----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 00:22:19]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 2 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3 (148) Number of symmetry operations in supercell: 72 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.489707554104783 1.437433326565839 4.537602099999995 b -2.489707554104779 1.437433326565839 4.537602099999995 c 0.000000000000003 -2.874866653131682 4.537602099999995 Atomic positions (fractional): *1 F 0.24031996393886 0.90230325772266 0.61132142769232 18.998 2 F 0.61132142769232 0.24031996393886 0.90230325772266 18.998 3 F 0.09769674227734 0.38867857230769 0.75968003606114 18.998 4 F 0.38867857230768 0.75968003606115 0.09769674227734 18.998 5 F 0.75968003606114 0.09769674227734 0.38867857230768 18.998 6 F 0.90230325772266 0.61132142769232 0.24031996393886 18.998 *7 Zn 0.50000000000000 0.50000000000000 0.50000000000000 65.380 *8 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 -------------------------------- unit cell --------------------------------- Lattice vectors: a 4.979415108209563 0.000000000000000 0.000000000000000 b -2.489707554104782 4.312299979697521 0.000000000000000 c 0.000000000000000 0.000000000000000 13.612806299999999 Atomic positions (fractional): *1 F 0.32233841415425 0.30666012209229 0.91798154978461 18.998 > 1 2 F 0.69333987790771 0.01567829206195 0.91798154978461 18.998 > 2 3 F 0.34901162539528 0.98900508082091 0.74868511688206 18.998 > 3 4 F 0.63999345542563 0.65098837460472 0.74868511688206 18.998 > 4 5 F 0.01099491917909 0.36000654457437 0.74868511688206 18.998 > 5 6 F 0.98432170793805 0.67766158584575 0.91798154978461 18.998 > 6 7 F 0.98900508082091 0.63999345542563 0.25131488311794 18.998 > 1 8 F 0.36000654457437 0.34901162539528 0.25131488311794 18.998 > 2 9 F 0.01567829206195 0.32233841415425 0.08201845021539 18.998 > 3 10 F 0.30666012209229 0.98432170793805 0.08201845021539 18.998 > 4 11 F 0.67766158584575 0.69333987790771 0.08201845021539 18.998 > 5 12 F 0.65098837460472 0.01099491917909 0.25131488311794 18.998 > 6 13 F 0.65567174748758 0.97332678875896 0.58464821645128 18.998 > 1 14 F 0.02667321124104 0.68234495872862 0.58464821645128 18.998 > 2 15 F 0.68234495872862 0.65567174748758 0.41535178354872 18.998 > 3 16 F 0.97332678875896 0.31765504127138 0.41535178354872 18.998 > 4 17 F 0.34432825251242 0.02667321124104 0.41535178354872 18.998 > 5 18 F 0.31765504127138 0.34432825251242 0.58464821645128 18.998 > 6 *19 Zn 0.66666666666667 0.33333333333333 0.83333333333333 65.380 > 7 20 Zn 0.33333333333333 0.66666666666667 0.16666666666667 65.380 > 7 21 Zn 0.00000000000000 0.00000000000000 0.50000000000000 65.380 > 7 *22 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 > 8 23 Pd 0.66666666666667 0.33333333333333 0.33333333333333 106.420 > 8 24 Pd 0.33333333333333 0.66666666666667 0.66666666666667 106.420 > 8 -------------------------------- super cell -------------------------------- Lattice vectors: a 9.958830216419125 0.000000000000000 0.000000000000000 b -4.979415108209564 8.624599959395042 0.000000000000000 c 0.000000000000000 0.000000000000000 13.612806299999999 Atomic positions (fractional): *1 F 0.16116920707712 0.15333006104615 0.91798154978461 18.998 > 1 2 F 0.66116920707712 0.15333006104615 0.91798154978461 18.998 > 1 3 F 0.16116920707712 0.65333006104615 0.91798154978461 18.998 > 1 4 F 0.66116920707712 0.65333006104615 0.91798154978461 18.998 > 1 5 F 0.34666993895385 0.00783914603098 0.91798154978461 18.998 > 2 6 F 0.84666993895385 0.00783914603098 0.91798154978461 18.998 > 2 7 F 0.34666993895385 0.50783914603098 0.91798154978461 18.998 > 2 8 F 0.84666993895385 0.50783914603098 0.91798154978461 18.998 > 2 9 F 0.17450581269764 0.49450254041046 0.74868511688206 18.998 > 3 10 F 0.67450581269764 0.49450254041046 0.74868511688206 18.998 > 3 11 F 0.17450581269764 0.99450254041046 0.74868511688206 18.998 > 3 12 F 0.67450581269764 0.99450254041046 0.74868511688206 18.998 > 3 13 F 0.31999672771281 0.32549418730236 0.74868511688206 18.998 > 4 14 F 0.81999672771281 0.32549418730236 0.74868511688206 18.998 > 4 15 F 0.31999672771281 0.82549418730236 0.74868511688206 18.998 > 4 16 F 0.81999672771281 0.82549418730236 0.74868511688206 18.998 > 4 17 F 0.00549745958954 0.18000327228719 0.74868511688206 18.998 > 5 18 F 0.50549745958954 0.18000327228719 0.74868511688206 18.998 > 5 19 F 0.00549745958954 0.68000327228719 0.74868511688206 18.998 > 5 20 F 0.50549745958954 0.68000327228719 0.74868511688206 18.998 > 5 21 F 0.49216085396902 0.33883079292288 0.91798154978461 18.998 > 6 22 F 0.99216085396902 0.33883079292288 0.91798154978461 18.998 > 6 23 F 0.49216085396902 0.83883079292288 0.91798154978461 18.998 > 6 24 F 0.99216085396902 0.83883079292288 0.91798154978461 18.998 > 6 25 F 0.49450254041046 0.31999672771281 0.25131488311794 18.998 > 1 26 F 0.99450254041046 0.31999672771281 0.25131488311794 18.998 > 1 27 F 0.49450254041046 0.81999672771281 0.25131488311794 18.998 > 1 28 F 0.99450254041046 0.81999672771281 0.25131488311794 18.998 > 1 29 F 0.18000327228719 0.17450581269764 0.25131488311794 18.998 > 2 30 F 0.68000327228719 0.17450581269764 0.25131488311794 18.998 > 2 31 F 0.18000327228719 0.67450581269764 0.25131488311794 18.998 > 2 32 F 0.68000327228719 0.67450581269764 0.25131488311794 18.998 > 2 33 F 0.00783914603098 0.16116920707712 0.08201845021539 18.998 > 3 34 F 0.50783914603098 0.16116920707712 0.08201845021539 18.998 > 3 35 F 0.00783914603098 0.66116920707712 0.08201845021539 18.998 > 3 36 F 0.50783914603098 0.66116920707712 0.08201845021539 18.998 > 3 37 F 0.15333006104615 0.49216085396902 0.08201845021539 18.998 > 4 38 F 0.65333006104615 0.49216085396902 0.08201845021539 18.998 > 4 39 F 0.15333006104615 0.99216085396902 0.08201845021539 18.998 > 4 40 F 0.65333006104615 0.99216085396902 0.08201845021539 18.998 > 4 41 F 0.33883079292288 0.34666993895385 0.08201845021539 18.998 > 5 42 F 0.83883079292288 0.34666993895385 0.08201845021539 18.998 > 5 43 F 0.33883079292288 0.84666993895385 0.08201845021539 18.998 > 5 44 F 0.83883079292288 0.84666993895385 0.08201845021539 18.998 > 5 45 F 0.32549418730236 0.00549745958954 0.25131488311794 18.998 > 6 46 F 0.82549418730236 0.00549745958954 0.25131488311794 18.998 > 6 47 F 0.32549418730236 0.50549745958954 0.25131488311794 18.998 > 6 48 F 0.82549418730236 0.50549745958954 0.25131488311794 18.998 > 6 49 F 0.32783587374379 0.48666339437948 0.58464821645128 18.998 > 1 50 F 0.82783587374379 0.48666339437948 0.58464821645128 18.998 > 1 51 F 0.32783587374379 0.98666339437948 0.58464821645128 18.998 > 1 52 F 0.82783587374379 0.98666339437948 0.58464821645128 18.998 > 1 53 F 0.01333660562052 0.34117247936431 0.58464821645128 18.998 > 2 54 F 0.51333660562052 0.34117247936431 0.58464821645128 18.998 > 2 55 F 0.01333660562052 0.84117247936431 0.58464821645128 18.998 > 2 56 F 0.51333660562052 0.84117247936431 0.58464821645128 18.998 > 2 57 F 0.34117247936431 0.32783587374379 0.41535178354872 18.998 > 3 58 F 0.84117247936431 0.32783587374379 0.41535178354872 18.998 > 3 59 F 0.34117247936431 0.82783587374379 0.41535178354872 18.998 > 3 60 F 0.84117247936431 0.82783587374379 0.41535178354872 18.998 > 3 61 F 0.48666339437948 0.15882752063569 0.41535178354872 18.998 > 4 62 F 0.98666339437948 0.15882752063569 0.41535178354872 18.998 > 4 63 F 0.48666339437948 0.65882752063569 0.41535178354872 18.998 > 4 64 F 0.98666339437948 0.65882752063569 0.41535178354872 18.998 > 4 65 F 0.17216412625621 0.01333660562052 0.41535178354872 18.998 > 5 66 F 0.67216412625621 0.01333660562052 0.41535178354872 18.998 > 5 67 F 0.17216412625621 0.51333660562052 0.41535178354872 18.998 > 5 68 F 0.67216412625621 0.51333660562052 0.41535178354872 18.998 > 5 69 F 0.15882752063569 0.17216412625621 0.58464821645128 18.998 > 6 70 F 0.65882752063569 0.17216412625621 0.58464821645128 18.998 > 6 71 F 0.15882752063569 0.67216412625621 0.58464821645128 18.998 > 6 72 F 0.65882752063569 0.67216412625621 0.58464821645128 18.998 > 6 *73 Zn 0.33333333333333 0.16666666666667 0.83333333333333 65.380 > 7 74 Zn 0.83333333333333 0.16666666666667 0.83333333333333 65.380 > 7 75 Zn 0.33333333333333 0.66666666666667 0.83333333333333 65.380 > 7 76 Zn 0.83333333333333 0.66666666666667 0.83333333333333 65.380 > 7 77 Zn 0.16666666666667 0.33333333333333 0.16666666666667 65.380 > 7 78 Zn 0.66666666666667 0.33333333333333 0.16666666666667 65.380 > 7 79 Zn 0.16666666666667 0.83333333333333 0.16666666666667 65.380 > 7 80 Zn 0.66666666666667 0.83333333333333 0.16666666666667 65.380 > 7 81 Zn 0.00000000000000 0.00000000000000 0.50000000000000 65.380 > 7 82 Zn 0.50000000000000 0.00000000000000 0.50000000000000 65.380 > 7 83 Zn 0.00000000000000 0.50000000000000 0.50000000000000 65.380 > 7 84 Zn 0.50000000000000 0.50000000000000 0.50000000000000 65.380 > 7 *85 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 > 8 86 Pd 0.50000000000000 0.00000000000000 0.00000000000000 106.420 > 8 87 Pd 0.00000000000000 0.50000000000000 0.00000000000000 106.420 > 8 88 Pd 0.50000000000000 0.50000000000000 0.00000000000000 106.420 > 8 89 Pd 0.33333333333333 0.16666666666667 0.33333333333333 106.420 > 8 90 Pd 0.83333333333333 0.16666666666667 0.33333333333333 106.420 > 8 91 Pd 0.33333333333333 0.66666666666667 0.33333333333333 106.420 > 8 92 Pd 0.83333333333333 0.66666666666667 0.33333333333333 106.420 > 8 93 Pd 0.16666666666667 0.33333333333333 0.66666666666667 106.420 > 8 94 Pd 0.66666666666667 0.33333333333333 0.66666666666667 106.420 > 8 95 Pd 0.16666666666667 0.83333333333333 0.66666666666667 106.420 > 8 96 Pd 0.66666666666667 0.83333333333333 0.66666666666667 106.420 > 8 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.8917779 -0.0000003 0.0000000 0.0000003 3.8917779 0.0000000 0.0000000 0.0000000 4.2504283 -------------------------- Born effective charges -------------------------- 1 F -0.9272819 -0.4927745 0.5975096 -0.4072325 -0.9194369 0.4743740 0.5147444 0.5765174 -0.9698069 2 F -1.3111126 0.1856278 -0.7095747 0.2711698 -0.5356062 0.2802715 -0.7566509 0.1575231 -0.9698069 3 F -0.5316837 0.1788337 0.1120652 0.2643757 -1.3150351 -0.7546455 0.2419065 -0.7340405 -0.9698069 4 F -1.3111126 0.1856278 -0.7095747 0.2711698 -0.5356062 0.2802715 -0.7566509 0.1575231 -0.9698069 5 F -0.9272819 -0.4927745 0.5975096 -0.4072325 -0.9194369 0.4743740 0.5147444 0.5765174 -0.9698069 6 F -0.5316837 0.1788337 0.1120652 0.2643757 -1.3150351 -0.7546455 0.2419065 -0.7340405 -0.9698069 7 Zn 2.6457510 -0.3918974 0.0000000 0.3918974 2.6457510 0.0000000 0.0000000 -0.0000000 2.9681558 8 Pd 2.8944054 0.6485233 0.0000000 -0.6485233 2.8944054 0.0000000 0.0000000 -0.0000000 2.8506857 ---------------------------------------------------------------------------- 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: 4920/4920 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 620 Number of blocks in projector: 300 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 3 --- Eigsh_solver_block: 1 / 3 --- Block_size: 284 Use standard eigh solver. --- Eigsh_solver_block: 2 / 3 --- Block_size: 256 Use standard eigh solver. --- Eigsh_solver_block: 3 / 3 --- Block_size: 80 Use standard eigh solver. Tree of FC basis block matrices: - (620, 606), data: False |-- (80, 77), data: True |-- (256, 252), data: True |-- (284, 277), data: True ----- Solver_atoms: 1 -- 96 / 96 Time (Solver_compr_matrix_reshape): 0.010 Solver_block: 100 / 160 - Time: 0.464 Solver_block: 160 / 160 - Time: 0.320 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 0.800 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (zy) -0.00000000 (zy) Permutation basis: 288/288 Permutation basis: 4920/4920 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 620 Number of blocks in projector: 300 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 3 --- Eigsh_solver_block: 1 / 3 --- Block_size: 284 Use standard eigh solver. --- Eigsh_solver_block: 2 / 3 --- Block_size: 256 Use standard eigh solver. --- Eigsh_solver_block: 3 / 3 --- Block_size: 80 Use standard eigh solver. Tree of FC basis block matrices: - (620, 606), data: False |-- (80, 77), data: True |-- (256, 252), data: True |-- (284, 277), data: True Max drift after symmetrization by symfc projector: -0.00000000 (zy) -0.00000000 (zy) 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 00:22:26]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 00:22:26]------------------------- 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 2 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3 (148) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.489707554104783 1.437433326565839 4.537602099999995 b -2.489707554104779 1.437433326565839 4.537602099999995 c 0.000000000000003 -2.874866653131682 4.537602099999995 Atomic positions (fractional): 1 F 0.24031996393886 0.90230325772266 0.61132142769232 18.998 2 F 0.61132142769232 0.24031996393886 0.90230325772266 18.998 3 F 0.09769674227734 0.38867857230769 0.75968003606114 18.998 4 F 0.38867857230768 0.75968003606115 0.09769674227734 18.998 5 F 0.75968003606114 0.09769674227734 0.38867857230768 18.998 6 F 0.90230325772266 0.61132142769232 0.24031996393886 18.998 7 Zn 0.50000000000000 0.50000000000000 0.50000000000000 65.380 8 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.958830216419125 0.000000000000000 0.000000000000000 b -4.979415108209564 8.624599959395042 0.000000000000000 c 0.000000000000000 0.000000000000000 13.612806299999999 Atomic positions (fractional): 1 F 0.16116920707712 0.15333006104615 0.91798154978461 18.998 > 1 2 F 0.66116920707712 0.15333006104615 0.91798154978461 18.998 > 1 3 F 0.16116920707712 0.65333006104615 0.91798154978461 18.998 > 1 4 F 0.66116920707712 0.65333006104615 0.91798154978461 18.998 > 1 5 F 0.34666993895385 0.00783914603098 0.91798154978461 18.998 > 5 6 F 0.84666993895385 0.00783914603098 0.91798154978461 18.998 > 5 7 F 0.34666993895385 0.50783914603098 0.91798154978461 18.998 > 5 8 F 0.84666993895385 0.50783914603098 0.91798154978461 18.998 > 5 9 F 0.17450581269764 0.49450254041046 0.74868511688206 18.998 > 9 10 F 0.67450581269764 0.49450254041046 0.74868511688206 18.998 > 9 11 F 0.17450581269764 0.99450254041046 0.74868511688206 18.998 > 9 12 F 0.67450581269764 0.99450254041046 0.74868511688206 18.998 > 9 13 F 0.31999672771281 0.32549418730236 0.74868511688206 18.998 > 13 14 F 0.81999672771281 0.32549418730236 0.74868511688206 18.998 > 13 15 F 0.31999672771281 0.82549418730236 0.74868511688206 18.998 > 13 16 F 0.81999672771281 0.82549418730236 0.74868511688206 18.998 > 13 17 F 0.00549745958954 0.18000327228719 0.74868511688206 18.998 > 17 18 F 0.50549745958954 0.18000327228719 0.74868511688206 18.998 > 17 19 F 0.00549745958954 0.68000327228719 0.74868511688206 18.998 > 17 20 F 0.50549745958954 0.68000327228719 0.74868511688206 18.998 > 17 21 F 0.49216085396902 0.33883079292288 0.91798154978461 18.998 > 21 22 F 0.99216085396902 0.33883079292288 0.91798154978461 18.998 > 21 23 F 0.49216085396902 0.83883079292288 0.91798154978461 18.998 > 21 24 F 0.99216085396902 0.83883079292288 0.91798154978461 18.998 > 21 25 F 0.49450254041046 0.31999672771281 0.25131488311794 18.998 > 1 26 F 0.99450254041046 0.31999672771281 0.25131488311794 18.998 > 1 27 F 0.49450254041046 0.81999672771281 0.25131488311794 18.998 > 1 28 F 0.99450254041046 0.81999672771281 0.25131488311794 18.998 > 1 29 F 0.18000327228719 0.17450581269764 0.25131488311794 18.998 > 5 30 F 0.68000327228719 0.17450581269764 0.25131488311794 18.998 > 5 31 F 0.18000327228719 0.67450581269764 0.25131488311794 18.998 > 5 32 F 0.68000327228719 0.67450581269764 0.25131488311794 18.998 > 5 33 F 0.00783914603098 0.16116920707712 0.08201845021539 18.998 > 9 34 F 0.50783914603098 0.16116920707712 0.08201845021539 18.998 > 9 35 F 0.00783914603098 0.66116920707712 0.08201845021539 18.998 > 9 36 F 0.50783914603098 0.66116920707712 0.08201845021539 18.998 > 9 37 F 0.15333006104615 0.49216085396902 0.08201845021539 18.998 > 13 38 F 0.65333006104615 0.49216085396902 0.08201845021539 18.998 > 13 39 F 0.15333006104615 0.99216085396902 0.08201845021539 18.998 > 13 40 F 0.65333006104615 0.99216085396902 0.08201845021539 18.998 > 13 41 F 0.33883079292288 0.34666993895385 0.08201845021539 18.998 > 17 42 F 0.83883079292288 0.34666993895385 0.08201845021539 18.998 > 17 43 F 0.33883079292288 0.84666993895385 0.08201845021539 18.998 > 17 44 F 0.83883079292288 0.84666993895385 0.08201845021539 18.998 > 17 45 F 0.32549418730236 0.00549745958954 0.25131488311794 18.998 > 21 46 F 0.82549418730236 0.00549745958954 0.25131488311794 18.998 > 21 47 F 0.32549418730236 0.50549745958954 0.25131488311794 18.998 > 21 48 F 0.82549418730236 0.50549745958954 0.25131488311794 18.998 > 21 49 F 0.32783587374379 0.48666339437948 0.58464821645128 18.998 > 1 50 F 0.82783587374379 0.48666339437948 0.58464821645128 18.998 > 1 51 F 0.32783587374379 0.98666339437948 0.58464821645128 18.998 > 1 52 F 0.82783587374379 0.98666339437948 0.58464821645128 18.998 > 1 53 F 0.01333660562052 0.34117247936431 0.58464821645128 18.998 > 5 54 F 0.51333660562052 0.34117247936431 0.58464821645128 18.998 > 5 55 F 0.01333660562052 0.84117247936431 0.58464821645128 18.998 > 5 56 F 0.51333660562052 0.84117247936431 0.58464821645128 18.998 > 5 57 F 0.34117247936431 0.32783587374379 0.41535178354872 18.998 > 9 58 F 0.84117247936431 0.32783587374379 0.41535178354872 18.998 > 9 59 F 0.34117247936431 0.82783587374379 0.41535178354872 18.998 > 9 60 F 0.84117247936431 0.82783587374379 0.41535178354872 18.998 > 9 61 F 0.48666339437948 0.15882752063569 0.41535178354872 18.998 > 13 62 F 0.98666339437948 0.15882752063569 0.41535178354872 18.998 > 13 63 F 0.48666339437948 0.65882752063569 0.41535178354872 18.998 > 13 64 F 0.98666339437948 0.65882752063569 0.41535178354872 18.998 > 13 65 F 0.17216412625621 0.01333660562052 0.41535178354872 18.998 > 17 66 F 0.67216412625621 0.01333660562052 0.41535178354872 18.998 > 17 67 F 0.17216412625621 0.51333660562052 0.41535178354872 18.998 > 17 68 F 0.67216412625621 0.51333660562052 0.41535178354872 18.998 > 17 69 F 0.15882752063569 0.17216412625621 0.58464821645128 18.998 > 21 70 F 0.65882752063569 0.17216412625621 0.58464821645128 18.998 > 21 71 F 0.15882752063569 0.67216412625621 0.58464821645128 18.998 > 21 72 F 0.65882752063569 0.67216412625621 0.58464821645128 18.998 > 21 73 Zn 0.33333333333333 0.16666666666667 0.83333333333333 65.380 > 73 74 Zn 0.83333333333333 0.16666666666667 0.83333333333333 65.380 > 73 75 Zn 0.33333333333333 0.66666666666667 0.83333333333333 65.380 > 73 76 Zn 0.83333333333333 0.66666666666667 0.83333333333333 65.380 > 73 77 Zn 0.16666666666667 0.33333333333333 0.16666666666667 65.380 > 73 78 Zn 0.66666666666667 0.33333333333333 0.16666666666667 65.380 > 73 79 Zn 0.16666666666667 0.83333333333333 0.16666666666667 65.380 > 73 80 Zn 0.66666666666667 0.83333333333333 0.16666666666667 65.380 > 73 81 Zn 0.00000000000000 0.00000000000000 0.50000000000000 65.380 > 73 82 Zn 0.50000000000000 0.00000000000000 0.50000000000000 65.380 > 73 83 Zn 0.00000000000000 0.50000000000000 0.50000000000000 65.380 > 73 84 Zn 0.50000000000000 0.50000000000000 0.50000000000000 65.380 > 73 85 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 > 85 86 Pd 0.50000000000000 0.00000000000000 0.00000000000000 106.420 > 85 87 Pd 0.00000000000000 0.50000000000000 0.00000000000000 106.420 > 85 88 Pd 0.50000000000000 0.50000000000000 0.00000000000000 106.420 > 85 89 Pd 0.33333333333333 0.16666666666667 0.33333333333333 106.420 > 85 90 Pd 0.83333333333333 0.16666666666667 0.33333333333333 106.420 > 85 91 Pd 0.33333333333333 0.66666666666667 0.33333333333333 106.420 > 85 92 Pd 0.83333333333333 0.66666666666667 0.33333333333333 106.420 > 85 93 Pd 0.16666666666667 0.33333333333333 0.66666666666667 106.420 > 85 94 Pd 0.66666666666667 0.33333333333333 0.66666666666667 106.420 > 85 95 Pd 0.16666666666667 0.83333333333333 0.66666666666667 106.420 > 85 96 Pd 0.66666666666667 0.83333333333333 0.66666666666667 106.420 > 85 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.8917779 -0.0000003 0.0000000 0.0000003 3.8917779 0.0000000 0.0000000 0.0000000 4.2504283 -------------------------- Born effective charges -------------------------- 1 F -0.9272819 -0.4927745 0.5975096 -0.4072325 -0.9194369 0.4743740 0.5147444 0.5765174 -0.9698069 2 F -1.3111126 0.1856278 -0.7095747 0.2711698 -0.5356062 0.2802715 -0.7566509 0.1575231 -0.9698069 3 F -0.5316837 0.1788337 0.1120652 0.2643757 -1.3150351 -0.7546455 0.2419065 -0.7340405 -0.9698069 4 F -1.3111126 0.1856278 -0.7095747 0.2711698 -0.5356062 0.2802715 -0.7566509 0.1575231 -0.9698069 5 F -0.9272819 -0.4927745 0.5975096 -0.4072325 -0.9194369 0.4743740 0.5147444 0.5765174 -0.9698069 6 F -0.5316837 0.1788337 0.1120652 0.2643757 -1.3150351 -0.7546455 0.2419065 -0.7340405 -0.9698069 7 Zn 2.6457510 -0.3918974 0.0000000 0.3918974 2.6457510 0.0000000 0.0000000 -0.0000000 2.9681558 8 Pd 2.8944054 0.6485233 0.0000000 -0.6485233 2.8944054 0.0000000 0.0000000 -0.0000000 2.8506857 ---------------------------------------------------------------------------- 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] [-0.0050 0.0087 0.0000] [ 0.0050 -0.0087 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 85, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000003 (xzx) -0.00000003 (xzx) -0.00000003 (xxz) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000014 (yx) 0.00000014 (yx) 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 00:22:33]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 00:22:33]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 2 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3 (148) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.489707554104783 1.437433326565839 4.537602099999995 b -2.489707554104779 1.437433326565839 4.537602099999995 c 0.000000000000003 -2.874866653131682 4.537602099999995 Atomic positions (fractional): 1 F 0.24031996393886 0.90230325772266 0.61132142769232 18.998 2 F 0.61132142769232 0.24031996393886 0.90230325772266 18.998 3 F 0.09769674227734 0.38867857230769 0.75968003606114 18.998 4 F 0.38867857230768 0.75968003606115 0.09769674227734 18.998 5 F 0.75968003606114 0.09769674227734 0.38867857230768 18.998 6 F 0.90230325772266 0.61132142769232 0.24031996393886 18.998 7 Zn 0.50000000000000 0.50000000000000 0.50000000000000 65.380 8 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.958830216419125 0.000000000000000 0.000000000000000 b -4.979415108209564 8.624599959395042 0.000000000000000 c 0.000000000000000 0.000000000000000 13.612806299999999 Atomic positions (fractional): 1 F 0.16116920707712 0.15333006104615 0.91798154978461 18.998 > 1 2 F 0.66116920707712 0.15333006104615 0.91798154978461 18.998 > 1 3 F 0.16116920707712 0.65333006104615 0.91798154978461 18.998 > 1 4 F 0.66116920707712 0.65333006104615 0.91798154978461 18.998 > 1 5 F 0.34666993895385 0.00783914603098 0.91798154978461 18.998 > 5 6 F 0.84666993895385 0.00783914603098 0.91798154978461 18.998 > 5 7 F 0.34666993895385 0.50783914603098 0.91798154978461 18.998 > 5 8 F 0.84666993895385 0.50783914603098 0.91798154978461 18.998 > 5 9 F 0.17450581269764 0.49450254041046 0.74868511688206 18.998 > 9 10 F 0.67450581269764 0.49450254041046 0.74868511688206 18.998 > 9 11 F 0.17450581269764 0.99450254041046 0.74868511688206 18.998 > 9 12 F 0.67450581269764 0.99450254041046 0.74868511688206 18.998 > 9 13 F 0.31999672771281 0.32549418730236 0.74868511688206 18.998 > 13 14 F 0.81999672771281 0.32549418730236 0.74868511688206 18.998 > 13 15 F 0.31999672771281 0.82549418730236 0.74868511688206 18.998 > 13 16 F 0.81999672771281 0.82549418730236 0.74868511688206 18.998 > 13 17 F 0.00549745958954 0.18000327228719 0.74868511688206 18.998 > 17 18 F 0.50549745958954 0.18000327228719 0.74868511688206 18.998 > 17 19 F 0.00549745958954 0.68000327228719 0.74868511688206 18.998 > 17 20 F 0.50549745958954 0.68000327228719 0.74868511688206 18.998 > 17 21 F 0.49216085396902 0.33883079292288 0.91798154978461 18.998 > 21 22 F 0.99216085396902 0.33883079292288 0.91798154978461 18.998 > 21 23 F 0.49216085396902 0.83883079292288 0.91798154978461 18.998 > 21 24 F 0.99216085396902 0.83883079292288 0.91798154978461 18.998 > 21 25 F 0.49450254041046 0.31999672771281 0.25131488311794 18.998 > 1 26 F 0.99450254041046 0.31999672771281 0.25131488311794 18.998 > 1 27 F 0.49450254041046 0.81999672771281 0.25131488311794 18.998 > 1 28 F 0.99450254041046 0.81999672771281 0.25131488311794 18.998 > 1 29 F 0.18000327228719 0.17450581269764 0.25131488311794 18.998 > 5 30 F 0.68000327228719 0.17450581269764 0.25131488311794 18.998 > 5 31 F 0.18000327228719 0.67450581269764 0.25131488311794 18.998 > 5 32 F 0.68000327228719 0.67450581269764 0.25131488311794 18.998 > 5 33 F 0.00783914603098 0.16116920707712 0.08201845021539 18.998 > 9 34 F 0.50783914603098 0.16116920707712 0.08201845021539 18.998 > 9 35 F 0.00783914603098 0.66116920707712 0.08201845021539 18.998 > 9 36 F 0.50783914603098 0.66116920707712 0.08201845021539 18.998 > 9 37 F 0.15333006104615 0.49216085396902 0.08201845021539 18.998 > 13 38 F 0.65333006104615 0.49216085396902 0.08201845021539 18.998 > 13 39 F 0.15333006104615 0.99216085396902 0.08201845021539 18.998 > 13 40 F 0.65333006104615 0.99216085396902 0.08201845021539 18.998 > 13 41 F 0.33883079292288 0.34666993895385 0.08201845021539 18.998 > 17 42 F 0.83883079292288 0.34666993895385 0.08201845021539 18.998 > 17 43 F 0.33883079292288 0.84666993895385 0.08201845021539 18.998 > 17 44 F 0.83883079292288 0.84666993895385 0.08201845021539 18.998 > 17 45 F 0.32549418730236 0.00549745958954 0.25131488311794 18.998 > 21 46 F 0.82549418730236 0.00549745958954 0.25131488311794 18.998 > 21 47 F 0.32549418730236 0.50549745958954 0.25131488311794 18.998 > 21 48 F 0.82549418730236 0.50549745958954 0.25131488311794 18.998 > 21 49 F 0.32783587374379 0.48666339437948 0.58464821645128 18.998 > 1 50 F 0.82783587374379 0.48666339437948 0.58464821645128 18.998 > 1 51 F 0.32783587374379 0.98666339437948 0.58464821645128 18.998 > 1 52 F 0.82783587374379 0.98666339437948 0.58464821645128 18.998 > 1 53 F 0.01333660562052 0.34117247936431 0.58464821645128 18.998 > 5 54 F 0.51333660562052 0.34117247936431 0.58464821645128 18.998 > 5 55 F 0.01333660562052 0.84117247936431 0.58464821645128 18.998 > 5 56 F 0.51333660562052 0.84117247936431 0.58464821645128 18.998 > 5 57 F 0.34117247936431 0.32783587374379 0.41535178354872 18.998 > 9 58 F 0.84117247936431 0.32783587374379 0.41535178354872 18.998 > 9 59 F 0.34117247936431 0.82783587374379 0.41535178354872 18.998 > 9 60 F 0.84117247936431 0.82783587374379 0.41535178354872 18.998 > 9 61 F 0.48666339437948 0.15882752063569 0.41535178354872 18.998 > 13 62 F 0.98666339437948 0.15882752063569 0.41535178354872 18.998 > 13 63 F 0.48666339437948 0.65882752063569 0.41535178354872 18.998 > 13 64 F 0.98666339437948 0.65882752063569 0.41535178354872 18.998 > 13 65 F 0.17216412625621 0.01333660562052 0.41535178354872 18.998 > 17 66 F 0.67216412625621 0.01333660562052 0.41535178354872 18.998 > 17 67 F 0.17216412625621 0.51333660562052 0.41535178354872 18.998 > 17 68 F 0.67216412625621 0.51333660562052 0.41535178354872 18.998 > 17 69 F 0.15882752063569 0.17216412625621 0.58464821645128 18.998 > 21 70 F 0.65882752063569 0.17216412625621 0.58464821645128 18.998 > 21 71 F 0.15882752063569 0.67216412625621 0.58464821645128 18.998 > 21 72 F 0.65882752063569 0.67216412625621 0.58464821645128 18.998 > 21 73 Zn 0.33333333333333 0.16666666666667 0.83333333333333 65.380 > 73 74 Zn 0.83333333333333 0.16666666666667 0.83333333333333 65.380 > 73 75 Zn 0.33333333333333 0.66666666666667 0.83333333333333 65.380 > 73 76 Zn 0.83333333333333 0.66666666666667 0.83333333333333 65.380 > 73 77 Zn 0.16666666666667 0.33333333333333 0.16666666666667 65.380 > 73 78 Zn 0.66666666666667 0.33333333333333 0.16666666666667 65.380 > 73 79 Zn 0.16666666666667 0.83333333333333 0.16666666666667 65.380 > 73 80 Zn 0.66666666666667 0.83333333333333 0.16666666666667 65.380 > 73 81 Zn 0.00000000000000 0.00000000000000 0.50000000000000 65.380 > 73 82 Zn 0.50000000000000 0.00000000000000 0.50000000000000 65.380 > 73 83 Zn 0.00000000000000 0.50000000000000 0.50000000000000 65.380 > 73 84 Zn 0.50000000000000 0.50000000000000 0.50000000000000 65.380 > 73 85 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 > 85 86 Pd 0.50000000000000 0.00000000000000 0.00000000000000 106.420 > 85 87 Pd 0.00000000000000 0.50000000000000 0.00000000000000 106.420 > 85 88 Pd 0.50000000000000 0.50000000000000 0.00000000000000 106.420 > 85 89 Pd 0.33333333333333 0.16666666666667 0.33333333333333 106.420 > 85 90 Pd 0.83333333333333 0.16666666666667 0.33333333333333 106.420 > 85 91 Pd 0.33333333333333 0.66666666666667 0.33333333333333 106.420 > 85 92 Pd 0.83333333333333 0.66666666666667 0.33333333333333 106.420 > 85 93 Pd 0.16666666666667 0.33333333333333 0.66666666666667 106.420 > 85 94 Pd 0.66666666666667 0.33333333333333 0.66666666666667 106.420 > 85 95 Pd 0.16666666666667 0.83333333333333 0.66666666666667 106.420 > 85 96 Pd 0.66666666666667 0.83333333333333 0.66666666666667 106.420 > 85 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.8917779 -0.0000003 0.0000000 0.0000003 3.8917779 0.0000000 0.0000000 0.0000000 4.2504283 -------------------------- Born effective charges -------------------------- 1 F -0.9272819 -0.4927745 0.5975096 -0.4072325 -0.9194369 0.4743740 0.5147444 0.5765174 -0.9698069 2 F -1.3111126 0.1856278 -0.7095747 0.2711698 -0.5356062 0.2802715 -0.7566509 0.1575231 -0.9698069 3 F -0.5316837 0.1788337 0.1120652 0.2643757 -1.3150351 -0.7546455 0.2419065 -0.7340405 -0.9698069 4 F -1.3111126 0.1856278 -0.7095747 0.2711698 -0.5356062 0.2802715 -0.7566509 0.1575231 -0.9698069 5 F -0.9272819 -0.4927745 0.5975096 -0.4072325 -0.9194369 0.4743740 0.5147444 0.5765174 -0.9698069 6 F -0.5316837 0.1788337 0.1120652 0.2643757 -1.3150351 -0.7546455 0.2419065 -0.7340405 -0.9698069 7 Zn 2.6457510 -0.3918974 0.0000000 0.3918974 2.6457510 0.0000000 0.0000000 -0.0000000 2.9681558 8 Pd 2.8944054 0.6485233 0.0000000 -0.6485233 2.8944054 0.0000000 0.0000000 -0.0000000 2.8506857 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000003 (xzx) -0.00000003 (xzx) -0.00000003 (xxz) Max drift of fc2: -0.00000000 (zy) -0.00000000 (zy) --------------------------- 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 ... [ 12 12 12 ] 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: 0.90, Number of G-points: 297, Lambda: 0.19 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/294) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 294 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 4.079 ( 0.000 0.000 0.000) 0.000 4.079 ( 0.000 0.000 0.000) 0.000 5.107 ( 0.000 0.000 0.000) 0.000 5.220 ( 0.000 0.000 0.000) 0.000 5.220 ( 0.000 0.000 0.000) 0.000 6.474 ( 0.000 0.000 0.000) 0.000 6.474 ( 0.000 0.000 0.000) 0.000 6.511 ( 0.000 0.000 0.000) 0.000 7.224 ( 0.000 0.000 0.000) 0.000 7.833 ( 0.000 0.000 0.000) 0.000 7.833 ( 0.000 0.000 0.000) 0.000 7.837 ( 0.000 0.000 0.000) 0.000 9.848 ( 0.000 0.000 0.000) 0.000 10.379 ( 0.000 0.000 0.000) 0.000 10.379 ( 0.000 0.000 0.000) 0.000 15.788 ( 0.000 0.000 0.000) 0.000 15.788 ( 0.000 0.000 0.000) 0.000 17.051 ( 0.000 0.000 0.000) 0.000 17.260 ( 0.000 0.000 0.000) 0.000 17.263 ( 0.000 0.000 0.000) 0.000 17.263 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/294) ======================= q-point: ( 0.08 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.527 ( 29.176 -7.610 19.216) 35.755 0.601 ( 15.984 25.165 14.764) 33.268 0.731 ( 28.996 21.125 5.033) 36.226 3.999 ( -4.912 -5.538 -2.336) 7.762 4.036 ( -5.108 1.110 -1.278) 5.381 5.159 ( 1.517 0.008 6.161) 6.345 5.234 ( 0.744 1.703 -1.937) 2.685 5.728 ( -5.477 -4.637 -1.277) 7.289 6.235 ( -12.593 -7.161 1.506) 14.565 6.442 ( -2.225 -1.411 -2.825) 3.863 6.907 ( 12.150 5.953 1.027) 13.569 7.261 ( 2.711 1.769 2.868) 4.325 7.713 ( -5.257 -1.135 -0.297) 5.386 7.888 ( 3.901 2.448 3.239) 5.630 7.987 ( 7.290 3.878 -0.518) 8.274 9.807 ( -5.890 -2.485 2.886) 7.014 10.353 ( -3.849 1.536 -0.607) 4.189 10.566 ( -0.205 -4.778 -9.182) 10.353 15.810 ( 2.742 1.285 -2.298) 3.801 15.831 ( 2.384 1.685 4.434) 5.309 17.035 ( -0.847 -0.683 -1.719) 2.035 17.236 ( -3.151 -0.925 2.077) 3.886 17.246 ( 1.154 -3.090 -3.820) 5.047 18.883 ( -1.145 1.831 3.048) 3.735 ======================= Grid point 2 (3/294) ======================= q-point: ( 0.17 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.067 ( 29.392 -6.404 19.094) 35.630 1.201 ( 17.166 24.199 12.256) 32.101 1.430 ( 26.087 20.057 6.676) 33.576 3.809 ( -7.154 -7.769 -3.268) 11.056 3.926 ( -8.374 2.224 -2.189) 8.936 5.206 ( 0.038 -3.528 -3.093) 4.692 5.217 ( -2.913 1.359 2.690) 4.192 5.481 ( -10.928 -9.093 -6.792) 15.755 6.074 ( -4.183 -1.632 4.929) 6.668 6.371 ( -1.747 -0.916 -3.413) 3.942 7.091 ( 6.112 0.771 -1.648) 6.377 7.401 ( 5.738 3.380 10.502) 12.436 7.645 ( -1.787 1.495 -2.467) 3.393 8.044 ( 5.880 6.294 6.206) 10.616 8.141 ( 7.769 3.197 -2.107) 8.661 9.656 ( -9.259 -4.367 0.786) 10.268 10.272 ( -7.258 3.572 -4.181) 9.106 10.421 ( -2.102 -10.287 -6.189) 12.187 15.875 ( 5.113 2.609 -4.073) 7.039 15.947 ( 4.051 2.919 7.827) 9.284 16.991 ( -1.093 -1.797 -3.109) 3.753 17.164 ( -5.944 -1.408 3.302) 6.944 17.191 ( 0.916 -5.469 -6.679) 8.681 18.910 ( -1.029 3.424 3.521) 5.018 ======================= Grid point 3 (4/294) ======================= q-point: ( 0.25 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.615 ( 28.878 -5.352 18.401) 34.658 1.789 ( 18.616 22.227 8.161) 30.120 2.063 ( 21.150 18.806 9.021) 29.705 3.591 ( -7.292 -7.620 -3.044) 10.978 3.780 ( -10.234 2.955 -2.594) 10.963 4.963 ( -16.939 -6.614 -5.111) 18.889 5.136 ( -4.764 -7.861 -7.534) 11.885 5.280 ( -1.584 -4.878 1.469) 5.335 6.079 ( 0.227 1.534 4.438) 4.701 6.339 ( 0.252 0.488 -2.605) 2.662 7.140 ( 2.428 -0.585 -3.634) 4.410 7.596 ( 1.822 1.900 18.786) 18.969 7.671 ( 7.016 3.753 -7.957) 11.252 8.266 ( 3.353 8.854 8.643) 12.819 8.282 ( 10.072 3.133 -3.725) 11.187 9.433 ( -11.137 -6.357 0.073) 12.824 10.104 ( -8.326 -1.222 -12.949) 15.443 10.261 ( -3.884 -7.376 0.858) 8.380 15.980 ( 6.858 3.990 -5.007) 9.382 16.108 ( 4.806 3.454 9.693) 11.357 16.927 ( -0.969 -3.396 -4.217) 5.500 17.054 ( -7.988 -1.771 4.308) 9.247 17.091 ( -0.515 -6.108 -8.302) 10.319 18.956 ( -0.468 3.907 3.689) 5.394 ======================= Grid point 4 (5/294) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.142 ( 26.893 -5.199 16.790) 32.127 2.344 ( 19.669 18.841 2.921) 27.393 2.598 ( 13.876 17.817 10.477) 24.895 3.395 ( -5.908 -6.258 -2.051) 8.847 3.609 ( -11.663 2.539 -2.004) 12.103 4.563 ( -19.037 -5.449 -3.302) 20.075 4.878 ( -5.325 -13.214 -12.798) 19.151 5.229 ( -1.998 -3.591 2.659) 4.895 6.141 ( 0.958 2.914 4.087) 5.109 6.344 ( 1.313 0.033 -1.992) 2.386 7.136 ( 0.581 -0.153 -3.531) 3.581 7.723 ( 3.324 3.216 5.601) 7.263 7.839 ( 8.034 2.222 5.072) 9.757 8.372 ( 5.406 1.468 -4.510) 7.192 8.538 ( 5.541 12.014 10.004) 16.587 9.178 ( -10.480 -7.583 -0.390) 12.942 9.833 ( -7.727 -8.039 -15.007) 18.697 10.154 ( -4.898 -1.758 1.872) 5.530 16.118 ( 7.785 5.357 -4.987) 10.685 16.284 ( 4.941 3.257 10.047) 11.660 16.835 ( -2.249 -5.550 -3.773) 7.077 16.925 ( -7.085 -2.401 2.090) 7.768 16.966 ( -2.505 -4.112 -6.639) 8.201 19.010 ( 0.062 3.281 3.025) 4.463 ======================= Grid point 5 (6/294) ======================= q-point: ( 0.42 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.602 ( 22.660 -6.316 14.291) 27.524 2.832 ( 19.085 14.001 -3.229) 23.889 2.964 ( 2.287 16.255 5.900) 17.444 3.254 ( -3.713 -4.340 -1.270) 5.851 3.416 ( -12.214 -0.845 2.486) 12.493 4.223 ( -14.611 -1.152 -0.957) 14.688 4.581 ( -4.121 -13.320 -12.227) 18.545 5.180 ( -1.625 -2.213 1.525) 3.141 6.203 ( 0.273 2.725 3.015) 4.073 6.350 ( 1.274 -1.060 -1.573) 2.286 7.122 ( -0.040 0.224 -2.165) 2.177 7.839 ( 4.092 2.666 0.572) 4.917 8.010 ( 5.171 1.026 7.750) 9.374 8.431 ( 3.572 2.113 -5.926) 7.235 8.763 ( -1.850 6.839 9.194) 11.607 8.998 ( -0.760 -1.138 2.879) 3.187 9.522 ( -7.398 -10.796 -14.305) 19.388 10.086 ( -3.226 -0.033 1.054) 3.394 16.277 ( 7.387 6.227 -3.845) 10.398 16.452 ( 4.987 2.180 8.523) 10.113 16.694 ( -6.388 -5.880 1.143) 8.757 16.796 ( -3.332 -3.357 -6.798) 8.282 16.872 ( -2.527 -1.209 -0.970) 2.965 19.053 ( 0.197 1.844 1.682) 2.504 ======================= Grid point 6 (7/294) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 436 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.878 ( -0.000 0.000 -0.000) 0.000 3.024 ( 0.000 0.000 0.000) 0.000 3.153 ( -0.000 0.000 0.000) 0.000 3.180 ( 0.000 -0.000 0.000) 0.000 3.241 ( 0.000 0.000 -0.000) 0.000 4.090 ( 0.000 0.000 0.000) 0.000 4.419 ( 0.000 0.000 0.000) 0.000 5.160 ( 0.000 0.000 -0.000) 0.000 6.229 ( 0.000 0.000 0.000) 0.000 6.350 ( 0.000 -0.000 -0.000) 0.000 7.116 ( 0.000 0.000 0.000) 0.000 7.892 ( 0.000 0.000 -0.000) 0.000 8.092 ( 0.000 -0.000 0.000) 0.000 8.458 ( 0.000 -0.000 0.000) 0.000 8.734 ( 0.000 0.000 0.000) 0.000 9.172 ( 0.000 -0.000 -0.000) 0.000 9.243 ( 0.000 0.000 0.000) 0.000 10.062 ( 0.000 0.000 0.000) 0.000 16.391 ( 0.000 -0.000 0.000) 0.000 16.568 ( 0.000 -0.000 -0.000) 0.000 16.574 ( -0.000 0.000 0.000) 0.000 16.701 ( 0.000 0.000 0.000) 0.000 16.842 ( 0.000 0.000 -0.000) 0.000 19.069 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 14 (8/294) ======================= q-point: ( 0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.415 ( -8.982 14.866 10.259) 20.172 0.471 ( 1.704 11.923 18.990) 22.487 1.086 ( 2.536 37.186 28.637) 47.003 4.018 ( -0.880 -4.023 -3.282) 5.266 4.049 ( 2.510 -3.094 0.113) 3.985 5.157 ( -0.879 -1.278 3.346) 3.688 5.247 ( 2.012 2.454 -0.634) 3.237 5.694 ( -2.402 -11.157 -5.964) 12.877 6.220 ( 0.428 -13.818 1.067) 13.866 6.507 ( -0.380 0.295 4.197) 4.224 6.822 ( -1.361 9.177 -5.304) 10.686 7.260 ( 0.273 0.425 2.645) 2.692 7.763 ( 7.069 -3.201 3.234) 8.407 7.874 ( -7.400 3.410 1.620) 8.307 8.012 ( 2.579 10.536 2.930) 11.236 9.827 ( 1.720 -9.218 2.890) 9.812 10.300 ( 3.195 -3.640 -6.493) 8.101 10.528 ( -4.931 2.218 -8.873) 10.391 15.777 ( 0.029 -0.280 -1.165) 1.198 15.880 ( 0.001 5.585 5.101) 7.564 17.023 ( -0.214 -1.173 -2.246) 2.543 17.265 ( -1.123 1.178 -1.445) 2.176 17.295 ( -2.869 1.389 2.669) 4.157 18.829 ( 3.469 -5.835 -0.032) 6.788 ======================= Grid point 15 (9/294) ======================= q-point: ( 0.17 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.727 ( 18.833 -0.110 24.122) 30.604 0.934 ( 23.624 16.676 -0.176) 28.917 1.684 ( 5.854 35.039 27.782) 45.098 3.863 ( -8.030 -6.001 -2.053) 10.233 4.023 ( -2.660 -1.088 -1.242) 3.131 5.154 ( 0.102 -1.680 -0.689) 1.819 5.298 ( -0.614 2.634 0.795) 2.819 5.427 ( -5.764 -14.419 -13.080) 20.303 6.108 ( -1.781 -9.145 4.968) 10.558 6.447 ( -6.994 2.816 1.282) 7.647 6.941 ( 9.362 0.793 -5.072) 10.677 7.322 ( 5.622 -1.486 3.512) 6.793 7.785 ( -7.566 3.807 4.301) 9.500 7.923 ( 10.574 0.233 -0.075) 10.577 8.203 ( 1.923 13.914 6.875) 15.638 9.714 ( -3.943 -10.785 -0.956) 11.523 10.255 ( 1.854 -7.815 -9.782) 12.657 10.400 ( -6.723 2.621 -4.005) 8.253 15.793 ( 3.119 0.099 -1.838) 3.622 15.996 ( 2.044 6.834 7.014) 10.004 16.972 ( -1.954 -2.403 -3.217) 4.465 17.182 ( -6.308 3.241 -6.752) 9.792 17.257 ( -3.897 -2.150 5.986) 7.459 18.877 ( 6.595 -4.761 0.077) 8.134 ======================= Grid point 16 (10/294) ======================= q-point: ( 0.25 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.234 ( 25.059 -2.780 22.829) 34.013 1.497 ( 26.617 14.531 -4.786) 30.700 2.282 ( 6.805 31.966 25.948) 41.730 3.647 ( -8.850 -6.179 -1.372) 10.881 3.933 ( -6.575 0.768 -1.721) 6.839 5.017 ( -7.816 -14.629 -9.496) 19.112 5.127 ( -6.369 -2.753 -10.741) 12.787 5.290 ( -2.421 -3.416 4.205) 5.934 6.056 ( 1.219 -6.355 3.743) 7.476 6.401 ( -3.758 5.825 0.177) 6.934 7.040 ( 6.076 -0.681 -4.793) 7.768 7.460 ( 10.879 -3.339 3.123) 11.801 7.746 ( -4.400 3.022 5.784) 7.871 8.101 ( 10.362 0.866 -3.104) 10.851 8.433 ( 1.554 16.762 10.790) 19.996 9.491 ( -6.573 -12.965 -4.260) 15.147 10.077 ( -5.481 -6.890 -12.309) 15.134 10.318 ( -4.856 1.030 0.320) 4.975 15.861 ( 6.051 0.839 -2.432) 6.575 16.157 ( 3.214 7.035 8.337) 11.372 16.874 ( -2.540 -4.454 -4.967) 7.139 17.071 ( -4.704 2.253 -7.564) 9.188 17.187 ( -6.208 -2.813 6.435) 9.373 18.938 ( 5.232 -3.236 -0.130) 6.153 ======================= Grid point 17 (11/294) ======================= q-point: ( 0.33 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.765 ( 25.653 -2.953 19.532) 32.378 2.035 ( 25.972 12.185 -5.905) 29.290 2.826 ( 5.256 27.510 22.417) 35.874 3.445 ( -7.698 -5.405 -0.201) 9.408 3.802 ( -9.428 1.912 -1.674) 9.765 4.639 ( -8.748 -16.993 -12.425) 22.796 4.890 ( -12.179 -2.708 -8.168) 14.912 5.237 ( -2.076 -5.052 4.417) 7.025 6.058 ( 4.284 -6.314 0.404) 7.641 6.426 ( -2.518 8.268 1.333) 8.745 7.082 ( 3.047 -0.344 -4.091) 5.113 7.642 ( 11.958 -0.411 -2.108) 12.149 7.774 ( 0.914 -1.196 10.580) 10.686 8.238 ( 8.020 0.645 -4.599) 9.268 8.706 ( 2.294 17.524 12.183) 21.465 9.210 ( -6.891 -13.839 -6.350) 16.714 9.813 ( -9.479 -6.048 -11.282) 15.929 10.245 ( -5.193 0.361 0.971) 5.296 15.979 ( 8.369 1.581 -2.597) 8.904 16.332 ( 3.351 6.508 8.748) 11.406 16.749 ( -1.770 -6.222 -6.143) 8.921 16.975 ( -4.086 2.377 -7.030) 8.472 17.076 ( -8.289 -3.205 6.651) 11.100 18.986 ( 4.301 -2.757 -1.128) 5.232 ======================= Grid point 18 (12/294) ======================= q-point: ( 0.42 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.255 ( 23.250 -3.528 15.502) 28.166 2.524 ( 23.604 10.381 -6.339) 26.553 3.208 ( -0.656 15.993 9.900) 18.820 3.298 ( -5.566 -1.251 4.758) 7.428 3.632 ( -11.973 1.340 -0.353) 12.052 4.274 ( -6.711 -15.278 -11.853) 20.468 4.625 ( -11.893 0.674 -2.365) 12.144 5.180 ( -1.300 -4.921 2.509) 5.675 6.067 ( 5.447 -7.482 -2.880) 9.693 6.476 ( -3.498 9.323 2.858) 10.360 7.094 ( 1.582 -0.505 -2.624) 3.105 7.796 ( 5.858 6.494 -6.855) 11.112 7.885 ( 8.842 -8.897 12.329) 17.588 8.334 ( 6.101 0.529 -3.461) 7.034 8.870 ( -4.226 -6.722 -5.143) 9.460 9.054 ( 1.798 10.862 9.991) 14.868 9.515 ( -11.302 -5.762 -9.677) 15.955 10.165 ( -5.121 0.078 0.827) 5.188 16.135 ( 9.846 1.871 -2.277) 10.278 16.474 ( 1.443 1.784 4.373) 4.938 16.648 ( 0.517 -3.055 -1.768) 3.567 16.899 ( -3.630 4.155 -6.918) 8.849 16.933 ( -9.490 -3.951 7.203) 12.551 19.012 ( 3.630 -3.330 -2.634) 5.586 ======================= Grid point 19 (13/294) ======================= q-point: ( 0.50 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.640 ( 17.388 -5.925 10.159) 20.992 2.928 ( 17.606 9.563 -9.007) 21.967 3.158 ( -4.867 -6.420 -1.494) 8.193 3.293 ( -9.371 8.899 -1.447) 13.004 3.424 ( -13.449 -3.706 5.711) 15.074 4.005 ( -2.740 -9.585 -7.678) 12.583 4.565 ( -3.467 11.254 8.692) 14.636 5.139 ( 0.491 -3.507 0.552) 3.584 6.058 ( 5.485 -8.079 -5.187) 11.057 6.514 ( -5.069 8.877 3.297) 10.741 7.100 ( 1.255 -0.914 -0.413) 1.607 7.884 ( 1.973 3.140 -2.039) 4.232 7.983 ( 6.758 -8.773 -0.531) 11.087 8.420 ( 4.761 -1.425 2.784) 5.697 8.674 ( -0.666 -6.449 -9.730) 11.692 9.217 ( -10.112 -6.414 -6.738) 13.740 9.335 ( 3.063 16.618 12.855) 21.232 10.092 ( -3.541 -0.426 0.233) 3.574 16.304 ( 8.935 0.689 -1.365) 9.065 16.423 ( 0.212 -6.799 -5.023) 8.456 16.733 ( 2.717 2.927 5.884) 7.111 16.769 ( -9.835 0.720 3.698) 10.532 16.866 ( -2.430 4.478 -0.808) 5.159 19.008 ( 2.981 -4.619 -4.283) 6.969 ======================= Grid point 20 (14/294) ======================= q-point: (-0.42 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.698 ( -2.809 -18.401 -11.135) 21.690 2.913 ( -14.431 4.337 -10.967) 18.637 3.096 ( -4.134 -5.599 6.855) 9.769 3.255 ( 1.150 1.713 -0.414) 2.105 3.285 ( -1.101 4.694 4.477) 6.580 3.971 ( 11.263 -2.539 -1.988) 11.715 4.771 ( 1.500 15.820 13.835) 21.069 5.140 ( 2.769 -1.502 -1.282) 3.401 6.035 ( 5.050 -7.575 -6.116) 10.968 6.512 ( -6.350 6.710 2.580) 9.592 7.119 ( 1.338 -0.568 1.865) 2.365 7.869 ( -2.963 -0.549 -11.048) 11.451 7.924 ( 1.678 -12.363 1.229) 12.537 8.477 ( 0.626 -2.237 6.246) 6.664 8.638 ( 3.209 0.722 -9.682) 10.226 8.998 ( -4.392 -2.262 -3.341) 5.964 9.622 ( 4.314 12.231 13.069) 18.412 10.055 ( -0.069 0.150 -0.511) 0.537 16.267 ( -2.069 -8.556 -2.499) 9.150 16.482 ( 5.009 1.422 -4.667) 6.992 16.612 ( -4.385 -1.972 2.886) 5.608 16.839 ( 2.643 1.709 -2.076) 3.771 16.942 ( -1.177 11.423 10.601) 15.629 18.971 ( 2.450 -6.136 -5.662) 8.701 ======================= Grid point 21 (15/294) ======================= q-point: (-0.33 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.224 ( -12.142 -24.856 -19.513) 33.852 2.560 ( -24.705 7.134 -14.483) 29.513 2.856 ( -20.475 -8.374 11.407) 24.889 3.369 ( 7.377 3.708 -1.254) 8.351 3.425 ( 8.056 1.554 6.230) 10.302 4.268 ( 21.215 3.153 1.479) 21.499 5.029 ( 1.933 12.838 11.952) 17.647 5.185 ( 4.431 0.606 -2.038) 4.915 6.009 ( 4.156 -6.058 -5.815) 9.370 6.468 ( -6.370 3.896 2.040) 7.741 7.155 ( 1.001 0.544 3.042) 3.248 7.670 ( -2.787 -7.435 -17.888) 19.571 7.849 ( -2.522 -9.220 7.583) 12.202 8.454 ( -5.295 3.333 -7.349) 9.652 8.561 ( -5.885 -3.877 3.696) 7.958 9.053 ( 9.511 3.305 -1.345) 10.159 9.854 ( 5.582 3.233 9.984) 11.886 10.110 ( 3.819 5.557 0.588) 6.769 16.132 ( -2.580 -8.369 -1.610) 8.904 16.374 ( -9.792 0.473 -2.468) 10.110 16.715 ( 10.236 0.115 -0.420) 10.245 16.886 ( 2.624 1.971 -2.121) 3.908 17.111 ( -1.123 11.635 11.803) 16.611 18.908 ( 2.290 -7.204 -6.144) 9.741 ======================= Grid point 22 (16/294) ======================= q-point: (-0.25 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.634 ( -13.826 -25.554 -20.768) 35.714 2.085 ( -29.092 6.741 -13.575) 32.803 2.428 ( -27.767 -7.889 8.082) 29.976 3.539 ( 9.667 2.042 -0.061) 9.881 3.624 ( 7.981 2.856 7.615) 11.394 4.698 ( 22.798 5.258 2.397) 23.519 5.177 ( 1.537 2.998 1.522) 3.697 5.289 ( 3.585 4.623 3.537) 6.837 5.989 ( 2.954 -3.693 -4.654) 6.635 6.417 ( -4.515 2.681 2.484) 5.809 7.189 ( -0.446 1.065 2.689) 2.926 7.452 ( -0.955 -7.318 -17.556) 19.044 7.759 ( -3.946 -8.406 9.663) 13.402 8.290 ( -9.230 3.883 -11.876) 15.534 8.452 ( -8.929 -2.712 8.109) 12.363 9.275 ( 12.681 3.227 -0.605) 13.100 10.008 ( 7.795 -2.336 4.957) 9.529 10.274 ( 5.167 8.253 2.558) 10.068 16.004 ( -2.799 -6.985 -0.780) 7.566 16.199 ( -9.904 1.020 -2.332) 10.226 16.886 ( 9.679 0.829 -0.733) 9.742 16.937 ( 2.818 1.608 -1.801) 3.711 17.256 ( -2.183 9.678 9.636) 13.831 18.843 ( 2.534 -6.847 -4.758) 8.714 ======================= Grid point 23 (17/294) ======================= q-point: (-0.17 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.033 ( -14.944 -22.423 -19.222) 33.100 1.570 ( -31.014 7.149 -11.129) 33.717 1.889 ( -33.076 -7.206 7.265) 34.622 3.717 ( 10.854 -1.028 -0.178) 10.904 3.835 ( 6.479 5.649 7.096) 11.146 5.107 ( 14.721 3.819 0.741) 15.227 5.208 ( 2.660 -0.078 0.249) 2.672 5.391 ( 5.007 0.876 0.909) 5.164 5.988 ( 2.823 -1.073 -2.790) 4.112 6.412 ( -1.342 2.917 2.667) 4.174 7.154 ( -3.890 -2.176 -3.228) 5.504 7.318 ( 0.735 -2.407 -8.367) 8.737 7.690 ( -2.688 -6.017 9.951) 11.935 8.108 ( -9.751 5.462 -9.371) 14.586 8.299 ( -10.405 -3.546 5.572) 12.324 9.508 ( 11.928 1.657 0.505) 12.053 10.148 ( 7.964 -0.960 3.102) 8.600 10.437 ( 5.418 4.258 0.228) 6.894 15.898 ( -2.769 -4.335 -0.295) 5.153 16.040 ( -8.880 1.195 -1.478) 9.081 16.984 ( 2.311 0.642 -0.437) 2.438 17.041 ( 8.203 1.501 -1.815) 8.534 17.328 ( -2.871 4.889 4.001) 6.939 18.814 ( 2.566 -4.110 -0.821) 4.914 ======================= Grid point 24 (18/294) ======================= q-point: (-0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.521 ( -16.460 -4.828 -7.248) 18.622 1.061 ( -31.589 6.419 -4.451) 32.540 1.289 ( -36.774 -3.322 6.255) 37.450 3.876 ( 10.116 -1.923 -0.900) 10.337 4.006 ( 4.264 2.324 3.464) 5.965 5.148 ( -1.079 -0.082 -1.092) 1.537 5.278 ( -1.144 -0.961 1.878) 2.400 5.586 ( 14.238 0.349 -2.879) 14.531 6.056 ( 7.962 0.060 0.436) 7.974 6.440 ( 1.045 0.326 -0.183) 1.110 7.021 ( -6.923 -0.065 -2.806) 7.470 7.284 ( -2.009 0.543 0.424) 2.124 7.683 ( 1.250 -3.332 5.878) 6.871 7.965 ( -8.355 5.852 -4.894) 11.314 8.121 ( -9.570 -3.047 2.728) 10.408 9.698 ( 8.901 -0.430 1.478) 9.033 10.287 ( 5.543 1.288 3.486) 6.673 10.530 ( 5.481 -0.890 -5.079) 7.525 15.831 ( -2.335 -0.360 0.127) 2.366 15.911 ( -6.865 0.382 -0.040) 6.876 17.019 ( 1.884 0.075 -0.913) 2.094 17.163 ( 5.676 1.275 -0.902) 5.887 17.302 ( -2.158 -1.552 -3.160) 4.129 18.842 ( 1.617 0.161 4.047) 4.361 ======================= Grid point 26 (19/294) ======================= q-point: ( 0.08 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.894 ( -21.224 1.633 26.662) 34.118 0.943 ( -25.681 18.564 -2.566) 31.791 1.606 ( -1.865 35.234 27.072) 44.472 3.893 ( 5.474 -5.451 -5.057) 9.233 3.920 ( 7.377 -4.906 -0.513) 8.874 5.182 ( -0.178 -0.883 -2.344) 2.511 5.240 ( -0.406 -0.954 0.719) 1.262 5.519 ( 4.848 -9.183 -9.120) 13.820 6.086 ( 2.115 -8.929 3.258) 9.737 6.455 ( 7.016 2.417 1.494) 7.570 7.009 ( -10.808 3.747 -3.914) 12.090 7.309 ( -6.293 -2.695 2.740) 7.374 7.649 ( 4.499 -2.741 3.559) 6.358 8.058 ( -7.433 5.631 0.129) 9.326 8.118 ( 0.973 12.074 6.787) 13.885 9.667 ( 3.821 -11.525 -2.767) 12.454 10.196 ( 2.026 -3.986 -5.709) 7.252 10.513 ( 2.619 0.105 -5.676) 6.252 15.792 ( -3.159 -0.067 -1.788) 3.630 15.991 ( -1.754 6.659 6.505) 9.473 16.992 ( 0.767 -0.939 -2.746) 3.002 17.253 ( 2.820 -0.793 2.277) 3.710 17.299 ( 6.966 5.264 -0.428) 8.742 18.770 ( -5.600 -8.701 -2.180) 10.574 ======================= Grid point 27 (20/294) ======================= q-point: ( 0.17 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.826 ( -8.137 15.236 9.483) 19.705 0.919 ( 0.433 10.736 18.241) 21.171 2.122 ( 2.456 34.302 27.157) 43.820 3.862 ( -0.185 -6.439 -4.776) 8.019 3.970 ( 4.413 -4.877 -0.292) 6.583 5.165 ( -2.195 -10.366 -3.862) 11.278 5.176 ( 2.509 -1.543 -5.721) 6.435 5.398 ( -3.809 -1.858 -6.083) 7.414 6.043 ( 1.061 -8.890 2.997) 9.442 6.588 ( 0.633 0.751 6.914) 6.983 6.823 ( -4.054 0.963 -7.940) 8.967 7.266 ( 1.228 -2.147 2.094) 3.241 7.762 ( 8.311 -0.745 1.640) 8.504 7.969 ( -7.756 4.220 -0.079) 8.830 8.356 ( 3.125 15.560 10.205) 18.869 9.547 ( 2.024 -16.731 -7.074) 18.277 10.167 ( 0.010 -0.824 -5.400) 5.462 10.470 ( -2.683 -0.373 -3.883) 4.734 15.756 ( 0.068 -0.001 -1.434) 1.436 16.090 ( 0.372 7.542 6.901) 10.230 16.958 ( -1.188 -2.219 -2.974) 3.896 17.268 ( -1.651 2.201 -3.494) 4.448 17.368 ( -5.083 1.873 3.490) 6.444 18.661 ( 6.491 -9.819 -2.469) 12.027 ======================= Grid point 28 (21/294) ======================= q-point: ( 0.25 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.065 ( 11.187 6.379 20.098) 23.870 1.266 ( 15.717 14.423 4.483) 21.798 2.661 ( 4.071 31.487 25.437) 40.682 3.716 ( -6.324 -6.163 -2.185) 9.097 3.967 ( 0.458 -3.249 -0.848) 3.389 4.885 ( -5.202 -20.093 -12.471) 24.214 5.140 ( -3.195 1.561 -7.502) 8.302 5.331 ( -2.763 0.149 -0.427) 2.800 5.989 ( 0.595 -8.914 3.459) 9.580 6.552 ( -6.741 3.939 3.989) 8.768 6.864 ( 9.414 -1.161 -5.307) 10.869 7.311 ( 5.218 -2.974 2.880) 6.661 7.878 ( -2.941 2.537 -0.111) 3.886 7.928 ( 6.782 0.743 -0.253) 6.827 8.625 ( 3.011 15.449 11.119) 19.271 9.334 ( -0.507 -18.312 -9.886) 20.816 10.085 ( -5.430 -0.390 -5.523) 7.755 10.398 ( -3.641 0.260 -1.490) 3.942 15.778 ( 3.238 0.485 -1.285) 3.517 16.230 ( 2.279 7.537 7.482) 10.862 16.864 ( -3.828 -4.174 -4.199) 7.051 17.182 ( -7.998 6.600 -9.318) 13.941 17.294 ( -5.615 -3.210 8.326) 10.543 18.718 ( 11.494 -9.431 -2.848) 15.138 ======================= Grid point 29 (22/294) ======================= q-point: ( 0.33 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.500 ( 19.292 1.884 21.164) 28.700 1.727 ( 21.447 13.540 -2.031) 25.445 3.150 ( 3.234 25.446 20.136) 32.610 3.538 ( -7.847 -4.063 1.919) 9.043 3.915 ( -3.626 -0.751 -1.218) 3.898 4.502 ( -6.955 -19.685 -13.629) 24.932 4.999 ( -8.247 1.331 -10.941) 13.766 5.266 ( -3.606 -4.774 4.055) 7.228 5.942 ( 1.824 -8.366 1.956) 8.782 6.553 ( -2.240 7.515 1.849) 8.057 6.969 ( 6.985 -0.999 -4.019) 8.121 7.421 ( 10.053 -4.184 2.563) 11.186 7.842 ( -3.055 1.742 2.562) 4.351 8.070 ( 9.283 -0.083 -2.991) 9.754 8.858 ( 3.340 5.331 3.251) 7.081 9.102 ( -2.443 -8.046 -3.204) 8.998 9.912 ( -10.751 0.063 -5.635) 12.139 10.332 ( -4.161 0.045 0.046) 4.162 15.857 ( 6.160 0.884 -0.926) 6.292 16.395 ( 3.082 7.096 7.813) 10.995 16.709 ( -4.480 -5.824 -6.195) 9.611 17.063 ( -6.861 6.330 -7.903) 12.231 17.211 ( -6.555 -3.882 8.055) 11.087 18.793 ( 9.978 -8.501 -4.128) 13.743 ======================= Grid point 30 (23/294) ======================= q-point: ( 0.42 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.968 ( 20.526 0.266 17.236) 26.804 2.203 ( 22.799 11.264 -3.261) 25.638 3.315 ( -4.991 -3.013 0.182) 5.833 3.531 ( -4.717 11.330 12.102) 17.236 3.815 ( -7.795 1.455 -1.897) 8.153 4.157 ( -5.201 -12.054 -8.832) 15.822 4.803 ( -8.875 2.602 -5.769) 10.900 5.178 ( -3.171 -6.366 4.184) 8.251 5.909 ( 3.029 -7.614 -0.892) 8.243 6.620 ( -1.239 9.054 1.381) 9.242 7.025 ( 3.785 -1.403 -2.593) 4.798 7.586 ( 13.149 -4.439 -0.701) 13.895 7.845 ( -0.038 0.199 3.504) 3.510 8.194 ( 8.192 -1.181 -1.827) 8.476 8.726 ( -0.711 -14.628 -13.918) 20.203 9.223 ( 1.736 12.231 13.174) 18.060 9.675 ( -13.991 2.347 -5.176) 15.101 10.255 ( -5.015 -0.543 0.643) 5.086 15.984 ( 8.401 0.769 -0.376) 8.445 16.500 ( -3.896 -1.662 -1.014) 4.356 16.599 ( 3.984 0.529 0.665) 4.074 16.986 ( -4.962 7.342 -5.695) 10.534 17.097 ( -8.406 -3.770 8.315) 12.410 18.833 ( 7.931 -8.149 -5.829) 12.778 ======================= Grid point 31 (24/294) ======================= q-point: ( 0.50 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.375 ( 17.295 -1.615 11.415) 20.785 2.653 ( 20.909 9.358 -3.691) 23.203 3.149 ( -6.107 -11.391 -3.158) 13.305 3.467 ( -7.329 -0.584 -2.056) 7.634 3.656 ( -11.998 1.760 -0.903) 12.160 3.999 ( -7.070 -0.448 -1.432) 7.227 4.770 ( -1.552 10.159 6.209) 12.007 5.098 ( -1.235 -6.015 2.243) 6.537 5.883 ( 3.572 -6.503 -3.281) 8.113 6.681 ( -3.020 8.448 0.825) 9.010 7.051 ( 2.752 -1.947 -0.070) 3.372 7.717 ( 10.479 -9.174 -5.748) 15.067 7.880 ( 1.458 1.142 1.491) 2.378 8.308 ( 7.835 -3.765 3.522) 9.379 8.532 ( 1.347 -6.011 -13.216) 14.581 9.303 ( -8.473 -4.688 1.762) 9.843 9.576 ( -3.643 17.910 6.234) 19.310 10.162 ( -5.233 -1.379 0.637) 5.449 16.141 ( 9.698 0.063 0.141) 9.699 16.356 ( -3.144 -6.210 -5.976) 9.174 16.709 ( 3.730 0.538 2.170) 4.349 16.937 ( -7.991 2.939 -2.736) 8.943 17.017 ( -4.174 6.231 10.165) 12.632 18.830 ( 6.267 -8.499 -7.446) 12.921 ======================= Grid point 32 (25/294) ======================= q-point: (-0.42 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.529 ( -1.209 -12.831 -5.600) 14.052 2.930 ( 2.475 -8.828 0.476) 9.180 2.996 ( 11.866 7.479 -7.492) 15.902 3.425 ( -5.506 8.059 0.283) 9.764 3.442 ( -11.425 -2.096 7.808) 13.996 3.859 ( -3.836 -1.397 -2.586) 4.832 4.957 ( 3.584 9.958 8.617) 13.648 5.061 ( 0.785 -2.023 1.866) 2.862 5.866 ( 3.784 -4.625 -4.627) 7.558 6.679 ( -5.400 5.339 0.033) 7.594 7.091 ( 2.757 -0.572 2.409) 3.706 7.657 ( 3.809 -15.024 -11.185) 19.113 7.914 ( -0.251 0.050 1.522) 1.543 8.426 ( 6.648 -1.574 2.939) 7.437 8.527 ( 6.230 2.785 -6.598) 9.492 9.073 ( -10.096 -4.413 -1.530) 11.124 9.771 ( 0.076 12.532 8.066) 14.903 10.081 ( -2.732 -0.349 1.105) 2.967 16.205 ( -2.029 -6.454 -4.209) 7.968 16.319 ( 10.045 0.065 -1.459) 10.151 16.725 ( -3.789 -5.445 5.954) 8.913 16.822 ( -3.179 4.534 -5.985) 8.154 17.146 ( -1.028 12.268 11.164) 16.619 18.791 ( 5.022 -8.948 -8.264) 13.175 ======================= Grid point 33 (26/294) ======================= q-point: (-0.33 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.115 ( -14.053 -19.892 -15.485) 28.861 2.899 ( -13.232 7.513 -10.972) 18.759 3.087 ( -2.005 -5.031 7.788) 9.486 3.274 ( -3.387 -1.745 4.034) 5.549 3.475 ( -2.645 6.671 6.534) 9.705 3.970 ( 17.221 2.471 0.548) 17.406 5.053 ( 6.302 -4.914 -3.248) 8.626 5.189 ( 1.147 10.133 9.295) 13.799 5.867 ( 3.734 -2.042 -4.899) 6.489 6.616 ( -6.372 2.559 0.653) 6.897 7.155 ( 2.163 1.220 3.015) 3.906 7.472 ( 0.793 -13.796 -12.824) 18.853 7.885 ( -3.326 -3.029 4.550) 6.399 8.504 ( 0.012 7.902 -11.328) 13.812 8.625 ( 1.429 -2.010 9.274) 9.597 8.944 ( 1.792 -1.458 -1.229) 2.617 9.849 ( -0.002 -0.835 1.968) 2.138 10.137 ( 2.595 7.194 4.432) 8.839 16.086 ( -2.246 -5.273 -3.537) 6.735 16.463 ( 4.432 0.719 -2.364) 5.074 16.609 ( -3.393 -3.254 5.059) 6.906 16.837 ( 2.798 2.251 -4.355) 5.645 17.315 ( -1.221 11.225 10.410) 15.358 18.735 ( 4.274 -8.178 -7.003) 11.584 ======================= Grid point 34 (27/294) ======================= q-point: (-0.25 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.580 ( -17.062 -16.316 -13.603) 27.247 2.547 ( -26.040 9.472 -13.539) 30.840 2.849 ( -22.787 -7.958 13.177) 27.500 3.357 ( 9.726 -1.419 -0.393) 9.837 3.613 ( 5.596 5.390 7.545) 10.830 4.366 ( 23.019 4.294 1.810) 23.486 5.099 ( 6.528 -3.821 -3.464) 8.319 5.311 ( 1.106 2.326 3.251) 4.147 5.893 ( 3.207 0.868 -3.925) 5.142 6.543 ( -5.718 2.110 2.137) 6.459 7.212 ( 0.692 1.249 1.589) 2.137 7.293 ( 0.200 -8.337 -9.723) 12.810 7.813 ( -4.595 -4.340 6.540) 9.095 8.424 ( -7.634 7.133 -11.952) 15.875 8.627 ( -6.898 -1.491 10.840) 12.935 9.074 ( 12.304 0.359 -0.923) 12.343 9.873 ( 6.253 -3.223 -0.418) 7.047 10.282 ( 3.536 5.365 2.892) 7.046 15.989 ( -2.526 -3.037 -1.818) 4.348 16.368 ( -9.690 -0.213 0.301) 9.697 16.713 ( 10.272 0.281 -0.611) 10.294 16.886 ( 3.504 0.711 -1.967) 4.081 17.419 ( -2.415 5.681 4.992) 7.939 18.710 ( 3.907 -4.515 -1.998) 6.296 ======================= Grid point 35 (28/294) ======================= q-point: (-0.17 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.108 ( -18.352 -4.612 -5.444) 19.690 2.094 ( -29.531 8.603 -9.131) 32.085 2.410 ( -29.503 -5.479 9.982) 31.624 3.511 ( 10.852 -2.390 -0.310) 11.116 3.812 ( 6.912 3.313 5.979) 9.721 4.802 ( 23.083 2.870 0.430) 23.265 5.146 ( 4.538 -2.858 -1.291) 5.516 5.317 ( 1.736 -4.153 -3.335) 5.602 5.940 ( 2.174 2.888 -1.493) 3.911 6.489 ( -4.033 0.753 1.121) 4.253 7.151 ( -2.003 -1.676 -4.827) 5.488 7.285 ( 1.279 1.970 2.135) 3.174 7.739 ( -4.027 -4.039 6.536) 8.675 8.291 ( -8.803 8.234 -9.203) 15.166 8.494 ( -12.369 -3.822 8.248) 15.350 9.296 ( 13.890 -0.988 0.639) 13.940 10.000 ( 10.650 0.195 -0.869) 10.687 10.373 ( 3.314 -0.073 -1.156) 3.510 15.923 ( -2.887 0.137 -0.016) 2.890 16.203 ( -9.892 -0.045 0.508) 9.905 16.879 ( 9.073 2.124 -4.836) 10.498 16.945 ( 4.294 -0.915 1.838) 4.760 17.393 ( -3.102 -2.210 -3.378) 5.091 18.763 ( 3.222 0.786 5.007) 6.006 ======================= Grid point 36 (29/294) ======================= q-point: (-0.08 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.894 ( -14.669 17.839 11.236) 25.684 1.630 ( -30.580 6.655 -1.114) 31.316 1.902 ( -33.186 -0.512 7.165) 33.954 3.666 ( 11.051 -2.505 -1.402) 11.418 3.941 ( 4.622 -2.945 1.187) 5.608 5.126 ( 9.553 0.778 -3.171) 10.096 5.201 ( 6.751 -5.094 3.993) 9.353 5.313 ( 8.974 -1.493 -7.045) 11.506 6.001 ( 1.938 2.483 1.994) 3.728 6.424 ( -1.999 -2.620 -2.553) 4.169 7.106 ( -2.578 3.545 -1.544) 4.647 7.349 ( -0.559 3.850 7.084) 8.082 7.685 ( -2.225 -2.188 2.701) 4.127 8.178 ( -10.020 9.242 -5.681) 14.768 8.274 ( -11.588 -6.169 6.194) 14.516 9.509 ( 12.488 -3.014 1.766) 12.968 10.201 ( 10.476 3.649 0.141) 11.094 10.373 ( 3.138 -5.695 -6.756) 9.377 15.896 ( -2.999 3.938 0.635) 4.990 16.047 ( -8.861 -0.812 1.716) 9.062 16.961 ( 3.675 0.890 -4.367) 5.777 17.061 ( 7.388 -0.050 1.639) 7.568 17.261 ( -2.152 -5.957 -8.151) 10.322 18.869 ( 1.637 2.506 7.884) 8.433 ======================= Grid point 38 (30/294) ======================= q-point: ( 0.08 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.452 ( -25.239 2.817 19.329) 31.915 1.538 ( -26.212 14.932 0.599) 30.173 2.141 ( -4.246 30.987 24.750) 39.885 3.693 ( 7.606 -4.211 -8.014) 11.824 3.734 ( 6.608 -8.466 1.035) 10.789 5.007 ( 9.545 -12.386 -8.430) 17.764 5.203 ( 3.731 -1.199 -4.338) 5.846 5.362 ( 3.587 -0.952 0.306) 3.723 6.032 ( -1.765 -5.363 1.842) 5.939 6.392 ( 4.287 4.110 0.371) 5.951 7.122 ( -2.437 2.882 -4.621) 5.966 7.454 ( -13.317 -4.877 -2.507) 14.402 7.630 ( -1.246 -2.947 11.036) 11.491 8.211 ( -6.249 5.598 -4.421) 9.483 8.300 ( -1.070 12.510 11.106) 16.763 9.460 ( 4.219 -12.329 -4.597) 13.818 10.062 ( 5.261 -3.700 -6.459) 9.115 10.397 ( 6.942 -0.514 -3.499) 7.791 15.858 ( -5.981 0.580 -2.720) 6.596 16.139 ( -3.190 6.227 7.352) 10.149 16.945 ( 1.819 -1.052 -2.624) 3.362 17.178 ( 9.300 -2.567 8.805) 13.061 17.193 ( 6.699 5.753 -8.872) 12.517 18.802 ( -9.102 -8.505 -2.015) 12.619 ======================= Grid point 39 (31/294) ======================= q-point: ( 0.17 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.271 ( -15.813 7.011 19.645) 26.175 1.286 ( -20.667 15.437 5.036) 26.282 2.580 ( 0.617 31.325 25.297) 40.269 3.702 ( 6.277 -7.113 -5.320) 10.876 3.805 ( 7.733 -5.599 -1.619) 9.683 4.919 ( 3.559 -16.724 -11.009) 20.336 5.201 ( -0.439 0.497 -2.312) 2.406 5.390 ( 0.826 -0.235 -0.957) 1.286 5.964 ( -0.028 -6.516 -0.225) 6.520 6.528 ( 6.695 2.782 1.092) 7.332 6.976 ( -13.110 -1.326 -3.577) 13.654 7.260 ( -2.394 -3.299 1.571) 4.368 7.671 ( 3.152 -1.285 4.768) 5.859 8.122 ( -7.020 4.294 -3.548) 8.961 8.520 ( 2.395 14.162 10.174) 17.601 9.318 ( 0.674 -15.157 -7.212) 16.799 10.108 ( 4.229 0.204 -3.233) 5.327 10.436 ( 2.298 -1.705 -3.964) 4.889 15.774 ( -3.006 0.435 -1.535) 3.403 16.207 ( -1.118 6.807 6.184) 9.265 16.931 ( -0.064 -2.182 -2.572) 3.373 17.256 ( 2.526 0.880 -1.788) 3.218 17.398 ( 7.452 3.539 1.856) 8.457 18.528 ( -6.428 -11.792 -4.067) 14.032 ======================= Grid point 40 (32/294) ======================= q-point: ( 0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.235 ( -6.866 15.242 8.978) 18.976 1.329 ( -1.145 9.389 16.850) 19.323 3.045 ( 2.605 27.410 22.408) 35.500 3.682 ( 1.459 -5.386 -3.075) 6.372 3.855 ( 6.030 -5.906 -1.317) 8.542 4.678 ( -2.435 -19.475 -11.760) 22.880 5.176 ( -2.418 1.896 -3.546) 4.692 5.369 ( -2.188 1.099 -3.773) 4.498 5.901 ( 1.160 -8.747 0.744) 8.855 6.669 ( 8.119 0.234 -0.901) 8.172 6.746 ( -10.044 -0.806 1.980) 10.269 7.250 ( 1.497 -1.746 1.496) 2.743 7.766 ( 6.872 -0.173 0.523) 6.894 8.023 ( -6.556 2.998 -2.382) 7.592 8.724 ( 3.884 4.848 2.476) 6.688 9.156 ( -0.988 -7.798 -1.647) 8.031 10.129 ( -1.181 1.574 -2.755) 3.385 10.414 ( -0.291 -1.197 -2.655) 2.927 15.748 ( 0.171 0.683 -0.837) 1.094 16.310 ( 1.369 6.583 5.567) 8.729 16.860 ( -3.027 -3.869 -3.284) 5.909 17.265 ( -1.393 2.907 -4.985) 5.937 17.441 ( -6.521 1.434 2.805) 7.242 18.402 ( 8.595 -12.701 -3.354) 15.699 ======================= Grid point 41 (33/294) ======================= q-point: ( 0.33 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.444 ( 7.162 8.993 16.616) 20.205 1.592 ( 10.484 12.373 6.196) 17.361 3.388 ( 1.298 8.166 7.363) 11.072 3.665 ( -2.687 7.550 9.176) 12.183 3.879 ( 3.494 -4.105 -1.513) 5.599 4.354 ( -5.705 -16.585 -9.611) 20.000 5.083 ( -7.138 3.079 -9.571) 12.330 5.300 ( -3.201 -2.295 -0.697) 4.000 5.845 ( 1.631 -9.711 2.567) 10.176 6.660 ( -2.102 3.142 -0.414) 3.802 6.803 ( 7.677 -0.936 0.846) 7.780 7.283 ( 4.029 -3.102 1.810) 5.397 7.886 ( 6.404 -0.457 -0.886) 6.481 7.945 ( -2.622 1.811 -1.806) 3.663 8.689 ( 2.420 -13.529 -12.426) 18.528 9.201 ( -0.183 9.896 11.755) 15.367 10.059 ( -7.402 2.930 -3.351) 8.638 10.377 ( -1.819 -0.871 -0.713) 2.139 15.782 ( 3.322 0.821 -0.140) 3.425 16.440 ( 3.624 4.714 3.807) 7.061 16.718 ( -6.341 -3.982 -3.358) 8.206 17.199 ( -6.313 6.912 -9.472) 13.317 17.333 ( -7.204 -3.263 8.171) 11.372 18.463 ( 13.477 -11.860 -4.475) 18.502 ======================= Grid point 42 (34/294) ======================= q-point: ( 0.42 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.803 ( 14.195 4.616 17.135) 22.725 1.967 ( 17.155 12.044 0.625) 20.970 3.338 ( -4.041 -8.204 -1.961) 9.353 3.733 ( -7.317 -0.210 0.461) 7.335 3.836 ( 0.674 -5.178 -4.619) 6.971 4.200 ( -3.962 7.396 7.303) 11.124 4.913 ( -7.665 3.409 -9.481) 12.660 5.215 ( -4.055 -4.784 3.775) 7.320 5.800 ( 1.834 -8.303 1.629) 8.658 6.701 ( 1.274 6.468 -1.670) 6.801 6.911 ( 6.190 -1.904 0.148) 6.477 7.349 ( 7.924 -5.711 0.499) 9.780 7.882 ( -1.865 0.692 0.231) 2.003 8.025 ( 8.492 -1.855 -1.450) 8.812 8.498 ( 1.194 -12.133 -13.908) 18.495 9.382 ( 0.301 8.271 11.955) 14.540 9.917 ( -11.514 6.798 -3.268) 13.765 10.323 ( -3.541 -1.306 0.785) 3.855 15.869 ( 6.037 0.448 0.583) 6.081 16.477 ( -0.707 -7.270 -7.737) 10.640 16.626 ( -2.281 6.111 5.523) 8.546 17.115 ( -5.333 8.257 -7.092) 12.120 17.241 ( -6.576 -3.553 9.685) 12.234 18.531 ( 11.705 -11.209 -6.726) 17.547 ======================= Grid point 43 (35/294) ======================= q-point: ( 0.50 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.180 ( 14.970 2.787 11.695) 19.200 2.386 ( 19.747 8.887 0.514) 21.660 3.100 ( -7.547 -15.689 -6.909) 18.730 3.539 ( -5.879 -2.000 -3.796) 7.279 3.785 ( -3.315 -1.745 -0.408) 3.768 4.210 ( -11.858 8.906 0.649) 14.845 4.862 ( 0.199 3.939 1.883) 4.370 5.134 ( -4.056 -1.646 5.672) 7.165 5.768 ( 2.258 -5.881 -0.649) 6.333 6.774 ( 0.580 6.789 -3.214) 7.533 6.978 ( 3.926 -2.130 2.196) 4.977 7.415 ( 9.167 -10.205 -4.318) 14.381 7.881 ( 0.581 1.078 0.253) 1.251 8.139 ( 8.929 -4.405 1.817) 10.121 8.373 ( 2.984 -3.158 -11.446) 12.243 9.423 ( -7.121 -2.311 4.843) 8.917 9.851 ( -6.428 15.350 1.849) 16.744 10.240 ( -5.172 -2.261 1.554) 5.854 15.994 ( 8.027 -0.449 1.194) 8.127 16.314 ( -3.245 -6.401 -7.401) 10.309 16.690 ( 0.431 2.412 1.561) 2.905 17.069 ( -6.042 3.232 -2.488) 7.290 17.208 ( -3.488 5.663 10.895) 12.765 18.552 ( 9.387 -10.938 -8.701) 16.836 ======================= Grid point 44 (36/294) ======================= q-point: ( 0.58 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.417 ( 2.714 -4.748 -0.163) 5.471 2.765 ( 12.929 -5.289 3.265) 14.345 2.813 ( 4.067 -0.228 -6.506) 7.676 3.507 ( 0.820 4.380 2.979) 5.360 3.665 ( -9.823 0.339 -1.193) 9.901 4.022 ( -14.340 2.964 -2.676) 14.885 4.892 ( 1.799 -6.387 1.599) 6.826 5.175 ( -0.375 8.190 7.845) 11.347 5.757 ( 2.851 -2.763 -2.657) 4.777 6.788 ( -2.919 3.823 -2.416) 5.383 7.051 ( 3.895 0.159 3.563) 5.281 7.376 ( 5.104 -13.815 -8.258) 16.885 7.915 ( 1.422 0.301 1.179) 1.872 8.282 ( 10.027 0.662 -0.395) 10.057 8.404 ( 6.887 1.380 -3.929) 8.048 9.221 ( -12.457 -4.164 0.369) 13.140 9.945 ( -3.251 10.496 2.256) 11.217 10.146 ( -3.896 -0.584 3.248) 5.106 16.134 ( 7.079 -2.538 1.325) 7.636 16.179 ( -0.317 -2.728 -5.835) 6.449 16.709 ( 0.840 -1.241 0.779) 1.689 16.948 ( -8.367 0.891 -1.258) 8.507 17.340 ( -0.448 11.028 10.644) 15.333 18.537 ( 7.777 -10.055 -8.975) 15.560 ======================= Grid point 45 (37/294) ======================= q-point: (-0.33 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.124 ( -14.501 -12.435 -9.098) 21.158 2.895 ( 9.887 -1.973 5.897) 11.680 3.050 ( 7.481 6.285 -5.292) 11.112 3.457 ( -13.429 -0.363 0.763) 13.456 3.669 ( 2.006 8.190 9.070) 12.384 3.815 ( -4.648 -0.595 -2.782) 5.450 4.867 ( 4.763 -8.242 -1.541) 9.643 5.288 ( 0.599 4.456 3.862) 5.927 5.781 ( 3.348 1.051 -3.416) 4.897 6.740 ( -5.281 2.323 0.761) 5.819 7.141 ( 3.394 1.409 2.258) 4.313 7.258 ( 2.207 -11.509 -6.817) 13.558 7.930 ( -1.033 -0.886 2.975) 3.271 8.452 ( 7.486 10.087 -12.854) 17.972 8.564 ( 9.424 -1.938 10.060) 13.920 8.989 ( -9.579 -3.634 0.278) 10.249 9.881 ( -6.045 -3.153 -1.490) 6.979 10.199 ( 1.324 6.308 4.026) 7.600 16.070 ( -2.393 -1.730 -3.010) 4.217 16.306 ( 10.202 -0.505 -0.260) 10.218 16.696 ( -2.545 -5.219 6.291) 8.561 16.826 ( -4.277 3.822 -6.419) 8.609 17.481 ( -1.194 7.492 6.949) 10.288 18.531 ( 7.007 -6.185 -5.128) 10.660 ======================= Grid point 46 (38/294) ======================= q-point: (-0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.719 ( -17.533 -4.833 -4.083) 18.640 2.937 ( -15.378 10.795 -11.670) 22.118 3.089 ( -0.119 -4.315 7.380) 8.550 3.284 ( -6.928 -3.983 6.471) 10.283 3.637 ( -1.617 0.889 5.136) 5.457 4.064 ( 19.038 5.739 1.174) 19.919 4.886 ( 8.240 -7.440 -3.045) 11.512 5.304 ( -0.008 -2.617 -2.771) 3.811 5.849 ( 3.323 4.643 -2.323) 6.164 6.669 ( -6.091 0.551 2.037) 6.446 7.162 ( 1.573 -3.904 -4.396) 6.086 7.229 ( 1.994 0.961 3.953) 4.531 7.900 ( -4.080 -0.612 3.890) 5.670 8.516 ( -2.489 8.653 -12.683) 15.554 8.747 ( 2.795 -0.475 13.029) 13.334 8.898 ( 3.965 -2.012 -0.807) 4.518 9.758 ( 0.165 -5.528 -3.250) 6.415 10.291 ( 1.834 2.835 1.031) 3.530 16.015 ( -2.623 1.427 -0.773) 3.085 16.448 ( 4.471 0.361 -1.775) 4.824 16.610 ( -2.517 -3.377 5.436) 6.877 16.819 ( 2.812 1.647 -4.643) 5.672 17.496 ( -2.868 -1.191 -1.574) 3.482 18.610 ( 6.238 0.820 2.944) 6.947 ======================= Grid point 47 (39/294) ======================= q-point: (-0.17 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.442 ( -17.151 8.874 5.785) 20.158 2.597 ( -26.027 11.148 -11.085) 30.406 2.874 ( -23.338 -6.647 14.095) 28.062 3.320 ( 8.688 -1.885 -0.265) 8.894 3.733 ( 7.056 -1.914 4.060) 8.363 4.452 ( 21.050 2.912 -0.367) 21.253 4.953 ( 10.022 -6.884 -3.418) 12.631 5.231 ( 0.020 -4.600 -5.932) 7.507 5.944 ( 2.431 6.252 -0.435) 6.722 6.563 ( -5.635 -3.431 0.006) 6.597 7.153 ( -0.126 2.029 -1.686) 2.641 7.315 ( 1.961 3.403 7.751) 8.689 7.836 ( -5.772 0.517 2.962) 6.508 8.431 ( -6.465 5.982 -8.210) 12.041 8.729 ( -11.468 -1.561 9.574) 15.020 9.046 ( 13.726 -2.565 0.150) 13.965 9.790 ( 10.817 -1.768 -4.512) 11.853 10.317 ( 1.143 -2.229 -2.102) 3.270 15.999 ( -3.015 4.579 1.204) 5.613 16.366 ( -9.083 -1.025 1.235) 9.224 16.710 ( 9.880 0.858 -1.708) 10.063 16.867 ( 4.237 -0.717 -0.896) 4.390 17.361 ( -3.529 -7.553 -8.310) 11.771 18.770 ( 4.506 4.729 8.469) 10.695 ======================= Grid point 48 (40/294) ======================= q-point: (-0.08 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.415 ( -12.667 23.176 16.362) 31.069 2.188 ( -28.458 8.799 -3.359) 29.976 2.464 ( -28.502 -1.764 10.299) 30.357 3.456 ( 10.037 -2.376 -1.070) 10.370 3.816 ( 5.202 -6.771 0.055) 8.539 4.786 ( 19.422 -4.202 -2.556) 20.035 5.034 ( 10.354 -5.208 -6.567) 13.321 5.198 ( 2.484 0.148 -1.592) 2.954 6.034 ( 0.764 5.248 2.196) 5.740 6.429 ( -4.269 -4.767 -2.048) 6.718 7.152 ( -0.999 2.491 -2.838) 3.906 7.460 ( 1.075 6.147 14.335) 15.634 7.759 ( -5.742 2.659 -1.213) 6.443 8.342 ( -5.722 5.762 -5.604) 9.866 8.504 ( -16.149 -4.898 7.936) 18.648 9.258 ( 14.132 -3.814 1.135) 14.681 9.986 ( 14.794 1.728 -6.795) 16.371 10.264 ( 0.026 -6.427 -3.268) 7.210 16.011 ( -3.606 7.389 0.826) 8.263 16.205 ( -9.497 -1.770 3.339) 10.222 16.856 ( 7.214 2.737 -6.215) 9.908 16.945 ( 6.548 -2.565 3.642) 7.920 17.173 ( -2.039 -7.664 -9.991) 12.756 18.920 ( 1.681 3.199 8.351) 9.100 ======================= Grid point 50 (41/294) ======================= q-point: ( 0.08 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.010 ( -25.051 7.311 8.235) 27.365 2.108 ( -24.498 9.491 7.827) 27.414 2.620 ( -3.401 24.156 20.805) 32.061 3.480 ( 7.176 -3.847 -6.878) 10.659 3.557 ( 4.789 -8.922 0.710) 10.151 4.622 ( 12.868 -16.057 -5.405) 21.275 5.038 ( 10.610 2.732 -11.698) 16.028 5.304 ( 3.783 -2.558 3.340) 5.658 6.048 ( -4.608 -5.433 1.623) 7.307 6.397 ( 1.626 6.276 -0.179) 6.486 7.126 ( 0.427 1.313 -3.789) 4.033 7.580 ( -10.259 -1.138 -8.911) 13.637 7.777 ( -9.086 -5.739 17.094) 20.191 8.319 ( -4.251 4.810 -6.322) 9.010 8.517 ( -3.375 9.982 12.158) 16.089 9.238 ( 5.578 -10.788 -3.948) 12.770 9.872 ( 8.493 -1.071 -10.205) 13.320 10.251 ( 7.317 -1.820 0.382) 7.550 15.967 ( -8.177 1.105 -3.152) 8.833 16.302 ( -4.197 5.117 7.128) 9.727 16.869 ( 3.629 -3.632 -1.319) 5.301 17.031 ( 9.391 4.345 -4.277) 11.197 17.079 ( 7.442 -1.179 1.918) 7.775 18.871 ( -9.123 -6.849 -1.882) 11.562 ======================= Grid point 51 (42/294) ======================= q-point: ( 0.17 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.758 ( -20.950 6.421 15.134) 26.630 1.828 ( -23.735 11.861 4.930) 26.988 2.976 ( 1.778 22.262 19.181) 29.439 3.501 ( 6.251 -3.250 -3.786) 7.998 3.609 ( 7.471 -5.408 -0.724) 9.251 4.597 ( 7.800 -17.414 -7.615) 20.544 5.138 ( 5.854 2.756 -9.207) 11.253 5.349 ( 2.995 -4.093 3.864) 6.376 5.926 ( -3.355 -5.208 -2.583) 6.712 6.490 ( 2.587 4.997 0.117) 5.628 7.103 ( -4.145 1.333 -4.642) 6.364 7.312 ( -9.294 -6.805 0.009) 11.519 7.704 ( -4.114 -2.212 8.942) 10.088 8.242 ( -5.651 3.966 -5.636) 8.913 8.650 ( -0.002 6.313 5.113) 8.124 9.161 ( 1.330 -7.912 -1.376) 8.140 9.988 ( 8.641 2.244 -4.189) 9.862 10.330 ( 5.067 -2.526 -1.893) 5.970 15.844 ( -5.740 1.051 -1.956) 6.154 16.329 ( -2.523 4.839 4.823) 7.284 16.878 ( 2.138 -3.549 -1.498) 4.406 17.182 ( 5.783 2.763 -5.458) 8.418 17.256 ( 12.236 1.034 5.244) 13.352 18.571 ( -13.149 -10.284 -4.824) 17.376 ======================= Grid point 52 (43/294) ======================= q-point: ( 0.25 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.624 ( -15.023 14.286 4.885) 21.299 1.652 ( -14.493 6.770 17.968) 24.056 3.262 ( 5.909 3.990 5.608) 9.071 3.623 ( 5.020 6.621 0.111) 8.309 3.687 ( 5.746 0.536 6.968) 9.048 4.453 ( 1.158 -17.094 -7.695) 18.782 5.179 ( 1.870 2.475 -6.387) 7.101 5.369 ( 0.807 -2.446 1.058) 2.784 5.807 ( -1.084 -6.893 -4.544) 8.327 6.567 ( 2.976 1.878 -2.296) 4.202 6.926 ( -10.550 -2.933 3.382) 11.460 7.227 ( 0.427 -1.851 0.422) 1.946 7.705 ( 1.083 -0.104 3.009) 3.200 8.140 ( -6.535 2.744 -4.637) 8.469 8.624 ( 0.561 -9.454 -8.167) 12.506 9.202 ( 0.822 6.581 9.630) 11.693 10.112 ( 4.295 3.165 -1.334) 5.499 10.358 ( 2.889 -1.909 -2.843) 4.480 15.774 ( -2.818 1.182 -1.023) 3.223 16.371 ( 0.124 3.271 2.325) 4.015 16.848 ( -0.840 -3.061 -1.115) 3.365 17.247 ( 2.707 1.944 -3.945) 5.164 17.475 ( 6.974 1.975 2.333) 7.615 18.238 ( -7.503 -12.417 -4.401) 15.161 ======================= Grid point 53 (44/294) ======================= q-point: ( 0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.620 ( -5.190 12.995 8.247) 16.243 1.689 ( -2.264 8.128 13.814) 16.187 3.331 ( 4.991 -7.943 -2.885) 9.814 3.682 ( 6.184 -5.193 -4.761) 9.374 3.911 ( -1.737 10.209 8.307) 13.276 4.284 ( -1.271 -4.233 3.343) 5.542 5.162 ( -3.227 2.684 -5.621) 7.015 5.322 ( -3.130 -0.395 -4.693) 5.655 5.719 ( 2.545 -10.236 -0.077) 10.548 6.592 ( 3.330 -1.763 -4.548) 5.906 6.830 ( -3.427 0.175 7.340) 8.102 7.228 ( 1.129 -1.575 0.039) 1.938 7.767 ( 4.904 -0.170 -0.126) 4.908 8.028 ( -5.788 1.158 -3.408) 6.816 8.456 ( 0.896 -12.495 -11.684) 17.130 9.369 ( 0.654 9.502 11.532) 14.957 10.160 ( -2.088 3.944 -0.659) 4.511 10.365 ( 1.310 -0.678 -1.904) 2.409 15.760 ( 0.281 1.063 -0.118) 1.106 16.405 ( 2.127 -1.771 -2.542) 3.758 16.796 ( -3.822 1.400 2.346) 4.699 17.259 ( -0.896 3.032 -5.301) 6.173 17.486 ( -7.433 0.426 1.601) 7.615 18.112 ( 9.372 -12.803 -2.950) 16.139 ======================= Grid point 54 (45/294) ======================= q-point: ( 0.42 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.794 ( 5.383 7.689 13.096) 16.112 1.885 ( 7.614 10.297 4.969) 13.737 3.254 ( -0.301 -11.976 -4.591) 12.830 3.685 ( 4.042 -7.198 -6.928) 10.777 3.809 ( -5.950 -4.478 -3.127) 8.076 4.450 ( -1.668 16.124 16.153) 22.884 5.035 ( -9.145 4.385 -9.366) 13.805 5.247 ( -2.023 -2.314 0.536) 3.120 5.683 ( 3.466 -10.209 2.506) 11.068 6.627 ( 6.524 -0.762 -6.187) 9.024 6.862 ( 1.072 0.536 5.864) 5.985 7.230 ( 1.773 -3.153 -0.265) 3.627 7.844 ( 5.513 -3.491 0.036) 6.526 7.947 ( -2.040 1.524 -2.835) 3.811 8.302 ( 1.388 -7.947 -10.730) 13.424 9.516 ( -0.324 5.692 9.289) 10.899 10.125 ( -6.671 6.941 -1.624) 9.763 10.358 ( -1.296 -0.770 0.874) 1.743 15.800 ( 3.226 0.466 0.725) 3.339 16.354 ( 0.910 -7.222 -7.391) 10.374 16.792 ( -5.134 6.835 5.399) 10.110 17.215 ( -3.675 4.784 -6.364) 8.768 17.372 ( -6.108 -1.447 6.165) 8.799 18.171 ( 12.655 -11.775 -5.174) 18.043 ======================= Grid point 55 (46/294) ======================= q-point: ( 0.50 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.072 ( 10.729 5.206 10.477) 15.875 2.185 ( 14.595 7.583 2.218) 16.596 3.028 ( -6.626 -14.089 -6.911) 17.034 3.574 ( -2.819 -2.935 -4.598) 6.140 3.756 ( 1.573 -2.504 -0.729) 3.046 4.524 ( -13.309 10.487 0.273) 16.947 4.931 ( -3.661 2.222 2.625) 5.023 5.221 ( -1.762 1.395 4.948) 5.435 5.661 ( 3.284 -7.881 0.852) 8.580 6.712 ( 7.698 1.628 -7.642) 10.969 6.929 ( 2.785 -0.580 4.538) 5.355 7.217 ( 2.198 -5.839 -1.533) 6.425 7.860 ( 1.970 -4.558 1.970) 5.342 7.987 ( 5.725 1.751 -2.061) 6.331 8.237 ( 3.352 -1.568 -7.789) 8.624 9.545 ( -5.236 -0.620 4.764) 7.106 10.088 ( -5.956 10.830 -1.335) 12.431 10.311 ( -4.224 -1.921 3.051) 5.554 15.882 ( 5.682 -0.603 1.467) 5.899 16.239 ( -0.698 -6.086 -7.143) 9.410 16.779 ( -5.761 4.430 1.426) 7.406 17.168 ( -4.189 1.892 -1.370) 4.797 17.366 ( -1.520 5.506 8.629) 10.349 18.216 ( 11.022 -11.530 -7.952) 17.824 ======================= Grid point 56 (47/294) ======================= q-point: ( 0.58 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.331 ( 7.364 3.069 1.466) 8.111 2.509 ( 15.750 -2.129 6.001) 16.989 2.757 ( -4.478 -4.514 -5.851) 8.641 3.531 ( 0.905 1.101 -1.299) 1.928 3.742 ( -1.611 -0.438 -0.927) 1.910 4.309 ( -16.900 5.807 -5.516) 18.702 4.883 ( -4.693 -5.583 6.907) 10.045 5.276 ( -0.104 4.325 4.067) 5.937 5.662 ( 4.023 -3.593 -1.255) 5.537 6.806 ( 4.050 4.204 -4.101) 7.134 6.992 ( 4.159 -2.311 0.822) 4.828 7.173 ( 1.512 -6.923 -1.124) 7.174 7.880 ( 2.909 -2.703 2.690) 4.796 8.131 ( 9.204 4.723 -2.459) 10.634 8.281 ( 6.203 0.358 -2.580) 6.727 9.396 ( -11.473 -2.931 1.075) 11.890 10.095 ( -4.703 6.005 -1.825) 7.843 10.235 ( -4.233 -0.153 4.093) 5.890 15.993 ( 7.565 -1.719 2.079) 8.032 16.145 ( -1.250 -1.897 -4.890) 5.392 16.726 ( -3.327 1.026 -0.546) 3.525 17.076 ( -6.912 -0.259 0.009) 6.916 17.498 ( 0.238 8.852 8.712) 12.422 18.237 ( 10.318 -9.386 -7.787) 15.975 ======================= Grid point 57 (48/294) ======================= q-point: (-0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.233 ( -11.832 -4.234 -3.006) 12.921 2.729 ( 11.960 -1.567 6.405) 13.658 2.894 ( 13.321 4.222 -0.388) 13.979 3.579 ( 1.775 -0.321 -4.342) 4.702 3.692 ( -3.064 6.588 -1.401) 7.399 4.048 ( -15.846 1.373 0.327) 15.909 4.779 ( -3.391 -7.851 5.245) 10.033 5.298 ( 0.172 -1.556 -2.434) 2.893 5.720 ( 4.454 2.233 -1.003) 5.083 6.853 ( -3.726 3.500 2.335) 5.620 7.024 ( 6.583 -4.294 -6.191) 10.006 7.162 ( 1.794 -1.670 4.245) 4.902 7.928 ( 2.392 -1.244 3.491) 4.411 8.320 ( 9.196 9.584 -12.576) 18.291 8.436 ( 10.721 -0.959 9.405) 14.294 9.157 ( -13.149 -2.699 0.041) 13.423 9.965 ( -8.993 -4.524 -0.823) 10.100 10.251 ( 0.252 3.782 0.575) 3.833 16.091 ( -0.637 1.079 0.166) 1.264 16.138 ( 8.029 -0.505 -0.386) 8.054 16.692 ( -0.503 -1.590 0.844) 1.869 16.944 ( -8.178 0.513 -1.519) 8.334 17.576 ( -1.857 1.374 1.323) 2.663 18.329 ( 10.605 -1.220 -0.444) 10.684 ======================= Grid point 58 (49/294) ======================= q-point: (-0.25 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.992 ( -15.057 4.009 3.001) 15.867 2.942 ( 9.882 -0.268 4.610) 10.908 3.111 ( 6.265 4.021 -1.492) 7.592 3.432 ( -10.899 -0.391 -3.673) 11.507 3.745 ( -5.392 -2.905 -3.831) 7.224 3.912 ( 3.691 6.207 5.728) 9.218 4.708 ( 1.776 -8.338 2.362) 8.846 5.234 ( -0.041 -4.770 -6.775) 8.286 5.830 ( 4.207 5.965 -0.467) 7.314 6.765 ( -5.871 -4.636 0.648) 7.508 7.094 ( 3.924 3.649 -1.818) 5.658 7.235 ( 2.790 1.379 7.064) 7.720 7.964 ( -0.569 0.439 3.446) 3.520 8.472 ( 7.942 8.285 -13.183) 17.479 8.684 ( 9.127 1.051 9.537) 13.242 8.946 ( -8.073 -1.678 1.992) 8.483 9.743 ( -8.088 -7.870 -2.257) 11.508 10.281 ( 0.970 0.526 -2.218) 2.478 16.095 ( -2.625 5.691 0.972) 6.342 16.293 ( 10.267 -0.649 0.007) 10.287 16.675 ( -1.420 -4.802 5.842) 7.695 16.814 ( -5.228 2.668 -5.746) 8.214 17.480 ( -3.407 -6.930 -6.737) 10.247 18.547 ( 9.103 5.771 7.066) 12.887 ======================= Grid point 59 (50/294) ======================= q-point: (-0.17 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.876 ( -14.054 14.677 10.606) 22.922 3.024 ( -18.321 12.795 -11.917) 25.325 3.105 ( 3.574 -2.866 6.873) 8.260 3.273 ( -7.881 -5.459 6.478) 11.571 3.603 ( 2.268 -8.926 2.487) 9.540 4.172 ( 15.435 5.165 -3.215) 16.590 4.699 ( 6.851 -9.522 -2.007) 11.901 5.155 ( 0.408 -2.702 -5.421) 6.071 5.962 ( 3.547 7.715 -0.106) 8.491 6.607 ( -5.822 -7.429 0.180) 9.440 7.155 ( 1.141 2.636 -2.998) 4.152 7.385 ( 3.165 6.566 13.023) 14.924 7.954 ( -4.170 2.469 1.648) 5.119 8.524 ( -2.985 6.536 -10.262) 12.527 8.817 ( 8.748 -3.647 1.504) 9.596 8.933 ( -4.542 1.108 10.721) 11.696 9.586 ( 3.633 -6.061 -6.159) 9.374 10.260 ( 0.313 -3.307 -3.923) 5.141 16.124 ( -3.187 8.239 2.236) 9.112 16.436 ( 4.380 0.263 -1.078) 4.519 16.609 ( -1.854 -3.551 5.335) 6.672 16.788 ( 2.841 0.772 -4.099) 5.046 17.279 ( -3.881 -9.871 -10.002) 14.579 18.792 ( 6.215 6.623 9.150) 12.892 ======================= Grid point 60 (51/294) ======================= q-point: (-0.08 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.940 ( -10.494 23.237 16.788) 30.527 2.699 ( -24.730 11.072 -7.645) 28.154 2.933 ( -22.111 -4.638 12.691) 25.913 3.281 ( 7.703 -1.525 -0.398) 7.863 3.631 ( 7.387 -10.381 0.348) 12.746 4.430 ( 15.592 -3.851 -3.603) 16.460 4.735 ( 11.649 -5.745 -9.285) 15.966 5.154 ( 2.631 0.619 -0.101) 2.705 6.087 ( 1.852 7.258 1.252) 7.595 6.442 ( -4.936 -7.059 -0.216) 8.616 7.157 ( -0.165 0.888 -3.598) 3.709 7.599 ( 2.073 7.654 16.596) 18.393 7.895 ( -6.598 5.078 -2.369) 8.657 8.443 ( -5.175 4.080 -6.027) 8.931 8.775 ( -14.535 -5.448 8.458) 17.678 8.999 ( 12.292 -2.526 1.399) 12.627 9.689 ( 14.782 -0.593 -9.319) 17.485 10.189 ( -0.294 -5.766 -3.167) 6.585 16.164 ( -4.133 9.653 0.625) 10.520 16.363 ( -8.449 -2.312 4.483) 9.840 16.705 ( 9.344 1.302 -2.484) 9.755 16.841 ( 5.046 -1.823 0.870) 5.436 17.069 ( -2.408 -8.349 -10.047) 13.284 18.969 ( 2.343 3.577 7.344) 8.498 ======================= Grid point 62 (52/294) ======================= q-point: ( 0.08 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.520 ( -22.638 10.636 -1.024) 25.033 2.615 ( -20.858 2.284 10.607) 23.511 2.917 ( 1.605 10.899 9.875) 14.794 3.314 ( 5.316 -0.541 -3.747) 6.527 3.441 ( 2.838 -4.364 6.192) 8.090 4.245 ( 10.585 -15.015 -0.769) 18.387 4.781 ( 14.122 4.885 -14.280) 20.669 5.226 ( 3.537 -3.611 2.158) 5.496 6.087 ( -5.493 -6.979 2.186) 9.147 6.436 ( 2.099 8.345 -1.634) 8.759 7.109 ( 0.100 0.144 -1.440) 1.450 7.684 ( -9.681 -0.817 -9.364) 13.494 7.978 ( -8.745 -5.078 13.908) 17.196 8.364 ( -2.327 1.794 -6.003) 6.683 8.751 ( -5.166 6.251 13.250) 15.535 9.031 ( 5.108 -7.520 -2.995) 9.572 9.637 ( 11.725 2.825 -13.269) 17.931 10.140 ( 4.808 -1.953 3.586) 6.308 16.111 ( -9.703 1.100 -2.620) 10.111 16.460 ( -4.716 3.936 5.312) 8.121 16.728 ( 5.318 -8.329 -0.228) 9.884 16.902 ( 8.871 7.297 -9.212) 14.724 16.970 ( 6.258 -0.931 6.949) 9.398 18.941 ( -7.670 -5.362 -2.590) 9.711 ======================= Grid point 63 (53/294) ======================= q-point: ( 0.17 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.255 ( -21.430 8.149 6.464) 23.821 2.340 ( -21.766 5.279 7.053) 23.481 3.044 ( 5.839 -4.539 -1.012) 7.465 3.415 ( 5.692 2.089 -2.714) 6.643 3.562 ( 2.784 10.884 15.414) 19.073 4.257 ( 9.103 -15.631 -2.516) 18.262 4.956 ( 11.188 4.744 -13.583) 18.225 5.258 ( 4.108 -6.194 3.617) 8.265 5.935 ( -5.345 -5.851 -2.031) 8.181 6.529 ( 0.438 7.276 -0.298) 7.295 7.113 ( 0.605 1.130 -1.733) 2.156 7.415 ( -11.657 -6.716 -4.989) 14.348 7.851 ( -8.662 -3.295 9.854) 13.527 8.304 ( -2.639 1.917 -6.457) 7.234 8.717 ( -6.850 -4.586 -1.208) 8.332 9.091 ( 6.523 1.476 6.657) 9.437 9.824 ( 11.619 7.040 -7.344) 15.443 10.219 ( 4.605 -2.946 2.584) 6.046 15.959 ( -7.951 1.417 -2.115) 8.348 16.435 ( -3.663 1.350 1.855) 4.322 16.755 ( 5.992 -6.181 -0.237) 8.612 17.058 ( 8.016 4.822 -7.186) 11.796 17.139 ( 7.965 1.892 8.726) 11.965 18.672 ( -12.880 -8.587 -5.656) 16.481 ======================= Grid point 64 (54/294) ======================= q-point: ( 0.25 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.050 ( -17.746 8.147 8.470) 21.285 2.096 ( -19.093 6.661 8.134) 21.796 3.071 ( 8.722 -9.698 -4.585) 13.825 3.476 ( 5.334 -2.822 -3.846) 7.156 3.886 ( 2.811 19.443 16.034) 25.358 4.216 ( 5.810 -13.901 -1.131) 15.108 5.075 ( 7.202 3.906 -11.688) 14.273 5.296 ( 4.656 -6.485 5.008) 9.424 5.768 ( -5.165 -4.824 -6.728) 9.758 6.579 ( -1.320 4.309 -0.128) 4.509 7.075 ( -8.270 -1.307 -0.518) 8.389 7.195 ( -0.818 -5.465 0.477) 5.547 7.764 ( -4.891 -0.094 4.148) 6.414 8.228 ( -4.450 2.204 -6.108) 7.872 8.494 ( -4.796 -12.150 -7.231) 14.930 9.292 ( 4.909 7.004 9.771) 12.986 10.042 ( 8.670 7.867 -2.673) 12.008 10.266 ( 3.527 -3.111 0.752) 4.763 15.850 ( -5.471 1.697 -1.558) 5.936 16.390 ( -1.294 -2.261 -1.693) 3.107 16.797 ( 3.943 -2.787 1.185) 4.972 17.171 ( 5.561 2.525 -4.517) 7.596 17.364 ( 9.301 3.149 6.704) 11.889 18.303 ( -14.835 -10.147 -6.534) 19.124 ======================= Grid point 65 (55/294) ======================= q-point: ( 0.33 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.925 ( -12.206 11.377 2.311) 16.845 1.955 ( -11.155 3.336 14.272) 18.419 3.097 ( 8.552 -9.889 -4.411) 13.798 3.502 ( 4.973 -4.202 -4.423) 7.871 3.986 ( -2.956 -5.242 -4.357) 7.430 4.373 ( 6.213 13.454 18.574) 23.761 5.134 ( 3.970 2.114 -8.161) 9.318 5.331 ( 0.860 -2.708 1.971) 3.457 5.599 ( -2.404 -6.397 -7.134) 9.879 6.556 ( -2.795 -0.855 -0.819) 3.035 6.929 ( -5.202 -2.482 4.232) 7.150 7.193 ( 1.607 -1.123 -0.796) 2.116 7.736 ( -0.711 1.028 0.115) 1.255 8.115 ( -6.708 0.334 -4.593) 8.136 8.283 ( -0.795 -10.645 -7.526) 13.061 9.482 ( 2.963 6.493 8.144) 10.829 10.206 ( 2.204 5.299 2.521) 6.269 10.301 ( 4.042 -0.105 -2.540) 4.775 15.791 ( -2.659 1.490 -0.753) 3.140 16.322 ( 0.250 -5.848 -4.922) 7.648 16.859 ( 2.082 2.323 4.204) 5.235 17.238 ( 2.743 2.219 -4.089) 5.400 17.549 ( 3.486 2.632 3.346) 5.503 17.950 ( -7.970 -11.521 -4.727) 14.785 ======================= Grid point 66 (56/294) ======================= q-point: ( 0.42 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.911 ( -2.912 7.712 5.248) 9.772 1.957 ( -1.874 4.900 8.039) 9.599 3.089 ( 3.781 -9.393 -3.805) 10.817 3.509 ( 4.409 -4.844 -4.805) 8.123 3.830 ( -4.414 -5.079 -3.726) 7.692 4.714 ( 2.112 15.593 17.184) 23.300 5.144 ( -1.964 2.839 -6.405) 7.276 5.258 ( -4.521 0.424 -4.947) 6.715 5.522 ( 4.333 -10.333 1.422) 11.295 6.501 ( 1.198 -2.928 -2.856) 4.262 6.896 ( -0.902 -0.622 3.805) 3.960 7.197 ( 0.375 -0.900 -0.615) 1.153 7.749 ( 2.148 -0.844 -1.398) 2.698 7.986 ( -3.994 -1.389 -2.371) 4.847 8.172 ( 0.675 -4.381 -6.112) 7.550 9.606 ( 0.755 3.626 5.533) 6.658 10.242 ( -2.018 2.456 0.817) 3.282 10.368 ( 1.535 3.004 0.148) 3.377 15.780 ( 0.234 0.736 0.135) 0.784 16.232 ( 0.463 -6.557 -5.911) 8.840 16.955 ( -0.685 6.399 6.247) 8.969 17.253 ( -0.627 2.622 -4.682) 5.402 17.494 ( -7.975 -1.101 0.544) 8.069 17.858 ( 8.548 -9.423 -2.104) 12.896 ======================= Grid point 67 (57/294) ======================= q-point: ( 0.50 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.036 ( 6.121 3.244 7.978) 10.567 2.075 ( 6.681 5.364 0.255) 8.571 2.979 ( -4.035 -7.699 -3.672) 9.437 3.494 ( 2.595 -4.348 -4.745) 6.940 3.744 ( -1.139 -0.157 0.360) 1.205 4.843 ( -12.252 9.759 0.596) 15.675 5.037 ( -4.684 1.810 -0.147) 5.024 5.267 ( 2.362 2.332 4.292) 5.426 5.509 ( 4.514 -10.479 1.526) 11.512 6.530 ( 7.442 -0.095 -5.920) 9.510 6.913 ( 1.030 -0.975 2.792) 3.131 7.181 ( -0.840 -1.138 -0.029) 1.415 7.768 ( 3.281 -4.304 1.733) 5.682 7.954 ( 1.074 2.941 -2.350) 3.914 8.141 ( 2.259 -0.840 -3.942) 4.621 9.635 ( -2.801 0.070 2.825) 3.979 10.225 ( -3.004 4.170 -2.075) 5.542 10.384 ( -2.862 0.363 2.878) 4.075 15.812 ( 2.945 -0.435 0.993) 3.139 16.154 ( 0.338 -3.685 -4.379) 5.733 16.959 ( -8.625 4.502 0.842) 9.766 17.228 ( -2.072 0.529 -0.076) 2.140 17.460 ( 1.413 4.624 4.918) 6.896 17.895 ( 8.734 -9.599 -5.464) 14.082 ======================= Grid point 68 (58/294) ======================= q-point: (-0.42 -0.58 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.237 ( 9.042 5.450 -1.665) 10.688 2.280 ( 13.455 -2.335 6.002) 14.916 2.799 ( -7.415 -2.239 -2.675) 8.195 3.469 ( 2.191 -2.715 -4.057) 5.351 3.767 ( 0.055 3.145 2.189) 3.832 4.610 ( -17.117 4.898 -8.156) 19.583 4.987 ( -5.659 -3.725 8.567) 10.922 5.320 ( -1.703 0.223 -0.096) 1.720 5.533 ( 7.052 -4.174 2.322) 8.517 6.669 ( 10.810 3.551 -5.988) 12.858 6.934 ( 1.007 -1.835 2.141) 2.994 7.152 ( -1.341 -1.050 1.065) 2.009 7.805 ( 3.961 -4.110 4.186) 7.078 8.047 ( 5.934 7.074 -2.683) 9.615 8.180 ( 4.596 -0.081 -0.874) 4.679 9.544 ( -8.015 -1.939 0.360) 8.254 10.196 ( -3.821 3.031 -2.264) 5.377 10.321 ( -4.591 -2.049 1.978) 5.403 15.880 ( 5.349 -1.583 1.792) 5.859 16.126 ( 0.159 1.018 -1.680) 1.971 16.831 ( -8.055 1.531 -1.709) 8.376 17.172 ( -4.810 -0.921 1.155) 5.031 17.608 ( 0.733 6.869 5.623) 8.907 17.928 ( 11.820 -7.039 -5.174) 14.698 ======================= Grid point 70 (59/294) ======================= q-point: (-0.33 -0.58 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.353 ( -1.450 3.651 -1.492) 4.202 2.527 ( 14.491 -4.414 7.539) 16.921 2.749 ( 4.745 3.805 -2.505) 6.577 3.469 ( 3.736 -1.920 -5.257) 6.729 3.805 ( -2.626 6.735 0.181) 7.231 4.310 ( -15.748 -0.275 -5.694) 16.748 4.875 ( -8.550 -6.192 10.381) 14.806 5.247 ( -1.323 -3.129 -6.459) 7.298 5.661 ( 6.130 2.556 3.020) 7.296 6.826 ( 7.470 -3.873 -5.136) 9.858 6.956 ( 0.176 6.754 3.391) 7.560 7.147 ( 1.264 -1.006 2.579) 3.043 7.875 ( 4.709 -1.831 3.928) 6.399 8.207 ( 6.054 7.932 -8.174) 12.899 8.313 ( 10.098 1.218 7.284) 12.511 9.348 ( -12.049 -1.953 -1.428) 12.290 10.075 ( -9.375 -5.416 1.759) 10.969 10.266 ( -0.503 0.820 -3.713) 3.836 15.983 ( 7.550 -2.039 2.185) 8.120 16.155 ( -0.530 5.509 0.953) 5.616 16.723 ( -4.476 -0.043 -1.276) 4.655 17.068 ( -7.069 -0.664 0.380) 7.110 17.586 ( -2.991 -4.951 -4.948) 7.612 18.156 ( 14.010 5.223 5.288) 15.860 ======================= Grid point 71 (60/294) ======================= q-point: (-0.25 -0.58 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.304 ( -10.230 8.935 5.569) 14.680 2.767 ( 13.800 -2.482 4.038) 14.591 2.936 ( 13.024 0.179 0.292) 13.029 3.472 ( 2.079 -1.608 -7.201) 7.665 3.786 ( -7.113 9.355 -10.088) 15.488 4.045 ( -8.917 -5.289 2.448) 10.653 4.726 ( -8.082 -7.730 9.778) 14.855 5.163 ( -0.974 -1.353 -6.701) 6.905 5.812 ( 5.300 5.787 1.643) 8.018 6.763 ( -1.931 -8.972 -0.933) 9.224 7.085 ( 2.026 6.990 -1.896) 7.521 7.241 ( 5.598 3.528 8.604) 10.854 7.964 ( 3.620 0.391 3.430) 5.003 8.322 ( 7.495 4.932 -8.763) 12.542 8.589 ( 11.961 5.074 7.581) 15.043 9.111 ( -12.192 -1.225 -2.164) 12.443 9.829 ( -11.818 -9.902 1.752) 15.517 10.245 ( 0.414 -0.228 -5.459) 5.480 16.119 ( 9.431 -1.549 1.339) 9.651 16.218 ( -1.840 8.738 3.181) 9.479 16.666 ( -0.935 -1.781 0.167) 2.019 16.933 ( -8.343 -0.093 -0.819) 8.384 17.411 ( -3.845 -9.244 -8.806) 13.333 18.491 ( 11.836 8.412 8.632) 16.892 ======================= Grid point 72 (61/294) ======================= q-point: (-0.17 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.298 ( -10.213 15.824 10.689) 21.655 2.982 ( 11.000 -1.086 3.315) 11.540 3.138 ( 10.846 -2.968 2.802) 11.589 3.376 ( -9.206 2.732 -7.782) 12.360 3.590 ( -9.086 -6.356 -7.427) 13.346 4.017 ( 5.242 3.133 -2.954) 6.784 4.585 ( -4.343 -9.584 6.151) 12.188 5.117 ( -0.458 1.332 -3.456) 3.732 5.968 ( 4.745 7.873 0.092) 9.193 6.617 ( -4.540 -9.403 1.066) 10.496 7.132 ( 1.465 1.754 -3.482) 4.164 7.470 ( 5.724 8.103 13.076) 16.414 8.027 ( -0.119 2.337 2.111) 3.152 8.450 ( 8.623 4.258 -9.888) 13.793 8.788 ( -2.619 1.332 2.348) 3.762 8.997 ( 3.872 3.049 3.909) 6.291 9.533 ( -10.419 -11.492 -0.546) 15.522 10.199 ( -0.265 -2.470 -5.588) 6.115 16.263 ( 4.172 3.993 -0.281) 5.782 16.310 ( 2.970 6.121 3.913) 7.849 16.650 ( 0.107 -4.411 4.338) 6.188 16.791 ( -6.517 0.916 -3.555) 7.480 17.190 ( -4.294 -9.815 -9.494) 14.315 18.793 ( 8.332 7.349 8.304) 13.870 ======================= Grid point 73 (62/294) ======================= q-point: (-0.08 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.403 ( -7.572 20.778 14.250) 26.308 3.110 ( -11.961 6.066 -4.736) 14.223 3.158 ( -0.714 4.758 -1.795) 5.135 3.232 ( -6.707 -5.885 4.621) 10.049 3.377 ( 6.311 -15.475 0.476) 16.719 4.158 ( 10.590 0.026 -6.701) 12.531 4.492 ( 2.987 -6.994 -1.893) 7.837 5.131 ( 1.205 1.897 0.102) 2.250 6.119 ( 3.746 8.404 -0.564) 9.219 6.454 ( -4.994 -8.856 1.913) 10.345 7.137 ( 0.531 0.266 -3.140) 3.196 7.720 ( 4.204 7.209 14.372) 16.619 8.026 ( -4.194 4.393 -0.673) 6.111 8.505 ( -1.195 3.648 -9.496) 10.242 8.758 ( 4.316 -3.153 1.001) 5.438 9.080 ( -10.677 -1.317 12.475) 16.473 9.384 ( 11.007 -3.898 -10.097) 15.437 10.127 ( -0.720 -3.870 -3.806) 5.475 16.330 ( -3.171 9.151 -0.431) 9.694 16.447 ( 2.955 1.593 2.294) 4.066 16.602 ( -1.195 -4.285 5.935) 7.417 16.750 ( 3.451 -0.094 -3.421) 4.860 16.980 ( -3.411 -7.703 -8.395) 11.893 18.995 ( 3.762 3.930 5.712) 7.888 ======================= Grid point 76 (63/294) ======================= q-point: ( 0.08 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.741 ( 1.710 -15.776 -6.841) 17.280 2.947 ( -17.986 8.630 -5.074) 20.585 3.064 ( -8.621 6.621 3.541) 11.432 3.275 ( 3.725 8.588 2.150) 9.605 3.394 ( 9.839 -4.290 13.184) 17.001 4.043 ( -0.547 -7.770 5.195) 9.363 4.531 ( 10.942 6.636 -11.021) 16.889 5.157 ( 1.429 -3.239 0.623) 3.595 6.117 ( -5.112 -8.243 2.001) 9.904 6.457 ( 3.981 9.351 -2.746) 10.528 7.113 ( -0.646 -0.218 1.358) 1.520 7.751 ( -7.696 -3.746 -10.879) 13.843 8.088 ( -1.516 -3.800 3.736) 5.541 8.413 ( -5.730 -1.157 3.454) 6.790 8.802 ( 7.905 -1.167 3.846) 8.868 9.063 ( -12.867 -0.990 4.959) 13.825 9.381 ( 14.528 6.701 -11.630) 19.779 10.101 ( 2.087 0.625 4.313) 4.832 16.274 ( -9.835 0.254 -0.884) 9.878 16.545 ( 3.152 -10.523 -1.886) 11.146 16.594 ( -2.408 4.195 0.969) 4.933 16.764 ( 7.982 2.989 -2.748) 8.955 16.941 ( 4.573 4.760 6.182) 9.044 18.986 ( -5.686 -4.440 -3.987) 8.243 ======================= Grid point 77 (64/294) ======================= q-point: ( 0.17 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.589 ( -1.732 -11.388 -0.734) 11.543 2.698 ( -18.591 9.897 -4.580) 21.553 2.944 ( -7.511 -2.504 0.303) 7.923 3.373 ( 0.504 2.088 2.959) 3.657 3.679 ( 10.747 7.282 15.702) 20.373 4.015 ( 3.074 -7.701 1.780) 8.481 4.722 ( 12.206 6.965 -13.487) 19.478 5.159 ( 2.732 -5.127 2.484) 6.318 5.957 ( -5.509 -7.101 -0.766) 9.020 6.588 ( 1.965 9.126 -1.131) 9.403 7.110 ( -0.262 -0.517 1.684) 1.781 7.487 ( -9.470 -7.047 -9.393) 15.086 8.004 ( -6.471 -3.007 3.530) 7.961 8.324 ( -4.094 -1.674 0.627) 4.467 8.794 ( -10.486 -7.406 -5.114) 13.819 9.021 ( 9.029 2.393 8.399) 12.561 9.656 ( 13.526 11.447 -7.032) 19.065 10.170 ( 1.980 -0.679 5.731) 6.101 16.108 ( -9.533 1.210 -1.452) 9.719 16.451 ( -0.384 -8.110 -3.940) 9.025 16.629 ( 2.650 0.039 1.909) 3.266 16.921 ( 8.842 1.963 -2.116) 9.301 17.129 ( 5.238 7.399 8.107) 12.162 18.753 ( -10.717 -7.766 -6.926) 14.937 ======================= Grid point 78 (65/294) ======================= q-point: ( 0.25 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.428 ( -11.156 -5.996 9.820) 16.027 2.465 ( -16.854 10.572 -6.966) 21.079 2.834 ( 2.152 -7.496 -2.257) 8.119 3.401 ( 0.408 0.059 1.446) 1.504 3.979 ( 6.033 -12.057 1.420) 13.556 4.063 ( 8.272 14.148 12.381) 20.540 4.895 ( 10.253 6.204 -13.109) 17.761 5.186 ( 3.929 -5.039 4.872) 8.035 5.786 ( -6.072 -4.992 -4.289) 8.955 6.671 ( -1.919 7.032 1.140) 7.377 7.120 ( 1.518 -1.344 0.900) 2.218 7.206 ( -9.576 -7.492 -4.849) 13.090 7.885 ( -6.822 -0.498 1.314) 6.965 8.251 ( -2.500 -1.795 -1.446) 3.400 8.494 ( -11.105 -8.354 -5.824) 15.068 9.263 ( 10.244 2.919 6.354) 12.403 9.945 ( 11.484 11.510 -4.755) 16.940 10.218 ( 1.170 -2.144 5.946) 6.428 15.968 ( -7.703 1.895 -1.834) 8.142 16.340 ( -0.550 -7.904 -4.292) 9.011 16.702 ( 5.000 -0.644 1.980) 5.416 17.062 ( 7.370 1.421 -1.877) 7.737 17.345 ( 5.303 7.740 8.550) 12.694 18.411 ( -14.148 -9.336 -8.140) 18.804 ======================= Grid point 79 (66/294) ======================= q-point: ( 0.33 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.243 ( -12.679 -3.002 11.473) 17.361 2.251 ( -14.856 8.372 -5.308) 17.859 2.844 ( 8.163 -6.594 -2.343) 10.752 3.413 ( 0.791 -0.449 0.128) 0.919 3.913 ( 0.161 -7.792 -3.643) 8.603 4.450 ( 12.360 9.172 14.845) 21.384 5.015 ( 6.382 4.576 -10.507) 13.117 5.257 ( 5.051 -2.593 5.447) 7.868 5.604 ( -7.080 -2.575 -7.321) 10.505 6.650 ( -7.151 0.899 2.880) 7.761 6.992 ( -4.802 -5.176 -1.316) 7.182 7.150 ( 1.861 0.154 -0.270) 1.886 7.794 ( -4.500 1.696 -1.770) 5.124 8.184 ( -1.702 -3.206 -1.365) 3.878 8.214 ( -9.307 -6.380 -4.492) 12.145 9.478 ( 7.676 3.135 4.134) 9.265 10.187 ( 8.745 7.424 -3.985) 12.144 10.248 ( 0.650 -1.004 6.021) 6.139 15.867 ( -5.303 1.895 -1.610) 5.857 16.232 ( -0.397 -7.041 -4.009) 8.112 16.811 ( 6.663 0.180 2.831) 7.242 17.169 ( 5.156 1.519 -2.299) 5.846 17.547 ( 4.479 6.168 7.370) 10.603 18.023 ( -14.985 -9.280 -7.556) 19.177 ======================= Grid point 80 (67/294) ======================= q-point: ( 0.42 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.083 ( -9.265 5.042 -3.119) 11.000 2.106 ( -7.440 -1.877 7.464) 10.705 2.920 ( 6.830 -3.259 -0.854) 7.616 3.422 ( 0.660 -0.323 -0.185) 0.758 3.811 ( -1.699 -4.649 -3.294) 5.946 4.816 ( 12.063 4.906 14.133) 19.218 5.074 ( 3.590 1.791 -6.810) 7.905 5.348 ( 0.631 3.164 2.092) 3.845 5.411 ( -5.784 -3.392 -7.770) 10.264 6.518 ( -6.882 -3.515 2.468) 8.112 6.920 ( -1.310 -0.551 -0.142) 1.428 7.176 ( 1.309 -0.008 -0.387) 1.365 7.743 ( -2.154 2.068 -3.315) 4.462 8.018 ( -4.648 -5.402 -0.314) 7.133 8.129 ( -1.609 -0.880 -1.621) 2.448 9.620 ( 3.820 2.155 1.921) 4.788 10.254 ( 1.350 -2.166 2.045) 3.271 10.365 ( 3.962 5.309 -0.503) 6.644 15.807 ( -2.689 1.177 -0.893) 3.068 16.150 ( -0.242 -4.311 -2.529) 5.004 16.963 ( 7.779 1.285 4.130) 8.900 17.233 ( 2.468 1.869 -3.192) 4.447 17.659 ( -13.756 -2.131 -1.915) 14.051 17.696 ( 3.754 -1.951 1.195) 4.396 ======================= Grid point 81 (68/294) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 436 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.018 ( -0.000 0.000 0.000) 0.000 2.057 ( -0.000 0.000 0.000) 0.000 2.966 ( 0.000 0.000 0.000) 0.000 3.425 ( -0.000 0.000 0.000) 0.000 3.758 ( 0.000 0.000 0.000) 0.000 5.074 ( -0.000 -0.000 -0.000) 0.000 5.074 ( 0.000 0.000 0.000) 0.000 5.227 ( -0.000 0.000 0.000) 0.000 5.406 ( 0.000 0.000 0.000) 0.000 6.442 ( -0.000 0.000 0.000) 0.000 6.908 ( -0.000 0.000 0.000) 0.000 7.186 ( -0.000 0.000 0.000) 0.000 7.722 ( -0.000 0.000 -0.000) 0.000 7.954 ( -0.000 0.000 0.000) 0.000 8.104 ( -0.000 0.000 0.000) 0.000 9.668 ( -0.000 0.000 0.000) 0.000 10.261 ( -0.000 0.000 0.000) 0.000 10.423 ( -0.000 0.000 0.000) 0.000 15.788 ( 0.000 0.000 0.000) 0.000 16.118 ( -0.000 0.000 0.000) 0.000 17.086 ( 0.000 0.000 -0.000) 0.000 17.247 ( 0.000 0.000 0.000) 0.000 17.472 ( -0.000 0.000 0.000) 0.000 17.744 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 162 (69/294) ======================= q-point: ( 0.08 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 292 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.551 ( -0.000 0.000 29.860) 29.860 0.551 ( -0.000 0.000 29.860) 29.860 0.799 ( -0.000 0.000 43.199) 43.199 4.040 ( 0.000 -0.000 -4.206) 4.206 4.040 ( 0.000 -0.000 -4.206) 4.206 5.199 ( 0.000 -0.000 -2.291) 2.291 5.199 ( 0.000 -0.000 -2.291) 2.291 5.842 ( 0.000 -0.000 -16.860) 16.860 6.487 ( -0.000 0.000 1.507) 1.507 6.487 ( 0.000 0.000 1.507) 1.507 6.615 ( -0.000 0.000 6.245) 6.245 7.292 ( -0.000 0.000 7.735) 7.735 7.857 ( 0.000 -0.000 -0.193) 0.193 7.869 ( -0.000 0.000 3.838) 3.838 7.869 ( -0.000 0.000 3.838) 3.838 10.001 ( 0.000 -0.000 -2.863) 2.863 10.325 ( 0.000 -0.000 -5.890) 5.890 10.325 ( 0.000 -0.000 -5.890) 5.890 15.820 ( -0.000 0.000 3.395) 3.395 15.820 ( -0.000 0.000 3.395) 3.395 17.025 ( 0.000 -0.000 -2.734) 2.734 17.237 ( 0.000 -0.000 -2.846) 2.846 17.237 ( 0.000 -0.000 -2.846) 2.846 18.946 ( -0.000 0.000 2.688) 2.688 ======================= Grid point 163 (70/294) ======================= q-point: ( 0.17 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.715 ( 11.958 9.311 16.305) 22.261 1.006 ( 20.391 -0.900 27.473) 34.225 1.303 ( 12.712 15.540 37.378) 42.429 3.918 ( -6.053 -2.744 -6.316) 9.168 4.014 ( -3.633 -0.687 -2.514) 4.471 5.161 ( -0.152 -0.692 -4.852) 4.903 5.246 ( 2.754 2.807 0.640) 3.984 5.579 ( -9.145 -7.666 -14.025) 18.414 6.324 ( -11.386 -3.786 7.263) 14.026 6.413 ( -2.902 -3.703 -0.066) 4.705 6.870 ( 11.731 4.718 -3.667) 13.165 7.361 ( 2.235 1.537 7.117) 7.616 7.774 ( -5.967 0.732 6.729) 9.023 7.946 ( 7.813 -2.242 1.009) 8.191 8.016 ( 4.195 7.618 5.613) 10.350 9.845 ( -9.437 -2.722 -0.751) 9.851 10.255 ( -4.570 2.685 -11.692) 12.837 10.365 ( 6.065 -4.728 -7.560) 10.784 15.798 ( -0.187 -0.183 1.111) 1.142 15.937 ( 4.568 2.888 6.974) 8.823 16.984 ( -1.408 -1.048 -3.453) 3.874 17.144 ( -0.688 -5.051 -6.642) 8.373 17.304 ( 0.765 1.000 2.070) 2.423 18.918 ( -2.921 1.707 2.026) 3.944 ======================= Grid point 164 (71/294) ======================= q-point: ( 0.25 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.187 ( 21.953 12.500 3.608) 25.518 1.527 ( 23.831 -1.647 24.824) 34.451 1.908 ( 13.110 19.198 32.541) 39.991 3.727 ( -7.801 -4.078 -5.878) 10.585 3.894 ( -8.109 0.312 -1.930) 8.341 5.086 ( -4.130 -2.016 -7.810) 9.062 5.220 ( -9.334 -8.215 -10.117) 16.030 5.347 ( 1.862 -1.463 -1.729) 2.932 6.181 ( -7.329 -0.936 5.951) 9.487 6.342 ( -1.563 -2.299 0.252) 2.791 7.013 ( 6.520 0.649 -5.466) 8.533 7.459 ( 3.568 3.380 -1.473) 5.131 7.790 ( -0.992 1.509 14.912) 15.021 8.076 ( 8.409 0.335 -1.908) 8.629 8.220 ( 5.073 9.085 9.565) 14.133 9.638 ( -10.615 -3.212 -3.168) 11.533 10.074 ( -5.883 -3.528 -15.582) 17.025 10.345 ( 0.402 -3.605 -2.596) 4.461 15.826 ( 2.719 1.640 -1.124) 3.369 16.103 ( 5.248 3.798 9.030) 11.113 16.920 ( -0.889 -3.264 -4.571) 5.687 17.034 ( -0.995 -5.022 -8.491) 9.915 17.295 ( -4.103 -2.536 7.406) 8.838 18.920 ( -1.109 4.739 -1.423) 5.071 ======================= Grid point 165 (72/294) ======================= q-point: ( 0.33 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.698 ( 24.066 11.868 -1.874) 26.898 2.060 ( 24.068 -1.842 22.211) 32.803 2.484 ( 10.634 19.408 27.434) 35.247 3.524 ( -7.626 -3.914 -4.263) 9.573 3.739 ( -9.927 1.902 -2.161) 10.336 4.817 ( -13.412 -7.911 -11.047) 19.092 4.941 ( -6.083 -8.627 -11.066) 15.294 5.348 ( -1.619 -3.116 4.201) 5.475 6.135 ( -1.175 0.960 1.142) 1.898 6.326 ( -0.033 0.454 1.150) 1.237 7.062 ( 3.254 -0.217 -4.168) 5.292 7.531 ( 3.770 5.226 -6.383) 9.070 7.926 ( 3.802 -0.150 15.967) 16.414 8.197 ( 6.796 1.399 -3.069) 7.587 8.477 ( 5.848 11.068 12.065) 17.386 9.389 ( -10.651 -6.130 -4.728) 13.167 9.819 ( -6.724 -5.724 -17.203) 19.337 10.285 ( -3.159 -2.946 1.384) 4.536 15.908 ( 5.407 3.602 -2.674) 7.026 16.286 ( 4.877 4.254 9.615) 11.590 16.833 ( 0.562 -7.020 -6.952) 9.896 16.918 ( -2.788 -2.026 -7.091) 7.884 17.216 ( -7.488 -4.435 9.995) 13.253 18.947 ( 0.408 5.210 -4.141) 6.668 ======================= Grid point 166 (73/294) ======================= q-point: ( 0.42 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.191 ( 23.973 10.758 -4.705) 26.693 2.547 ( 21.718 -3.738 18.342) 28.672 2.931 ( 2.874 17.305 18.091) 25.199 3.353 ( -6.645 -2.395 -2.845) 7.615 3.591 ( -8.444 2.266 0.982) 8.797 4.450 ( -11.762 -9.011 -10.358) 18.078 4.669 ( -8.778 -8.308 -7.630) 14.293 5.289 ( -3.748 -4.059 3.728) 6.665 6.148 ( 2.633 -0.486 -3.762) 4.617 6.352 ( -0.579 2.907 2.675) 3.993 7.084 ( 1.850 0.105 -1.714) 2.525 7.620 ( 5.159 6.658 -8.067) 11.663 8.071 ( 4.301 -1.870 9.132) 10.266 8.300 ( 4.959 2.330 0.527) 5.504 8.763 ( 5.504 11.229 12.425) 17.629 9.122 ( -8.158 -8.182 -5.083) 12.622 9.540 ( -7.303 -6.221 -16.238) 18.861 10.208 ( -4.460 -2.591 3.645) 6.316 16.042 ( 7.470 5.344 -3.173) 9.717 16.455 ( 3.614 3.701 8.135) 9.640 16.724 ( 0.866 -7.095 -8.525) 11.125 16.821 ( -3.355 -0.719 -3.502) 4.903 17.089 ( -9.024 -5.440 10.377) 14.788 18.977 ( 1.361 4.200 -6.319) 7.708 ======================= Grid point 167 (74/294) ======================= q-point: ( 0.50 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.645 ( 22.099 9.483 -6.038) 24.794 2.880 ( 10.295 -6.702 7.992) 14.655 3.073 ( -8.427 12.258 1.222) 14.926 3.220 ( -3.523 -2.287 -1.679) 4.523 3.542 ( -4.807 -1.830 11.199) 12.324 4.151 ( -5.762 -8.783 -8.283) 13.377 4.467 ( -5.961 1.036 1.876) 6.335 5.208 ( -3.345 -2.862 1.676) 4.710 6.152 ( 4.072 -3.449 -7.415) 9.135 6.387 ( -2.220 4.527 4.317) 6.638 7.110 ( 1.474 0.080 0.879) 1.718 7.717 ( 4.226 7.226 -10.060) 13.088 8.118 ( 1.024 -2.849 -0.720) 3.112 8.435 ( 5.026 3.332 7.457) 9.590 8.806 ( -4.427 -10.151 -5.284) 12.270 9.130 ( 5.621 11.415 11.784) 17.343 9.265 ( -7.422 -5.774 -12.684) 15.789 10.139 ( -3.451 -2.668 4.319) 6.138 16.217 ( 8.586 6.312 -2.538) 10.955 16.515 ( 0.871 -5.080 -4.231) 6.669 16.670 ( -2.357 4.734 -2.544) 5.868 16.759 ( -1.082 -2.030 5.223) 5.707 16.954 ( -6.564 -5.886 8.406) 12.182 18.991 ( 1.608 2.482 -8.235) 8.750 ======================= Grid point 168 (75/294) ======================= q-point: (-0.42 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.716 ( -18.487 5.436 -12.593) 23.020 2.996 ( 0.443 -16.689 -7.579) 18.334 3.054 ( 15.279 7.406 -5.404) 17.818 3.211 ( 2.080 3.653 3.120) 5.235 3.422 ( -13.221 -8.321 14.866) 21.564 4.046 ( 7.372 -5.696 -3.111) 9.822 4.556 ( 0.942 13.750 12.115) 18.350 5.155 ( -1.174 -0.731 -0.183) 1.395 6.128 ( 4.023 -5.087 -8.900) 11.013 6.413 ( -3.289 4.247 5.077) 7.391 7.143 ( 1.284 -0.320 2.570) 2.891 7.739 ( -1.230 5.436 -14.121) 15.181 8.070 ( -1.416 -3.094 -1.609) 3.764 8.588 ( -1.945 -5.167 4.752) 7.284 8.627 ( 6.074 -1.855 -5.332) 8.292 9.019 ( -6.439 -6.046 -7.274) 11.442 9.447 ( 6.507 14.094 13.033) 20.269 10.100 ( -0.596 -3.285 3.883) 5.121 16.394 ( 2.878 -1.662 -1.060) 3.488 16.412 ( 2.657 -0.575 -8.289) 8.724 16.595 ( -6.542 2.821 -0.913) 7.183 16.834 ( -2.289 5.070 10.235) 11.649 16.899 ( 3.150 -5.311 6.112) 8.688 18.975 ( 1.388 0.648 -10.020) 10.136 ======================= Grid point 169 (76/294) ======================= q-point: (-0.33 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.309 ( -25.035 5.896 -16.220) 30.407 2.611 ( -8.635 -25.393 -17.669) 32.118 3.138 ( -20.824 -9.898 15.607) 27.842 3.259 ( 5.718 5.976 -0.514) 8.287 3.425 ( 13.301 2.613 3.094) 13.903 4.230 ( 16.912 1.025 -0.496) 16.951 4.827 ( 3.474 15.410 13.415) 20.724 5.155 ( 1.204 1.178 -0.932) 1.925 6.084 ( 3.021 -4.965 -8.566) 10.352 6.421 ( -3.264 2.180 5.251) 6.556 7.175 ( 0.810 -0.427 3.083) 3.216 7.611 ( -4.992 1.364 -18.110) 18.835 7.998 ( -4.347 -2.434 1.248) 5.136 8.435 ( -1.115 -7.669 -10.104) 12.734 8.718 ( -3.299 -6.819 9.438) 12.102 8.924 ( 5.258 6.004 -6.170) 10.087 9.770 ( 6.743 13.221 12.314) 19.285 10.105 ( 2.729 -3.847 2.929) 5.552 16.258 ( -2.294 -5.965 -9.836) 11.730 16.372 ( -9.390 -1.688 4.322) 10.474 16.669 ( 8.496 5.269 -1.699) 10.140 16.872 ( -0.252 1.801 4.862) 5.191 17.016 ( 3.339 2.389 10.668) 11.431 18.929 ( 1.161 -0.750 -11.590) 11.672 ======================= Grid point 170 (77/294) ======================= q-point: (-0.25 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.815 ( -28.219 5.959 -16.739) 33.347 2.060 ( -11.133 -29.079 -19.817) 36.909 2.735 ( -25.953 -12.398 16.256) 33.039 3.432 ( 6.601 7.716 2.223) 10.395 3.659 ( 10.803 -0.168 3.252) 11.283 4.582 ( 20.321 6.804 -1.596) 21.489 5.085 ( 2.733 9.952 8.632) 13.454 5.207 ( 2.611 3.905 1.194) 4.847 6.032 ( 1.643 -3.692 -7.021) 8.101 6.415 ( -2.199 -0.219 5.474) 5.903 7.195 ( -0.489 0.013 2.432) 2.481 7.418 ( -3.308 -1.426 -19.285) 19.618 7.891 ( -7.726 -0.218 2.174) 8.029 8.278 ( -0.723 -9.385 -9.470) 13.352 8.580 ( -10.316 -5.386 9.753) 15.184 9.132 ( 11.987 8.310 -5.077) 15.444 10.071 ( 6.438 11.722 9.794) 16.577 10.148 ( 5.010 -3.982 1.956) 6.692 16.094 ( -4.100 -3.676 -10.147) 11.545 16.221 ( -8.558 -3.976 5.839) 11.097 16.848 ( 8.407 2.885 -2.230) 9.164 16.936 ( 2.057 1.892 6.368) 6.954 17.156 ( 1.215 4.527 10.575) 11.567 18.864 ( 1.277 -1.086 -12.553) 12.664 ======================= Grid point 171 (78/294) ======================= q-point: (-0.17 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.291 ( -29.577 6.394 -14.326) 33.480 1.457 ( -11.453 -31.085 -19.026) 38.203 2.236 ( -30.246 -15.012 18.106) 38.315 3.649 ( 7.448 8.524 3.559) 11.865 3.831 ( 8.269 -0.442 2.494) 8.648 4.984 ( 18.914 8.270 -3.128) 20.878 5.180 ( 0.261 2.285 0.691) 2.401 5.340 ( 3.151 6.053 4.750) 8.315 5.992 ( 1.321 -1.569 -4.647) 5.080 6.421 ( -0.395 -0.887 6.166) 6.243 7.154 ( -3.810 -1.040 -6.312) 7.446 7.284 ( 1.306 -1.377 -10.489) 10.659 7.781 ( -8.190 2.949 2.787) 9.140 8.116 ( -1.031 -11.276 -5.440) 12.562 8.404 ( -12.236 -3.455 8.332) 15.201 9.388 ( 12.272 8.049 -4.663) 15.399 10.207 ( 4.404 -0.616 -1.168) 4.597 10.325 ( 6.731 6.572 7.131) 11.805 15.937 ( -4.109 -2.175 -8.569) 9.749 16.085 ( -7.192 -4.437 6.172) 10.464 16.952 ( 3.943 1.213 -1.918) 4.549 17.067 ( 5.685 1.033 7.520) 9.483 17.261 ( -0.653 3.795 8.314) 9.163 18.806 ( 1.593 0.246 -12.152) 12.259 ======================= Grid point 172 (79/294) ======================= q-point: (-0.08 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.796 ( -27.651 4.978 -6.405) 28.816 0.864 ( -10.959 -30.695 -13.358) 35.224 1.666 ( -33.402 -16.863 21.598) 43.204 3.873 ( 7.113 7.044 3.251) 10.525 3.961 ( 5.443 1.284 0.939) 5.671 5.156 ( -0.010 -1.053 -0.616) 1.220 5.259 ( 2.042 3.947 -0.151) 4.446 5.507 ( 11.529 4.904 -3.877) 13.115 6.019 ( 4.806 2.605 -0.795) 5.524 6.463 ( 1.003 -0.017 6.260) 6.340 7.006 ( -3.930 -3.828 -10.366) 11.728 7.264 ( 0.308 0.038 -2.285) 2.306 7.726 ( -5.219 5.736 3.397) 8.466 7.969 ( -1.050 -10.685 -1.192) 10.802 8.209 ( -12.175 -3.107 5.520) 13.724 9.628 ( 9.845 7.058 -2.314) 12.333 10.262 ( 3.189 1.750 -3.940) 5.363 10.499 ( 5.625 1.906 1.087) 6.037 15.821 ( -2.409 -1.086 -5.467) 6.072 15.970 ( -6.160 -3.812 5.975) 9.391 17.002 ( 2.333 0.640 -1.646) 2.926 17.206 ( 4.441 -0.076 7.225) 8.481 17.303 ( -1.072 -0.007 4.253) 4.386 18.782 ( 1.580 3.153 -9.114) 9.772 ======================= Grid point 175 (80/294) ======================= q-point: ( 0.17 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.799 ( 4.702 -0.769 26.044) 26.476 0.979 ( -8.682 0.514 31.087) 32.280 1.672 ( 2.607 29.597 34.062) 45.199 3.908 ( 1.004 -3.305 -7.653) 8.396 4.007 ( 0.834 -0.152 -4.547) 4.626 5.142 ( 0.006 -0.020 -4.699) 4.699 5.213 ( 0.170 2.322 -3.223) 3.976 5.487 ( -1.744 -11.347 -14.596) 18.570 6.284 ( 1.036 -12.799 4.300) 13.542 6.590 ( 1.426 2.978 4.563) 5.632 6.746 ( -3.271 3.783 -3.673) 6.205 7.365 ( 0.473 -4.547 8.497) 9.649 7.823 ( 4.843 -3.297 3.908) 7.043 7.907 ( -5.419 2.090 1.608) 6.027 8.122 ( 2.257 13.969 9.024) 16.782 9.808 ( 2.694 -13.336 -5.442) 14.653 10.149 ( -0.758 -2.233 -8.702) 9.016 10.371 ( -2.187 6.354 -8.817) 11.086 15.792 ( -0.038 -3.239 2.756) 4.253 15.992 ( 0.254 6.945 7.005) 9.867 16.967 ( -0.138 -1.091 -3.729) 3.888 17.169 ( -4.853 2.311 -7.592) 9.302 17.304 ( 1.593 5.521 -1.726) 6.000 18.880 ( 2.630 -10.114 4.433) 11.352 ======================= Grid point 176 (81/294) ======================= q-point: ( 0.25 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.096 ( 9.583 8.666 16.290) 20.792 1.237 ( 17.737 -5.612 29.528) 34.900 2.230 ( 5.186 29.700 30.842) 43.131 3.783 ( -5.917 -3.324 -6.189) 9.185 3.970 ( -2.513 0.463 -4.690) 5.341 5.079 ( -2.856 -0.270 -7.434) 7.968 5.149 ( -4.556 -14.975 -15.417) 21.970 5.302 ( 1.471 2.006 -1.561) 2.937 6.203 ( -0.434 -10.486 4.233) 11.317 6.503 ( -11.397 4.056 4.658) 12.963 6.850 ( 9.471 0.043 -4.489) 10.482 7.404 ( 3.616 -3.650 5.251) 7.346 7.872 ( -2.072 -0.377 6.036) 6.393 7.925 ( 7.724 -0.771 -0.090) 7.763 8.376 ( 2.139 16.812 11.368) 20.408 9.624 ( -1.630 -16.462 -9.036) 18.850 10.033 ( -5.138 0.095 -11.827) 12.895 10.344 ( -1.559 3.279 -3.965) 5.376 15.791 ( 1.499 -1.657 1.757) 2.842 16.140 ( 3.236 6.858 8.394) 11.312 16.901 ( -3.173 -2.548 -4.686) 6.207 17.028 ( -6.055 2.375 -8.684) 10.850 17.358 ( -0.583 0.927 3.148) 3.333 18.876 ( 4.528 -7.016 0.412) 8.361 ======================= Grid point 177 (82/294) ======================= q-point: ( 0.33 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.481 ( 16.090 10.917 6.782) 20.593 1.719 ( 24.809 -6.259 25.573) 36.175 2.773 ( 5.112 27.045 26.508) 38.213 3.604 ( -7.789 -2.774 -3.290) 8.899 3.877 ( -6.215 1.812 -4.524) 7.898 4.771 ( -8.500 -16.904 -16.039) 24.804 4.948 ( -5.688 -1.899 -8.666) 10.538 5.347 ( 1.259 -1.383 1.370) 2.318 6.119 ( -0.982 -8.337 2.353) 8.718 6.431 ( -5.566 6.225 2.911) 8.843 6.956 ( 6.403 -0.136 -3.668) 7.380 7.468 ( 4.392 -0.101 -0.689) 4.447 7.904 ( 2.572 -3.876 9.190) 10.301 8.058 ( 8.816 -0.308 -0.575) 8.840 8.649 ( 2.125 17.234 11.960) 21.085 9.347 ( -3.835 -17.626 -10.887) 21.069 9.839 ( -9.630 1.619 -12.659) 15.988 10.323 ( -2.085 0.736 -0.407) 2.249 15.839 ( 4.135 0.682 0.261) 4.199 16.322 ( 4.176 6.130 9.393) 11.969 16.762 ( -4.057 -4.223 -7.444) 9.471 16.925 ( -3.626 1.844 -7.067) 8.155 17.338 ( -4.551 -2.883 7.904) 9.566 18.888 ( 4.484 -3.842 -4.536) 7.446 ======================= Grid point 178 (83/294) ======================= q-point: ( 0.42 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.910 ( 19.699 10.320 1.099) 22.265 2.221 ( 24.081 -5.684 21.193) 32.578 3.196 ( 0.769 18.407 15.600) 24.141 3.453 ( -7.278 0.815 1.181) 7.418 3.753 ( -7.836 2.762 -2.742) 8.749 4.372 ( -7.565 -16.154 -15.643) 23.725 4.763 ( -8.184 -1.602 -5.080) 9.765 5.321 ( -2.342 -5.066 4.053) 6.898 6.044 ( 0.877 -6.841 -2.221) 7.246 6.458 ( -1.961 8.102 1.856) 8.540 7.025 ( 4.068 -0.042 -1.592) 4.368 7.544 ( 5.148 3.549 -5.701) 8.462 7.975 ( 5.269 -6.229 6.365) 10.348 8.207 ( 8.662 -0.753 3.606) 9.413 8.875 ( 1.188 2.911 -0.060) 3.145 9.089 ( -2.684 -3.226 -0.152) 4.199 9.597 ( -11.846 1.399 -11.881) 16.835 10.279 ( -3.719 -0.899 2.116) 4.373 15.946 ( 6.793 2.681 -0.781) 7.344 16.489 ( 1.838 3.340 6.655) 7.670 16.629 ( -0.014 -3.567 -5.330) 6.414 16.844 ( -3.449 2.129 -6.207) 7.413 17.252 ( -7.861 -4.916 10.611) 14.091 18.892 ( 4.394 -2.472 -8.493) 9.877 ======================= Grid point 179 (84/294) ======================= q-point: ( 0.50 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.342 ( 20.862 8.737 -1.774) 22.687 2.640 ( 17.778 -5.248 14.358) 23.447 3.259 ( -4.156 -1.498 -0.254) 4.426 3.370 ( -12.379 9.017 -2.965) 15.600 3.658 ( -6.005 -2.231 3.313) 7.212 4.070 ( -4.171 -8.361 -8.016) 12.311 4.646 ( -5.439 5.531 4.498) 8.967 5.238 ( -3.441 -5.970 3.776) 7.857 5.985 ( 2.792 -6.513 -6.236) 9.439 6.520 ( -2.010 8.373 1.812) 8.799 7.077 ( 2.838 -0.485 0.831) 2.997 7.636 ( 5.759 5.528 -9.542) 12.440 8.015 ( 4.120 -6.961 0.694) 8.118 8.380 ( 8.498 -1.094 8.304) 11.932 8.672 ( -1.999 -15.147 -13.534) 20.410 9.282 ( 2.073 16.881 12.558) 21.142 9.335 ( -11.390 -0.426 -9.249) 14.678 10.210 ( -4.659 -2.148 3.527) 6.226 16.103 ( 8.839 3.589 -1.117) 9.605 16.431 ( -1.890 -5.703 -6.841) 9.105 16.718 ( 5.154 0.723 6.054) 7.984 16.784 ( -3.852 6.417 -3.453) 8.243 17.120 ( -9.787 -4.950 11.695) 16.033 18.880 ( 4.269 -2.578 -11.324) 12.373 ======================= Grid point 180 (85/294) ======================= q-point: ( 0.58 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.716 ( 14.541 -3.128 -1.813) 14.983 2.817 ( 3.990 0.625 -4.203) 5.829 3.044 ( -12.050 -3.318 -10.683) 16.442 3.283 ( -4.245 6.141 2.172) 7.775 3.558 ( -1.688 -6.691 8.504) 10.952 3.924 ( -3.591 -4.671 -0.825) 5.949 4.766 ( 0.497 14.147 11.918) 18.505 5.155 ( -1.725 -4.729 1.539) 5.264 5.935 ( 3.964 -6.258 -8.294) 11.121 6.562 ( -3.568 6.901 2.199) 8.074 7.123 ( 2.243 -0.825 2.482) 3.445 7.685 ( 2.244 2.603 -14.557) 14.957 7.996 ( 2.625 -6.655 -0.594) 7.178 8.442 ( 0.525 -7.113 -14.313) 15.991 8.579 ( 7.319 -2.178 11.572) 13.865 9.085 ( -10.232 -1.223 -6.918) 12.412 9.575 ( 4.246 14.550 12.636) 19.733 10.132 ( -3.935 -3.158 3.727) 6.273 16.285 ( 8.210 1.842 -3.333) 9.050 16.302 ( 0.325 -5.639 -4.923) 7.493 16.716 ( -3.369 2.883 -4.701) 6.463 16.859 ( 0.159 -1.819 8.253) 8.452 17.028 ( -5.723 4.516 12.354) 14.345 18.845 ( 3.896 -3.390 -13.124) 14.104 ======================= Grid point 181 (86/294) ======================= q-point: (-0.33 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.436 ( -10.919 -22.607 -15.430) 29.469 2.668 ( -20.677 6.870 -14.344) 26.087 3.116 ( 14.373 3.977 -2.327) 15.093 3.352 ( 2.010 2.311 7.231) 7.853 3.480 ( -13.412 -3.798 16.031) 21.244 3.956 ( 13.635 -1.200 -0.617) 13.701 5.011 ( 2.261 14.407 11.701) 18.697 5.118 ( 1.432 -2.819 -0.549) 3.209 5.898 ( 4.601 -5.385 -8.815) 11.308 6.559 ( -4.892 4.209 2.983) 7.110 7.167 ( 1.711 -0.405 2.832) 3.333 7.558 ( -3.030 -4.291 -18.226) 18.968 7.987 ( 1.400 -4.643 2.070) 5.273 8.330 ( -0.195 0.170 -14.262) 14.264 8.748 ( 4.781 -1.528 12.301) 13.286 8.907 ( -4.527 0.355 -5.545) 7.167 9.846 ( 5.301 8.571 11.331) 15.164 10.080 ( -1.066 -1.508 2.918) 3.453 16.168 ( -1.338 -6.307 -7.576) 9.948 16.454 ( 5.653 0.333 1.240) 5.797 16.633 ( -5.141 2.563 -1.697) 5.990 16.856 ( 1.859 -4.775 5.149) 7.265 17.155 ( -0.846 11.400 11.592) 16.280 18.787 ( 3.431 -3.784 -13.809) 14.724 ======================= Grid point 182 (87/294) ======================= q-point: (-0.25 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.892 ( -14.300 -24.329 -15.846) 32.365 2.251 ( -26.157 8.903 -16.583) 32.225 3.149 ( -22.844 -10.566 18.172) 31.043 3.349 ( 11.042 2.678 -0.339) 11.368 3.560 ( 6.172 4.854 7.876) 11.122 4.275 ( 21.078 4.521 -1.498) 21.610 5.135 ( 2.751 -0.752 -0.205) 2.859 5.234 ( 2.987 8.988 7.266) 11.938 5.879 ( 4.678 -3.663 -8.160) 10.094 6.525 ( -5.026 1.865 4.331) 6.892 7.205 ( 0.931 0.396 2.172) 2.396 7.335 ( -3.911 -4.763 -17.915) 18.945 7.958 ( -1.315 -5.233 3.989) 6.710 8.226 ( -4.660 3.186 -12.687) 13.886 8.754 ( -7.370 -4.018 11.732) 14.426 8.977 ( 10.321 6.093 -5.888) 13.353 10.002 ( 5.843 -6.583 6.270) 10.807 10.160 ( 3.195 9.261 4.373) 10.728 16.040 ( -2.092 -4.703 -7.149) 8.810 16.394 ( -9.721 -1.442 3.732) 10.512 16.703 ( 8.848 1.143 -1.643) 9.071 16.904 ( 4.106 -2.387 4.492) 6.537 17.308 ( -1.485 9.650 9.055) 13.317 18.729 ( 3.151 -2.128 -12.590) 13.151 ======================= Grid point 183 (88/294) ======================= q-point: (-0.17 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.324 ( -15.961 -21.705 -11.690) 29.369 1.782 ( -28.919 10.587 -15.164) 34.327 2.720 ( -28.635 -12.173 19.753) 36.855 3.550 ( 10.958 0.174 1.226) 11.028 3.760 ( 6.321 5.021 6.813) 10.563 4.684 ( 22.281 6.973 -4.317) 23.742 5.177 ( 2.376 -0.149 0.519) 2.437 5.356 ( 2.306 0.916 1.695) 3.005 5.889 ( 4.302 -0.685 -5.479) 6.999 6.493 ( -3.611 0.662 5.475) 6.592 7.130 ( -3.762 -1.841 -14.002) 14.615 7.243 ( 0.649 1.748 0.154) 1.871 7.902 ( -2.197 -5.654 5.436) 8.145 8.089 ( -7.187 4.105 -9.635) 12.702 8.627 ( -11.553 -3.729 10.690) 16.176 9.208 ( 13.642 6.932 -6.390) 16.583 10.072 ( 7.354 -5.845 2.336) 9.680 10.326 ( 4.266 5.284 2.700) 7.308 15.923 ( -2.961 -1.955 -6.241) 7.179 16.237 ( -9.606 -1.917 4.940) 10.971 16.842 ( 7.769 0.200 -2.646) 8.209 16.998 ( 5.874 -2.423 6.709) 9.240 17.378 ( -2.615 3.477 3.000) 5.284 18.715 ( 2.807 2.810 -8.420) 9.310 ======================= Grid point 184 (89/294) ======================= q-point: (-0.08 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.847 ( -16.287 -9.852 1.152) 19.069 1.322 ( -29.284 12.042 -10.120) 33.241 2.212 ( -32.316 -13.262 22.628) 41.620 3.728 ( 10.902 -2.729 0.652) 11.257 3.939 ( 4.913 4.347 3.842) 7.602 5.050 ( 15.305 4.453 -5.645) 16.909 5.225 ( 4.149 2.464 -0.799) 4.892 5.361 ( 2.340 -5.342 -3.164) 6.634 5.954 ( 4.840 2.368 -0.153) 5.391 6.478 ( -1.098 -2.383 4.080) 4.850 7.001 ( -3.688 3.221 -9.447) 10.641 7.276 ( -0.096 3.666 0.874) 3.770 7.844 ( -1.081 -7.863 5.568) 9.695 7.969 ( -7.716 7.479 -5.387) 12.020 8.432 ( -13.608 -4.965 9.105) 17.109 9.473 ( 13.869 6.286 -4.658) 15.923 10.161 ( 7.013 -1.145 -2.069) 7.401 10.418 ( 3.658 -1.294 -1.263) 4.080 15.834 ( -3.038 1.019 -4.456) 5.489 16.102 ( -8.202 -2.230 6.168) 10.502 16.929 ( 4.928 -0.221 -3.161) 5.858 17.127 ( 6.913 -3.394 8.060) 11.148 17.323 ( -2.637 -3.941 -4.450) 6.503 18.776 ( 1.816 8.373 -3.007) 9.080 ======================= Grid point 187 (90/294) ======================= q-point: ( 0.17 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.043 ( -12.820 8.919 13.871) 20.888 1.435 ( -20.624 -1.002 29.976) 36.400 2.148 ( -1.019 29.333 30.993) 42.685 3.751 ( 6.285 -3.957 -8.506) 11.292 3.908 ( 5.298 -4.688 -2.738) 7.586 5.059 ( 2.691 -4.135 -9.152) 10.398 5.230 ( 1.708 -6.327 -6.584) 9.289 5.329 ( -1.502 2.869 -8.077) 8.702 6.160 ( 2.245 -11.871 4.492) 12.890 6.487 ( 9.002 2.630 1.427) 9.486 6.926 ( -8.934 3.772 -3.937) 10.466 7.373 ( -2.528 -5.450 4.306) 7.392 7.794 ( -1.824 -5.783 10.874) 12.450 8.025 ( -5.544 3.528 -2.054) 6.885 8.299 ( 0.848 14.655 11.144) 18.430 9.571 ( 2.516 -15.150 -7.646) 17.155 10.076 ( 4.207 -0.298 -7.926) 8.979 10.376 ( 0.745 3.963 -8.279) 9.208 15.789 ( -1.374 -1.879 1.616) 2.833 16.125 ( -2.684 6.016 7.796) 10.207 16.932 ( 0.761 -0.120 -3.633) 3.713 17.131 ( 6.177 5.483 -9.951) 12.932 17.356 ( -0.470 2.899 1.541) 3.317 18.778 ( -2.329 -12.671 2.526) 13.129 ======================= Grid point 188 (91/294) ======================= q-point: ( 0.25 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.132 ( 2.620 4.661 21.647) 22.298 1.367 ( -8.533 1.795 28.130) 29.450 2.637 ( 2.529 29.538 28.194) 40.912 3.738 ( 2.108 -3.915 -7.874) 9.043 3.924 ( 3.252 -2.501 -4.719) 6.252 4.934 ( -0.281 -14.030 -14.542) 20.209 5.124 ( -4.646 -0.660 -5.352) 7.118 5.287 ( -0.256 3.319 -6.733) 7.511 6.109 ( 1.825 -10.962 3.648) 11.696 6.663 ( 9.696 0.082 -1.536) 9.817 6.763 ( -11.820 1.838 3.406) 12.438 7.347 ( 1.751 -6.022 6.890) 9.317 7.811 ( 3.867 -3.016 3.926) 6.282 7.958 ( -4.524 2.268 -0.673) 5.105 8.556 ( 3.310 14.820 10.659) 18.553 9.381 ( 0.534 -17.059 -9.856) 19.709 10.069 ( -1.935 1.890 -5.613) 6.231 10.359 ( -0.294 3.569 -8.166) 8.917 15.771 ( 0.159 -2.389 2.988) 3.829 16.221 ( 0.992 6.817 7.289) 10.029 16.893 ( -1.857 -1.985 -4.136) 4.949 17.127 ( -5.170 4.801 -10.151) 12.362 17.388 ( 0.018 4.931 -1.558) 5.171 18.686 ( 5.099 -15.005 4.082) 16.365 ======================= Grid point 189 (92/294) ======================= q-point: ( 0.33 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.442 ( 10.696 6.395 17.196) 21.237 1.529 ( 8.094 0.132 25.430) 26.687 3.115 ( 3.037 25.091 22.832) 34.060 3.658 ( -3.065 -1.922 -3.444) 4.995 3.905 ( 0.050 -0.662 -5.980) 6.016 4.624 ( -5.951 -17.920 -14.805) 23.994 4.986 ( -6.653 0.519 -8.573) 10.864 5.306 ( 2.445 0.934 -3.061) 4.027 6.049 ( 0.639 -9.751 2.316) 10.043 6.619 ( -7.756 2.262 2.505) 8.458 6.816 ( 7.404 0.190 0.679) 7.438 7.382 ( 4.011 -4.894 4.861) 7.979 7.907 ( 7.554 -0.842 -0.056) 7.601 7.915 ( -1.709 -0.533 2.718) 3.255 8.777 ( 4.158 4.672 2.042) 6.579 9.180 ( -2.066 -8.237 -3.129) 9.051 9.966 ( -8.461 3.458 -7.556) 11.859 10.347 ( -0.247 2.319 -4.310) 4.900 15.792 ( 2.340 -1.039 2.796) 3.791 16.369 ( 3.668 5.975 7.461) 10.238 16.767 ( -5.717 -3.965 -6.518) 9.534 17.007 ( -6.894 6.195 -8.718) 12.725 17.408 ( -1.547 0.065 3.284) 3.631 18.681 ( 7.964 -12.193 -1.107) 14.605 ======================= Grid point 190 (93/294) ======================= q-point: ( 0.42 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.765 ( 11.719 8.827 8.055) 16.737 1.937 ( 20.332 -2.504 23.647) 31.286 3.386 ( -2.082 4.564 3.560) 6.151 3.641 ( -4.220 10.454 8.709) 14.245 3.840 ( -2.750 0.724 -6.353) 6.960 4.261 ( -7.460 -13.343 -11.051) 18.863 4.829 ( -5.828 0.098 -6.502) 8.732 5.315 ( 0.132 -3.101 0.890) 3.229 5.968 ( -0.609 -8.418 0.244) 8.444 6.579 ( -3.034 5.691 0.973) 6.522 6.931 ( 5.969 -0.149 0.420) 5.985 7.439 ( 5.400 -2.848 0.028) 6.105 7.903 ( 0.887 -2.615 1.712) 3.249 8.058 ( 9.814 -1.682 3.715) 10.628 8.698 ( 0.957 -16.014 -14.616) 21.702 9.238 ( 0.065 12.806 12.418) 17.838 9.774 ( -12.590 4.542 -9.151) 16.214 10.331 ( -1.833 0.594 -0.512) 1.994 15.866 ( 4.969 0.642 1.918) 5.365 16.535 ( 5.345 2.647 5.427) 8.064 16.575 ( -6.710 -3.405 -6.774) 10.125 16.924 ( -5.069 6.778 -5.530) 10.111 17.374 ( -4.629 -3.461 7.953) 9.832 18.684 ( 7.565 -9.136 -7.285) 13.920 ======================= Grid point 191 (94/294) ======================= q-point: ( 0.50 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.114 ( 15.980 7.974 2.698) 18.062 2.386 ( 19.498 -2.423 18.542) 27.016 3.292 ( -5.385 -6.550 -4.232) 9.477 3.571 ( -8.904 -1.534 -5.623) 10.643 3.756 ( -7.206 0.460 -4.865) 8.707 4.088 ( -4.683 3.043 0.712) 5.630 4.774 ( -1.117 5.381 3.626) 6.584 5.259 ( -3.080 -5.957 4.178) 7.901 5.877 ( -0.389 -6.495 -3.129) 7.220 6.620 ( -0.325 7.328 -1.109) 7.419 7.019 ( 4.187 -0.734 1.849) 4.635 7.504 ( 6.669 -1.491 -6.081) 9.147 7.903 ( 2.066 -4.278 0.159) 4.753 8.246 ( 10.910 -2.829 7.970) 13.804 8.455 ( -0.207 -13.666 -14.608) 20.004 9.434 ( -2.148 5.161 5.799) 8.054 9.565 ( -10.505 12.894 -2.698) 16.849 10.285 ( -3.939 -1.201 2.154) 4.647 15.990 ( 7.355 1.553 0.964) 7.579 16.386 ( -4.079 -5.687 -8.266) 10.831 16.660 ( 3.356 0.516 1.570) 3.741 16.920 ( -2.879 9.664 1.356) 10.175 17.291 ( -7.201 -4.193 10.850) 13.680 18.666 ( 6.820 -7.365 -11.945) 15.603 ======================= Grid point 192 (95/294) ======================= q-point: ( 0.58 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.456 ( 15.190 2.662 -0.180) 15.423 2.709 ( 8.535 -0.716 5.192) 10.016 3.035 ( -4.231 -13.229 -7.177) 15.634 3.456 ( -3.833 3.765 1.568) 5.597 3.575 ( -8.457 1.696 -6.853) 11.016 4.020 ( -7.177 -0.768 3.030) 7.828 4.918 ( 2.726 8.829 9.158) 13.009 5.169 ( -3.864 -4.803 5.338) 8.154 5.799 ( 0.953 -4.367 -6.279) 7.707 6.671 ( -1.162 6.384 -1.254) 6.609 7.085 ( 3.143 -1.007 3.140) 4.555 7.525 ( 4.998 -5.556 -12.057) 14.185 7.899 ( 2.443 -1.892 -1.308) 3.355 8.287 ( 1.362 -5.482 -11.936) 13.205 8.462 ( 11.163 -3.365 11.358) 16.277 9.234 ( -12.846 0.163 -7.484) 14.868 9.736 ( 1.436 14.112 9.738) 17.205 10.205 ( -5.205 -2.655 3.563) 6.844 16.144 ( 8.671 1.285 -0.478) 8.779 16.230 ( -2.246 -5.558 -6.596) 8.913 16.693 ( 2.039 0.303 -3.564) 4.117 16.971 ( -4.990 2.462 6.977) 8.924 17.237 ( -4.752 4.108 12.108) 13.641 18.626 ( 6.231 -6.504 -14.343) 16.937 ======================= Grid point 193 (96/294) ======================= q-point: (-0.33 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.354 ( -11.568 -17.076 -10.901) 23.329 2.876 ( 9.134 7.053 -4.447) 12.367 2.933 ( -3.093 0.900 -4.182) 5.279 3.413 ( -3.147 3.214 1.807) 4.847 3.613 ( 7.836 2.254 8.007) 11.428 3.881 ( -8.782 -3.625 5.017) 10.744 5.020 ( 2.281 -5.902 2.224) 6.707 5.189 ( -0.061 8.586 8.202) 11.875 5.751 ( 2.396 -1.968 -8.053) 8.630 6.681 ( -3.375 4.052 0.630) 5.311 7.146 ( 2.608 -0.192 2.902) 3.906 7.408 ( 0.457 -9.277 -13.898) 16.716 7.939 ( 2.308 0.646 -0.179) 2.403 8.243 ( 3.077 2.770 -12.044) 12.736 8.682 ( 9.394 -2.401 11.803) 15.275 8.997 ( -9.710 -0.310 -5.499) 11.163 9.912 ( 0.528 4.096 7.427) 8.498 10.135 ( -2.642 0.942 4.096) 4.964 16.099 ( -1.744 -4.131 -6.644) 8.016 16.315 ( 9.490 -0.010 0.676) 9.514 16.707 ( 0.591 2.702 -5.198) 5.888 16.875 ( -7.231 -6.010 9.222) 13.170 17.351 ( -1.198 10.535 10.201) 14.713 18.582 ( 5.784 -4.808 -13.779) 15.698 ======================= Grid point 194 (97/294) ======================= q-point: (-0.25 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.881 ( -16.499 -15.485 -9.238) 24.441 2.649 ( -21.414 9.591 -14.291) 27.473 3.150 ( 13.174 0.780 0.430) 13.205 3.435 ( -5.057 -4.257 10.744) 12.614 3.665 ( -9.175 1.427 13.525) 16.406 3.964 ( 18.750 3.440 -1.802) 19.148 5.020 ( 5.180 -6.414 0.210) 8.247 5.303 ( 0.832 3.216 2.642) 4.244 5.749 ( 3.506 1.652 -7.433) 8.382 6.653 ( -4.915 2.470 3.468) 6.503 7.194 ( 1.661 -1.398 -1.884) 2.875 7.246 ( -1.496 -3.443 -8.026) 8.860 7.950 ( -0.914 -2.171 1.890) 3.021 8.259 ( -0.050 8.142 -12.690) 15.078 8.851 ( 5.546 2.524 -4.201) 7.401 8.875 ( -2.374 -2.690 10.981) 11.552 9.905 ( 0.191 -8.222 4.416) 9.335 10.215 ( 2.262 6.355 3.483) 7.592 16.003 ( -1.933 -1.921 -4.955) 5.655 16.458 ( 5.730 -1.403 1.426) 6.070 16.652 ( -5.197 1.708 -1.840) 5.772 16.834 ( 3.130 -4.271 5.445) 7.595 17.458 ( -2.024 5.780 4.296) 7.481 18.579 ( 5.478 0.341 -8.986) 10.530 ======================= Grid point 195 (98/294) ======================= q-point: (-0.17 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.437 ( -18.213 -7.037 -1.298) 19.568 2.262 ( -25.879 12.097 -14.692) 32.124 3.174 ( -23.157 -10.636 19.380) 32.016 3.357 ( 10.936 -1.390 0.548) 11.037 3.753 ( 4.875 3.333 7.271) 9.367 4.341 ( 21.979 5.672 -5.008) 23.245 5.078 ( 7.479 -4.940 1.565) 9.099 5.293 ( 0.639 -5.157 -5.397) 7.493 5.812 ( 3.869 5.232 -3.860) 7.566 6.606 ( -5.464 0.211 4.236) 6.917 7.104 ( -1.950 0.172 -8.386) 8.611 7.267 ( 0.620 3.750 2.444) 4.518 7.899 ( -2.548 -4.492 2.241) 5.630 8.218 ( -5.604 8.627 -9.726) 14.157 8.835 ( -7.388 -1.211 9.231) 11.886 9.006 ( 11.039 3.237 -4.155) 12.231 9.895 ( 6.576 -8.651 2.459) 11.141 10.315 ( 2.602 2.091 0.675) 3.405 15.936 ( -2.659 1.161 -3.393) 4.465 16.408 ( -8.747 -1.842 3.936) 9.767 16.690 ( 7.731 0.400 -2.640) 8.179 16.911 ( 5.753 -2.856 4.978) 8.126 17.426 ( -3.276 -2.862 -4.203) 6.049 18.671 ( 4.667 7.313 -2.118) 8.930 ======================= Grid point 196 (99/294) ======================= q-point: (-0.08 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.177 ( -16.241 8.988 12.222) 22.224 1.858 ( -27.279 13.956 -11.546) 32.745 2.749 ( -29.062 -11.126 21.942) 38.077 3.517 ( 10.534 -3.701 0.793) 11.193 3.895 ( 5.179 -0.167 2.994) 5.984 4.718 ( 21.607 4.587 -9.013) 23.857 5.182 ( 7.388 -3.813 4.215) 9.321 5.195 ( 1.359 -6.953 -9.341) 11.724 5.921 ( 3.870 6.037 -0.073) 7.172 6.518 ( -5.034 -3.886 1.832) 6.618 7.057 ( -2.381 5.113 -5.160) 7.644 7.350 ( -0.044 8.291 4.390) 9.382 7.815 ( -2.469 -6.067 1.731) 6.775 8.149 ( -6.623 8.892 -5.851) 12.537 8.680 ( -14.203 -5.144 11.447) 18.953 9.239 ( 15.435 4.417 -6.749) 17.415 9.979 ( 9.907 -4.474 -1.904) 11.036 10.344 ( 1.834 -3.146 -1.470) 3.927 15.892 ( -3.521 4.125 -2.510) 5.976 16.266 ( -9.001 -1.670 5.828) 10.852 16.801 ( 7.118 -0.050 -4.087) 8.209 17.025 ( 6.824 -3.279 6.555) 10.015 17.270 ( -3.119 -7.696 -8.870) 12.150 18.823 ( 2.933 9.938 1.037) 10.414 ======================= Grid point 199 (100/294) ======================= q-point: ( 0.17 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.486 ( -19.111 13.284 4.112) 23.635 1.973 ( -23.216 -1.148 27.105) 35.707 2.626 ( -2.296 25.511 26.727) 37.019 3.547 ( 6.408 -4.886 -7.826) 11.233 3.734 ( 6.375 -6.995 -1.227) 9.543 4.827 ( 7.549 -11.885 -10.979) 17.854 5.038 ( 8.326 0.805 -11.657) 14.348 5.392 ( -1.334 1.299 0.954) 2.093 6.057 ( -0.802 -9.206 0.865) 9.281 6.409 ( 4.718 3.701 1.260) 6.127 7.031 ( -3.231 3.178 -4.131) 6.132 7.398 ( -4.621 -3.308 -1.209) 5.810 7.897 ( -7.871 -7.698 14.390) 18.118 8.134 ( -5.322 3.575 -3.375) 7.246 8.504 ( -1.715 12.138 10.792) 16.332 9.351 ( 2.143 -13.124 -6.615) 14.852 9.895 ( 10.766 2.292 -11.778) 16.121 10.337 ( 2.319 0.533 -2.835) 3.701 15.828 ( -3.926 -0.006 -0.301) 3.937 16.282 ( -4.262 3.952 7.864) 9.778 16.896 ( 1.470 0.363 -2.641) 3.045 16.988 ( 9.024 6.082 -11.747) 16.013 17.352 ( 5.139 -1.701 7.870) 9.552 18.751 ( -7.572 -10.183 -3.104) 13.063 ======================= Grid point 200 (101/294) ======================= q-point: ( 0.25 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.395 ( -10.818 10.598 12.418) 19.584 1.778 ( -17.832 -0.782 28.369) 33.517 3.032 ( 1.777 24.695 22.663) 33.565 3.572 ( 6.689 -2.896 -7.366) 10.363 3.775 ( 6.333 -5.092 -2.292) 8.444 4.705 ( 1.586 -14.659 -11.884) 18.938 5.089 ( 4.169 1.387 -9.170) 10.168 5.339 ( -5.593 3.359 -5.221) 8.357 5.980 ( 2.476 -11.307 1.962) 11.740 6.530 ( 5.762 1.506 -0.141) 5.957 6.954 ( -7.136 1.654 0.687) 7.358 7.318 ( -0.798 -5.621 4.701) 7.371 7.798 ( -2.923 -5.890 8.317) 10.602 8.055 ( -5.333 3.005 -3.429) 7.017 8.658 ( 1.757 5.235 3.390) 6.480 9.222 ( -0.337 -6.918 -1.511) 7.089 10.022 ( 6.552 3.440 -6.637) 9.940 10.336 ( 0.191 1.592 -6.526) 6.720 15.780 ( -1.620 -1.403 2.177) 3.054 16.319 ( -1.136 4.501 5.916) 7.520 16.878 ( -0.882 -1.501 -3.397) 3.818 17.109 ( 4.996 6.194 -10.804) 13.419 17.435 ( 0.361 3.657 0.249) 3.683 18.522 ( -2.305 -16.379 2.447) 16.721 ======================= Grid point 201 (102/294) ======================= q-point: ( 0.33 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.497 ( 1.345 7.273 18.419) 19.849 1.724 ( -8.356 1.380 24.618) 26.034 3.359 ( 3.321 8.649 7.559) 11.957 3.647 ( 4.156 6.200 1.179) 7.556 3.816 ( 3.573 -0.871 -1.574) 4.001 4.470 ( -3.766 -14.338 -9.693) 17.712 5.062 ( -4.741 2.372 -8.216) 9.778 5.260 ( -0.293 2.569 -7.892) 8.305 5.934 ( 2.926 -10.926 2.201) 11.523 6.615 ( 4.479 -1.490 -1.312) 4.899 6.870 ( -6.020 1.127 6.990) 9.294 7.309 ( 2.140 -5.905 5.338) 8.243 7.799 ( 3.758 -2.497 2.635) 5.225 7.977 ( -4.384 1.556 -2.160) 5.129 8.635 ( 1.727 -11.197 -9.684) 14.904 9.252 ( -0.335 8.069 9.803) 12.701 10.065 ( -2.550 4.116 -4.280) 6.463 10.320 ( 1.462 2.579 -7.506) 8.070 15.775 ( 0.598 -1.470 3.594) 3.928 16.396 ( 2.239 2.607 3.371) 4.814 16.794 ( -4.439 -1.518 -3.847) 6.067 17.117 ( -3.633 6.312 -8.681) 11.332 17.449 ( -1.479 3.719 -2.149) 4.543 18.415 ( 6.211 -17.357 3.388) 18.743 ======================= Grid point 202 (103/294) ======================= q-point: ( 0.42 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.771 ( 7.649 6.520 15.363) 18.358 1.832 ( 5.088 0.841 21.722) 22.326 3.394 ( 0.443 -5.016 -4.552) 6.788 3.757 ( 4.838 -2.968 -5.716) 8.056 3.835 ( -5.423 2.671 -0.598) 6.075 4.288 ( -5.011 3.311 3.637) 7.021 4.912 ( -7.705 2.672 -6.963) 10.723 5.269 ( 2.483 -0.168 -3.445) 4.250 5.883 ( 1.367 -9.372 1.008) 9.525 6.632 ( 0.790 -1.291 -0.698) 1.667 6.883 ( 0.949 1.253 5.702) 5.914 7.327 ( 3.551 -6.178 3.137) 7.786 7.882 ( 4.322 0.182 -2.704) 5.102 7.930 ( 1.507 -2.053 3.387) 4.238 8.449 ( 0.423 -13.922 -12.484) 18.704 9.421 ( 0.581 10.334 11.159) 15.220 9.972 ( -9.824 6.350 -5.961) 13.129 10.338 ( 1.207 2.045 -3.472) 4.206 15.816 ( 2.964 -0.759 3.705) 4.805 16.439 ( 2.348 -5.053 -4.374) 7.083 16.693 ( -6.002 4.499 0.304) 7.508 17.055 ( -5.214 7.621 -4.537) 10.288 17.438 ( -1.903 -0.779 2.841) 3.507 18.397 ( 8.695 -14.283 -2.774) 16.951 ======================= Grid point 203 (104/294) ======================= q-point: ( 0.50 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.006 ( 8.522 6.003 7.124) 12.626 2.188 ( 16.546 0.118 20.254) 26.154 3.243 ( -4.508 -11.797 -9.474) 15.788 3.620 ( -6.008 -5.058 -5.973) 9.867 3.779 ( 0.169 -1.538 -4.597) 4.850 4.296 ( -10.105 11.268 -0.009) 15.135 4.868 ( -0.717 6.232 5.806) 8.548 5.270 ( -0.512 -2.389 1.830) 3.052 5.809 ( -0.342 -7.497 -1.062) 7.579 6.643 ( 1.977 1.849 -3.034) 4.066 6.963 ( 3.560 0.103 4.083) 5.418 7.338 ( 4.397 -6.964 -1.256) 8.332 7.868 ( -0.618 0.440 -3.063) 3.156 8.063 ( 10.826 -5.521 6.002) 13.554 8.271 ( 0.412 -7.874 -9.707) 12.505 9.546 ( -2.535 3.334 4.129) 5.881 9.845 ( -9.577 12.569 -2.666) 16.025 10.339 ( -1.778 0.367 0.695) 1.944 15.902 ( 5.307 -0.131 2.847) 6.024 16.324 ( -1.864 -7.321 -8.553) 11.411 16.679 ( -2.772 4.532 -0.566) 5.343 17.071 ( -2.326 9.016 3.469) 9.937 17.404 ( -3.545 -2.659 7.374) 8.603 18.379 ( 8.288 -11.214 -9.588) 16.923 ======================= Grid point 204 (105/294) ======================= q-point: ( 0.58 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.264 ( 12.131 4.367 1.408) 12.970 2.574 ( 14.919 0.129 15.173) 21.280 2.924 ( -7.341 -15.094 -10.958) 20.045 3.515 ( -2.052 0.233 0.647) 2.164 3.700 ( -5.503 1.811 -8.582) 10.355 4.174 ( -10.082 4.396 -2.195) 11.215 4.994 ( 0.470 2.659 10.021) 10.378 5.245 ( -2.582 0.188 6.028) 6.561 5.723 ( -0.359 -4.743 -4.496) 6.545 6.694 ( 2.958 4.140 -4.419) 6.739 7.041 ( 3.381 -1.058 3.564) 5.025 7.313 ( 3.851 -8.599 -5.679) 11.001 7.861 ( 1.061 2.395 -3.451) 4.333 8.137 ( 4.049 -5.996 -4.437) 8.487 8.308 ( 10.346 -1.802 7.361) 12.825 9.407 ( -12.026 0.237 -6.184) 13.525 9.908 ( -1.269 12.228 4.262) 13.011 10.290 ( -4.676 -1.569 3.457) 6.023 16.020 ( 7.096 0.028 1.204) 7.197 16.179 ( -2.207 -4.924 -6.536) 8.476 16.665 ( -0.763 2.170 -3.467) 4.160 17.123 ( -4.948 1.815 7.803) 9.416 17.403 ( -1.981 4.404 9.739) 10.871 18.346 ( 8.045 -8.592 -13.460) 17.881 ======================= Grid point 205 (106/294) ======================= q-point: (-0.33 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.342 ( -6.822 -8.845 -5.134) 12.294 2.708 ( 8.344 3.266 -4.828) 10.178 2.909 ( 9.926 -2.086 9.041) 13.587 3.534 ( -7.899 2.901 -8.049) 11.644 3.554 ( 3.041 3.323 -0.164) 4.507 4.054 ( -8.285 0.293 4.910) 9.635 4.985 ( -3.332 -7.853 7.873) 11.608 5.287 ( -0.117 3.221 3.880) 5.044 5.669 ( 1.351 0.007 -6.799) 6.932 6.753 ( 0.352 5.441 -1.289) 5.602 7.093 ( 3.587 -3.367 -0.007) 4.920 7.244 ( 1.558 -6.281 -4.462) 7.860 7.912 ( 2.931 4.174 -2.731) 5.785 8.142 ( 3.860 1.372 -7.015) 8.124 8.541 ( 12.326 -3.159 11.799) 17.353 9.151 ( -12.873 0.569 -7.333) 14.826 9.998 ( -2.225 3.120 3.751) 5.363 10.220 ( -3.645 -0.041 3.870) 5.316 16.065 ( -1.473 -0.941 -5.713) 5.974 16.168 ( 7.994 -1.134 1.751) 8.262 16.666 ( 1.572 1.590 -3.947) 4.536 17.027 ( -9.147 -4.820 8.506) 13.388 17.510 ( -0.987 7.282 6.820) 10.026 18.341 ( 8.612 -3.623 -11.393) 14.734 ======================= Grid point 206 (107/294) ======================= q-point: (-0.25 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.017 ( -15.629 -6.062 -2.169) 16.903 2.933 ( 7.763 2.782 -2.279) 8.555 2.958 ( -5.019 7.793 -5.610) 10.835 3.447 ( 1.625 -2.119 2.637) 3.753 3.712 ( 11.856 2.102 -4.214) 12.757 3.945 ( -10.605 -0.814 13.473) 17.165 4.904 ( -0.092 -8.878 5.358) 10.370 5.285 ( 0.142 -3.722 -4.669) 5.973 5.698 ( 2.840 5.661 -4.601) 7.829 6.781 ( -4.022 4.057 3.403) 6.649 7.080 ( 3.368 -4.824 -6.598) 8.840 7.239 ( 1.207 1.336 2.708) 3.251 7.965 ( 0.075 1.576 0.055) 1.579 8.213 ( 5.432 8.017 -11.030) 14.678 8.768 ( 7.721 -1.515 7.531) 10.891 8.944 ( -5.726 0.040 -1.555) 5.933 9.908 ( -6.565 -7.832 4.102) 11.011 10.244 ( 1.349 2.819 0.746) 3.213 16.012 ( -2.049 2.005 -2.980) 4.135 16.312 ( 9.062 -1.032 0.599) 9.140 16.696 ( 2.153 2.251 -4.460) 5.440 16.868 ( -8.587 -6.239 9.176) 14.030 17.529 ( -2.726 -0.753 -2.249) 3.613 18.450 ( 8.672 5.170 -3.208) 10.594 ======================= Grid point 207 (108/294) ======================= q-point: (-0.17 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.741 ( -16.575 4.156 6.267) 18.201 2.694 ( -21.548 12.432 -13.084) 28.108 3.161 ( 11.235 -0.717 1.470) 11.354 3.459 ( -5.701 -6.895 10.436) 13.746 3.767 ( -1.374 -4.379 6.353) 7.837 4.039 ( 14.418 5.393 -1.902) 15.510 4.895 ( 5.822 -9.090 3.291) 11.285 5.189 ( 0.095 -5.550 -8.971) 10.549 5.798 ( 3.486 7.798 -2.515) 8.904 6.720 ( -6.347 -2.397 3.225) 7.512 7.078 ( 1.753 2.123 -4.683) 5.432 7.324 ( 1.618 5.927 6.074) 8.640 7.940 ( -3.777 -0.232 0.079) 3.785 8.293 ( 0.362 9.428 -10.630) 14.214 8.807 ( 4.677 2.495 -8.475) 9.996 9.007 ( 0.718 -1.338 14.240) 14.321 9.754 ( -1.043 -11.281 2.329) 11.566 10.282 ( 1.870 -0.607 -1.737) 2.623 15.996 ( -2.619 5.031 -1.091) 5.776 16.441 ( 6.153 -1.349 0.479) 6.317 16.659 ( -5.557 1.157 -1.268) 5.816 16.821 ( 3.932 -4.503 6.261) 8.657 17.393 ( -3.843 -7.457 -8.811) 12.166 18.661 ( 6.957 10.246 1.967) 12.540 ======================= Grid point 208 (109/294) ======================= q-point: (-0.08 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.648 ( -13.920 16.326 15.602) 26.527 2.356 ( -24.387 14.322 -11.867) 30.670 3.208 ( -21.771 -9.972 18.284) 30.129 3.324 ( 9.380 -2.763 1.224) 9.855 3.801 ( 4.923 -5.605 2.867) 7.992 4.349 ( 19.900 4.357 -9.829) 22.619 4.913 ( 7.722 -13.015 -3.769) 15.596 5.139 ( 2.853 0.119 -1.654) 3.300 5.926 ( 3.684 8.142 -1.106) 9.005 6.583 ( -6.616 -5.806 1.999) 9.026 7.093 ( -0.361 3.314 -4.109) 5.291 7.486 ( 1.316 11.954 9.462) 15.302 7.845 ( -5.488 -1.512 -1.510) 5.889 8.280 ( -4.195 7.640 -6.981) 11.166 8.903 ( -1.351 0.398 1.178) 1.836 9.015 ( 2.796 -1.104 3.493) 4.609 9.736 ( 9.596 -8.245 -2.108) 12.826 10.271 ( 1.350 -4.210 -2.226) 4.950 15.999 ( -3.785 7.127 -0.847) 8.114 16.426 ( -6.811 -1.638 4.978) 8.593 16.661 ( 5.825 0.944 -3.832) 7.036 16.916 ( 6.738 -3.527 6.010) 9.693 17.182 ( -3.484 -9.311 -10.198) 14.242 18.870 ( 4.146 9.720 1.891) 10.735 ======================= Grid point 211 (110/294) ======================= q-point: ( 0.17 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.962 ( -20.237 14.369 -1.099) 24.844 2.496 ( -21.638 -1.455 22.290) 31.099 2.984 ( 1.288 14.057 15.937) 21.290 3.364 ( 4.975 -3.265 -5.426) 8.053 3.591 ( 3.198 -3.934 4.236) 6.607 4.499 ( 9.663 -11.513 -8.628) 17.331 4.808 ( 11.819 1.531 -11.877) 16.826 5.374 ( 4.146 -2.956 3.925) 6.429 6.028 ( -5.422 -5.801 -4.537) 9.146 6.407 ( 2.288 5.084 1.807) 5.860 7.071 ( -1.354 2.069 -1.750) 3.029 7.451 ( -6.586 -1.514 -4.968) 8.387 8.039 ( -7.451 -6.386 8.338) 12.876 8.232 ( -5.548 1.333 -0.692) 5.748 8.722 ( -6.267 6.141 9.424) 12.877 9.164 ( 4.869 -7.656 -2.964) 9.545 9.642 ( 13.345 4.898 -14.066) 19.998 10.279 ( 3.525 -1.520 2.058) 4.356 15.919 ( -6.913 1.436 -1.780) 7.282 16.430 ( -4.775 1.464 6.368) 8.093 16.798 ( 6.859 -0.173 -10.108) 12.217 16.880 ( 4.265 6.007 -1.914) 7.612 17.260 ( 8.618 -4.426 10.983) 14.645 18.780 ( -9.087 -6.743 -7.700) 13.687 ======================= Grid point 212 (111/294) ======================= q-point: ( 0.25 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.795 ( -16.175 12.724 4.732) 21.117 2.254 ( -20.437 -2.947 24.780) 32.255 3.184 ( 6.558 -1.172 1.027) 6.741 3.451 ( 5.934 5.053 -1.315) 7.904 3.687 ( 2.819 6.313 10.684) 12.726 4.452 ( 5.103 -12.830 -8.067) 15.992 4.929 ( 8.907 2.831 -12.455) 15.572 5.403 ( -0.699 -1.305 0.878) 1.721 5.859 ( -1.864 -9.015 -4.190) 10.115 6.501 ( 1.887 4.072 1.965) 4.899 7.049 ( -2.920 2.128 -1.231) 3.817 7.320 ( -3.346 -5.208 1.166) 6.299 7.878 ( -7.502 -7.648 7.565) 13.115 8.148 ( -5.235 2.402 -3.537) 6.759 8.658 ( -4.055 -6.725 -3.003) 8.408 9.220 ( 3.001 4.415 6.780) 8.629 9.855 ( 12.471 7.223 -9.543) 17.285 10.309 ( 0.859 -0.757 -0.843) 1.422 15.828 ( -4.127 0.106 0.371) 4.145 16.407 ( -2.650 0.567 3.366) 4.321 16.823 ( 3.399 -1.623 -6.060) 7.135 17.020 ( 5.697 8.238 -5.434) 11.395 17.415 ( 5.971 -1.276 7.383) 9.581 18.482 ( -9.612 -12.146 -4.789) 16.212 ======================= Grid point 213 (112/294) ======================= q-point: ( 0.33 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.741 ( -8.568 9.737 10.918) 16.954 2.079 ( -15.197 -1.923 23.805) 28.307 3.239 ( 7.865 -7.361 -5.640) 12.159 3.548 ( 6.421 -2.511 -4.753) 8.373 3.910 ( 0.352 12.516 8.875) 15.347 4.363 ( 1.094 -5.544 0.387) 5.664 5.012 ( 6.041 3.314 -11.018) 12.995 5.316 ( -7.399 2.224 -6.976) 10.409 5.768 ( 4.209 -11.864 0.696) 12.608 6.564 ( 1.008 0.860 2.467) 2.800 6.997 ( -4.615 -0.472 3.211) 5.642 7.259 ( 0.459 -5.844 3.216) 6.686 7.771 ( -1.864 -4.039 2.856) 5.286 8.058 ( -5.318 1.890 -3.614) 6.702 8.469 ( -2.511 -12.083 -7.202) 14.288 9.386 ( 2.196 8.550 9.063) 12.651 10.056 ( 7.288 7.861 -4.453) 11.608 10.288 ( -0.846 0.771 -4.522) 4.664 15.788 ( -1.374 -0.772 2.515) 2.968 16.385 ( -0.139 -2.585 -0.942) 2.754 16.819 ( 0.081 1.428 -3.013) 3.335 17.133 ( 2.531 6.273 -4.580) 8.169 17.500 ( -0.316 3.653 -0.847) 3.764 18.221 ( -2.012 -17.028 1.520) 17.214 ======================= Grid point 214 (113/294) ======================= q-point: ( 0.42 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.837 ( 1.433 5.892 14.844) 16.035 2.005 ( -7.691 -0.738 19.325) 20.812 3.235 ( 5.103 -8.647 -7.598) 12.591 3.578 ( 5.668 -5.141 -5.797) 9.600 3.894 ( -5.100 -3.942 -5.648) 8.570 4.493 ( -0.333 15.082 13.612) 20.319 5.021 ( -4.086 3.987 -7.899) 9.746 5.201 ( 0.384 2.022 -8.068) 8.326 5.746 ( 4.422 -10.973 2.039) 12.005 6.581 ( 0.667 -3.522 2.958) 4.647 6.948 ( -2.616 -1.300 4.875) 5.683 7.244 ( 1.719 -5.108 1.955) 5.733 7.773 ( 4.242 -1.959 -0.108) 4.673 7.968 ( -4.318 0.435 -2.456) 4.987 8.283 ( -1.443 -9.981 -6.212) 11.845 9.544 ( 1.541 6.670 6.818) 9.662 10.142 ( -5.158 7.043 -1.097) 8.798 10.291 ( 3.998 3.646 -5.852) 7.970 15.796 ( 1.049 -1.209 3.864) 4.182 16.325 ( 0.528 -6.572 -5.582) 8.638 16.828 ( -2.690 6.618 -0.762) 7.184 17.167 ( -2.265 5.606 -1.295) 6.184 17.480 ( -2.915 2.495 -2.431) 4.543 18.112 ( 6.160 -16.798 1.622) 17.965 ======================= Grid point 215 (114/294) ======================= q-point: ( 0.50 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.021 ( 1.708 2.686 9.261) 9.793 2.091 ( 8.910 -0.053 18.548) 20.577 3.122 ( -1.711 -10.541 -9.721) 14.441 3.562 ( 2.451 -5.506 -5.394) 8.088 3.752 ( -2.872 -1.801 -3.268) 4.709 4.595 ( -11.648 12.896 -2.249) 17.522 4.984 ( -0.960 6.058 5.616) 8.317 5.242 ( 3.704 1.843 -1.566) 4.423 5.712 ( 2.161 -9.366 0.290) 9.617 6.570 ( 2.302 -4.728 0.454) 5.278 6.951 ( 1.063 -0.762 3.197) 3.455 7.230 ( 1.298 -4.806 0.355) 4.991 7.853 ( 5.556 0.274 -2.342) 6.036 7.905 ( 0.244 -3.565 1.666) 3.943 8.171 ( 0.125 -4.168 -2.807) 5.027 9.626 ( -1.174 2.378 2.155) 3.417 10.078 ( -7.636 8.776 -3.433) 12.129 10.361 ( 1.142 3.122 -0.132) 3.327 15.845 ( 3.240 -1.339 3.971) 5.297 16.221 ( -0.261 -6.551 -6.706) 9.378 16.809 ( -6.395 7.113 -4.016) 10.374 17.208 ( -1.193 6.678 6.736) 9.560 17.452 ( -0.961 -0.640 2.057) 2.359 18.076 ( 7.520 -13.400 -5.298) 16.253 ======================= Grid point 216 (115/294) ======================= q-point: ( 0.58 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.151 ( 7.083 2.634 2.336) 7.910 2.404 ( 15.213 -2.340 16.625) 22.656 2.877 ( -7.977 -9.017 -8.894) 14.968 3.512 ( 0.650 -3.628 -2.437) 4.418 3.711 ( -1.143 1.881 -4.172) 4.717 4.421 ( -14.484 8.072 -6.372) 17.763 5.076 ( -0.496 1.222 7.900) 8.009 5.312 ( 0.139 2.557 4.681) 5.335 5.643 ( 0.770 -7.165 -2.968) 7.794 6.603 ( 6.116 -0.185 -3.151) 6.883 6.991 ( 2.817 -2.064 1.931) 3.990 7.199 ( 0.371 -4.005 -0.485) 4.051 7.860 ( -0.465 2.862 -3.792) 4.773 7.984 ( 7.470 -4.902 3.785) 9.704 8.193 ( 5.550 -0.363 2.975) 6.307 9.550 ( -8.361 0.114 -4.163) 9.341 10.056 ( -3.199 8.673 -1.945) 9.446 10.369 ( -3.134 -0.071 2.904) 4.273 15.924 ( 5.151 -1.280 2.880) 6.039 16.128 ( -0.778 -3.120 -4.572) 5.590 16.727 ( -5.659 4.651 -5.369) 9.082 17.262 ( -4.595 -0.949 10.065) 11.105 17.505 ( 1.790 6.103 6.244) 8.913 18.040 ( 8.385 -9.787 -11.017) 16.955 ======================= Grid point 217 (116/294) ======================= q-point: ( 0.67 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.301 ( 5.367 0.664 -1.888) 5.728 2.634 ( -1.846 -4.069 -4.328) 6.220 2.742 ( 13.033 -1.347 13.072) 18.508 3.491 ( 2.263 -2.932 -3.025) 4.782 3.656 ( -6.007 5.715 -7.392) 11.108 4.245 ( -10.575 4.273 -0.215) 11.408 5.061 ( -5.168 -5.146 9.739) 12.167 5.303 ( -1.966 -4.406 -1.433) 5.033 5.616 ( 2.369 1.622 -2.895) 4.077 6.731 ( 7.681 5.874 -3.220) 10.192 7.000 ( 0.675 -5.274 0.874) 5.388 7.181 ( 1.430 -1.444 0.508) 2.095 7.884 ( 2.463 3.465 -3.530) 5.526 8.068 ( 3.691 1.076 0.457) 3.872 8.374 ( 11.816 -1.932 9.335) 15.181 9.332 ( -12.866 0.740 -7.616) 14.969 10.081 ( -1.838 4.066 -0.215) 4.468 10.297 ( -4.918 -3.092 2.607) 6.368 16.021 ( 5.555 -0.065 -0.166) 5.558 16.089 ( -0.002 0.351 -0.002) 0.351 16.663 ( -2.249 2.679 -4.726) 5.880 17.175 ( -7.929 -5.549 9.261) 13.395 17.601 ( -1.339 2.260 1.268) 2.917 18.096 ( 11.959 0.364 -6.170) 13.461 ======================= Grid point 218 (117/294) ======================= q-point: (-0.25 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.228 ( -10.865 1.319 2.442) 11.214 2.726 ( 12.922 3.619 -4.671) 14.209 3.010 ( 9.648 -0.804 9.447) 13.527 3.444 ( -3.038 -0.967 -8.883) 9.438 3.585 ( -0.301 4.297 -5.735) 7.173 4.141 ( -6.909 -0.982 6.350) 9.435 4.946 ( -7.707 -7.893 11.206) 15.725 5.189 ( -0.375 -6.250 -9.045) 11.001 5.693 ( 2.885 6.366 -1.432) 7.135 6.902 ( 1.020 9.203 1.320) 9.353 6.928 ( 2.084 -7.693 -2.386) 8.320 7.235 ( 3.675 1.631 2.991) 5.011 7.954 ( 3.522 2.953 -2.534) 5.248 8.147 ( 3.459 5.628 -3.754) 7.598 8.633 ( 12.800 -1.837 11.415) 17.249 9.074 ( -12.082 1.223 -8.369) 14.748 10.005 ( -8.872 -5.516 4.590) 11.411 10.230 ( 0.411 -1.303 -2.831) 3.143 16.070 ( -1.134 5.813 -1.367) 6.078 16.165 ( 7.229 -1.150 2.128) 7.623 16.650 ( 1.345 1.300 -3.650) 4.102 17.024 ( -9.565 -5.832 8.407) 14.007 17.513 ( -3.246 -6.085 -7.435) 10.141 18.347 ( 11.781 9.504 1.950) 15.262 ======================= Grid point 219 (118/294) ======================= q-point: (-0.17 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.109 ( -12.741 9.601 9.145) 18.388 2.962 ( 12.192 2.712 -2.367) 12.712 3.053 ( -12.209 10.038 -6.852) 17.227 3.392 ( 6.418 -7.301 3.220) 10.241 3.638 ( 7.837 -1.432 -6.773) 10.457 4.050 ( -5.117 -4.361 6.786) 9.553 4.819 ( -4.457 -9.386 8.169) 13.217 5.088 ( 0.535 -2.310 -8.115) 8.455 5.805 ( 3.346 7.919 -1.744) 8.772 6.794 ( -5.246 -7.193 2.343) 9.206 7.039 ( 3.357 5.247 -3.382) 7.088 7.383 ( 4.920 7.432 7.803) 11.846 7.994 ( -0.905 1.875 -1.173) 2.390 8.257 ( 5.575 8.311 -8.210) 12.944 8.781 ( -3.311 0.888 -3.922) 5.209 8.984 ( 7.580 0.062 6.691) 10.111 9.774 ( -11.164 -11.323 4.860) 16.627 10.217 ( 1.925 -2.296 -4.422) 5.341 16.105 ( -2.617 8.476 0.315) 8.876 16.297 ( 8.426 -0.536 0.046) 8.444 16.683 ( 3.216 1.018 -2.825) 4.400 16.862 ( -8.687 -5.793 8.853) 13.689 17.318 ( -4.208 -9.198 -9.847) 14.116 18.647 ( 9.257 11.214 3.243) 14.899 ======================= Grid point 220 (119/294) ======================= q-point: (-0.08 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.117 ( -10.630 17.508 14.748) 25.239 2.802 ( -20.895 13.710 -11.036) 27.319 3.163 ( 9.323 -0.486 0.864) 9.375 3.421 ( -2.003 -8.127 7.331) 11.127 3.659 ( 3.960 -11.512 1.239) 12.237 4.065 ( 10.010 1.839 -5.822) 11.725 4.704 ( -0.374 -11.965 1.595) 12.077 5.088 ( 2.930 1.960 -1.383) 3.786 5.934 ( 3.880 8.659 -2.388) 9.784 6.641 ( -6.131 -7.911 2.828) 10.400 7.089 ( 1.061 2.603 -3.529) 4.511 7.621 ( 4.708 11.708 11.658) 17.180 7.938 ( -6.193 2.170 -3.689) 7.528 8.346 ( 0.288 7.215 -7.199) 10.197 8.744 ( 5.863 1.987 -8.747) 10.716 9.159 ( 0.006 0.104 11.907) 11.908 9.529 ( -2.135 -13.100 -0.286) 13.276 10.189 ( 1.524 -4.338 -3.221) 5.614 16.142 ( -3.876 9.351 0.051) 10.122 16.424 ( 6.650 0.285 -1.355) 6.793 16.674 ( -5.605 0.824 1.114) 5.774 16.812 ( 4.711 -5.378 7.666) 10.483 17.093 ( -4.238 -9.392 -9.636) 14.107 18.889 ( 5.661 9.205 1.122) 10.865 ======================= Grid point 223 (120/294) ======================= q-point: ( 0.17 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.416 ( -19.469 13.426 -4.046) 23.993 2.846 ( -7.645 -12.081 5.216) 15.218 3.003 ( -0.043 0.328 2.914) 2.932 3.294 ( 3.737 5.443 1.248) 6.719 3.648 ( 0.376 3.849 15.696) 16.165 4.210 ( 7.285 -8.340 -5.204) 12.236 4.554 ( 11.275 1.287 -7.932) 13.846 5.272 ( 5.248 -4.642 3.102) 7.662 6.049 ( -6.302 -3.813 -7.215) 10.311 6.437 ( 2.436 5.703 2.805) 6.806 7.108 ( -1.493 1.300 1.015) 2.225 7.514 ( -7.380 -2.055 -8.864) 11.716 8.090 ( -2.590 -3.574 -2.802) 5.228 8.359 ( -8.022 -1.582 5.465) 9.835 8.938 ( -12.325 -5.320 4.188) 14.063 8.994 ( 10.823 1.801 0.739) 10.996 9.407 ( 12.499 8.513 -9.037) 17.617 10.224 ( 3.722 -1.286 4.994) 6.360 16.064 ( -9.696 2.178 -2.171) 10.172 16.534 ( -4.026 -1.594 2.369) 4.935 16.614 ( 6.522 -0.831 -10.362) 12.272 16.875 ( 3.928 4.676 4.794) 7.764 17.135 ( 9.104 -2.657 10.527) 14.169 18.817 ( -8.136 -4.394 -10.691) 14.135 ======================= Grid point 224 (121/294) ======================= q-point: ( 0.25 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.215 ( -17.497 12.060 -0.415) 21.255 2.635 ( -12.693 -7.884 12.585) 19.536 2.982 ( 4.431 -8.504 -3.067) 10.068 3.394 ( 2.172 2.077 0.760) 3.100 3.859 ( 2.490 13.115 14.265) 19.537 4.202 ( 6.984 -9.727 -3.672) 12.525 4.715 ( 10.966 3.829 -10.755) 15.830 5.333 ( 5.437 -6.171 4.525) 9.387 5.838 ( -7.483 -4.696 -8.533) 12.283 6.549 ( 1.060 6.371 3.346) 7.274 7.099 ( -1.733 1.890 -0.537) 2.620 7.332 ( -4.898 -6.039 -3.736) 8.626 7.951 ( -6.014 -5.801 -1.267) 8.451 8.247 ( -6.568 0.187 1.010) 6.648 8.674 ( -9.929 -10.697 -0.965) 14.627 9.213 ( 9.034 4.919 3.378) 10.827 9.680 ( 12.349 12.243 -5.634) 18.279 10.285 ( 1.683 -1.333 3.780) 4.348 15.927 ( -7.154 1.283 -1.201) 7.367 16.443 ( -2.594 -4.826 -1.362) 5.645 16.679 ( 6.489 1.067 -7.142) 9.709 17.018 ( 3.612 5.806 3.732) 7.790 17.329 ( 8.249 -1.040 10.275) 13.218 18.520 ( -11.511 -8.156 -10.595) 17.643 ======================= Grid point 225 (122/294) ======================= q-point: ( 0.33 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.067 ( -13.285 9.051 3.765) 16.511 2.428 ( -14.088 -6.200 16.201) 22.347 2.978 ( 7.964 -8.883 -4.837) 12.874 3.431 ( 2.088 -1.088 -0.594) 2.428 3.984 ( -0.499 -1.209 -4.601) 4.783 4.344 ( 9.075 8.321 12.332) 17.427 4.852 ( 8.198 4.673 -10.557) 14.160 5.373 ( 0.932 -3.246 2.070) 3.961 5.630 ( -3.598 -6.839 -6.672) 10.210 6.621 ( -1.733 3.916 4.935) 6.534 7.061 ( -3.527 -0.703 -1.596) 3.935 7.210 ( -0.186 -6.935 1.104) 7.025 7.798 ( -4.801 -3.620 -1.832) 6.286 8.149 ( -5.965 1.246 -2.075) 6.437 8.414 ( -7.253 -11.273 -0.365) 13.410 9.417 ( 7.094 5.045 2.437) 9.040 9.964 ( 10.559 11.889 -3.695) 16.325 10.300 ( -0.831 -0.523 1.877) 2.118 15.840 ( -3.955 0.415 0.447) 4.002 16.341 ( -1.368 -6.420 -3.518) 7.447 16.761 ( 5.612 2.937 -5.235) 8.217 17.144 ( 2.525 4.470 3.848) 6.416 17.501 ( 4.858 2.318 6.151) 8.174 18.175 ( -10.506 -11.833 -7.301) 17.427 ======================= Grid point 226 (123/294) ======================= q-point: ( 0.42 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.002 ( -6.126 4.588 7.728) 10.877 2.253 ( -11.292 -5.571 15.425) 19.912 3.004 ( 7.467 -7.006 -5.757) 11.747 3.445 ( 2.319 -2.233 -1.405) 3.512 3.875 ( -2.570 -5.053 -6.901) 8.930 4.687 ( 6.874 14.676 12.469) 20.448 4.955 ( 6.171 4.325 -8.821) 11.602 5.273 ( -9.013 2.871 -7.372) 11.993 5.560 ( 5.758 -11.182 2.315) 12.789 6.616 ( -4.445 -1.932 6.810) 8.359 6.972 ( -1.878 -4.676 -0.092) 5.040 7.190 ( 1.442 -2.525 0.446) 2.942 7.717 ( -0.313 -1.189 -2.302) 2.610 8.040 ( -5.821 0.186 -3.132) 6.612 8.230 ( -3.978 -7.785 2.016) 8.972 9.569 ( 4.593 3.855 0.952) 6.072 10.202 ( 7.867 8.559 -3.468) 12.132 10.275 ( -3.424 2.262 0.589) 4.145 15.806 ( -1.069 -0.642 2.347) 2.658 16.234 ( -0.901 -6.375 -4.365) 7.779 16.860 ( 4.411 6.033 -4.684) 8.820 17.233 ( 0.637 2.755 5.496) 6.181 17.572 ( -4.303 5.774 -1.348) 7.326 17.906 ( -0.649 -15.803 -0.869) 15.840 ======================= Grid point 227 (124/294) ======================= q-point: ( 0.50 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.050 ( 2.352 -0.014 9.730) 10.010 2.143 ( -4.883 -5.104 11.518) 13.511 2.994 ( 1.981 -4.771 -6.563) 8.352 3.448 ( 1.923 -2.584 -1.623) 3.607 3.763 ( -2.089 -1.704 -3.345) 4.296 4.884 ( -8.508 12.450 -4.012) 15.604 5.034 ( 3.195 3.514 -1.338) 4.935 5.191 ( 3.297 4.517 -0.115) 5.594 5.561 ( 4.550 -10.842 1.766) 11.889 6.540 ( -3.439 -6.456 6.713) 9.929 6.928 ( 0.819 -2.425 -0.701) 2.654 7.193 ( 0.579 -1.235 0.247) 1.386 7.738 ( 4.595 -1.051 0.639) 4.757 7.937 ( -3.996 -0.024 -2.337) 4.629 8.150 ( -1.573 -3.097 3.298) 4.790 9.649 ( 1.444 1.637 -0.831) 2.336 10.212 ( -4.013 3.460 -4.597) 7.015 10.368 ( 3.014 5.715 0.372) 6.471 15.816 ( 1.253 -1.671 3.684) 4.235 16.145 ( -0.707 -3.767 -3.305) 5.061 16.927 ( -1.672 7.672 -7.653) 10.964 17.314 ( 1.382 3.335 10.177) 10.798 17.485 ( -5.105 -0.150 -0.875) 5.182 17.825 ( 4.863 -11.262 -2.457) 12.510 ======================= Grid point 228 (125/294) ======================= q-point: ( 0.58 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.095 ( 1.772 -2.293 2.186) 3.630 2.236 ( 11.073 -5.606 12.874) 17.882 2.895 ( -5.147 -1.805 -4.950) 7.366 3.439 ( 1.000 -2.357 -1.397) 2.916 3.740 ( -0.453 3.156 -0.965) 3.332 4.703 ( -14.829 6.942 -8.881) 18.627 5.098 ( 2.067 0.751 -0.344) 2.226 5.348 ( 2.564 4.246 3.886) 6.301 5.520 ( 3.227 -9.104 0.123) 9.659 6.510 ( 2.255 -2.729 4.287) 5.560 6.932 ( 2.392 -1.610 -0.934) 3.031 7.185 ( -0.615 -0.876 0.474) 1.171 7.838 ( 5.306 -4.993 5.493) 9.125 7.897 ( 0.635 5.361 -2.183) 5.824 8.154 ( 1.327 -0.504 4.308) 4.536 9.627 ( -3.553 -0.341 -3.564) 5.044 10.156 ( -3.587 5.273 -5.519) 8.434 10.420 ( -0.979 0.277 1.005) 1.430 15.857 ( 3.209 -2.331 3.859) 5.534 16.106 ( -0.507 0.617 -0.749) 1.095 16.853 ( -7.299 5.593 -8.442) 12.483 17.377 ( -4.567 -5.046 10.851) 12.808 17.538 ( 7.126 8.488 5.282) 12.278 17.769 ( 4.357 -8.887 -8.494) 13.042 ======================= Grid point 229 (126/294) ======================= q-point: (-0.33 -0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.160 ( 8.509 -0.439 -4.516) 9.643 2.469 ( 14.264 -7.974 11.495) 19.979 2.767 ( -6.799 2.118 0.150) 7.123 3.421 ( 0.296 -1.758 -1.516) 2.340 3.763 ( -2.704 7.237 -2.248) 8.046 4.461 ( -12.782 1.368 -6.706) 14.499 5.108 ( -0.131 -1.980 0.254) 2.000 5.293 ( -5.106 -6.895 -0.255) 8.583 5.585 ( 4.182 2.867 3.245) 6.020 6.618 ( 7.851 2.460 1.113) 8.302 6.959 ( 2.612 -0.977 0.075) 2.790 7.165 ( -0.814 -0.846 0.415) 1.245 7.849 ( 1.722 -1.495 -0.608) 2.360 8.048 ( 4.816 5.405 5.746) 9.243 8.245 ( 7.083 -0.548 6.218) 9.441 9.480 ( -9.330 -0.480 -6.980) 11.662 10.132 ( -1.354 4.653 -4.932) 6.914 10.353 ( -4.926 -5.164 1.516) 7.296 15.924 ( 4.991 -2.316 2.913) 6.226 16.130 ( -0.561 5.018 2.031) 5.443 16.733 ( -6.119 3.670 -6.864) 9.901 17.291 ( -5.903 -6.637 8.756) 12.473 17.612 ( -2.798 -4.059 -5.970) 7.743 17.894 ( 14.582 7.244 2.979) 16.553 ======================= Grid point 230 (127/294) ======================= q-point: (-0.25 -0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.297 ( 9.388 2.208 -5.966) 11.341 2.606 ( 1.243 1.783 2.388) 3.229 2.824 ( 11.716 -4.998 10.705) 16.639 3.394 ( -0.354 -0.849 -3.443) 3.563 3.732 ( -8.687 9.796 -5.441) 14.179 4.233 ( -6.962 -6.905 -3.863) 10.539 5.062 ( -3.030 -2.695 1.159) 4.217 5.134 ( -6.608 -4.728 1.500) 8.263 5.702 ( 3.026 5.489 1.965) 6.569 6.766 ( 6.974 -1.864 -1.634) 7.402 7.009 ( -0.270 5.305 2.759) 5.986 7.178 ( 4.614 0.186 0.482) 4.643 7.883 ( 4.256 0.103 -2.723) 5.053 8.175 ( 0.410 5.891 4.565) 7.464 8.468 ( 13.036 0.041 9.543) 16.156 9.240 ( -12.472 0.251 -9.653) 15.774 10.123 ( -3.428 1.604 -0.056) 3.785 10.188 ( -5.051 -8.410 -1.882) 9.989 16.015 ( 6.518 -1.574 1.396) 6.849 16.200 ( -1.187 8.277 3.685) 9.137 16.647 ( -2.693 1.842 -5.282) 6.208 17.162 ( -7.639 -6.132 6.708) 11.872 17.452 ( -3.855 -7.430 -7.581) 11.294 18.254 ( 13.835 10.973 4.869) 18.317 ======================= Grid point 231 (128/294) ======================= q-point: (-0.17 -0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.401 ( -1.560 8.451 2.710) 9.011 2.733 ( 11.534 4.215 -3.846) 12.868 3.063 ( 14.465 -7.860 11.222) 19.923 3.335 ( -3.975 1.977 -7.827) 8.998 3.604 ( -9.281 4.610 -6.339) 12.147 4.053 ( -2.300 -9.970 -3.191) 10.718 4.942 ( -10.376 -6.882 11.687) 17.076 5.050 ( -0.878 2.989 -4.857) 5.770 5.817 ( 2.988 6.958 -0.392) 7.583 6.765 ( 0.380 -8.118 0.247) 8.131 7.054 ( -0.765 4.660 -0.484) 4.747 7.373 ( 10.235 8.153 4.782) 13.931 7.950 ( 5.300 0.916 -4.792) 7.204 8.254 ( 0.156 5.768 2.635) 6.343 8.754 ( 11.660 1.287 9.230) 14.927 8.978 ( -9.992 0.455 -11.000) 14.868 9.916 ( -12.748 -10.802 6.039) 17.766 10.133 ( 1.447 -0.699 -5.922) 6.136 16.128 ( 7.343 -0.083 -0.221) 7.346 16.283 ( -2.328 9.996 3.218) 10.756 16.619 ( 1.782 -0.414 -3.161) 3.652 17.008 ( -8.419 -4.881 5.159) 11.014 17.255 ( -5.278 -8.812 -5.809) 11.800 18.602 ( 11.422 11.002 3.221) 16.182 ======================= Grid point 232 (129/294) ======================= q-point: (-0.08 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.488 ( -4.511 14.447 8.573) 17.394 2.971 ( 14.217 2.228 -3.492) 14.808 3.165 ( -14.366 10.438 -9.422) 20.102 3.274 ( 11.075 -10.042 7.107) 16.553 3.474 ( 0.406 -9.790 -4.586) 10.819 3.944 ( 1.488 -3.203 -5.104) 6.207 4.755 ( -11.262 -8.216 11.249) 17.913 5.074 ( 1.178 4.474 -1.593) 4.893 5.934 ( 3.661 8.066 -3.044) 9.366 6.659 ( -3.548 -9.065 2.372) 10.020 7.080 ( 0.556 2.412 -1.467) 2.878 7.676 ( 9.230 10.498 8.141) 16.177 7.988 ( 0.973 1.876 -7.013) 7.324 8.339 ( 2.416 5.689 0.360) 6.192 8.729 ( -7.215 2.181 -9.282) 11.957 9.051 ( 12.976 -0.942 3.009) 13.354 9.619 ( -14.724 -10.889 7.939) 19.960 10.108 ( 1.034 -2.436 -3.788) 4.621 16.249 ( 5.417 3.009 -1.197) 6.311 16.348 ( -1.517 8.545 -0.277) 8.683 16.662 ( 5.600 -1.924 0.359) 5.933 16.858 ( -7.888 -4.155 5.724) 10.595 17.043 ( -6.057 -8.509 -4.192) 11.254 18.870 ( 7.474 8.800 -0.100) 11.546 ======================= Grid point 236 (130/294) ======================= q-point: ( 0.17 0.58 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.565 ( 6.869 -17.250 -10.413) 21.288 2.842 ( -16.155 8.220 -5.896) 19.061 3.119 ( -5.805 -0.065 2.958) 6.516 3.282 ( 9.412 8.678 -3.421) 13.252 3.678 ( 10.945 -3.353 16.802) 20.331 4.091 ( -1.332 0.669 -2.192) 2.651 4.446 ( -1.381 0.461 3.886) 4.150 5.176 ( 2.934 -3.006 1.844) 4.588 6.063 ( -4.604 -2.731 -7.946) 9.582 6.465 ( 3.146 5.369 4.177) 7.495 7.156 ( -1.394 0.862 2.620) 3.090 7.522 ( -5.432 -5.411 -13.611) 15.622 8.058 ( -0.592 -2.513 -4.244) 4.968 8.525 ( -9.392 -0.285 3.417) 9.998 8.785 ( 12.668 1.992 -4.254) 13.511 9.049 ( -3.295 -6.012 -5.352) 8.697 9.367 ( 0.273 8.311 10.392) 13.309 10.199 ( 3.023 1.105 5.832) 6.661 16.254 ( -11.465 2.154 -1.132) 11.720 16.430 ( 4.219 -5.101 -9.644) 11.698 16.562 ( 0.747 0.052 -1.288) 1.489 16.875 ( 3.657 -2.129 10.627) 11.439 17.079 ( 5.607 6.173 8.465) 11.883 18.829 ( -6.212 -3.166 -12.842) 14.613 ======================= Grid point 237 (131/294) ======================= q-point: ( 0.25 0.58 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.483 ( 5.482 -11.215 -6.604) 14.122 2.621 ( -13.647 5.574 -4.803) 15.504 3.007 ( -7.567 -3.762 4.581) 9.612 3.441 ( 0.972 5.362 2.382) 5.948 3.947 ( 10.039 4.388 12.213) 16.408 4.011 ( -0.019 -7.392 -3.196) 8.054 4.550 ( 7.694 5.468 -2.124) 9.675 5.220 ( 4.000 -3.764 4.349) 7.006 5.879 ( -7.370 -3.542 -7.663) 11.207 6.611 ( 2.758 7.669 4.108) 9.127 7.144 ( -2.094 0.799 0.785) 2.375 7.304 ( -4.289 -7.672 -9.657) 13.058 7.965 ( -3.713 -2.645 -5.419) 7.082 8.383 ( -8.410 -0.219 1.398) 8.528 8.762 ( -11.587 -11.661 3.689) 16.848 9.044 ( 13.456 4.197 -6.745) 15.626 9.623 ( 9.031 11.901 4.444) 15.587 10.279 ( 1.599 -0.064 5.646) 5.869 16.078 ( -10.179 1.676 -1.781) 10.468 16.359 ( 1.615 -8.140 -6.250) 10.389 16.595 ( 2.607 3.166 -3.321) 5.277 17.005 ( 5.826 -1.774 9.555) 11.330 17.293 ( 5.680 6.939 8.951) 12.671 18.562 ( -10.233 -6.026 -13.554) 18.021 ======================= Grid point 238 (132/294) ======================= q-point: ( 0.33 0.58 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.376 ( -12.481 4.851 -1.939) 13.530 2.495 ( 2.349 -8.043 -1.861) 8.583 2.872 ( -5.337 -5.855 5.107) 9.426 3.469 ( -3.465 2.015 5.157) 6.531 3.905 ( 0.040 -5.972 -7.039) 9.231 4.273 ( 14.731 6.547 4.369) 16.702 4.735 ( 8.172 5.153 0.210) 9.664 5.287 ( 4.344 -3.600 5.843) 8.123 5.668 ( -8.696 -1.788 -8.102) 12.019 6.733 ( -0.711 6.827 5.678) 8.908 7.082 ( -4.182 -3.452 -7.803) 9.502 7.150 ( -0.047 -5.654 1.182) 5.777 7.834 ( -5.076 -1.155 -5.264) 7.403 8.258 ( -7.087 0.624 -1.654) 7.304 8.479 ( -10.977 -11.529 6.262) 17.106 9.276 ( 12.902 4.134 -5.181) 14.505 9.905 ( 9.017 10.781 1.167) 14.103 10.319 ( 0.206 -0.956 4.582) 4.685 15.937 ( -7.025 1.330 -1.458) 7.297 16.265 ( -0.137 -7.035 -3.798) 7.996 16.667 ( 4.962 3.448 -4.299) 7.416 17.137 ( 5.195 -2.185 9.229) 10.814 17.499 ( 4.768 6.500 7.308) 10.881 18.223 ( -12.660 -7.187 -12.030) 18.885 ======================= Grid point 239 (133/294) ======================= q-point: ( 0.42 0.58 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.204 ( -10.651 2.043 0.557) 10.860 2.411 ( -6.022 -7.813 6.513) 11.820 2.825 ( 3.915 -3.866 -0.038) 5.502 3.457 ( -2.805 1.347 4.280) 5.292 3.809 ( -0.327 -4.232 -6.931) 8.127 4.598 ( 15.614 6.933 -4.942) 17.784 4.916 ( 6.057 3.767 6.521) 9.665 5.359 ( 2.896 -1.922 4.603) 5.767 5.459 ( -8.512 -1.169 -7.616) 11.481 6.759 ( -7.080 0.792 8.441) 11.045 6.931 ( -1.380 -4.945 -5.323) 7.395 7.145 ( 1.892 -1.270 -0.214) 2.288 7.730 ( -3.446 0.935 -3.900) 5.287 8.122 ( -6.800 -0.987 -3.779) 7.841 8.283 ( -6.759 -7.399 9.104) 13.539 9.474 ( 9.454 3.574 -4.552) 11.085 10.132 ( 7.249 7.491 -2.071) 10.628 10.331 ( -0.341 -0.497 2.937) 2.998 15.852 ( -3.731 0.534 0.099) 3.770 16.181 ( -1.051 -4.354 -1.533) 4.734 16.774 ( 6.817 4.279 -5.381) 9.682 17.246 ( 3.782 -2.752 9.573) 10.655 17.653 ( 3.557 3.164 3.340) 5.815 17.876 ( -13.421 -5.140 -7.877) 16.389 ======================= Grid point 240 (134/294) ======================= q-point: ( 0.50 0.58 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.087 ( -3.532 -3.259 3.542) 5.970 2.243 ( -8.380 -9.207 7.552) 14.561 2.890 ( 4.824 1.502 -2.757) 5.755 3.458 ( -2.264 2.122 3.731) 4.853 3.742 ( 0.108 -1.326 -3.775) 4.003 4.827 ( 10.939 4.141 -14.071) 18.297 5.110 ( 5.986 3.353 12.462) 14.226 5.251 ( -9.897 3.033 -6.628) 12.292 5.408 ( 3.275 -5.548 1.394) 6.592 6.638 ( -8.467 -5.510 9.554) 13.904 6.885 ( 0.395 -0.308 -3.450) 3.486 7.171 ( 1.652 -0.123 0.028) 1.657 7.701 ( 0.283 1.818 -0.563) 1.924 7.995 ( -4.647 -1.082 -1.512) 5.005 8.201 ( -3.818 -3.093 8.052) 9.433 9.595 ( 5.011 1.777 -4.545) 6.995 10.236 ( 0.892 2.809 -3.540) 4.606 10.362 ( 2.832 1.470 -0.216) 3.198 15.819 ( -1.072 -0.856 2.124) 2.528 16.137 ( -1.237 -0.161 1.058) 1.635 16.896 ( 6.104 5.100 -8.048) 11.316 17.334 ( 3.340 -2.774 9.898) 10.809 17.571 ( -5.343 -10.948 -4.585) 13.016 17.745 ( -4.066 8.130 1.961) 9.299 ======================= Grid point 241 (135/294) ======================= q-point: (-0.42 -0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.073 ( -3.608 -8.041 2.461) 9.151 2.081 ( 5.543 -9.693 6.222) 12.783 2.946 ( -1.194 5.590 -1.846) 6.007 3.460 ( -2.846 2.730 3.074) 5.001 3.757 ( 1.990 3.286 0.005) 3.841 4.816 ( -2.121 -4.566 -16.591) 17.338 5.113 ( -4.551 6.271 -2.509) 8.145 5.357 ( 8.995 2.032 10.068) 13.653 5.381 ( -0.237 -4.133 -2.473) 4.823 6.544 ( -4.159 -3.242 10.251) 11.528 6.874 ( 1.392 -0.485 -3.748) 4.027 7.191 ( 0.250 0.222 0.822) 0.888 7.761 ( 3.495 -0.304 4.107) 5.401 7.939 ( -1.258 2.790 -0.429) 3.090 8.188 ( -1.508 -0.507 7.770) 7.931 9.616 ( 0.669 -1.008 -5.596) 5.725 10.216 ( -2.579 3.115 -4.827) 6.297 10.407 ( 2.011 -1.150 -1.789) 2.927 15.821 ( 1.043 -2.356 3.531) 4.371 16.153 ( -1.022 4.389 3.675) 5.815 16.924 ( -1.495 3.249 -10.448) 11.043 17.413 ( -1.625 -8.951 3.122) 9.618 17.462 ( 8.593 0.497 4.243) 9.596 17.738 ( -5.525 5.489 1.807) 7.995 ======================= Grid point 242 (136/294) ======================= q-point: (-0.33 -0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.977 ( 4.133 -7.517 -5.991) 10.463 2.198 ( 13.804 -12.013 9.171) 20.468 2.938 ( -6.769 7.836 1.406) 10.450 3.454 ( -3.203 2.967 2.266) 4.920 3.852 ( 1.119 8.315 1.454) 8.515 4.534 ( -8.142 -11.257 -16.277) 21.399 5.116 ( -2.035 5.307 -1.959) 6.012 5.307 ( -2.216 -3.150 -1.815) 4.257 5.568 ( 5.823 3.551 8.319) 10.758 6.569 ( 2.090 -0.264 7.883) 8.159 6.884 ( 3.647 -0.250 -4.045) 5.453 7.191 ( -1.361 0.185 1.447) 1.995 7.796 ( 1.179 -4.096 2.436) 4.909 8.057 ( 6.816 7.949 4.915) 11.567 8.228 ( -0.082 0.976 7.878) 7.938 9.528 ( -3.720 -3.273 -7.771) 9.216 10.168 ( -2.649 3.782 -6.871) 8.278 10.374 ( -2.150 -4.262 0.075) 4.774 15.851 ( 3.025 -3.118 3.791) 5.766 16.225 ( -0.776 7.227 5.345) 9.022 16.821 ( -5.305 2.144 -8.742) 10.448 17.332 ( -2.324 -6.621 2.646) 7.499 17.562 ( 0.187 -1.808 -7.069) 7.299 17.819 ( 7.120 7.934 11.521) 15.696 ======================= Grid point 243 (137/294) ======================= q-point: (-0.25 -0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.005 ( 13.084 -4.354 -13.006) 18.955 2.404 ( 17.703 -13.527 10.816) 24.766 2.910 ( -7.790 8.932 4.630) 12.724 3.435 ( -3.840 2.948 1.233) 4.996 3.942 ( -4.315 12.687 0.772) 13.423 4.168 ( -6.510 -17.061 -15.489) 23.945 5.105 ( -3.504 6.116 -3.628) 7.927 5.232 ( -4.304 -3.262 4.366) 6.944 5.722 ( 3.124 4.343 5.936) 7.991 6.655 ( 3.732 -2.290 2.625) 5.105 6.984 ( 9.222 4.727 -1.731) 10.506 7.167 ( -2.545 -0.142 1.907) 3.183 7.794 ( 2.758 -3.491 -0.423) 4.469 8.288 ( -1.264 4.210 8.608) 9.665 8.327 ( 11.456 5.334 7.629) 14.761 9.340 ( -7.780 -3.805 -10.224) 13.399 10.111 ( -1.756 0.758 -8.719) 8.926 10.266 ( -6.526 -4.130 3.940) 8.670 15.909 ( 4.980 -2.844 3.003) 6.474 16.322 ( -0.225 7.327 5.435) 9.126 16.707 ( -5.454 3.179 -6.906) 9.357 17.222 ( -4.443 -4.786 -2.051) 6.845 17.445 ( -5.664 -4.938 -0.410) 7.525 18.158 ( 13.767 9.617 7.691) 18.471 ======================= Grid point 244 (138/294) ======================= q-point: (-0.17 -0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.164 ( 19.375 -1.093 -16.438) 25.432 2.643 ( 16.511 -11.523 11.646) 23.260 2.925 ( -3.298 6.842 6.356) 9.904 3.394 ( -4.525 2.886 -0.972) 5.454 3.766 ( -9.742 -11.808 -12.700) 19.891 4.000 ( -4.156 6.875 -1.068) 8.104 5.092 ( -3.170 6.926 -2.702) 8.082 5.136 ( -7.821 -4.248 8.742) 12.476 5.837 ( 2.280 5.321 1.927) 6.101 6.665 ( 2.181 -6.302 -0.356) 6.678 7.127 ( -3.212 1.516 1.761) 3.965 7.262 ( 14.245 8.684 0.943) 16.710 7.821 ( 5.222 -2.647 -3.100) 6.625 8.351 ( -0.928 2.526 8.156) 8.588 8.625 ( 11.257 5.224 7.367) 14.432 9.087 ( -10.212 -2.457 -11.543) 15.607 9.984 ( -5.308 -6.925 -3.677) 9.468 10.163 ( -6.003 1.118 2.373) 6.551 16.000 ( 6.777 -1.668 1.484) 7.135 16.421 ( 1.048 5.541 4.598) 7.276 16.615 ( -4.961 3.847 -6.032) 8.706 17.077 ( -5.061 -3.117 -5.594) 8.162 17.290 ( -7.834 -7.388 6.112) 12.382 18.519 ( 12.996 10.107 3.830) 16.903 ======================= Grid point 245 (139/294) ======================= q-point: (-0.08 -0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.412 ( 20.817 2.287 -15.570) 26.097 2.864 ( 8.979 -1.761 11.094) 14.380 2.996 ( 7.075 -7.289 3.256) 10.667 3.325 ( -5.262 3.677 -5.280) 8.312 3.444 ( -6.677 -11.699 -5.709) 14.630 3.976 ( -7.236 10.327 -1.623) 12.714 4.977 ( -12.449 -5.910 13.309) 19.158 5.114 ( -1.045 6.477 -2.878) 7.164 5.933 ( 2.834 6.628 -2.585) 7.658 6.611 ( -0.113 -8.370 0.591) 8.392 7.108 ( -1.527 1.267 1.564) 2.527 7.612 ( 14.100 11.047 1.524) 17.977 7.868 ( 5.929 -2.140 -6.307) 8.917 8.409 ( -0.869 2.405 8.279) 8.665 8.786 ( -0.927 -4.781 -12.575) 13.485 8.912 ( 0.921 5.796 3.426) 6.796 9.791 ( -9.521 -6.754 5.663) 12.974 10.097 ( -3.700 0.791 -1.200) 3.969 16.121 ( 8.158 0.220 -0.370) 8.170 16.520 ( -0.052 6.826 3.750) 7.788 16.542 ( -0.811 -0.581 -5.257) 5.351 16.937 ( -4.802 -1.493 -5.296) 7.303 17.116 ( -9.564 -7.963 9.332) 15.555 18.810 ( 9.212 8.586 -0.721) 12.613 ======================= Grid point 248 (140/294) ======================= q-point: ( 0.17 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.151 ( 10.808 -20.381 -12.447) 26.213 2.953 ( 14.534 5.241 -13.488) 20.509 3.147 ( -1.280 3.360 -5.019) 6.174 3.283 ( -6.272 -0.750 4.390) 7.693 3.503 ( 11.599 -1.355 14.743) 18.808 4.187 ( -7.414 5.320 -3.176) 9.662 4.636 ( -12.549 -0.260 11.904) 17.299 5.148 ( 0.325 0.371 2.156) 2.212 6.051 ( -2.347 -2.008 -7.391) 8.011 6.486 ( 3.456 4.567 5.178) 7.720 7.197 ( -0.601 0.279 2.923) 2.997 7.426 ( -2.340 -7.155 -16.990) 18.583 8.005 ( 1.681 -3.621 -2.679) 4.808 8.578 ( 10.855 4.881 -7.667) 14.158 8.712 ( -11.223 2.500 -1.948) 11.662 8.939 ( 7.682 -3.233 1.555) 8.478 9.592 ( -11.244 0.277 12.045) 16.480 10.215 ( 2.115 3.886 5.201) 6.828 16.246 ( 4.117 -5.894 -8.522) 11.150 16.450 ( -3.246 0.051 3.355) 4.669 16.526 ( -3.644 1.415 -3.600) 5.314 16.867 ( 0.308 -3.595 8.760) 9.474 17.149 ( 2.879 9.445 9.534) 13.726 18.805 ( -4.251 -2.398 -14.570) 15.366 ======================= Grid point 249 (141/294) ======================= q-point: ( 0.25 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.130 ( 12.894 -12.971 -6.977) 19.575 2.875 ( -11.463 3.000 -6.807) 13.665 3.152 ( -9.801 -0.349 3.303) 10.348 3.352 ( 14.826 6.900 -9.489) 18.907 3.795 ( 13.687 -3.288 14.098) 19.922 4.028 ( -7.775 -5.573 -2.989) 10.022 4.581 ( -3.803 5.064 6.525) 9.093 5.200 ( 1.304 2.111 5.066) 5.641 5.912 ( -5.496 -3.420 -5.825) 8.708 6.648 ( 4.653 7.128 4.382) 9.574 7.188 ( -1.619 -1.934 2.224) 3.363 7.217 ( -3.219 -5.478 -14.020) 15.393 7.960 ( -1.245 -1.797 -4.494) 4.997 8.534 ( -9.693 1.524 -4.004) 10.597 8.777 ( 10.340 0.858 -1.382) 10.467 8.890 ( -5.084 -6.126 -0.729) 7.994 9.643 ( 4.060 6.482 9.660) 12.321 10.295 ( 0.963 1.043 4.491) 4.710 16.199 ( 2.516 -6.604 -6.345) 9.498 16.278 ( -11.668 1.167 -0.164) 11.727 16.567 ( 2.680 2.564 -3.170) 4.879 16.934 ( 4.959 -4.469 10.392) 12.352 17.359 ( 3.655 9.884 8.334) 13.435 18.578 ( -7.912 -4.202 -14.553) 17.089 ======================= Grid point 250 (142/294) ======================= q-point: ( 0.33 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.235 ( 12.155 -4.248 -1.518) 12.965 2.646 ( -13.541 2.266 -6.766) 15.306 2.994 ( -9.905 -3.650 4.867) 11.624 3.543 ( 4.309 4.770 -2.006) 6.733 3.812 ( -3.042 -7.740 -5.846) 10.166 4.089 ( 13.664 0.250 6.394) 15.088 4.668 ( 4.632 2.932 5.179) 7.542 5.276 ( 1.079 2.263 5.048) 5.636 5.747 ( -7.098 -1.449 -5.083) 8.849 6.811 ( 3.645 6.101 3.570) 7.953 7.044 ( -3.630 -3.953 -7.428) 9.164 7.143 ( -2.302 -1.933 -0.220) 3.014 7.879 ( -3.905 0.466 -4.769) 6.181 8.369 ( -8.043 0.814 -5.708) 9.897 8.618 ( -12.184 -12.174 11.554) 20.740 9.044 ( 14.556 5.945 -8.331) 17.794 9.870 ( 7.938 6.971 5.361) 11.848 10.322 ( 0.465 -2.348 2.853) 3.724 16.074 ( -8.441 0.722 -3.205) 9.058 16.181 ( 0.341 -3.816 -1.060) 3.975 16.615 ( 2.584 3.310 -3.610) 5.537 17.053 ( 6.780 -5.365 10.494) 13.597 17.538 ( 3.099 5.956 4.211) 7.925 18.305 ( -10.853 -2.026 -10.773) 15.425 ======================= Grid point 251 (143/294) ======================= q-point: ( 0.42 0.67 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.375 ( -3.623 -3.489 -4.032) 6.446 2.414 ( -3.647 4.242 1.715) 5.851 2.824 ( -6.766 -5.578 4.647) 9.925 3.560 ( -3.427 0.407 3.179) 4.692 3.726 ( 1.983 -1.873 -6.836) 7.360 4.357 ( 14.630 3.387 -3.230) 15.361 4.831 ( 8.567 -1.446 7.751) 11.643 5.322 ( 0.978 -1.529 1.223) 2.189 5.594 ( -8.238 2.695 -3.734) 9.437 6.874 ( -0.115 -2.175 -5.232) 5.667 6.953 ( -6.796 3.843 8.099) 11.250 7.100 ( 1.204 -0.788 -2.184) 2.616 7.794 ( -4.532 2.730 -3.722) 6.469 8.199 ( -7.438 -1.913 -5.055) 9.194 8.413 ( -9.071 -7.877 12.890) 17.620 9.286 ( 12.983 5.378 -7.594) 15.973 10.078 ( 6.704 5.714 1.485) 8.933 10.308 ( 1.123 -5.311 0.887) 5.500 15.945 ( -6.535 1.684 -1.562) 6.927 16.161 ( 0.235 -1.344 1.280) 1.871 16.681 ( 4.543 3.226 -4.184) 6.968 17.175 ( 6.470 -5.914 10.318) 13.539 17.590 ( 1.289 -4.350 -4.842) 6.635 18.090 ( -11.853 7.161 -1.434) 13.922 ======================= Grid point 252 (144/294) ======================= q-point: (-0.50 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.135 ( -8.292 -6.691 -4.707) 11.649 2.365 ( -10.986 -7.318 7.816) 15.341 2.838 ( 5.398 6.761 1.164) 8.729 3.555 ( -0.966 2.254 4.765) 5.359 3.707 ( -0.009 1.055 -3.727) 3.873 4.575 ( 12.228 2.273 -12.202) 17.423 5.012 ( 9.932 -4.901 11.378) 15.878 5.275 ( -0.641 -6.203 -4.123) 7.476 5.498 ( -7.207 7.970 -1.847) 10.903 6.785 ( -6.366 -1.676 3.853) 7.627 6.902 ( -4.413 0.190 0.546) 4.451 7.144 ( 1.979 2.298 0.853) 3.150 7.750 ( -2.753 4.470 -1.268) 5.401 8.050 ( -5.000 -2.511 -0.908) 5.668 8.310 ( -5.789 -3.376 10.979) 12.862 9.467 ( 8.466 3.370 -7.709) 11.936 10.215 ( 3.547 3.592 -0.790) 5.110 10.282 ( 3.430 -5.943 -1.974) 7.140 15.866 ( -3.911 0.521 0.403) 3.966 16.185 ( -0.333 3.069 4.319) 5.309 16.773 ( 6.419 2.277 -5.946) 9.041 17.277 ( 5.388 -6.454 10.016) 13.077 17.461 ( -1.125 -8.960 -9.539) 13.136 18.023 ( -10.581 12.528 4.694) 17.057 ======================= Grid point 253 (145/294) ======================= q-point: (-0.42 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.946 ( -0.659 -11.991 -1.305) 12.080 2.106 ( -10.514 -12.537 3.771) 16.791 3.023 ( 2.314 12.648 1.369) 12.931 3.597 ( -4.147 5.721 5.154) 8.746 3.738 ( 4.096 3.476 0.342) 5.383 4.597 ( 4.253 -8.236 -19.583) 21.666 5.176 ( 2.573 -4.382 2.544) 5.683 5.226 ( 6.855 -1.468 5.583) 8.963 5.471 ( -4.636 9.683 -1.724) 10.873 6.689 ( -7.771 -1.734 10.288) 13.010 6.839 ( -1.105 -0.722 -4.517) 4.706 7.193 ( 0.741 1.499 1.314) 2.126 7.775 ( -0.386 4.130 2.594) 4.893 7.978 ( -1.748 -0.387 1.020) 2.061 8.287 ( -3.278 0.678 10.633) 11.147 9.525 ( 3.237 -1.136 -8.893) 9.532 10.236 ( 0.284 -1.994 -0.883) 2.199 10.313 ( 4.608 0.023 -4.883) 6.714 15.824 ( -1.588 -1.473 2.377) 3.216 16.259 ( -0.861 6.816 6.726) 9.614 16.836 ( 4.733 -1.061 -8.885) 10.122 17.319 ( 2.668 -6.724 -2.540) 7.668 17.380 ( 3.861 -2.619 3.522) 5.846 17.992 ( -10.732 10.596 6.310) 16.348 ======================= Grid point 254 (146/294) ======================= q-point: (-0.33 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.832 ( -1.963 -13.870 -2.405) 14.213 1.910 ( 7.175 -15.461 2.846) 17.280 3.143 ( -3.982 12.268 2.375) 13.115 3.592 ( -5.325 5.993 2.921) 8.532 3.896 ( 4.886 7.637 3.494) 9.716 4.356 ( -2.197 -15.387 -20.424) 25.666 5.191 ( 0.702 2.539 0.145) 2.638 5.308 ( -1.257 1.199 -1.697) 2.428 5.569 ( 4.639 6.666 7.184) 10.843 6.637 ( -3.978 -1.627 11.263) 12.056 6.800 ( 1.647 -0.991 -6.074) 6.371 7.216 ( -0.119 0.594 1.328) 1.460 7.792 ( -2.287 -1.557 3.622) 4.558 8.031 ( 5.262 3.340 2.856) 6.856 8.343 ( -1.921 5.752 11.356) 12.874 9.453 ( -0.070 -6.024 -10.769) 12.339 10.201 ( -1.803 0.149 -3.474) 3.917 10.343 ( 1.709 -0.123 -2.695) 3.194 15.813 ( 0.612 -2.977 3.762) 4.836 16.351 ( -1.553 6.657 6.689) 9.564 16.805 ( 1.108 -1.964 -8.427) 8.723 17.300 ( 0.820 -2.061 -2.655) 3.460 17.472 ( 6.045 0.522 -2.268) 6.477 17.969 ( -6.923 7.108 11.831) 15.441 ======================= Grid point 255 (147/294) ======================= q-point: (-0.25 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.687 ( 5.819 -10.755 -11.061) 16.489 2.002 ( 17.777 -18.376 7.943) 26.773 3.165 ( -7.627 9.873 2.910) 12.811 3.573 ( -5.781 5.617 1.975) 8.299 3.908 ( -0.195 -18.278 -15.943) 24.256 4.174 ( -3.223 12.584 1.469) 13.073 5.228 ( -2.297 5.171 0.692) 5.700 5.256 ( -2.268 1.305 -4.128) 4.887 5.751 ( 3.775 4.081 8.202) 9.909 6.638 ( -1.477 -2.859 5.844) 6.672 6.847 ( 8.452 2.265 -2.422) 9.079 7.218 ( -1.266 0.263 1.639) 2.088 7.743 ( -1.327 -3.941 1.584) 4.450 8.201 ( 8.555 0.026 4.914) 9.866 8.469 ( -1.039 10.918 11.595) 15.961 9.291 ( -2.172 -8.250 -12.034) 14.751 10.130 ( -4.191 1.001 -5.525) 7.006 10.335 ( -2.035 0.322 0.767) 2.198 15.835 ( 2.825 -3.338 4.037) 5.951 16.399 ( -0.805 1.264 2.968) 3.325 16.771 ( -1.373 3.803 -4.312) 5.911 17.239 ( -4.001 -0.139 -5.752) 7.008 17.492 ( -2.144 -0.606 -2.611) 3.432 18.113 ( 6.782 6.649 13.522) 16.525 ======================= Grid point 256 (148/294) ======================= q-point: (-0.17 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.705 ( 16.831 -6.295 -17.766) 25.270 2.220 ( 21.952 -18.696 11.239) 30.947 3.117 ( -6.642 2.332 -0.882) 7.095 3.502 ( -5.211 -0.572 -8.541) 10.021 3.610 ( -4.234 -11.610 -3.739) 12.911 4.280 ( -7.547 18.227 4.901) 20.328 5.194 ( -3.768 6.734 -6.324) 9.977 5.245 ( -2.714 -1.191 6.265) 6.931 5.867 ( 1.552 3.489 4.337) 5.778 6.593 ( -0.721 -5.339 0.305) 5.396 7.094 ( 14.211 6.229 1.499) 15.589 7.202 ( -1.948 1.485 1.481) 2.862 7.709 ( 2.019 -4.382 -0.616) 4.864 8.347 ( 6.300 -3.012 6.602) 9.610 8.637 ( 1.318 7.770 6.848) 10.440 9.103 ( -3.793 -3.893 -9.520) 10.962 10.014 ( -6.151 0.026 -5.018) 7.938 10.295 ( -5.124 1.488 2.892) 6.069 15.894 ( 5.017 -2.479 3.041) 6.369 16.399 ( 1.909 -3.732 -0.685) 4.247 16.763 ( -5.112 8.385 -1.783) 9.981 17.104 ( -6.124 0.922 -9.430) 11.282 17.397 ( -6.393 -5.207 6.441) 10.463 18.426 ( 12.207 8.528 7.430) 16.642 ======================= Grid point 257 (149/294) ======================= q-point: (-0.08 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.902 ( 24.597 -1.672 -20.379) 31.986 2.490 ( 22.179 -18.398 12.056) 31.237 2.933 ( -1.627 -15.841 -12.864) 20.471 3.383 ( -3.281 4.800 -3.589) 6.833 3.491 ( -7.702 0.185 5.418) 9.419 4.310 ( -12.593 17.911 3.408) 22.159 5.157 ( -4.783 -0.659 2.939) 5.652 5.207 ( -5.214 3.780 2.571) 6.934 5.938 ( 1.598 4.566 -1.147) 4.972 6.530 ( 0.389 -6.933 -0.195) 6.947 7.163 ( -2.293 -0.325 3.173) 3.928 7.455 ( 15.715 11.218 -4.208) 19.761 7.720 ( 4.906 -4.478 -0.122) 6.644 8.444 ( 3.698 -3.110 8.484) 9.764 8.638 ( -0.035 -8.185 -9.502) 12.542 9.052 ( -3.761 9.724 1.752) 10.573 9.891 ( -5.716 0.406 -0.062) 5.731 10.221 ( -7.613 1.410 2.814) 8.238 15.993 ( 7.112 -0.583 1.172) 7.232 16.391 ( 4.124 -6.600 -2.383) 8.139 16.734 ( -6.998 9.592 -1.594) 11.980 16.968 ( -4.504 0.649 -6.851) 8.225 17.265 ( -8.564 -7.201 10.818) 15.564 18.727 ( 10.032 8.392 0.623) 13.094 ======================= Grid point 260 (150/294) ======================= q-point: ( 0.17 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.679 ( 13.288 -19.812 -10.663) 26.130 2.513 ( 28.842 7.398 -17.597) 34.587 3.050 ( 17.672 -13.829 14.179) 26.544 3.302 ( -7.389 0.586 2.855) 7.943 3.635 ( -7.777 6.867 0.974) 10.420 4.404 ( -15.168 6.436 -5.387) 17.335 4.928 ( -12.749 -0.287 10.769) 16.691 5.188 ( -0.885 2.836 3.174) 4.348 6.017 ( -0.606 -1.559 -5.864) 6.097 6.500 ( 3.524 3.393 5.553) 7.401 7.202 ( 0.542 -2.488 -0.789) 2.666 7.296 ( -0.917 -2.274 -14.136) 14.347 7.886 ( 4.500 -5.825 -3.187) 8.021 8.430 ( 8.340 6.129 -6.861) 12.417 8.759 ( 9.784 -5.175 4.103) 11.804 8.938 ( -11.771 5.287 -2.451) 13.135 9.857 ( -13.538 -2.895 8.809) 16.409 10.262 ( 0.950 5.193 4.159) 6.720 16.074 ( 4.100 -4.876 -7.627) 9.937 16.364 ( 8.257 -1.141 3.007) 8.861 16.721 ( -12.076 1.773 -0.221) 12.208 16.906 ( -2.697 -2.776 7.256) 8.224 17.255 ( 2.180 8.382 9.811) 13.087 18.752 ( -2.852 -1.350 -15.741) 16.054 ======================= Grid point 261 (151/294) ======================= q-point: ( 0.25 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.755 ( 15.841 -7.717 -2.027) 17.737 2.900 ( 15.099 6.834 -13.924) 21.646 3.105 ( 2.561 -1.143 -4.106) 4.973 3.293 ( -2.246 -4.607 7.866) 9.388 3.651 ( 6.807 -0.935 8.486) 10.919 4.132 ( -14.335 -2.842 -6.576) 16.026 4.808 ( -10.594 3.605 9.109) 14.429 5.253 ( 0.542 4.511 4.315) 6.266 5.925 ( -3.473 -2.986 -3.943) 6.044 6.642 ( 5.296 3.525 3.448) 7.236 7.123 ( -1.286 -1.771 -9.164) 9.421 7.227 ( -1.922 -0.386 -1.138) 2.267 7.893 ( 3.621 -2.582 -4.511) 6.334 8.591 ( 8.325 3.703 -5.607) 10.699 8.690 ( -7.478 3.530 -9.149) 12.332 8.910 ( -1.262 -6.225 8.620) 10.707 9.742 ( -4.181 0.998 10.107) 10.983 10.315 ( -0.084 0.461 1.741) 1.803 16.059 ( 3.654 -3.778 -4.466) 6.897 16.483 ( -0.208 -1.058 3.721) 3.874 16.518 ( -7.205 2.504 -4.327) 8.770 16.906 ( 0.607 -3.312 8.338) 8.992 17.436 ( 3.020 7.190 6.301) 10.026 18.575 ( -5.384 -0.906 -13.578) 14.634 ======================= Grid point 262 (152/294) ======================= q-point: ( 0.33 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.008 ( 14.871 3.422 4.646) 15.951 2.820 ( -10.915 1.062 -7.615) 13.351 3.172 ( -10.395 -2.774 4.923) 11.831 3.339 ( 18.323 5.950 -12.126) 22.764 3.817 ( -7.828 -9.435 -5.690) 13.516 3.893 ( 11.547 -3.612 11.726) 16.849 4.759 ( -5.938 4.853 7.275) 10.571 5.309 ( 0.203 1.092 0.964) 1.471 5.812 ( -4.934 -1.217 -2.462) 5.647 6.762 ( 5.510 -0.238 -0.180) 5.518 7.083 ( -2.070 7.276 -2.000) 7.825 7.168 ( -3.105 -2.085 -0.628) 3.793 7.892 ( 0.408 0.352 -3.784) 3.822 8.474 ( -8.770 0.989 -9.579) 13.025 8.757 ( -5.477 -10.871 13.746) 18.361 8.844 ( 7.738 7.182 -8.093) 13.302 9.847 ( 5.377 3.451 8.139) 10.347 10.292 ( -0.331 -4.587 -1.119) 4.733 16.069 ( 2.504 -1.084 -1.641) 3.183 16.297 ( -11.756 0.893 -0.041) 11.790 16.580 ( 3.375 3.069 -3.402) 5.691 16.964 ( 4.416 -5.232 9.758) 11.920 17.534 ( 2.069 -0.331 -1.454) 2.550 18.419 ( -7.400 4.752 -6.037) 10.667 ======================= Grid point 263 (153/294) ======================= q-point: ( 0.42 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.317 ( 7.984 6.713 4.357) 11.304 2.590 ( -10.573 3.784 -5.514) 12.511 2.969 ( -12.725 -6.142 6.178) 15.421 3.578 ( 11.422 4.754 -9.451) 15.569 3.593 ( -3.748 -5.997 -3.562) 7.918 4.140 ( 13.400 -3.566 6.572) 15.345 4.795 ( 0.310 3.148 6.895) 7.586 5.277 ( -0.172 -5.411 -4.397) 6.975 5.717 ( -5.394 2.135 -1.397) 5.967 6.828 ( 3.105 0.275 -0.111) 3.119 7.065 ( -3.044 -3.144 -3.878) 5.847 7.163 ( -3.371 11.351 5.932) 13.244 7.868 ( -2.586 2.800 -2.288) 4.446 8.278 ( -8.255 -1.079 -6.980) 10.864 8.577 ( -9.973 -8.843 13.960) 19.301 9.076 ( 13.228 7.608 -7.910) 17.188 10.029 ( 6.838 2.813 5.335) 9.118 10.211 ( 0.600 -8.923 -3.620) 9.648 16.069 ( -5.270 2.696 -1.280) 6.056 16.171 ( -1.973 0.965 2.072) 3.020 16.636 ( 2.290 3.437 -3.366) 5.328 17.061 ( 6.558 -6.375 9.170) 12.951 17.475 ( 0.335 -8.310 -8.433) 11.844 18.357 ( -8.479 11.614 1.870) 14.501 ======================= Grid point 264 (154/294) ======================= q-point: (-0.50 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.190 ( -11.421 -5.978 -9.713) 16.140 2.573 ( -13.844 -3.754 8.931) 16.897 2.855 ( 4.280 9.615 4.448) 11.426 3.548 ( 3.249 -0.961 1.354) 3.649 3.702 ( 3.481 4.507 -4.968) 7.557 4.330 ( 10.818 -2.639 -4.660) 12.071 4.903 ( 5.310 -1.335 9.107) 10.626 5.173 ( 0.967 -7.752 -6.743) 10.320 5.657 ( -5.200 5.457 -1.265) 7.643 6.872 ( -1.156 2.825 2.906) 4.214 6.949 ( -3.239 -4.927 -2.987) 6.610 7.237 ( -4.706 9.699 4.302) 11.607 7.845 ( -3.134 4.583 0.055) 5.552 8.111 ( -6.183 -1.681 -1.708) 6.631 8.455 ( -6.811 -3.886 12.458) 14.720 9.298 ( 10.485 5.946 -8.970) 15.025 10.112 ( 3.862 -12.582 -3.383) 13.589 10.181 ( 4.655 3.402 1.183) 5.886 15.965 ( -6.858 1.601 -0.716) 7.078 16.241 ( 2.132 4.932 4.979) 7.326 16.683 ( 2.607 1.662 -3.530) 4.692 17.156 ( 6.482 -6.694 4.454) 10.328 17.333 ( 0.313 -9.303 -6.160) 11.162 18.353 ( -9.723 13.669 4.595) 17.392 ======================= Grid point 265 (155/294) ======================= q-point: (-0.42 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.876 ( -8.356 -10.919 -8.464) 16.145 2.241 ( -17.013 -13.653 6.456) 22.749 3.116 ( 4.918 15.200 2.707) 16.203 3.683 ( 7.015 4.635 5.780) 10.203 3.739 ( -1.604 5.391 -1.598) 5.848 4.328 ( 3.318 -9.638 -16.945) 19.775 5.059 ( 8.607 -4.538 12.039) 15.479 5.137 ( 4.526 -0.716 -4.145) 6.179 5.631 ( -4.637 8.070 -1.575) 9.440 6.831 ( -2.835 -3.914 -3.959) 6.247 6.864 ( -6.071 1.267 6.897) 9.275 7.245 ( -3.773 4.699 1.090) 6.124 7.861 ( -1.368 4.629 2.621) 5.493 8.020 ( -4.122 -0.669 1.801) 4.548 8.434 ( -3.753 2.642 12.433) 13.253 9.391 ( 4.117 -0.329 -11.363) 12.090 10.080 ( 7.736 -9.376 -2.735) 12.459 10.273 ( 2.453 3.237 -0.978) 4.177 15.877 ( -4.533 -0.298 1.046) 4.662 16.375 ( 1.429 7.876 7.189) 10.759 16.694 ( 2.730 -3.388 -5.992) 7.405 17.170 ( 4.862 -3.445 -9.096) 10.874 17.308 ( 4.062 -6.477 8.116) 11.149 18.335 ( -11.483 12.701 5.344) 17.937 ======================= Grid point 266 (156/294) ======================= q-point: (-0.33 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.635 ( 0.803 -16.404 -3.636) 16.821 1.861 ( -13.888 -15.968 2.799) 21.347 3.306 ( 0.502 11.288 1.527) 11.402 3.732 ( -1.715 3.653 -2.955) 5.001 3.853 ( 2.101 -3.055 -3.215) 4.907 4.169 ( 1.917 0.397 -8.077) 8.311 5.163 ( 2.897 0.184 1.217) 3.148 5.278 ( 7.750 -0.143 5.187) 9.326 5.651 ( -1.574 9.229 0.297) 9.367 6.737 ( -0.572 -3.601 -4.501) 5.793 6.794 ( -7.738 -0.226 8.798) 11.718 7.236 ( -1.240 1.516 0.209) 1.970 7.886 ( -4.814 1.662 4.739) 6.956 7.987 ( 2.304 -0.989 1.555) 2.950 8.528 ( -2.143 9.676 13.086) 16.415 9.306 ( 0.496 -7.604 -13.133) 15.184 10.133 ( 6.312 -4.214 -0.839) 7.635 10.322 ( 1.024 4.051 -3.106) 5.207 15.822 ( -2.148 -2.128 3.090) 4.324 16.474 ( -2.973 2.798 4.838) 6.331 16.678 ( 5.551 -1.354 -5.409) 7.868 17.208 ( 6.275 2.158 -8.852) 11.063 17.374 ( 4.471 -4.637 6.145) 8.903 18.285 ( -12.051 10.227 8.029) 17.729 ======================= Grid point 267 (157/294) ======================= q-point: (-0.25 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.507 ( -4.284 -16.025 -2.911) 16.841 1.587 ( 10.658 -20.486 2.739) 23.255 3.319 ( -4.381 -4.544 -6.036) 8.734 3.641 ( -0.388 -9.960 -14.466) 17.567 3.737 ( -4.600 6.659 0.468) 8.107 4.361 ( 2.448 18.533 7.764) 20.242 5.208 ( 2.019 -0.106 -0.230) 2.035 5.351 ( -2.006 3.957 -1.533) 4.694 5.774 ( 3.845 5.823 5.640) 8.972 6.674 ( -1.349 -1.551 -6.338) 6.663 6.768 ( 0.698 -1.319 11.360) 11.458 7.234 ( -0.258 0.169 0.406) 0.509 7.796 ( -6.733 -2.250 3.159) 7.770 8.086 ( 7.496 -1.376 3.029) 8.202 8.674 ( -2.358 10.285 10.805) 15.102 9.146 ( 0.087 -7.789 -11.760) 14.106 10.161 ( -0.106 -0.781 -0.553) 0.963 10.357 ( 0.661 4.168 -2.816) 5.074 15.803 ( 0.247 -3.133 4.522) 5.507 16.404 ( -2.045 -5.450 -2.580) 6.368 16.781 ( 3.448 5.567 0.773) 6.594 17.255 ( 0.687 2.461 -6.129) 6.641 17.439 ( 4.568 -0.173 -3.685) 5.871 18.266 ( -6.449 6.910 13.939) 16.841 ======================= Grid point 268 (158/294) ======================= q-point: (-0.17 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.313 ( 6.324 -12.489 -12.769) 18.948 1.716 ( 21.991 -21.794 9.794) 32.473 3.003 ( -2.399 -25.375 -19.597) 32.151 3.543 ( -5.931 7.847 -3.179) 10.337 3.732 ( -5.320 4.801 4.189) 8.300 4.603 ( -3.086 20.671 8.212) 22.456 5.221 ( 0.504 -0.302 -2.216) 2.292 5.327 ( -3.313 5.151 -2.236) 6.520 5.899 ( 1.743 2.645 4.895) 5.831 6.583 ( -3.078 -3.627 -2.439) 5.346 6.944 ( 11.293 3.493 6.858) 13.667 7.234 ( -0.230 0.036 0.860) 0.891 7.685 ( -3.999 -3.604 1.071) 5.489 8.223 ( 8.321 -3.356 4.484) 10.031 8.689 ( -2.586 -6.243 -3.077) 7.425 9.103 ( 0.088 8.209 0.791) 8.247 10.108 ( -5.480 1.494 -1.456) 5.864 10.383 ( -1.316 3.853 -0.345) 4.086 15.825 ( 2.635 -2.920 4.467) 5.952 16.309 ( 0.637 -6.919 -4.217) 8.127 16.872 ( -0.133 5.543 1.463) 5.735 17.187 ( -6.615 3.684 -8.908) 11.691 17.445 ( -0.785 -1.374 -2.565) 3.014 18.408 ( 4.985 6.370 13.842) 16.032 ======================= Grid point 269 (159/294) ======================= q-point: (-0.08 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.353 ( 20.872 -5.708 -19.729) 29.283 1.978 ( 24.591 -21.272 12.252) 34.747 2.594 ( 1.159 -28.910 -20.344) 35.370 3.526 ( -4.960 10.225 -0.792) 11.392 3.689 ( -8.444 3.116 6.757) 11.255 4.728 ( -11.066 19.563 6.368) 23.360 5.203 ( -0.864 1.388 -2.755) 3.204 5.322 ( -2.459 2.735 1.623) 4.020 5.953 ( 0.452 2.561 0.373) 2.627 6.483 ( -2.225 -5.276 -0.362) 5.737 7.182 ( 3.727 -0.661 2.442) 4.505 7.295 ( 9.469 7.783 -2.395) 12.489 7.630 ( 1.543 -3.657 2.441) 4.660 8.345 ( 7.275 -4.872 5.416) 10.295 8.497 ( -1.834 -13.670 -9.718) 16.873 9.236 ( -2.170 13.636 5.012) 14.689 10.015 ( -6.653 3.712 -0.395) 7.629 10.369 ( -5.210 2.990 1.635) 6.225 15.891 ( 5.176 -1.423 2.766) 6.039 16.243 ( 2.856 -7.733 -4.095) 9.204 16.901 ( -3.471 5.402 1.097) 6.514 17.034 ( -7.462 3.810 -9.662) 12.789 17.372 ( -4.818 -5.431 5.671) 9.213 18.663 ( 8.315 7.453 5.338) 12.377 ======================= Grid point 272 (160/294) ======================= q-point: ( 0.17 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.222 ( 15.186 -14.594 -3.354) 21.327 1.968 ( 32.193 8.563 -16.702) 37.264 2.637 ( 25.492 -15.650 18.643) 35.247 3.490 ( -11.258 0.829 2.607) 11.585 3.795 ( -6.626 2.354 -2.334) 7.409 4.740 ( -20.320 7.116 -6.116) 22.382 5.138 ( -5.253 -0.339 5.450) 7.577 5.272 ( -3.795 2.505 4.330) 6.279 5.979 ( -0.102 -0.770 -3.750) 3.829 6.499 ( 2.917 0.861 5.158) 5.988 7.124 ( 1.524 0.082 -8.909) 9.039 7.260 ( -0.190 1.303 -3.904) 4.120 7.734 ( 3.475 -6.039 -3.255) 7.690 8.313 ( 8.703 6.190 -5.508) 12.016 8.552 ( 11.635 -8.361 9.117) 16.982 9.187 ( -13.726 6.499 -5.761) 16.243 10.068 ( -10.461 -3.981 2.911) 11.565 10.341 ( -2.230 4.560 3.987) 6.454 15.929 ( 3.879 -2.172 -6.296) 7.707 16.228 ( 8.522 -1.823 4.024) 9.600 16.900 ( -6.290 2.351 -1.635) 6.911 17.003 ( -7.372 -4.270 9.696) 12.907 17.345 ( 2.191 5.670 8.033) 10.074 18.693 ( -2.356 0.791 -15.396) 15.596 ======================= Grid point 273 (161/294) ======================= q-point: ( 0.25 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.460 ( 17.182 2.343 7.833) 19.028 2.472 ( 28.896 9.202 -15.366) 33.997 2.971 ( 15.662 -11.926 14.047) 24.184 3.345 ( -7.041 -0.212 3.560) 7.892 3.658 ( -5.334 -2.602 -4.014) 7.164 4.385 ( -21.083 0.484 -5.960) 21.915 5.063 ( -9.022 2.390 7.464) 11.950 5.298 ( 0.132 2.405 0.596) 2.481 5.929 ( -2.096 -1.470 -2.186) 3.366 6.579 ( 4.680 -1.702 1.362) 5.163 7.133 ( -0.431 8.304 -2.807) 8.776 7.236 ( -1.183 -1.048 -1.859) 2.440 7.754 ( 6.027 -1.809 -4.783) 7.904 8.465 ( 7.635 4.585 -5.332) 10.380 8.676 ( 5.165 -6.336 2.633) 8.588 9.014 ( -9.673 3.779 -0.784) 10.415 9.899 ( -8.118 -2.560 6.740) 10.857 10.332 ( -2.243 -1.061 -0.671) 2.571 15.954 ( 3.859 0.107 -3.274) 5.062 16.374 ( 8.117 -0.573 1.546) 8.283 16.736 ( -12.675 -0.656 1.280) 12.757 16.943 ( -2.505 -2.678 7.032) 7.931 17.455 ( 2.506 0.822 1.154) 2.878 18.589 ( -3.191 4.837 -10.162) 11.698 ======================= Grid point 274 (162/294) ======================= q-point: ( 0.33 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.882 ( 15.418 12.573 13.062) 23.799 2.875 ( 12.240 7.380 -12.896) 19.250 3.030 ( 5.080 -1.076 -3.661) 6.353 3.307 ( -4.379 -3.824 7.555) 9.533 3.616 ( 9.001 -9.514 3.127) 13.465 4.013 ( -16.953 -2.137 -2.751) 17.308 4.986 ( -8.925 4.390 6.640) 11.959 5.282 ( -0.032 -4.038 -5.015) 6.438 5.864 ( -3.520 0.152 -0.696) 3.591 6.654 ( 6.032 -1.714 0.316) 6.278 7.172 ( -2.880 -1.250 -2.736) 4.165 7.236 ( -1.071 13.525 3.342) 13.973 7.824 ( 5.270 0.776 -3.220) 6.224 8.524 ( -2.063 0.557 -10.531) 10.746 8.701 ( 4.932 1.456 2.845) 5.877 8.905 ( -6.831 -2.890 4.577) 8.716 9.863 ( 0.386 -0.481 7.357) 7.382 10.242 ( -2.328 -6.057 -4.189) 7.723 16.018 ( 3.524 2.592 -0.466) 4.400 16.504 ( 6.478 1.185 -0.411) 6.599 16.517 ( -13.171 0.250 0.136) 13.174 16.936 ( 0.128 -3.882 7.689) 8.614 17.440 ( 1.665 -6.954 -7.114) 10.087 18.567 ( -4.152 10.415 -1.916) 11.375 ======================= Grid point 275 (163/294) ======================= q-point: ( 0.42 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.317 ( 8.916 13.836 10.288) 19.411 2.764 ( -9.716 4.431 -6.612) 12.560 3.174 ( -11.610 -4.936 7.741) 14.801 3.300 ( 17.936 5.862 -12.495) 22.631 3.580 ( -3.269 -8.624 -2.179) 9.477 3.934 ( 8.839 -4.760 8.409) 13.096 4.938 ( -6.294 4.719 5.207) 9.434 5.161 ( -0.143 -10.139 -9.480) 13.881 5.812 ( -4.217 2.788 0.375) 5.070 6.751 ( 6.243 -1.437 1.443) 6.567 7.082 ( -3.756 -1.334 -3.083) 5.039 7.380 ( -2.865 16.264 4.326) 17.071 7.891 ( 1.956 2.190 -0.011) 2.936 8.366 ( -7.722 0.298 -8.457) 11.456 8.729 ( -7.901 -9.486 13.922) 18.607 8.918 ( 9.283 9.401 -6.591) 14.765 9.946 ( 5.831 -5.505 3.942) 8.935 10.110 ( -1.361 -5.693 -4.472) 7.367 16.112 ( 2.683 4.808 1.509) 5.709 16.314 ( -11.239 1.086 -0.044) 11.292 16.607 ( 3.920 3.574 -2.450) 5.844 16.966 ( 3.264 -6.004 7.656) 10.263 17.315 ( 0.959 -11.130 -9.529) 14.683 18.608 ( -5.382 13.060 2.409) 14.329 ======================= Grid point 276 (164/294) ======================= q-point: (-0.50 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.299 ( -13.625 -1.591 -10.466) 17.254 2.841 ( -8.444 5.691 8.763) 13.434 2.933 ( -4.182 1.944 6.051) 7.608 3.466 ( 6.603 -0.452 -1.921) 6.891 3.600 ( 8.837 5.120 -4.265) 11.068 4.096 ( 10.306 -6.882 2.181) 12.583 4.913 ( -1.182 -3.639 1.735) 4.201 5.029 ( 1.488 -4.124 -5.869) 7.326 5.782 ( -4.499 5.266 0.778) 6.969 6.822 ( 4.547 -5.935 0.317) 7.484 7.003 ( -4.138 2.748 -0.467) 4.989 7.470 ( -6.387 13.727 -0.012) 15.140 7.925 ( -1.614 1.353 3.537) 4.116 8.214 ( -6.897 2.626 -2.453) 7.777 8.606 ( -6.670 -4.498 12.296) 14.694 9.140 ( 10.113 8.615 -7.724) 15.367 9.879 ( 3.535 -16.670 -5.437) 17.888 10.141 ( 4.431 1.787 2.865) 5.571 16.113 ( -8.821 2.296 -0.741) 9.145 16.270 ( 2.823 5.454 3.430) 7.034 16.669 ( 0.734 3.118 -1.574) 3.569 17.000 ( 4.824 -7.018 -1.658) 8.676 17.191 ( 2.653 -10.433 -0.654) 10.785 18.650 ( -7.032 13.165 3.099) 15.244 ======================= Grid point 277 (165/294) ======================= q-point: (-0.42 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.927 ( -15.772 -6.202 -13.191) 21.476 2.485 ( -21.276 -12.637 9.163) 26.388 3.166 ( 6.107 11.760 0.993) 13.288 3.599 ( 7.331 -0.262 -1.920) 7.583 3.773 ( 5.538 7.604 1.834) 9.584 4.112 ( 2.925 -6.716 -8.152) 10.959 4.924 ( 9.099 -5.907 4.041) 11.577 5.061 ( 2.613 3.056 0.251) 4.029 5.771 ( -4.418 7.022 0.437) 8.307 6.777 ( 0.229 -8.120 -2.450) 8.485 6.996 ( -3.172 3.679 3.750) 6.137 7.424 ( -9.513 8.230 -3.567) 13.075 7.904 ( -1.429 -2.528 2.934) 4.128 8.156 ( -6.738 4.739 3.972) 9.146 8.605 ( -2.479 5.057 12.664) 13.860 9.256 ( 3.365 0.929 -12.215) 12.704 9.811 ( 9.799 -11.055 -3.030) 15.080 10.244 ( 3.950 1.230 1.790) 4.508 15.983 ( -7.520 0.718 0.104) 7.555 16.423 ( 5.040 6.724 3.641) 9.158 16.645 ( -3.191 -2.886 -1.449) 4.540 16.988 ( 6.072 -2.054 -10.592) 12.381 17.212 ( 5.422 -8.137 9.571) 13.682 18.658 ( -8.975 12.306 2.772) 15.482 ======================= Grid point 278 (166/294) ======================= q-point: (-0.33 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.532 ( -11.016 -11.755 -10.973) 19.492 2.044 ( -21.376 -15.434 8.443) 27.685 3.350 ( 3.879 5.385 -0.271) 6.643 3.539 ( 2.932 -15.529 -17.157) 23.326 3.863 ( -0.202 2.610 -3.823) 4.633 4.207 ( 5.284 16.651 7.504) 19.012 5.125 ( 11.128 -3.531 10.862) 15.947 5.140 ( 4.267 4.493 -3.295) 7.017 5.777 ( -3.467 7.961 -0.098) 8.684 6.679 ( -0.779 -6.523 -3.277) 7.341 6.972 ( -6.464 1.281 5.864) 8.821 7.317 ( -6.704 3.968 -2.641) 8.226 7.899 ( 2.709 -3.095 1.538) 4.391 8.083 ( -8.862 1.273 4.935) 10.223 8.749 ( -1.444 12.373 12.512) 17.655 9.143 ( -0.226 -8.390 -13.322) 15.745 9.936 ( 11.714 -2.024 -1.155) 11.944 10.317 ( 2.398 1.834 0.068) 3.020 15.883 ( -5.080 -0.917 1.996) 5.534 16.502 ( -2.174 -7.958 -5.843) 10.109 16.613 ( 3.989 7.699 5.430) 10.231 17.051 ( 7.596 2.774 -9.477) 12.458 17.290 ( 5.054 -7.002 9.524) 12.857 18.623 ( -10.732 11.013 3.464) 15.763 ======================= Grid point 279 (167/294) ======================= q-point: (-0.25 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.246 ( 1.328 -18.595 -3.722) 19.010 1.585 ( -19.119 -17.624 5.550) 26.589 3.100 ( -3.455 -27.696 -20.530) 34.648 3.579 ( 5.767 7.815 -1.952) 9.907 3.859 ( -2.820 6.474 -3.515) 7.888 4.548 ( 4.860 21.413 9.920) 24.095 5.188 ( 1.012 0.640 0.946) 1.525 5.335 ( 6.996 0.255 3.211) 7.701 5.822 ( 0.177 7.403 1.049) 7.479 6.600 ( 0.712 -3.701 -5.566) 6.722 6.899 ( -6.818 -0.765 9.940) 12.078 7.258 ( -2.487 1.474 -0.992) 3.056 7.947 ( -7.144 -1.770 5.650) 9.279 7.957 ( 3.625 -2.821 -0.793) 4.661 8.800 ( -3.708 -5.771 -4.532) 8.222 9.086 ( 1.029 9.396 3.182) 9.974 10.092 ( 7.293 0.360 0.287) 7.308 10.367 ( 1.332 3.471 -1.613) 4.053 15.822 ( -2.487 -2.286 4.144) 5.347 16.342 ( -2.317 -8.375 -6.008) 10.565 16.787 ( 4.423 6.433 3.543) 8.573 17.158 ( 7.616 4.214 -9.926) 13.201 17.352 ( 3.517 -5.012 5.672) 8.346 18.567 ( -10.629 8.847 7.043) 15.519 ======================= Grid point 280 (168/294) ======================= q-point: (-0.17 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.151 ( -9.207 -18.550 -0.309) 20.712 1.214 ( 14.913 -23.031 5.972) 28.081 2.620 ( -2.492 -32.285 -22.837) 39.624 3.703 ( -1.745 10.342 -1.333) 10.572 3.859 ( -2.131 6.108 -0.628) 6.499 4.870 ( 1.622 21.131 8.673) 22.899 5.197 ( -0.060 -0.320 -0.580) 0.665 5.394 ( -0.707 2.095 -0.958) 2.410 5.920 ( 2.066 4.003 2.776) 5.291 6.554 ( 0.478 -0.944 -7.948) 8.018 6.907 ( 1.598 -1.374 13.891) 14.050 7.240 ( -0.503 0.443 0.033) 0.671 7.780 ( -9.317 -2.536 1.500) 9.771 8.060 ( 9.047 -4.345 1.808) 10.198 8.581 ( -3.096 -13.952 -10.302) 17.618 9.269 ( -0.735 16.315 7.796) 18.098 10.172 ( 0.311 1.155 2.144) 2.455 10.416 ( 1.127 5.170 -2.466) 5.837 15.806 ( -0.036 -2.837 5.372) 6.075 16.200 ( -0.443 -8.109 -6.250) 10.248 16.912 ( 2.001 4.381 2.424) 5.392 17.230 ( 1.373 3.717 -7.979) 8.909 17.377 ( 2.721 -1.096 -4.192) 5.117 18.559 ( -4.949 5.786 12.824) 14.914 ======================= Grid point 281 (169/294) ======================= q-point: (-0.08 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.904 ( 7.448 -13.488 -12.385) 19.768 1.418 ( 25.402 -23.294 13.069) 36.860 2.138 ( 0.626 -34.231 -21.851) 40.615 3.709 ( -5.943 10.445 -2.731) 12.324 3.881 ( -4.671 4.427 5.037) 8.172 5.091 ( -4.288 16.972 7.191) 18.925 5.186 ( 0.985 -0.257 -2.471) 2.672 5.389 ( -2.483 5.296 -1.462) 6.029 5.977 ( -0.100 2.232 0.958) 2.431 6.483 ( -2.594 -2.225 -3.396) 4.818 7.070 ( 8.424 -0.435 5.159) 9.888 7.262 ( 2.142 1.566 1.968) 3.303 7.638 ( -4.287 -2.095 1.195) 4.919 8.185 ( 9.470 -5.824 3.506) 11.658 8.329 ( -2.815 -14.634 -9.793) 17.832 9.441 ( -1.978 14.405 5.494) 15.543 10.161 ( -5.175 3.258 2.806) 6.728 10.462 ( -1.015 5.296 -1.658) 5.642 15.831 ( 2.417 -2.211 4.341) 5.438 16.099 ( 1.786 -7.963 -5.300) 9.731 16.972 ( -0.249 2.699 1.756) 3.229 17.154 ( -7.504 4.305 -8.914) 12.422 17.375 ( 1.092 -1.951 -3.348) 4.025 18.678 ( 2.900 4.988 11.130) 12.537 ======================= Grid point 321 (170/294) ======================= q-point: ( 0.17 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 294 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.094 ( -0.000 0.000 29.273) 29.273 1.094 ( -0.000 0.000 29.273) 29.273 1.581 ( -0.000 0.000 41.710) 41.710 3.931 ( 0.000 -0.000 -7.421) 7.421 3.931 ( 0.000 -0.000 -7.421) 7.421 5.133 ( 0.000 -0.000 -4.937) 4.937 5.133 ( 0.000 -0.000 -4.937) 4.937 5.509 ( 0.000 -0.000 -18.520) 18.520 6.529 ( 0.000 0.000 3.001) 3.001 6.529 ( 0.000 0.000 3.001) 3.001 6.652 ( 0.000 -0.000 -2.265) 2.265 7.491 ( -0.000 0.000 12.058) 12.058 7.871 ( -0.000 0.000 2.926) 2.926 7.971 ( -0.000 0.000 7.164) 7.164 7.971 ( -0.000 0.000 7.164) 7.164 9.923 ( 0.000 -0.000 -5.614) 5.614 10.169 ( 0.000 -0.000 -10.811) 10.811 10.169 ( 0.000 -0.000 -10.811) 10.811 15.909 ( -0.000 0.000 6.180) 6.180 15.909 ( -0.000 0.000 6.180) 6.180 16.957 ( 0.000 -0.000 -4.411) 4.411 17.161 ( 0.000 -0.000 -5.371) 5.371 17.161 ( 0.000 -0.000 -5.371) 5.371 19.013 ( -0.000 0.000 4.318) 4.318 ======================= Grid point 322 (171/294) ======================= q-point: ( 0.25 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.121 ( -2.366 2.111 25.541) 25.737 1.518 ( 16.664 0.848 27.911) 32.518 1.998 ( 10.155 10.250 37.715) 40.380 3.782 ( -6.091 -1.945 -8.313) 10.488 3.927 ( -0.612 0.045 -6.680) 6.709 5.050 ( -2.143 -1.033 -6.960) 7.355 5.195 ( 5.946 1.547 -7.024) 9.332 5.294 ( -7.763 -4.539 -14.677) 17.213 6.432 ( -3.410 -10.348 2.051) 11.087 6.442 ( -10.691 4.688 4.276) 12.432 6.798 ( 9.454 2.849 -3.430) 10.453 7.495 ( -4.211 -1.428 7.015) 8.305 7.910 ( 1.879 0.539 3.769) 4.246 8.000 ( 3.242 -1.324 9.657) 10.273 8.164 ( 5.690 7.635 9.696) 13.590 9.774 ( -9.696 -1.238 -6.524) 11.752 9.991 ( -2.305 -6.529 -15.641) 17.105 10.240 ( 5.050 3.248 -7.649) 9.724 15.851 ( -2.970 -1.750 4.509) 5.676 16.080 ( 5.884 3.861 8.388) 10.949 16.910 ( -1.594 -1.303 -4.557) 5.001 17.010 ( -2.552 -5.182 -7.810) 9.714 17.292 ( 6.353 5.075 -3.129) 8.712 18.972 ( -5.341 -1.239 3.651) 6.587 ======================= Grid point 323 (172/294) ======================= q-point: ( 0.33 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.367 ( 9.841 7.449 15.471) 19.791 1.994 ( 20.469 -1.215 25.451) 32.684 2.511 ( 10.205 14.221 32.228) 36.674 3.603 ( -7.311 -1.228 -7.497) 10.543 3.832 ( -5.641 -0.467 -4.848) 7.452 4.926 ( -9.600 -4.542 -12.263) 16.223 4.954 ( -4.205 -8.138 -12.850) 15.780 5.327 ( 6.111 2.814 -2.964) 7.352 6.260 ( -9.357 -2.594 1.577) 9.837 6.378 ( -2.874 -0.857 3.925) 4.940 6.928 ( 6.540 0.902 -3.156) 7.317 7.455 ( -2.606 0.810 1.577) 3.152 7.981 ( 4.179 0.321 0.321) 4.203 8.132 ( 4.910 -1.065 12.957) 13.897 8.417 ( 5.749 10.945 11.561) 16.926 9.538 ( -10.594 -3.189 -7.410) 13.316 9.759 ( -4.404 -7.686 -17.838) 19.916 10.292 ( 2.468 1.401 -3.766) 4.715 15.838 ( -0.084 0.273 2.400) 2.417 16.273 ( 5.510 4.638 9.308) 11.769 16.812 ( -1.383 -6.245 -7.407) 9.786 16.897 ( -1.565 -2.148 -6.132) 6.684 17.390 ( 1.619 1.111 2.302) 3.025 18.891 ( -4.731 1.280 -1.165) 5.037 ======================= Grid point 324 (173/294) ======================= q-point: ( 0.42 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.742 ( 16.345 9.027 7.116) 19.982 2.471 ( 20.676 -2.640 21.918) 30.247 2.963 ( 5.326 13.912 23.114) 27.499 3.430 ( -7.517 -0.019 -6.389) 9.865 3.705 ( -6.174 0.796 -0.481) 6.243 4.550 ( -10.023 -11.861 -16.938) 22.979 4.783 ( -6.415 -3.721 -6.239) 9.692 5.399 ( 1.624 -1.059 0.548) 2.015 6.107 ( -5.719 -0.660 -3.969) 6.992 6.378 ( -0.408 0.854 4.484) 4.583 7.009 ( 4.341 0.654 -1.376) 4.601 7.451 ( 0.256 2.865 -2.243) 3.648 8.046 ( 4.196 -0.364 -2.966) 5.152 8.288 ( 4.353 0.642 12.545) 13.295 8.700 ( 6.191 11.455 11.771) 17.553 9.269 ( -8.273 -9.598 -8.036) 15.004 9.502 ( -6.513 -3.921 -16.209) 17.903 10.302 ( -0.484 -0.331 0.099) 0.595 15.887 ( 3.186 2.852 0.448) 4.299 16.456 ( 3.706 4.898 8.612) 10.578 16.677 ( -0.529 -6.743 -8.894) 11.174 16.826 ( -0.819 -2.257 -3.807) 4.500 17.390 ( -4.361 -2.891 8.075) 9.622 18.831 ( -1.805 3.222 -7.708) 8.547 ======================= Grid point 325 (174/294) ======================= q-point: ( 0.50 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.158 ( 19.191 9.287 1.756) 21.393 2.865 ( 15.649 -5.739 15.257) 22.597 3.144 ( -9.673 10.647 3.044) 14.703 3.274 ( -5.060 -0.810 -4.435) 6.778 3.707 ( 0.505 1.874 11.694) 11.854 4.194 ( -6.074 -11.043 -15.277) 19.805 4.614 ( -7.691 -0.396 0.368) 7.710 5.361 ( -4.345 -4.075 3.799) 7.065 6.014 ( 0.045 -0.322 -10.029) 10.035 6.424 ( 0.208 2.373 5.007) 5.545 7.078 ( 3.264 0.910 0.631) 3.446 7.485 ( 2.239 4.492 -6.302) 8.056 8.070 ( 2.195 -0.771 -5.017) 5.530 8.435 ( 2.898 3.169 8.691) 9.695 8.879 ( 0.813 -9.998 -5.937) 11.656 9.096 ( 0.519 7.778 8.137) 11.269 9.281 ( -6.083 -2.948 -9.979) 12.053 10.275 ( -2.504 -1.903 3.253) 4.525 16.005 ( 6.246 5.306 -0.887) 8.243 16.501 ( -0.567 -5.785 -6.232) 8.522 16.634 ( -1.073 6.280 1.219) 6.487 16.798 ( 3.481 -4.111 1.766) 5.669 17.295 ( -8.968 -5.276 11.371) 15.413 18.795 ( 0.943 3.477 -12.940) 13.432 ======================= Grid point 326 (175/294) ======================= q-point: ( 0.58 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.570 ( 18.183 9.000 -1.568) 20.348 2.878 ( -14.302 1.518 -8.171) 16.541 3.061 ( 0.154 -8.571 -2.180) 8.845 3.218 ( -2.038 2.215 1.512) 3.368 3.781 ( 1.924 -7.679 12.838) 15.083 3.992 ( -2.012 -4.425 -5.871) 7.622 4.591 ( -2.772 9.840 9.398) 13.886 5.252 ( -5.675 -3.820 3.289) 7.591 5.967 ( 3.492 -2.087 -12.053) 12.721 6.480 ( -0.716 2.776 5.669) 6.353 7.142 ( 2.483 0.565 1.890) 3.171 7.512 ( 0.913 5.326 -11.689) 12.878 8.051 ( 0.556 -0.623 -4.764) 4.837 8.514 ( 1.261 -2.290 -5.991) 6.536 8.678 ( -0.757 -8.159 -4.488) 9.342 9.117 ( -4.756 -4.135 -1.160) 6.408 9.371 ( 6.130 12.934 13.740) 19.841 10.228 ( -2.700 -3.445 5.042) 6.677 16.182 ( 8.593 6.645 -1.523) 10.969 16.374 ( -1.256 -5.940 -8.928) 10.797 16.635 ( -3.979 3.909 -1.599) 5.802 16.901 ( 5.700 -0.301 9.029) 10.682 17.148 ( -9.996 -5.817 11.895) 16.590 18.763 ( 2.209 2.474 -16.096) 16.434 ======================= Grid point 327 (176/294) ======================= q-point: (-0.33 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.482 ( -22.166 3.537 -12.290) 25.591 2.777 ( -7.649 -20.627 -14.430) 26.310 2.971 ( 16.023 6.918 -3.928) 17.889 3.292 ( 3.226 6.195 5.576) 8.938 3.733 ( -12.262 -8.719 18.298) 23.690 3.988 ( 10.632 -2.820 -3.570) 11.565 4.791 ( 2.037 15.304 12.345) 19.768 5.166 ( -2.413 -2.160 1.671) 3.644 5.936 ( 4.688 -3.724 -11.439) 12.911 6.518 ( -1.886 1.952 6.265) 6.827 7.191 ( 1.700 -0.131 2.093) 2.700 7.443 ( -3.905 3.368 -17.077) 17.839 8.035 ( -0.079 0.244 -2.304) 2.318 8.357 ( 1.564 -11.564 -15.241) 19.196 8.692 ( 1.808 6.251 -4.140) 7.712 9.019 ( -3.963 -6.702 9.327) 12.150 9.683 ( 5.974 13.311 12.546) 19.242 10.188 ( -0.738 -4.976 5.326) 7.326 16.225 ( -2.068 -5.068 -9.794) 11.219 16.406 ( 9.732 6.470 -0.601) 11.701 16.574 ( -5.760 1.281 -0.171) 5.903 17.024 ( -4.829 -5.721 9.912) 12.422 17.059 ( 3.182 3.659 11.004) 12.025 18.714 ( 2.220 1.197 -17.866) 18.043 ======================= Grid point 328 (177/294) ======================= q-point: (-0.25 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.036 ( -25.315 3.530 -12.776) 28.575 2.291 ( -10.566 -26.402 -16.284) 32.769 3.220 ( 7.061 7.138 -1.934) 10.225 3.465 ( -11.197 -0.420 14.728) 18.506 3.524 ( 2.354 -3.648 10.358) 11.231 4.187 ( 15.353 2.979 -4.312) 16.223 5.052 ( 2.715 13.537 10.694) 17.464 5.156 ( 1.874 -0.652 1.060) 2.249 5.912 ( 4.793 -4.220 -9.810) 11.705 6.532 ( -2.355 0.327 6.761) 7.167 7.221 ( 0.892 -0.525 1.646) 1.945 7.261 ( -5.604 0.329 -19.333) 20.131 7.985 ( -5.518 1.478 -3.119) 6.508 8.225 ( 3.862 -9.091 -10.124) 14.144 8.769 ( 4.850 6.007 -10.155) 12.757 8.959 ( -4.841 -4.648 14.492) 15.970 9.969 ( 4.556 12.718 9.375) 16.444 10.181 ( 2.835 -6.188 4.967) 8.426 16.073 ( -3.466 -4.022 -9.652) 11.016 16.461 ( -7.960 -2.156 4.118) 9.218 16.631 ( 10.209 5.168 -1.743) 11.574 17.005 ( -0.073 -1.632 9.093) 9.239 17.212 ( 2.510 3.874 10.268) 11.258 18.644 ( 1.850 0.777 -18.692) 18.799 ======================= Grid point 329 (178/294) ======================= q-point: (-0.17 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.567 ( -25.614 2.817 -9.221) 27.368 1.742 ( -11.795 -28.191 -13.634) 33.462 3.068 ( -24.501 -10.474 18.527) 32.453 3.485 ( 7.000 6.836 4.040) 10.586 3.716 ( 7.321 3.439 2.561) 8.485 4.502 ( 19.176 8.308 -6.688) 21.942 5.176 ( 0.997 0.841 2.762) 3.054 5.284 ( 3.619 7.744 5.243) 10.028 5.898 ( 4.365 -3.294 -7.322) 9.139 6.536 ( -1.713 -1.030 7.422) 7.686 7.057 ( -3.798 -1.173 -18.020) 18.453 7.234 ( 0.413 -0.320 0.447) 0.688 7.869 ( -7.887 4.263 -3.872) 9.766 8.149 ( 2.341 -9.534 -4.485) 10.793 8.753 ( -8.086 -2.107 5.613) 10.067 9.032 ( 9.052 5.477 -2.650) 10.907 10.142 ( 1.040 4.284 1.397) 4.624 10.265 ( 6.960 0.252 7.039) 9.903 15.922 ( -3.725 -2.735 -8.228) 9.436 16.327 ( -7.916 -3.454 5.375) 10.173 16.810 ( 7.913 2.031 -1.972) 8.404 17.093 ( 3.926 0.311 9.891) 10.646 17.331 ( 0.795 2.669 8.061) 8.529 18.575 ( 1.811 2.606 -17.824) 18.104 ======================= Grid point 334 (179/294) ======================= q-point: ( 0.25 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.298 ( 4.996 -5.011 27.623) 28.515 1.548 ( -7.843 0.383 30.413) 31.410 2.309 ( 2.158 21.895 34.749) 41.129 3.752 ( 1.552 -3.510 -9.194) 9.963 3.889 ( 0.101 1.730 -8.123) 8.306 5.010 ( 0.469 -3.471 -9.342) 9.977 5.122 ( -3.231 1.262 -6.711) 7.555 5.214 ( 1.318 -4.345 -14.122) 14.833 6.353 ( -0.142 -11.783 2.777) 12.107 6.636 ( 9.946 1.615 -2.046) 10.282 6.704 ( -9.734 5.606 1.659) 11.355 7.536 ( 1.051 -6.619 8.581) 10.888 7.910 ( -1.499 -2.963 5.694) 6.591 7.966 ( -0.598 -3.305 5.917) 6.804 8.322 ( 2.243 15.979 12.074) 20.153 9.647 ( 1.822 -16.259 -11.233) 19.846 9.990 ( -3.609 1.730 -8.907) 9.765 10.182 ( 1.230 7.913 -11.917) 14.358 15.874 ( -0.009 -5.287 6.096) 8.069 16.132 ( 0.452 7.265 8.131) 10.914 16.891 ( -0.346 -0.746 -4.453) 4.528 17.013 ( -3.740 -0.172 -9.033) 9.778 17.238 ( 2.077 7.821 -5.241) 9.641 18.970 ( 1.288 -9.940 5.075) 11.235 ======================= Grid point 335 (180/294) ======================= q-point: ( 0.33 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.471 ( 0.192 2.827 23.265) 23.437 1.780 ( 14.798 -6.102 29.211) 33.309 2.791 ( 4.271 23.325 29.601) 37.928 3.651 ( -3.995 -0.953 -8.075) 9.059 3.850 ( -1.126 1.103 -8.179) 8.330 4.833 ( -4.551 -12.910 -16.069) 21.109 4.957 ( -5.719 -2.074 -7.754) 9.856 5.231 ( 5.560 3.469 -6.129) 8.973 6.247 ( -1.175 -9.810 0.390) 9.888 6.582 ( -9.791 3.655 3.027) 10.880 6.802 ( 7.479 1.409 -0.118) 7.611 7.511 ( -2.447 -4.184 6.136) 7.819 7.914 ( 2.456 -1.339 0.251) 2.808 8.031 ( 6.913 -6.105 10.303) 13.828 8.594 ( 2.446 15.946 11.475) 19.798 9.412 ( -0.886 -17.890 -12.575) 21.885 9.829 ( -10.587 4.803 -10.869) 15.915 10.239 ( 3.750 4.937 -7.519) 9.745 15.857 ( -0.662 -3.017 5.329) 6.159 16.299 ( 4.444 6.480 8.840) 11.828 16.790 ( -5.702 -3.196 -7.526) 9.968 16.887 ( -3.259 1.121 -6.266) 7.151 17.357 ( 5.106 5.117 -3.126) 7.876 18.900 ( -0.707 -9.436 2.125) 9.698 ======================= Grid point 336 (181/294) ======================= q-point: ( 0.42 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.691 ( 6.755 6.069 15.757) 18.186 2.194 ( 20.764 -7.078 25.398) 33.560 3.213 ( 1.857 17.790 19.456) 26.429 3.526 ( -6.442 3.086 -5.293) 8.890 3.779 ( -2.746 1.315 -4.777) 5.665 4.468 ( -8.956 -15.173 -16.234) 23.958 4.815 ( -4.597 -1.804 -5.334) 7.269 5.323 ( 5.445 1.278 -4.139) 6.958 6.121 ( -3.189 -7.802 -2.272) 8.729 6.501 ( -6.563 4.044 4.822) 9.093 6.924 ( 5.947 1.014 0.027) 6.033 7.472 ( -1.630 -0.934 1.609) 2.474 7.949 ( 3.704 -1.485 -2.264) 4.588 8.188 ( 10.252 -6.523 12.472) 17.413 8.807 ( 2.562 4.791 0.991) 5.522 9.171 ( -3.031 -7.391 -3.362) 8.667 9.616 ( -12.159 5.235 -11.837) 17.758 10.291 ( 1.916 2.432 -3.229) 4.474 15.875 ( 1.489 0.004 3.660) 3.951 16.495 ( 4.628 5.435 9.250) 11.684 16.610 ( -4.098 -4.351 -8.581) 10.457 16.815 ( -2.859 0.884 -5.038) 5.860 17.438 ( 1.146 0.680 2.370) 2.719 18.800 ( -0.814 -6.672 -4.378) 8.022 ======================= Grid point 337 (182/294) ======================= q-point: ( 0.50 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.996 ( 12.835 7.057 8.541) 16.956 2.608 ( 18.954 -7.068 19.924) 28.394 3.321 ( -4.037 0.220 -2.958) 5.010 3.434 ( -10.809 9.716 -3.274) 14.898 3.781 ( -1.345 0.142 4.589) 4.784 4.111 ( -6.031 -8.396 -10.490) 14.728 4.722 ( -3.677 1.663 0.936) 4.143 5.364 ( 1.333 -2.744 -0.087) 3.051 5.970 ( -3.775 -5.547 -5.572) 8.722 6.503 ( -1.881 4.848 3.609) 6.330 7.025 ( 4.632 1.018 0.962) 4.839 7.461 ( 0.494 1.270 -3.032) 3.324 7.974 ( 3.546 -2.610 -3.667) 5.730 8.379 ( 9.327 -4.638 11.435) 15.468 8.672 ( -0.264 -16.651 -15.052) 22.447 9.260 ( 0.158 15.152 12.447) 19.610 9.388 ( -11.240 3.283 -10.130) 15.483 10.306 ( -0.725 0.146 0.495) 0.890 15.954 ( 4.504 2.600 1.732) 5.481 16.435 ( -3.380 -5.002 -7.959) 9.989 16.693 ( 6.228 -0.405 5.598) 8.384 16.757 ( -3.432 6.220 -0.951) 7.167 17.431 ( -4.386 -3.218 8.165) 9.811 18.699 ( 0.979 -3.977 -11.776) 12.468 ======================= Grid point 338 (183/294) ======================= q-point: ( 0.58 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.350 ( 16.695 7.068 3.122) 18.397 2.858 ( 5.969 -8.526 7.358) 12.746 3.126 ( -10.842 -2.448 -13.486) 17.476 3.343 ( -7.088 6.300 1.510) 9.603 3.657 ( 0.467 -10.661 -2.433) 10.945 4.042 ( -2.718 0.849 3.927) 4.851 4.773 ( -0.429 10.190 8.614) 13.350 5.312 ( -3.643 -5.558 3.825) 7.668 5.838 ( -0.642 -4.069 -9.312) 10.182 6.557 ( -0.256 5.021 2.687) 5.700 7.109 ( 3.398 0.556 1.797) 3.884 7.464 ( 1.447 2.227 -8.855) 9.245 7.969 ( 2.826 -4.122 -4.410) 6.665 8.365 ( -1.295 -11.300 -13.835) 17.910 8.603 ( 7.309 -3.044 8.116) 11.338 9.172 ( -8.700 -0.267 -6.315) 10.753 9.525 ( 2.885 15.040 12.826) 19.975 10.276 ( -2.947 -2.141 3.292) 4.909 16.091 ( 7.246 3.789 -0.407) 8.187 16.291 ( -1.839 -5.421 -7.685) 9.583 16.682 ( -0.624 -0.832 -3.570) 3.718 16.904 ( 2.855 6.971 9.831) 12.385 17.339 ( -8.696 -4.458 11.644) 15.201 18.614 ( 3.121 -2.440 -17.049) 17.503 ======================= Grid point 339 (184/294) ======================= q-point: (-0.33 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.630 ( -4.458 -17.005 -9.378) 19.924 2.723 ( 5.202 5.563 -2.749) 8.098 2.824 ( -11.021 3.917 -12.384) 17.035 3.360 ( -0.224 5.189 5.707) 7.717 3.706 ( 11.599 -6.216 5.385) 14.219 3.979 ( -7.887 -2.880 7.779) 11.446 4.966 ( 1.956 12.892 9.210) 15.964 5.209 ( -4.526 -4.741 4.460) 7.928 5.757 ( 2.777 -3.982 -10.793) 11.835 6.608 ( -1.187 3.951 3.126) 5.176 7.170 ( 2.221 -0.066 1.928) 2.942 7.406 ( -1.642 -0.342 -15.235) 15.327 7.957 ( 4.453 -3.900 -3.771) 7.018 8.186 ( -0.873 -4.352 -12.376) 13.148 8.712 ( 0.725 4.037 -1.306) 4.305 9.044 ( -1.628 -6.069 5.975) 8.671 9.795 ( 4.434 12.396 11.277) 17.335 10.212 ( -3.635 -4.217 4.606) 7.226 16.141 ( -0.755 -4.801 -8.284) 9.604 16.289 ( 8.767 3.303 -0.775) 9.400 16.649 ( -1.645 0.849 -2.058) 2.768 17.027 ( -0.763 -1.783 9.710) 9.901 17.258 ( -6.024 3.664 12.133) 14.033 18.544 ( 4.034 -1.682 -18.996) 19.492 ======================= Grid point 340 (185/294) ======================= q-point: (-0.25 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.172 ( -13.405 -20.779 -12.608) 27.757 2.415 ( -23.311 5.638 -12.611) 27.096 3.071 ( 15.208 6.215 -2.140) 16.568 3.488 ( 4.288 4.631 7.348) 9.686 3.812 ( -14.820 -6.124 18.228) 24.277 3.923 ( 14.784 -0.308 -2.122) 14.938 5.114 ( 1.918 -1.621 1.459) 2.905 5.204 ( 0.175 8.823 7.782) 11.766 5.718 ( 4.835 -3.795 -10.525) 12.188 6.629 ( -2.703 2.285 4.541) 5.757 7.207 ( 0.903 0.376 0.307) 1.025 7.229 ( -4.420 -2.803 -16.140) 16.967 7.995 ( 4.627 -2.671 -1.907) 5.673 8.085 ( -1.931 2.091 -10.931) 11.296 8.709 ( 0.431 5.227 -10.450) 11.692 9.053 ( -0.454 -5.640 15.001) 16.033 10.037 ( 5.624 5.589 9.404) 12.300 10.146 ( -2.083 -3.034 3.870) 5.341 16.022 ( -2.012 -3.903 -7.711) 8.873 16.478 ( 10.585 2.221 -1.242) 10.887 16.595 ( -5.804 0.612 0.628) 5.870 16.999 ( -0.571 -6.979 9.315) 11.653 17.348 ( -1.494 8.793 8.738) 12.486 18.489 ( 3.801 0.522 -17.799) 18.208 ======================= Grid point 341 (186/294) ======================= q-point: (-0.17 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.671 ( -15.377 -18.765 -7.469) 25.384 1.991 ( -25.474 7.065 -11.095) 28.670 3.321 ( 6.818 3.739 -0.053) 7.776 3.524 ( -12.592 -10.784 18.441) 24.798 3.703 ( 1.689 6.239 7.650) 10.015 4.204 ( 18.638 4.605 -5.640) 20.010 5.145 ( 3.489 -1.653 1.462) 4.128 5.323 ( 1.861 2.476 1.641) 3.506 5.727 ( 6.106 -0.795 -7.483) 9.690 6.623 ( -3.503 0.834 6.154) 7.130 7.028 ( -5.177 0.296 -15.076) 15.943 7.232 ( 0.582 0.741 0.739) 1.197 7.996 ( -2.202 -0.084 -0.170) 2.210 8.021 ( -0.675 1.014 -8.806) 8.890 8.756 ( 6.110 6.321 -10.709) 13.855 9.054 ( -4.503 -3.702 13.441) 14.650 10.092 ( 2.844 -8.341 3.604) 9.521 10.248 ( 4.118 6.073 4.712) 8.720 15.910 ( -2.936 -1.533 -6.348) 7.161 16.476 ( -8.796 -1.586 4.185) 9.869 16.656 ( 9.980 0.702 -2.606) 10.338 17.036 ( 4.961 -5.017 9.058) 11.482 17.417 ( -1.962 2.882 2.096) 4.068 18.482 ( 3.119 6.663 -13.095) 15.020 ======================= Grid point 346 (187/294) ======================= q-point: ( 0.25 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.393 ( -2.577 0.829 22.797) 22.957 1.975 ( -17.727 0.411 28.455) 33.528 2.716 ( -0.658 21.991 30.088) 37.274 3.589 ( 5.546 -4.022 -9.189) 11.462 3.821 ( 2.891 -2.042 -6.281) 7.210 4.863 ( 2.268 -9.171 -12.011) 15.281 5.020 ( 7.229 -0.825 -12.552) 14.508 5.218 ( -7.918 4.370 -6.695) 11.252 6.235 ( 2.520 -12.665 2.668) 13.186 6.498 ( 7.158 1.932 0.475) 7.429 6.885 ( -5.441 5.050 -0.541) 7.443 7.470 ( 3.274 -6.020 6.164) 9.218 7.954 ( -2.751 -0.528 1.402) 3.133 8.059 ( -8.971 -7.110 10.588) 15.593 8.505 ( 1.289 13.561 10.600) 17.261 9.410 ( 0.498 -14.356 -8.952) 16.926 9.892 ( 10.091 4.597 -12.060) 16.383 10.222 ( -4.561 4.756 -8.678) 10.897 15.851 ( 0.988 -3.518 5.039) 6.224 16.273 ( -3.431 4.804 8.220) 10.120 16.864 ( 0.349 0.793 -3.626) 3.728 16.935 ( 6.337 3.419 -10.995) 13.143 17.334 ( -6.430 5.368 -3.811) 9.203 18.843 ( 2.679 -13.298 4.132) 14.181 ======================= Grid point 347 (188/294) ======================= q-point: ( 0.33 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.569 ( 5.079 -0.548 25.124) 25.638 1.901 ( -9.849 -1.558 29.294) 30.944 3.126 ( 2.519 21.533 23.554) 32.012 3.590 ( 3.748 -1.032 -7.609) 8.544 3.803 ( 1.157 0.032 -8.096) 8.178 4.673 ( -2.565 -13.273 -13.273) 18.945 4.992 ( -3.924 -0.452 -8.173) 9.078 5.140 ( 2.214 4.061 -9.148) 10.251 6.158 ( 0.652 -10.917 0.961) 10.978 6.618 ( 5.432 0.297 -1.266) 5.586 6.847 ( -5.296 4.589 3.899) 8.020 7.505 ( 2.153 -7.630 9.304) 12.224 7.892 ( -1.944 -4.898 3.958) 6.591 7.978 ( -0.500 -2.217 4.393) 4.946 8.693 ( 3.465 4.059 2.160) 5.758 9.248 ( -1.438 -6.413 -2.306) 6.965 9.950 ( -3.077 4.048 -7.473) 9.039 10.172 ( 1.992 6.399 -12.038) 13.778 15.860 ( 0.422 -4.122 6.547) 7.748 16.355 ( 1.623 5.000 7.155) 8.878 16.800 ( -3.714 -2.298 -6.526) 7.853 16.946 ( -3.123 5.115 -8.060) 10.044 17.317 ( 1.719 7.123 -5.903) 9.409 18.776 ( 2.694 -16.088 5.078) 17.084 ======================= Grid point 348 (189/294) ======================= q-point: ( 0.42 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.795 ( 1.925 2.559 21.022) 21.264 2.029 ( 8.789 -4.485 27.671) 29.378 3.388 ( 0.600 4.653 1.454) 4.912 3.662 ( -0.138 12.286 7.326) 14.305 3.755 ( 0.095 -0.072 -9.519) 9.520 4.383 ( -7.337 -12.238 -10.510) 17.722 4.854 ( -5.396 -0.171 -4.923) 7.306 5.207 ( 6.392 2.782 -7.730) 10.409 6.059 ( -0.804 -8.944 -1.431) 9.093 6.645 ( -2.501 0.506 1.716) 3.075 6.873 ( 1.367 2.859 3.683) 4.859 7.492 ( -1.156 -6.443 7.060) 9.628 7.874 ( 1.917 -1.876 -1.932) 3.306 8.039 ( 7.334 -5.225 9.228) 12.893 8.651 ( 1.638 -13.424 -12.280) 18.267 9.279 ( -0.906 10.080 10.692) 14.722 9.806 ( -11.603 5.878 -9.856) 16.319 10.238 ( 4.730 4.693 -7.390) 9.951 15.876 ( 0.824 -2.337 6.225) 6.700 16.484 ( 4.808 0.362 3.237) 5.807 16.636 ( -7.055 -0.603 -6.192) 9.406 16.891 ( -4.731 6.203 -3.309) 8.474 17.406 ( 4.346 4.033 -3.353) 6.811 18.678 ( 1.361 -14.823 0.674) 14.901 ======================= Grid point 349 (190/294) ======================= q-point: ( 0.50 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.976 ( 4.462 3.763 14.463) 15.596 2.376 ( 16.795 -4.958 23.392) 29.220 3.329 ( -2.984 -3.430 -9.941) 10.932 3.627 ( -7.122 2.459 -6.688) 10.074 3.797 ( -1.079 -2.536 -1.563) 3.168 4.147 ( -7.202 2.127 -1.398) 7.639 4.799 ( -1.517 3.596 3.657) 5.349 5.284 ( 4.788 0.560 -4.545) 6.625 5.938 ( -2.596 -7.249 -3.389) 8.412 6.609 ( -3.637 1.635 3.224) 5.128 6.966 ( 4.351 1.643 2.033) 5.075 7.448 ( -0.761 -4.246 1.440) 4.548 7.872 ( 2.388 -2.675 -3.850) 5.261 8.218 ( 11.609 -5.611 11.727) 17.429 8.427 ( -0.429 -14.906 -13.699) 20.249 9.462 ( 0.339 10.097 9.811) 14.083 9.592 ( -13.372 9.089 -8.856) 18.435 10.303 ( 2.022 2.725 -2.645) 4.302 15.926 ( 2.682 -0.167 4.509) 5.249 16.401 ( -3.834 -5.984 -9.320) 11.720 16.629 ( 1.845 0.605 1.276) 2.324 16.903 ( -2.440 10.087 4.098) 11.158 17.472 ( 1.254 -0.048 2.203) 2.535 18.548 ( 0.986 -11.734 -6.956) 13.676 ======================= Grid point 350 (191/294) ======================= q-point: ( 0.58 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.206 ( 10.480 3.952 7.408) 13.428 2.713 ( 11.834 -4.594 15.458) 20.002 3.105 ( -5.626 -9.684 -14.597) 18.399 3.516 ( -5.050 2.218 0.097) 5.516 3.624 ( -8.050 -3.105 -7.593) 11.493 4.111 ( -2.903 2.278 1.129) 3.859 4.915 ( 1.308 9.555 9.976) 13.876 5.309 ( 0.619 -2.334 0.442) 2.455 5.793 ( -3.829 -5.575 -5.529) 8.736 6.612 ( -0.307 2.859 1.209) 3.119 7.063 ( 4.140 0.865 1.747) 4.576 7.400 ( 0.479 -3.778 -4.865) 6.178 7.849 ( 2.159 -4.015 -5.348) 7.027 8.218 ( -1.123 -7.606 -10.017) 12.628 8.452 ( 12.648 -5.540 12.640) 18.720 9.320 ( -12.608 2.768 -10.474) 16.623 9.702 ( 1.098 13.495 10.126) 16.907 10.319 ( -1.451 0.300 1.274) 1.954 16.015 ( 4.922 1.079 1.434) 5.239 16.236 ( -2.756 -5.108 -7.452) 9.446 16.636 ( 0.921 -1.212 -2.607) 3.019 17.037 ( -0.311 10.573 9.673) 14.334 17.469 ( -3.449 -2.798 7.982) 9.134 18.414 ( 2.830 -7.928 -14.758) 16.990 ======================= Grid point 351 (192/294) ======================= q-point: ( 0.67 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.458 ( 9.348 -2.355 0.378) 9.648 2.661 ( -5.531 -5.492 -8.735) 11.707 2.971 ( -3.401 -0.578 -2.290) 4.141 3.451 ( -3.554 2.218 -0.354) 4.204 3.545 ( 4.110 -1.230 3.353) 5.445 4.086 ( -2.818 -0.889 4.319) 5.233 5.083 ( 0.875 5.847 8.174) 10.088 5.276 ( -3.075 -1.613 5.525) 6.526 5.652 ( -1.641 -3.473 -9.267) 10.031 6.658 ( 1.059 3.601 0.315) 3.766 7.137 ( 3.010 -0.223 1.770) 3.499 7.313 ( -0.400 -4.901 -10.480) 11.576 7.828 ( 3.361 -0.830 -5.965) 6.897 8.118 ( -0.323 -1.437 -5.890) 6.072 8.674 ( 8.887 -2.009 9.300) 13.019 9.089 ( -8.791 -0.501 -6.121) 10.724 9.904 ( 2.649 9.499 8.121) 12.775 10.276 ( -4.291 -2.129 3.768) 6.095 16.062 ( 0.314 -2.611 -6.861) 7.347 16.184 ( 5.233 0.243 0.145) 5.241 16.630 ( 1.360 -0.315 -2.434) 2.807 17.141 ( -4.395 1.759 10.626) 11.632 17.442 ( -3.999 2.468 9.764) 10.836 18.323 ( 5.447 -3.801 -18.025) 19.210 ======================= Grid point 352 (193/294) ======================= q-point: (-0.25 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.181 ( -14.146 -13.243 -7.234) 20.684 2.755 ( -18.173 6.129 -11.030) 22.124 2.846 ( 15.959 5.458 -1.565) 16.939 3.505 ( 3.454 0.915 6.869) 7.742 3.683 ( 11.051 -1.074 -0.333) 11.108 4.048 ( -6.418 -2.136 12.644) 14.340 5.090 ( -2.136 -6.117 5.061) 8.221 5.300 ( -0.402 2.410 3.111) 3.956 5.579 ( 2.197 1.033 -9.812) 10.108 6.709 ( -0.543 3.997 2.384) 4.685 7.150 ( -0.354 -5.693 -7.066) 9.081 7.209 ( -0.145 1.885 -3.132) 3.658 7.880 ( 5.074 3.294 -6.186) 8.652 8.084 ( -0.503 1.692 -4.521) 4.854 8.732 ( -3.976 4.014 -8.257) 10.005 9.039 ( 4.865 -5.733 11.838) 14.025 10.044 ( 1.262 -0.355 6.801) 6.926 10.208 ( -2.978 0.144 3.421) 4.538 15.982 ( -1.489 -1.574 -5.679) 6.078 16.320 ( 8.987 0.911 -0.931) 9.081 16.641 ( 0.587 0.691 -1.264) 1.555 17.061 ( -7.321 -6.572 10.769) 14.586 17.489 ( -2.286 4.726 3.806) 6.484 18.318 ( 6.681 2.860 -13.727) 15.532 ======================= Grid point 353 (194/294) ======================= q-point: (-0.17 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.794 ( -16.388 -7.266 -0.000) 17.927 2.407 ( -22.897 9.002 -11.468) 27.145 3.144 ( 14.592 2.985 -0.800) 14.916 3.615 ( 2.558 -1.702 8.228) 8.783 3.827 ( 5.322 -0.934 -3.735) 6.568 4.012 ( -1.880 -0.483 14.545) 14.674 5.060 ( 3.294 -5.445 3.660) 7.341 5.261 ( 0.346 -6.742 -7.581) 10.151 5.639 ( 4.163 6.756 -3.291) 8.591 6.735 ( -3.589 2.663 5.144) 6.814 7.024 ( -2.423 -0.286 -9.664) 9.967 7.246 ( 0.699 3.603 0.978) 3.798 7.937 ( 1.619 0.613 -3.707) 4.091 8.078 ( -0.750 6.012 -5.951) 8.492 8.664 ( 1.237 4.766 -12.002) 12.973 9.148 ( 1.166 -3.757 14.651) 15.170 9.999 ( -1.015 -10.824 5.337) 12.111 10.258 ( 2.525 2.985 1.232) 4.099 15.921 ( -2.287 1.282 -3.646) 4.491 16.473 ( 9.785 -0.362 -2.044) 10.003 16.615 ( -5.148 0.578 0.869) 5.253 16.986 ( -0.006 -6.482 9.835) 11.779 17.450 ( -3.058 -2.818 -5.097) 6.578 18.435 ( 5.935 11.146 -6.331) 14.126 ======================= Grid point 358 (195/294) ======================= q-point: ( 0.25 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.662 ( -10.516 6.622 14.584) 19.160 2.453 ( -18.715 0.061 24.642) 30.944 3.073 ( 0.384 15.039 19.765) 24.839 3.404 ( 5.151 -3.610 -7.628) 9.887 3.712 ( 2.999 -2.483 0.435) 3.918 4.598 ( 8.337 -8.984 -14.201) 18.758 4.830 ( 7.204 0.007 -9.775) 12.143 5.354 ( -6.973 3.900 -5.369) 9.626 6.060 ( 4.008 -11.968 -0.703) 12.641 6.450 ( 3.110 2.770 3.889) 5.699 6.988 ( -2.856 3.595 -0.958) 4.690 7.414 ( 0.834 -3.863 2.763) 4.822 8.000 ( -3.180 0.338 -3.375) 4.649 8.211 ( -9.628 -9.009 11.419) 17.443 8.674 ( -4.024 5.984 6.899) 9.980 9.254 ( 1.701 -6.810 -2.710) 7.524 9.646 ( 14.853 6.837 -14.493) 21.850 10.281 ( -2.827 2.007 -3.678) 5.054 15.851 ( -1.252 -1.410 2.912) 3.469 16.420 ( -4.636 1.251 7.043) 8.524 16.771 ( 7.622 2.230 -11.435) 13.922 16.858 ( 1.370 4.494 -1.383) 4.897 17.441 ( -2.092 1.793 1.446) 3.112 18.702 ( -0.258 -11.988 -1.888) 12.139 ======================= Grid point 359 (196/294) ======================= q-point: ( 0.33 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.705 ( -3.001 3.652 20.427) 20.967 2.288 ( -16.476 -2.930 26.595) 31.422 3.287 ( 4.944 1.268 -0.334) 5.115 3.492 ( 6.477 6.334 0.446) 9.071 3.766 ( 0.862 5.047 4.070) 6.541 4.500 ( 1.160 -10.450 -9.903) 14.444 4.896 ( 6.830 1.538 -10.912) 12.965 5.202 ( -9.187 3.835 -8.964) 13.397 6.014 ( 3.957 -12.178 0.869) 12.834 6.552 ( 3.442 1.918 3.133) 5.034 6.973 ( -3.021 3.535 0.777) 4.714 7.431 ( 3.357 -7.041 7.487) 10.812 7.906 ( -3.563 -5.833 0.206) 6.838 8.048 ( -6.777 -3.753 5.368) 9.425 8.629 ( -1.784 -7.334 -4.926) 9.013 9.287 ( 0.976 5.834 7.147) 9.277 9.865 ( 11.223 7.336 -9.854) 16.640 10.203 ( -5.341 3.997 -7.906) 10.344 15.851 ( 0.571 -3.105 5.419) 6.272 16.416 ( -1.200 0.362 4.190) 4.373 16.776 ( 0.613 -0.613 -8.602) 8.646 16.960 ( 2.804 8.276 -3.174) 9.297 17.390 ( -5.540 5.765 -5.028) 9.445 18.587 ( 2.885 -17.857 3.992) 18.524 ======================= Grid point 360 (197/294) ======================= q-point: ( 0.42 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.875 ( 4.012 1.720 21.991) 22.420 2.193 ( -9.660 -3.604 25.678) 27.670 3.310 ( 4.265 -4.288 -9.389) 11.168 3.613 ( 6.080 -1.647 -5.933) 8.653 3.863 ( -2.976 7.264 2.779) 8.328 4.379 ( -3.554 -0.112 0.643) 3.613 4.915 ( -1.988 2.243 -6.514) 7.170 5.090 ( 1.786 3.253 -10.041) 10.705 5.957 ( 1.704 -10.082 -0.213) 10.227 6.634 ( 2.583 -0.064 3.334) 4.218 6.959 ( -3.318 2.684 2.243) 4.821 7.453 ( 2.105 -10.985 10.112) 15.079 7.816 ( 0.465 -3.755 -2.178) 4.366 7.986 ( -0.605 -2.573 4.144) 4.915 8.454 ( -1.847 -11.880 -8.462) 14.702 9.438 ( 1.269 9.019 8.886) 12.724 9.980 ( -5.220 7.639 -4.514) 10.294 10.146 ( 4.093 6.011 -11.163) 13.323 15.873 ( 1.181 -3.254 6.836) 7.663 16.411 ( 1.109 -4.662 -2.331) 5.330 16.715 ( -3.496 3.241 -4.587) 6.616 17.023 ( -3.149 8.257 -0.284) 8.842 17.368 ( 1.012 6.065 -6.362) 8.848 18.487 ( 3.156 -19.114 3.867) 19.755 ======================= Grid point 361 (198/294) ======================= q-point: ( 0.50 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.068 ( 0.424 0.834 16.923) 16.949 2.268 ( 7.044 -4.126 24.520) 25.843 3.227 ( 0.089 -6.908 -13.799) 15.432 3.614 ( 2.147 -3.155 -6.995) 7.968 3.788 ( -4.283 -4.050 -3.748) 6.985 4.359 ( -9.493 10.238 0.912) 13.992 4.896 ( -0.940 5.891 5.466) 8.091 5.162 ( 7.261 3.299 -8.131) 11.389 5.873 ( -0.442 -8.021 -1.997) 8.278 6.663 ( -0.697 -2.472 4.261) 4.976 6.959 ( -0.017 1.817 1.568) 2.400 7.404 ( -0.097 -11.128 5.100) 12.241 7.803 ( 1.199 0.124 -5.256) 5.393 8.049 ( 8.488 -5.990 8.808) 13.620 8.268 ( -2.154 -8.780 -6.381) 11.066 9.571 ( -0.064 5.054 3.372) 6.076 9.861 ( -11.173 10.670 -4.948) 16.222 10.260 ( 5.238 5.855 -4.432) 9.020 15.911 ( 1.803 -2.291 6.466) 7.093 16.315 ( -0.878 -7.527 -8.010) 11.026 16.675 ( -3.795 4.333 -2.533) 6.292 17.074 ( -2.217 10.370 6.118) 12.243 17.433 ( 3.820 3.024 -3.225) 5.842 18.359 ( 1.612 -17.412 -1.462) 17.547 ======================= Grid point 362 (199/294) ======================= q-point: ( 0.58 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.167 ( 3.087 -0.166 10.086) 10.549 2.570 ( 13.737 -3.106 20.574) 24.933 3.002 ( -5.517 -10.222 -15.412) 19.299 3.563 ( -0.813 -2.266 -1.949) 3.097 3.664 ( -4.093 -1.440 -6.236) 7.597 4.253 ( -10.020 6.251 -2.485) 12.069 5.036 ( 1.814 7.544 9.261) 12.081 5.262 ( 4.480 3.502 -2.859) 6.365 5.760 ( -2.526 -6.963 -3.945) 8.392 6.635 ( -0.998 -2.633 2.890) 4.035 7.013 ( 3.595 0.890 0.268) 3.713 7.317 ( -0.226 -8.643 -0.849) 8.687 7.782 ( -0.098 0.840 -5.190) 5.258 8.129 ( 0.517 -6.321 -1.426) 6.500 8.261 ( 11.517 -4.100 10.627) 16.198 9.486 ( -10.626 2.367 -9.063) 14.165 9.865 ( -1.486 10.902 3.105) 11.432 10.346 ( 0.853 3.478 0.196) 3.587 15.966 ( 2.778 -1.185 3.717) 4.789 16.180 ( -1.546 -5.312 -6.561) 8.582 16.632 ( -2.538 2.012 -3.325) 4.642 17.217 ( -0.826 10.985 10.931) 15.519 17.494 ( 2.214 0.023 1.998) 2.982 18.197 ( 1.627 -13.562 -9.509) 16.643 ======================= Grid point 363 (200/294) ======================= q-point: ( 0.67 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.305 ( 8.153 -0.775 2.986) 8.717 2.679 ( -9.089 -5.912 -9.137) 14.179 2.890 ( 11.444 -3.764 11.789) 16.855 3.517 ( -3.755 -0.048 -8.130) 8.956 3.548 ( -2.590 -0.078 1.709) 3.104 4.165 ( -5.040 3.657 0.890) 6.290 5.151 ( 0.554 0.941 5.481) 5.589 5.340 ( -0.041 3.298 3.927) 5.128 5.607 ( -3.488 -5.262 -7.489) 9.795 6.648 ( 2.621 1.193 0.386) 2.905 7.079 ( 3.797 -1.322 0.073) 4.022 7.225 ( -0.686 -5.044 -3.866) 6.392 7.771 ( 0.792 3.120 -4.888) 5.853 8.091 ( -0.080 -1.078 -0.048) 1.082 8.510 ( 13.692 -4.839 12.815) 19.368 9.238 ( -13.144 2.450 -11.120) 17.390 9.980 ( 1.814 6.688 2.849) 7.493 10.351 ( -3.311 -0.164 2.850) 4.372 16.001 ( 1.132 -0.481 -3.509) 3.718 16.120 ( 2.038 -1.834 0.538) 2.794 16.602 ( -0.248 0.873 -2.842) 2.984 17.311 ( -5.453 1.252 11.620) 12.897 17.551 ( -0.170 2.958 6.014) 6.705 18.077 ( 6.114 -5.566 -14.910) 17.050 ======================= Grid point 364 (201/294) ======================= q-point: (-0.25 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.277 ( -10.071 -5.681 -1.512) 11.661 2.623 ( 11.775 3.535 -5.012) 13.277 2.994 ( -6.400 4.463 -1.458) 7.938 3.451 ( 3.443 -2.496 2.505) 4.936 3.560 ( 2.887 -1.651 0.335) 3.343 4.161 ( -1.846 1.936 5.979) 6.550 5.135 ( -3.962 -5.078 6.407) 9.085 5.292 ( -3.334 -8.259 -3.736) 9.658 5.549 ( 1.157 6.689 -4.194) 7.979 6.744 ( 3.589 6.029 0.506) 7.035 7.066 ( -0.669 -6.781 -1.346) 6.945 7.199 ( 2.116 2.438 -2.631) 4.164 7.817 ( 3.296 5.843 -5.606) 8.742 8.091 ( -0.543 1.285 0.443) 1.463 8.743 ( 7.032 -1.144 6.675) 9.762 9.005 ( -5.906 -1.007 -4.930) 7.759 10.067 ( 0.853 1.295 3.166) 3.525 10.276 ( -4.725 -3.074 2.236) 6.064 15.977 ( -1.096 2.037 -3.620) 4.296 16.193 ( 6.186 -0.448 0.663) 6.237 16.609 ( 1.908 0.580 -1.655) 2.591 17.215 ( -9.577 -6.566 11.363) 16.246 17.549 ( -2.792 -1.426 -3.365) 4.599 18.163 ( 10.094 7.556 -6.885) 14.367 ======================= Grid point 365 (202/294) ======================= q-point: (-0.17 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.047 ( -14.157 1.449 5.189) 15.148 2.767 ( -13.824 9.573 -11.392) 20.311 2.914 ( 12.015 3.513 -2.103) 12.693 3.556 ( 5.935 -5.037 6.174) 9.936 3.624 ( 8.842 -1.117 -2.998) 9.403 4.177 ( -3.613 -2.376 11.042) 11.859 5.033 ( -4.382 -7.478 7.440) 11.423 5.124 ( -0.351 -7.915 -11.574) 14.026 5.646 ( 2.625 7.987 -0.829) 8.448 6.852 ( -1.711 5.704 3.945) 7.143 6.972 ( 0.396 -3.949 -4.807) 6.234 7.276 ( 2.865 6.164 0.431) 6.811 7.904 ( 3.090 5.515 -5.557) 8.417 8.102 ( -0.390 3.920 -1.326) 4.156 8.681 ( -6.738 3.641 -11.286) 13.639 9.094 ( 9.924 -4.470 12.320) 16.439 10.009 ( -7.016 -8.952 6.273) 12.989 10.228 ( 1.879 -0.996 -2.252) 3.098 15.971 ( -1.957 4.940 -1.333) 5.478 16.307 ( 8.037 -0.375 -1.786) 8.242 16.646 ( 1.756 0.829 -0.312) 1.966 17.055 ( -7.947 -7.481 10.443) 15.106 17.414 ( -3.626 -6.434 -8.942) 11.597 18.409 ( 8.766 13.500 -1.927) 16.211 ======================= Grid point 370 (203/294) ======================= q-point: ( 0.25 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.021 ( -14.266 9.609 7.615) 18.811 2.857 ( -14.241 -4.276 15.741) 21.653 3.096 ( 5.873 -5.163 -3.099) 8.411 3.318 ( 3.854 4.754 0.508) 6.141 3.769 ( -2.088 5.429 14.580) 15.698 4.278 ( 10.458 -4.128 -14.933) 18.693 4.654 ( 6.807 -2.376 -4.432) 8.463 5.422 ( 0.288 -0.143 0.166) 0.362 5.900 ( -0.589 -7.798 -7.562) 10.879 6.478 ( 1.377 3.722 5.904) 7.114 7.054 ( -2.672 2.310 -0.750) 3.611 7.394 ( -1.346 -2.807 -1.313) 3.378 8.012 ( -2.372 -1.499 -6.433) 7.018 8.332 ( -7.960 -7.161 5.677) 12.120 8.843 ( -10.748 -4.009 4.113) 12.187 9.144 ( 9.752 1.252 -1.876) 10.009 9.419 ( 11.095 10.362 -6.222) 16.407 10.308 ( -0.164 0.418 0.766) 0.888 15.909 ( -5.001 0.326 0.761) 5.069 16.522 ( -4.191 -2.835 3.209) 5.992 16.593 ( 7.303 1.483 -10.769) 13.096 16.901 ( 1.091 7.584 3.434) 8.396 17.441 ( 5.044 -2.604 7.937) 9.758 18.608 ( -4.391 -7.779 -10.285) 13.623 ======================= Grid point 371 (204/294) ======================= q-point: ( 0.33 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.966 ( -9.132 6.379 13.494) 17.498 2.661 ( -14.400 -6.446 18.156) 24.053 3.102 ( 6.514 -7.138 -6.900) 11.874 3.426 ( 3.986 1.669 -1.235) 4.495 3.909 ( -0.593 8.406 8.721) 12.127 4.312 ( 7.556 -2.239 -6.380) 10.139 4.731 ( 6.728 1.755 -7.083) 9.925 5.344 ( -8.497 3.085 -7.123) 11.509 5.814 ( 5.085 -12.189 -0.354) 13.212 6.576 ( 0.941 3.936 6.127) 7.343 7.034 ( -1.520 2.038 -1.211) 2.816 7.360 ( 1.514 -6.307 3.274) 7.266 7.889 ( -3.282 -5.981 -5.450) 8.733 8.162 ( -7.787 -4.345 3.108) 9.443 8.619 ( -8.731 -9.295 0.672) 12.771 9.324 ( 7.198 5.342 1.259) 9.052 9.698 ( 11.751 12.700 -4.604) 17.904 10.283 ( -3.835 2.184 -2.275) 4.965 15.860 ( -1.546 -1.477 3.060) 3.733 16.437 ( -2.208 -4.953 -0.838) 5.487 16.665 ( 5.677 2.335 -8.561) 10.534 17.024 ( 0.777 9.460 4.349) 10.441 17.490 ( -2.242 2.271 0.274) 3.203 18.406 ( -0.719 -15.099 -3.042) 15.419 ======================= Grid point 372 (205/294) ======================= q-point: ( 0.42 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.007 ( -2.500 2.699 17.455) 17.838 2.486 ( -12.409 -6.812 19.538) 24.127 3.097 ( 6.411 -6.793 -9.255) 13.149 3.473 ( 3.781 -1.664 -3.242) 5.251 3.916 ( -2.249 -2.770 -5.394) 6.467 4.476 ( 4.655 11.645 6.045) 13.922 4.825 ( 6.246 3.898 -6.372) 9.737 5.160 ( -9.681 3.494 -8.270) 13.203 5.798 ( 5.187 -11.353 1.423) 12.562 6.652 ( -0.166 1.969 6.641) 6.929 7.019 ( -1.318 0.476 -1.152) 1.814 7.349 ( 2.953 -11.152 6.431) 13.208 7.757 ( -0.997 -4.818 -4.274) 6.517 8.037 ( -5.244 -1.757 0.935) 5.609 8.403 ( -6.699 -8.739 0.895) 11.047 9.487 ( 5.374 5.011 0.708) 7.382 9.978 ( 9.922 11.930 -3.190) 15.842 10.198 ( -7.238 4.483 -4.756) 9.752 15.862 ( 0.876 -2.683 5.277) 5.984 16.336 ( -1.222 -6.810 -4.316) 8.155 16.725 ( 2.923 4.342 -5.940) 7.917 17.150 ( -0.603 8.918 5.692) 10.596 17.434 ( -5.551 6.160 -6.109) 10.300 18.263 ( 3.242 -19.576 2.530) 20.003 ======================= Grid point 373 (206/294) ======================= q-point: ( 0.50 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.137 ( 2.906 -0.530 17.083) 17.336 2.368 ( -6.670 -7.454 19.621) 22.024 3.051 ( 2.912 -6.387 -12.205) 14.080 3.488 ( 3.344 -2.860 -4.008) 5.952 3.791 ( -3.307 -3.975 -4.885) 7.114 4.623 ( -6.868 12.375 -1.201) 14.204 4.937 ( 5.863 4.452 -3.797) 8.283 5.077 ( 0.550 6.279 -0.817) 6.356 5.767 ( 2.427 -9.528 -0.052) 9.833 6.684 ( -1.445 -2.228 7.702) 8.147 6.978 ( -1.121 -1.888 -2.142) 3.067 7.306 ( 1.395 -11.411 4.230) 12.250 7.746 ( 3.776 0.287 -1.539) 4.088 7.967 ( -0.746 -3.648 2.415) 4.438 8.249 ( -4.639 -5.124 2.369) 7.307 9.597 ( 2.731 3.003 -1.168) 4.224 10.076 ( -7.535 6.317 -8.502) 12.999 10.214 ( 5.664 10.157 0.249) 11.632 15.895 ( 1.904 -3.160 6.632) 7.589 16.218 ( -1.210 -6.406 -5.802) 8.727 16.757 ( -1.617 5.594 -5.424) 7.958 17.241 ( -1.690 8.405 6.648) 10.849 17.410 ( -0.241 5.934 -3.906) 7.108 18.141 ( 2.838 -19.727 1.235) 19.968 ======================= Grid point 374 (207/294) ======================= q-point: ( 0.58 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.203 ( -1.893 -4.412 10.176) 11.252 2.454 ( 9.661 -6.182 20.313) 23.328 2.916 ( -3.073 -5.148 -11.936) 13.357 3.481 ( 2.406 -3.306 -4.391) 6.000 3.697 ( -3.003 -0.239 -1.983) 3.606 4.506 ( -13.259 8.335 -4.637) 16.333 5.049 ( 5.999 2.676 -4.037) 7.710 5.238 ( 4.691 9.167 4.027) 11.057 5.689 ( -0.389 -8.696 -2.588) 9.081 6.650 ( -2.680 -6.097 7.942) 10.365 6.953 ( 2.552 -1.265 -3.396) 4.432 7.247 ( -0.122 -6.280 1.379) 6.430 7.795 ( -0.651 3.767 -1.847) 4.246 8.002 ( 7.570 -7.672 7.667) 13.227 8.194 ( -0.145 -0.886 4.704) 4.789 9.589 ( -4.551 1.285 -5.870) 7.538 9.992 ( -4.013 7.659 -6.209) 10.645 10.365 ( 2.449 5.793 0.644) 6.322 15.939 ( 2.003 -2.884 6.085) 7.026 16.118 ( -0.845 -3.311 -4.278) 5.475 16.708 ( -5.149 4.419 -5.630) 8.817 17.390 ( 3.261 10.654 7.987) 13.709 17.453 ( 0.562 2.127 1.201) 2.506 17.983 ( 1.070 -17.374 -4.153) 17.895 ======================= Grid point 375 (208/294) ======================= q-point: ( 0.67 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.206 ( 3.287 -4.331 3.578) 6.508 2.677 ( 4.184 -7.111 1.852) 8.456 2.769 ( 2.246 -1.033 8.267) 8.628 3.450 ( 1.266 -3.017 -5.909) 6.755 3.645 ( -4.531 2.969 -0.423) 5.434 4.348 ( -10.624 6.317 -2.426) 12.596 5.124 ( 3.882 -0.537 -3.626) 5.339 5.383 ( 0.968 2.374 2.724) 3.741 5.569 ( -1.773 -4.142 -3.780) 5.881 6.628 ( 0.817 -1.927 5.984) 6.340 6.985 ( 4.618 -1.483 -2.952) 5.678 7.195 ( -1.361 -2.798 0.276) 3.124 7.795 ( -1.594 4.086 -2.024) 4.830 8.086 ( 2.249 -2.160 6.549) 7.253 8.320 ( 11.225 -3.051 10.227) 15.488 9.409 ( -11.752 2.150 -10.488) 15.898 10.008 ( 1.070 5.241 -3.694) 6.501 10.409 ( -1.629 0.421 1.277) 2.112 15.974 ( 1.284 -0.771 2.173) 2.639 16.087 ( 0.599 -0.262 0.450) 0.794 16.631 ( -3.792 2.719 -4.573) 6.533 17.458 ( -3.575 -2.581 8.098) 9.220 17.597 ( 1.815 5.986 3.470) 7.153 17.842 ( 5.861 -6.674 -7.622) 11.704 ======================= Grid point 376 (209/294) ======================= q-point: (-0.25 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.276 ( 7.028 -2.322 -1.281) 7.512 2.552 ( -5.256 1.740 -3.011) 6.302 3.001 ( 9.962 -2.444 12.936) 16.509 3.390 ( -0.067 -2.625 -6.938) 7.419 3.589 ( -5.691 2.702 1.893) 6.578 4.257 ( -4.754 2.718 -0.262) 5.483 5.102 ( 0.893 -5.614 -8.290) 10.052 5.293 ( -5.954 -7.575 2.978) 10.085 5.594 ( 0.834 7.043 1.051) 7.170 6.718 ( 5.137 3.810 2.269) 6.786 7.019 ( 1.853 -2.834 0.400) 3.410 7.164 ( 0.767 0.593 -1.983) 2.207 7.813 ( 0.619 4.635 -2.429) 5.270 8.135 ( -0.573 2.112 5.402) 5.828 8.578 ( 14.258 -4.036 12.307) 19.262 9.142 ( -13.620 2.397 -12.268) 18.487 10.060 ( 2.597 2.479 -2.590) 4.427 10.335 ( -5.476 -5.045 1.534) 7.602 16.005 ( 0.527 3.504 -0.308) 3.557 16.125 ( 2.164 0.550 2.513) 3.361 16.590 ( -0.492 1.222 -2.800) 3.095 17.361 ( -7.828 -8.743 8.769) 14.650 17.522 ( -2.741 -4.782 -8.074) 9.776 18.053 ( 11.691 11.518 1.408) 16.472 ======================= Grid point 377 (210/294) ======================= q-point: (-0.17 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.304 ( -5.535 3.949 4.715) 8.274 2.613 ( 12.148 4.127 -6.441) 14.356 3.084 ( -8.800 7.795 -4.021) 12.425 3.394 ( 9.377 -9.076 6.681) 14.660 3.544 ( -2.050 0.358 1.102) 2.355 4.207 ( -0.984 -5.189 -0.003) 5.282 4.981 ( 0.028 -3.974 -11.513) 12.180 5.150 ( -8.300 -5.919 9.039) 13.625 5.687 ( 1.219 6.994 1.038) 7.175 6.852 ( 5.730 1.190 -2.591) 6.400 6.985 ( -4.330 -0.125 4.344) 6.134 7.248 ( 6.988 5.929 -2.123) 9.407 7.873 ( 2.901 4.571 -3.289) 6.335 8.173 ( -2.181 4.340 4.378) 6.539 8.784 ( -3.239 2.223 -2.577) 4.698 8.936 ( 4.906 -3.477 1.151) 6.123 10.094 ( -1.734 -1.153 2.679) 3.393 10.163 ( -4.387 -8.335 -2.476) 9.739 16.057 ( -0.508 6.969 -0.009) 6.988 16.191 ( 3.929 0.643 0.259) 3.989 16.606 ( 2.671 0.331 -0.479) 2.734 17.169 ( -7.707 -9.004 3.038) 12.235 17.374 ( -5.144 -5.980 -3.158) 8.497 18.373 ( 10.531 13.575 0.363) 17.185 ======================= Grid point 383 (211/294) ======================= q-point: ( 0.25 0.58 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.400 ( -15.484 9.679 2.248) 18.398 2.769 ( 6.635 -16.387 -8.920) 19.802 3.108 ( -4.732 -2.962 5.942) 8.154 3.308 ( 6.699 7.455 -1.741) 10.173 3.958 ( -1.307 4.817 15.080) 15.884 4.031 ( 5.918 -0.316 -10.110) 11.719 4.539 ( 2.469 -2.925 4.858) 6.185 5.342 ( 6.320 -4.979 4.303) 9.124 5.853 ( -5.367 -1.056 -12.343) 13.501 6.534 ( 1.539 3.916 7.080) 8.236 7.117 ( -3.302 1.427 -1.277) 3.817 7.369 ( -1.748 -4.047 -6.415) 7.784 7.985 ( -2.351 -2.579 -6.702) 7.556 8.415 ( -6.634 -3.670 -1.289) 7.690 8.873 ( 13.449 5.869 -14.301) 20.490 9.021 ( -8.993 -10.292 8.064) 15.869 9.433 ( 3.593 11.913 9.731) 15.797 10.309 ( 1.943 0.167 4.006) 4.456 16.036 ( -9.042 1.662 -0.887) 9.236 16.415 ( 5.337 -1.812 -10.423) 11.849 16.561 ( -1.609 -2.014 0.648) 2.658 17.003 ( 0.376 7.485 8.443) 11.290 17.337 ( 9.326 -4.223 10.943) 14.985 18.564 ( -6.329 -3.897 -16.281) 17.898 ======================= Grid point 384 (212/294) ======================= q-point: ( 0.33 0.58 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.273 ( -12.087 6.376 6.656) 15.200 2.685 ( 5.171 -12.941 -5.348) 14.927 3.017 ( -4.631 -5.399 5.343) 8.896 3.431 ( 0.472 4.525 1.947) 4.948 3.957 ( -0.947 -3.370 -6.039) 6.980 4.159 ( 9.196 5.487 0.723) 10.733 4.658 ( 5.201 4.782 6.010) 9.276 5.403 ( 1.784 -2.608 1.599) 3.541 5.669 ( -3.595 -5.614 -7.555) 10.075 6.652 ( 0.996 5.564 7.396) 9.309 7.058 ( -2.110 0.317 -4.630) 5.098 7.289 ( 0.538 -6.714 -0.854) 6.790 7.855 ( -3.813 -4.239 -6.767) 8.849 8.257 ( -7.011 -2.426 -1.706) 7.612 8.733 ( -12.174 -9.733 6.554) 16.908 9.140 ( 14.732 4.476 -9.293) 17.984 9.695 ( 6.234 12.985 6.003) 15.605 10.340 ( -1.184 1.101 2.048) 2.609 15.920 ( -5.308 -0.029 0.516) 5.333 16.367 ( 0.849 -6.431 -6.741) 9.355 16.578 ( 3.174 2.746 -2.907) 5.106 17.143 ( 0.739 8.047 8.902) 12.023 17.493 ( 5.056 -0.914 6.956) 8.648 18.299 ( -6.309 -9.121 -12.770) 16.914 ======================= Grid point 385 (213/294) ======================= q-point: ( 0.42 0.58 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.202 ( -7.252 1.681 10.718) 13.050 2.608 ( -0.655 -9.565 2.010) 9.796 2.934 ( -0.542 -6.408 1.251) 6.552 3.454 ( -1.909 1.581 2.406) 3.454 3.852 ( -0.582 -5.150 -8.304) 9.788 4.399 ( 13.119 7.789 -7.723) 17.100 4.844 ( 2.568 8.812 10.474) 13.927 5.315 ( -9.609 3.355 -6.884) 12.287 5.600 ( 5.938 -11.048 2.360) 12.763 6.746 ( -1.460 4.388 7.926) 9.177 6.997 ( -0.227 -3.046 -5.439) 6.238 7.238 ( 1.682 -8.212 2.026) 8.624 7.722 ( -2.820 -2.678 -4.540) 5.978 8.118 ( -6.207 -1.250 -1.976) 6.633 8.498 ( -10.320 -8.570 8.556) 15.911 9.356 ( 11.977 4.351 -8.215) 15.162 9.944 ( 6.653 11.001 0.876) 12.887 10.321 ( -3.982 2.848 0.462) 4.918 15.867 ( -1.366 -1.375 2.580) 3.227 16.267 ( -1.102 -6.124 -4.368) 7.602 16.658 ( 4.978 3.952 -4.814) 7.974 17.281 ( 0.177 6.387 9.685) 11.603 17.554 ( -3.106 6.003 -0.953) 6.826 18.054 ( -0.958 -15.989 -4.904) 16.752 ======================= Grid point 386 (214/294) ======================= q-point: ( 0.50 0.58 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.199 ( -1.126 -2.901 13.207) 13.568 2.494 ( -6.011 -10.098 10.355) 15.663 2.887 ( 2.648 -4.107 -6.448) 8.091 3.448 ( -1.318 0.829 1.058) 1.883 3.756 ( -0.523 -3.220 -5.600) 6.481 4.621 ( 11.610 7.245 -13.479) 19.208 5.005 ( -4.725 10.112 6.594) 12.964 5.165 ( -4.140 3.958 -1.288) 5.871 5.610 ( 5.066 -10.796 2.108) 12.110 6.777 ( -4.256 0.149 9.641) 10.540 6.916 ( 0.460 -6.252 -5.570) 8.386 7.215 ( 1.885 -5.630 2.301) 6.367 7.686 ( 2.183 -0.078 0.095) 2.187 8.004 ( -4.794 -1.331 -0.774) 5.035 8.336 ( -7.288 -5.186 8.516) 12.350 9.514 ( 7.781 2.977 -6.651) 10.660 10.103 ( 2.307 6.832 -6.969) 10.028 10.301 ( -2.144 5.716 1.777) 6.358 15.872 ( 1.280 -2.543 4.757) 5.544 16.171 ( -1.924 -3.632 -2.429) 4.775 16.749 ( 4.028 4.953 -6.027) 8.780 17.359 ( -2.350 3.395 2.955) 5.077 17.540 ( -5.482 10.864 1.610) 12.275 17.901 ( 3.630 -19.385 0.503) 19.728 ======================= Grid point 387 (215/294) ======================= q-point: ( 0.58 0.58 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.247 ( -0.675 -5.834 11.178) 12.626 2.376 ( 0.589 -13.230 13.929) 19.220 2.855 ( 0.575 0.748 -8.156) 8.210 3.436 ( -1.327 0.768 -0.754) 1.708 3.715 ( -0.091 0.395 -1.346) 1.406 4.707 ( -1.520 5.042 -12.561) 13.620 4.959 ( -2.162 6.338 -5.139) 8.442 5.286 ( 3.749 6.514 6.620) 10.015 5.572 ( 2.225 -10.379 -0.423) 10.623 6.721 ( -5.486 -6.297 12.077) 14.683 6.865 ( 2.254 -1.638 -5.799) 6.434 7.212 ( 0.712 -2.527 1.868) 3.222 7.789 ( 6.876 1.405 4.921) 8.571 7.925 ( -2.592 -2.453 1.545) 3.889 8.259 ( -3.960 -1.647 7.837) 8.934 9.580 ( 2.302 0.760 -6.437) 6.878 10.077 ( -4.170 6.310 -9.731) 12.325 10.377 ( 2.508 3.859 0.139) 4.604 15.909 ( 2.272 -3.543 6.312) 7.586 16.114 ( -1.910 0.709 -0.140) 2.042 16.780 ( -1.711 4.790 -7.353) 8.941 17.365 ( 2.148 4.272 -5.064) 6.964 17.615 ( -2.943 8.601 11.212) 14.434 17.772 ( 2.072 -18.119 0.030) 18.237 ======================= Grid point 388 (216/294) ======================= q-point: (-0.33 -0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.150 ( -2.374 -10.308 3.912) 11.278 2.491 ( 12.024 -10.518 14.111) 21.315 2.822 ( -2.943 3.783 -1.958) 5.178 3.409 ( -1.565 1.446 -3.212) 3.854 3.732 ( -1.165 4.197 1.583) 4.634 4.551 ( -9.990 1.256 -9.021) 13.519 5.004 ( 3.995 2.866 -8.276) 9.627 5.372 ( 0.226 -3.192 -1.711) 3.628 5.550 ( 2.533 1.025 4.076) 4.907 6.673 ( -2.654 -3.720 12.138) 12.970 6.872 ( 3.991 -0.971 -5.254) 6.669 7.206 ( -0.900 -1.028 1.743) 2.215 7.862 ( -3.064 1.608 0.428) 3.487 8.007 ( 10.473 -1.543 10.824) 15.140 8.267 ( 0.229 0.161 7.545) 7.550 9.512 ( -5.376 -0.214 -8.721) 10.247 10.022 ( -1.947 5.843 -8.998) 10.904 10.420 ( 0.632 -0.506 -1.043) 1.320 15.950 ( 2.186 -3.765 6.136) 7.524 16.124 ( -1.278 5.226 2.392) 5.888 16.709 ( -5.251 3.510 -6.928) 9.374 17.442 ( 4.465 0.850 -2.579) 5.226 17.585 ( -1.069 -9.081 -10.982) 14.290 17.778 ( 1.752 4.276 18.771) 19.331 ======================= Grid point 389 (217/294) ======================= q-point: (-0.25 -0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.082 ( 5.817 -8.674 -3.489) 11.011 2.649 ( 3.123 -1.187 6.977) 7.736 2.857 ( 6.000 -3.026 10.597) 12.548 3.370 ( -2.641 2.614 -5.076) 6.291 3.755 ( -5.072 6.856 3.222) 9.116 4.327 ( -6.868 -5.824 -9.295) 12.942 4.990 ( -0.287 -0.054 -10.353) 10.357 5.312 ( -0.798 -3.390 0.220) 3.489 5.661 ( 1.220 5.897 5.330) 8.041 6.706 ( 1.235 -0.643 7.402) 7.532 6.923 ( 6.282 0.387 -3.352) 7.131 7.183 ( -2.166 -0.304 1.621) 2.722 7.838 ( -0.877 0.293 0.612) 1.109 8.211 ( 2.050 4.645 10.306) 11.488 8.390 ( 10.800 -2.431 9.546) 14.618 9.305 ( -11.395 0.545 -11.604) 16.273 10.011 ( 1.388 2.887 -8.261) 8.861 10.372 ( -3.287 -4.148 0.285) 5.300 15.989 ( 2.566 -2.669 4.232) 5.623 16.190 ( -1.363 8.195 3.981) 9.212 16.618 ( -3.766 1.947 -5.289) 6.778 17.355 ( -3.401 -11.102 -6.868) 13.490 17.502 ( -0.337 -1.034 -0.960) 1.450 18.026 ( 7.873 9.654 11.150) 16.719 ======================= Grid point 390 (218/294) ======================= q-point: (-0.17 -0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.144 ( 13.938 -5.089 -9.215) 17.467 2.687 ( -5.020 8.403 6.331) 11.657 3.065 ( 14.359 -9.346 14.392) 22.376 3.302 ( -4.859 3.354 -6.530) 8.804 3.711 ( -10.486 6.063 3.765) 12.684 4.110 ( -1.068 -12.628 -10.021) 16.156 4.924 ( -1.186 4.238 -9.431) 10.407 5.265 ( -4.298 -3.151 5.672) 7.783 5.752 ( -0.070 5.488 3.466) 6.491 6.755 ( 3.209 -3.001 0.205) 4.398 7.054 ( 4.019 5.180 1.806) 6.801 7.171 ( 2.462 1.871 -0.709) 3.173 7.850 ( 1.752 -0.007 0.233) 1.767 8.305 ( -2.628 6.186 8.523) 10.854 8.657 ( 14.447 -2.354 10.637) 18.095 9.021 ( -13.594 1.164 -13.514) 19.204 10.008 ( 3.042 -1.387 -8.651) 9.274 10.243 ( -7.531 -5.261 3.893) 9.978 16.040 ( 3.871 -1.309 1.457) 4.338 16.269 ( -2.932 10.218 3.125) 11.080 16.570 ( 0.382 -0.305 -2.345) 2.395 17.147 ( -3.834 -8.389 -8.736) 12.704 17.444 ( -5.542 -4.435 6.354) 9.526 18.332 ( 10.016 11.583 3.916) 15.806 ======================= Grid point 395 (219/294) ======================= q-point: ( 0.25 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.384 ( 10.323 -17.688 -8.927) 22.340 2.749 ( -13.800 6.392 -4.045) 15.737 3.126 ( 17.199 8.320 -11.230) 22.162 3.198 ( -6.455 -2.025 4.434) 8.089 3.934 ( 3.381 -1.855 0.555) 3.896 4.050 ( 3.155 2.172 9.511) 10.253 4.617 ( -8.325 -2.203 11.967) 14.743 5.230 ( 4.507 -2.532 3.917) 6.486 5.871 ( -4.451 1.874 -11.603) 12.568 6.582 ( 2.393 3.318 7.695) 8.715 7.169 ( -3.503 0.259 -4.590) 5.780 7.285 ( 0.001 -5.782 -8.948) 10.654 7.973 ( -2.650 -2.107 -4.677) 5.774 8.459 ( -1.699 2.974 -9.301) 9.912 8.618 ( 9.305 3.857 -11.907) 15.596 9.109 ( -3.533 -7.376 10.141) 13.028 9.598 ( -4.072 5.363 13.174) 14.795 10.302 ( 2.896 1.214 5.145) 6.027 16.228 ( -12.305 2.475 -2.156) 12.736 16.247 ( 5.000 -2.390 -9.498) 10.997 16.558 ( 0.046 -2.169 0.972) 2.377 17.093 ( 2.445 -1.956 12.660) 13.041 17.239 ( 6.623 4.885 8.729) 11.997 18.531 ( -5.642 -1.736 -19.011) 19.906 ======================= Grid point 396 (220/294) ======================= q-point: ( 0.33 0.67 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.373 ( 10.417 -11.771 -5.498) 16.653 2.561 ( -12.480 4.039 -0.982) 13.154 3.091 ( -6.264 -3.548 4.292) 8.382 3.389 ( 11.402 6.999 -7.735) 15.453 3.882 ( -1.674 -2.830 -9.392) 9.951 4.137 ( 0.513 -1.892 9.352) 9.555 4.684 ( 4.656 3.535 13.898) 15.078 5.310 ( 4.802 -3.054 4.976) 7.559 5.709 ( -7.778 0.459 -9.590) 12.356 6.724 ( 2.833 5.860 7.381) 9.841 7.041 ( -2.502 -2.610 -11.146) 11.718 7.219 ( -0.229 -4.654 -0.416) 4.679 7.862 ( -4.454 -1.702 -5.026) 6.927 8.331 ( -6.250 -0.609 -5.646) 8.444 8.807 ( 8.267 4.891 -11.857) 15.259 8.954 ( -4.734 -8.669 10.082) 14.114 9.762 ( 4.155 8.754 8.849) 13.122 10.366 ( 0.857 0.010 3.704) 3.802 16.043 ( -9.218 0.658 -1.993) 9.454 16.237 ( 2.972 -3.734 -6.398) 7.982 16.556 ( 0.752 0.883 -0.713) 1.362 17.218 ( 4.176 -1.282 12.944) 13.661 17.441 ( 5.826 4.700 6.780) 10.100 18.273 ( -8.377 -3.598 -17.353) 19.602 ======================= Grid point 397 (221/294) ======================= q-point: ( 0.42 0.67 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.394 ( -8.746 -0.519 3.742) 9.527 2.434 ( 7.756 -5.077 -3.735) 9.994 2.970 ( -6.507 -5.721 5.141) 10.075 3.522 ( 1.210 3.930 -1.178) 4.278 3.757 ( -0.458 -5.247 -8.339) 9.863 4.226 ( 7.273 4.681 -4.240) 9.632 4.915 ( 6.920 3.267 14.459) 16.359 5.383 ( 3.568 -2.856 3.958) 6.046 5.522 ( -8.400 -0.018 -6.598) 10.682 6.842 ( 0.608 3.093 1.609) 3.539 6.937 ( -1.075 -0.688 -3.446) 3.675 7.166 ( 0.031 -5.352 0.496) 5.375 7.747 ( -4.511 -0.147 -3.514) 5.720 8.191 ( -5.912 -0.828 -4.282) 7.346 8.662 ( -11.442 -8.788 10.866) 18.061 9.115 ( 14.590 5.625 -10.353) 18.753 9.958 ( 4.554 7.915 3.383) 9.738 10.379 ( -0.741 -0.842 1.829) 2.146 15.921 ( -4.946 0.062 -0.074) 4.947 16.202 ( 0.629 -3.178 -3.000) 4.415 16.596 ( 3.179 2.728 -2.774) 5.025 17.348 ( 3.522 -2.033 12.467) 13.113 17.595 ( 4.360 2.719 2.834) 5.868 17.990 ( -9.828 -2.946 -12.250) 15.979 ======================= Grid point 398 (222/294) ======================= q-point: ( 0.50 0.67 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.268 ( -4.734 -6.286 6.171) 10.001 2.499 ( 1.507 -2.301 3.421) 4.390 2.834 ( -3.976 -5.756 1.182) 7.095 3.529 ( -2.831 2.846 2.174) 4.566 3.687 ( 1.168 -2.047 -5.721) 6.188 4.394 ( 11.357 6.241 -12.526) 18.023 5.131 ( 5.923 2.491 11.716) 13.362 5.327 ( -11.693 5.653 -4.320) 13.687 5.435 ( 4.848 -9.414 2.087) 10.793 6.810 ( 0.694 -2.596 -7.198) 7.683 6.935 ( -5.754 1.078 9.999) 11.587 7.148 ( 2.667 -2.897 0.709) 4.001 7.686 ( -1.552 1.567 -0.405) 2.242 8.070 ( -5.035 -0.966 -1.797) 5.433 8.483 ( -9.142 -6.419 11.744) 16.208 9.328 ( 11.894 4.814 -10.521) 16.593 10.096 ( 2.862 6.477 -2.444) 7.491 10.357 ( -0.908 -1.266 -0.018) 1.558 15.875 ( -1.217 -0.785 2.553) 2.935 16.173 ( -0.897 -0.219 0.372) 0.995 16.674 ( 4.936 3.528 -4.653) 7.646 17.423 ( -0.618 -1.017 5.327) 5.459 17.636 ( 4.795 -12.140 -3.835) 13.604 17.807 ( -8.976 9.190 2.645) 13.116 ======================= Grid point 399 (223/294) ======================= q-point: (-0.42 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.207 ( 2.540 -11.509 9.242) 14.978 2.395 ( -9.407 -12.418 9.400) 18.195 2.820 ( 2.643 6.384 -4.558) 8.278 3.520 ( -4.314 4.312 1.300) 6.236 3.692 ( 2.822 1.136 -0.744) 3.132 4.527 ( 9.209 1.994 -17.455) 19.836 5.158 ( -10.002 4.524 -3.397) 11.491 5.317 ( 3.059 5.560 7.226) 9.617 5.417 ( 4.226 -10.457 1.549) 11.385 6.765 ( 0.303 -1.924 -2.637) 3.279 6.877 ( -6.294 -2.680 9.614) 11.799 7.187 ( 2.027 -0.298 1.538) 2.562 7.733 ( 3.700 2.122 4.096) 5.914 7.986 ( -3.972 -0.309 0.759) 4.055 8.380 ( -6.009 -2.860 10.750) 12.643 9.459 ( 7.043 1.742 -9.944) 12.310 10.138 ( -1.837 6.300 -6.937) 9.549 10.343 ( 2.199 -1.951 -1.958) 3.531 15.885 ( 1.015 -2.385 4.991) 5.624 16.182 ( -1.564 4.206 3.558) 5.727 16.752 ( 3.768 3.218 -6.871) 8.471 17.365 ( -2.345 -0.264 -6.693) 7.097 17.561 ( 3.220 -13.017 -0.704) 13.428 17.846 ( -5.023 9.218 12.791) 16.547 ======================= Grid point 400 (224/294) ======================= q-point: (-0.33 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.141 ( -8.435 -15.948 5.530) 18.870 2.253 ( 10.656 -15.135 11.865) 21.987 2.915 ( -0.735 11.178 -1.014) 11.248 3.487 ( -4.605 5.283 -1.626) 7.194 3.783 ( 2.448 5.323 3.747) 6.955 4.478 ( 1.756 -8.428 -19.853) 21.639 5.064 ( -6.038 8.362 -2.861) 10.703 5.312 ( -0.574 -4.220 -4.762) 6.389 5.538 ( 6.412 2.813 9.645) 11.918 6.745 ( -0.218 -1.719 0.829) 1.921 6.819 ( -3.082 -3.225 8.265) 9.392 7.216 ( 0.451 0.115 1.548) 1.617 7.873 ( 4.175 -3.196 8.042) 9.608 7.956 ( 1.082 4.920 2.356) 5.561 8.357 ( -3.233 0.635 10.061) 10.586 9.468 ( 1.604 -2.285 -10.340) 10.710 10.089 ( -4.923 6.593 -8.755) 12.015 10.359 ( 3.491 -2.334 -3.389) 5.396 15.914 ( 1.843 -4.038 6.506) 7.876 16.243 ( -1.793 7.951 5.796) 10.001 16.751 ( -1.274 1.710 -8.322) 8.591 17.338 ( 4.558 -1.514 -6.538) 8.113 17.459 ( -1.304 -5.223 -7.386) 9.140 17.953 ( -2.161 4.902 19.454) 20.178 ======================= Grid point 401 (225/294) ======================= q-point: (-0.25 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.911 ( -1.708 -15.391 -0.515) 15.494 2.410 ( 16.388 -16.207 13.523) 26.722 2.979 ( -4.928 10.546 3.101) 12.046 3.456 ( -4.488 6.511 -2.732) 8.366 3.901 ( 0.173 8.581 4.169) 9.542 4.219 ( -3.571 -15.419 -17.298) 23.446 5.034 ( -5.429 8.837 -6.916) 12.466 5.264 ( 2.051 -1.619 -2.916) 3.916 5.720 ( 3.401 4.718 8.572) 10.359 6.725 ( 0.054 -2.769 -0.227) 2.779 6.838 ( 2.208 -0.615 7.862) 8.190 7.223 ( -0.980 0.251 1.567) 1.866 7.851 ( -1.783 -4.366 3.938) 6.144 8.186 ( 11.583 4.385 8.792) 15.188 8.396 ( -2.190 3.603 10.042) 10.891 9.346 ( -3.784 -4.604 -11.709) 13.138 10.012 ( -4.153 5.373 -9.902) 12.007 10.358 ( 0.831 -2.314 -1.895) 3.104 15.945 ( 2.083 -4.558 6.445) 8.164 16.334 ( -1.624 8.484 6.241) 10.656 16.670 ( -3.858 2.117 -7.637) 8.814 17.258 ( -2.746 -7.141 -9.410) 12.128 17.447 ( 4.761 2.491 -5.967) 8.029 18.112 ( 1.704 4.621 19.321) 19.939 ======================= Grid point 402 (226/294) ======================= q-point: (-0.17 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.807 ( 8.594 -11.986 -7.493) 16.543 2.636 ( 17.929 -14.774 14.045) 27.147 3.006 ( -4.822 7.408 5.669) 10.501 3.412 ( -5.822 5.518 -4.188) 9.049 3.882 ( -1.550 -19.083 -15.049) 24.352 4.000 ( -7.112 12.870 5.975) 15.872 4.982 ( -4.169 9.082 -8.742) 13.277 5.289 ( 1.510 -0.398 0.661) 1.695 5.831 ( -0.308 3.810 5.845) 6.984 6.691 ( 0.539 -4.651 -0.426) 4.701 6.984 ( 8.244 4.860 3.727) 10.270 7.208 ( -2.303 0.325 1.929) 3.021 7.816 ( 0.491 -4.598 3.082) 5.557 8.443 ( 5.137 -2.035 8.381) 10.038 8.504 ( 5.147 9.383 10.743) 15.164 9.125 ( -8.178 -3.908 -12.628) 15.545 9.934 ( -2.174 2.232 -10.346) 10.805 10.318 ( -3.067 -1.761 1.458) 3.826 15.976 ( 2.628 -3.714 4.242) 6.220 16.423 ( -0.019 5.358 5.356) 7.576 16.584 ( -4.927 4.307 -6.231) 9.036 17.081 ( -3.600 -4.650 -10.085) 11.674 17.487 ( 0.497 -1.564 0.996) 1.920 18.333 ( 5.878 7.237 11.787) 15.028 ======================= Grid point 407 (227/294) ======================= q-point: ( 0.25 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.970 ( 12.871 -16.536 -6.828) 22.039 2.680 ( 22.401 5.949 -15.438) 27.848 3.052 ( -9.512 3.211 -4.765) 11.113 3.373 ( -9.856 0.431 5.347) 11.221 3.813 ( 13.523 -5.746 16.714) 22.254 4.088 ( -6.106 2.519 -5.425) 8.548 4.862 ( -12.802 -1.782 11.515) 17.311 5.204 ( 1.634 2.406 3.472) 4.530 5.888 ( -2.480 2.796 -9.550) 10.255 6.611 ( 3.016 2.387 7.614) 8.531 7.110 ( -0.457 -4.868 -17.016) 17.705 7.232 ( -0.462 -0.191 0.729) 0.884 7.935 ( 1.270 -4.313 -4.660) 6.475 8.375 ( 8.151 11.144 -11.568) 18.012 8.582 ( -7.260 0.430 -9.779) 12.187 9.115 ( 3.531 -5.615 12.876) 14.484 9.812 ( -9.177 -0.791 11.652) 14.853 10.303 ( 2.413 2.405 4.085) 5.319 16.084 ( 4.920 -2.516 -8.505) 10.143 16.442 ( -9.107 2.428 -5.196) 10.763 16.543 ( -1.367 -1.854 5.981) 6.410 17.056 ( 2.671 -5.824 11.382) 13.062 17.316 ( 1.822 9.102 8.357) 12.490 18.482 ( -3.854 -0.164 -19.822) 20.194 ======================= Grid point 408 (228/294) ======================= q-point: ( 0.33 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.055 ( 13.303 -6.963 -1.062) 15.052 2.758 ( -9.039 1.459 -5.869) 10.876 3.104 ( 14.468 6.712 -14.209) 21.360 3.255 ( -6.225 -0.375 5.919) 8.598 3.871 ( -6.303 -1.507 -7.463) 9.884 4.106 ( 8.343 -8.233 13.775) 18.087 4.774 ( -4.658 0.707 12.445) 13.307 5.282 ( 1.892 2.131 3.391) 4.429 5.781 ( -5.728 1.402 -7.507) 9.546 6.748 ( 4.351 2.900 4.865) 7.143 6.975 ( -1.191 -0.326 -11.063) 11.131 7.206 ( -1.573 -1.953 -0.361) 2.533 7.880 ( -1.525 -1.517 -3.733) 4.309 8.394 ( -6.730 1.757 -9.310) 11.621 8.594 ( 12.042 9.143 -12.256) 19.463 9.072 ( -7.592 -10.815 13.160) 18.649 9.836 ( 1.070 3.849 10.508) 11.242 10.356 ( 1.436 -1.690 2.075) 3.037 16.082 ( 2.633 -2.406 -5.938) 6.927 16.255 ( -10.778 2.590 -2.624) 11.391 16.551 ( 0.386 -0.600 1.592) 1.745 17.149 ( 6.344 -6.692 12.461) 15.502 17.477 ( 2.510 6.635 3.976) 8.132 18.287 ( -6.558 1.760 -16.170) 17.537 ======================= Grid point 409 (229/294) ======================= q-point: ( 0.42 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.244 ( 10.853 1.835 1.859) 11.163 2.551 ( -10.528 -1.632 -2.980) 11.062 3.089 ( -8.290 -2.257 4.020) 9.485 3.405 ( 13.229 5.751 -9.295) 17.160 3.684 ( -4.056 -5.951 -7.150) 10.149 4.203 ( 1.830 -0.565 5.344) 5.677 4.871 ( 6.112 -2.432 14.170) 15.622 5.328 ( 1.576 -1.811 0.318) 2.422 5.650 ( -7.443 2.788 -4.711) 9.239 6.803 ( 1.051 -0.092 -5.401) 5.503 6.989 ( 1.442 6.978 2.575) 7.576 7.144 ( -2.375 -3.435 0.061) 4.176 7.812 ( -4.003 1.251 -2.134) 4.706 8.247 ( -5.621 -0.210 -6.624) 8.690 8.783 ( 2.079 2.887 -4.807) 5.980 8.925 ( 0.594 -4.604 6.260) 7.793 9.981 ( 3.608 5.105 5.765) 8.504 10.349 ( 1.270 -5.508 0.162) 5.655 16.022 ( -5.807 1.052 -2.075) 6.256 16.162 ( -0.455 0.354 -1.409) 1.522 16.571 ( 1.245 1.637 -0.804) 2.208 17.273 ( 7.459 -8.043 12.509) 16.637 17.540 ( 1.520 -2.082 -4.192) 4.921 18.132 ( -8.646 9.200 -7.167) 14.518 ======================= Grid point 410 (230/294) ======================= q-point: (-0.50 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.291 ( -5.471 -7.956 -2.992) 10.109 2.514 ( 3.696 9.192 6.575) 11.891 2.914 ( -10.339 -7.106 5.223) 13.589 3.555 ( 2.943 3.409 -4.189) 6.151 3.599 ( 4.381 -1.309 -5.467) 7.127 4.262 ( 3.660 4.034 -5.352) 7.636 5.055 ( 8.923 -4.622 12.957) 16.397 5.295 ( 1.525 -8.203 -3.461) 9.033 5.539 ( -8.057 5.667 -1.990) 10.049 6.783 ( -1.536 3.593 -3.907) 5.526 7.061 ( 0.086 -5.916 -0.159) 5.919 7.110 ( -1.345 6.892 6.382) 9.488 7.760 ( -3.908 3.649 0.374) 5.360 8.126 ( -4.511 -1.002 -3.006) 5.513 8.650 ( -9.644 -7.160 12.046) 17.012 9.105 ( 12.849 6.696 -10.926) 18.146 10.098 ( 2.426 4.586 -0.014) 5.188 10.305 ( 1.586 -7.489 -0.965) 7.716 15.936 ( -4.652 1.146 0.816) 4.860 16.187 ( 1.400 2.560 1.172) 3.144 16.616 ( 2.711 2.601 -2.312) 4.411 17.376 ( 7.135 -11.548 6.359) 14.990 17.447 ( -1.191 -5.988 -5.666) 8.329 18.093 ( -8.507 14.633 1.510) 16.993 ======================= Grid point 411 (231/294) ======================= q-point: (-0.42 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.102 ( -2.040 -14.130 1.211) 14.328 2.541 ( -13.071 -10.005 11.161) 19.888 2.842 ( 3.317 11.535 -0.359) 12.008 3.618 ( -0.612 5.272 -2.969) 6.082 3.643 ( 4.785 2.159 1.300) 5.408 4.310 ( 5.120 0.334 -15.090) 15.938 5.182 ( 1.876 -4.395 -3.483) 5.913 5.247 ( 7.526 -8.582 8.753) 14.384 5.472 ( -6.797 7.854 0.353) 10.393 6.764 ( -2.380 3.200 -3.322) 5.191 6.996 ( -3.523 -5.347 7.485) 9.850 7.180 ( 0.173 3.348 2.233) 4.028 7.773 ( -1.124 5.451 3.973) 6.838 8.045 ( -3.241 -0.779 0.581) 3.383 8.529 ( -7.051 -3.745 12.195) 14.576 9.277 ( 9.233 3.916 -12.434) 15.974 10.156 ( 2.567 2.907 -5.094) 6.403 10.254 ( 0.874 -5.545 -1.620) 5.843 15.899 ( -1.698 -0.738 3.238) 3.730 16.269 ( 1.016 6.519 4.285) 7.868 16.672 ( 3.366 1.539 -4.216) 5.610 17.262 ( 1.414 -10.539 -10.872) 15.208 17.460 ( 1.857 -4.741 6.844) 8.530 18.121 ( -7.450 12.662 7.276) 16.394 ======================= Grid point 412 (232/294) ======================= q-point: (-0.33 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.994 ( 5.912 -18.889 6.418) 20.807 2.219 ( -14.328 -16.863 8.527) 23.714 3.042 ( 1.816 15.762 1.062) 15.902 3.603 ( -3.418 6.062 -4.317) 8.189 3.807 ( 4.767 6.421 6.279) 10.167 4.211 ( 2.350 -9.648 -21.479) 23.664 5.148 ( 1.167 -0.490 -2.028) 2.391 5.303 ( -1.908 0.690 -2.168) 2.969 5.529 ( 3.878 4.973 8.922) 10.926 6.721 ( -1.494 0.171 -5.219) 5.432 6.937 ( -4.943 -5.004 13.928) 15.604 7.216 ( 0.673 1.065 0.667) 1.425 7.869 ( 1.864 3.968 7.688) 8.851 8.001 ( -1.916 -0.073 1.553) 2.467 8.499 ( -4.147 1.654 11.922) 12.731 9.319 ( 4.107 -2.200 -13.278) 14.072 10.184 ( -3.249 6.574 -5.834) 9.371 10.216 ( 5.793 -5.310 -4.320) 8.968 15.898 ( 0.303 -2.922 5.566) 6.294 16.388 ( -0.478 8.809 6.838) 11.162 16.683 ( 2.287 -1.894 -7.308) 7.889 17.174 ( 4.872 -4.713 -9.393) 11.583 17.446 ( -2.235 -1.231 -0.971) 2.730 18.179 ( -5.134 7.565 14.469) 17.116 ======================= Grid point 413 (233/294) ======================= q-point: (-0.25 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.861 ( -10.483 -18.954 5.782) 22.419 2.038 ( 14.288 -20.944 10.792) 27.555 3.183 ( -3.158 12.586 2.069) 13.140 3.586 ( -4.096 8.028 -3.409) 9.635 3.846 ( 1.299 -14.346 -15.446) 21.120 4.110 ( 2.090 8.023 0.251) 8.294 5.177 ( 0.369 4.709 -1.618) 4.992 5.220 ( -5.475 3.426 -6.830) 9.400 5.732 ( 6.546 3.889 9.602) 12.254 6.662 ( 0.107 -1.486 -7.083) 7.238 6.919 ( -2.961 -4.310 17.153) 17.933 7.234 ( 0.452 0.232 0.328) 0.605 7.887 ( -4.306 -3.967 6.372) 8.653 8.096 ( 8.307 2.870 4.514) 9.881 8.562 ( -2.610 7.256 11.994) 14.258 9.224 ( 0.704 -7.336 -13.841) 15.681 10.113 ( -6.254 5.263 -6.268) 10.300 10.273 ( 5.405 0.078 -4.726) 7.180 15.915 ( 1.185 -4.461 7.251) 8.596 16.460 ( -2.719 1.856 4.340) 5.448 16.668 ( 1.911 3.308 -5.924) 7.049 17.179 ( 2.655 -1.074 -9.039) 9.482 17.380 ( -0.990 2.645 -7.603) 8.110 18.278 ( -2.018 3.605 19.953) 20.376 ======================= Grid point 414 (234/294) ======================= q-point: (-0.17 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.579 ( -2.601 -18.073 -0.212) 18.261 2.212 ( 20.688 -21.147 14.436) 32.918 3.192 ( -5.998 2.678 -0.859) 6.625 3.477 ( -4.825 -6.689 -14.007) 16.255 3.673 ( 0.512 -1.463 -4.583) 4.838 4.276 ( -2.779 16.750 7.461) 18.546 5.111 ( -6.793 8.173 -8.832) 13.818 5.241 ( 3.327 1.945 -1.813) 4.259 5.892 ( 1.874 2.378 7.322) 7.923 6.618 ( 1.586 -2.507 -6.259) 6.926 6.978 ( 1.722 -0.518 14.246) 14.359 7.240 ( -0.192 0.134 0.496) 0.548 7.804 ( -3.015 -6.058 4.745) 8.264 8.301 ( 10.307 -1.456 6.219) 12.126 8.678 ( -1.974 8.386 10.258) 13.395 9.061 ( -1.196 -6.350 -12.209) 13.814 10.008 ( -7.463 5.925 -7.599) 12.188 10.322 ( 2.016 1.229 -2.123) 3.176 15.936 ( 1.353 -4.733 6.823) 8.413 16.414 ( 0.243 -5.439 -1.481) 5.643 16.722 ( -2.491 10.069 -0.964) 10.418 17.075 ( -5.638 0.518 -10.273) 11.730 17.411 ( 5.442 1.620 -6.687) 8.773 18.423 ( 0.981 3.348 18.828) 19.148 ======================= Grid point 480 (235/294) ======================= q-point: ( 0.25 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 292 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.623 ( -0.000 0.000 28.171) 28.171 1.623 ( -0.000 0.000 28.171) 28.171 2.324 ( -0.000 0.000 39.017) 39.017 3.772 ( 0.000 -0.000 -9.820) 9.820 3.772 ( 0.000 -0.000 -9.820) 9.820 5.022 ( 0.000 -0.000 -6.934) 6.934 5.022 ( 0.000 -0.000 -6.934) 6.934 5.176 ( 0.000 -0.000 -17.611) 17.611 6.555 ( 0.000 -0.000 -7.530) 7.530 6.593 ( -0.000 0.000 3.810) 3.810 6.593 ( 0.000 0.000 3.810) 3.810 7.637 ( -0.000 0.000 2.984) 2.984 8.027 ( -0.000 0.000 14.256) 14.256 8.128 ( -0.000 0.000 9.785) 9.785 8.128 ( -0.000 0.000 9.785) 9.785 9.797 ( 0.000 -0.000 -8.111) 8.111 9.937 ( 0.000 -0.000 -14.095) 14.095 9.937 ( 0.000 -0.000 -14.095) 14.095 16.041 ( -0.000 0.000 8.071) 8.071 16.041 ( -0.000 0.000 8.071) 8.071 16.871 ( 0.000 -0.000 -4.685) 4.685 17.043 ( 0.000 -0.000 -7.343) 7.343 17.043 ( 0.000 -0.000 -7.343) 7.343 19.096 ( -0.000 0.000 4.558) 4.558 ======================= Grid point 481 (236/294) ======================= q-point: ( 0.33 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.609 ( -7.185 -0.787 27.123) 28.069 2.021 ( 14.387 1.628 26.638) 30.319 2.670 ( 7.279 6.870 34.970) 36.374 3.613 ( -5.558 -1.354 -10.289) 11.772 3.778 ( 1.678 0.729 -9.343) 9.520 4.917 ( -2.557 -1.783 -7.277) 7.916 4.947 ( -6.042 -5.663 -16.288) 18.272 5.112 ( 5.023 4.095 -8.154) 10.416 6.408 ( -5.087 -5.870 -4.951) 9.211 6.527 ( -6.587 2.481 5.122) 8.705 6.769 ( 8.214 1.685 0.247) 8.388 7.601 ( -4.988 -1.845 3.997) 6.653 7.970 ( -3.629 -2.755 5.152) 6.878 8.246 ( 6.656 -4.087 14.739) 16.680 8.362 ( 4.750 11.423 11.665) 17.003 9.621 ( -10.091 0.221 -9.736) 14.023 9.695 ( -3.108 -10.015 -16.318) 19.396 10.073 ( 8.614 6.219 -10.444) 14.899 15.960 ( -5.081 -2.868 7.241) 9.299 16.241 ( 6.462 4.369 9.052) 11.949 16.819 ( -2.565 -3.484 -5.613) 7.086 16.866 ( -2.709 -2.775 -7.344) 8.305 17.198 ( 9.375 6.851 -6.887) 13.500 19.044 ( -6.779 -3.025 3.974) 8.421 ======================= Grid point 482 (237/294) ======================= q-point: ( 0.42 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.721 ( 0.961 2.978 22.214) 22.433 2.448 ( 17.256 -0.793 23.628) 29.269 3.059 ( 5.435 9.331 26.177) 28.317 3.443 ( -6.419 0.158 -10.425) 12.244 3.738 ( -0.746 0.345 -4.229) 4.308 4.619 ( -10.067 -10.398 -17.362) 22.603 4.811 ( -3.657 -1.227 -5.828) 6.989 5.225 ( 8.042 4.548 -7.738) 12.051 6.223 ( -7.544 -4.316 -4.960) 10.008 6.487 ( -4.469 1.036 7.399) 8.706 6.900 ( 6.172 1.030 -0.401) 6.271 7.515 ( -5.669 -1.571 4.606) 7.471 7.953 ( 1.356 -0.602 -1.420) 2.053 8.392 ( 4.333 -2.902 13.213) 14.205 8.631 ( 5.094 11.838 11.019) 16.956 9.378 ( -6.081 -10.720 -10.105) 15.937 9.450 ( -6.958 -1.150 -14.154) 15.814 10.196 ( 6.247 4.229 -6.734) 10.112 15.913 ( -2.804 -0.919 5.754) 6.467 16.443 ( 5.053 5.323 9.189) 11.760 16.662 ( -2.672 -6.753 -8.445) 11.139 16.801 ( -0.367 -1.466 -4.472) 4.720 17.371 ( 7.709 5.206 -4.239) 10.222 18.886 ( -9.485 -3.187 0.585) 10.023 ======================= Grid point 483 (238/294) ======================= q-point: ( 0.50 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.954 ( 7.993 4.889 15.465) 18.082 2.847 ( 16.056 -3.004 18.578) 24.738 3.242 ( -9.474 7.169 -1.467) 11.971 3.289 ( -2.038 0.086 -1.941) 2.816 3.787 ( 3.619 2.814 10.208) 11.191 4.234 ( -9.457 -11.346 -16.463) 22.118 4.706 ( -4.666 -0.124 -2.130) 5.131 5.347 ( 6.847 2.402 -6.244) 9.573 6.016 ( -8.911 -2.848 -5.218) 10.712 6.492 ( -1.360 0.236 7.847) 7.967 6.998 ( 4.555 1.521 -0.607) 4.841 7.448 ( -3.609 -0.403 1.781) 4.045 7.964 ( 2.177 0.216 -4.903) 5.369 8.487 ( -0.309 2.024 7.250) 7.534 8.830 ( 4.307 -2.595 -2.976) 5.843 9.157 ( -2.462 -2.490 1.320) 3.742 9.287 ( -4.594 -0.067 -5.775) 7.379 10.279 ( 3.415 2.053 -2.743) 4.838 15.925 ( 0.384 1.831 3.716) 4.161 16.495 ( -2.108 -6.256 -7.724) 10.160 16.616 ( 0.011 6.972 4.737) 8.429 16.780 ( 4.432 -3.984 -0.056) 5.960 17.484 ( 2.389 1.332 1.491) 3.115 18.693 ( -7.916 -1.669 -6.510) 10.384 ======================= Grid point 484 (239/294) ======================= q-point: ( 0.58 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.257 ( 12.697 6.023 8.748) 16.554 3.006 ( -12.582 0.996 -8.827) 15.401 3.105 ( 5.157 -6.840 4.485) 9.669 3.254 ( -4.285 3.419 -0.142) 5.483 3.851 ( 0.786 -10.061 -5.199) 11.352 4.049 ( 1.188 1.683 8.418) 8.666 4.658 ( -3.452 5.231 4.063) 7.469 5.399 ( 0.736 -1.734 -0.857) 2.069 5.829 ( -5.202 -1.040 -8.349) 9.892 6.537 ( 0.646 0.181 7.296) 7.327 7.078 ( 3.486 2.455 -1.498) 4.519 7.398 ( -2.509 0.504 -3.002) 3.944 7.964 ( 1.316 0.791 -6.016) 6.209 8.480 ( -3.425 -1.500 -5.817) 6.915 8.674 ( -0.863 -9.639 -11.703) 15.186 9.214 ( -1.871 -0.735 3.980) 4.459 9.334 ( 5.997 8.893 14.001) 17.637 10.316 ( 0.717 -0.374 1.073) 1.344 16.008 ( 3.980 4.521 1.223) 6.146 16.350 ( -2.059 -5.792 -8.738) 10.683 16.639 ( -2.964 3.799 -0.766) 4.879 16.900 ( 7.542 -0.835 8.068) 11.076 17.483 ( -5.193 -2.979 8.294) 10.229 18.528 ( -2.894 0.526 -15.167) 15.450 ======================= Grid point 485 (240/294) ======================= q-point: ( 0.67 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.587 ( 13.767 7.175 2.802) 15.775 2.682 ( -18.907 2.210 -11.448) 22.213 2.926 ( -5.390 -18.319 -11.855) 22.476 3.284 ( -0.697 5.919 5.173) 7.892 3.820 ( 6.992 -4.018 -4.799) 9.384 4.129 ( -1.320 -4.820 16.182) 16.936 4.763 ( 0.590 12.343 8.392) 14.937 5.324 ( -6.177 -4.062 4.074) 8.441 5.741 ( 2.544 -0.869 -11.612) 11.919 6.595 ( 0.697 0.132 6.885) 6.922 7.137 ( 2.071 3.229 -4.392) 5.832 7.319 ( -3.620 0.216 -7.566) 8.390 7.964 ( 1.745 1.417 -4.583) 5.105 8.279 ( -0.915 -12.897 -15.058) 19.847 8.579 ( -2.798 4.678 -7.752) 9.476 9.225 ( 0.468 -4.485 10.355) 11.294 9.625 ( 6.049 11.155 13.724) 18.692 10.312 ( -0.939 -2.943 3.813) 4.908 16.148 ( 6.071 3.424 -2.816) 7.518 16.215 ( -1.209 -1.903 -7.733) 8.055 16.624 ( -2.024 2.147 0.770) 3.050 17.072 ( 6.530 0.263 9.340) 11.399 17.370 ( -10.033 -4.831 11.889) 16.290 18.420 ( 1.422 1.705 -20.556) 20.675 ======================= Grid point 486 (241/294) ======================= q-point: (-0.25 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.279 ( -22.363 1.199 -9.509) 24.331 2.502 ( -9.139 -20.825 -14.780) 27.123 2.919 ( 13.712 7.189 -1.529) 15.558 3.405 ( 3.375 7.299 6.180) 10.142 3.882 ( 5.392 0.304 -5.529) 7.729 4.106 ( -6.364 -8.593 19.827) 22.527 4.978 ( 3.457 13.118 7.379) 15.442 5.222 ( -3.852 -2.812 4.356) 6.459 5.726 ( 5.572 -2.817 -11.011) 12.658 6.640 ( -0.381 -0.306 6.851) 6.868 7.102 ( -4.191 2.719 -16.264) 17.014 7.235 ( -0.453 -0.979 -0.924) 1.420 7.985 ( -1.338 2.734 -3.199) 4.416 8.090 ( 4.622 -10.338 -12.808) 17.096 8.544 ( -0.377 5.006 -9.927) 11.124 9.248 ( -1.869 -4.409 13.163) 14.007 9.903 ( 4.896 10.879 11.235) 16.388 10.283 ( -0.567 -5.154 4.774) 7.049 16.054 ( -2.803 -4.494 -8.615) 10.113 16.349 ( 8.392 7.172 -5.164) 12.188 16.623 ( -1.937 0.813 5.300) 5.701 17.196 ( 0.748 -7.078 8.709) 11.247 17.274 ( -3.610 3.906 11.641) 12.799 18.344 ( 2.522 1.905 -21.683) 21.913 ======================= Grid point 493 (242/294) ======================= q-point: ( 0.33 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.802 ( 4.047 -6.345 27.044) 28.072 2.087 ( -6.203 2.322 28.112) 28.882 2.926 ( 1.640 14.304 31.779) 34.888 3.570 ( 1.837 -2.740 -10.746) 11.241 3.715 ( -0.598 2.888 -10.730) 11.128 4.807 ( -1.250 -8.918 -12.484) 15.393 4.960 ( -2.378 -1.048 -10.161) 10.488 5.006 ( 2.714 3.906 -8.650) 9.872 6.348 ( -1.049 -8.923 -4.174) 9.906 6.604 ( 4.733 0.264 1.082) 4.862 6.756 ( -3.453 6.325 2.612) 7.665 7.634 ( 0.741 -1.894 2.162) 2.969 8.069 ( 2.619 -8.686 11.749) 14.844 8.120 ( -5.096 -6.644 10.312) 13.283 8.543 ( 2.758 14.034 11.212) 18.174 9.429 ( -0.134 -14.986 -11.435) 18.851 9.814 ( -3.882 4.548 -10.289) 11.900 9.937 ( 3.056 9.087 -14.575) 17.446 16.009 ( 0.099 -6.347 8.340) 10.481 16.288 ( 0.588 6.907 8.812) 11.212 16.804 ( -2.043 -1.925 -5.784) 6.429 16.851 ( -0.994 -0.732 -7.572) 7.672 17.116 ( 1.633 8.829 -7.906) 11.963 19.058 ( 0.602 -9.338 4.346) 10.317 ======================= Grid point 494 (243/294) ======================= q-point: ( 0.42 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.918 ( -3.406 -0.475 24.909) 25.145 2.299 ( 11.292 -4.768 27.069) 29.715 3.269 ( 2.031 11.436 17.820) 21.271 3.494 ( -4.136 4.894 -6.299) 8.985 3.689 ( 2.654 1.412 -8.033) 8.577 4.550 ( -7.068 -12.031 -14.354) 20.018 4.837 ( -4.061 -0.480 -4.846) 6.341 5.085 ( 7.388 3.861 -9.362) 12.536 6.205 ( -2.853 -7.818 -4.855) 9.635 6.636 ( -3.342 2.041 3.914) 5.536 6.824 ( 3.657 3.304 1.295) 5.096 7.610 ( -3.763 -1.901 4.002) 5.813 7.954 ( -4.148 -5.446 4.815) 8.369 8.247 ( 10.783 -8.810 12.969) 19.029 8.733 ( 2.772 3.166 0.784) 4.281 9.242 ( -2.385 -5.521 -2.764) 6.618 9.622 ( -12.483 6.241 -11.677) 18.198 10.072 ( 8.668 6.671 -10.478) 15.147 15.981 ( -2.413 -3.880 8.053) 9.259 16.462 ( 5.482 5.358 8.673) 11.575 16.637 ( -6.125 -4.073 -8.716) 11.405 16.795 ( -2.568 1.424 -3.839) 4.833 17.254 ( 8.512 7.619 -7.663) 13.756 18.945 ( -4.467 -10.997 2.568) 12.144 ======================= Grid point 495 (244/294) ======================= q-point: ( 0.50 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.033 ( 0.167 1.661 20.662) 20.729 2.637 ( 15.975 -6.551 22.431) 28.306 3.286 ( -3.305 -0.256 -12.695) 13.121 3.482 ( -7.497 8.698 0.156) 11.484 3.799 ( 5.235 3.812 7.528) 9.931 4.202 ( -9.972 -9.931 -11.691) 18.296 4.767 ( -2.724 1.353 0.238) 3.051 5.199 ( 8.227 3.414 -8.984) 12.651 6.045 ( -4.371 -6.406 -5.364) 9.429 6.613 ( -4.928 1.565 7.323) 8.965 6.929 ( 4.988 2.301 -0.344) 5.504 7.531 ( -5.588 -2.675 4.604) 7.719 7.903 ( 0.991 -2.521 -2.192) 3.484 8.427 ( 9.731 -7.244 12.542) 17.449 8.639 ( 0.444 -14.713 -14.368) 20.570 9.286 ( -1.940 12.613 10.907) 16.787 9.409 ( -10.377 4.511 -9.707) 14.908 10.202 ( 6.278 4.759 -6.390) 10.144 15.970 ( -1.178 -1.019 6.628) 6.808 16.448 ( -4.373 -5.097 -8.644) 10.946 16.654 ( 6.472 0.300 5.415) 8.444 16.752 ( -3.364 6.073 0.418) 6.955 17.416 ( 7.464 4.895 -4.644) 10.062 18.741 ( -7.298 -10.556 -2.049) 12.996 ======================= Grid point 496 (245/294) ======================= q-point: ( 0.58 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.211 ( 5.962 2.371 14.207) 15.588 2.925 ( 10.483 -7.588 13.349) 18.592 3.104 ( -6.165 -1.454 -16.681) 17.843 3.415 ( -7.539 6.198 -1.032) 9.814 3.751 ( -5.346 -10.929 -5.311) 13.276 4.087 ( 1.465 2.378 5.572) 6.233 4.792 ( -1.419 7.713 5.806) 9.757 5.300 ( 6.465 1.255 -6.632) 9.346 5.868 ( -6.245 -5.313 -4.809) 9.505 6.605 ( -2.645 0.814 7.533) 8.025 7.026 ( 4.433 2.555 -1.580) 5.355 7.438 ( -4.498 -2.465 0.571) 5.161 7.889 ( 2.447 -2.369 -5.309) 6.308 8.354 ( -2.428 -14.092 -13.818) 19.885 8.605 ( 5.785 -2.157 6.664) 9.085 9.225 ( -5.959 0.107 -5.079) 7.831 9.509 ( 1.248 13.904 13.003) 19.077 10.290 ( 3.083 2.424 -2.235) 4.514 16.006 ( 1.471 1.212 3.737) 4.195 16.286 ( -2.860 -5.167 -7.893) 9.858 16.663 ( 0.225 -2.299 -2.939) 3.738 16.899 ( 3.067 8.871 10.269) 13.912 17.524 ( 2.725 1.078 1.272) 3.195 18.493 ( -6.323 -8.302 -9.751) 14.282 ======================= Grid point 497 (246/294) ======================= q-point: ( 0.67 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.448 ( 11.247 3.318 6.743) 13.527 2.796 ( -7.851 -11.868 -14.767) 20.507 2.929 ( -12.054 -0.475 -5.592) 13.296 3.390 ( -1.900 5.419 3.523) 6.737 3.646 ( 4.872 -5.998 1.130) 7.809 4.160 ( 2.002 -3.049 8.772) 9.501 4.927 ( 0.092 12.716 7.138) 14.583 5.344 ( 1.754 -2.000 -1.492) 3.050 5.685 ( -5.337 -4.510 -5.937) 9.169 6.633 ( -0.026 0.765 5.794) 5.845 7.103 ( 3.047 3.127 -3.631) 5.679 7.330 ( -4.049 -2.890 -5.167) 7.172 7.866 ( 3.365 -4.733 -6.763) 8.915 8.132 ( -2.450 -6.365 -9.884) 12.009 8.655 ( -3.237 5.178 -4.086) 7.347 9.171 ( 3.288 -7.038 6.752) 10.292 9.751 ( 3.213 12.249 11.701) 17.242 10.321 ( -0.244 -0.561 1.425) 1.550 16.068 ( 2.759 -0.640 -3.120) 4.214 16.173 ( -0.188 -1.136 -4.178) 4.333 16.641 ( 0.723 -1.074 -0.651) 1.449 17.090 ( 2.404 7.222 10.274) 12.786 17.529 ( -4.753 -2.702 8.520) 10.123 18.280 ( -0.802 -3.993 -18.468) 18.911 ======================= Grid point 498 (247/294) ======================= q-point: (-0.25 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.411 ( -11.175 -15.841 -12.457) 23.043 2.592 ( -17.475 3.233 -11.767) 21.315 2.744 ( 11.917 4.772 3.066) 13.198 3.471 ( 1.251 5.862 5.562) 8.177 3.722 ( 7.539 -2.502 -2.276) 8.263 4.213 ( 0.014 -5.930 16.090) 17.148 5.092 ( 0.533 10.443 4.654) 11.445 5.303 ( -3.893 -2.437 4.790) 6.636 5.557 ( 1.505 -4.242 -10.489) 11.414 6.680 ( 0.532 0.959 4.660) 4.787 7.106 ( -3.374 2.925 -12.531) 13.303 7.214 ( -0.386 -3.020 -1.911) 3.595 7.847 ( 5.559 -4.512 -7.570) 10.420 8.030 ( -2.308 1.343 -4.565) 5.289 8.578 ( -5.181 5.284 -10.305) 12.687 9.245 ( 4.939 -6.897 12.747) 15.312 9.986 ( 4.599 9.019 9.467) 13.861 10.290 ( -2.537 -3.926 3.693) 5.957 15.998 ( -1.364 -3.929 -7.166) 8.285 16.250 ( 6.605 4.467 -3.337) 8.644 16.658 ( 1.228 -0.893 3.090) 3.443 17.207 ( -1.454 -0.398 9.594) 9.712 17.457 ( -6.309 0.215 9.113) 11.086 18.174 ( 3.881 1.170 -20.399) 20.798 ======================= Grid point 505 (248/294) ======================= q-point: ( 0.33 0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.844 ( 2.142 -2.972 25.669) 25.929 2.470 ( -14.250 2.157 25.225) 29.052 3.204 ( 0.996 9.641 19.057) 21.380 3.414 ( 5.472 -0.894 -8.313) 9.992 3.706 ( -1.635 2.428 -4.565) 5.423 4.620 ( 4.551 -9.004 -14.329) 17.524 4.820 ( 5.514 0.038 -8.621) 10.234 5.076 ( -8.128 3.562 -8.177) 12.067 6.216 ( 3.293 -8.913 -4.508) 10.517 6.549 ( 3.236 0.188 5.343) 6.249 6.887 ( -3.391 5.393 0.138) 6.372 7.582 ( 4.420 -3.818 5.260) 7.860 7.970 ( 3.185 -3.470 2.691) 5.425 8.291 ( -11.495 -11.640 12.504) 20.590 8.652 ( -0.026 5.016 4.191) 6.536 9.290 ( -0.326 -5.096 -2.505) 5.688 9.648 ( 14.292 7.632 -13.815) 21.292 10.049 ( -9.608 5.837 -10.242) 15.207 15.969 ( 2.969 -4.766 7.583) 9.436 16.423 ( -3.629 2.782 8.047) 9.255 16.730 ( 4.325 -0.598 -10.816) 11.664 16.813 ( 1.306 4.376 -2.034) 4.999 17.225 ( -9.086 6.854 -7.685) 13.733 18.917 ( 5.587 -12.998 3.749) 14.636 ======================= Grid point 506 (249/294) ======================= q-point: ( 0.42 0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.034 ( 4.425 -2.945 25.139) 25.695 2.423 ( -8.475 -2.433 27.068) 28.468 3.298 ( 2.421 -1.151 -8.935) 9.328 3.565 ( 7.459 4.115 -0.625) 8.541 3.695 ( -4.664 10.803 4.994) 12.782 4.460 ( -3.205 -9.111 -9.891) 13.824 4.852 ( 1.409 0.449 -6.408) 6.576 4.967 ( 0.218 3.141 -8.833) 9.377 6.126 ( -0.321 -8.601 -4.055) 9.515 6.644 ( 3.539 0.830 3.920) 5.346 6.888 ( -2.828 5.064 0.485) 5.820 7.638 ( 1.399 -1.603 4.068) 4.590 7.989 ( -0.628 -13.286 8.029) 15.536 8.117 ( -0.352 -6.227 9.588) 11.438 8.616 ( 0.073 -9.470 -8.310) 12.599 9.322 ( -0.133 7.622 8.283) 11.257 9.800 ( -4.769 6.772 -8.497) 11.866 9.926 ( 4.314 8.370 -14.462) 17.258 16.002 ( 0.845 -5.156 8.650) 10.105 16.467 ( 1.511 -0.275 3.793) 4.092 16.650 ( -3.508 -0.702 -8.046) 8.805 16.868 ( -2.213 6.855 -0.558) 7.225 17.180 ( 1.975 8.268 -8.718) 12.176 18.859 ( 1.253 -16.004 3.741) 16.483 ======================= Grid point 507 (250/294) ======================= q-point: ( 0.50 0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.191 ( -1.239 -1.159 21.581) 21.647 2.524 ( 6.211 -5.590 25.691) 27.016 3.218 ( -0.535 -2.362 -16.430) 16.608 3.585 ( -0.302 1.542 -8.100) 8.252 3.818 ( 0.209 2.595 5.511) 6.095 4.254 ( -8.703 -1.028 -3.802) 9.553 4.834 ( -1.435 3.317 2.937) 4.657 5.031 ( 8.346 3.631 -10.881) 14.186 6.002 ( -2.215 -7.242 -4.134) 8.628 6.712 ( -0.067 0.218 5.483) 5.488 6.904 ( 0.262 3.778 -0.679) 3.847 7.624 ( -4.532 -3.803 6.293) 8.637 7.847 ( -1.214 -9.281 -0.816) 9.396 8.245 ( 11.106 -7.699 12.898) 18.681 8.425 ( -1.672 -12.524 -10.727) 16.575 9.474 ( 0.626 8.402 7.584) 11.336 9.619 ( -13.514 9.658 -8.618) 18.713 10.087 ( 8.977 7.767 -8.539) 14.623 16.013 ( -0.569 -3.468 8.441) 9.143 16.402 ( -2.537 -6.609 -9.019) 11.466 16.615 ( 0.198 1.350 0.711) 1.539 16.905 ( -2.802 10.205 4.947) 11.682 17.300 ( 7.756 6.887 -7.674) 12.903 18.696 ( -3.370 -16.710 0.979) 17.075 ======================= Grid point 508 (251/294) ======================= q-point: ( 0.58 0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.269 ( -0.563 -1.613 16.795) 16.882 2.776 ( 11.092 -5.339 19.323) 22.911 3.037 ( -3.506 -4.378 -19.634) 20.419 3.540 ( -2.789 2.695 -4.354) 5.831 3.734 ( -5.428 -8.124 -2.369) 10.054 4.153 ( -4.802 3.749 1.063) 6.184 4.926 ( 0.329 8.973 8.412) 12.304 5.149 ( 8.415 3.706 -9.794) 13.434 5.864 ( -3.583 -6.349 -3.908) 8.271 6.710 ( -3.693 -1.176 7.371) 8.328 6.966 ( 4.008 2.799 -2.503) 5.492 7.498 ( -6.153 -8.010 3.615) 10.728 7.777 ( 2.070 -4.179 -6.359) 7.886 8.221 ( -3.006 -7.729 -7.262) 11.023 8.462 ( 12.424 -6.990 13.528) 19.653 9.357 ( -11.828 3.871 -11.365) 16.854 9.685 ( 0.754 11.516 8.876) 14.560 10.239 ( 5.361 6.264 -3.883) 9.113 16.023 ( -0.353 -1.928 5.626) 5.958 16.239 ( -2.702 -5.276 -7.695) 9.713 16.612 ( 0.265 -1.378 -1.882) 2.347 17.047 ( 0.187 12.370 10.205) 16.037 17.446 ( 7.413 4.292 -4.851) 9.844 18.445 ( -6.324 -15.662 -4.068) 17.374 ======================= Grid point 509 (252/294) ======================= q-point: ( 0.67 0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.369 ( 5.032 -1.801 9.681) 11.058 2.744 ( -7.879 -7.544 -15.145) 18.664 2.989 ( 3.038 -1.814 4.478) 5.707 3.479 ( -3.570 1.562 -2.521) 4.641 3.598 ( -2.095 -3.344 4.045) 5.651 4.142 ( 0.389 -0.735 2.829) 2.949 5.084 ( 0.494 10.338 7.526) 12.797 5.250 ( 5.786 3.080 -6.937) 9.544 5.702 ( -5.631 -6.911 -3.799) 9.691 6.683 ( -2.095 -1.828 6.505) 7.074 7.046 ( 4.407 2.694 -3.948) 6.501 7.332 ( -4.702 -7.522 -2.719) 9.278 7.736 ( 1.532 -2.706 -5.739) 6.528 8.100 ( -2.383 -1.402 -3.011) 4.088 8.664 ( 7.197 -1.969 8.308) 11.167 9.148 ( -6.692 -0.780 -6.225) 9.173 9.863 ( 2.915 8.506 6.982) 11.384 10.330 ( 1.108 3.302 -0.047) 3.483 16.011 ( -0.272 -2.615 -2.974) 3.969 16.150 ( -0.097 -1.401 -0.601) 1.527 16.598 ( 1.256 -1.500 -1.199) 2.295 17.235 ( -0.349 11.108 11.184) 15.767 17.561 ( 3.889 1.505 1.245) 4.352 18.158 ( -4.932 -11.759 -11.797) 17.371 ======================= Grid point 510 (253/294) ======================= q-point: (-0.25 0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.407 ( -9.417 -9.694 -7.416) 15.416 2.542 ( 8.521 2.028 -2.250) 9.043 2.889 ( -12.664 3.095 -4.975) 13.953 3.506 ( 3.497 1.200 4.158) 5.564 3.608 ( 2.142 -2.147 3.290) 4.475 4.198 ( 4.221 -2.644 8.358) 9.729 5.198 ( -0.115 3.032 3.856) 4.907 5.332 ( 2.527 6.367 -0.986) 6.921 5.491 ( -6.543 -8.453 -6.454) 12.487 6.698 ( 0.907 0.205 4.300) 4.400 7.104 ( 1.269 3.947 -7.332) 8.423 7.175 ( -2.654 -5.861 -2.809) 7.020 7.722 ( 2.333 0.371 -4.346) 4.947 8.060 ( -1.836 1.869 -0.947) 2.786 8.681 ( -6.993 5.108 -8.228) 11.945 9.126 ( 7.769 -7.804 9.696) 14.672 10.027 ( 4.275 4.994 5.209) 8.387 10.334 ( -2.900 -0.808 2.355) 3.822 15.947 ( -0.824 -1.709 -5.260) 5.592 16.183 ( 3.394 1.403 -0.456) 3.701 16.618 ( 2.863 -1.482 1.271) 3.465 17.340 ( -4.492 3.029 10.242) 11.586 17.580 ( -4.572 -2.991 4.839) 7.298 17.996 ( 5.003 1.336 -16.253) 17.058 ======================= Grid point 517 (254/294) ======================= q-point: ( 0.33 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.996 ( -3.587 1.462 21.022) 21.376 2.861 ( -13.419 -0.428 19.103) 23.349 3.166 ( 4.576 -5.343 -9.270) 11.637 3.354 ( 4.752 4.182 0.933) 6.399 3.824 ( -3.972 6.721 11.590) 13.974 4.318 ( 11.215 -4.908 -15.297) 19.592 4.702 ( 3.115 -1.925 -3.994) 5.419 5.214 ( -9.354 4.646 -8.851) 13.691 6.023 ( 6.011 -9.309 -3.241) 11.545 6.562 ( 1.376 1.373 7.898) 8.134 6.973 ( -2.322 3.448 -1.237) 4.337 7.494 ( 4.854 -4.753 5.707) 8.873 7.921 ( -0.322 -1.791 -4.356) 4.721 8.370 ( -6.135 -12.598 3.792) 14.516 8.753 ( -8.694 -2.691 2.627) 9.473 9.251 ( 6.900 1.205 -1.455) 7.154 9.429 ( 10.708 11.722 -4.405) 16.476 10.191 ( -7.304 4.391 -6.149) 10.509 15.933 ( 1.258 -3.140 5.876) 6.781 16.525 ( -3.493 -3.707 2.516) 5.681 16.571 ( 6.289 1.653 -8.796) 10.938 16.865 ( -0.010 8.643 2.585) 9.021 17.401 ( -8.874 4.972 -5.509) 11.568 18.687 ( 7.254 -13.777 0.151) 15.571 ======================= Grid point 518 (255/294) ======================= q-point: ( 0.42 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.115 ( 0.867 -0.771 23.581) 23.610 2.730 ( -11.943 -5.056 20.220) 24.022 3.138 ( 4.400 -3.976 -11.551) 12.984 3.454 ( 4.909 1.092 -4.986) 7.081 3.893 ( -2.999 5.220 5.149) 7.922 4.354 ( 5.107 0.462 -6.401) 8.202 4.740 ( 4.780 1.448 -4.087) 6.454 5.045 ( -8.590 3.398 -7.261) 11.750 5.994 ( 3.281 -9.091 -2.737) 10.045 6.648 ( 1.333 2.152 6.812) 7.267 6.966 ( -1.712 3.465 -1.878) 4.297 7.582 ( 5.964 -5.239 8.230) 11.434 7.860 ( 1.378 -9.332 -2.892) 9.867 8.164 ( -5.862 -10.295 4.126) 12.545 8.566 ( -7.956 -7.331 0.168) 10.819 9.392 ( 5.623 5.085 0.870) 7.631 9.713 ( 11.033 13.015 -3.966) 17.517 10.048 ( -10.521 6.610 -8.530) 15.071 15.971 ( 2.579 -4.530 7.480) 9.117 16.440 ( -1.335 -6.169 -3.354) 7.147 16.623 ( 2.685 2.631 -5.104) 6.339 16.984 ( -0.209 10.883 4.820) 11.904 17.260 ( -7.940 6.991 -8.754) 13.732 18.654 ( 5.501 -18.191 3.104) 19.257 ======================= Grid point 519 (256/294) ======================= q-point: ( 0.50 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.281 ( 2.910 -2.086 21.607) 21.902 2.639 ( -6.349 -6.755 21.693) 23.591 3.071 ( 1.594 -4.204 -15.250) 15.899 3.492 ( 4.058 -0.530 -6.769) 7.910 3.851 ( -2.744 -4.039 -2.301) 5.398 4.406 ( -4.185 8.860 -1.246) 9.877 4.833 ( 6.572 3.140 -4.875) 8.765 4.957 ( -2.098 5.421 -0.573) 5.841 5.926 ( 0.351 -7.826 -2.589) 8.251 6.728 ( 1.421 1.186 6.272) 6.539 6.950 ( -1.917 2.444 -2.933) 4.272 7.649 ( 1.088 -12.287 10.028) 15.897 7.734 ( 0.186 -6.931 -5.983) 9.158 8.104 ( 4.598 -6.764 8.082) 11.498 8.371 ( -6.913 -6.533 0.259) 9.515 9.523 ( 3.698 3.988 -0.802) 5.497 9.873 ( -9.786 8.117 -11.646) 17.242 9.989 ( 7.168 12.992 -0.019) 14.838 16.016 ( 1.915 -4.487 8.472) 9.776 16.312 ( -1.761 -7.338 -7.687) 10.772 16.649 ( -0.690 3.032 -2.260) 3.844 17.092 ( -3.273 10.557 5.827) 12.495 17.233 ( 2.478 8.451 -7.094) 11.308 18.544 ( 1.284 -19.943 2.269) 20.113 ======================= Grid point 520 (257/294) ======================= q-point: ( 0.58 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.372 ( -2.346 -4.640 15.527) 16.374 2.707 ( 5.761 -5.870 22.426) 23.887 2.921 ( -2.059 -4.404 -18.033) 18.677 3.500 ( 2.752 -1.663 -6.292) 7.066 3.738 ( -3.501 -4.974 -0.794) 6.134 4.338 ( -10.280 6.932 -2.129) 12.580 4.952 ( 9.219 3.104 -9.002) 13.254 5.071 ( 1.837 10.559 6.360) 12.462 5.825 ( -1.902 -7.175 -2.584) 7.860 6.779 ( -1.085 -1.786 7.716) 7.994 6.925 ( 0.687 1.330 -5.064) 5.281 7.477 ( -3.025 -16.155 1.222) 16.481 7.727 ( -0.713 2.400 -1.320) 2.830 8.202 ( -0.047 -6.839 3.333) 7.609 8.273 ( 7.339 -4.847 11.004) 14.087 9.504 ( -7.833 2.913 -9.177) 12.412 9.800 ( -0.925 8.537 -3.916) 9.438 10.210 ( 5.291 10.229 -0.077) 11.517 16.043 ( -0.320 -3.735 7.283) 8.191 16.172 ( -1.047 -5.413 -6.768) 8.729 16.624 ( -2.738 1.604 -2.553) 4.073 17.218 ( 2.062 11.419 6.023) 13.074 17.350 ( 4.317 7.210 -2.993) 8.921 18.340 ( -3.184 -19.783 -0.549) 20.046 ======================= Grid point 521 (258/294) ======================= q-point: ( 0.67 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.357 ( -0.854 -6.542 10.223) 12.167 2.713 ( -5.515 -3.408 -15.193) 16.519 2.918 ( 8.202 -3.170 15.837) 18.115 3.467 ( 0.968 -3.164 -6.287) 7.104 3.653 ( -3.573 -1.772 4.107) 5.725 4.224 ( -7.593 4.516 -1.170) 8.911 5.077 ( 8.161 1.969 -7.838) 11.486 5.245 ( 1.758 11.417 4.241) 12.306 5.684 ( -3.965 -8.221 -3.799) 9.886 6.746 ( -3.647 -4.417 8.306) 10.089 6.958 ( 4.919 1.396 -5.749) 7.694 7.304 ( -3.207 -8.975 -0.750) 9.561 7.720 ( -1.783 2.454 -0.900) 3.164 8.136 ( -2.936 -0.438 2.304) 3.758 8.500 ( 13.733 -6.761 14.311) 20.955 9.281 ( -12.640 3.343 -12.286) 17.942 9.890 ( 3.918 5.358 -1.211) 6.747 10.352 ( 1.862 5.978 0.494) 6.281 15.996 ( -2.564 -2.144 -1.817) 3.804 16.131 ( 1.167 -2.556 2.713) 3.906 16.580 ( -1.358 0.418 -2.101) 2.536 17.428 ( -0.536 11.902 10.836) 16.104 17.464 ( 8.349 4.360 -5.292) 10.803 18.064 ( -5.946 -17.240 -3.783) 18.625 ======================= Grid point 522 (259/294) ======================= q-point: ( 0.75 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.366 ( 3.664 -6.008 3.556) 7.884 2.507 ( -6.884 -0.266 -8.245) 10.744 3.029 ( -2.573 2.266 0.821) 3.526 3.452 ( 4.510 -3.784 2.853) 6.542 3.621 ( -2.516 -1.863 5.866) 6.649 4.185 ( -0.605 2.703 1.080) 2.973 5.141 ( 4.449 -2.419 -7.633) 9.161 5.391 ( 1.281 7.389 2.318) 7.849 5.494 ( -5.990 -5.879 -3.647) 9.151 6.723 ( -0.751 -1.401 7.298) 7.469 7.026 ( 5.686 1.437 -5.833) 8.272 7.177 ( -4.190 -3.912 -1.181) 5.852 7.718 ( -0.925 3.577 -0.584) 3.740 8.122 ( -2.288 2.298 2.979) 4.404 8.726 ( 6.981 -1.859 7.804) 10.635 9.046 ( -6.310 -1.376 -6.916) 9.463 10.000 ( 5.031 2.742 -0.716) 5.774 10.387 ( -2.016 0.516 0.882) 2.260 15.941 ( -1.698 1.355 -2.357) 3.205 16.153 ( 1.403 -1.072 2.410) 2.987 16.572 ( 1.410 -0.418 -0.201) 1.485 17.486 ( -2.382 2.325 3.179) 4.603 17.607 ( -1.712 -5.431 0.116) 5.695 17.870 ( 3.003 2.900 -3.443) 5.411 ======================= Grid point 530 (260/294) ======================= q-point: ( 0.33 0.58 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.230 ( -7.373 4.447 14.548) 16.905 2.899 ( 4.469 -12.865 -9.729) 16.737 3.135 ( -5.243 -3.118 6.421) 8.857 3.322 ( 4.765 6.676 -0.486) 8.216 3.947 ( 4.843 -0.547 -8.373) 9.688 4.100 ( 0.097 3.712 8.344) 9.133 4.640 ( 1.863 -0.366 2.839) 3.415 5.351 ( -6.944 4.307 -7.229) 10.910 5.810 ( 6.143 -9.305 -2.095) 11.345 6.616 ( 1.114 2.998 8.792) 9.356 7.020 ( -2.344 1.158 -3.421) 4.306 7.399 ( 3.722 -4.905 1.645) 6.373 7.884 ( -2.133 -2.594 -6.968) 7.735 8.352 ( -4.821 -8.719 -2.879) 10.370 8.811 ( 5.024 3.136 -11.275) 12.735 9.114 ( -1.286 -5.951 5.757) 8.380 9.486 ( 3.257 13.241 9.525) 16.633 10.299 ( -4.026 3.189 -1.780) 5.436 15.948 ( -2.500 -1.612 3.433) 4.543 16.395 ( 5.342 -1.370 -10.116) 11.522 16.566 ( -1.699 -2.531 1.284) 3.308 17.001 ( -1.011 10.359 7.188) 12.649 17.523 ( -3.095 1.487 0.350) 3.451 18.435 ( 4.838 -11.200 -7.608) 14.378 ======================= Grid point 531 (261/294) ======================= q-point: ( 0.42 0.58 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.270 ( -3.264 0.679 19.051) 19.340 2.793 ( 2.506 -10.557 -6.697) 12.751 3.060 ( -3.300 -4.253 4.425) 6.969 3.412 ( 0.247 3.693 -0.221) 3.708 3.905 ( 0.290 -5.335 -7.323) 9.065 4.234 ( 8.087 5.626 -3.151) 10.343 4.740 ( 1.585 6.864 7.850) 10.548 5.195 ( -9.921 4.190 -7.764) 13.277 5.816 ( 5.798 -9.677 -0.045) 11.281 6.715 ( 0.099 3.662 8.404) 9.167 6.985 ( -0.314 0.679 -4.463) 4.525 7.442 ( 6.680 -9.142 5.557) 12.612 7.765 ( -2.147 -5.060 -6.720) 8.682 8.176 ( -5.096 -6.432 -1.311) 8.310 8.693 ( -10.461 -6.067 5.269) 13.191 9.225 ( 12.531 2.901 -8.302) 15.309 9.731 ( 4.655 12.790 5.235) 14.583 10.227 ( -7.517 5.810 -3.371) 10.081 15.938 ( 1.013 -3.446 5.337) 6.433 16.350 ( 0.611 -5.740 -7.834) 9.731 16.577 ( 2.656 1.912 -1.211) 3.490 17.145 ( -0.577 12.009 8.236) 14.573 17.423 ( -9.169 5.297 -7.114) 12.758 18.378 ( 7.218 -17.758 -0.143) 19.169 ======================= Grid point 532 (262/294) ======================= q-point: ( 0.50 0.58 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.357 ( 0.223 -2.921 19.885) 20.100 2.707 ( 1.032 -7.662 -0.898) 7.783 2.976 ( -3.417 -6.599 1.440) 7.569 3.423 ( -0.125 1.628 -2.563) 3.038 3.803 ( -0.450 -5.598 -5.852) 8.111 4.408 ( 9.322 7.001 -10.126) 15.442 4.862 ( -4.427 8.034 5.569) 10.731 5.066 ( -3.976 5.510 -0.599) 6.821 5.805 ( 3.361 -8.634 -0.393) 9.273 6.785 ( -0.873 2.630 6.557) 7.119 6.955 ( -0.261 -0.512 -5.022) 5.055 7.465 ( 4.736 -16.717 4.343) 17.910 7.689 ( 1.446 0.017 -0.382) 1.496 8.061 ( -2.068 -4.662 1.956) 5.462 8.494 ( -10.440 -5.696 7.641) 14.136 9.404 ( 10.549 3.360 -8.429) 13.915 9.907 ( 1.527 8.846 -6.580) 11.130 10.161 ( -5.895 9.782 1.707) 11.548 15.974 ( 3.037 -4.268 6.602) 8.427 16.238 ( -1.852 -5.636 -5.826) 8.315 16.643 ( 2.890 3.032 -2.615) 4.938 17.265 ( -6.626 5.958 -3.467) 9.561 17.321 ( -1.515 12.850 3.545) 13.416 18.306 ( 5.021 -20.630 2.282) 21.354 ======================= Grid point 533 (263/294) ======================= q-point: ( 0.58 0.58 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.431 ( -0.335 -5.361 13.433) 14.467 2.700 ( 3.453 -6.968 12.848) 15.018 2.830 ( -3.790 -6.482 -6.542) 9.958 3.415 ( 0.476 -0.074 -4.554) 4.579 3.729 ( -0.515 -2.867 -1.585) 3.316 4.512 ( -0.262 7.614 -9.740) 12.366 4.821 ( -1.249 4.113 -5.619) 7.075 5.180 ( 2.193 8.880 7.706) 11.960 5.750 ( 0.426 -8.583 -1.228) 8.681 6.822 ( 0.305 0.908 2.240) 2.436 6.897 ( -2.087 -3.113 -1.518) 4.043 7.362 ( -0.000 -12.274 1.385) 12.352 7.768 ( 1.692 2.605 3.845) 4.943 8.059 ( 5.860 -7.536 8.105) 12.522 8.346 ( -7.357 -2.556 7.420) 10.757 9.513 ( 3.889 1.714 -7.379) 8.515 9.864 ( -4.687 8.123 -13.445) 16.393 10.261 ( 1.884 9.027 3.349) 9.811 16.030 ( 3.214 -4.397 7.620) 9.366 16.123 ( -2.909 -2.866 -4.121) 5.802 16.671 ( -1.360 2.860 -3.467) 4.695 17.222 ( 1.203 6.380 -7.561) 9.966 17.474 ( -0.915 11.385 8.421) 14.191 18.168 ( 0.688 -20.637 2.591) 20.810 ======================= Grid point 534 (264/294) ======================= q-point: ( 0.67 0.58 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.388 ( -4.343 -8.912 9.817) 13.952 2.678 ( -2.559 -2.355 -8.538) 9.219 2.847 ( 8.600 -5.536 16.987) 19.829 3.373 ( 0.056 -1.693 -7.122) 7.321 3.712 ( -1.145 0.124 3.724) 3.898 4.424 ( -10.026 6.037 -5.732) 13.032 4.885 ( 8.441 3.289 -11.299) 14.482 5.340 ( 1.934 7.141 5.535) 9.240 5.636 ( -2.388 -8.419 -2.347) 9.060 6.822 ( -2.561 -3.866 2.962) 5.502 6.851 ( 2.207 -0.294 0.036) 2.227 7.273 ( -1.404 -5.658 1.315) 5.977 7.801 ( -2.937 3.657 2.250) 5.202 8.170 ( 4.443 -5.353 9.806) 12.023 8.332 ( 4.783 -2.736 10.543) 11.896 9.431 ( -8.736 2.296 -10.719) 14.017 9.845 ( 2.585 6.268 -9.728) 11.858 10.377 ( 2.040 4.652 0.236) 5.085 16.036 ( -3.591 0.086 1.180) 3.781 16.093 ( 2.815 -2.797 4.665) 6.125 16.622 ( -3.737 1.976 -3.565) 5.530 17.326 ( 8.268 5.902 -7.502) 12.628 17.587 ( -1.087 5.928 2.916) 6.695 17.989 ( -3.491 -14.812 7.562) 16.993 ======================= Grid point 536 (265/294) ======================= q-point: (-0.25 -0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.280 ( -0.738 -10.932 4.556) 11.867 2.592 ( -4.734 4.443 -4.112) 7.685 3.043 ( 6.628 -2.546 12.845) 14.677 3.322 ( 2.874 -3.660 -4.933) 6.782 3.719 ( -3.430 1.039 7.400) 8.222 4.282 ( -7.368 3.924 -5.721) 10.120 4.954 ( 6.217 -1.855 -13.591) 15.060 5.386 ( -0.178 -4.642 -2.719) 5.382 5.568 ( -1.815 5.349 4.583) 7.274 6.787 ( -2.088 -2.144 8.046) 8.584 6.899 ( 5.142 0.045 -3.576) 6.263 7.209 ( -2.877 -2.052 0.888) 3.644 7.795 ( -2.942 3.763 2.004) 5.180 8.212 ( -1.861 2.145 6.891) 7.453 8.548 ( 14.174 -6.350 14.073) 20.959 9.188 ( -13.631 3.124 -13.126) 19.180 9.911 ( 5.395 2.688 -6.899) 9.161 10.411 ( -0.408 -0.020 -1.124) 1.196 16.007 ( -3.213 3.860 1.808) 5.338 16.137 ( 1.470 -1.663 4.407) 4.934 16.569 ( -1.576 0.817 -2.086) 2.739 17.450 ( 4.008 0.901 -10.132) 10.933 17.538 ( 0.623 -7.492 -4.693) 8.862 17.955 ( -2.277 4.481 15.844) 16.622 ======================= Grid point 543 (266/294) ======================= q-point: ( 0.33 0.67 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.485 ( -9.100 4.870 5.307) 11.606 2.597 ( 7.618 -14.790 -7.756) 18.356 3.137 ( 4.823 0.847 -10.277) 11.384 3.253 ( 5.685 1.353 3.742) 6.939 3.825 ( 0.659 1.826 -8.536) 8.754 4.253 ( -4.384 -1.100 13.057) 13.817 4.683 ( -0.699 2.976 10.032) 10.487 5.399 ( 2.179 -0.990 0.491) 2.443 5.660 ( -0.701 -3.058 -6.692) 7.391 6.680 ( 1.727 3.710 8.594) 9.519 7.025 ( -2.523 -1.937 -8.584) 9.155 7.297 ( 2.536 -4.219 -1.784) 5.236 7.872 ( -3.858 -2.046 -5.300) 6.867 8.329 ( -2.000 -2.980 -7.109) 7.964 8.581 ( 12.579 6.327 -15.841) 21.194 9.217 ( -8.390 -8.618 12.024) 17.007 9.644 ( -0.667 9.613 11.834) 15.261 10.364 ( -0.550 2.073 1.816) 2.810 16.030 ( -6.871 0.006 0.220) 6.874 16.235 ( 5.140 -1.192 -9.090) 10.510 16.577 ( -1.789 -2.393 1.432) 3.313 17.168 ( -1.002 9.690 9.216) 13.410 17.518 ( 5.645 -3.657 8.113) 10.539 18.245 ( -1.284 -5.203 -17.453) 18.257 ======================= Grid point 544 (267/294) ======================= q-point: ( 0.42 0.67 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.445 ( -4.812 0.319 10.746) 11.778 2.547 ( 6.516 -10.217 -7.594) 14.301 3.080 ( -2.322 -3.231 -0.700) 4.040 3.424 ( 5.955 4.106 -1.633) 7.415 3.780 ( 0.991 -2.707 -9.536) 9.962 4.192 ( -2.192 -1.830 2.205) 3.607 4.862 ( 2.823 9.664 13.359) 16.728 5.348 ( -7.763 4.226 -5.993) 10.680 5.628 ( 5.535 -9.222 1.941) 10.929 6.799 ( 0.922 3.979 7.396) 8.449 6.934 ( 0.592 -2.273 -7.720) 8.070 7.290 ( 3.461 -6.988 0.634) 7.824 7.750 ( -4.014 -2.260 -4.023) 6.116 8.198 ( -4.591 -2.992 -3.911) 6.733 8.746 ( 5.492 3.869 -9.722) 11.818 9.078 ( -1.875 -6.170 7.170) 9.643 9.819 ( 2.251 9.486 6.122) 11.512 10.358 ( -3.705 3.517 0.058) 5.108 15.947 ( -2.572 -2.114 2.386) 4.096 16.232 ( 2.596 -2.777 -7.100) 8.054 16.558 ( 0.543 0.199 0.268) 0.638 17.319 ( -0.141 10.630 9.590) 14.317 17.553 ( -3.846 2.771 -1.450) 4.958 18.096 ( 4.218 -13.497 -7.570) 16.040 ======================= Grid point 545 (268/294) ======================= q-point: ( 0.50 0.67 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.446 ( -2.143 -5.219 15.205) 16.218 2.537 ( 6.410 -3.933 -7.539) 10.649 2.995 ( -3.989 -6.835 3.315) 8.581 3.477 ( -1.921 2.667 -0.453) 3.318 3.705 ( 1.101 -3.839 -7.269) 8.294 4.235 ( 7.687 3.137 -7.571) 11.236 5.071 ( 0.427 9.955 11.996) 15.595 5.196 ( -9.662 4.539 -5.645) 12.076 5.649 ( 5.269 -9.595 2.490) 11.226 6.819 ( 0.733 -2.559 -5.598) 6.199 6.941 ( -0.351 2.969 4.978) 5.807 7.283 ( 3.913 -9.686 2.720) 10.795 7.677 ( -0.711 -0.333 0.226) 0.817 8.086 ( -3.869 -2.115 -0.955) 4.512 8.665 ( -9.492 -4.905 7.420) 13.008 9.179 ( 12.171 3.125 -8.723) 15.297 9.945 ( 0.674 7.567 -1.835) 7.815 10.325 ( -4.298 4.557 0.237) 6.269 15.933 ( 1.186 -3.006 4.386) 5.447 16.190 ( -0.324 -2.337 -3.722) 4.407 16.599 ( 3.147 2.028 -1.521) 4.041 17.404 ( -6.723 3.063 -3.298) 8.091 17.513 ( -2.903 13.474 2.755) 14.056 18.025 ( 6.739 -18.368 2.356) 19.707 ======================= Grid point 546 (269/294) ======================= q-point: ( 0.58 0.67 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.462 ( 0.066 -5.605 13.171) 14.314 2.594 ( 6.628 -2.968 0.502) 7.279 2.831 ( -6.967 -11.052 2.776) 13.356 3.448 ( -3.822 3.042 -1.800) 5.206 3.679 ( 2.582 -0.882 -2.682) 3.826 4.365 ( 9.920 4.045 -13.228) 17.022 5.016 ( -12.581 6.839 -2.677) 14.568 5.255 ( 2.890 6.198 6.996) 9.783 5.632 ( 2.656 -10.034 0.921) 10.420 6.765 ( 1.234 -2.223 -8.008) 8.401 6.974 ( -3.593 0.872 9.266) 9.977 7.265 ( 2.029 -7.380 2.840) 8.164 7.741 ( 5.524 0.486 5.721) 7.967 8.019 ( -2.001 -2.623 2.881) 4.380 8.511 ( -9.218 -3.843 9.736) 13.948 9.348 ( 10.488 2.854 -10.565) 15.158 9.949 ( -4.366 7.631 -9.726) 13.110 10.327 ( -0.405 3.291 0.714) 3.392 15.974 ( 3.215 -3.191 5.981) 7.503 16.146 ( -2.079 0.484 -0.290) 2.155 16.663 ( 2.678 2.471 -3.037) 4.743 17.271 ( -5.934 4.711 -8.884) 11.676 17.617 ( -0.665 6.272 0.530) 6.329 17.987 ( 3.447 -14.353 11.232) 18.548 ======================= Grid point 548 (270/294) ======================= q-point: (-0.33 -0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.456 ( -6.199 -8.915 11.600) 15.889 2.630 ( 2.211 -13.684 9.356) 16.723 2.730 ( 5.830 2.672 -1.086) 6.505 3.384 ( -4.439 2.838 -4.901) 7.196 3.736 ( 2.288 2.306 3.531) 4.798 4.436 ( 5.327 0.401 -16.407) 17.255 4.880 ( -8.362 7.638 -4.447) 12.167 5.366 ( 1.645 -0.353 0.930) 1.922 5.586 ( 1.244 -4.449 4.013) 6.119 6.730 ( 2.056 -0.596 -7.618) 7.914 6.960 ( -4.961 -1.703 12.627) 13.673 7.250 ( 0.462 -3.280 2.052) 3.897 7.884 ( 1.588 3.848 4.442) 6.088 8.031 ( 6.677 -6.770 10.622) 14.256 8.419 ( -5.777 -0.758 9.130) 10.831 9.424 ( 3.433 0.034 -10.251) 10.810 9.869 ( -5.082 8.976 -12.599) 16.283 10.363 ( 2.265 0.580 -1.733) 2.910 16.040 ( 3.368 -4.014 7.600) 9.231 16.134 ( -3.014 5.193 2.135) 6.372 16.671 ( -1.849 1.908 -4.384) 5.126 17.236 ( 2.669 5.289 -8.303) 10.200 17.568 ( -0.889 -7.316 -9.196) 11.785 18.034 ( -0.523 -1.734 20.630) 20.709 ======================= Grid point 549 (271/294) ======================= q-point: (-0.25 -0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.243 ( -6.778 -16.279 6.340) 18.739 2.682 ( 1.423 3.326 4.889) 6.082 2.893 ( 10.929 -5.924 11.046) 16.630 3.310 ( -4.038 4.452 -6.693) 8.996 3.819 ( -0.220 3.739 7.074) 8.004 4.331 ( -2.624 -5.344 -14.991) 16.130 4.830 ( -1.751 6.211 -10.610) 12.418 5.309 ( 0.269 -5.856 -4.368) 7.310 5.674 ( 1.195 5.384 9.202) 10.728 6.727 ( 3.790 -0.798 -7.479) 8.423 6.947 ( -4.215 -1.605 14.374) 15.065 7.235 ( -1.072 -1.099 1.153) 1.920 7.897 ( -3.578 2.005 3.288) 5.257 8.236 ( 10.344 -2.359 13.470) 17.147 8.423 ( 0.774 -0.417 9.353) 9.394 9.320 ( -7.155 -0.158 -11.649) 13.672 9.830 ( 0.416 6.130 -11.793) 13.297 10.380 ( 1.833 -1.327 -3.258) 3.967 16.081 ( 0.627 -4.525 8.144) 9.338 16.180 ( -2.095 9.179 3.242) 9.957 16.605 ( -3.459 0.931 -4.202) 5.522 17.321 ( 4.351 2.551 -10.955) 12.060 17.394 ( 1.642 -9.262 -8.606) 12.750 18.155 ( -2.186 3.772 21.258) 21.700 ======================= Grid point 641 (272/294) ======================= q-point: ( 0.33 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 294 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.125 ( -0.000 0.000 26.348) 26.348 2.125 ( -0.000 0.000 26.348) 26.348 3.004 ( -0.000 0.000 34.793) 34.793 3.570 ( 0.000 -0.000 -12.368) 12.368 3.570 ( 0.000 -0.000 -12.368) 12.368 4.861 ( 0.000 -0.000 -16.903) 16.903 4.891 ( 0.000 -0.000 -6.942) 6.942 4.891 ( 0.000 -0.000 -6.942) 6.942 6.398 ( 0.000 -0.000 -9.022) 9.022 6.661 ( -0.000 0.000 3.430) 3.430 6.661 ( 0.000 0.000 3.430) 3.430 7.649 ( 0.000 -0.000 -0.592) 0.592 8.325 ( -0.000 0.000 11.457) 11.457 8.325 ( -0.000 0.000 11.457) 11.457 8.330 ( -0.000 0.000 17.216) 17.216 9.629 ( 0.000 -0.000 -10.003) 10.003 9.664 ( 0.000 -0.000 -15.239) 15.239 9.664 ( 0.000 -0.000 -15.239) 15.239 16.200 ( -0.000 0.000 9.144) 9.144 16.200 ( -0.000 0.000 9.144) 9.144 16.792 ( 0.000 -0.000 -3.776) 3.776 16.895 ( 0.000 -0.000 -8.674) 8.674 16.895 ( 0.000 -0.000 -8.674) 8.674 19.173 ( -0.000 0.000 3.648) 3.648 ======================= Grid point 642 (273/294) ======================= q-point: ( 0.42 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.103 ( -8.089 -1.931 26.412) 27.690 2.488 ( 12.186 2.048 24.057) 27.045 3.255 ( 2.335 3.101 26.508) 26.791 3.394 ( -5.305 -1.013 -13.747) 14.770 3.603 ( 5.932 2.305 -7.849) 10.105 4.646 ( -7.399 -6.494 -16.138) 18.903 4.802 ( -2.836 0.272 -5.086) 5.830 4.958 ( 6.274 3.449 -8.307) 10.967 6.281 ( -4.501 -3.401 -7.682) 9.531 6.625 ( -3.326 1.419 5.323) 6.435 6.783 ( 6.178 1.164 0.703) 6.326 7.638 ( -1.116 -0.313 0.552) 1.284 8.118 ( -11.692 -6.059 10.538) 16.866 8.502 ( 8.034 -7.870 12.319) 16.680 8.579 ( 1.942 14.021 11.093) 17.984 9.410 ( -3.129 -10.452 -13.808) 17.599 9.435 ( -8.741 1.313 -9.759) 13.167 9.861 ( 11.846 7.672 -12.461) 18.827 16.111 ( -6.275 -3.320 8.991) 11.456 16.411 ( 6.596 4.539 9.482) 12.411 16.685 ( -4.994 -5.872 -8.497) 11.472 16.765 ( -0.806 -0.087 -3.974) 4.056 17.049 ( 10.386 7.103 -9.027) 15.486 19.110 ( -7.359 -3.843 3.055) 8.846 ======================= Grid point 643 (274/294) ======================= q-point: ( 0.50 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.156 ( -3.342 0.153 24.503) 24.730 2.851 ( 13.521 -0.585 19.927) 24.088 3.207 ( -5.524 -0.394 -15.346) 16.314 3.361 ( -3.818 2.995 2.810) 5.607 3.776 ( 8.687 3.923 11.549) 14.975 4.316 ( -10.596 -9.227 -15.132) 20.649 4.736 ( -3.060 1.124 -2.288) 3.983 5.065 ( 8.320 4.212 -8.993) 12.955 6.112 ( -6.058 -3.972 -6.144) 9.499 6.631 ( -2.638 1.403 7.740) 8.296 6.890 ( 5.370 1.008 -1.216) 5.597 7.602 ( -4.197 -1.629 4.140) 6.116 7.960 ( -6.215 -3.563 2.810) 7.695 8.574 ( -1.857 0.336 5.348) 5.671 8.746 ( 3.158 -0.323 -2.079) 3.795 9.225 ( -0.521 -5.371 -1.003) 5.489 9.299 ( -4.144 1.864 -2.783) 5.328 10.045 ( 10.096 6.296 -9.553) 15.259 16.044 ( -4.931 -1.652 8.325) 9.816 16.503 ( -3.667 -5.881 -8.531) 10.991 16.609 ( 2.466 6.684 7.929) 10.660 16.736 ( 3.036 -3.111 -1.984) 4.778 17.249 ( 10.999 7.377 -8.589) 15.785 18.905 ( -12.443 -6.128 1.222) 13.924 ======================= Grid point 644 (275/294) ======================= q-point: ( 0.58 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.285 ( 1.538 0.937 19.732) 19.814 3.009 ( -6.688 0.231 -15.594) 16.969 3.139 ( 9.975 -5.011 12.219) 16.551 3.287 ( -6.810 4.214 -4.621) 9.246 3.912 ( -5.754 -8.256 -5.687) 11.559 4.091 ( 4.565 1.827 9.086) 10.331 4.701 ( -2.915 3.479 1.208) 4.697 5.198 ( 9.024 3.820 -8.878) 13.223 5.931 ( -7.494 -3.746 -3.728) 9.170 6.655 ( -1.479 -0.149 9.351) 9.468 6.966 ( 3.735 1.721 -3.023) 5.104 7.510 ( -7.163 -3.174 4.796) 9.186 7.878 ( -1.088 -0.072 -4.489) 4.619 8.506 ( -6.893 -0.618 -6.118) 9.237 8.623 ( -1.129 -8.701 -13.125) 15.788 9.290 ( 1.095 -1.326 5.663) 5.918 9.338 ( 4.689 7.171 13.787) 16.232 10.200 ( 7.716 4.285 -5.754) 10.536 16.020 ( -2.610 0.523 6.475) 7.000 16.340 ( -2.980 -5.468 -8.662) 10.668 16.644 ( -2.757 2.968 -0.863) 4.142 16.866 ( 8.523 0.199 8.205) 11.832 17.438 ( 8.961 5.730 -6.143) 12.283 18.608 ( -14.382 -6.943 -2.863) 16.225 ======================= Grid point 645 (276/294) ======================= q-point: ( 0.67 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.451 ( 4.923 1.637 10.561) 11.767 2.792 ( -9.474 0.495 -11.360) 14.801 3.032 ( -8.291 -10.563 -12.579) 18.400 3.315 ( -0.035 3.516 5.945) 6.907 3.742 ( 0.066 -4.353 -3.282) 5.452 4.288 ( 6.395 -0.953 13.723) 15.170 4.740 ( -0.664 8.082 4.231) 9.147 5.317 ( 7.222 1.783 -6.943) 10.176 5.745 ( -8.454 -3.654 -1.281) 9.299 6.691 ( -0.103 -1.533 9.244) 9.371 7.005 ( 1.146 2.993 -6.294) 7.063 7.371 ( -6.901 -3.065 -0.346) 7.559 7.858 ( 1.387 1.464 -5.460) 5.821 8.267 ( -3.229 -13.228 -13.649) 19.280 8.498 ( -5.116 4.989 -8.672) 11.237 9.352 ( 2.928 -3.340 9.331) 10.334 9.602 ( 5.757 9.242 14.725) 18.313 10.310 ( 4.713 1.534 -1.668) 5.230 16.047 ( 0.648 2.245 2.828) 3.668 16.191 ( -2.891 -4.352 -8.450) 9.935 16.634 ( -0.846 2.098 0.637) 2.351 17.062 ( 7.298 1.182 9.171) 11.780 17.567 ( 3.420 2.363 -0.093) 4.158 18.281 ( -11.527 -5.578 -10.426) 16.513 ======================= Grid point 654 (277/294) ======================= q-point: ( 0.42 0.42 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.284 ( 2.778 -6.573 25.279) 26.267 2.574 ( -4.378 4.053 24.719) 25.429 3.286 ( 0.580 -4.256 -9.876) 10.769 3.479 ( 7.007 3.866 -3.297) 8.655 3.537 ( -5.791 9.314 12.051) 16.295 4.558 ( -1.441 -7.918 -14.588) 16.660 4.806 ( 3.170 0.383 -6.050) 6.840 4.865 ( -1.919 2.739 -6.561) 7.364 6.233 ( -0.499 -5.647 -6.791) 8.846 6.663 ( 2.621 -0.449 4.199) 4.970 6.786 ( -2.074 5.307 0.540) 5.723 7.645 ( 0.168 0.541 -0.259) 0.623 8.306 ( 12.014 -9.384 13.081) 20.087 8.338 ( -13.711 -10.150 13.137) 21.531 8.678 ( 2.444 1.740 1.317) 3.276 9.287 ( -1.375 -2.989 -1.823) 3.761 9.614 ( -3.971 6.154 -11.237) 13.413 9.658 ( 4.397 9.395 -15.339) 18.518 16.174 ( 0.372 -6.723 9.409) 11.570 16.453 ( 0.574 5.757 8.962) 10.667 16.651 ( -2.235 -4.977 -9.412) 10.879 16.771 ( -0.182 2.218 -2.195) 3.126 16.955 ( 1.172 8.964 -9.492) 13.108 19.124 ( 0.261 -8.915 2.773) 9.340 ======================= Grid point 655 (278/294) ======================= q-point: ( 0.50 0.42 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.369 ( -3.910 -2.640 23.810) 24.273 2.763 ( 7.492 -2.804 23.060) 24.408 3.151 ( -2.178 -2.394 -17.869) 18.160 3.460 ( -1.988 5.275 -9.254) 10.835 3.785 ( 5.310 6.506 17.050) 19.006 4.309 ( -8.292 -7.781 -12.087) 16.595 4.789 ( -2.156 2.462 -0.437) 3.301 4.907 ( 7.527 2.471 -9.190) 12.133 6.103 ( -3.263 -6.065 -5.050) 8.541 6.727 ( -0.150 1.794 5.453) 5.743 6.824 ( 2.174 3.228 -1.533) 4.183 7.650 ( -0.737 0.751 0.742) 1.287 8.091 ( -11.709 -10.478 9.239) 18.228 8.491 ( 10.388 -8.326 12.911) 18.545 8.602 ( 0.120 -12.414 -11.985) 17.256 9.336 ( -2.374 11.080 9.470) 14.767 9.412 ( -9.872 4.851 -10.103) 14.935 9.864 ( 11.995 8.551 -11.677) 18.798 16.146 ( -3.282 -4.354 9.647) 11.081 16.464 ( -3.950 -5.907 -8.948) 11.426 16.614 ( 4.626 1.694 5.459) 7.353 16.758 ( -3.213 6.224 1.096) 7.090 17.092 ( 9.537 8.568 -9.448) 15.925 18.985 ( -6.267 -11.768 1.555) 13.423 ======================= Grid point 656 (279/294) ======================= q-point: ( 0.58 0.42 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.424 ( -3.070 -2.066 21.224) 21.544 2.963 ( -3.024 -2.387 -20.204) 20.568 2.999 ( 9.116 -5.340 15.517) 18.772 3.415 ( -4.315 6.337 -6.883) 10.303 3.904 ( -4.055 -8.702 1.190) 9.674 4.108 ( -0.563 2.549 2.967) 3.952 4.804 ( -1.906 6.667 2.405) 7.339 5.022 ( 9.279 3.090 -9.017) 13.302 5.957 ( -4.294 -5.523 -3.267) 7.721 6.754 ( -2.715 1.413 7.220) 7.841 6.895 ( 4.451 2.147 -3.194) 5.884 7.623 ( -5.084 -1.898 4.743) 7.207 7.875 ( -5.155 -8.236 -1.073) 9.775 8.367 ( -2.467 -13.558 -12.764) 18.784 8.627 ( 3.346 -1.679 6.488) 7.491 9.252 ( -4.101 0.083 -3.864) 5.635 9.523 ( 0.816 12.009 12.002) 16.998 10.065 ( 9.622 7.689 -8.094) 14.738 16.110 ( -3.478 -2.585 8.057) 9.149 16.293 ( -3.351 -5.258 -7.872) 10.042 16.644 ( 0.801 -2.656 -2.497) 3.732 16.886 ( 2.379 10.148 10.140) 14.541 17.286 ( 10.524 7.374 -8.836) 15.595 18.717 ( -11.165 -13.243 -0.858) 17.343 ======================= Grid point 657 (280/294) ======================= q-point: ( 0.67 0.42 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.485 ( -0.284 -2.340 13.985) 14.182 2.753 ( -3.217 -4.531 -19.009) 19.805 3.063 ( -4.482 -4.606 -0.997) 6.503 3.387 ( -1.564 5.819 0.050) 6.026 3.722 ( -4.185 -6.134 2.317) 7.779 4.223 ( 6.205 -2.942 8.983) 11.307 4.884 ( -1.369 11.869 2.927) 12.301 5.153 ( 8.890 2.562 -8.130) 12.316 5.809 ( -5.585 -5.630 -1.470) 8.065 6.761 ( -2.473 -0.627 8.261) 8.646 6.961 ( 3.273 2.562 -4.936) 6.453 7.469 ( -9.597 -6.817 2.133) 11.964 7.774 ( 2.219 -4.177 -7.103) 8.533 8.143 ( -3.692 -7.382 -7.894) 11.421 8.625 ( -6.267 5.910 -4.781) 9.852 9.244 ( 5.946 -7.516 6.905) 11.812 9.735 ( 2.738 10.511 11.319) 15.688 10.228 ( 6.406 5.607 -4.247) 9.514 16.065 ( -1.909 -3.803 -0.099) 4.257 16.171 ( -2.753 -1.656 -1.973) 3.770 16.627 ( 1.484 -1.590 -0.718) 2.290 17.092 ( 2.721 9.453 10.596) 14.458 17.468 ( 9.344 5.673 -6.879) 12.915 18.362 ( -13.380 -13.231 -4.512) 19.351 ======================= Grid point 667 (281/294) ======================= q-point: ( 0.42 0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.318 ( 3.383 -4.294 25.500) 26.080 2.890 ( -10.153 2.305 19.835) 22.402 3.125 ( 3.351 -3.855 -15.050) 15.893 3.383 ( 4.086 1.807 -7.389) 8.635 3.813 ( -5.514 8.173 15.330) 18.227 4.350 ( 7.311 -5.537 -14.687) 17.316 4.718 ( 2.159 -0.999 -2.167) 3.218 4.937 ( -6.482 3.570 -6.561) 9.890 6.114 ( 3.178 -5.953 -5.404) 8.645 6.664 ( 0.639 0.238 6.401) 6.437 6.874 ( -2.463 4.593 -1.758) 5.501 7.643 ( 1.070 0.128 1.480) 1.831 8.080 ( 11.427 -10.181 8.949) 17.729 8.450 ( -5.103 -15.458 1.784) 16.376 8.672 ( -6.844 -2.758 1.069) 7.456 9.317 ( 4.128 2.548 0.285) 4.859 9.439 ( 10.164 12.309 -3.809) 16.411 9.848 ( -12.814 7.601 -11.272) 18.683 16.123 ( 3.988 -5.693 8.933) 11.319 16.519 ( 0.831 -4.407 -7.252) 8.526 16.572 ( 0.389 1.098 2.598) 2.847 16.810 ( 0.357 8.861 2.219) 9.141 17.064 ( -9.769 7.234 -9.494) 15.424 18.974 ( 6.734 -12.587 2.266) 14.454 ======================= Grid point 668 (282/294) ======================= q-point: ( 0.50 0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.480 ( 2.345 -4.269 23.120) 23.628 2.864 ( -4.081 -3.657 16.603) 17.484 3.036 ( -0.862 -1.893 -13.590) 13.748 3.411 ( 3.530 3.388 -11.052) 12.086 3.899 ( -1.289 1.849 10.401) 10.642 4.286 ( -1.509 -0.453 -10.196) 10.317 4.766 ( 4.663 1.131 -3.426) 5.896 4.862 ( -2.737 4.051 -1.228) 5.041 6.046 ( -0.317 -6.702 -3.515) 7.575 6.734 ( 2.226 1.560 4.921) 5.622 6.867 ( -1.985 4.093 -2.487) 5.184 7.666 ( 0.242 1.674 -0.062) 1.692 8.129 ( -1.258 -22.017 2.837) 22.235 8.312 ( 7.501 -7.980 11.980) 16.231 8.498 ( -7.390 -6.733 -1.229) 10.073 9.437 ( 4.195 4.542 0.197) 6.186 9.630 ( -10.065 8.514 -13.857) 19.126 9.721 ( 6.729 14.452 -0.015) 15.942 16.169 ( 1.559 -5.711 9.299) 11.024 16.396 ( -2.271 -6.720 -9.416) 11.789 16.613 ( 0.672 0.782 2.120) 2.357 16.917 ( -3.396 10.623 5.004) 12.224 17.010 ( 2.977 9.271 -8.834) 13.147 18.909 ( 0.424 -15.839 1.674) 15.933 ======================= Grid point 669 (283/294) ======================= q-point: ( 0.58 0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.567 ( -2.101 -4.721 18.339) 19.053 2.843 ( -0.373 -2.748 -18.172) 18.382 2.961 ( 0.656 -4.491 16.572) 17.182 3.436 ( 2.050 4.043 -8.814) 9.911 3.883 ( -1.829 -8.863 3.533) 9.715 4.205 ( -5.435 5.672 -2.838) 8.353 4.830 ( 6.803 2.778 -10.168) 12.546 4.933 ( 0.763 7.726 6.645) 10.219 5.942 ( -2.504 -6.382 -1.456) 7.008 6.819 ( 3.085 1.186 3.225) 4.618 6.855 ( -1.690 2.805 -2.230) 3.963 7.683 ( -0.042 1.669 -0.545) 1.756 7.839 ( -7.003 -20.001 -0.201) 21.193 8.305 ( -7.133 -5.442 -1.208) 9.053 8.504 ( 11.762 -7.912 14.396) 20.204 9.368 ( -10.617 4.100 -11.125) 15.915 9.630 ( 4.135 7.590 -0.084) 8.644 9.979 ( 7.011 13.219 -0.711) 14.980 16.171 ( -2.792 -4.998 6.249) 8.474 16.238 ( -1.070 -5.614 -5.895) 8.210 16.610 ( -0.945 -0.993 -0.891) 1.635 17.030 ( 1.783 11.339 5.287) 12.637 17.159 ( 6.267 9.608 -4.677) 12.388 18.706 ( -5.658 -17.586 0.049) 18.474 ======================= Grid point 670 (284/294) ======================= q-point: ( 0.67 0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.566 ( -2.375 -6.868 13.675) 15.486 2.650 ( -4.307 -1.668 -19.773) 20.305 3.055 ( 1.872 -3.507 8.342) 9.240 3.445 ( 0.140 3.435 -4.613) 5.753 3.766 ( -4.285 -6.751 5.633) 9.781 4.183 ( -0.462 0.137 2.254) 2.305 4.938 ( 8.786 5.851 -11.817) 15.845 5.069 ( 0.415 9.147 6.399) 11.171 5.818 ( -4.011 -7.046 -0.880) 8.155 6.838 ( -1.899 0.475 1.226) 2.310 6.894 ( 3.491 0.875 -0.469) 3.629 7.535 ( -7.560 -15.408 -2.092) 17.290 7.687 ( -0.615 0.774 -0.365) 1.053 8.157 ( -5.565 -1.584 -0.312) 5.794 8.682 ( 5.119 -2.096 8.287) 9.963 9.182 ( -5.055 -1.147 -5.521) 7.573 9.785 ( 6.056 5.436 1.032) 8.203 10.190 ( 4.726 10.502 -0.401) 11.523 16.044 ( -3.372 -4.960 -5.154) 7.907 16.207 ( -1.373 -2.593 6.031) 6.707 16.582 ( 0.477 -1.362 -1.186) 1.868 17.239 ( 3.231 12.575 8.701) 15.629 17.320 ( 7.369 7.047 -6.728) 12.216 18.394 ( -10.229 -17.610 -1.742) 20.439 ======================= Grid point 680 (285/294) ======================= q-point: ( 0.42 0.58 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.408 ( 0.746 -1.456 23.154) 23.212 2.906 ( 2.851 -7.154 -14.957) 16.823 3.150 ( -4.454 -2.351 5.127) 7.187 3.312 ( 1.885 5.730 -1.472) 6.209 3.973 ( 2.983 -4.763 -2.414) 6.117 4.135 ( 1.565 4.220 1.119) 4.638 4.695 ( 1.107 1.303 3.649) 4.030 5.061 ( -8.359 4.841 -7.497) 12.228 5.959 ( 4.939 -6.152 -2.951) 8.423 6.716 ( -0.142 1.425 8.177) 8.302 6.927 ( -1.737 2.423 -3.906) 4.914 7.610 ( 5.417 -3.185 6.268) 8.875 7.856 ( 5.154 -8.488 -2.376) 10.211 8.350 ( -2.864 -12.514 -4.057) 13.463 8.730 ( 2.715 2.308 -7.871) 8.640 9.210 ( 0.123 -3.825 3.463) 5.161 9.522 ( 2.620 13.104 8.870) 16.039 10.063 ( -10.571 7.564 -7.307) 14.912 16.062 ( 2.967 -4.932 7.971) 9.832 16.370 ( 4.398 -2.264 -10.168) 11.307 16.588 ( -0.707 -2.524 1.696) 3.122 16.957 ( -1.746 11.510 6.950) 13.558 17.259 ( -11.741 6.349 -9.156) 16.186 18.698 ( 11.205 -14.406 0.776) 18.267 ======================= Grid point 681 (286/294) ======================= q-point: ( 0.50 0.58 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.551 ( 1.325 -3.330 23.422) 23.695 2.783 ( 2.401 -6.421 -15.973) 17.382 3.112 ( -2.760 -2.761 7.730) 8.660 3.344 ( -0.584 4.081 -4.655) 6.218 3.915 ( 0.090 -8.309 -0.992) 8.369 4.226 ( 4.774 6.365 -7.668) 11.050 4.773 ( -1.791 4.635 5.501) 7.413 4.953 ( -3.981 5.159 -2.230) 6.888 5.944 ( 2.528 -6.749 -1.720) 7.409 6.774 ( -0.594 2.317 5.883) 6.351 6.902 ( -0.806 2.383 -4.663) 5.298 7.676 ( 0.289 1.150 0.333) 1.232 7.847 ( 8.611 -19.618 1.756) 21.497 8.209 ( 1.195 -8.527 3.716) 9.378 8.634 ( -9.605 -4.222 4.571) 11.444 9.295 ( 10.126 2.240 -7.333) 12.702 9.694 ( -0.833 9.410 -4.223) 10.348 9.952 ( -8.089 12.532 1.272) 14.970 16.115 ( 3.734 -5.793 7.676) 10.316 16.303 ( -0.437 -5.414 -8.889) 10.417 16.606 ( 2.026 0.333 1.376) 2.472 17.073 ( -5.409 9.252 -8.161) 13.470 17.122 ( -3.624 11.333 6.507) 13.562 18.697 ( 6.137 -17.938 1.591) 19.025 ======================= Grid point 682 (287/294) ======================= q-point: ( 0.58 0.58 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.597 ( -0.329 -5.842 -1.046) 5.944 2.739 ( 2.395 -1.196 1.912) 3.289 3.063 ( -4.915 -7.269 15.060) 17.430 3.355 ( 2.878 3.090 -8.476) 9.469 3.830 ( 0.073 -8.622 1.037) 8.684 4.297 ( 0.701 8.421 -9.876) 12.998 4.741 ( -2.164 1.201 -3.467) 4.260 5.047 ( 1.400 9.399 7.392) 12.039 5.895 ( 0.015 -7.006 -0.053) 7.006 6.796 ( 0.319 0.923 -3.263) 3.406 6.902 ( -0.693 2.160 1.675) 2.819 7.616 ( -0.206 -10.325 -6.423) 12.162 7.791 ( -0.843 -5.905 5.499) 8.113 8.294 ( 10.415 -9.644 12.786) 19.104 8.451 ( -9.969 -3.691 7.161) 12.817 9.428 ( 5.228 2.118 -7.865) 9.679 9.611 ( -5.216 8.584 -15.183) 18.205 10.078 ( 0.956 12.931 6.962) 14.717 16.151 ( 0.973 -5.248 -4.349) 6.886 16.186 ( -0.756 -4.992 4.971) 7.085 16.631 ( -1.055 0.294 0.119) 1.101 17.032 ( 1.385 7.730 -9.145) 12.054 17.287 ( -0.619 13.402 9.153) 16.242 18.574 ( 0.027 -19.619 1.277) 19.661 ======================= Grid point 684 (288/294) ======================= q-point: (-0.33 -0.42 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.513 ( 0.211 -1.105 -11.742) 11.796 2.703 ( -6.715 -6.159 6.950) 11.460 3.065 ( 0.969 -4.599 14.262) 15.016 3.378 ( 3.936 -1.018 -6.468) 7.640 3.779 ( -0.224 -5.402 5.732) 7.880 4.271 ( -5.727 5.917 -6.211) 10.314 4.758 ( 6.838 2.460 -9.646) 12.077 5.208 ( 0.662 10.039 7.591) 12.603 5.797 ( -2.873 -8.614 -0.366) 9.087 6.785 ( 2.659 0.614 -8.944) 9.352 6.924 ( -1.446 0.020 6.807) 6.959 7.446 ( -2.361 -11.799 -3.074) 12.420 7.770 ( -3.584 1.274 4.985) 6.270 8.272 ( -7.416 -1.916 4.824) 9.052 8.537 ( 12.546 -7.970 15.932) 21.789 9.300 ( -11.412 3.563 -11.900) 16.868 9.672 ( 8.819 5.401 -9.474) 14.025 10.249 ( 2.149 9.427 3.259) 10.203 16.032 ( -3.369 -2.284 -5.498) 6.841 16.218 ( 1.442 -4.595 8.890) 10.111 16.588 ( -2.697 0.133 -1.388) 3.036 17.148 ( 8.760 7.264 -8.194) 14.023 17.449 ( -0.866 11.246 7.663) 13.636 18.348 ( -5.589 -18.402 2.006) 19.336 ======================= Grid point 805 (289/294) ======================= q-point: ( 0.42 0.42 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 292 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.585 ( -0.000 0.000 23.579) 23.579 2.585 ( -0.000 0.000 23.579) 23.579 3.312 ( 0.000 -0.000 -15.816) 15.816 3.312 ( 0.000 -0.000 -15.816) 15.816 3.588 ( -0.000 0.000 28.116) 28.116 4.547 ( 0.000 -0.000 -17.371) 17.371 4.783 ( 0.000 -0.000 -4.385) 4.385 4.783 ( 0.000 -0.000 -4.385) 4.385 6.250 ( 0.000 -0.000 -6.365) 6.365 6.713 ( 0.000 0.000 1.998) 1.998 6.713 ( 0.000 0.000 1.998) 1.998 7.635 ( 0.000 -0.000 -0.647) 0.647 8.533 ( -0.000 0.000 10.492) 10.492 8.533 ( -0.000 0.000 10.492) 10.492 8.623 ( -0.000 0.000 13.737) 13.737 9.399 ( 0.000 -0.000 -12.685) 12.685 9.399 ( 0.000 -0.000 -12.685) 12.685 9.442 ( 0.000 -0.000 -9.670) 9.670 16.373 ( -0.000 0.000 9.625) 9.625 16.373 ( -0.000 0.000 9.625) 9.625 16.728 ( 0.000 -0.000 -9.415) 9.415 16.728 ( 0.000 -0.000 -9.415) 9.415 16.738 ( 0.000 -0.000 -2.080) 2.080 19.226 ( -0.000 0.000 1.999) 1.999 ======================= Grid point 806 (290/294) ======================= q-point: ( 0.50 0.42 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.570 ( -7.083 -2.351 24.106) 25.235 2.897 ( 9.491 2.105 20.257) 22.469 3.098 ( -4.775 -2.792 -18.318) 19.135 3.302 ( 1.433 2.784 -13.714) 14.067 3.810 ( 5.487 2.794 21.265) 22.139 4.354 ( -7.061 -4.683 -15.339) 17.523 4.741 ( -1.806 1.268 -1.423) 2.625 4.825 ( 5.380 1.532 -5.559) 7.887 6.163 ( -4.140 -2.679 -4.361) 6.583 6.712 ( -0.792 1.876 3.903) 4.402 6.782 ( 4.424 0.493 -0.998) 4.562 7.639 ( 0.489 0.335 -0.163) 0.615 8.336 ( -14.981 -7.901 12.640) 21.134 8.651 ( 0.540 -2.047 1.737) 2.739 8.700 ( -1.323 1.111 -0.197) 1.738 9.255 ( 0.416 -3.093 -0.603) 3.178 9.314 ( -2.259 1.366 -1.422) 2.999 9.624 ( 13.587 8.166 -12.928) 20.455 16.284 ( -6.677 -3.105 9.781) 12.243 16.522 ( -5.278 -4.895 -9.174) 11.661 16.589 ( 6.387 4.782 9.814) 12.648 16.704 ( -0.348 -1.167 -3.015) 3.251 16.880 ( 10.148 6.676 -8.832) 15.019 19.151 ( -7.490 -4.188 1.335) 8.685 ======================= Grid point 807 (291/294) ======================= q-point: ( 0.58 0.42 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.599 ( -4.732 -1.799 22.929) 23.481 2.883 ( -3.666 -2.400 -19.442) 19.930 3.171 ( 9.118 -2.000 14.093) 16.904 3.237 ( -3.576 4.778 -12.571) 13.915 4.049 ( -0.069 -1.217 11.241) 11.307 4.084 ( -2.295 -1.642 -6.738) 7.305 4.724 ( -1.656 1.883 0.881) 2.658 4.919 ( 7.520 2.821 -6.337) 10.231 6.030 ( -5.458 -3.391 -2.108) 6.762 6.753 ( 0.069 1.709 4.605) 4.913 6.852 ( 4.115 0.959 -2.323) 4.821 7.652 ( 0.094 0.111 1.467) 1.474 8.058 ( -15.771 -8.150 6.960) 19.068 8.556 ( -4.706 -8.463 -10.774) 14.486 8.574 ( -5.654 1.249 -8.284) 10.107 9.341 ( 6.089 -5.831 6.888) 10.886 9.370 ( 1.194 10.260 12.600) 16.293 9.856 ( 13.293 7.558 -10.467) 18.530 16.212 ( -6.192 -1.971 9.721) 11.693 16.341 ( -4.147 -4.673 -8.984) 10.943 16.652 ( -2.187 0.951 -1.784) 2.978 16.818 ( 8.453 2.104 9.229) 12.691 17.078 ( 11.519 7.651 -9.340) 16.687 18.921 ( -13.455 -7.536 0.252) 15.424 ======================= Grid point 819 (292/294) ======================= q-point: ( 0.50 0.50 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.723 ( 1.335 -6.238 22.326) 23.219 2.968 ( -0.761 -3.587 -5.035) 6.228 2.999 ( -2.194 2.599 4.937) 5.995 3.230 ( 1.716 6.400 -16.040) 17.355 3.921 ( -0.195 3.941 16.119) 16.594 4.281 ( -0.191 -5.587 -13.507) 14.618 4.743 ( 2.067 -0.018 -1.272) 2.427 4.782 ( -1.752 3.138 -1.602) 3.935 6.142 ( -0.123 -4.882 -2.264) 5.382 6.733 ( 1.543 0.973 2.750) 3.300 6.776 ( -1.435 3.649 -1.401) 4.164 7.639 ( 0.021 0.937 -0.222) 0.963 8.523 ( -4.484 -12.079 3.785) 13.429 8.551 ( 10.257 -13.433 6.688) 18.176 8.607 ( -5.961 -4.369 1.154) 7.480 9.353 ( 3.367 4.778 0.540) 5.870 9.397 ( -7.166 6.350 -10.761) 14.404 9.442 ( 3.958 13.299 -1.464) 13.952 16.349 ( 0.918 -6.876 9.542) 11.797 16.465 ( -1.403 -6.815 -9.599) 11.855 16.618 ( 0.527 2.940 7.001) 7.611 16.763 ( -4.121 6.502 -0.913) 7.752 16.778 ( 4.014 8.878 -6.733) 11.843 19.157 ( 0.058 -8.699 0.746) 8.731 ======================= Grid point 820 (293/294) ======================= q-point: ( 0.58 0.50 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.758 ( -1.403 -5.569 -9.760) 11.324 2.791 ( -4.354 -2.987 7.232) 8.954 3.121 ( 2.194 -1.400 12.281) 12.554 3.250 ( 2.201 7.716 -10.162) 12.948 4.061 ( 3.535 5.192 2.325) 6.698 4.105 ( -5.386 -8.281 -0.495) 9.891 4.746 ( 1.388 0.877 -4.755) 5.030 4.843 ( 2.064 4.869 3.241) 6.202 6.055 ( -3.160 -5.441 0.362) 6.302 6.767 ( 1.063 1.792 -4.512) 4.969 6.819 ( 1.738 2.983 4.222) 5.453 7.654 ( 0.620 1.114 -0.101) 1.279 8.220 ( -9.666 -19.056 -0.324) 21.370 8.416 ( -7.364 -7.321 -3.063) 10.826 8.673 ( 1.729 -1.174 4.857) 5.288 9.270 ( -2.304 -0.503 -2.102) 3.158 9.500 ( 6.042 6.623 1.800) 9.143 9.701 ( 7.669 14.693 -1.007) 16.604 16.286 ( -4.165 -6.589 -6.916) 10.421 16.339 ( -2.192 -4.387 7.957) 9.347 16.634 ( -0.565 -1.786 -1.875) 2.651 16.856 ( 4.169 9.352 4.860) 11.334 16.940 ( 6.482 9.856 -3.715) 12.368 18.997 ( -7.007 -12.133 -0.288) 14.014 ======================= Grid point 976 (294/294) ======================= q-point: (-0.50 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 5.98e-04 3.09e-04 Number of triplets: 148 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.982 ( -0.000 0.000 0.000) 0.000 2.982 ( -0.000 0.000 0.000) 0.000 2.988 ( 0.000 -0.000 -0.000) 0.000 2.988 ( 0.000 -0.000 -0.000) 0.000 3.936 ( -0.000 0.000 0.000) 0.000 4.301 ( 0.000 -0.000 -0.000) 0.000 4.741 ( -0.000 0.000 0.000) 0.000 4.741 ( -0.000 0.000 0.000) 0.000 6.187 ( -0.000 0.000 0.000) 0.000 6.731 ( -0.000 0.000 0.000) 0.000 6.731 ( -0.000 0.000 0.000) 0.000 7.629 ( -0.000 0.000 0.000) 0.000 8.650 ( -0.000 0.000 0.000) 0.000 8.650 ( -0.000 0.000 0.000) 0.000 8.771 ( -0.000 0.000 0.000) 0.000 9.262 ( -0.000 0.000 0.000) 0.000 9.262 ( -0.000 0.000 0.000) 0.000 9.332 ( -0.000 0.000 0.000) 0.000 16.546 ( 0.000 0.000 -0.000) 0.000 16.546 ( 0.000 0.000 -0.000) 0.000 16.557 ( -0.000 0.000 0.000) 0.000 16.557 ( -0.000 0.000 0.000) 0.000 16.718 ( -0.000 0.000 0.000) 0.000 19.244 ( -0.000 0.000 0.000) 0.000 =================== 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 3/41472 10.0 658.232 658.232 916.189 0.000 -0.000 0.000 3/41472 20.0 295.843 295.843 403.255 0.000 -0.000 0.000 3/41472 30.0 154.770 154.770 210.068 0.000 -0.000 0.000 3/41472 40.0 97.507 97.507 132.324 0.000 -0.000 0.000 3/41472 50.0 67.153 67.153 91.135 0.000 -0.000 0.000 3/41472 60.0 49.203 49.203 66.734 0.000 -0.000 0.000 3/41472 70.0 37.892 37.892 51.353 0.000 -0.000 0.000 3/41472 80.0 30.379 30.379 41.143 0.000 -0.000 0.000 3/41472 90.0 25.154 25.154 34.049 0.000 -0.000 0.000 3/41472 100.0 21.373 21.373 28.919 0.000 -0.000 0.000 3/41472 110.0 18.540 18.540 25.079 0.000 -0.000 0.000 3/41472 120.0 16.355 16.355 22.119 0.000 -0.000 0.000 3/41472 130.0 14.626 14.626 19.777 0.000 -0.000 0.000 3/41472 140.0 13.228 13.228 17.885 0.000 -0.000 0.000 3/41472 150.0 12.076 12.076 16.327 0.000 -0.000 0.000 3/41472 160.0 11.113 11.113 15.023 0.000 -0.000 0.000 3/41472 170.0 10.295 10.295 13.917 0.000 -0.000 0.000 3/41472 180.0 9.592 9.592 12.967 0.000 -0.000 0.000 3/41472 190.0 8.983 8.983 12.143 0.000 -0.000 0.000 3/41472 200.0 8.448 8.448 11.421 0.000 -0.000 0.000 3/41472 210.0 7.976 7.976 10.783 0.000 -0.000 0.000 3/41472 220.0 7.556 7.556 10.215 0.000 -0.000 0.000 3/41472 230.0 7.180 7.180 9.706 0.000 -0.000 0.000 3/41472 240.0 6.840 6.840 9.247 0.000 -0.000 0.000 3/41472 250.0 6.533 6.533 8.831 0.000 -0.000 0.000 3/41472 260.0 6.253 6.253 8.453 0.000 -0.000 0.000 3/41472 270.0 5.997 5.997 8.107 0.000 -0.000 0.000 3/41472 280.0 5.761 5.761 7.789 0.000 -0.000 0.000 3/41472 290.0 5.544 5.544 7.496 0.000 -0.000 0.000 3/41472 300.0 5.344 5.344 7.224 0.000 -0.000 0.000 3/41472 310.0 5.158 5.158 6.973 0.000 -0.000 0.000 3/41472 320.0 4.985 4.985 6.739 0.000 -0.000 0.000 3/41472 330.0 4.823 4.823 6.520 0.000 -0.000 0.000 3/41472 340.0 4.672 4.672 6.316 0.000 -0.000 0.000 3/41472 350.0 4.530 4.530 6.125 0.000 -0.000 0.000 3/41472 360.0 4.397 4.397 5.945 0.000 -0.000 0.000 3/41472 370.0 4.272 4.272 5.775 0.000 -0.000 0.000 3/41472 380.0 4.154 4.154 5.616 0.000 -0.000 0.000 3/41472 390.0 4.042 4.042 5.465 0.000 -0.000 0.000 3/41472 400.0 3.936 3.936 5.322 0.000 -0.000 0.000 3/41472 410.0 3.836 3.836 5.186 0.000 -0.000 0.000 3/41472 420.0 3.741 3.741 5.058 0.000 -0.000 0.000 3/41472 430.0 3.651 3.651 4.936 0.000 -0.000 0.000 3/41472 440.0 3.564 3.564 4.819 0.000 -0.000 0.000 3/41472 450.0 3.482 3.482 4.708 0.000 -0.000 0.000 3/41472 460.0 3.404 3.404 4.603 0.000 -0.000 0.000 3/41472 470.0 3.329 3.329 4.502 0.000 -0.000 0.000 3/41472 480.0 3.258 3.258 4.405 0.000 -0.000 0.000 3/41472 490.0 3.189 3.189 4.312 0.000 -0.000 0.000 3/41472 500.0 3.124 3.124 4.224 0.000 -0.000 0.000 3/41472 510.0 3.061 3.061 4.139 0.000 -0.000 0.000 3/41472 520.0 3.001 3.001 4.057 0.000 -0.000 0.000 3/41472 530.0 2.943 2.943 3.979 0.000 -0.000 0.000 3/41472 540.0 2.887 2.887 3.903 0.000 -0.000 0.000 3/41472 550.0 2.833 2.833 3.831 0.000 -0.000 0.000 3/41472 560.0 2.781 2.781 3.761 0.000 -0.000 0.000 3/41472 570.0 2.732 2.732 3.693 0.000 -0.000 0.000 3/41472 580.0 2.684 2.684 3.629 0.000 -0.000 0.000 3/41472 590.0 2.637 2.637 3.566 0.000 -0.000 0.000 3/41472 600.0 2.593 2.593 3.505 0.000 -0.000 0.000 3/41472 610.0 2.549 2.549 3.447 0.000 -0.000 0.000 3/41472 620.0 2.507 2.507 3.390 0.000 -0.000 0.000 3/41472 630.0 2.467 2.467 3.336 0.000 -0.000 0.000 3/41472 640.0 2.428 2.428 3.283 0.000 -0.000 0.000 3/41472 650.0 2.390 2.390 3.231 0.000 -0.000 0.000 3/41472 660.0 2.353 2.353 3.182 0.000 -0.000 0.000 3/41472 670.0 2.317 2.317 3.134 0.000 -0.000 0.000 3/41472 680.0 2.283 2.283 3.087 0.000 -0.000 0.000 3/41472 690.0 2.249 2.249 3.041 0.000 -0.000 0.000 3/41472 700.0 2.217 2.217 2.997 0.000 -0.000 0.000 3/41472 710.0 2.185 2.185 2.955 0.000 -0.000 0.000 3/41472 720.0 2.155 2.155 2.913 0.000 -0.000 0.000 3/41472 730.0 2.125 2.125 2.873 0.000 -0.000 0.000 3/41472 740.0 2.096 2.096 2.834 0.000 -0.000 0.000 3/41472 750.0 2.067 2.067 2.795 0.000 -0.000 0.000 3/41472 760.0 2.040 2.040 2.758 0.000 -0.000 0.000 3/41472 770.0 2.013 2.013 2.722 0.000 -0.000 0.000 3/41472 780.0 1.987 1.987 2.687 0.000 -0.000 0.000 3/41472 790.0 1.962 1.962 2.652 0.000 -0.000 0.000 3/41472 800.0 1.937 1.937 2.619 0.000 -0.000 0.000 3/41472 810.0 1.913 1.913 2.586 0.000 -0.000 0.000 3/41472 820.0 1.889 1.889 2.554 0.000 -0.000 0.000 3/41472 830.0 1.866 1.866 2.523 0.000 -0.000 0.000 3/41472 840.0 1.844 1.844 2.493 0.000 -0.000 0.000 3/41472 850.0 1.822 1.822 2.464 0.000 -0.000 0.000 3/41472 860.0 1.801 1.801 2.435 0.000 -0.000 0.000 3/41472 870.0 1.780 1.780 2.406 0.000 -0.000 0.000 3/41472 880.0 1.759 1.759 2.379 0.000 -0.000 0.000 3/41472 890.0 1.739 1.739 2.352 0.000 -0.000 0.000 3/41472 900.0 1.720 1.720 2.326 0.000 -0.000 0.000 3/41472 910.0 1.701 1.701 2.300 0.000 -0.000 0.000 3/41472 920.0 1.682 1.682 2.275 0.000 -0.000 0.000 3/41472 930.0 1.664 1.664 2.250 0.000 -0.000 0.000 3/41472 940.0 1.646 1.646 2.226 0.000 -0.000 0.000 3/41472 950.0 1.629 1.629 2.202 0.000 -0.000 0.000 3/41472 960.0 1.612 1.612 2.179 0.000 -0.000 0.000 3/41472 970.0 1.595 1.595 2.157 0.000 -0.000 0.000 3/41472 980.0 1.579 1.579 2.135 0.000 -0.000 0.000 3/41472 990.0 1.563 1.563 2.113 0.000 -0.000 0.000 3/41472 1000.0 1.547 1.547 2.092 0.000 -0.000 0.000 3/41472 Thermal conductivity related properties were written into "kappa-m121212.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 00:23:53]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|