086 ( 2.608 0.776 3.684) 4.580 5.162 ( 3.201 -3.472 8.488) 9.713 6.061 ( 18.701 3.413 5.440) 19.773 6.278 ( 1.181 3.304 -5.216) 6.287 6.419 ( 8.007 5.074 -10.806) 14.374 6.478 ( 2.085 8.358 4.570) 9.752 6.857 ( -3.348 0.390 -5.151) 6.156 7.125 ( -2.424 -10.628 -1.624) 11.021 7.522 ( -0.273 -5.555 -3.157) 6.395 7.845 ( -0.915 0.567 4.735) 4.856 8.271 ( 3.195 3.408 -4.969) 6.820 8.403 ( 8.750 2.816 4.975) 10.452 8.575 ( -6.113 6.112 -1.442) 8.764 8.712 ( -0.023 -5.630 2.728) 6.256 9.472 ( -0.818 -2.243 -4.969) 5.513 9.804 ( 0.296 0.519 2.830) 2.892 10.414 ( -4.300 -1.702 1.927) 5.010 11.685 ( -8.566 7.103 -0.476) 11.138 12.181 ( -13.049 -1.610 8.675) 15.752 12.840 ( 4.566 -6.484 -6.098) 10.004 13.652 ( 8.048 -0.860 -3.870) 8.971 13.804 ( -0.350 7.471 0.716) 7.513 14.145 ( 1.400 -3.724 1.255) 4.172 16.394 ( -4.949 1.412 -6.603) 8.372 16.938 ( -2.853 -2.624 -5.374) 6.626 17.606 ( -16.800 -4.714 7.841) 19.129 18.170 ( -8.063 -3.398 13.732) 16.282 19.935 ( 17.595 6.085 -7.616) 20.116 22.627 ( 1.141 0.326 -4.182) 4.347 ======================= Grid point 611 (298/336) ======================= q-point: (-0.18 -0.18 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.098 ( 1.110 -0.000 -9.142) 9.209 2.335 ( -18.488 0.000 12.495) 22.315 2.345 ( -3.907 0.000 18.818) 19.219 3.369 ( -13.115 0.000 5.972) 14.411 3.871 ( 4.671 -0.000 -2.859) 5.476 4.417 ( 1.375 -0.000 -12.160) 12.238 4.727 ( 9.140 -0.000 0.028) 9.141 5.111 ( 1.355 -0.000 6.658) 6.795 5.113 ( 5.596 -0.000 7.411) 9.286 6.091 ( 21.021 -0.000 6.666) 22.053 6.307 ( 2.041 -0.000 -6.191) 6.518 6.472 ( 11.949 -0.000 -10.940) 16.200 6.589 ( -0.829 0.000 3.831) 3.920 6.923 ( -0.534 0.000 -4.867) 4.896 6.927 ( -5.928 0.000 -0.730) 5.973 7.472 ( -1.884 0.000 -4.017) 4.437 7.851 ( -1.020 0.000 4.668) 4.778 8.294 ( 7.988 -0.000 -2.916) 8.504 8.480 ( 4.482 -0.000 6.046) 7.526 8.557 ( 1.285 -0.000 -3.790) 4.002 8.699 ( -6.844 0.000 2.228) 7.198 9.447 ( -1.845 0.000 -4.525) 4.887 9.809 ( 0.523 -0.000 2.615) 2.667 10.397 ( -4.660 0.000 2.120) 5.120 11.776 ( -9.372 0.000 0.194) 9.374 12.153 ( -14.470 0.000 5.493) 15.477 12.769 ( 7.178 -0.000 -4.801) 8.635 13.644 ( 7.574 -0.000 -4.089) 8.608 13.897 ( -2.201 0.000 1.115) 2.467 14.089 ( 3.374 -0.000 1.073) 3.540 16.411 ( -5.936 0.000 -8.467) 10.341 16.909 ( -2.955 0.000 -5.941) 6.635 17.560 ( -18.567 0.000 9.793) 20.991 18.138 ( -8.005 0.000 14.446) 16.515 19.994 ( 18.970 -0.000 -7.868) 20.537 22.631 ( 1.030 -0.000 -4.612) 4.726 ======================= Grid point 612 (299/336) ======================= q-point: (-0.09 -0.18 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.816 ( -13.818 18.320 4.489) 23.382 2.234 ( -16.931 -18.205 9.096) 26.474 2.504 ( 5.137 0.579 17.571) 18.316 3.149 ( -18.486 -2.349 5.380) 19.396 4.015 ( 11.702 0.772 4.371) 12.516 4.345 ( -1.426 -3.133 -14.228) 14.638 4.889 ( 9.991 0.786 2.653) 10.367 5.172 ( 3.380 2.914 4.494) 6.333 5.248 ( 4.544 -2.612 5.886) 7.882 6.311 ( 2.252 2.979 -0.173) 3.738 6.471 ( 10.820 7.351 0.577) 13.094 6.491 ( 10.650 4.786 -0.602) 11.691 6.606 ( 6.427 -2.396 -6.258) 9.285 6.787 ( -3.771 3.357 -1.873) 5.385 7.006 ( 3.148 -7.464 -4.527) 9.280 7.491 ( 4.339 -4.134 -0.960) 6.069 7.889 ( 3.103 0.106 4.990) 5.877 8.284 ( -1.699 3.984 -4.889) 6.532 8.492 ( -8.185 2.833 -2.808) 9.106 8.609 ( 3.762 1.848 2.330) 4.795 8.710 ( 7.162 -3.921 8.638) 11.886 9.404 ( -1.064 -2.119 -4.984) 5.520 9.846 ( 2.145 0.260 2.806) 3.542 10.314 ( -7.978 -1.255 0.653) 8.102 11.580 ( -10.888 5.532 -1.745) 12.337 11.921 ( -18.722 -5.640 2.380) 19.697 12.861 ( 6.647 -1.160 -4.947) 8.367 13.748 ( 6.774 -0.792 -2.475) 7.256 13.843 ( -2.254 3.389 0.879) 4.164 14.198 ( 6.971 -0.952 4.109) 8.148 16.304 ( -1.752 -0.344 -5.748) 6.019 16.824 ( -3.846 -1.728 -4.882) 6.451 17.322 ( -18.561 -3.855 5.942) 19.866 18.032 ( -16.168 -1.712 11.546) 19.941 20.265 ( 21.500 4.488 -4.999) 22.525 22.618 ( 0.953 0.026 -4.599) 4.697 ======================= Grid point 623 (300/336) ======================= q-point: (-0.09 -0.09 0.40) 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.756 ( -11.720 0.000 7.030) 13.667 1.891 ( -17.641 0.000 13.679) 22.323 2.620 ( -7.201 0.000 9.197) 11.681 2.930 ( -8.397 0.000 13.295) 15.724 4.197 ( -3.354 0.000 -14.877) 15.251 4.263 ( 13.333 -0.000 7.244) 15.174 5.080 ( 10.114 -0.000 4.524) 11.079 5.284 ( 4.320 -0.000 3.014) 5.267 5.322 ( 3.765 -0.000 2.882) 4.741 6.339 ( -5.337 0.000 2.972) 6.108 6.493 ( 4.303 -0.000 -2.853) 5.163 6.603 ( 3.479 -0.000 -11.281) 11.806 6.697 ( -4.415 0.000 -0.222) 4.421 6.913 ( 21.164 -0.000 5.941) 21.983 7.063 ( 7.662 -0.000 -4.972) 9.134 7.573 ( 7.664 -0.000 0.441) 7.677 8.025 ( 9.795 -0.000 5.839) 11.404 8.224 ( -4.808 0.000 -4.609) 6.660 8.317 ( -12.607 0.000 -3.794) 13.166 8.616 ( 0.959 -0.000 -1.625) 1.887 8.936 ( 9.404 -0.000 13.152) 16.168 9.354 ( 0.736 -0.000 -5.092) 5.145 9.906 ( 3.019 -0.000 2.350) 3.826 10.125 ( -14.265 0.000 -3.176) 14.614 11.416 ( -11.256 0.000 -3.691) 11.845 11.580 ( -17.843 0.000 0.633) 17.854 12.946 ( 6.887 -0.000 -3.872) 7.900 13.816 ( -3.011 0.000 0.783) 3.112 13.817 ( 3.964 -0.000 -2.046) 4.461 14.383 ( 10.889 -0.000 6.279) 12.569 16.278 ( 2.911 -0.000 -4.029) 4.971 16.755 ( -0.545 0.000 -1.044) 1.178 17.027 ( -18.794 0.000 3.434) 19.105 17.774 ( -20.759 0.000 6.290) 21.691 20.607 ( 19.631 -0.000 -2.384) 19.775 22.604 ( 0.384 -0.000 -3.664) 3.684 ======================= Grid point 624 (301/336) ======================= 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.830 ( 0.000 -0.000 0.000) 0.000 1.923 ( 0.000 -0.000 0.000) 0.000 2.213 ( -0.000 0.000 0.000) 0.000 3.266 ( 0.000 -0.000 0.000) 0.000 3.826 ( 0.000 -0.000 0.000) 0.000 4.765 ( 0.000 -0.000 0.000) 0.000 5.360 ( 0.000 -0.000 0.000) 0.000 5.404 ( 0.000 -0.000 0.000) 0.000 5.418 ( 0.000 -0.000 0.000) 0.000 6.141 ( 0.000 -0.000 0.000) 0.000 6.456 ( -0.000 0.000 0.000) 0.000 6.638 ( 0.000 -0.000 0.000) 0.000 6.816 ( 0.000 -0.000 0.000) 0.000 7.039 ( -0.000 0.000 -0.000) 0.000 7.460 ( 0.000 -0.000 0.000) 0.000 7.768 ( -0.000 0.000 0.000) 0.000 7.881 ( -0.000 0.000 0.000) 0.000 7.927 ( -0.000 0.000 0.000) 0.000 8.512 ( 0.000 -0.000 0.000) 0.000 8.627 ( 0.000 -0.000 0.000) 0.000 9.191 ( 0.000 -0.000 -0.000) 0.000 9.506 ( 0.000 -0.000 0.000) 0.000 9.535 ( 0.000 -0.000 0.000) 0.000 9.997 ( -0.000 0.000 0.000) 0.000 11.044 ( -0.000 0.000 0.000) 0.000 11.335 ( 0.000 -0.000 0.000) 0.000 13.006 ( 0.000 -0.000 0.000) 0.000 13.770 ( 0.000 -0.000 0.000) 0.000 13.835 ( 0.000 -0.000 0.000) 0.000 14.713 ( 0.000 -0.000 0.000) 0.000 16.490 ( -0.000 0.000 0.000) 0.000 16.524 ( 0.000 -0.000 0.000) 0.000 17.088 ( -0.000 0.000 0.000) 0.000 17.163 ( 0.000 -0.000 0.000) 0.000 20.935 ( 0.000 -0.000 0.000) 0.000 22.551 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 626 (302/336) ======================= 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.801 ( -1.758 5.350 -5.743) 8.044 1.997 ( 7.444 -14.327 -2.104) 16.282 2.425 ( 18.933 -3.378 1.835) 19.319 3.220 ( -2.882 1.506 -4.440) 5.504 3.878 ( 2.459 -3.183 5.057) 6.461 4.665 ( -7.611 1.340 -8.039) 11.152 5.300 ( -1.349 6.444 -2.348) 6.990 5.355 ( -4.720 1.130 -1.713) 5.147 5.464 ( 0.536 -6.167 -2.364) 6.626 6.122 ( 3.370 11.322 4.530) 12.651 6.491 ( -4.224 -9.013 6.654) 11.973 6.654 ( -0.459 2.903 -5.439) 6.182 6.711 ( -2.926 -0.540 -4.342) 5.263 7.005 ( -3.818 5.572 3.112) 7.437 7.315 ( -14.193 0.810 -2.892) 14.507 7.696 ( -3.376 3.498 -1.388) 5.056 7.966 ( 7.914 3.792 4.779) 9.993 8.011 ( 6.964 1.259 4.437) 8.353 8.380 ( -10.702 0.390 -6.600) 12.580 8.615 ( -2.025 -3.112 0.697) 3.778 9.223 ( 2.056 -3.046 -1.874) 4.125 9.441 ( -6.436 1.449 -5.718) 8.730 9.712 ( 16.205 -2.507 5.798) 17.393 9.984 ( -2.039 -1.197 0.156) 2.370 11.157 ( 6.839 -5.737 3.567) 9.613 11.423 ( 10.140 -4.444 -1.313) 11.149 12.957 ( -4.650 2.730 1.439) 5.581 13.780 ( 1.281 0.690 0.300) 1.486 13.827 ( -1.792 -0.799 0.831) 2.131 14.628 ( -6.743 4.274 -1.761) 8.176 16.334 ( -9.890 -3.654 0.929) 10.585 16.786 ( 17.268 -4.001 0.128) 17.726 16.886 ( -9.874 -2.810 -3.138) 10.735 17.491 ( 23.886 -2.523 -0.199) 24.019 20.810 ( -11.246 6.914 0.111) 13.202 22.544 ( -1.480 0.080 1.985) 2.477 ======================= Grid point 627 (303/336) ======================= 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.692 ( 0.856 8.811 -5.694) 10.526 2.284 ( 11.054 -14.112 -1.525) 17.991 2.815 ( 20.665 -8.275 -3.607) 22.550 3.111 ( -3.116 1.429 -6.615) 7.451 4.011 ( 3.549 -5.012 8.498) 10.485 4.439 ( -11.010 0.903 -10.915) 15.529 5.139 ( -10.034 3.121 -4.406) 11.395 5.265 ( -0.731 5.551 -2.823) 6.271 5.481 ( -0.754 -2.787 -6.057) 6.710 6.115 ( 4.480 11.254 7.708) 14.357 6.445 ( -8.726 6.391 -3.855) 11.483 6.549 ( -3.192 -5.975 4.916) 8.369 6.776 ( 0.427 -0.224 -3.845) 3.875 6.820 ( -8.348 5.907 1.545) 10.342 7.055 ( -12.205 0.464 -1.916) 12.364 7.612 ( -4.342 -1.043 -0.519) 4.495 8.045 ( 3.169 5.932 4.945) 8.348 8.107 ( 1.525 6.015 -0.175) 6.207 8.234 ( 1.618 -1.697 -1.296) 2.679 8.632 ( -1.649 -4.578 2.201) 5.340 9.175 ( -7.217 1.538 -12.669) 14.662 9.352 ( -0.673 -5.318 0.546) 5.389 9.913 ( -1.196 0.697 1.363) 1.943 10.082 ( 14.215 -3.241 4.408) 15.232 11.330 ( 7.817 -1.755 1.929) 8.240 11.740 ( 18.192 -12.072 -0.509) 21.840 12.843 ( -6.917 3.557 3.573) 8.559 13.783 ( -0.978 1.600 0.880) 2.072 13.806 ( -1.875 -0.310 0.877) 2.093 14.434 ( -8.840 4.697 -3.178) 10.502 16.265 ( -5.186 -5.580 1.666) 7.798 16.790 ( -3.521 -3.713 -1.312) 5.282 17.139 ( 18.130 -6.816 0.643) 19.379 17.916 ( 25.868 -4.428 -4.678) 26.658 20.469 ( -19.533 11.774 0.818) 22.821 22.533 ( -2.001 -0.287 3.665) 4.185 ======================= Grid point 628 (304/336) ======================= 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.584 ( 0.853 12.438 -2.827) 12.783 2.555 ( 8.997 -8.628 -0.990) 12.504 2.921 ( -0.620 -3.154 -18.374) 18.653 3.264 ( 15.250 -7.454 2.749) 17.195 4.109 ( -5.786 -0.287 -2.804) 6.436 4.240 ( -3.667 -5.104 1.150) 6.389 4.907 ( -11.083 3.745 -2.684) 12.003 5.188 ( -0.087 4.781 -4.297) 6.429 5.424 ( -1.193 1.963 -7.462) 7.808 6.130 ( 1.474 7.310 6.351) 9.795 6.220 ( -9.819 7.910 -0.095) 12.609 6.473 ( -8.529 9.566 -7.259) 14.729 6.558 ( -5.974 -0.044 4.480) 7.467 6.800 ( -5.913 -4.626 -2.714) 7.983 7.022 ( 4.225 -4.373 4.932) 7.829 7.583 ( -2.324 -4.325 0.272) 4.918 7.989 ( -3.101 1.281 -3.474) 4.830 8.082 ( 1.692 5.176 3.596) 6.526 8.334 ( 8.313 6.317 2.778) 10.804 8.652 ( -4.278 -4.861 1.739) 6.705 8.941 ( -8.121 0.841 -12.114) 14.608 9.418 ( 0.654 -5.417 0.736) 5.506 9.869 ( -2.526 0.601 -0.363) 2.622 10.333 ( 9.869 -2.091 2.573) 10.411 11.473 ( 8.217 0.380 0.628) 8.249 12.135 ( 17.675 -9.407 -3.924) 20.403 12.747 ( -5.691 0.538 8.074) 9.893 13.732 ( -5.999 -1.393 1.939) 6.456 13.759 ( -1.457 5.743 -0.661) 5.962 14.268 ( -5.128 1.328 -2.452) 5.837 16.283 ( -1.210 -6.126 1.822) 6.505 16.810 ( 0.556 -4.363 2.201) 4.918 17.482 ( 16.416 -5.665 0.231) 17.368 18.309 ( 21.984 -5.119 -10.925) 25.077 20.018 ( -22.236 13.249 4.037) 26.197 22.535 ( -1.449 -0.895 4.420) 4.737 ======================= Grid point 629 (305/336) ======================= 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.450 ( -1.555 12.507 0.203) 12.605 2.642 ( -0.201 -1.706 -9.003) 9.165 2.933 ( 7.343 -6.410 -8.502) 12.934 3.537 ( 8.598 -4.925 2.545) 10.230 3.887 ( -11.015 0.416 -9.062) 14.270 4.330 ( 0.206 -4.980 5.903) 7.726 4.712 ( -7.602 3.052 -0.089) 8.192 5.118 ( -0.800 4.018 -3.725) 5.538 5.347 ( 0.748 3.399 -5.301) 6.341 5.956 ( -9.070 9.404 0.749) 13.087 6.113 ( -3.649 2.176 4.333) 6.069 6.296 ( -4.755 0.201 -3.858) 6.126 6.448 ( -1.973 6.273 -5.330) 8.465 6.786 ( -2.532 -4.566 4.357) 6.800 7.196 ( 6.568 -5.231 4.867) 9.705 7.613 ( -0.132 -4.626 0.921) 4.719 7.931 ( -0.753 0.397 -3.038) 3.155 8.082 ( 0.957 3.935 3.352) 5.257 8.376 ( 5.081 10.715 -0.872) 11.891 8.558 ( -10.703 -6.057 -4.019) 12.938 8.834 ( -0.391 -0.945 -2.369) 2.580 9.467 ( -0.524 -3.715 0.629) 3.804 9.830 ( -0.971 0.715 -0.928) 1.522 10.465 ( 4.084 -1.306 0.081) 4.288 11.584 ( 5.765 0.879 0.138) 5.833 12.368 ( 9.635 -0.383 -7.486) 12.207 12.794 ( 1.012 -6.016 10.923) 12.512 13.622 ( -7.863 1.291 0.129) 7.969 13.684 ( -1.559 3.859 0.374) 4.178 14.213 ( -1.114 -0.842 -0.842) 1.630 16.344 ( 0.735 -4.815 1.041) 4.980 16.899 ( 2.160 -4.127 4.950) 6.797 17.765 ( 13.757 -3.033 -0.358) 14.092 18.533 ( 10.023 -3.563 -17.071) 20.114 19.625 ( -15.906 10.286 9.484) 21.184 22.554 ( -0.583 -1.081 3.652) 3.853 ======================= Grid point 630 (306/336) ======================= 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 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.333 ( -1.541 5.614 0.628) 5.855 2.590 ( -0.389 -0.691 -5.536) 5.592 3.058 ( 4.351 -2.654 -1.868) 5.428 3.658 ( 1.087 1.478 5.351) 5.656 3.705 ( -4.187 -2.532 -7.851) 9.251 4.381 ( -0.488 -1.959 1.734) 2.661 4.613 ( -2.509 1.173 0.559) 2.826 5.047 ( -1.212 2.311 -1.704) 3.116 5.331 ( 1.516 1.029 -1.514) 2.377 5.803 ( -2.842 3.402 0.953) 4.534 6.066 ( -1.721 0.781 0.956) 2.118 6.218 ( -3.838 -1.470 -0.741) 4.176 6.366 ( 0.979 3.201 -3.610) 4.923 6.817 ( -0.598 -1.541 2.575) 3.060 7.351 ( 3.738 -2.840 2.389) 5.268 7.651 ( 0.077 -1.472 0.587) 1.587 7.917 ( 0.427 -0.131 -0.827) 0.940 8.081 ( 0.355 1.464 1.191) 1.920 8.286 ( -1.878 4.701 -3.428) 6.114 8.486 ( -2.233 -2.086 -0.384) 3.080 8.843 ( 0.366 -0.516 0.055) 0.635 9.483 ( -0.531 -1.266 0.274) 1.400 9.813 ( -0.070 0.300 -0.491) 0.579 10.508 ( 0.900 -0.425 -0.356) 1.057 11.639 ( 1.886 0.460 -0.042) 1.941 12.421 ( 2.606 0.800 -2.601) 3.768 12.936 ( 2.568 -3.505 4.119) 5.987 13.504 ( -3.930 1.236 -0.259) 4.128 13.642 ( -0.842 1.186 0.301) 1.485 14.211 ( -0.053 -0.496 -0.150) 0.521 16.392 ( 0.545 -1.816 0.246) 1.912 16.986 ( 1.186 -1.912 2.941) 3.703 17.964 ( 7.564 -0.869 0.293) 7.619 18.508 ( -1.625 -0.525 -9.882) 10.029 19.459 ( -3.885 3.341 5.657) 7.633 22.573 ( -0.100 -0.489 1.418) 1.503 ======================= Grid point 637 (307/336) ======================= q-point: ( 0.09 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.837 ( 2.623 -0.000 -1.916) 3.248 2.084 ( 15.616 -0.000 -5.516) 16.562 2.739 ( 20.595 -0.000 -2.439) 20.738 3.127 ( -4.072 0.000 -7.174) 8.250 3.960 ( 4.045 -0.000 8.794) 9.680 4.450 ( -11.599 0.000 -11.723) 16.491 5.165 ( -10.995 0.000 -4.131) 11.746 5.359 ( -0.671 0.000 -3.751) 3.810 5.406 ( 0.623 -0.000 -5.438) 5.473 6.306 ( 5.853 -0.000 8.191) 10.067 6.400 ( -6.584 0.000 9.494) 11.554 6.530 ( -7.075 0.000 -8.698) 11.213 6.722 ( 4.482 -0.000 -2.572) 5.168 6.976 ( -6.651 0.000 3.930) 7.725 7.013 ( -19.429 0.000 -4.637) 19.974 7.595 ( -7.226 0.000 -2.339) 7.595 8.130 ( 4.378 -0.000 5.292) 6.868 8.147 ( -9.175 0.000 -6.665) 11.341 8.222 ( 11.222 -0.000 5.740) 12.605 8.580 ( -1.425 0.000 1.926) 2.396 9.192 ( -6.111 0.000 -12.487) 13.902 9.297 ( -1.558 0.000 0.346) 1.596 9.929 ( -3.444 0.000 0.041) 3.444 10.037 ( 17.443 -0.000 5.813) 18.386 11.329 ( 12.021 -0.000 5.101) 13.058 11.606 ( 17.189 -0.000 -1.803) 17.284 12.880 ( -7.744 0.000 2.900) 8.269 13.783 ( -4.062 0.000 1.305) 4.267 13.817 ( 2.370 -0.000 0.593) 2.443 14.479 ( -11.111 0.000 -3.629) 11.689 16.211 ( -4.892 0.000 2.883) 5.678 16.754 ( -3.311 0.000 -1.011) 3.462 17.073 ( 20.549 -0.000 -1.377) 20.595 17.873 ( 25.809 -0.000 -3.930) 26.107 20.582 ( -20.594 0.000 0.431) 20.598 22.530 ( -2.315 0.000 3.811) 4.459 ======================= Grid point 638 (308/336) ======================= q-point: ( 0.18 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.832 ( 3.015 11.277 1.997) 11.843 2.366 ( 15.416 -9.551 -5.080) 18.833 2.876 ( 0.044 -1.378 -18.853) 18.903 3.173 ( 13.742 -2.241 3.035) 14.251 4.092 ( 2.692 -1.279 8.837) 9.326 4.183 ( -11.539 -0.906 -10.195) 15.424 4.946 ( -12.437 0.813 -3.047) 12.831 5.282 ( -0.496 4.795 -6.227) 7.875 5.395 ( -0.366 -3.555 -8.734) 9.437 6.284 ( -5.288 7.668 10.068) 13.716 6.342 ( -7.853 3.118 -0.090) 8.449 6.522 ( 3.494 -2.230 2.644) 4.916 6.609 ( -17.113 1.723 -6.749) 18.476 6.779 ( -0.855 4.781 -1.002) 4.959 6.926 ( -2.222 -6.311 3.453) 7.530 7.494 ( -4.850 -3.538 -1.669) 6.231 7.994 ( -3.940 -0.073 -6.155) 7.308 8.186 ( 1.317 4.386 5.437) 7.108 8.415 ( 7.555 1.140 5.349) 9.327 8.595 ( 0.439 -0.810 2.624) 2.781 8.941 ( -11.498 -0.478 -13.917) 18.059 9.347 ( 2.937 -1.929 1.011) 3.656 9.876 ( -2.699 0.163 -0.311) 2.721 10.298 ( 10.777 -1.242 2.431) 11.117 11.531 ( 11.646 4.142 3.311) 12.796 11.949 ( 19.933 -7.951 -0.789) 21.474 12.764 ( -8.359 0.791 5.006) 9.775 13.710 ( -6.415 -0.603 1.354) 6.584 13.848 ( 1.966 2.815 0.455) 3.463 14.277 ( -9.589 -0.025 -3.772) 10.304 16.205 ( -0.301 -2.144 4.474) 4.970 16.750 ( 0.706 -1.752 2.541) 3.166 17.409 ( 21.114 -1.972 -3.048) 21.424 18.237 ( 22.137 -2.125 -9.335) 24.118 20.192 ( -24.880 4.863 2.651) 25.489 22.523 ( -1.852 -0.308 4.978) 5.321 ======================= Grid point 639 (309/336) ======================= q-point: ( 0.27 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.733 ( -2.235 15.722 4.434) 16.487 2.605 ( 6.135 -3.121 -7.338) 10.061 2.795 ( 5.742 -7.179 -15.859) 18.331 3.441 ( 11.240 -4.268 2.564) 12.294 3.911 ( -10.449 1.587 -8.503) 13.565 4.238 ( 0.954 -4.229 9.098) 10.078 4.739 ( -10.675 0.250 -0.715) 10.702 5.196 ( -0.148 4.268 -7.042) 8.236 5.352 ( -0.539 -2.252 -10.744) 10.991 6.113 ( -13.668 6.625 0.613) 15.201 6.200 ( -6.939 5.928 8.678) 12.594 6.286 ( -10.668 -1.769 -3.541) 11.379 6.583 ( 0.842 8.045 -6.614) 10.449 6.742 ( 2.939 0.100 6.314) 6.965 7.067 ( 4.809 -8.894 4.425) 11.037 7.491 ( -0.823 -6.458 -0.484) 6.528 7.938 ( 0.703 0.346 -5.011) 5.072 8.172 ( -1.383 4.755 5.278) 7.237 8.479 ( -5.314 -1.484 0.487) 5.538 8.573 ( 2.074 8.544 -2.183) 9.059 8.770 ( -3.010 -5.217 -4.986) 7.818 9.416 ( 2.454 -1.791 1.084) 3.226 9.838 ( -1.344 0.232 -0.733) 1.549 10.439 ( 4.975 -1.342 -0.465) 5.174 11.663 ( 9.219 6.684 1.630) 11.503 12.300 ( 14.087 -6.749 -3.916) 16.104 12.692 ( -5.937 -3.527 9.257) 11.549 13.609 ( -7.464 -0.839 0.699) 7.543 13.815 ( 0.100 7.433 -0.329) 7.441 14.170 ( -3.768 -3.415 -1.330) 5.256 16.280 ( 2.906 -2.107 5.250) 6.359 16.825 ( 2.184 -3.266 5.621) 6.858 17.728 ( 19.297 -1.014 -4.690) 19.885 18.464 ( 11.388 -3.192 -16.276) 20.119 19.786 ( -21.143 6.346 8.042) 23.494 22.538 ( -0.610 -0.563 4.828) 4.899 ======================= Grid point 640 (310/336) ======================= q-point: ( 0.36 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.535 ( -6.803 14.260 3.800) 16.250 2.590 ( 3.007 0.816 -9.307) 9.815 2.966 ( 8.458 -7.323 -4.558) 12.080 3.611 ( 2.772 -4.554 -1.040) 5.432 3.731 ( -3.411 3.606 -0.264) 4.971 4.319 ( -0.936 -3.832 6.191) 7.341 4.607 ( -6.608 -1.662 1.452) 6.967 5.097 ( -2.549 3.049 -6.796) 7.872 5.311 ( 0.383 -2.792 -10.033) 10.422 5.856 ( -9.804 2.208 -2.821) 10.438 6.106 ( -5.004 2.734 6.077) 8.333 6.192 ( -4.247 -1.400 4.239) 6.162 6.465 ( -0.441 7.509 -4.679) 8.859 6.842 ( 6.085 3.651 3.632) 7.972 7.252 ( 4.453 -8.115 3.213) 9.798 7.560 ( 0.848 -6.236 0.347) 6.303 7.930 ( 2.317 1.082 -4.665) 5.320 8.118 ( -5.118 1.252 3.204) 6.166 8.307 ( -7.853 1.582 -4.126) 9.010 8.574 ( 4.311 6.720 2.099) 8.256 8.789 ( 0.083 -4.021 -1.697) 4.365 9.471 ( 2.490 -0.223 1.199) 2.772 9.817 ( -0.599 0.144 -0.661) 0.904 10.495 ( 1.793 -0.906 -1.025) 2.255 11.719 ( 5.248 7.655 0.763) 9.312 12.423 ( 1.592 -0.728 -3.289) 3.725 12.780 ( -0.790 -11.213 7.728) 13.641 13.516 ( -3.972 0.051 -0.317) 3.985 13.740 ( 0.652 7.919 -0.403) 7.956 14.170 ( -1.051 -3.754 0.214) 3.905 16.380 ( 3.898 0.314 5.281) 6.571 16.930 ( 1.809 -3.639 5.725) 7.021 17.971 ( 13.771 1.381 -5.565) 14.917 18.466 ( -0.277 -3.372 -15.734) 16.094 19.532 ( -11.444 3.944 9.321) 15.278 22.566 ( 0.355 -0.228 3.116) 3.145 ======================= Grid point 641 (311/336) ======================= q-point: ( 0.45 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.350 ( -4.349 6.895 1.863) 8.362 2.614 ( 4.252 1.987 1.566) 4.948 3.072 ( 0.703 -1.196 -0.057) 1.389 3.609 ( -0.797 -3.828 -4.818) 6.205 3.765 ( 5.103 3.974 8.307) 10.528 4.370 ( 0.146 -2.987 2.860) 4.139 4.571 ( -2.187 -3.140 1.745) 4.206 5.009 ( -1.854 -1.651 -4.640) 5.262 5.279 ( -1.837 -3.788 -7.670) 8.750 5.740 ( -2.420 -3.004 -3.950) 5.521 6.069 ( -1.872 0.367 5.044) 5.393 6.227 ( 2.481 -1.343 7.191) 7.725 6.378 ( -0.910 5.628 -1.170) 5.820 6.897 ( 5.652 6.452 -0.780) 8.613 7.359 ( -0.726 -2.731 0.675) 2.906 7.602 ( -1.263 -4.859 -1.935) 5.381 7.929 ( 1.901 0.622 -4.851) 5.247 8.045 ( -6.133 -4.240 1.580) 7.621 8.218 ( -1.276 1.460 2.403) 3.088 8.604 ( 5.968 7.154 3.639) 10.002 8.807 ( -0.771 -3.381 -2.257) 4.137 9.516 ( 3.328 1.931 0.822) 3.935 9.807 ( -0.617 -0.363 0.132) 0.728 10.511 ( 0.087 -0.106 -0.287) 0.318 11.705 ( 1.441 7.345 0.744) 7.522 12.398 ( -4.620 -1.514 1.874) 5.210 12.875 ( -3.667 -9.288 0.721) 10.011 13.496 ( 2.247 0.449 -0.870) 2.451 13.696 ( 2.777 6.041 -0.928) 6.714 14.189 ( -0.875 -2.690 0.609) 2.893 16.448 ( 2.983 4.005 4.984) 7.055 16.993 ( -0.091 -1.263 0.984) 1.604 18.007 ( -2.235 3.690 -5.917) 7.323 18.475 ( 4.886 -4.026 -0.253) 6.337 19.420 ( -5.137 -0.781 0.713) 5.245 22.584 ( 0.579 0.633 0.416) 0.953 ======================= Grid point 642 (312/336) ======================= q-point: (-0.45 0.09 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.315 ( 1.364 -1.471 2.068) 2.881 2.686 ( 3.174 3.270 7.912) 9.131 3.029 ( -4.770 4.053 5.498) 8.331 3.585 ( -4.062 -0.503 -3.147) 5.163 3.910 ( 10.359 3.009 10.064) 14.753 4.396 ( -0.180 1.233 -0.371) 1.300 4.621 ( 3.453 -6.185 -0.900) 7.140 5.031 ( 1.288 -6.138 -0.778) 6.320 5.244 ( -2.825 -5.759 -2.888) 7.035 5.796 ( 5.506 -7.473 -2.101) 9.517 6.098 ( 1.296 -0.907 3.955) 4.260 6.307 ( -4.278 0.739 2.379) 4.950 6.363 ( 7.929 -0.611 4.352) 9.065 6.902 ( 4.873 7.480 -2.663) 9.316 7.274 ( -6.853 3.055 -3.023) 8.089 7.618 ( -0.793 -3.951 -2.008) 4.503 7.919 ( 1.195 -0.837 -5.198) 5.399 8.015 ( -4.902 -5.036 1.123) 7.117 8.239 ( -0.123 -1.593 4.414) 4.694 8.692 ( 9.721 7.449 5.273) 13.334 8.806 ( -1.336 -3.382 -0.460) 3.665 9.545 ( 3.083 4.146 0.099) 5.168 9.811 ( 0.126 -1.220 0.928) 1.538 10.486 ( -2.941 0.934 -0.667) 3.157 11.640 ( -1.963 6.753 1.165) 7.128 12.340 ( -8.143 -2.646 6.775) 10.919 12.846 ( -3.675 -1.916 -6.444) 7.662 13.554 ( 3.680 -2.443 -0.143) 4.419 13.711 ( 5.900 3.866 -2.042) 7.344 14.200 ( -0.940 -2.092 0.815) 2.433 16.459 ( 1.769 7.292 3.815) 8.418 16.964 ( -1.385 2.421 -2.834) 3.977 17.842 ( -8.086 5.171 -3.253) 10.134 18.574 ( -4.773 0.260 13.456) 14.279 19.430 ( 6.355 -9.683 -9.297) 14.852 22.577 ( 0.517 1.345 -2.137) 2.578 ======================= Grid point 643 (313/336) ======================= q-point: (-0.36 0.09 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.420 ( 4.699 -4.429 4.819) 8.057 2.688 ( -3.067 6.361 2.163) 7.386 2.986 ( -1.059 3.828 13.768) 14.330 3.414 ( -12.013 7.046 -1.484) 14.006 4.120 ( 9.181 1.350 7.178) 11.732 4.339 ( 0.060 4.481 -3.085) 5.440 4.796 ( 9.395 -8.199 0.780) 12.494 5.106 ( 0.823 -4.343 1.345) 4.620 5.301 ( 0.560 -9.931 2.852) 10.348 5.999 ( 6.584 -8.579 2.612) 11.126 6.136 ( 2.586 0.778 -3.448) 4.380 6.301 ( -0.490 -8.230 5.595) 9.963 6.534 ( 9.967 -1.817 -0.815) 10.164 6.902 ( 4.391 6.100 1.309) 7.630 7.102 ( -6.665 4.138 -4.136) 8.869 7.616 ( -0.727 -1.202 -1.909) 2.370 7.932 ( 0.771 -4.146 -4.369) 6.072 7.990 ( -4.806 -5.897 -0.870) 7.657 8.263 ( -0.653 0.136 3.359) 3.425 8.742 ( 2.147 3.758 -2.962) 5.245 8.919 ( 8.463 -0.615 11.840) 14.567 9.529 ( 0.770 5.789 -0.233) 5.845 9.849 ( 2.212 -1.628 0.523) 2.796 10.370 ( -8.870 1.926 -3.093) 9.589 11.535 ( -3.881 6.822 1.632) 8.016 12.246 ( -11.557 2.148 8.710) 14.630 12.757 ( 0.775 1.230 -10.454) 10.555 13.644 ( 2.278 -5.283 0.811) 5.810 13.776 ( 7.064 2.571 -2.656) 7.973 14.223 ( 0.461 -3.384 1.411) 3.695 16.427 ( 2.268 8.970 1.758) 9.418 16.902 ( 0.281 5.093 -0.763) 5.158 17.615 ( -10.137 8.306 -3.707) 13.620 18.412 ( -20.394 5.447 12.039) 24.300 19.718 ( 17.292 -18.054 -6.689) 25.879 22.556 ( 0.752 1.303 -3.497) 3.806 ======================= Grid point 644 (314/336) ======================= q-point: (-0.27 0.09 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.583 ( 6.712 -2.471 7.361) 10.264 2.521 ( -6.637 11.111 -0.068) 12.942 3.027 ( -13.103 11.331 10.205) 20.105 3.096 ( -3.936 1.900 0.260) 4.378 4.120 ( -2.190 5.818 -6.873) 9.267 4.429 ( 9.261 0.084 8.719) 12.720 5.047 ( 9.440 -6.558 3.758) 12.093 5.168 ( 1.477 -5.093 1.410) 5.487 5.436 ( 1.561 -8.358 4.447) 9.595 5.993 ( -6.256 -0.472 -2.320) 6.689 6.298 ( 8.620 -8.760 1.920) 12.439 6.502 ( 7.345 -12.184 1.191) 14.276 6.679 ( 8.847 -0.173 -4.188) 9.789 6.917 ( -3.662 6.699 0.647) 7.662 7.015 ( 6.450 -2.274 3.037) 7.483 7.605 ( -0.771 -2.074 -2.492) 3.333 7.952 ( -7.245 -8.553 -2.174) 11.418 7.954 ( -0.266 -4.282 -4.513) 6.227 8.281 ( 2.884 2.879 4.287) 5.915 8.715 ( 1.431 3.923 -1.896) 4.586 9.149 ( 8.776 -0.847 12.403) 15.217 9.468 ( -0.596 6.316 -0.500) 6.364 9.904 ( 2.416 -0.911 -1.152) 2.828 10.132 ( -14.076 2.373 -4.876) 15.085 11.423 ( -2.342 7.921 1.518) 8.399 11.990 ( -15.092 13.337 2.775) 20.331 12.768 ( 4.737 -3.811 -5.894) 8.468 13.720 ( 0.772 -4.328 0.444) 4.419 13.835 ( 4.458 2.142 -2.088) 5.369 14.316 ( 3.759 -7.402 2.122) 8.568 16.407 ( 5.543 9.133 0.749) 10.710 16.886 ( 4.060 6.373 2.708) 8.027 17.313 ( -12.647 11.305 -4.685) 17.598 18.027 ( -25.413 7.079 6.021) 27.059 20.161 ( 16.735 -20.511 -2.121) 26.556 22.541 ( 1.160 0.580 -3.278) 3.526 ======================= Grid point 645 (315/336) ======================= q-point: (-0.18 0.09 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.762 ( 8.690 0.660 7.060) 11.216 2.302 ( -4.305 15.593 -0.194) 16.178 2.574 ( -20.884 13.698 -0.911) 24.992 3.176 ( 2.088 -2.703 4.478) 5.632 3.980 ( -2.085 7.008 -4.889) 8.795 4.627 ( 6.890 -2.276 7.027) 10.101 5.172 ( -0.948 -6.120 1.585) 6.392 5.320 ( 7.660 -3.569 2.138) 8.717 5.532 ( 0.858 -1.733 3.187) 3.728 5.906 ( -5.053 -7.463 -3.922) 9.829 6.530 ( 6.749 -9.396 4.368) 12.366 6.632 ( 5.330 2.550 -5.285) 7.928 6.772 ( -5.518 6.146 1.993) 8.497 6.842 ( 5.868 -9.639 -1.559) 11.392 7.256 ( 12.044 -5.886 5.329) 14.426 7.590 ( -3.937 -6.290 -3.785) 8.330 7.888 ( -6.239 -5.987 -2.591) 9.027 7.950 ( -1.770 -2.797 -2.890) 4.394 8.371 ( 5.780 -0.498 4.414) 7.290 8.702 ( 3.010 5.463 0.291) 6.244 9.303 ( 1.805 3.559 6.216) 7.387 9.420 ( 0.860 0.906 0.312) 1.287 9.792 ( -10.584 5.468 -4.761) 12.829 9.989 ( 0.103 -1.568 -0.318) 1.604 11.334 ( 1.575 11.210 0.195) 11.322 11.606 ( -14.156 15.633 -0.395) 21.093 12.869 ( 3.852 -6.079 -1.969) 7.461 13.753 ( -0.343 -2.192 -0.020) 2.219 13.854 ( 1.813 1.987 -1.078) 2.898 14.485 ( 4.267 -10.291 1.538) 11.246 16.455 ( 10.208 8.610 1.102) 13.400 16.904 ( -7.506 7.351 0.374) 10.513 17.008 ( 2.807 10.662 -0.233) 11.028 17.581 ( -23.663 6.834 1.076) 24.654 20.563 ( 10.128 -18.855 -0.420) 21.407 22.542 ( 1.040 -0.148 -1.888) 2.161 ======================= Grid point 646 (316/336) ======================= q-point: (-0.09 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 308 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.875 ( 0.000 2.424 0.000) 2.424 2.095 ( -0.000 18.942 0.000) 18.942 2.262 ( -0.000 5.230 0.000) 5.230 3.235 ( 0.000 -2.869 0.000) 2.869 3.885 ( 0.000 5.864 0.000) 5.864 4.737 ( 0.000 -2.661 0.000) 2.661 5.227 ( 0.000 -7.635 0.000) 7.635 5.414 ( 0.000 -0.900 0.000) 0.900 5.523 ( -0.000 5.605 -0.000) 5.605 5.958 ( 0.000 -13.672 0.000) 13.672 6.609 ( 0.000 11.220 -0.000) 11.220 6.647 ( -0.000 0.262 0.000) 0.262 6.727 ( 0.000 -8.400 0.000) 8.400 6.968 ( -0.000 -7.290 -0.000) 7.290 7.457 ( -0.000 -0.423 0.000) 0.423 7.598 ( 0.000 -13.992 0.000) 13.992 7.870 ( 0.000 -3.480 0.000) 3.480 7.929 ( 0.000 0.163 0.000) 0.163 8.469 ( 0.000 -3.699 0.000) 3.699 8.689 ( 0.000 5.663 0.000) 5.663 9.262 ( -0.000 6.754 0.000) 6.754 9.432 ( 0.000 -3.647 0.000) 3.647 9.637 ( 0.000 6.489 0.000) 6.489 10.005 ( 0.000 -0.234 0.000) 0.234 11.212 ( -0.000 17.613 0.000) 17.613 11.378 ( 0.000 4.419 0.000) 4.419 12.952 ( 0.000 -5.315 0.000) 5.315 13.762 ( 0.000 -0.957 0.000) 0.957 13.849 ( 0.000 1.447 0.000) 1.447 14.623 ( 0.000 -9.002 0.000) 9.002 16.576 ( -0.000 5.144 0.000) 5.144 16.593 ( 0.000 10.360 0.000) 10.360 17.133 ( -0.000 4.964 0.000) 4.964 17.215 ( 0.000 5.481 0.000) 5.481 20.802 ( 0.000 -13.874 0.000) 13.874 22.548 ( 0.000 -0.323 0.000) 0.323 ======================= Grid point 650 (317/336) ======================= q-point: ( 0.18 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.919 ( -5.071 0.000 9.241) 10.541 2.541 ( 16.517 -0.000 -8.260) 18.467 2.727 ( -0.295 0.000 -20.296) 20.298 3.400 ( 11.870 -0.000 2.761) 12.187 3.929 ( -10.058 0.000 -8.592) 13.228 4.195 ( 1.684 -0.000 10.139) 10.278 4.738 ( -11.969 0.000 -0.865) 12.000 5.262 ( 0.579 -0.000 -8.318) 8.338 5.302 ( -1.406 0.000 -11.600) 11.685 6.206 ( -18.055 0.000 0.292) 18.057 6.228 ( -6.978 0.000 2.196) 7.316 6.270 ( -13.148 0.000 3.733) 13.667 6.676 ( 8.243 -0.000 -4.779) 9.528 6.803 ( -1.830 0.000 6.687) 6.933 6.910 ( 5.688 -0.000 1.412) 5.861 7.425 ( -0.376 0.000 0.064) 0.381 7.942 ( 1.103 -0.000 -4.902) 5.025 8.221 ( -3.857 0.000 4.543) 5.960 8.479 ( -1.001 0.000 4.332) 4.446 8.666 ( -10.516 0.000 -12.490) 16.327 8.696 ( 6.724 -0.000 2.762) 7.269 9.399 ( 3.535 -0.000 0.818) 3.628 9.840 ( -1.438 0.000 -0.630) 1.569 10.424 ( 5.397 -0.000 -0.653) 5.437 11.755 ( 10.607 -0.000 2.242) 10.842 12.202 ( 15.403 -0.000 -0.369) 15.408 12.664 ( -8.417 0.000 6.364) 10.552 13.601 ( -7.014 0.000 0.507) 7.032 13.902 ( 1.918 -0.000 0.584) 2.004 14.121 ( -6.209 0.000 -2.226) 6.596 16.261 ( 3.821 -0.000 7.010) 7.983 16.792 ( 2.037 -0.000 5.620) 5.978 17.720 ( 21.712 -0.000 -6.734) 22.732 18.431 ( 11.402 -0.000 -15.382) 19.147 19.847 ( -22.829 0.000 7.393) 23.996 22.533 ( -0.616 0.000 5.268) 5.304 ======================= Grid point 651 (318/336) ======================= q-point: ( 0.27 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.778 ( -12.155 8.831 7.656) 16.863 2.632 ( 6.119 3.940 -11.993) 14.028 2.797 ( 12.265 -9.215 -8.071) 17.335 3.544 ( 2.387 -2.012 -0.743) 3.209 3.792 ( -0.857 2.170 0.741) 2.448 4.263 ( -1.172 -1.728 8.358) 8.615 4.570 ( -9.520 -1.521 1.522) 9.760 5.158 ( -3.544 3.185 -11.407) 12.362 5.247 ( 0.348 -3.399 -11.056) 11.572 5.886 ( -13.902 0.873 -6.717) 15.465 6.144 ( -8.615 1.218 8.418) 12.106 6.167 ( -5.140 -1.111 7.567) 9.215 6.631 ( 0.613 8.183 -5.707) 9.995 6.917 ( 9.445 3.364 4.178) 10.862 7.067 ( 4.790 -9.487 1.893) 10.795 7.471 ( 2.562 -2.679 2.516) 4.480 7.947 ( 2.811 0.516 -5.151) 5.890 8.115 ( -10.951 -0.653 0.439) 10.979 8.406 ( -3.383 7.860 -0.436) 8.568 8.563 ( -2.120 -7.202 -0.706) 7.541 8.790 ( 4.978 2.791 0.513) 5.730 9.466 ( 4.033 -0.279 0.935) 4.149 9.819 ( -0.838 0.028 -0.708) 1.097 10.480 ( 2.484 -0.521 -1.399) 2.898 11.882 ( 8.373 7.505 0.799) 11.273 12.380 ( 3.469 -3.644 -1.771) 5.334 12.602 ( -6.456 -5.478 7.988) 11.640 13.515 ( -3.066 -0.039 -0.409) 3.093 13.889 ( 0.546 6.742 -0.002) 6.764 14.081 ( -1.668 -5.017 0.138) 5.289 16.393 ( 6.317 0.673 8.752) 10.815 16.871 ( 1.630 -2.016 6.611) 7.101 18.001 ( 19.325 1.252 -9.904) 21.751 18.407 ( -1.857 -2.117 -16.906) 17.139 19.588 ( -15.248 1.695 10.362) 18.513 22.564 ( 0.628 -0.051 4.123) 4.171 ======================= Grid point 652 (319/336) ======================= q-point: ( 0.36 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.529 ( -10.136 9.875 3.987) 14.702 2.670 ( 7.960 4.123 -1.016) 9.022 3.004 ( 7.579 -6.002 -3.160) 10.171 3.525 ( -3.632 -4.181 -3.171) 6.381 3.858 ( 7.352 5.359 8.427) 12.401 4.302 ( -1.528 -3.301 5.525) 6.615 4.494 ( -5.306 -4.697 3.671) 7.980 4.988 ( -6.381 -0.582 -11.034) 12.760 5.216 ( -0.023 -2.570 -9.889) 10.218 5.696 ( -5.001 -1.647 -6.680) 8.505 6.071 ( -5.529 -0.105 7.290) 9.150 6.192 ( -0.380 -1.733 10.004) 10.160 6.541 ( 2.397 10.059 -3.471) 10.908 7.027 ( 7.672 6.424 0.547) 10.021 7.231 ( 2.593 -9.623 1.293) 10.050 7.534 ( -0.531 -2.260 -0.106) 2.324 7.930 ( -3.385 -1.047 -2.774) 4.500 7.964 ( -5.107 -2.510 -3.408) 6.633 8.315 ( -0.184 7.371 3.282) 8.070 8.617 ( -0.109 -6.170 2.550) 6.677 8.820 ( 3.922 4.777 -0.850) 6.239 9.542 ( 4.777 0.677 0.865) 4.901 9.801 ( -1.171 -0.245 -0.317) 1.237 10.506 ( 1.130 -0.266 -0.629) 1.321 11.896 ( 4.518 12.158 0.801) 12.995 12.366 ( -6.205 -2.084 1.372) 6.688 12.650 ( -4.454 -12.885 3.792) 14.150 13.507 ( 2.537 0.494 -1.344) 2.913 13.830 ( 1.291 7.395 -0.625) 7.532 14.117 ( -0.796 -4.793 0.803) 4.925 16.532 ( 6.353 4.434 9.432) 12.206 16.946 ( 0.231 -3.163 3.889) 5.019 18.100 ( 1.522 6.115 -10.038) 11.852 18.368 ( 6.763 -6.959 -8.689) 13.026 19.421 ( -11.364 0.539 5.795) 12.767 22.594 ( 0.929 0.457 1.792) 2.070 ======================= Grid point 653 (320/336) ======================= q-point: (-0.55 0.18 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.376 ( -0.849 6.563 2.978) 7.257 2.768 ( 6.712 5.549 6.473) 10.851 3.085 ( -0.071 1.695 3.659) 4.033 3.515 ( -2.131 -6.448 -2.999) 7.423 3.998 ( 9.933 6.306 10.385) 15.694 4.358 ( 0.416 -4.728 3.303) 5.782 4.513 ( -1.264 -5.036 1.686) 5.459 4.883 ( -3.218 -8.454 -7.313) 11.632 5.179 ( -0.420 -1.363 -5.958) 6.127 5.677 ( 3.213 -5.136 -5.143) 7.947 6.058 ( -2.620 -2.748 5.658) 6.814 6.277 ( 0.153 -1.715 8.455) 8.629 6.482 ( 4.222 9.989 -0.206) 10.846 7.051 ( 4.676 7.927 -1.896) 9.397 7.290 ( -5.142 -2.392 0.544) 5.697 7.514 ( -1.081 -5.111 -4.181) 6.691 7.891 ( -4.986 -5.813 1.472) 7.798 7.909 ( -1.211 -1.206 -7.441) 7.635 8.294 ( 1.461 5.446 5.343) 7.768 8.706 ( 1.563 -5.415 4.031) 6.929 8.837 ( 5.416 6.091 0.903) 8.201 9.607 ( 4.339 2.328 -0.018) 4.924 9.787 ( -1.139 -1.256 0.579) 1.792 10.501 ( -1.546 0.744 -0.932) 1.952 11.824 ( 0.189 12.365 1.836) 12.502 12.286 ( -8.073 -2.816 5.495) 10.164 12.719 ( -2.156 -10.722 -1.423) 11.029 13.547 ( 3.686 0.880 -1.709) 4.157 13.798 ( 3.367 5.083 -1.950) 6.402 14.143 ( -1.459 -3.635 0.759) 3.990 16.609 ( 4.054 8.535 7.959) 12.354 16.978 ( -0.149 -1.114 0.461) 1.215 17.953 ( -4.601 6.471 -3.816) 8.809 18.529 ( 4.526 -4.975 1.306) 6.852 19.290 ( -6.070 -4.908 -3.995) 8.769 22.601 ( 0.426 1.134 -0.789) 1.446 ======================= Grid point 654 (321/336) ======================= q-point: (-0.45 0.18 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.417 ( 8.256 3.491 4.546) 10.051 2.817 ( 1.689 7.745 4.042) 8.898 3.064 ( -2.052 4.381 10.231) 11.317 3.482 ( -6.220 -0.488 -1.257) 6.365 4.169 ( 8.783 3.899 8.036) 12.527 4.386 ( -1.804 0.451 1.234) 2.232 4.613 ( 7.548 -10.392 -2.900) 13.167 4.965 ( 2.233 -11.786 -0.056) 11.995 5.170 ( 0.161 -1.898 -0.159) 1.911 5.828 ( 9.272 -8.940 -1.890) 13.018 6.107 ( -0.149 -6.333 4.396) 7.710 6.258 ( -4.228 4.343 1.269) 6.192 6.534 ( 7.692 2.873 3.798) 9.046 7.024 ( 2.152 6.786 -0.474) 7.135 7.165 ( -7.265 2.104 -2.388) 7.932 7.541 ( -1.565 -6.221 -2.674) 6.950 7.851 ( -3.586 -4.204 -5.521) 7.811 7.885 ( -1.816 -4.528 -2.480) 5.473 8.309 ( 1.380 3.420 4.521) 5.835 8.771 ( 1.308 -0.140 0.376) 1.368 8.942 ( 9.083 2.567 9.101) 13.112 9.619 ( 0.723 3.652 -0.554) 3.764 9.808 ( 1.172 -2.588 0.376) 2.865 10.407 ( -7.481 2.043 -3.422) 8.476 11.707 ( -2.491 10.771 3.124) 11.488 12.245 ( -5.120 -1.050 8.772) 10.211 12.746 ( -0.063 -3.538 -6.499) 7.400 13.584 ( 2.298 -0.838 -0.567) 2.511 13.822 ( 5.292 2.040 -3.167) 6.496 14.152 ( -2.036 -3.774 0.762) 4.355 16.606 ( 2.504 9.757 3.941) 10.817 16.988 ( 2.194 3.793 2.919) 5.265 17.783 ( -5.215 9.393 -4.061) 11.486 18.495 ( -15.080 3.043 9.321) 17.988 19.375 ( 9.363 -17.676 -9.299) 22.059 22.581 ( -0.022 1.308 -2.531) 2.850 ======================= Grid point 655 (322/336) ======================= q-point: (-0.36 0.18 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.595 ( 12.639 3.222 6.297) 14.483 2.719 ( -3.816 10.566 0.905) 11.271 3.087 ( 0.561 1.913 9.110) 9.325 3.281 ( -13.063 9.836 0.513) 16.360 4.207 ( -1.436 3.235 -3.971) 5.320 4.437 ( 6.595 0.296 6.530) 9.286 4.879 ( 11.993 -11.696 0.250) 16.754 5.084 ( 1.331 -4.373 0.258) 4.578 5.241 ( 0.656 -8.924 4.903) 10.203 6.031 ( -0.187 -1.515 4.853) 5.088 6.157 ( 3.229 -1.851 -4.815) 6.086 6.256 ( 5.498 -12.615 1.522) 13.844 6.668 ( 6.926 -0.769 1.281) 7.086 7.016 ( 2.247 2.783 4.030) 5.388 7.024 ( -4.681 3.885 -2.709) 6.660 7.533 ( -3.728 -5.611 -3.466) 7.575 7.796 ( -6.362 -6.898 -3.654) 10.070 7.900 ( 1.588 -2.484 -3.410) 4.507 8.327 ( 1.343 1.769 2.848) 3.612 8.786 ( 3.012 4.074 0.958) 5.157 9.144 ( 8.820 0.063 11.148) 14.215 9.569 ( -1.597 4.224 -0.417) 4.535 9.861 ( 1.693 -3.564 -1.270) 4.145 10.184 ( -13.149 3.125 -5.748) 14.686 11.599 ( -1.141 9.948 3.495) 10.606 12.197 ( -5.318 8.266 7.946) 12.639 12.723 ( 1.836 -0.897 -8.420) 8.664 13.640 ( 1.767 -3.675 0.667) 4.132 13.872 ( 4.509 1.238 -2.996) 5.553 14.176 ( -1.057 -6.892 1.057) 7.052 16.587 ( 5.036 9.491 1.840) 10.901 17.019 ( 4.913 7.608 6.362) 11.068 17.545 ( -7.198 13.081 -6.920) 16.457 18.166 ( -23.167 7.501 5.878) 25.050 19.731 ( 12.818 -24.643 -4.425) 28.128 22.554 ( 0.072 0.750 -2.797) 2.896 ======================= Grid point 656 (323/336) ======================= q-point: (-0.27 0.18 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.809 ( 12.538 3.906 5.863) 14.381 2.545 ( -4.435 11.518 0.032) 12.342 2.906 ( -14.669 18.816 -1.307) 23.894 3.141 ( 0.749 -0.420 5.330) 5.399 4.105 ( -1.801 5.446 -4.186) 7.101 4.590 ( 5.705 -1.751 5.453) 8.084 5.098 ( -0.061 -1.233 1.279) 1.778 5.190 ( 9.744 -11.315 0.146) 14.933 5.367 ( -1.233 -11.624 3.475) 12.195 5.918 ( -5.111 6.176 -0.225) 8.020 6.318 ( 3.914 -12.729 1.000) 13.354 6.526 ( 10.415 -12.074 -1.136) 15.986 6.738 ( -0.091 -1.465 -0.059) 1.469 6.906 ( -2.223 6.185 -2.439) 7.011 7.134 ( 6.388 -5.233 7.064) 10.867 7.492 ( -4.010 -4.448 -4.795) 7.672 7.742 ( -6.321 -8.416 -2.430) 10.802 7.926 ( 1.429 -0.658 -1.770) 2.368 8.360 ( 1.649 -0.739 1.670) 2.460 8.811 ( 4.637 6.269 2.411) 8.162 9.320 ( 4.538 -0.417 7.585) 8.849 9.491 ( -2.126 4.846 -1.196) 5.425 9.891 ( -4.036 2.906 -4.699) 6.842 9.925 ( -6.073 -3.112 -1.412) 6.968 11.529 ( 1.574 9.448 2.356) 9.864 11.975 ( -7.478 21.677 1.622) 22.988 12.756 ( 2.652 -5.334 -3.546) 6.932 13.699 ( 0.715 -3.414 0.429) 3.514 13.895 ( 1.945 1.977 -1.562) 3.183 14.272 ( 0.992 -11.666 1.001) 11.751 16.627 ( 9.199 8.964 2.082) 13.012 17.055 ( 0.569 9.009 4.994) 10.317 17.263 ( -1.192 15.599 -5.701) 16.651 17.735 ( -22.384 9.352 1.591) 24.311 20.132 ( 8.296 -26.304 -1.233) 27.609 22.540 ( 0.321 -0.062 -1.735) 1.766 ======================= Grid point 657 (324/336) ======================= q-point: (-0.18 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 308 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.925 ( -0.000 3.200 0.000) 3.200 2.402 ( -0.000 9.392 -0.000) 9.392 2.535 ( 0.000 25.424 0.000) 25.424 3.179 ( 0.000 -2.499 0.000) 2.499 4.016 ( 0.000 7.150 0.000) 7.150 4.683 ( 0.000 -2.819 0.000) 2.819 5.113 ( 0.000 -3.857 0.000) 3.857 5.368 ( 0.000 -4.195 0.000) 4.195 5.477 ( 0.000 -13.263 0.000) 13.263 5.822 ( 0.000 2.636 0.000) 2.636 6.488 ( 0.000 -14.012 0.000) 14.012 6.684 ( 0.000 1.019 -0.000) 1.019 6.767 ( -0.000 -7.013 0.000) 7.013 6.818 ( 0.000 3.735 0.000) 3.735 7.330 ( -0.000 -12.976 0.000) 12.976 7.443 ( 0.000 -0.867 0.000) 0.867 7.754 ( 0.000 -8.249 0.000) 8.249 7.933 ( 0.000 0.239 0.000) 0.239 8.402 ( 0.000 -3.047 0.000) 3.047 8.809 ( 0.000 6.838 0.000) 6.838 9.382 ( 0.000 -1.731 0.000) 1.731 9.401 ( 0.000 7.174 0.000) 7.174 9.756 ( 0.000 5.963 0.000) 5.963 9.958 ( 0.000 -4.826 -0.000) 4.826 11.489 ( 0.000 7.043 0.000) 7.043 11.653 ( -0.000 27.440 -0.000) 27.440 12.831 ( 0.000 -6.956 0.000) 6.956 13.731 ( 0.000 -2.337 0.000) 2.337 13.885 ( 0.000 2.172 0.000) 2.172 14.408 ( 0.000 -13.105 0.000) 13.105 16.693 ( 0.000 6.596 0.000) 6.596 16.843 ( -0.000 15.348 -0.000) 15.348 17.278 ( -0.000 10.625 0.000) 10.625 17.355 ( 0.000 9.032 0.000) 9.032 20.438 ( 0.000 -24.146 0.000) 24.146 22.541 ( 0.000 -0.426 0.000) 0.426 ======================= Grid point 663 (325/336) ======================= q-point: ( 0.27 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.636 ( -13.171 0.000 5.116) 14.130 2.739 ( 8.809 -0.000 -0.132) 8.810 2.908 ( 12.330 -0.000 -7.050) 14.203 3.483 ( -5.207 0.000 -1.986) 5.573 3.920 ( 9.009 -0.000 8.816) 12.604 4.269 ( -2.360 0.000 6.360) 6.783 4.438 ( -7.345 0.000 3.660) 8.206 4.984 ( -8.697 0.000 -13.757) 16.276 5.191 ( 1.389 -0.000 -9.342) 9.445 5.681 ( -5.847 0.000 -7.782) 9.734 6.069 ( -6.895 0.000 7.313) 10.051 6.174 ( -0.849 0.000 11.412) 11.444 6.666 ( 2.759 -0.000 -5.376) 6.042 7.096 ( 8.183 -0.000 0.723) 8.215 7.106 ( 4.263 -0.000 1.800) 4.628 7.511 ( 0.330 -0.000 2.073) 2.099 7.909 ( -11.515 0.000 -0.101) 11.516 7.951 ( 1.441 -0.000 -7.094) 7.239 8.454 ( -2.796 0.000 3.290) 4.317 8.483 ( 2.083 -0.000 1.618) 2.637 8.876 ( 3.558 -0.000 0.261) 3.568 9.546 ( 5.295 -0.000 0.676) 5.338 9.798 ( -1.356 0.000 -0.556) 1.465 10.503 ( 1.627 -0.000 -0.707) 1.774 12.064 ( 8.883 -0.000 -0.576) 8.902 12.321 ( -8.135 0.000 2.224) 8.433 12.499 ( -6.690 0.000 5.107) 8.417 13.511 ( 2.833 -0.000 -1.456) 3.185 13.927 ( -0.728 0.000 -0.371) 0.817 14.045 ( 0.531 -0.000 0.853) 1.005 16.582 ( 8.394 -0.000 11.675) 14.380 16.908 ( -0.413 0.000 4.430) 4.449 18.220 ( -7.801 0.000 -8.551) 11.575 18.238 ( 17.832 -0.000 -14.644) 23.075 19.428 ( -13.376 0.000 7.451) 15.312 22.599 ( 1.055 -0.000 2.298) 2.528 ======================= Grid point 664 (326/336) ======================= q-point: ( 0.36 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.492 ( -3.720 4.124 3.351) 6.487 2.887 ( 9.304 6.143 7.811) 13.613 3.074 ( 8.063 -2.886 -1.380) 8.675 3.396 ( -5.837 -4.252 -1.111) 7.307 4.128 ( 11.554 6.274 11.160) 17.245 4.277 ( -1.039 -2.707 3.185) 4.307 4.410 ( -2.591 -5.446 6.427) 8.814 4.766 ( -8.699 -3.237 -12.369) 15.465 5.171 ( 2.329 -0.013 -6.882) 7.266 5.610 ( 1.546 -1.922 -7.226) 7.636 6.017 ( -4.669 -1.232 4.402) 6.535 6.258 ( 1.081 -0.487 12.320) 12.377 6.661 ( 4.223 7.041 -2.939) 8.720 7.163 ( 0.949 1.116 0.158) 1.473 7.200 ( 2.486 -2.612 0.802) 3.694 7.466 ( -4.194 -0.788 -4.419) 6.143 7.800 ( -5.204 -2.861 3.301) 6.794 7.901 ( -1.559 -0.188 -9.119) 9.253 8.399 ( -1.263 4.636 2.883) 5.603 8.603 ( 4.746 -4.526 6.011) 8.896 8.922 ( 3.674 2.496 1.332) 4.637 9.632 ( 5.012 0.504 -0.257) 5.044 9.769 ( -2.112 -0.511 0.030) 2.173 10.512 ( -0.504 0.314 -0.941) 1.113 12.072 ( -2.793 12.666 2.390) 13.188 12.237 ( -3.262 -2.907 3.060) 5.334 12.498 ( -1.961 -10.472 2.338) 10.908 13.563 ( 4.643 0.583 -2.345) 5.234 13.882 ( -1.267 3.094 -1.219) 3.559 14.079 ( 0.533 -2.534 0.419) 2.623 16.762 ( 6.744 6.895 11.531) 15.033 16.923 ( -0.468 -4.142 2.020) 4.632 18.066 ( -5.230 4.526 1.138) 7.009 18.422 ( 12.571 -4.741 -14.440) 19.724 19.239 ( -13.725 -1.075 1.734) 13.876 22.616 ( 0.359 0.445 -0.014) 0.571 ======================= Grid point 665 (327/336) ======================= q-point: (-0.55 0.27 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.508 ( 8.249 4.907 3.486) 10.212 2.981 ( 5.446 9.632 5.227) 12.237 3.141 ( -1.213 3.490 8.105) 8.908 3.395 ( -1.814 -8.088 -1.194) 8.375 4.255 ( 3.937 3.940 6.224) 8.352 4.362 ( 1.806 -1.703 7.628) 8.022 4.468 ( 3.492 -3.664 -5.073) 7.166 4.725 ( 1.739 -12.614 0.343) 12.738 5.181 ( 3.303 1.717 -2.676) 4.585 5.683 ( 7.634 -6.075 -5.301) 11.103 5.999 ( -3.126 -4.311 2.402) 5.842 6.325 ( -0.914 2.029 7.505) 7.828 6.651 ( 4.582 8.452 2.452) 9.922 7.118 ( -5.920 0.247 2.978) 6.631 7.190 ( -1.774 3.006 -3.570) 4.993 7.421 ( -1.652 -5.494 -4.994) 7.606 7.787 ( -3.058 -2.520 -1.212) 4.144 7.818 ( -1.494 -2.594 -6.936) 7.554 8.364 ( -1.048 2.117 1.814) 2.978 8.767 ( 6.608 0.041 7.805) 10.227 8.987 ( 5.590 1.795 4.670) 7.502 9.666 ( 0.321 1.445 -1.421) 2.052 9.762 ( 0.035 -2.104 0.100) 2.106 10.441 ( -6.334 1.424 -3.445) 7.350 11.895 ( -7.774 7.770 4.872) 12.023 12.257 ( 2.815 3.840 5.730) 7.450 12.617 ( 2.857 -9.672 -1.313) 10.170 13.600 ( 2.747 1.886 -2.115) 3.947 13.840 ( -0.138 -0.141 -2.501) 2.509 14.098 ( -0.796 -1.685 -0.201) 1.875 16.773 ( 0.854 7.422 2.188) 7.785 17.034 ( 5.607 1.072 9.801) 11.342 17.954 ( -3.867 8.273 2.159) 9.384 18.511 ( -1.749 -1.541 -4.091) 4.709 19.100 ( -4.133 -10.555 -7.000) 13.323 22.602 ( -0.619 0.823 -1.830) 2.100 ======================= Grid point 666 (328/336) ======================= q-point: (-0.45 0.27 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.679 ( 14.712 4.985 4.127) 16.073 2.918 ( -3.232 10.294 1.691) 10.921 3.145 ( 0.312 4.149 7.948) 8.971 3.386 ( -5.091 1.156 1.377) 5.399 4.243 ( -3.802 0.861 -1.706) 4.256 4.424 ( 4.082 -1.949 3.895) 5.969 4.649 ( 9.838 -11.050 -2.084) 14.941 4.947 ( 7.107 -8.440 6.882) 13.004 5.202 ( 2.275 2.927 1.199) 3.896 5.878 ( 7.874 -9.977 -2.165) 12.893 6.051 ( 2.335 -8.784 1.444) 9.203 6.255 ( -4.372 6.958 -0.289) 8.223 6.689 ( 2.898 3.709 6.805) 8.274 7.051 ( -4.930 -1.140 4.885) 7.033 7.096 ( -0.827 5.042 -5.287) 7.353 7.410 ( -3.677 -6.854 -3.943) 8.721 7.702 ( -5.553 -3.210 -6.257) 8.961 7.853 ( 3.111 -2.584 -1.882) 4.461 8.346 ( -0.584 0.399 0.632) 0.949 8.878 ( 5.823 5.635 5.425) 9.751 9.139 ( 7.708 -0.927 9.402) 12.193 9.623 ( -2.315 1.622 -0.632) 2.897 9.786 ( -0.215 -3.860 -2.385) 4.543 10.239 ( -12.128 2.562 -5.986) 13.765 11.761 ( -4.201 6.677 4.828) 9.249 12.321 ( 4.858 6.249 8.643) 11.719 12.706 ( 2.824 -2.116 -5.661) 6.671 13.603 ( 0.802 0.153 -0.480) 0.947 13.855 ( 1.527 -3.507 -3.067) 4.903 14.089 ( -1.968 -2.004 -0.300) 2.825 16.742 ( 3.413 6.686 0.438) 7.520 17.159 ( 6.259 6.929 11.915) 15.138 17.787 ( -4.778 12.234 -3.096) 13.494 18.302 ( -16.936 7.072 0.811) 18.371 19.269 ( 7.511 -23.819 -7.074) 25.958 22.567 ( -0.912 0.645 -2.387) 2.636 ======================= Grid point 667 (329/336) ======================= q-point: (-0.36 0.27 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.895 ( 13.606 4.965 3.683) 14.945 2.749 ( -6.153 9.780 0.820) 11.584 3.148 ( 1.304 5.226 -0.382) 5.400 3.229 ( -7.590 10.974 4.927) 14.224 4.165 ( -2.429 0.957 -3.025) 3.996 4.547 ( 4.129 -3.352 3.474) 6.352 4.910 ( 7.050 -16.467 -1.410) 17.968 5.117 ( 4.726 1.265 1.961) 5.270 5.220 ( -0.589 -2.100 4.749) 5.226 6.020 ( -1.133 -3.933 4.502) 6.084 6.117 ( -2.024 -0.495 -5.889) 6.247 6.285 ( 10.821 -12.672 -0.233) 16.665 6.716 ( -2.541 -0.550 3.940) 4.720 6.993 ( -1.212 3.250 -4.249) 5.485 7.086 ( 1.437 -0.832 6.347) 6.560 7.406 ( -0.614 -5.101 -2.699) 5.804 7.606 ( -7.077 -5.413 -4.639) 10.045 7.911 ( 2.574 -1.113 -1.207) 3.053 8.346 ( 0.132 -0.643 0.116) 0.667 8.937 ( 5.586 7.221 4.386) 10.128 9.312 ( 4.941 -0.475 7.347) 8.867 9.563 ( -2.117 2.598 -0.541) 3.395 9.798 ( -1.827 -6.523 -3.079) 7.441 9.984 ( -9.925 3.405 -5.046) 11.643 11.683 ( -1.004 6.765 2.883) 7.422 12.344 ( 2.492 16.234 7.167) 17.919 12.692 ( 0.836 -0.893 -6.773) 6.883 13.635 ( 0.940 -3.113 0.608) 3.308 13.900 ( 1.637 -2.901 -2.061) 3.917 14.090 ( -1.666 -6.054 0.175) 6.282 16.770 ( 6.696 6.103 0.881) 9.103 17.236 ( 3.288 9.848 9.559) 14.113 17.561 ( -1.223 15.444 -5.313) 16.378 17.924 ( -18.321 10.949 -0.743) 21.356 19.610 ( 6.083 -28.781 -2.581) 29.530 22.540 ( -0.440 0.052 -1.590) 1.650 ======================= Grid point 668 (330/336) ======================= q-point: (-0.27 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 308 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.996 ( 0.000 4.250 0.000) 4.250 2.593 ( -0.000 10.212 -0.000) 10.212 2.977 ( 0.000 20.596 -0.000) 20.596 3.164 ( -0.000 1.373 0.000) 1.373 4.117 ( -0.000 3.056 0.000) 3.056 4.629 ( 0.000 -3.279 0.000) 3.279 5.089 ( -0.000 -3.319 0.000) 3.319 5.171 ( 0.000 -12.169 0.000) 12.169 5.269 ( 0.000 -5.365 0.000) 5.365 5.946 ( -0.000 8.464 0.000) 8.464 6.211 ( 0.000 -15.021 0.000) 15.021 6.527 ( -0.000 -14.049 0.000) 14.049 6.689 ( -0.000 -0.517 0.000) 0.517 6.934 ( 0.000 4.569 0.000) 4.569 7.159 ( 0.000 -5.050 0.000) 5.050 7.432 ( -0.000 -0.268 0.000) 0.268 7.581 ( 0.000 -9.729 0.000) 9.729 7.934 ( 0.000 -0.251 0.000) 0.251 8.360 ( 0.000 -1.560 0.000) 1.560 8.942 ( -0.000 7.346 0.000) 7.346 9.366 ( 0.000 -0.022 0.000) 0.022 9.510 ( -0.000 4.239 0.000) 4.239 9.839 ( -0.000 -7.464 0.000) 7.464 9.851 ( 0.000 3.974 -0.000) 3.974 11.624 ( 0.000 6.955 0.000) 6.955 12.166 ( -0.000 25.935 -0.000) 25.935 12.714 ( 0.000 -5.098 0.000) 5.098 13.677 ( 0.000 -3.317 0.000) 3.317 13.918 ( 0.000 0.622 0.000) 0.622 14.165 ( -0.000 -11.716 0.000) 11.716 16.803 ( 0.000 4.986 0.000) 4.986 17.135 ( -0.000 15.056 -0.000) 15.056 17.530 ( 0.000 16.155 0.000) 16.155 17.535 ( -0.000 9.594 -0.000) 9.594 19.930 ( 0.000 -29.301 0.000) 29.301 22.534 ( 0.000 -0.326 0.000) 0.326 ======================= Grid point 676 (331/336) ======================= q-point: ( 0.36 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.560 ( 7.584 -0.000 3.031) 8.167 3.126 ( 6.271 -0.000 13.664) 15.035 3.187 ( 8.724 -0.000 -2.164) 8.988 3.250 ( -8.648 0.000 0.379) 8.656 4.265 ( -0.112 0.000 2.250) 2.253 4.380 ( -2.396 0.000 5.476) 5.977 4.477 ( 16.227 -0.000 13.030) 20.811 4.548 ( -5.306 0.000 -10.732) 11.972 5.202 ( 4.976 -0.000 -3.070) 5.847 5.621 ( 6.358 -0.000 -6.741) 9.267 5.958 ( -3.979 0.000 1.853) 4.389 6.342 ( 0.221 -0.000 10.028) 10.031 6.759 ( 4.985 -0.000 -0.009) 4.985 7.080 ( -10.691 0.000 6.042) 12.281 7.248 ( 2.962 -0.000 -3.758) 4.785 7.361 ( -4.050 0.000 -6.751) 7.873 7.762 ( -0.014 0.000 1.838) 1.838 7.793 ( -4.053 0.000 -9.835) 10.637 8.384 ( -2.572 0.000 0.057) 2.572 8.769 ( 9.609 -0.000 11.547) 15.023 9.004 ( 3.820 -0.000 2.841) 4.761 9.678 ( 0.009 -0.000 -1.891) 1.891 9.740 ( -0.271 0.000 0.001) 0.271 10.455 ( -5.950 0.000 -3.419) 6.862 11.964 ( -12.626 0.000 6.529) 14.214 12.381 ( 11.970 -0.000 -0.460) 11.978 12.441 ( 0.425 -0.000 4.399) 4.420 13.624 ( 4.165 -0.000 -2.788) 5.012 13.833 ( -4.504 0.000 -1.575) 4.771 14.085 ( 0.904 -0.000 -0.913) 1.285 16.851 ( -1.679 0.000 -1.995) 2.608 17.038 ( 8.867 -0.000 16.117) 18.395 18.047 ( -5.921 0.000 11.406) 12.851 18.477 ( 10.240 -0.000 -20.560) 22.969 19.002 ( -13.782 0.000 -1.805) 13.900 22.610 ( -0.842 0.000 -1.577) 1.788 ======================= Grid point 677 (332/336) ======================= q-point: (-0.55 0.36 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.754 ( 14.739 2.386 2.713) 15.175 3.075 ( -8.380 5.254 0.802) 9.923 3.235 ( 3.618 5.177 8.225) 10.370 3.342 ( 2.848 -4.761 2.420) 6.053 4.247 ( -5.887 -0.203 0.768) 5.940 4.370 ( 3.050 -2.647 -3.315) 5.224 4.514 ( 2.884 -3.215 0.265) 4.327 4.835 ( 14.851 -3.017 11.434) 18.983 5.270 ( 5.195 2.886 0.365) 5.954 5.726 ( 7.334 -5.080 -5.507) 10.485 5.937 ( -0.097 -3.171 1.168) 3.381 6.350 ( -3.204 2.620 2.502) 4.836 6.805 ( 0.734 7.689 7.092) 10.485 6.973 ( -7.765 -6.515 6.591) 12.090 7.193 ( -3.476 4.892 -6.387) 8.764 7.297 ( -1.136 -4.986 -5.241) 7.323 7.666 ( -5.128 -0.838 -8.068) 9.597 7.812 ( 4.045 -1.388 -0.289) 4.286 8.349 ( -1.288 0.007 -0.540) 1.396 8.982 ( 8.810 4.762 10.455) 14.478 9.104 ( 5.588 -2.583 6.224) 8.754 9.635 ( -3.000 -0.000 -0.845) 3.117 9.735 ( -0.962 -1.350 -3.376) 3.761 10.273 ( -12.049 0.906 -6.061) 13.518 11.838 ( -6.641 1.801 5.942) 9.091 12.455 ( 6.698 7.459 5.553) 11.461 12.624 ( 8.721 -6.016 -0.634) 10.613 13.642 ( 0.850 3.298 -1.952) 3.925 13.764 ( -3.688 -4.867 -2.185) 6.486 14.080 ( -0.421 0.220 -1.625) 1.693 16.827 ( 1.918 2.309 -1.317) 3.278 17.258 ( 7.426 2.980 15.809) 17.719 17.969 ( -8.524 5.867 8.944) 13.678 18.440 ( -1.229 7.217 -14.011) 15.809 18.884 ( -2.524 -15.144 -6.215) 16.564 22.576 ( -1.491 0.255 -2.160) 2.637 ======================= Grid point 678 (333/336) ======================= q-point: (-0.45 0.36 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.980 ( 13.647 3.704 2.074) 14.292 2.889 ( -8.670 4.977 0.550) 10.013 3.263 ( 2.774 6.920 3.363) 8.178 3.372 ( -1.612 3.715 2.468) 4.742 4.159 ( -3.633 -0.950 -2.215) 4.360 4.463 ( 3.500 -4.845 0.395) 5.990 4.638 ( 3.072 -11.325 0.256) 11.737 5.110 ( 9.610 0.090 6.893) 11.827 5.294 ( 2.068 6.235 1.311) 6.699 5.835 ( 0.824 -9.363 -1.272) 9.485 6.074 ( 8.301 -8.831 -0.658) 12.138 6.235 ( -4.422 6.264 -1.903) 7.901 6.738 ( -5.747 2.997 7.011) 9.548 7.021 ( -0.457 -1.409 1.532) 2.131 7.064 ( -2.926 -1.057 -0.188) 3.117 7.319 ( 2.736 -3.161 -3.425) 5.405 7.545 ( -6.411 -1.507 -5.496) 8.578 7.886 ( 3.341 -1.274 -0.648) 3.633 8.337 ( -0.045 -0.294 -0.469) 0.555 9.076 ( 5.486 7.244 5.454) 10.598 9.292 ( 6.491 -1.980 8.685) 11.022 9.589 ( -2.124 0.216 -0.307) 2.157 9.692 ( -3.527 -4.106 -5.307) 7.581 10.028 ( -10.673 1.364 -5.488) 12.079 11.776 ( -2.262 3.153 3.326) 5.111 12.545 ( 6.310 5.380 7.735) 11.340 12.731 ( 3.842 4.050 -4.940) 7.455 13.600 ( -1.167 -0.094 -0.188) 1.186 13.782 ( -0.840 -7.576 -1.811) 7.834 14.055 ( -0.953 0.375 -1.125) 1.521 16.854 ( 4.488 2.866 -0.314) 5.334 17.397 ( 4.450 6.617 11.622) 14.094 17.798 ( -6.651 8.743 2.723) 11.318 18.169 ( -7.678 15.976 -8.089) 19.484 19.083 ( 3.215 -26.740 -3.979) 27.225 22.541 ( -1.012 0.072 -1.496) 1.807 ======================= Grid point 679 (334/336) ======================= q-point: (-0.36 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 308 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.078 ( 0.000 4.261 0.000) 4.261 2.754 ( -0.000 6.494 0.000) 6.494 3.239 ( 0.000 6.263 -0.000) 6.263 3.278 ( -0.000 11.288 0.000) 11.288 4.132 ( -0.000 -0.854 0.000) 0.854 4.546 ( 0.000 -5.465 0.000) 5.465 4.801 ( -0.000 -16.266 0.000) 16.266 5.210 ( 0.000 -0.305 0.000) 0.305 5.237 ( -0.000 7.921 0.000) 7.921 5.946 ( -0.000 -12.794 0.000) 12.794 6.105 ( -0.000 7.653 0.000) 7.653 6.274 ( -0.000 -12.124 0.000) 12.124 6.686 ( -0.000 0.811 0.000) 0.811 6.982 ( 0.000 0.803 -0.000) 0.803 7.105 ( 0.000 -2.323 0.000) 2.323 7.418 ( 0.000 -6.738 0.000) 6.738 7.434 ( -0.000 0.431 -0.000) 0.431 7.922 ( 0.000 -0.917 0.000) 0.917 8.341 ( 0.000 -0.565 0.000) 0.565 9.081 ( -0.000 7.328 0.000) 7.328 9.377 ( 0.000 1.053 0.000) 1.053 9.561 ( -0.000 1.365 0.000) 1.365 9.694 ( 0.000 -7.556 0.000) 7.556 9.903 ( -0.000 1.619 0.000) 1.619 11.734 ( 0.000 4.551 0.000) 4.551 12.587 ( -0.000 18.441 -0.000) 18.441 12.648 ( 0.000 -1.961 0.000) 1.961 13.614 ( 0.000 -3.110 0.000) 3.110 13.847 ( 0.000 -8.202 0.000) 8.202 14.043 ( -0.000 -1.008 0.000) 1.008 16.876 ( 0.000 2.833 0.000) 2.833 17.382 ( -0.000 10.791 -0.000) 10.791 17.696 ( 0.000 7.162 0.000) 7.162 17.874 ( -0.000 20.354 0.000) 20.354 19.371 ( -0.000 -29.766 0.000) 29.766 22.529 ( 0.000 -0.172 0.000) 0.172 ======================= Grid point 689 (335/336) ======================= q-point: (-0.55 0.45 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.017 ( 13.591 -0.000 1.532) 13.677 2.935 ( -9.775 0.000 0.186) 9.777 3.352 ( 0.847 -0.000 5.725) 5.788 3.389 ( 3.485 -0.000 0.943) 3.610 4.147 ( -4.254 0.000 -2.090) 4.740 4.408 ( 4.317 -0.000 -1.801) 4.678 4.527 ( 0.521 -0.000 2.018) 2.084 5.118 ( 11.962 -0.000 8.005) 14.394 5.367 ( 3.111 -0.000 1.585) 3.492 5.735 ( 0.996 -0.000 -3.336) 3.482 5.983 ( 6.468 -0.000 -0.189) 6.471 6.299 ( -4.252 0.000 -1.725) 4.589 6.788 ( -9.541 0.000 7.634) 12.219 6.973 ( 3.180 -0.000 7.722) 8.351 7.061 ( -6.692 0.000 -6.499) 9.329 7.294 ( 4.683 -0.000 -4.214) 6.300 7.533 ( -5.787 0.000 -5.310) 7.854 7.873 ( 3.658 -0.000 -0.364) 3.676 8.335 ( 0.004 -0.000 -0.604) 0.604 9.173 ( 3.505 -0.000 3.610) 5.032 9.248 ( 9.312 -0.000 11.889) 15.102 9.584 ( -2.403 0.000 -0.450) 2.444 9.656 ( -4.077 0.000 -6.447) 7.628 10.040 ( -11.161 0.000 -5.628) 12.499 11.805 ( -2.491 0.000 3.529) 4.320 12.589 ( 3.400 -0.000 3.439) 4.836 12.777 ( 9.961 -0.000 0.673) 9.984 13.624 ( -5.850 0.000 -1.411) 6.018 13.682 ( 1.189 -0.000 -1.440) 1.867 14.062 ( -0.727 0.000 -1.478) 1.647 16.880 ( 3.690 -0.000 -0.681) 3.752 17.462 ( 4.737 -0.000 11.823) 12.736 17.878 ( -10.486 0.000 6.641) 12.412 18.439 ( 2.283 -0.000 -13.946) 14.132 18.713 ( -1.952 0.000 -1.796) 2.652 22.542 ( -1.223 0.000 -1.465) 1.908 ======================= Grid point 691 (336/336) ======================= q-point: (-0.45 0.45 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.71e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 308 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.140 ( 0.000 1.953 0.000) 1.953 2.832 ( -0.000 1.975 0.000) 1.975 3.354 ( 0.000 4.363 0.000) 4.363 3.407 ( -0.000 3.040 0.000) 3.040 4.110 ( -0.000 -0.987 0.000) 0.987 4.457 ( 0.000 -2.975 0.000) 2.975 4.570 ( -0.000 -7.103 0.000) 7.103 5.242 ( 0.000 2.240 0.000) 2.240 5.369 ( -0.000 4.707 0.000) 4.707 5.758 ( -0.000 -6.152 0.000) 6.152 6.078 ( -0.000 -5.691 0.000) 5.691 6.234 ( -0.000 3.404 0.000) 3.404 6.720 ( 0.000 1.987 0.000) 1.987 6.981 ( -0.000 -0.369 0.000) 0.369 7.043 ( 0.000 -3.287 0.000) 3.287 7.349 ( 0.000 -1.128 0.000) 1.128 7.442 ( -0.000 0.277 0.000) 0.277 7.906 ( -0.000 -0.599 0.000) 0.599 8.335 ( 0.000 -0.112 0.000) 0.112 9.198 ( 0.000 4.274 0.000) 4.274 9.396 ( -0.000 0.685 -0.000) 0.685 9.565 ( -0.000 -1.984 0.000) 1.984 9.582 ( 0.000 -2.172 0.000) 2.172 9.918 ( -0.000 0.257 0.000) 0.257 11.790 ( 0.000 1.459 0.000) 1.459 12.631 ( 0.000 -0.203 0.000) 0.203 12.834 ( -0.000 7.257 0.000) 7.257 13.571 ( 0.000 -1.324 0.000) 1.324 13.709 ( 0.000 -4.664 0.000) 4.664 14.048 ( -0.000 0.438 0.000) 0.438 16.911 ( -0.000 0.906 0.000) 0.906 17.522 ( -0.000 3.915 -0.000) 3.915 17.789 ( 0.000 2.627 0.000) 2.627 18.276 ( 0.000 21.146 0.000) 21.146 18.847 ( -0.000 -24.574 0.000) 24.574 22.527 ( 0.000 -0.050 0.000) 0.050 =================== 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 3/43560 10.0 406.521 753.105 562.576 0.000 40.650 0.000 3/43560 20.0 101.416 144.776 143.152 0.000 3.660 0.000 3/43560 30.0 57.386 69.272 74.227 0.000 1.205 0.000 3/43560 40.0 37.475 42.743 46.760 0.000 0.850 0.000 3/43560 50.0 26.216 29.150 32.209 0.000 0.727 0.000 3/43560 60.0 19.382 21.218 23.609 0.000 0.632 0.000 3/43560 70.0 15.020 16.254 18.185 0.000 0.550 0.000 3/43560 80.0 12.104 12.978 14.585 0.000 0.482 0.000 3/43560 90.0 10.070 10.713 12.086 0.000 0.426 0.000 3/43560 100.0 8.594 9.083 10.280 0.000 0.380 0.000 3/43560 110.0 7.488 7.869 8.930 0.000 0.342 0.000 3/43560 120.0 6.634 6.937 7.890 0.000 0.311 0.000 3/43560 130.0 5.959 6.203 7.068 0.000 0.284 0.000 3/43560 140.0 5.414 5.614 6.405 0.000 0.261 0.000 3/43560 150.0 4.965 5.130 5.859 0.000 0.241 0.000 3/43560 160.0 4.590 4.727 5.402 0.000 0.224 0.000 3/43560 170.0 4.273 4.387 5.015 0.000 0.209 0.000 3/43560 180.0 4.000 4.095 4.682 0.000 0.195 0.000 3/43560 190.0 3.764 3.843 4.394 0.000 0.183 0.000 3/43560 200.0 3.556 3.622 4.141 0.000 0.172 0.000 3/43560 210.0 3.373 3.428 3.917 0.000 0.163 0.000 3/43560 220.0 3.209 3.255 3.718 0.000 0.154 0.000 3/43560 230.0 3.063 3.100 3.539 0.000 0.146 0.000 3/43560 240.0 2.930 2.960 3.378 0.000 0.138 0.000 3/43560 250.0 2.809 2.833 3.231 0.000 0.132 0.000 3/43560 260.0 2.699 2.718 3.098 0.000 0.126 0.000 3/43560 270.0 2.598 2.612 2.975 0.000 0.120 0.000 3/43560 280.0 2.505 2.515 2.863 0.000 0.115 0.000 3/43560 290.0 2.419 2.425 2.759 0.000 0.110 0.000 3/43560 300.0 2.338 2.342 2.663 0.000 0.105 0.000 3/43560 310.0 2.264 2.264 2.573 0.000 0.101 0.000 3/43560 320.0 2.194 2.192 2.490 0.000 0.097 0.000 3/43560 330.0 2.128 2.125 2.411 0.000 0.094 0.000 3/43560 340.0 2.067 2.061 2.338 0.000 0.091 0.000 3/43560 350.0 2.009 2.002 2.270 0.000 0.087 0.000 3/43560 360.0 1.954 1.946 2.205 0.000 0.085 0.000 3/43560 370.0 1.903 1.893 2.144 0.000 0.082 0.000 3/43560 380.0 1.854 1.843 2.087 0.000 0.079 0.000 3/43560 390.0 1.808 1.796 2.032 0.000 0.077 0.000 3/43560 400.0 1.764 1.751 1.980 0.000 0.075 0.000 3/43560 410.0 1.722 1.708 1.931 0.000 0.072 0.000 3/43560 420.0 1.682 1.668 1.885 0.000 0.070 0.000 3/43560 430.0 1.644 1.629 1.840 0.000 0.068 0.000 3/43560 440.0 1.607 1.592 1.798 0.000 0.067 0.000 3/43560 450.0 1.573 1.557 1.758 0.000 0.065 0.000 3/43560 460.0 1.539 1.523 1.719 0.000 0.063 0.000 3/43560 470.0 1.507 1.491 1.682 0.000 0.062 0.000 3/43560 480.0 1.477 1.460 1.647 0.000 0.060 0.000 3/43560 490.0 1.447 1.431 1.613 0.000 0.059 0.000 3/43560 500.0 1.419 1.402 1.581 0.000 0.058 0.000 3/43560 510.0 1.392 1.375 1.549 0.000 0.056 0.000 3/43560 520.0 1.366 1.349 1.519 0.000 0.055 0.000 3/43560 530.0 1.341 1.323 1.491 0.000 0.054 0.000 3/43560 540.0 1.317 1.299 1.463 0.000 0.053 0.000 3/43560 550.0 1.293 1.276 1.436 0.000 0.052 0.000 3/43560 560.0 1.271 1.253 1.410 0.000 0.051 0.000 3/43560 570.0 1.249 1.231 1.386 0.000 0.050 0.000 3/43560 580.0 1.228 1.210 1.362 0.000 0.049 0.000 3/43560 590.0 1.207 1.190 1.339 0.000 0.048 0.000 3/43560 600.0 1.188 1.170 1.316 0.000 0.047 0.000 3/43560 610.0 1.169 1.151 1.295 0.000 0.046 0.000 3/43560 620.0 1.150 1.133 1.274 0.000 0.045 0.000 3/43560 630.0 1.132 1.115 1.253 0.000 0.044 0.000 3/43560 640.0 1.115 1.098 1.234 0.000 0.044 0.000 3/43560 650.0 1.098 1.081 1.215 0.000 0.043 0.000 3/43560 660.0 1.082 1.065 1.196 0.000 0.042 0.000 3/43560 670.0 1.066 1.049 1.178 0.000 0.041 0.000 3/43560 680.0 1.051 1.034 1.161 0.000 0.041 0.000 3/43560 690.0 1.036 1.019 1.144 0.000 0.040 0.000 3/43560 700.0 1.021 1.004 1.128 0.000 0.039 0.000 3/43560 710.0 1.007 0.990 1.112 0.000 0.039 0.000 3/43560 720.0 0.993 0.977 1.097 0.000 0.038 0.000 3/43560 730.0 0.980 0.963 1.082 0.000 0.038 0.000 3/43560 740.0 0.967 0.950 1.067 0.000 0.037 0.000 3/43560 750.0 0.954 0.938 1.053 0.000 0.037 0.000 3/43560 760.0 0.942 0.926 1.039 0.000 0.036 0.000 3/43560 770.0 0.930 0.914 1.025 0.000 0.036 0.000 3/43560 780.0 0.918 0.902 1.012 0.000 0.035 0.000 3/43560 790.0 0.907 0.891 0.999 0.000 0.035 0.000 3/43560 800.0 0.896 0.880 0.987 0.000 0.034 0.000 3/43560 810.0 0.885 0.869 0.975 0.000 0.034 0.000 3/43560 820.0 0.874 0.858 0.963 0.000 0.033 0.000 3/43560 830.0 0.864 0.848 0.951 0.000 0.033 0.000 3/43560 840.0 0.853 0.838 0.940 0.000 0.032 0.000 3/43560 850.0 0.844 0.828 0.929 0.000 0.032 0.000 3/43560 860.0 0.834 0.819 0.918 0.000 0.032 0.000 3/43560 870.0 0.824 0.809 0.907 0.000 0.031 0.000 3/43560 880.0 0.815 0.800 0.897 0.000 0.031 0.000 3/43560 890.0 0.806 0.791 0.887 0.000 0.030 0.000 3/43560 900.0 0.797 0.782 0.877 0.000 0.030 0.000 3/43560 910.0 0.789 0.774 0.868 0.000 0.030 0.000 3/43560 920.0 0.780 0.766 0.858 0.000 0.029 0.000 3/43560 930.0 0.772 0.757 0.849 0.000 0.029 0.000 3/43560 940.0 0.764 0.749 0.840 0.000 0.029 0.000 3/43560 950.0 0.756 0.742 0.831 0.000 0.028 0.000 3/43560 960.0 0.748 0.734 0.822 0.000 0.028 0.000 3/43560 970.0 0.740 0.726 0.814 0.000 0.028 0.000 3/43560 980.0 0.733 0.719 0.806 0.000 0.028 0.000 3/43560 990.0 0.726 0.712 0.798 0.000 0.027 0.000 3/43560 1000.0 0.718 0.705 0.790 0.000 0.027 0.000 3/43560 Thermal conductivity related properties were written into "kappa-m111110.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 21:28:26]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|