----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-09 04:53:48]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 3 2] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) Number of symmetry operations in supercell: 48 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.298323150112258 -2.002355430000000 0.000000000000000 b 5.298323150112258 2.002355430000000 0.000000000000000 c -1.630190614868080 0.000000000000000 7.210138562052552 Atomic positions (fractional): *1 La 0.83497740602548 0.83497740602548 0.70063442526968 138.905 2 La 0.16502259397452 0.16502259397452 0.29936557473032 138.905 *3 Co 0.54035382495103 0.54035382495103 0.65451436518780 58.933 4 Co 0.45964617504897 0.45964617504897 0.34548563481220 58.933 *5 N 0.36606359626484 0.36606359626484 0.52569672101843 14.007 6 N 0.63393640373516 0.63393640373516 0.47430327898157 14.007 *7 N 0.60547073611404 0.60547073611404 0.88077996381923 14.007 *8 N 0.35038635715023 0.35038635715023 0.95790949389436 14.007 9 N 0.39452926388596 0.39452926388596 0.11922003618077 14.007 10 N 0.64961364284977 0.64961364284977 0.04209050610564 14.007 -------------------------------- unit cell --------------------------------- Lattice vectors: a 10.596646300224515 0.000000000000000 0.000000000000000 b 0.000000000000000 4.004710860000000 0.000000000000000 c -1.630190614868080 0.000000000000000 7.210138562052552 Atomic positions (fractional): *1 La 0.33497740602548 0.50000000000000 0.70063442526968 138.905 > 1 2 La 0.16502259397452 0.00000000000000 0.29936557473032 138.905 > 2 3 La 0.83497740602548 0.00000000000000 0.70063442526968 138.905 > 1 4 La 0.66502259397452 0.50000000000000 0.29936557473032 138.905 > 2 *5 Co 0.04035382495103 0.50000000000000 0.65451436518780 58.933 > 3 6 Co 0.45964617504897 0.00000000000000 0.34548563481220 58.933 > 4 7 Co 0.54035382495103 0.00000000000000 0.65451436518780 58.933 > 3 8 Co 0.95964617504897 0.50000000000000 0.34548563481220 58.933 > 4 *9 N 0.36606359626484 0.00000000000000 0.52569672101843 14.007 > 5 10 N 0.13393640373516 0.50000000000000 0.47430327898157 14.007 > 6 *11 N 0.10547073611404 0.50000000000000 0.88077996381923 14.007 > 7 *12 N 0.35038635715023 0.00000000000000 0.95790949389436 14.007 > 8 13 N 0.39452926388596 0.00000000000000 0.11922003618077 14.007 > 9 14 N 0.14961364284977 0.50000000000000 0.04209050610564 14.007 > 10 15 N 0.86606359626484 0.50000000000000 0.52569672101843 14.007 > 5 16 N 0.63393640373516 0.00000000000000 0.47430327898157 14.007 > 6 17 N 0.60547073611404 0.00000000000000 0.88077996381923 14.007 > 7 18 N 0.85038635715023 0.50000000000000 0.95790949389436 14.007 > 8 19 N 0.89452926388596 0.50000000000000 0.11922003618077 14.007 > 9 20 N 0.64961364284977 0.00000000000000 0.04209050610564 14.007 > 10 -------------------------------- super cell -------------------------------- Lattice vectors: a 10.596646300224515 0.000000000000000 0.000000000000000 b 0.000000000000000 12.014132580000002 0.000000000000000 c -3.260381229736160 0.000000000000000 14.420277124105104 Atomic positions (fractional): *1 La 0.33497740602548 0.16666666666667 0.35031721263484 138.905 > 1 2 La 0.33497740602548 0.50000000000000 0.35031721263484 138.905 > 1 3 La 0.33497740602548 0.83333333333333 0.35031721263484 138.905 > 1 4 La 0.33497740602548 0.16666666666667 0.85031721263484 138.905 > 1 5 La 0.33497740602548 0.50000000000000 0.85031721263484 138.905 > 1 6 La 0.33497740602548 0.83333333333333 0.85031721263484 138.905 > 1 7 La 0.16502259397452 0.00000000000000 0.14968278736516 138.905 > 2 8 La 0.16502259397452 0.33333333333333 0.14968278736516 138.905 > 2 9 La 0.16502259397452 0.66666666666667 0.14968278736516 138.905 > 2 10 La 0.16502259397452 0.00000000000000 0.64968278736516 138.905 > 2 11 La 0.16502259397452 0.33333333333333 0.64968278736516 138.905 > 2 12 La 0.16502259397452 0.66666666666667 0.64968278736516 138.905 > 2 13 La 0.83497740602548 0.00000000000000 0.35031721263484 138.905 > 1 14 La 0.83497740602548 0.33333333333333 0.35031721263484 138.905 > 1 15 La 0.83497740602548 0.66666666666667 0.35031721263484 138.905 > 1 16 La 0.83497740602548 0.00000000000000 0.85031721263484 138.905 > 1 17 La 0.83497740602548 0.33333333333333 0.85031721263484 138.905 > 1 18 La 0.83497740602548 0.66666666666667 0.85031721263484 138.905 > 1 19 La 0.66502259397452 0.16666666666667 0.14968278736516 138.905 > 2 20 La 0.66502259397452 0.50000000000000 0.14968278736516 138.905 > 2 21 La 0.66502259397452 0.83333333333333 0.14968278736516 138.905 > 2 22 La 0.66502259397452 0.16666666666667 0.64968278736516 138.905 > 2 23 La 0.66502259397452 0.50000000000000 0.64968278736516 138.905 > 2 24 La 0.66502259397452 0.83333333333333 0.64968278736516 138.905 > 2 *25 Co 0.04035382495103 0.16666666666667 0.32725718259390 58.933 > 3 26 Co 0.04035382495103 0.50000000000000 0.32725718259390 58.933 > 3 27 Co 0.04035382495103 0.83333333333333 0.32725718259390 58.933 > 3 28 Co 0.04035382495103 0.16666666666667 0.82725718259390 58.933 > 3 29 Co 0.04035382495103 0.50000000000000 0.82725718259390 58.933 > 3 30 Co 0.04035382495103 0.83333333333333 0.82725718259390 58.933 > 3 31 Co 0.45964617504897 0.00000000000000 0.17274281740610 58.933 > 4 32 Co 0.45964617504897 0.33333333333333 0.17274281740610 58.933 > 4 33 Co 0.45964617504897 0.66666666666667 0.17274281740610 58.933 > 4 34 Co 0.45964617504897 0.00000000000000 0.67274281740610 58.933 > 4 35 Co 0.45964617504897 0.33333333333333 0.67274281740610 58.933 > 4 36 Co 0.45964617504897 0.66666666666667 0.67274281740610 58.933 > 4 37 Co 0.54035382495103 0.00000000000000 0.32725718259390 58.933 > 3 38 Co 0.54035382495103 0.33333333333333 0.32725718259390 58.933 > 3 39 Co 0.54035382495103 0.66666666666667 0.32725718259390 58.933 > 3 40 Co 0.54035382495103 0.00000000000000 0.82725718259390 58.933 > 3 41 Co 0.54035382495103 0.33333333333333 0.82725718259390 58.933 > 3 42 Co 0.54035382495103 0.66666666666667 0.82725718259390 58.933 > 3 43 Co 0.95964617504897 0.16666666666667 0.17274281740610 58.933 > 4 44 Co 0.95964617504897 0.50000000000000 0.17274281740610 58.933 > 4 45 Co 0.95964617504897 0.83333333333333 0.17274281740610 58.933 > 4 46 Co 0.95964617504897 0.16666666666667 0.67274281740610 58.933 > 4 47 Co 0.95964617504897 0.50000000000000 0.67274281740610 58.933 > 4 48 Co 0.95964617504897 0.83333333333333 0.67274281740610 58.933 > 4 *49 N 0.36606359626484 0.00000000000000 0.26284836050921 14.007 > 5 50 N 0.36606359626484 0.33333333333333 0.26284836050921 14.007 > 5 51 N 0.36606359626484 0.66666666666667 0.26284836050921 14.007 > 5 52 N 0.36606359626484 0.00000000000000 0.76284836050921 14.007 > 5 53 N 0.36606359626484 0.33333333333333 0.76284836050921 14.007 > 5 54 N 0.36606359626484 0.66666666666667 0.76284836050921 14.007 > 5 55 N 0.13393640373516 0.16666666666667 0.23715163949079 14.007 > 6 56 N 0.13393640373516 0.50000000000000 0.23715163949079 14.007 > 6 57 N 0.13393640373516 0.83333333333333 0.23715163949079 14.007 > 6 58 N 0.13393640373516 0.16666666666667 0.73715163949079 14.007 > 6 59 N 0.13393640373516 0.50000000000000 0.73715163949079 14.007 > 6 60 N 0.13393640373516 0.83333333333333 0.73715163949079 14.007 > 6 *61 N 0.10547073611404 0.16666666666667 0.44038998190961 14.007 > 7 62 N 0.10547073611404 0.50000000000000 0.44038998190961 14.007 > 7 63 N 0.10547073611404 0.83333333333333 0.44038998190961 14.007 > 7 64 N 0.10547073611404 0.16666666666667 0.94038998190961 14.007 > 7 65 N 0.10547073611404 0.50000000000000 0.94038998190961 14.007 > 7 66 N 0.10547073611404 0.83333333333333 0.94038998190961 14.007 > 7 *67 N 0.35038635715023 0.00000000000000 0.47895474694718 14.007 > 8 68 N 0.35038635715023 0.33333333333333 0.47895474694718 14.007 > 8 69 N 0.35038635715023 0.66666666666667 0.47895474694718 14.007 > 8 70 N 0.35038635715023 0.00000000000000 0.97895474694718 14.007 > 8 71 N 0.35038635715023 0.33333333333333 0.97895474694718 14.007 > 8 72 N 0.35038635715023 0.66666666666667 0.97895474694718 14.007 > 8 73 N 0.39452926388596 0.00000000000000 0.05961001809039 14.007 > 9 74 N 0.39452926388596 0.33333333333333 0.05961001809039 14.007 > 9 75 N 0.39452926388596 0.66666666666667 0.05961001809039 14.007 > 9 76 N 0.39452926388596 0.00000000000000 0.55961001809039 14.007 > 9 77 N 0.39452926388596 0.33333333333333 0.55961001809039 14.007 > 9 78 N 0.39452926388596 0.66666666666667 0.55961001809039 14.007 > 9 79 N 0.14961364284977 0.16666666666667 0.02104525305282 14.007 > 10 80 N 0.14961364284977 0.50000000000000 0.02104525305282 14.007 > 10 81 N 0.14961364284977 0.83333333333333 0.02104525305282 14.007 > 10 82 N 0.14961364284977 0.16666666666667 0.52104525305282 14.007 > 10 83 N 0.14961364284977 0.50000000000000 0.52104525305282 14.007 > 10 84 N 0.14961364284977 0.83333333333333 0.52104525305282 14.007 > 10 85 N 0.86606359626484 0.16666666666667 0.26284836050921 14.007 > 5 86 N 0.86606359626484 0.50000000000000 0.26284836050921 14.007 > 5 87 N 0.86606359626484 0.83333333333333 0.26284836050921 14.007 > 5 88 N 0.86606359626484 0.16666666666667 0.76284836050921 14.007 > 5 89 N 0.86606359626484 0.50000000000000 0.76284836050921 14.007 > 5 90 N 0.86606359626484 0.83333333333333 0.76284836050921 14.007 > 5 91 N 0.63393640373516 0.00000000000000 0.23715163949079 14.007 > 6 92 N 0.63393640373516 0.33333333333333 0.23715163949079 14.007 > 6 93 N 0.63393640373516 0.66666666666667 0.23715163949079 14.007 > 6 94 N 0.63393640373516 0.00000000000000 0.73715163949079 14.007 > 6 95 N 0.63393640373516 0.33333333333333 0.73715163949079 14.007 > 6 96 N 0.63393640373516 0.66666666666667 0.73715163949079 14.007 > 6 97 N 0.60547073611404 0.00000000000000 0.44038998190961 14.007 > 7 98 N 0.60547073611404 0.33333333333333 0.44038998190961 14.007 > 7 99 N 0.60547073611404 0.66666666666667 0.44038998190961 14.007 > 7 100 N 0.60547073611404 0.00000000000000 0.94038998190961 14.007 > 7 101 N 0.60547073611404 0.33333333333333 0.94038998190961 14.007 > 7 102 N 0.60547073611404 0.66666666666667 0.94038998190961 14.007 > 7 103 N 0.85038635715023 0.16666666666667 0.47895474694718 14.007 > 8 104 N 0.85038635715023 0.50000000000000 0.47895474694718 14.007 > 8 105 N 0.85038635715023 0.83333333333333 0.47895474694718 14.007 > 8 106 N 0.85038635715023 0.16666666666667 0.97895474694718 14.007 > 8 107 N 0.85038635715023 0.50000000000000 0.97895474694718 14.007 > 8 108 N 0.85038635715023 0.83333333333333 0.97895474694718 14.007 > 8 109 N 0.89452926388596 0.16666666666667 0.05961001809039 14.007 > 9 110 N 0.89452926388596 0.50000000000000 0.05961001809039 14.007 > 9 111 N 0.89452926388596 0.83333333333333 0.05961001809039 14.007 > 9 112 N 0.89452926388596 0.16666666666667 0.55961001809039 14.007 > 9 113 N 0.89452926388596 0.50000000000000 0.55961001809039 14.007 > 9 114 N 0.89452926388596 0.83333333333333 0.55961001809039 14.007 > 9 115 N 0.64961364284977 0.00000000000000 0.02104525305282 14.007 > 10 116 N 0.64961364284977 0.33333333333333 0.02104525305282 14.007 > 10 117 N 0.64961364284977 0.66666666666667 0.02104525305282 14.007 > 10 118 N 0.64961364284977 0.00000000000000 0.52104525305282 14.007 > 10 119 N 0.64961364284977 0.33333333333333 0.52104525305282 14.007 > 10 120 N 0.64961364284977 0.66666666666667 0.52104525305282 14.007 > 10 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 13.8805253 0.0000000 -0.1269736 0.0000000 9.6742446 0.0000000 -0.1269066 0.0000000 19.6892432 -------------------------- Born effective charges -------------------------- 1 La 4.6814490 0.0000000 -0.0527101 0.0000000 4.8139935 0.0000000 0.0796430 0.0000000 4.1307252 2 La 4.6814490 0.0000000 -0.0527101 0.0000000 4.8139935 0.0000000 0.0796430 0.0000000 4.1307252 3 Co -0.4330114 0.0000000 -0.2921636 0.0000000 -1.3243728 0.0000000 -0.1903787 0.0000000 -2.8347746 4 Co -0.4330114 0.0000000 -0.2921636 0.0000000 -1.3243728 0.0000000 -0.1903787 0.0000000 -2.8347746 5 N -3.9737606 0.0000000 0.2082966 0.0000000 -2.3562888 0.0000000 0.0937230 0.0000000 -1.4646348 6 N -3.9737606 0.0000000 0.2082966 0.0000000 -2.3562888 0.0000000 0.0937230 0.0000000 -1.4646348 7 N 0.6663472 0.0000000 1.2353885 0.0000000 -0.1506500 0.0000000 0.7816923 0.0000000 7.0190799 8 N -0.9410242 0.0000000 -1.0988114 0.0000000 -0.9826819 0.0000000 -0.7646796 0.0000000 -6.8503956 9 N 0.6663472 0.0000000 1.2353885 0.0000000 -0.1506500 0.0000000 0.7816923 0.0000000 7.0190799 10 N -0.9410242 0.0000000 -1.0988114 0.0000000 -0.9826819 0.0000000 -0.7646796 0.0000000 -6.8503956 ---------------------------------------------------------------------------- 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: 360/360 Permutation basis: 6798/6798 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1520 Number of blocks in projector: 1520 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 400 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 240 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 240 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 240 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 200 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 200 Use standard eigh solver. Tree of FC basis block matrices: - (1520, 1496), data: False |-- (200, 200), data: True |-- (200, 200), data: True |-- (240, 235), data: True |-- (240, 235), data: True |-- (240, 235), data: True |-- (400, 391), data: True ----- Solver_atoms: 1 -- 120 / 120 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 100 / 320 - Time: 2.209 Solver_block: 200 / 320 - Time: 2.193 Solver_block: 300 / 320 - Time: 2.197 Solver_block: 320 / 320 - Time: 0.535 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 7.168 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (zz) -0.00000000 (zz) Permutation basis: 360/360 Permutation basis: 6798/6798 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1520 Number of blocks in projector: 1520 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 400 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 240 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 240 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 240 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 200 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 200 Use standard eigh solver. Tree of FC basis block matrices: - (1520, 1496), data: False |-- (200, 200), data: True |-- (200, 200), data: True |-- (240, 235), data: True |-- (240, 235), data: True |-- (240, 235), data: True |-- (400, 391), data: True Max drift after symmetrization by symfc projector: -0.00000000 (zz) -0.00000000 (zz) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-09 04:54:10]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 04:54:11]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 3 2] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.298323150112258 -2.002355430000000 0.000000000000000 b 5.298323150112258 2.002355430000000 0.000000000000000 c -1.630190614868080 0.000000000000000 7.210138562052552 Atomic positions (fractional): 1 La 0.83497740602548 0.83497740602548 0.70063442526968 138.905 2 La 0.16502259397452 0.16502259397452 0.29936557473032 138.905 3 Co 0.54035382495103 0.54035382495103 0.65451436518780 58.933 4 Co 0.45964617504897 0.45964617504897 0.34548563481220 58.933 5 N 0.36606359626484 0.36606359626484 0.52569672101843 14.007 6 N 0.63393640373516 0.63393640373516 0.47430327898157 14.007 7 N 0.60547073611404 0.60547073611404 0.88077996381923 14.007 8 N 0.35038635715023 0.35038635715023 0.95790949389436 14.007 9 N 0.39452926388596 0.39452926388596 0.11922003618077 14.007 10 N 0.64961364284977 0.64961364284977 0.04209050610564 14.007 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.596646300224515 0.000000000000000 0.000000000000000 b 0.000000000000000 12.014132580000002 0.000000000000000 c -3.260381229736160 0.000000000000000 14.420277124105104 Atomic positions (fractional): 1 La 0.33497740602548 0.16666666666667 0.35031721263484 138.905 > 1 2 La 0.33497740602548 0.50000000000000 0.35031721263484 138.905 > 1 3 La 0.33497740602548 0.83333333333333 0.35031721263484 138.905 > 1 4 La 0.33497740602548 0.16666666666667 0.85031721263484 138.905 > 1 5 La 0.33497740602548 0.50000000000000 0.85031721263484 138.905 > 1 6 La 0.33497740602548 0.83333333333333 0.85031721263484 138.905 > 1 7 La 0.16502259397452 0.00000000000000 0.14968278736516 138.905 > 7 8 La 0.16502259397452 0.33333333333333 0.14968278736516 138.905 > 7 9 La 0.16502259397452 0.66666666666667 0.14968278736516 138.905 > 7 10 La 0.16502259397452 0.00000000000000 0.64968278736516 138.905 > 7 11 La 0.16502259397452 0.33333333333333 0.64968278736516 138.905 > 7 12 La 0.16502259397452 0.66666666666667 0.64968278736516 138.905 > 7 13 La 0.83497740602548 0.00000000000000 0.35031721263484 138.905 > 1 14 La 0.83497740602548 0.33333333333333 0.35031721263484 138.905 > 1 15 La 0.83497740602548 0.66666666666667 0.35031721263484 138.905 > 1 16 La 0.83497740602548 0.00000000000000 0.85031721263484 138.905 > 1 17 La 0.83497740602548 0.33333333333333 0.85031721263484 138.905 > 1 18 La 0.83497740602548 0.66666666666667 0.85031721263484 138.905 > 1 19 La 0.66502259397452 0.16666666666667 0.14968278736516 138.905 > 7 20 La 0.66502259397452 0.50000000000000 0.14968278736516 138.905 > 7 21 La 0.66502259397452 0.83333333333333 0.14968278736516 138.905 > 7 22 La 0.66502259397452 0.16666666666667 0.64968278736516 138.905 > 7 23 La 0.66502259397452 0.50000000000000 0.64968278736516 138.905 > 7 24 La 0.66502259397452 0.83333333333333 0.64968278736516 138.905 > 7 25 Co 0.04035382495103 0.16666666666667 0.32725718259390 58.933 > 25 26 Co 0.04035382495103 0.50000000000000 0.32725718259390 58.933 > 25 27 Co 0.04035382495103 0.83333333333333 0.32725718259390 58.933 > 25 28 Co 0.04035382495103 0.16666666666667 0.82725718259390 58.933 > 25 29 Co 0.04035382495103 0.50000000000000 0.82725718259390 58.933 > 25 30 Co 0.04035382495103 0.83333333333333 0.82725718259390 58.933 > 25 31 Co 0.45964617504897 0.00000000000000 0.17274281740610 58.933 > 31 32 Co 0.45964617504897 0.33333333333333 0.17274281740610 58.933 > 31 33 Co 0.45964617504897 0.66666666666667 0.17274281740610 58.933 > 31 34 Co 0.45964617504897 0.00000000000000 0.67274281740610 58.933 > 31 35 Co 0.45964617504897 0.33333333333333 0.67274281740610 58.933 > 31 36 Co 0.45964617504897 0.66666666666667 0.67274281740610 58.933 > 31 37 Co 0.54035382495103 0.00000000000000 0.32725718259390 58.933 > 25 38 Co 0.54035382495103 0.33333333333333 0.32725718259390 58.933 > 25 39 Co 0.54035382495103 0.66666666666667 0.32725718259390 58.933 > 25 40 Co 0.54035382495103 0.00000000000000 0.82725718259390 58.933 > 25 41 Co 0.54035382495103 0.33333333333333 0.82725718259390 58.933 > 25 42 Co 0.54035382495103 0.66666666666667 0.82725718259390 58.933 > 25 43 Co 0.95964617504897 0.16666666666667 0.17274281740610 58.933 > 31 44 Co 0.95964617504897 0.50000000000000 0.17274281740610 58.933 > 31 45 Co 0.95964617504897 0.83333333333333 0.17274281740610 58.933 > 31 46 Co 0.95964617504897 0.16666666666667 0.67274281740610 58.933 > 31 47 Co 0.95964617504897 0.50000000000000 0.67274281740610 58.933 > 31 48 Co 0.95964617504897 0.83333333333333 0.67274281740610 58.933 > 31 49 N 0.36606359626484 0.00000000000000 0.26284836050921 14.007 > 49 50 N 0.36606359626484 0.33333333333333 0.26284836050921 14.007 > 49 51 N 0.36606359626484 0.66666666666667 0.26284836050921 14.007 > 49 52 N 0.36606359626484 0.00000000000000 0.76284836050921 14.007 > 49 53 N 0.36606359626484 0.33333333333333 0.76284836050921 14.007 > 49 54 N 0.36606359626484 0.66666666666667 0.76284836050921 14.007 > 49 55 N 0.13393640373516 0.16666666666667 0.23715163949079 14.007 > 55 56 N 0.13393640373516 0.50000000000000 0.23715163949079 14.007 > 55 57 N 0.13393640373516 0.83333333333333 0.23715163949079 14.007 > 55 58 N 0.13393640373516 0.16666666666667 0.73715163949079 14.007 > 55 59 N 0.13393640373516 0.50000000000000 0.73715163949079 14.007 > 55 60 N 0.13393640373516 0.83333333333333 0.73715163949079 14.007 > 55 61 N 0.10547073611404 0.16666666666667 0.44038998190961 14.007 > 61 62 N 0.10547073611404 0.50000000000000 0.44038998190961 14.007 > 61 63 N 0.10547073611404 0.83333333333333 0.44038998190961 14.007 > 61 64 N 0.10547073611404 0.16666666666667 0.94038998190961 14.007 > 61 65 N 0.10547073611404 0.50000000000000 0.94038998190961 14.007 > 61 66 N 0.10547073611404 0.83333333333333 0.94038998190961 14.007 > 61 67 N 0.35038635715023 0.00000000000000 0.47895474694718 14.007 > 67 68 N 0.35038635715023 0.33333333333333 0.47895474694718 14.007 > 67 69 N 0.35038635715023 0.66666666666667 0.47895474694718 14.007 > 67 70 N 0.35038635715023 0.00000000000000 0.97895474694718 14.007 > 67 71 N 0.35038635715023 0.33333333333333 0.97895474694718 14.007 > 67 72 N 0.35038635715023 0.66666666666667 0.97895474694718 14.007 > 67 73 N 0.39452926388596 0.00000000000000 0.05961001809039 14.007 > 73 74 N 0.39452926388596 0.33333333333333 0.05961001809039 14.007 > 73 75 N 0.39452926388596 0.66666666666667 0.05961001809039 14.007 > 73 76 N 0.39452926388596 0.00000000000000 0.55961001809039 14.007 > 73 77 N 0.39452926388596 0.33333333333333 0.55961001809039 14.007 > 73 78 N 0.39452926388596 0.66666666666667 0.55961001809039 14.007 > 73 79 N 0.14961364284977 0.16666666666667 0.02104525305282 14.007 > 79 80 N 0.14961364284977 0.50000000000000 0.02104525305282 14.007 > 79 81 N 0.14961364284977 0.83333333333333 0.02104525305282 14.007 > 79 82 N 0.14961364284977 0.16666666666667 0.52104525305282 14.007 > 79 83 N 0.14961364284977 0.50000000000000 0.52104525305282 14.007 > 79 84 N 0.14961364284977 0.83333333333333 0.52104525305282 14.007 > 79 85 N 0.86606359626484 0.16666666666667 0.26284836050921 14.007 > 49 86 N 0.86606359626484 0.50000000000000 0.26284836050921 14.007 > 49 87 N 0.86606359626484 0.83333333333333 0.26284836050921 14.007 > 49 88 N 0.86606359626484 0.16666666666667 0.76284836050921 14.007 > 49 89 N 0.86606359626484 0.50000000000000 0.76284836050921 14.007 > 49 90 N 0.86606359626484 0.83333333333333 0.76284836050921 14.007 > 49 91 N 0.63393640373516 0.00000000000000 0.23715163949079 14.007 > 55 92 N 0.63393640373516 0.33333333333333 0.23715163949079 14.007 > 55 93 N 0.63393640373516 0.66666666666667 0.23715163949079 14.007 > 55 94 N 0.63393640373516 0.00000000000000 0.73715163949079 14.007 > 55 95 N 0.63393640373516 0.33333333333333 0.73715163949079 14.007 > 55 96 N 0.63393640373516 0.66666666666667 0.73715163949079 14.007 > 55 97 N 0.60547073611404 0.00000000000000 0.44038998190961 14.007 > 61 98 N 0.60547073611404 0.33333333333333 0.44038998190961 14.007 > 61 99 N 0.60547073611404 0.66666666666667 0.44038998190961 14.007 > 61 100 N 0.60547073611404 0.00000000000000 0.94038998190961 14.007 > 61 101 N 0.60547073611404 0.33333333333333 0.94038998190961 14.007 > 61 102 N 0.60547073611404 0.66666666666667 0.94038998190961 14.007 > 61 103 N 0.85038635715023 0.16666666666667 0.47895474694718 14.007 > 67 104 N 0.85038635715023 0.50000000000000 0.47895474694718 14.007 > 67 105 N 0.85038635715023 0.83333333333333 0.47895474694718 14.007 > 67 106 N 0.85038635715023 0.16666666666667 0.97895474694718 14.007 > 67 107 N 0.85038635715023 0.50000000000000 0.97895474694718 14.007 > 67 108 N 0.85038635715023 0.83333333333333 0.97895474694718 14.007 > 67 109 N 0.89452926388596 0.16666666666667 0.05961001809039 14.007 > 73 110 N 0.89452926388596 0.50000000000000 0.05961001809039 14.007 > 73 111 N 0.89452926388596 0.83333333333333 0.05961001809039 14.007 > 73 112 N 0.89452926388596 0.16666666666667 0.55961001809039 14.007 > 73 113 N 0.89452926388596 0.50000000000000 0.55961001809039 14.007 > 73 114 N 0.89452926388596 0.83333333333333 0.55961001809039 14.007 > 73 115 N 0.64961364284977 0.00000000000000 0.02104525305282 14.007 > 79 116 N 0.64961364284977 0.33333333333333 0.02104525305282 14.007 > 79 117 N 0.64961364284977 0.66666666666667 0.02104525305282 14.007 > 79 118 N 0.64961364284977 0.00000000000000 0.52104525305282 14.007 > 79 119 N 0.64961364284977 0.33333333333333 0.52104525305282 14.007 > 79 120 N 0.64961364284977 0.66666666666667 0.52104525305282 14.007 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 13.8805253 0.0000000 -0.1269736 0.0000000 9.6742446 0.0000000 -0.1269066 0.0000000 19.6892432 -------------------------- Born effective charges -------------------------- 1 La 4.6814490 0.0000000 -0.0527101 0.0000000 4.8139935 0.0000000 0.0796430 0.0000000 4.1307252 2 La 4.6814490 0.0000000 -0.0527101 0.0000000 4.8139935 0.0000000 0.0796430 0.0000000 4.1307252 3 Co -0.4330114 0.0000000 -0.2921636 0.0000000 -1.3243728 0.0000000 -0.1903787 0.0000000 -2.8347746 4 Co -0.4330114 0.0000000 -0.2921636 0.0000000 -1.3243728 0.0000000 -0.1903787 0.0000000 -2.8347746 5 N -3.9737606 0.0000000 0.2082966 0.0000000 -2.3562888 0.0000000 0.0937230 0.0000000 -1.4646348 6 N -3.9737606 0.0000000 0.2082966 0.0000000 -2.3562888 0.0000000 0.0937230 0.0000000 -1.4646348 7 N 0.6663472 0.0000000 1.2353885 0.0000000 -0.1506500 0.0000000 0.7816923 0.0000000 7.0190799 8 N -0.9410242 0.0000000 -1.0988114 0.0000000 -0.9826819 0.0000000 -0.7646796 0.0000000 -6.8503956 9 N 0.6663472 0.0000000 1.2353885 0.0000000 -0.1506500 0.0000000 0.7816923 0.0000000 7.0190799 10 N -0.9410242 0.0000000 -1.0988114 0.0000000 -0.9826819 0.0000000 -0.7646796 0.0000000 -6.8503956 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0022 0.0000 0.0098] [ 0.0022 0.0000 -0.0098] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0022 0.0000 0.0098] [ 0.0022 0.0000 -0.0098] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0022 0.0000 0.0098] [ 0.0022 0.0000 -0.0098] Computing fc3[ 61, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0022 0.0000 0.0098] [ 0.0022 0.0000 -0.0098] Computing fc3[ 67, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0022 0.0000 0.0098] [ 0.0022 0.0000 -0.0098] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000185 (xxx) -0.00000185 (xxx) -0.00000185 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000002 (xz) 0.00000002 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 04:54:28]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 04:54:29]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 3 2] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.298323150112258 -2.002355430000000 0.000000000000000 b 5.298323150112258 2.002355430000000 0.000000000000000 c -1.630190614868080 0.000000000000000 7.210138562052552 Atomic positions (fractional): 1 La 0.83497740602548 0.83497740602548 0.70063442526968 138.905 2 La 0.16502259397452 0.16502259397452 0.29936557473032 138.905 3 Co 0.54035382495103 0.54035382495103 0.65451436518780 58.933 4 Co 0.45964617504897 0.45964617504897 0.34548563481220 58.933 5 N 0.36606359626484 0.36606359626484 0.52569672101843 14.007 6 N 0.63393640373516 0.63393640373516 0.47430327898157 14.007 7 N 0.60547073611404 0.60547073611404 0.88077996381923 14.007 8 N 0.35038635715023 0.35038635715023 0.95790949389436 14.007 9 N 0.39452926388596 0.39452926388596 0.11922003618077 14.007 10 N 0.64961364284977 0.64961364284977 0.04209050610564 14.007 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.596646300224515 0.000000000000000 0.000000000000000 b 0.000000000000000 12.014132580000002 0.000000000000000 c -3.260381229736160 0.000000000000000 14.420277124105104 Atomic positions (fractional): 1 La 0.33497740602548 0.16666666666667 0.35031721263484 138.905 > 1 2 La 0.33497740602548 0.50000000000000 0.35031721263484 138.905 > 1 3 La 0.33497740602548 0.83333333333333 0.35031721263484 138.905 > 1 4 La 0.33497740602548 0.16666666666667 0.85031721263484 138.905 > 1 5 La 0.33497740602548 0.50000000000000 0.85031721263484 138.905 > 1 6 La 0.33497740602548 0.83333333333333 0.85031721263484 138.905 > 1 7 La 0.16502259397452 0.00000000000000 0.14968278736516 138.905 > 7 8 La 0.16502259397452 0.33333333333333 0.14968278736516 138.905 > 7 9 La 0.16502259397452 0.66666666666667 0.14968278736516 138.905 > 7 10 La 0.16502259397452 0.00000000000000 0.64968278736516 138.905 > 7 11 La 0.16502259397452 0.33333333333333 0.64968278736516 138.905 > 7 12 La 0.16502259397452 0.66666666666667 0.64968278736516 138.905 > 7 13 La 0.83497740602548 0.00000000000000 0.35031721263484 138.905 > 1 14 La 0.83497740602548 0.33333333333333 0.35031721263484 138.905 > 1 15 La 0.83497740602548 0.66666666666667 0.35031721263484 138.905 > 1 16 La 0.83497740602548 0.00000000000000 0.85031721263484 138.905 > 1 17 La 0.83497740602548 0.33333333333333 0.85031721263484 138.905 > 1 18 La 0.83497740602548 0.66666666666667 0.85031721263484 138.905 > 1 19 La 0.66502259397452 0.16666666666667 0.14968278736516 138.905 > 7 20 La 0.66502259397452 0.50000000000000 0.14968278736516 138.905 > 7 21 La 0.66502259397452 0.83333333333333 0.14968278736516 138.905 > 7 22 La 0.66502259397452 0.16666666666667 0.64968278736516 138.905 > 7 23 La 0.66502259397452 0.50000000000000 0.64968278736516 138.905 > 7 24 La 0.66502259397452 0.83333333333333 0.64968278736516 138.905 > 7 25 Co 0.04035382495103 0.16666666666667 0.32725718259390 58.933 > 25 26 Co 0.04035382495103 0.50000000000000 0.32725718259390 58.933 > 25 27 Co 0.04035382495103 0.83333333333333 0.32725718259390 58.933 > 25 28 Co 0.04035382495103 0.16666666666667 0.82725718259390 58.933 > 25 29 Co 0.04035382495103 0.50000000000000 0.82725718259390 58.933 > 25 30 Co 0.04035382495103 0.83333333333333 0.82725718259390 58.933 > 25 31 Co 0.45964617504897 0.00000000000000 0.17274281740610 58.933 > 31 32 Co 0.45964617504897 0.33333333333333 0.17274281740610 58.933 > 31 33 Co 0.45964617504897 0.66666666666667 0.17274281740610 58.933 > 31 34 Co 0.45964617504897 0.00000000000000 0.67274281740610 58.933 > 31 35 Co 0.45964617504897 0.33333333333333 0.67274281740610 58.933 > 31 36 Co 0.45964617504897 0.66666666666667 0.67274281740610 58.933 > 31 37 Co 0.54035382495103 0.00000000000000 0.32725718259390 58.933 > 25 38 Co 0.54035382495103 0.33333333333333 0.32725718259390 58.933 > 25 39 Co 0.54035382495103 0.66666666666667 0.32725718259390 58.933 > 25 40 Co 0.54035382495103 0.00000000000000 0.82725718259390 58.933 > 25 41 Co 0.54035382495103 0.33333333333333 0.82725718259390 58.933 > 25 42 Co 0.54035382495103 0.66666666666667 0.82725718259390 58.933 > 25 43 Co 0.95964617504897 0.16666666666667 0.17274281740610 58.933 > 31 44 Co 0.95964617504897 0.50000000000000 0.17274281740610 58.933 > 31 45 Co 0.95964617504897 0.83333333333333 0.17274281740610 58.933 > 31 46 Co 0.95964617504897 0.16666666666667 0.67274281740610 58.933 > 31 47 Co 0.95964617504897 0.50000000000000 0.67274281740610 58.933 > 31 48 Co 0.95964617504897 0.83333333333333 0.67274281740610 58.933 > 31 49 N 0.36606359626484 0.00000000000000 0.26284836050921 14.007 > 49 50 N 0.36606359626484 0.33333333333333 0.26284836050921 14.007 > 49 51 N 0.36606359626484 0.66666666666667 0.26284836050921 14.007 > 49 52 N 0.36606359626484 0.00000000000000 0.76284836050921 14.007 > 49 53 N 0.36606359626484 0.33333333333333 0.76284836050921 14.007 > 49 54 N 0.36606359626484 0.66666666666667 0.76284836050921 14.007 > 49 55 N 0.13393640373516 0.16666666666667 0.23715163949079 14.007 > 55 56 N 0.13393640373516 0.50000000000000 0.23715163949079 14.007 > 55 57 N 0.13393640373516 0.83333333333333 0.23715163949079 14.007 > 55 58 N 0.13393640373516 0.16666666666667 0.73715163949079 14.007 > 55 59 N 0.13393640373516 0.50000000000000 0.73715163949079 14.007 > 55 60 N 0.13393640373516 0.83333333333333 0.73715163949079 14.007 > 55 61 N 0.10547073611404 0.16666666666667 0.44038998190961 14.007 > 61 62 N 0.10547073611404 0.50000000000000 0.44038998190961 14.007 > 61 63 N 0.10547073611404 0.83333333333333 0.44038998190961 14.007 > 61 64 N 0.10547073611404 0.16666666666667 0.94038998190961 14.007 > 61 65 N 0.10547073611404 0.50000000000000 0.94038998190961 14.007 > 61 66 N 0.10547073611404 0.83333333333333 0.94038998190961 14.007 > 61 67 N 0.35038635715023 0.00000000000000 0.47895474694718 14.007 > 67 68 N 0.35038635715023 0.33333333333333 0.47895474694718 14.007 > 67 69 N 0.35038635715023 0.66666666666667 0.47895474694718 14.007 > 67 70 N 0.35038635715023 0.00000000000000 0.97895474694718 14.007 > 67 71 N 0.35038635715023 0.33333333333333 0.97895474694718 14.007 > 67 72 N 0.35038635715023 0.66666666666667 0.97895474694718 14.007 > 67 73 N 0.39452926388596 0.00000000000000 0.05961001809039 14.007 > 73 74 N 0.39452926388596 0.33333333333333 0.05961001809039 14.007 > 73 75 N 0.39452926388596 0.66666666666667 0.05961001809039 14.007 > 73 76 N 0.39452926388596 0.00000000000000 0.55961001809039 14.007 > 73 77 N 0.39452926388596 0.33333333333333 0.55961001809039 14.007 > 73 78 N 0.39452926388596 0.66666666666667 0.55961001809039 14.007 > 73 79 N 0.14961364284977 0.16666666666667 0.02104525305282 14.007 > 79 80 N 0.14961364284977 0.50000000000000 0.02104525305282 14.007 > 79 81 N 0.14961364284977 0.83333333333333 0.02104525305282 14.007 > 79 82 N 0.14961364284977 0.16666666666667 0.52104525305282 14.007 > 79 83 N 0.14961364284977 0.50000000000000 0.52104525305282 14.007 > 79 84 N 0.14961364284977 0.83333333333333 0.52104525305282 14.007 > 79 85 N 0.86606359626484 0.16666666666667 0.26284836050921 14.007 > 49 86 N 0.86606359626484 0.50000000000000 0.26284836050921 14.007 > 49 87 N 0.86606359626484 0.83333333333333 0.26284836050921 14.007 > 49 88 N 0.86606359626484 0.16666666666667 0.76284836050921 14.007 > 49 89 N 0.86606359626484 0.50000000000000 0.76284836050921 14.007 > 49 90 N 0.86606359626484 0.83333333333333 0.76284836050921 14.007 > 49 91 N 0.63393640373516 0.00000000000000 0.23715163949079 14.007 > 55 92 N 0.63393640373516 0.33333333333333 0.23715163949079 14.007 > 55 93 N 0.63393640373516 0.66666666666667 0.23715163949079 14.007 > 55 94 N 0.63393640373516 0.00000000000000 0.73715163949079 14.007 > 55 95 N 0.63393640373516 0.33333333333333 0.73715163949079 14.007 > 55 96 N 0.63393640373516 0.66666666666667 0.73715163949079 14.007 > 55 97 N 0.60547073611404 0.00000000000000 0.44038998190961 14.007 > 61 98 N 0.60547073611404 0.33333333333333 0.44038998190961 14.007 > 61 99 N 0.60547073611404 0.66666666666667 0.44038998190961 14.007 > 61 100 N 0.60547073611404 0.00000000000000 0.94038998190961 14.007 > 61 101 N 0.60547073611404 0.33333333333333 0.94038998190961 14.007 > 61 102 N 0.60547073611404 0.66666666666667 0.94038998190961 14.007 > 61 103 N 0.85038635715023 0.16666666666667 0.47895474694718 14.007 > 67 104 N 0.85038635715023 0.50000000000000 0.47895474694718 14.007 > 67 105 N 0.85038635715023 0.83333333333333 0.47895474694718 14.007 > 67 106 N 0.85038635715023 0.16666666666667 0.97895474694718 14.007 > 67 107 N 0.85038635715023 0.50000000000000 0.97895474694718 14.007 > 67 108 N 0.85038635715023 0.83333333333333 0.97895474694718 14.007 > 67 109 N 0.89452926388596 0.16666666666667 0.05961001809039 14.007 > 73 110 N 0.89452926388596 0.50000000000000 0.05961001809039 14.007 > 73 111 N 0.89452926388596 0.83333333333333 0.05961001809039 14.007 > 73 112 N 0.89452926388596 0.16666666666667 0.55961001809039 14.007 > 73 113 N 0.89452926388596 0.50000000000000 0.55961001809039 14.007 > 73 114 N 0.89452926388596 0.83333333333333 0.55961001809039 14.007 > 73 115 N 0.64961364284977 0.00000000000000 0.02104525305282 14.007 > 79 116 N 0.64961364284977 0.33333333333333 0.02104525305282 14.007 > 79 117 N 0.64961364284977 0.66666666666667 0.02104525305282 14.007 > 79 118 N 0.64961364284977 0.00000000000000 0.52104525305282 14.007 > 79 119 N 0.64961364284977 0.33333333333333 0.52104525305282 14.007 > 79 120 N 0.64961364284977 0.66666666666667 0.52104525305282 14.007 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 13.8805253 0.0000000 -0.1269736 0.0000000 9.6742446 0.0000000 -0.1269066 0.0000000 19.6892432 -------------------------- Born effective charges -------------------------- 1 La 4.6814490 0.0000000 -0.0527101 0.0000000 4.8139935 0.0000000 0.0796430 0.0000000 4.1307252 2 La 4.6814490 0.0000000 -0.0527101 0.0000000 4.8139935 0.0000000 0.0796430 0.0000000 4.1307252 3 Co -0.4330114 0.0000000 -0.2921636 0.0000000 -1.3243728 0.0000000 -0.1903787 0.0000000 -2.8347746 4 Co -0.4330114 0.0000000 -0.2921636 0.0000000 -1.3243728 0.0000000 -0.1903787 0.0000000 -2.8347746 5 N -3.9737606 0.0000000 0.2082966 0.0000000 -2.3562888 0.0000000 0.0937230 0.0000000 -1.4646348 6 N -3.9737606 0.0000000 0.2082966 0.0000000 -2.3562888 0.0000000 0.0937230 0.0000000 -1.4646348 7 N 0.6663472 0.0000000 1.2353885 0.0000000 -0.1506500 0.0000000 0.7816923 0.0000000 7.0190799 8 N -0.9410242 0.0000000 -1.0988114 0.0000000 -0.9826819 0.0000000 -0.7646796 0.0000000 -6.8503956 9 N 0.6663472 0.0000000 1.2353885 0.0000000 -0.1506500 0.0000000 0.7816923 0.0000000 7.0190799 10 N -0.9410242 0.0000000 -1.0988114 0.0000000 -0.9826819 0.0000000 -0.7646796 0.0000000 -6.8503956 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000185 (xxx) -0.00000185 (xxx) -0.00000185 (xxx) Max drift of fc2: -0.00000000 (zz) -0.00000000 (zz) --------------------------- 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 ... [ 13 13 7 ] 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: 0.78, Number of G-points: 307, Lambda: 0.31 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/322) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.877 ( 0.000 0.000 0.000) 0.000 3.065 ( 0.000 0.000 0.000) 0.000 3.362 ( 0.000 0.000 0.000) 0.000 3.870 ( 0.000 0.000 0.000) 0.000 4.125 ( 0.000 0.000 0.000) 0.000 4.638 ( 0.000 0.000 0.000) 0.000 4.856 ( 0.000 0.000 0.000) 0.000 4.962 ( 0.000 0.000 0.000) 0.000 5.699 ( 0.000 0.000 0.000) 0.000 5.787 ( 0.000 0.000 0.000) 0.000 5.995 ( 0.000 0.000 0.000) 0.000 7.201 ( 0.000 0.000 0.000) 0.000 8.701 ( 0.000 0.000 0.000) 0.000 9.761 ( 0.000 0.000 0.000) 0.000 10.805 ( 0.000 0.000 0.000) 0.000 13.095 ( 0.000 0.000 0.000) 0.000 14.413 ( 0.000 0.000 0.000) 0.000 14.481 ( 0.000 0.000 0.000) 0.000 14.772 ( 0.000 0.000 0.000) 0.000 15.587 ( 0.000 0.000 0.000) 0.000 16.414 ( 0.000 0.000 0.000) 0.000 17.797 ( 0.000 0.000 0.000) 0.000 19.543 ( 0.000 0.000 0.000) 0.000 19.854 ( 0.000 0.000 0.000) 0.000 21.275 ( 0.000 0.000 0.000) 0.000 55.363 ( 0.000 0.000 0.000) 0.000 57.715 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/322) ======================= q-point: ( 0.08 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.355 ( 4.953 -17.117 -0.102) 17.820 0.415 ( 22.332 -12.241 7.020) 26.416 0.868 ( 13.190 -38.864 1.952) 41.088 2.848 ( -0.141 2.807 -0.424) 2.842 3.076 ( 0.287 0.445 -0.950) 1.088 3.380 ( -1.458 -4.564 -0.235) 4.798 3.919 ( 2.950 -2.248 -1.923) 4.177 4.600 ( -4.691 1.931 -4.178) 6.571 4.753 ( -9.747 1.468 -7.899) 12.631 4.906 ( -10.271 -1.334 -1.082) 10.413 5.081 ( -19.754 -12.403 5.445) 23.952 5.717 ( -0.244 -1.638 -0.709) 1.801 5.808 ( 3.310 -0.885 -1.498) 3.739 6.216 ( 37.754 14.708 3.545) 40.672 7.186 ( -2.159 0.684 -0.020) 2.265 8.701 ( -0.085 0.026 0.168) 0.190 9.825 ( 0.285 -6.622 -0.542) 6.650 11.822 ( -57.822 -24.239 -14.818) 64.424 13.085 ( 0.107 1.074 0.456) 1.171 14.413 ( 0.529 0.109 -0.442) 0.698 14.483 ( 0.104 -0.036 0.642) 0.651 14.940 ( 30.401 9.862 -11.557) 33.986 15.668 ( 14.167 4.973 11.263) 18.769 16.418 ( 2.685 0.535 0.295) 2.753 17.810 ( 14.221 8.255 -7.063) 17.896 19.530 ( -0.371 1.144 -0.451) 1.285 19.853 ( 0.060 0.134 -0.663) 0.679 21.257 ( -1.984 1.120 0.400) 2.313 55.440 ( 6.987 6.655 49.506) 50.438 57.658 ( -2.183 5.013 0.000) 5.468 ======================= Grid point 2 (3/322) ======================= q-point: ( 0.15 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.730 ( 5.103 -17.989 -1.044) 18.727 0.809 ( 19.502 -11.355 7.669) 23.834 1.655 ( 13.994 -30.678 3.815) 33.934 2.786 ( -0.129 1.881 -3.014) 3.556 3.029 ( 2.350 4.344 0.839) 5.010 3.549 ( -1.339 -13.162 -1.735) 13.343 3.967 ( -1.336 -1.904 -2.696) 3.561 4.480 ( -9.253 3.784 -4.586) 10.999 4.635 ( -4.644 4.637 -4.326) 7.860 4.873 ( 0.030 0.756 0.937) 1.204 5.172 ( -8.466 -6.497 6.963) 12.743 5.744 ( -2.025 -2.240 -3.824) 4.873 5.849 ( 6.157 0.538 -1.355) 6.327 6.216 ( 14.121 5.481 5.197) 16.014 7.145 ( -3.950 1.265 -0.094) 4.149 8.697 ( -0.306 0.200 -0.510) 0.628 10.017 ( 0.735 -12.905 -0.283) 12.929 11.856 ( -29.758 -14.189 -6.880) 33.678 13.061 ( 0.400 1.670 0.910) 1.944 14.417 ( 0.931 -0.051 -0.714) 1.174 14.484 ( 0.074 0.123 0.932) 0.943 14.951 ( 12.831 3.958 -6.940) 15.115 15.708 ( 6.449 0.149 5.086) 8.215 16.434 ( 5.099 0.819 0.469) 5.186 17.717 ( 9.731 9.280 -3.646) 13.932 19.491 ( -0.901 2.362 -0.926) 2.692 19.848 ( -0.070 0.211 -0.851) 0.880 21.208 ( -3.477 1.896 0.726) 4.026 55.449 ( 5.271 3.244 24.817) 25.578 57.497 ( -4.090 9.094 -0.188) 9.973 ======================= Grid point 3 (4/322) ======================= q-point: ( 0.23 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.086 ( 10.398 -11.843 -5.138) 16.577 1.160 ( 9.954 -13.415 9.937) 19.436 2.146 ( 12.784 -6.683 5.768) 15.536 2.874 ( 3.971 -12.468 -7.262) 14.965 2.987 ( 3.799 1.219 5.672) 6.935 3.794 ( -1.290 -10.804 -5.421) 12.156 3.967 ( -5.835 -3.160 -1.415) 6.785 4.332 ( -10.122 3.332 -5.813) 12.138 4.494 ( -0.506 7.128 0.985) 7.214 4.873 ( 3.067 0.841 -0.612) 3.238 5.229 ( -6.391 -3.834 7.927) 10.880 5.761 ( -2.026 -2.046 -7.196) 7.751 5.861 ( 5.320 2.280 -0.541) 5.813 6.227 ( 6.256 2.214 6.693) 9.425 7.083 ( -4.895 1.617 -0.207) 5.159 8.686 ( -0.564 0.407 -1.616) 1.759 10.317 ( 1.128 -17.034 0.546) 17.080 11.912 ( -19.763 -11.264 -3.924) 23.083 13.035 ( 0.863 1.569 1.262) 2.191 14.426 ( 1.003 -0.333 -1.090) 1.518 14.481 ( -0.079 0.370 1.065) 1.130 14.947 ( 5.962 2.632 -4.851) 8.124 15.768 ( 3.059 -1.945 2.359) 4.325 16.464 ( 6.939 0.725 0.452) 6.991 17.596 ( 9.394 9.672 -2.020) 13.634 19.423 ( -1.644 3.536 -1.343) 4.125 19.841 ( -0.197 0.256 -0.727) 0.795 21.142 ( -4.135 2.144 0.883) 4.741 55.477 ( 5.523 1.336 16.099) 17.072 57.260 ( -5.489 11.518 -0.630) 12.774 ======================= Grid point 4 (5/322) ======================= q-point: ( 0.31 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.269 ( 9.041 -0.666 -5.152) 10.427 1.498 ( 5.161 -13.244 6.143) 15.484 2.238 ( 11.747 1.655 3.230) 12.295 2.987 ( 7.822 -0.215 5.854) 9.772 3.281 ( 4.360 -18.323 -1.801) 18.921 3.788 ( -7.859 2.865 -7.405) 11.172 4.113 ( -3.216 -11.113 -1.918) 11.727 4.160 ( -10.918 6.443 1.529) 12.770 4.408 ( 6.146 2.672 -1.775) 6.933 4.867 ( 1.676 1.844 -1.347) 2.833 5.262 ( -5.570 -3.222 6.298) 9.004 5.768 ( -0.190 -0.895 -9.041) 9.088 5.845 ( 1.932 1.984 1.174) 3.008 6.241 ( 3.242 1.055 6.841) 7.644 7.016 ( -4.658 1.656 -0.306) 4.953 8.669 ( -0.678 0.504 -2.231) 2.386 10.662 ( 1.171 -17.029 1.231) 17.114 11.984 ( -13.440 -9.125 -2.263) 16.402 13.020 ( 1.238 0.899 1.340) 2.034 14.436 ( 0.375 -0.233 -1.949) 1.999 14.476 ( 0.176 0.263 1.544) 1.576 14.922 ( 2.455 2.351 -2.885) 4.458 15.825 ( 0.370 -2.223 0.481) 2.304 16.504 ( 7.310 0.656 0.198) 7.342 17.493 ( 9.586 7.621 -0.575) 12.259 19.330 ( -2.377 4.235 -1.517) 5.088 19.833 ( -0.273 0.247 -0.396) 0.541 21.074 ( -3.844 1.887 0.809) 4.358 55.533 ( 5.917 -0.512 11.019) 12.518 56.988 ( -6.148 11.828 -1.204) 13.385 ======================= Grid point 5 (6/322) ======================= q-point: ( 0.38 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.249 ( 4.046 5.381 -5.152) 8.477 1.720 ( 4.545 -5.076 3.157) 7.510 2.368 ( 11.102 -6.267 1.490) 12.835 3.103 ( 8.706 -4.252 9.352) 13.466 3.539 ( -0.974 -4.443 -3.384) 5.669 3.650 ( -7.845 2.463 -7.178) 10.915 3.940 ( -7.956 6.964 3.766) 11.224 4.270 ( -0.930 -6.090 1.500) 6.341 4.472 ( 7.776 -3.522 -4.555) 9.676 4.816 ( -1.763 3.216 -0.258) 3.677 5.301 ( -3.560 -3.539 2.197) 5.479 5.764 ( 2.149 0.487 -7.661) 7.971 5.823 ( -1.634 0.676 2.499) 3.061 6.255 ( 1.743 0.446 5.231) 5.532 6.957 ( -3.290 1.287 -0.333) 3.548 8.652 ( -0.554 0.423 -1.904) 2.028 10.961 ( 0.831 -12.456 1.271) 12.548 12.052 ( -7.976 -6.179 -1.196) 10.160 13.022 ( 1.169 0.148 1.031) 1.566 14.431 ( -0.375 0.282 -1.818) 1.877 14.482 ( 0.563 -0.252 1.237) 1.382 14.888 ( 0.794 1.880 -1.224) 2.379 15.857 ( -0.991 -1.414 -0.467) 1.788 16.536 ( 5.348 1.020 -0.120) 5.445 17.449 ( 8.214 3.716 0.414) 9.025 19.230 ( -2.445 3.749 -1.258) 4.650 19.827 ( -0.238 0.179 -0.111) 0.318 21.020 ( -2.701 1.270 0.543) 3.034 55.615 ( 5.392 -1.876 6.993) 9.028 56.732 ( -5.556 9.608 -1.527) 11.203 ======================= Grid point 6 (7/322) ======================= q-point: ( 0.46 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.166 ( 1.191 3.181 -2.259) 4.079 1.793 ( 1.922 -0.610 0.935) 2.223 2.573 ( 5.753 -5.625 0.165) 8.047 3.291 ( 8.418 -6.600 9.756) 14.478 3.458 ( -4.623 3.336 -1.875) 6.001 3.514 ( -8.070 6.657 -7.603) 12.932 3.865 ( -0.554 -0.138 1.296) 1.416 4.349 ( 0.006 -2.057 1.479) 2.534 4.599 ( 6.593 -4.343 -3.543) 8.654 4.723 ( -4.647 3.873 1.333) 6.195 5.341 ( -1.161 -1.785 0.002) 2.129 5.761 ( 1.956 0.479 -3.333) 3.894 5.805 ( -1.910 0.080 1.769) 2.604 6.265 ( 0.569 0.104 1.970) 2.053 6.922 ( -1.176 0.490 -0.160) 1.284 8.641 ( -0.214 0.167 -0.744) 0.792 11.134 ( 0.289 -4.544 0.544) 4.586 12.094 ( -2.653 -2.205 -0.383) 3.471 13.030 ( 0.490 -0.085 0.386) 0.630 14.421 ( -0.217 0.182 -0.689) 0.744 14.491 ( 0.241 -0.168 0.407) 0.502 14.864 ( 0.151 0.751 -0.272) 0.813 15.867 ( -0.590 -0.449 -0.328) 0.811 16.544 ( 1.901 0.625 -0.110) 2.004 17.454 ( 3.405 0.797 0.338) 3.513 19.161 ( -1.109 1.561 -0.502) 1.980 19.823 ( -0.094 0.066 -0.005) 0.115 20.991 ( -0.971 0.446 0.187) 1.085 55.688 ( 2.488 -1.275 2.592) 3.812 56.562 ( -2.538 4.017 -0.840) 4.825 ======================= Grid point 14 (8/322) ======================= q-point: ( 0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.158 ( 6.628 0.000 26.003) 26.834 0.180 ( 11.128 0.000 7.209) 13.259 0.793 ( 53.228 0.000 3.603) 53.350 2.900 ( 2.694 0.000 1.854) 3.270 3.035 ( -3.266 -0.000 -3.597) 4.859 3.323 ( -5.386 -0.000 0.682) 5.429 4.141 ( 12.347 0.000 -17.611) 21.507 4.144 ( 1.624 0.000 3.545) 3.900 4.579 ( -9.262 -0.000 2.567) 9.611 4.849 ( -0.650 -0.000 -1.000) 1.192 4.957 ( -2.056 -0.000 5.464) 5.838 5.721 ( 2.037 0.000 3.001) 3.626 5.796 ( 1.178 0.000 -0.327) 1.222 6.807 ( 0.148 0.000 -22.129) 22.129 7.180 ( -3.190 -0.000 1.507) 3.528 8.702 ( 0.004 0.000 0.419) 0.419 9.735 ( -3.333 -0.000 -0.380) 3.355 10.815 ( 1.350 0.000 -0.400) 1.408 13.099 ( 0.289 0.000 0.815) 0.865 14.419 ( 0.937 0.000 -0.811) 1.239 14.486 ( 0.385 0.000 1.425) 1.476 15.183 ( 2.624 0.000 -23.294) 23.441 16.006 ( -5.685 -0.000 1.709) 5.937 16.483 ( 8.193 0.000 1.361) 8.305 18.125 ( 11.377 0.000 -35.710) 37.479 19.537 ( -0.730 -0.000 -0.473) 0.870 19.854 ( 0.069 0.000 -1.592) 1.593 21.249 ( -3.640 -0.000 0.284) 3.651 55.799 ( -25.538 -0.000 122.987) 125.611 57.683 ( -4.347 -0.000 0.172) 4.351 ======================= Grid point 15 (9/322) ======================= q-point: ( 0.15 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.427 ( 6.800 -15.418 6.473) 18.051 0.691 ( 9.963 -22.574 9.273) 26.359 1.322 ( 42.874 -16.775 3.037) 46.138 2.869 ( 2.962 4.842 0.825) 5.736 3.044 ( -3.645 -2.595 -3.732) 5.826 3.329 ( -5.644 -6.285 0.043) 8.447 3.991 ( 7.568 4.315 -2.271) 9.003 4.464 ( -9.727 1.729 -9.180) 13.486 4.538 ( -5.834 -10.490 -3.092) 12.395 4.853 ( -1.007 -1.348 0.157) 1.689 4.996 ( -4.144 -5.367 7.405) 10.041 5.721 ( 0.642 0.901 0.801) 1.366 5.850 ( 2.739 -2.966 0.735) 4.104 6.553 ( 9.791 15.621 -5.815) 19.331 7.132 ( -5.273 1.270 1.087) 5.531 8.700 ( -0.114 0.249 0.238) 0.363 9.805 ( -3.039 -8.640 -1.297) 9.251 11.190 ( -21.699 -27.440 -5.916) 35.480 13.093 ( 0.547 1.017 1.256) 1.706 14.424 ( 1.285 0.086 -1.164) 1.736 14.491 ( 0.484 0.136 1.890) 1.955 15.108 ( 3.901 4.773 -13.236) 14.602 15.854 ( 3.645 7.833 3.279) 9.241 16.519 ( 10.184 2.276 1.655) 10.566 18.002 ( 14.571 11.529 -13.147) 22.761 19.516 ( -1.210 1.265 -1.035) 2.034 19.849 ( -0.032 0.161 -1.610) 1.619 21.206 ( -5.198 1.054 0.801) 5.364 55.676 ( -0.886 9.914 57.191) 58.051 57.596 ( -6.243 4.959 -0.042) 7.973 ======================= Grid point 16 (10/322) ======================= q-point: ( 0.23 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.803 ( 6.830 -17.248 3.994) 18.976 1.130 ( 18.038 -11.534 8.067) 22.880 1.986 ( 28.360 -21.439 4.624) 35.851 2.791 ( 2.138 3.050 -3.723) 5.266 3.045 ( -0.663 0.183 0.332) 0.764 3.503 ( -4.383 -14.664 -2.184) 15.460 3.953 ( 1.193 3.556 -1.951) 4.227 4.311 ( -10.844 3.431 -7.124) 13.420 4.585 ( 1.105 1.792 -1.997) 2.902 4.876 ( -0.422 -1.421 -1.769) 2.308 5.096 ( -6.256 -6.394 8.521) 12.354 5.714 ( -0.351 -0.383 -2.691) 2.740 5.911 ( 2.597 -0.640 0.230) 2.685 6.387 ( 6.726 8.181 1.690) 10.725 7.065 ( -6.876 1.135 0.377) 6.979 8.690 ( -0.295 0.553 -1.051) 1.224 10.010 ( -2.008 -14.524 -0.652) 14.677 11.460 ( -19.620 -18.699 -4.402) 27.459 13.076 ( 1.033 1.530 1.626) 2.460 14.431 ( 1.387 0.035 -1.469) 2.020 14.492 ( 0.428 0.423 1.990) 2.079 15.036 ( 2.760 3.571 -8.031) 9.212 15.794 ( 2.620 1.997 1.489) 3.615 16.556 ( 10.806 2.074 1.574) 11.115 17.874 ( 13.308 11.005 -5.940) 18.262 19.466 ( -1.990 2.563 -1.599) 3.618 19.842 ( -0.183 0.202 -1.473) 1.498 21.141 ( -5.979 1.478 1.153) 6.266 55.621 ( 4.912 5.424 30.759) 31.618 57.410 ( -7.686 8.868 -0.582) 11.750 ======================= Grid point 17 (11/322) ======================= q-point: ( 0.31 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.177 ( 8.113 -14.581 -0.889) 16.710 1.432 ( 18.441 -4.920 9.648) 21.386 2.374 ( 14.378 0.542 3.959) 14.922 2.938 ( 7.690 -17.777 -5.800) 20.219 3.050 ( 2.631 -0.048 4.936) 5.594 3.749 ( -2.216 -9.317 -4.433) 10.553 3.876 ( -5.946 -1.297 -1.743) 6.331 4.166 ( -9.748 3.106 -3.318) 10.756 4.534 ( 6.076 4.858 -1.874) 8.002 4.886 ( -0.397 -0.159 -3.606) 3.632 5.161 ( -6.901 -4.058 9.147) 12.156 5.723 ( -0.133 -1.379 -5.624) 5.793 5.905 ( 0.706 2.178 -0.318) 2.311 6.322 ( 3.628 3.641 5.747) 7.710 6.995 ( -6.960 0.762 -0.271) 7.007 8.673 ( -0.358 0.659 -2.336) 2.454 10.317 ( -1.814 -18.289 0.346) 18.382 11.647 ( -14.033 -14.513 -2.340) 20.323 13.058 ( 1.600 1.485 1.725) 2.782 14.437 ( 0.990 0.061 -1.917) 2.158 14.489 ( 0.530 0.542 2.024) 2.161 14.979 ( 0.896 2.679 -4.983) 5.729 15.797 ( 0.233 -0.695 -0.312) 0.797 16.598 ( 10.606 2.063 1.241) 10.876 17.752 ( 12.830 10.651 -2.745) 16.899 19.384 ( -2.947 3.697 -1.928) 5.106 19.834 ( -0.314 0.198 -1.036) 1.100 21.072 ( -5.717 1.355 1.179) 5.992 55.628 ( 6.817 2.775 19.283) 20.640 57.155 ( -8.529 11.015 -1.360) 13.997 ======================= Grid point 18 (12/322) ======================= q-point: ( 0.38 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.391 ( 11.544 0.624 -8.369) 14.272 1.659 ( 11.576 -6.016 13.214) 18.569 2.403 ( 10.060 1.448 -1.243) 10.240 3.115 ( 5.441 -2.613 8.822) 10.689 3.343 ( 5.087 -15.471 -3.275) 16.612 3.672 ( -5.206 5.937 -3.713) 8.726 3.972 ( -9.428 -0.508 -3.959) 10.238 4.092 ( -4.292 -7.321 3.300) 9.105 4.515 ( 9.839 1.924 -4.790) 11.111 4.855 ( -1.833 2.134 -2.853) 4.007 5.200 ( -5.689 -4.042 6.126) 9.286 5.744 ( 0.779 -1.548 -6.873) 7.088 5.853 ( -1.858 2.551 1.324) 3.422 6.301 ( 1.851 1.937 6.482) 7.014 6.938 ( -5.575 0.244 -0.793) 5.636 8.654 ( -0.225 0.537 -2.685) 2.747 10.659 ( -2.353 -18.022 0.821) 18.194 11.814 ( -8.539 -11.720 -0.672) 14.516 13.049 ( 1.937 1.093 1.391) 2.623 14.434 ( 0.351 0.356 -1.974) 2.036 14.489 ( 0.809 0.243 1.725) 1.920 14.928 ( -0.298 2.195 -2.765) 3.543 15.814 ( -1.545 -1.577 -1.341) 2.583 16.627 ( 8.775 2.720 0.649) 9.210 17.650 ( 12.011 8.981 -0.632) 15.011 19.281 ( -3.538 4.013 -1.836) 5.656 19.827 ( -0.357 0.139 -0.517) 0.643 21.015 ( -4.526 0.797 0.914) 4.686 55.671 ( 7.551 1.044 12.603) 14.729 56.875 ( -8.559 10.785 -2.099) 13.928 ======================= Grid point 19 (13/322) ======================= q-point: ( 0.46 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.345 ( 11.508 9.220 -7.534) 16.560 1.815 ( 5.361 -0.841 9.073) 10.572 2.516 ( 9.700 -5.227 -2.704) 11.345 3.255 ( 6.852 -5.374 10.935) 13.978 3.484 ( -3.962 2.566 -1.477) 4.946 3.531 ( -6.969 2.012 -5.481) 9.092 3.871 ( -2.376 1.680 1.002) 3.077 4.240 ( -3.820 -7.789 -0.244) 8.679 4.584 ( 9.245 -1.931 -5.492) 10.925 4.773 ( -3.179 3.934 -0.083) 5.058 5.264 ( -2.263 -4.814 1.834) 5.627 5.768 ( 1.978 -0.884 -7.133) 7.455 5.796 ( -4.075 1.241 4.714) 6.354 6.289 ( 0.588 1.351 4.587) 4.818 6.905 ( -3.340 -0.428 -0.966) 3.503 8.642 ( 0.076 0.242 -1.983) 1.999 10.948 ( -3.086 -13.388 0.518) 13.748 11.967 ( -3.447 -8.502 0.563) 9.192 13.047 ( 1.762 0.785 0.665) 2.040 14.426 ( 0.353 0.378 -1.235) 1.339 14.494 ( 0.608 0.083 0.983) 1.159 14.884 ( -0.802 1.543 -1.337) 2.194 15.830 ( -2.036 -1.808 -1.418) 3.070 16.618 ( 5.597 3.676 0.203) 6.699 17.576 ( 8.724 6.882 0.364) 11.118 19.187 ( -2.860 2.705 -1.232) 4.125 19.823 ( -0.282 0.036 -0.171) 0.331 20.982 ( -2.730 -0.009 0.505) 2.776 55.726 ( 6.499 0.843 7.473) 9.940 56.634 ( -6.993 7.290 -2.162) 10.331 ======================= Grid point 20 (14/322) ======================= q-point: ( 0.54 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.245 ( 10.275 7.217 -4.803) 13.444 1.820 ( 0.352 2.699 6.359) 6.917 2.626 ( 2.131 1.194 -3.102) 3.948 3.354 ( -7.121 6.644 -6.507) 11.712 3.424 ( -0.064 -1.333 0.577) 1.454 3.453 ( 5.886 -6.515 10.756) 13.885 3.870 ( 1.090 -0.259 -0.930) 1.456 4.316 ( -4.014 -3.427 -3.003) 6.072 4.635 ( -3.549 2.195 -0.967) 4.283 4.710 ( 5.557 -0.270 -0.433) 5.580 5.341 ( 0.879 -2.805 0.650) 3.010 5.746 ( -3.818 0.527 3.254) 5.044 5.803 ( 1.592 -1.126 -2.475) 3.151 6.270 ( -0.460 1.126 1.149) 1.674 6.905 ( -0.943 -1.305 -0.703) 1.757 8.641 ( 0.436 -0.135 -0.653) 0.796 11.110 ( -3.391 -5.507 -0.317) 6.475 12.086 ( 1.058 -4.538 1.363) 4.855 13.042 ( 1.087 0.907 -0.169) 1.426 14.424 ( 0.746 0.049 -0.081) 0.752 14.495 ( 0.142 0.278 0.210) 0.376 14.856 ( -0.910 0.388 -0.634) 1.175 15.850 ( -1.383 -1.697 -0.787) 2.326 16.575 ( 2.134 3.480 0.216) 4.088 17.499 ( 2.504 5.654 0.124) 6.185 19.146 ( -0.775 -0.160 -0.270) 0.836 19.821 ( -0.119 -0.093 -0.058) 0.162 20.978 ( -0.761 -0.888 0.106) 1.174 55.731 ( 2.297 3.280 2.150) 4.545 56.522 ( -2.511 -0.129 -0.720) 2.615 ======================= Grid point 21 (15/322) ======================= q-point: (-0.38 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.223 ( 7.595 1.574 -1.445) 7.889 1.765 ( -2.381 2.946 5.731) 6.869 2.465 ( -7.899 10.649 -4.092) 13.876 3.140 ( -7.974 7.265 -7.483) 13.129 3.544 ( 5.297 -5.374 2.828) 8.058 3.656 ( 7.135 -6.064 10.055) 13.740 3.881 ( 3.195 -1.481 -4.511) 5.723 4.311 ( -3.301 0.125 -4.655) 5.708 4.526 ( -4.941 4.849 3.767) 7.881 4.775 ( 2.902 -2.040 -1.570) 3.879 5.370 ( 2.484 1.105 0.416) 2.751 5.729 ( -3.765 -1.098 4.200) 5.746 5.830 ( 1.910 -0.512 -0.785) 2.128 6.243 ( -1.343 0.942 -2.403) 2.910 6.939 ( 1.123 -2.175 -0.310) 2.468 8.651 ( 0.705 -0.446 0.658) 1.063 11.103 ( -3.142 3.664 -1.089) 4.948 12.158 ( 5.018 -0.436 1.761) 5.336 13.027 ( 0.315 1.075 -0.784) 1.368 14.434 ( 0.994 -0.238 1.105) 1.505 14.486 ( -0.271 0.581 -0.570) 0.858 14.854 ( -1.113 -0.934 -0.051) 1.455 15.868 ( -0.452 -0.717 -0.236) 0.880 16.523 ( -1.148 2.282 0.421) 2.589 17.402 ( -3.381 3.450 -0.441) 4.850 19.180 ( 1.115 -2.944 0.578) 3.200 19.824 ( 0.054 -0.217 -0.040) 0.227 21.004 ( 0.938 -1.694 -0.213) 1.948 55.645 ( -2.127 4.988 -2.387) 5.925 56.598 ( 2.019 -7.282 0.741) 7.593 ======================= Grid point 22 (16/322) ======================= q-point: (-0.31 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.247 ( 1.415 0.878 -0.420) 1.718 1.686 ( 0.247 6.484 6.464) 9.158 2.184 ( -12.301 7.406 -6.594) 15.800 2.959 ( -7.111 4.165 -5.994) 10.190 3.538 ( -1.580 9.578 2.201) 9.954 3.805 ( 8.737 -3.592 9.765) 13.586 4.050 ( 8.445 -10.591 -6.700) 15.112 4.263 ( -1.103 2.702 -2.067) 3.576 4.401 ( -3.566 4.962 4.444) 7.556 4.814 ( -1.788 -1.709 -0.818) 2.605 5.349 ( 3.798 2.885 -2.177) 5.243 5.741 ( -3.927 -2.053 4.604) 6.390 5.844 ( 1.721 0.483 1.525) 2.350 6.209 ( -2.112 0.615 -4.832) 5.309 6.999 ( 2.433 -2.676 -0.051) 3.617 8.668 ( 0.762 -0.560 1.374) 1.668 10.928 ( -2.577 11.751 -1.293) 12.099 12.185 ( 8.490 2.966 1.960) 9.204 13.009 ( -0.149 0.520 -1.016) 1.152 14.445 ( 0.519 0.204 1.920) 2.000 14.472 ( -0.180 0.258 -1.356) 1.392 14.870 ( -1.976 -1.600 0.950) 2.714 15.860 ( -0.442 1.379 -0.525) 1.540 16.471 ( -3.462 1.409 0.459) 3.766 17.344 ( -5.842 -1.549 -0.344) 6.054 19.264 ( 1.623 -4.290 0.955) 4.686 19.830 ( 0.154 -0.301 0.049) 0.341 21.054 ( 2.006 -2.314 -0.425) 3.092 55.528 ( -3.659 3.934 -5.094) 7.404 56.803 ( 3.557 -11.121 0.903) 11.711 ======================= Grid point 23 (17/322) ======================= q-point: (-0.23 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.153 ( -6.789 7.060 -1.338) 9.886 1.474 ( 1.279 17.109 2.712) 17.370 2.067 ( -8.787 -3.282 -4.589) 10.442 2.873 ( -5.340 -0.702 -2.625) 5.991 3.234 ( -2.395 18.822 0.719) 18.987 3.920 ( 5.654 0.275 7.397) 9.315 4.135 ( 1.227 8.506 -0.990) 8.651 4.315 ( 6.386 -10.081 -3.362) 12.398 4.364 ( 1.508 -1.807 4.231) 4.841 4.817 ( -4.663 -1.455 -0.591) 4.920 5.318 ( 4.423 2.756 -4.518) 6.897 5.760 ( -4.884 -2.338 4.109) 6.797 5.841 ( 1.810 1.584 2.869) 3.743 6.172 ( -2.957 0.453 -5.467) 6.232 7.070 ( 2.661 -2.619 0.079) 3.734 8.685 ( 0.586 -0.457 1.261) 1.464 10.632 ( -1.828 16.454 -0.893) 16.580 12.181 ( 11.018 4.897 2.207) 12.257 13.006 ( -0.225 -0.621 -0.875) 1.097 14.434 ( -0.458 0.847 0.772) 1.234 14.475 ( 0.358 -0.348 -0.491) 0.700 14.881 ( -3.768 -1.160 1.968) 4.406 15.804 ( -1.508 3.362 -1.406) 3.944 16.425 ( -3.575 0.670 0.269) 3.647 17.384 ( -5.332 -6.639 0.327) 8.521 19.360 ( 1.185 -4.256 0.870) 4.503 19.837 ( 0.145 -0.322 0.211) 0.412 21.117 ( 2.226 -2.655 -0.481) 3.498 55.434 ( -3.429 2.031 -6.647) 7.750 57.060 ( 3.213 -12.500 0.539) 12.918 ======================= Grid point 24 (18/322) ======================= q-point: (-0.15 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.893 ( -9.326 12.896 -1.166) 15.957 1.114 ( -0.183 19.788 -0.587) 19.797 2.004 ( -4.371 9.605 -2.507) 10.846 2.869 ( -0.146 7.608 7.141) 10.435 2.914 ( -2.966 0.167 -6.431) 7.084 3.815 ( 0.087 12.405 1.919) 12.553 4.038 ( 2.569 3.210 1.164) 4.273 4.472 ( 6.614 -4.458 2.696) 8.419 4.520 ( 0.876 -8.343 0.493) 8.403 4.821 ( -2.708 -2.617 -1.075) 3.916 5.291 ( 4.055 2.629 -3.729) 6.104 5.769 ( -5.222 -1.930 2.218) 5.993 5.819 ( 1.821 2.555 2.671) 4.120 6.126 ( -3.743 1.163 -4.164) 5.719 7.133 ( 1.772 -2.120 0.090) 2.765 8.697 ( 0.273 -0.236 0.571) 0.675 10.297 ( -0.934 16.542 -0.265) 16.571 12.171 ( 11.009 4.727 2.295) 12.199 13.026 ( -0.084 -1.532 -0.486) 1.609 14.418 ( -0.412 0.514 0.296) 0.722 14.481 ( 0.133 -0.161 -0.259) 0.333 14.860 ( -5.427 0.198 1.964) 5.775 15.717 ( -1.929 3.736 -1.748) 4.554 16.399 ( -2.004 -0.149 0.061) 2.011 17.504 ( -3.532 -8.559 0.722) 9.287 19.442 ( 0.529 -3.423 0.492) 3.498 19.845 ( 0.065 -0.284 0.261) 0.391 21.182 ( 1.527 -2.602 -0.333) 3.035 55.378 ( -2.358 0.560 -6.583) 7.015 57.316 ( 1.894 -11.808 0.177) 11.961 ======================= Grid point 25 (19/322) ======================= q-point: (-0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.566 ( 0.000 15.593 -0.000) 15.593 0.732 ( 0.000 19.558 -0.000) 19.558 1.552 ( 0.000 32.928 -0.000) 32.928 2.799 ( -0.000 -1.462 0.000) 1.462 3.001 ( -0.000 -5.809 0.000) 5.809 3.561 ( 0.000 12.672 -0.000) 12.672 3.985 ( 0.000 3.705 -0.000) 3.705 4.577 ( -0.000 -2.854 0.000) 2.854 4.666 ( -0.000 -7.119 0.000) 7.119 4.884 ( -0.000 -4.132 0.000) 4.132 5.262 ( 0.000 2.162 -0.000) 2.162 5.774 ( -0.000 -0.942 0.000) 0.942 5.775 ( 0.000 2.978 -0.000) 2.978 6.064 ( 0.000 2.612 -0.000) 2.612 7.174 ( -0.000 -1.405 0.000) 1.405 8.701 ( -0.000 -0.056 0.000) 0.056 10.009 ( 0.000 12.573 -0.000) 12.573 12.155 ( 0.000 2.752 -0.000) 2.752 13.057 ( -0.000 -1.685 0.000) 1.685 14.411 ( 0.000 0.082 -0.000) 0.082 14.482 ( 0.000 0.004 -0.000) 0.004 14.814 ( 0.000 1.622 -0.000) 1.622 15.641 ( 0.000 2.860 -0.000) 2.860 16.400 ( -0.000 -0.535 0.000) 0.535 17.646 ( -0.000 -7.249 0.000) 7.249 19.499 ( -0.000 -2.294 0.000) 2.294 19.850 ( -0.000 -0.206 0.000) 0.206 21.233 ( -0.000 -2.065 0.000) 2.065 55.357 ( -0.000 -0.036 0.000) 0.036 57.528 ( -0.000 -9.185 0.000) 9.185 ======================= Grid point 28 (20/322) ======================= q-point: ( 0.15 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.374 ( 12.598 0.000 6.688) 14.263 0.377 ( 12.749 0.000 22.333) 25.716 1.561 ( 50.788 0.000 3.434) 50.904 2.952 ( -5.643 -0.000 -6.222) 8.400 2.959 ( 3.765 0.000 3.753) 5.316 3.215 ( -9.792 -0.000 1.315) 9.880 4.189 ( 2.294 0.000 5.908) 6.337 4.309 ( 16.088 0.000 -13.870) 21.242 4.416 ( -10.642 -0.000 -4.588) 11.589 4.831 ( -1.153 -0.000 -1.824) 2.158 4.935 ( -3.867 -0.000 7.714) 8.629 5.765 ( 1.697 0.000 5.069) 5.345 5.818 ( 2.063 0.000 -0.563) 2.138 6.706 ( -5.644 -0.000 -14.011) 15.105 7.118 ( -6.245 -0.000 2.742) 6.821 8.704 ( 0.009 0.000 0.790) 0.790 9.667 ( -5.593 -0.000 -0.648) 5.630 10.839 ( 2.110 0.000 -0.717) 2.229 13.109 ( 0.629 0.000 1.630) 1.747 14.433 ( 1.496 0.000 -1.529) 2.139 14.501 ( 0.822 0.000 2.605) 2.731 15.129 ( -2.057 -0.000 -11.699) 11.879 15.922 ( -5.477 -0.000 -1.602) 5.706 16.633 ( 11.134 0.000 1.709) 11.264 18.196 ( 10.599 0.000 -18.614) 21.421 19.517 ( -1.721 -0.000 -1.078) 2.031 19.847 ( -0.096 -0.000 -2.095) 2.097 21.175 ( -6.602 -0.000 0.635) 6.632 55.848 ( -9.392 -0.000 61.390) 62.104 57.592 ( -8.125 -0.000 0.059) 8.125 ======================= Grid point 29 (21/322) ======================= q-point: ( 0.23 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.612 ( 14.694 -10.605 10.130) 20.760 0.855 ( 9.340 -26.374 10.278) 29.807 1.985 ( 45.036 -6.677 2.758) 45.612 2.907 ( -0.453 4.845 -2.167) 5.327 2.976 ( -1.983 -3.523 -0.575) 4.084 3.217 ( -9.673 -8.470 0.569) 12.869 4.102 ( 6.928 7.605 1.320) 10.372 4.275 ( -11.673 2.385 -8.365) 14.557 4.561 ( 9.302 -6.693 -6.179) 13.020 4.830 ( -1.744 -1.211 -1.756) 2.755 4.958 ( -4.729 -4.290 7.884) 10.145 5.739 ( 0.958 2.423 2.046) 3.313 5.885 ( 1.393 -3.111 1.250) 3.631 6.564 ( -2.701 6.806 -7.781) 10.684 7.044 ( -7.650 2.138 2.553) 8.343 8.699 ( -0.037 0.556 0.204) 0.594 9.733 ( -5.973 -10.378 -1.189) 12.033 11.012 ( -4.837 -14.748 -1.928) 15.640 13.109 ( 0.942 0.847 1.989) 2.358 14.441 ( 1.539 0.107 -1.728) 2.316 14.509 ( 0.941 0.355 2.782) 2.958 15.075 ( -2.228 1.729 -8.766) 9.208 15.850 ( -2.621 2.684 -1.602) 4.079 16.692 ( 12.145 2.363 1.921) 12.521 18.157 ( 12.950 8.466 -11.531) 19.296 19.486 ( -2.452 1.425 -1.622) 3.267 19.841 ( -0.183 0.139 -2.117) 2.129 21.116 ( -7.400 0.778 1.060) 7.516 55.819 ( -0.882 5.770 42.117) 42.519 57.480 ( -9.506 4.864 -0.430) 10.686 ======================= Grid point 30 (22/322) ======================= q-point: ( 0.31 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.972 ( 13.743 -13.902 7.462) 20.924 1.391 ( 14.818 -17.181 9.017) 24.415 2.436 ( 28.525 -8.395 2.496) 29.839 2.808 ( 2.312 1.699 -5.358) 6.078 3.034 ( -0.217 -3.069 2.556) 4.000 3.405 ( -7.991 -16.797 -1.490) 18.660 3.980 ( 1.347 8.679 -1.317) 8.881 4.145 ( -7.611 2.382 -4.198) 9.013 4.653 ( 9.032 2.011 -4.872) 10.457 4.843 ( -2.558 -2.069 -4.257) 5.380 5.036 ( -5.853 -5.367 8.860) 11.898 5.714 ( 0.833 0.812 -0.819) 1.423 5.922 ( -1.348 -0.176 -0.006) 1.360 6.433 ( 0.182 4.893 0.219) 4.901 6.953 ( -8.656 1.145 1.081) 8.798 8.683 ( -0.011 0.919 -1.392) 1.668 9.951 ( -5.461 -16.435 -0.705) 17.333 11.259 ( -7.724 -15.759 -1.651) 17.628 13.100 ( 1.434 1.280 2.133) 2.872 14.445 ( 1.282 0.233 -1.844) 2.258 14.510 ( 0.986 0.677 2.562) 2.827 15.011 ( -2.028 1.914 -6.143) 6.746 15.797 ( -1.425 1.017 -1.874) 2.565 16.733 ( 12.066 2.838 1.827) 12.529 18.054 ( 14.135 10.601 -6.063) 18.680 19.421 ( -3.491 2.804 -2.127) 4.957 19.833 ( -0.298 0.164 -1.742) 1.775 21.048 ( -7.217 0.837 1.346) 7.389 55.787 ( 4.912 4.777 27.461) 28.302 57.274 ( -10.362 8.606 -1.373) 13.539 ======================= Grid point 31 (23/322) ======================= q-point: ( 0.38 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.336 ( 12.835 -11.704 3.006) 17.628 1.736 ( 18.985 -4.426 9.713) 21.780 2.535 ( 6.824 5.238 -2.544) 8.970 3.005 ( 0.082 -12.297 -0.207) 12.299 3.148 ( 10.827 -7.661 1.995) 13.412 3.688 ( -5.352 -16.432 -1.626) 17.358 3.801 ( -2.407 8.557 -3.494) 9.551 4.048 ( -5.678 2.640 1.435) 6.424 4.646 ( 10.431 4.168 -5.582) 12.543 4.850 ( -1.727 -0.873 -6.232) 6.525 5.089 ( -7.015 -3.758 9.430) 12.339 5.718 ( 1.192 -0.744 -3.418) 3.695 5.877 ( -4.478 2.057 -0.299) 4.937 6.372 ( 1.084 2.947 5.254) 6.120 6.886 ( -7.726 -0.365 -0.545) 7.754 8.663 ( 0.155 0.862 -2.525) 2.672 10.263 ( -5.317 -19.589 0.022) 20.298 11.500 ( -5.929 -14.710 -0.407) 15.865 13.090 ( 1.864 1.328 1.865) 2.952 14.443 ( 0.838 0.446 -1.756) 1.996 14.508 ( 1.064 0.668 2.058) 2.411 14.953 ( -2.023 1.768 -3.922) 4.754 15.778 ( -1.845 -0.485 -2.288) 2.979 16.760 ( 10.479 3.433 1.315) 11.106 17.941 ( 14.091 11.036 -2.595) 18.085 19.324 ( -4.456 3.724 -2.231) 6.221 19.826 ( -0.377 0.118 -1.114) 1.181 20.989 ( -6.041 0.371 1.219) 6.174 55.796 ( 7.768 3.149 18.326) 20.152 57.008 ( -10.697 10.453 -2.483) 15.161 ======================= Grid point 32 (24/322) ======================= q-point: ( 0.46 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.542 ( 11.369 0.764 -4.755) 12.347 1.900 ( 15.344 1.239 12.650) 19.925 2.523 ( 8.580 -0.318 -4.989) 9.930 3.170 ( -2.283 -8.285 8.038) 11.767 3.396 ( 2.833 -7.786 -3.133) 8.858 3.607 ( -2.603 8.704 -2.218) 9.351 3.870 ( -2.910 -2.363 -1.391) 3.998 4.027 ( -5.826 -7.762 2.601) 10.048 4.649 ( 9.950 2.188 -6.641) 12.161 4.822 ( 0.178 2.314 -3.233) 3.980 5.140 ( -4.965 -5.561 5.196) 9.087 5.744 ( 1.584 -1.502 -4.573) 5.067 5.798 ( -6.339 1.860 1.955) 6.889 6.338 ( 0.486 2.357 5.777) 6.259 6.854 ( -5.298 -1.411 -1.430) 5.666 8.647 ( 0.383 0.523 -2.521) 2.603 10.601 ( -5.442 -18.872 0.236) 19.642 11.735 ( -2.764 -12.900 0.825) 13.218 13.082 ( 1.977 1.204 1.157) 2.587 14.436 ( 0.733 0.515 -1.280) 1.562 14.507 ( 0.891 0.489 1.361) 1.699 14.901 ( -1.959 1.543 -2.263) 3.367 15.778 ( -2.245 -1.448 -2.236) 3.484 16.750 ( 7.595 4.693 0.648) 8.951 17.827 ( 12.178 10.693 -0.452) 16.213 19.217 ( -4.408 3.337 -1.809) 5.817 19.820 ( -0.364 0.024 -0.525) 0.640 20.953 ( -4.197 -0.395 0.811) 4.293 55.831 ( 8.826 2.395 12.160) 15.215 56.729 ( -10.269 9.475 -3.297) 14.356 ======================= Grid point 33 (25/322) ======================= q-point: ( 0.54 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.494 ( 10.747 9.178 -7.779) 16.132 1.939 ( 7.368 5.673 11.670) 14.922 2.638 ( 8.971 -3.123 -4.808) 10.647 3.336 ( -1.748 -8.204 7.930) 11.543 3.400 ( -7.433 3.969 -5.476) 10.050 3.464 ( 1.596 3.698 3.413) 5.280 3.868 ( 1.306 -0.533 -0.182) 1.423 4.158 ( -6.487 -8.134 -2.212) 10.637 4.651 ( 0.392 1.928 -4.122) 4.568 4.783 ( 6.523 2.790 -0.839) 7.144 5.250 ( -0.427 -6.761 1.281) 6.895 5.729 ( -6.273 0.784 3.502) 7.227 5.780 ( 1.537 -1.722 -3.365) 4.080 6.303 ( -0.324 2.128 3.511) 4.118 6.857 ( -2.688 -2.117 -1.369) 3.685 8.641 ( 0.589 0.056 -1.617) 1.722 10.885 ( -5.127 -14.110 -0.079) 15.012 11.950 ( 0.140 -10.005 1.604) 10.134 13.074 ( 1.682 1.221 0.267) 2.096 14.433 ( 1.000 0.261 -0.516) 1.155 14.505 ( 0.463 0.468 0.675) 0.943 14.860 ( -1.692 1.009 -1.284) 2.352 15.794 ( -2.027 -2.203 -1.605) 3.397 16.692 ( 4.403 5.746 0.284) 7.245 17.695 ( 7.301 10.579 0.258) 12.856 19.142 ( -2.654 1.146 -0.951) 3.043 19.818 ( -0.257 -0.097 -0.183) 0.330 20.947 ( -2.172 -1.246 0.364) 2.530 55.848 ( 6.932 4.347 6.772) 10.622 56.519 ( -7.546 3.984 -2.703) 8.951 ======================= Grid point 34 (26/322) ======================= q-point: (-0.38 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.386 ( 10.047 7.718 -7.066) 14.507 1.860 ( 1.794 6.727 10.849) 12.891 2.619 ( -1.003 8.767 -5.035) 10.160 3.224 ( -7.069 7.381 -4.734) 11.263 3.454 ( 3.247 -6.745 1.040) 7.558 3.568 ( 4.175 -7.991 9.344) 12.984 3.892 ( 2.545 -0.097 -1.077) 2.766 4.226 ( -5.973 -4.448 -4.432) 8.666 4.575 ( -3.729 3.422 0.219) 5.066 4.795 ( 5.657 1.252 -1.815) 6.071 5.364 ( 1.733 -3.681 0.829) 4.152 5.691 ( -4.786 -0.431 3.840) 6.152 5.819 ( 1.454 -1.561 -1.802) 2.793 6.262 ( -0.874 2.020 0.460) 2.248 6.891 ( -0.590 -2.824 -0.836) 3.004 8.648 ( 0.688 -0.386 -0.435) 0.901 11.049 ( -4.094 -6.190 -0.567) 7.443 12.120 ( 2.280 -6.347 1.794) 6.979 13.058 ( 1.154 1.526 -0.402) 1.955 14.440 ( 1.185 -0.104 0.334) 1.236 14.497 ( 0.047 0.666 0.039) 0.669 14.837 ( -1.319 0.044 -0.731) 1.509 15.826 ( -1.364 -2.461 -0.783) 2.920 16.604 ( 1.647 5.529 0.300) 5.777 17.527 ( 1.346 9.931 -0.027) 10.022 19.137 ( -0.372 -1.763 -0.069) 1.803 19.820 ( -0.103 -0.223 -0.073) 0.257 20.970 ( -0.452 -2.010 0.034) 2.060 55.766 ( 1.620 7.742 1.346) 8.023 56.487 ( -1.864 -4.283 -0.457) 4.693 ======================= Grid point 35 (27/322) ======================= q-point: (-0.31 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.327 ( 6.554 4.308 -4.743) 9.166 1.783 ( 1.246 3.413 10.907) 11.496 2.329 ( -7.615 15.116 -6.607) 18.170 3.024 ( -5.028 7.549 -3.871) 9.861 3.609 ( 2.264 -2.874 2.128) 4.233 3.776 ( 4.402 -7.708 8.847) 12.533 3.931 ( 5.573 -3.830 -5.350) 8.623 4.238 ( -4.378 -1.756 -3.532) 5.893 4.482 ( -2.515 4.101 2.205) 5.292 4.797 ( 0.932 0.794 -1.551) 1.976 5.407 ( 2.050 0.604 0.256) 2.153 5.687 ( -3.242 -1.372 2.629) 4.394 5.853 ( 1.234 -0.974 0.426) 1.629 6.216 ( -1.132 1.846 -1.794) 2.812 6.951 ( 0.693 -3.383 -0.348) 3.471 8.663 ( 0.611 -0.641 0.389) 0.967 11.053 ( -2.682 3.144 -0.787) 4.207 12.231 ( 3.631 -2.731 1.507) 4.787 13.032 ( 0.655 1.650 -0.621) 1.881 14.453 ( 0.989 -0.247 1.040) 1.456 14.480 ( -0.207 0.903 -0.612) 1.111 14.836 ( -1.151 -0.874 -0.142) 1.452 15.857 ( -0.749 -1.233 -0.379) 1.492 16.513 ( -0.422 4.278 0.389) 4.316 17.359 ( -2.124 6.260 -0.314) 6.618 19.195 ( 0.699 -3.778 0.389) 3.862 19.825 ( 0.020 -0.325 -0.041) 0.328 21.015 ( 0.586 -2.578 -0.143) 2.647 55.614 ( -1.235 7.383 -1.444) 7.624 56.623 ( 1.110 -9.309 0.433) 9.385 ======================= Grid point 36 (28/322) ======================= q-point: (-0.23 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.258 ( 0.549 5.878 -1.960) 6.220 1.783 ( 8.197 5.976 12.400) 16.021 1.976 ( -11.967 8.335 -10.953) 18.239 2.872 ( -2.758 4.269 -1.999) 5.462 3.523 ( -0.784 11.340 0.699) 11.389 3.937 ( 4.287 -4.024 6.810) 8.998 4.116 ( 3.364 -10.328 -6.434) 12.624 4.233 ( -1.612 0.093 -0.317) 1.645 4.396 ( 0.296 3.162 2.497) 4.040 4.777 ( -1.936 0.423 -0.823) 2.146 5.388 ( 1.893 2.407 -1.087) 3.249 5.698 ( -2.443 -1.578 1.562) 3.301 5.872 ( 0.955 0.045 1.512) 1.789 6.172 ( -1.015 1.526 -2.196) 2.860 7.024 ( 0.899 -3.455 -0.070) 3.570 8.680 ( 0.351 -0.633 0.501) 0.880 10.894 ( -1.266 11.438 -0.525) 11.520 12.283 ( 3.573 0.285 0.946) 3.707 13.009 ( 0.245 0.911 -0.430) 1.036 14.453 ( -0.029 1.121 0.701) 1.323 14.470 ( 0.283 -0.314 -0.477) 0.637 14.847 ( -1.168 -0.912 0.377) 1.530 15.849 ( -0.529 1.687 -0.435) 1.820 16.440 ( -1.080 2.688 0.280) 2.910 17.284 ( -2.113 -0.481 -0.136) 2.171 19.282 ( 0.567 -4.499 0.358) 4.549 19.832 ( 0.052 -0.370 0.012) 0.374 21.073 ( 0.745 -2.901 -0.162) 3.000 55.479 ( -1.312 5.109 -1.883) 5.600 56.840 ( 1.224 -11.874 0.298) 11.940 ======================= Grid point 37 (29/322) ======================= q-point: (-0.15 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.096 ( 0.000 10.525 -0.000) 10.525 1.499 ( 0.000 20.072 -0.000) 20.072 1.989 ( -0.000 -5.826 0.000) 5.826 2.828 ( -0.000 -0.964 0.000) 0.964 3.218 ( 0.000 18.878 -0.000) 18.878 3.975 ( 0.000 2.875 -0.000) 2.875 4.146 ( 0.000 6.997 -0.000) 6.997 4.322 ( -0.000 -10.414 0.000) 10.414 4.429 ( -0.000 -4.221 0.000) 4.221 4.769 ( -0.000 -1.007 0.000) 1.007 5.347 ( 0.000 2.392 -0.000) 2.392 5.720 ( -0.000 -1.617 0.000) 1.617 5.866 ( 0.000 1.293 -0.000) 1.293 6.138 ( 0.000 1.382 -0.000) 1.382 7.090 ( -0.000 -2.962 0.000) 2.962 8.692 ( -0.000 -0.436 0.000) 0.436 10.616 ( 0.000 16.306 -0.000) 16.306 12.272 ( 0.000 2.415 -0.000) 2.415 13.004 ( -0.000 -0.485 0.000) 0.485 14.431 ( 0.000 1.001 -0.000) 1.001 14.477 ( -0.000 -0.284 0.000) 0.284 14.851 ( 0.000 0.007 -0.000) 0.007 15.788 ( 0.000 3.957 -0.000) 3.957 16.400 ( 0.000 1.033 -0.000) 1.033 17.345 ( -0.000 -6.263 0.000) 6.263 19.370 ( -0.000 -4.246 0.000) 4.246 19.839 ( -0.000 -0.349 0.000) 0.349 21.133 ( -0.000 -2.936 0.000) 2.936 55.397 ( 0.000 2.716 -0.000) 2.716 57.084 ( -0.000 -12.732 0.000) 12.732 ======================= Grid point 42 (30/322) ======================= q-point: ( 0.23 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.591 ( 14.271 0.000 6.016) 15.487 0.673 ( 18.484 0.000 19.152) 26.617 2.284 ( 47.002 0.000 3.179) 47.109 2.837 ( -6.965 -0.000 -7.897) 10.529 3.017 ( 1.447 0.000 5.199) 5.397 3.055 ( -12.632 -0.000 2.079) 12.802 4.195 ( -11.992 -0.000 -10.381) 15.861 4.243 ( 2.174 0.000 6.779) 7.119 4.567 ( 20.708 0.000 -10.981) 23.439 4.805 ( -1.433 -0.000 -2.347) 2.750 4.896 ( -5.096 -0.000 7.955) 9.447 5.791 ( -0.983 -0.000 5.809) 5.892 5.850 ( 2.453 0.000 -0.649) 2.538 6.561 ( -8.288 -0.000 -10.895) 13.690 7.019 ( -8.809 -0.000 3.512) 9.483 8.707 ( 0.013 0.000 1.033) 1.033 9.576 ( -6.337 -0.000 -0.743) 6.381 10.868 ( 2.186 0.000 -0.874) 2.354 13.128 ( 0.974 0.000 2.309) 2.506 14.450 ( 1.538 0.000 -1.776) 2.350 14.526 ( 1.220 0.000 3.053) 3.287 15.052 ( -3.873 -0.000 -7.692) 8.612 15.842 ( -4.534 -0.000 -2.989) 5.431 16.806 ( 11.627 0.000 1.795) 11.765 18.308 ( 11.767 0.000 -12.383) 17.082 19.477 ( -3.200 -0.000 -1.824) 3.684 19.837 ( -0.242 -0.000 -2.356) 2.368 21.068 ( -8.219 -0.000 1.035) 8.284 55.928 ( -2.510 -0.000 39.920) 39.999 57.453 ( -10.787 -0.000 -0.533) 10.800 ======================= Grid point 43 (31/322) ======================= q-point: ( 0.31 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.905 ( 20.482 -7.422 10.474) 24.172 1.039 ( 11.325 -25.973 10.316) 30.154 2.593 ( 32.305 0.565 -0.169) 32.311 2.848 ( 0.655 -1.624 -5.979) 6.230 2.985 ( -0.539 -2.097 4.835) 5.298 3.068 ( -10.327 -8.258 2.121) 13.392 4.069 ( -9.332 2.902 -10.219) 14.139 4.208 ( 3.606 5.458 6.065) 8.921 4.711 ( 10.115 -1.501 -8.797) 13.489 4.810 ( 3.581 0.053 -3.785) 5.211 4.911 ( -5.003 -4.692 7.443) 10.121 5.753 ( -0.682 2.330 3.477) 4.241 5.891 ( -0.825 -1.508 -0.230) 1.734 6.471 ( -5.737 1.355 -6.150) 8.519 6.928 ( -9.522 2.423 3.228) 10.342 8.700 ( 0.086 0.801 0.190) 0.828 9.636 ( -6.514 -10.559 -0.804) 12.432 10.978 ( -0.229 -9.471 -0.937) 9.520 13.132 ( 1.215 0.674 2.449) 2.816 14.456 ( 1.355 0.197 -1.686) 2.172 14.535 ( 1.273 0.505 2.810) 3.126 15.004 ( -3.768 0.750 -6.104) 7.212 15.796 ( -3.358 0.876 -3.064) 4.629 16.872 ( 11.439 1.992 1.799) 11.750 18.312 ( 13.100 6.446 -8.668) 16.979 19.432 ( -4.213 1.573 -2.248) 5.027 19.831 ( -0.302 0.105 -2.157) 2.181 21.006 ( -8.060 0.357 1.301) 8.172 55.943 ( 1.830 3.330 30.678) 30.913 57.323 ( -11.449 4.794 -1.311) 12.481 ======================= Grid point 44 (32/322) ======================= q-point: ( 0.38 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.236 ( 18.157 -10.175 9.466) 22.865 1.633 ( 14.721 -21.781 8.454) 27.615 2.659 ( 1.787 4.116 -4.802) 6.572 2.863 ( 3.285 -2.238 -3.822) 5.514 3.096 ( 3.939 -5.706 4.483) 8.256 3.315 ( 2.937 -17.165 1.169) 17.454 3.922 ( -4.809 5.354 -8.293) 10.980 4.121 ( 1.420 6.577 6.652) 9.462 4.754 ( 0.697 -1.648 -7.623) 7.830 4.811 ( 5.683 2.204 -4.855) 7.793 4.997 ( -1.663 -3.765 6.608) 7.785 5.723 ( -0.245 0.780 1.543) 1.746 5.867 ( -5.613 1.261 -2.154) 6.143 6.424 ( -0.986 1.019 1.354) 1.960 6.825 ( -9.410 0.936 1.176) 9.529 8.681 ( 0.329 1.145 -1.373) 1.818 9.860 ( -6.426 -17.108 -0.419) 18.280 11.193 ( -1.857 -13.414 -0.381) 13.547 13.129 ( 1.502 1.065 2.234) 2.895 14.456 ( 1.034 0.436 -1.460) 1.842 14.535 ( 1.217 0.830 2.214) 2.659 14.953 ( -3.245 0.994 -4.340) 5.509 15.758 ( -2.485 0.302 -2.943) 3.864 16.904 ( 10.344 3.209 1.537) 10.939 18.242 ( 14.031 9.629 -4.700) 17.655 19.349 ( -5.307 2.933 -2.444) 6.537 19.823 ( -0.346 0.105 -1.608) 1.648 20.948 ( -6.893 0.080 1.346) 7.024 55.947 ( 6.035 3.478 21.936) 23.015 57.106 ( -11.667 8.476 -2.583) 14.650 ======================= Grid point 45 (33/322) ======================= q-point: ( 0.46 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.547 ( 13.487 -7.254 5.008) 16.112 2.044 ( 18.754 -5.578 9.628) 21.807 2.588 ( 4.529 2.153 -6.506) 8.214 2.946 ( -7.928 -8.944 0.276) 11.955 3.263 ( -0.543 -8.684 -0.558) 8.719 3.650 ( 4.424 -12.362 -1.380) 13.202 3.770 ( -0.870 6.509 -2.531) 7.038 4.008 ( -2.124 5.402 5.961) 8.320 4.755 ( 3.946 2.531 -5.501) 7.228 4.832 ( 4.688 -2.194 -8.412) 9.877 5.037 ( -2.576 -1.486 7.812) 8.359 5.724 ( -0.605 -0.843 1.153) 1.552 5.778 ( -7.585 1.783 -2.872) 8.304 6.399 ( 0.493 2.349 5.276) 5.796 6.773 ( -7.107 -1.867 -1.222) 7.449 8.661 ( 0.559 0.956 -2.115) 2.387 10.177 ( -6.015 -20.084 -0.045) 20.965 11.453 ( -1.315 -14.533 0.510) 14.601 13.122 ( 1.615 1.218 1.604) 2.582 14.451 ( 0.850 0.565 -1.058) 1.470 14.530 ( 1.013 0.851 1.490) 1.993 14.906 ( -2.700 1.091 -2.733) 3.993 15.739 ( -2.150 -0.575 -2.613) 3.432 16.899 ( 7.963 4.574 0.969) 9.234 18.135 ( 13.229 11.315 -1.743) 17.494 19.242 ( -5.662 3.367 -2.154) 6.931 19.817 ( -0.343 0.034 -0.931) 0.993 20.911 ( -5.025 -0.602 1.022) 5.163 55.972 ( 8.792 2.838 15.413) 17.970 56.833 ( -11.671 10.122 -3.963) 15.949 ======================= Grid point 46 (34/322) ======================= q-point: ( 0.54 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.665 ( 6.464 2.980 -1.657) 7.308 2.170 ( 15.818 6.022 9.930) 19.624 2.643 ( 10.665 -2.499 -5.329) 12.182 3.109 ( -7.556 -12.748 3.560) 15.241 3.361 ( -6.949 -3.279 -3.006) 8.251 3.593 ( 1.116 7.798 -0.779) 7.916 3.864 ( 1.144 -2.823 0.777) 3.144 3.956 ( -4.265 -4.632 1.712) 6.525 4.706 ( 0.713 3.603 -3.126) 4.823 4.896 ( 10.978 1.916 -5.604) 12.474 5.096 ( -3.011 -7.145 3.815) 8.642 5.689 ( -9.235 0.227 3.497) 9.878 5.754 ( 1.434 -1.431 -3.630) 4.157 6.357 ( -0.105 2.857 4.476) 5.311 6.781 ( -3.859 -3.040 -1.666) 5.187 8.648 ( 0.635 0.477 -1.783) 1.952 10.520 ( -5.128 -19.219 0.007) 19.891 11.722 ( -0.055 -13.582 1.151) 13.631 13.111 ( 1.438 1.275 0.748) 2.062 14.446 ( 0.919 0.415 -0.542) 1.145 14.522 ( 0.626 0.765 0.845) 1.300 14.864 ( -2.106 1.036 -1.574) 2.826 15.741 ( -1.787 -1.525 -1.921) 3.035 16.844 ( 4.984 6.130 0.424) 7.912 17.988 ( 9.619 12.744 -0.165) 15.968 19.147 ( -4.219 2.080 -1.398) 4.907 19.814 ( -0.274 -0.071 -0.395) 0.486 20.903 ( -2.953 -1.417 0.552) 3.322 56.005 ( 9.962 3.659 10.621) 15.014 56.559 ( -11.193 8.022 -4.823) 14.591 ======================= Grid point 47 (35/322) ======================= q-point: ( 0.62 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.580 ( 4.141 7.490 -4.798) 9.812 2.095 ( 8.146 11.413 8.810) 16.560 2.743 ( 6.993 2.026 -4.227) 8.419 3.250 ( -6.905 -1.417 -2.788) 7.580 3.335 ( -3.049 -5.589 2.576) 6.868 3.512 ( 1.964 0.678 3.708) 4.250 3.896 ( 2.112 -1.185 0.701) 2.521 4.056 ( -5.591 -7.356 -2.762) 9.644 4.623 ( -1.636 3.991 -1.077) 4.446 4.892 ( 7.249 4.080 -2.209) 8.607 5.256 ( 0.650 -8.401 0.562) 8.445 5.647 ( -5.930 -0.959 3.269) 6.839 5.791 ( 0.980 -1.859 -2.000) 2.901 6.306 ( -0.467 2.734 1.982) 3.408 6.822 ( -1.501 -3.378 -1.037) 3.839 8.646 ( 0.550 -0.082 -0.903) 1.060 10.817 ( -3.607 -14.467 -0.157) 14.910 11.965 ( 0.852 -10.911 1.236) 11.014 13.095 ( 1.021 1.424 0.050) 1.753 14.447 ( 0.933 0.080 -0.045) 0.938 14.512 ( 0.234 0.756 0.330) 0.857 14.832 ( -1.381 0.619 -0.859) 1.740 15.766 ( -1.214 -2.442 -1.025) 2.913 16.743 ( 2.386 6.991 0.184) 7.389 17.781 ( 4.189 13.776 0.134) 14.400 19.108 ( -1.650 -0.460 -0.512) 1.788 19.814 ( -0.155 -0.189 -0.120) 0.272 20.923 ( -1.194 -2.146 0.184) 2.463 55.963 ( 5.817 9.135 4.783) 11.839 56.406 ( -6.233 -0.738 -2.605) 6.796 ======================= Grid point 48 (36/322) ======================= q-point: (-0.31 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.463 ( 3.094 6.340 -3.714) 7.973 1.932 ( 2.540 9.585 6.377) 11.789 2.582 ( -1.345 14.244 -3.203) 14.661 3.137 ( -2.986 6.757 -1.606) 7.560 3.501 ( 2.035 -9.138 0.385) 9.370 3.627 ( 1.097 -9.028 3.585) 9.776 3.931 ( 2.314 -0.539 0.272) 2.391 4.137 ( -3.716 -4.943 -2.509) 6.673 4.537 ( -1.399 3.520 0.122) 3.790 4.850 ( 2.308 3.426 -1.045) 4.261 5.387 ( 0.831 -4.033 0.371) 4.135 5.646 ( -2.241 -1.393 1.682) 3.129 5.830 ( 0.541 -1.849 -0.556) 2.005 6.253 ( -0.423 2.576 0.096) 2.612 6.883 ( -0.200 -3.703 -0.373) 3.727 8.655 ( 0.327 -0.526 -0.151) 0.638 11.003 ( -1.733 -6.505 -0.246) 6.736 12.150 ( 1.024 -7.353 0.781) 7.465 13.070 ( 0.511 1.727 -0.195) 1.811 14.455 ( 0.603 -0.217 0.234) 0.682 14.497 ( 0.001 0.905 -0.025) 0.906 14.819 ( -0.646 -0.145 -0.339) 0.744 15.810 ( -0.562 -2.728 -0.322) 2.804 16.622 ( 0.614 6.547 0.133) 6.577 17.539 ( 0.396 12.438 -0.034) 12.445 19.134 ( -0.096 -2.726 0.001) 2.728 19.818 ( -0.041 -0.297 -0.033) 0.302 20.965 ( -0.145 -2.652 0.004) 2.656 55.785 ( 0.586 10.633 0.448) 10.658 56.467 ( -0.692 -7.007 -0.151) 7.043 ======================= Grid point 49 (37/322) ======================= q-point: (-0.23 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.365 ( 0.000 5.090 -0.000) 5.090 1.829 ( 0.000 2.016 -0.000) 2.016 2.247 ( 0.000 18.351 -0.000) 18.351 2.979 ( 0.000 7.579 -0.000) 7.579 3.628 ( -0.000 -1.114 0.000) 1.114 3.824 ( -0.000 -9.398 0.000) 9.398 3.976 ( -0.000 -4.373 0.000) 4.373 4.190 ( -0.000 -2.613 0.000) 2.613 4.467 ( 0.000 3.513 -0.000) 3.513 4.800 ( 0.000 2.309 -0.000) 2.309 5.423 ( 0.000 0.317 -0.000) 0.317 5.665 ( -0.000 -1.260 0.000) 1.260 5.864 ( -0.000 -1.287 0.000) 1.287 6.204 ( 0.000 2.237 -0.000) 2.237 6.956 ( -0.000 -3.824 0.000) 3.824 8.668 ( -0.000 -0.710 0.000) 0.710 11.031 ( 0.000 2.986 -0.000) 2.986 12.261 ( -0.000 -3.649 0.000) 3.649 13.037 ( 0.000 1.781 -0.000) 1.781 14.463 ( -0.000 -0.369 0.000) 0.369 14.477 ( 0.000 1.154 -0.000) 1.154 14.826 ( -0.000 -0.787 0.000) 0.787 15.850 ( -0.000 -1.298 0.000) 1.298 16.511 ( 0.000 4.945 -0.000) 4.945 17.343 ( 0.000 7.232 -0.000) 7.232 19.201 ( -0.000 -4.050 0.000) 4.050 19.825 ( -0.000 -0.365 0.000) 0.365 21.019 ( -0.000 -2.898 0.000) 2.898 55.602 ( 0.000 8.211 -0.000) 8.211 56.632 ( -0.000 -9.991 0.000) 9.991 ======================= Grid point 56 (38/322) ======================= q-point: ( 0.31 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.824 ( 15.096 0.000 5.250) 15.983 1.029 ( 22.122 0.000 16.386) 27.530 2.698 ( -8.484 -0.000 -8.762) 12.197 2.877 ( -12.151 -0.000 2.977) 12.510 2.932 ( 36.044 0.000 0.360) 36.046 3.017 ( 0.124 0.000 6.838) 6.839 4.012 ( -7.536 -0.000 -10.032) 12.547 4.294 ( 1.723 0.000 6.280) 6.512 4.776 ( -1.442 -0.000 -2.453) 2.846 4.787 ( 1.749 0.000 1.868) 2.559 4.884 ( 12.269 0.000 -6.701) 13.980 5.764 ( -5.459 -0.000 4.882) 7.324 5.883 ( 2.280 0.000 -0.579) 2.352 6.413 ( -7.374 -0.000 -6.819) 10.044 6.890 ( -10.309 -0.000 3.583) 10.914 8.711 ( 0.013 0.000 1.049) 1.049 9.485 ( -5.654 -0.000 -0.666) 5.693 10.894 ( 1.791 0.000 -0.829) 1.973 13.152 ( 1.154 0.000 2.554) 2.803 14.465 ( 1.246 0.000 -1.476) 1.932 14.554 ( 1.315 0.000 2.658) 2.966 14.972 ( -3.978 -0.000 -5.328) 6.649 15.772 ( -3.579 -0.000 -3.297) 4.866 16.973 ( 10.348 0.000 1.657) 10.480 18.452 ( 12.490 0.000 -8.229) 14.957 19.410 ( -5.149 -0.000 -2.441) 5.698 19.826 ( -0.328 -0.000 -2.119) 2.145 20.952 ( -7.961 -0.000 1.307) 8.068 56.034 ( 1.729 0.000 27.568) 27.622 57.283 ( -11.762 -0.000 -1.571) 11.867 ======================= Grid point 57 (39/322) ======================= q-point: ( 0.38 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.239 ( 15.728 -24.078 1.747) 28.812 1.263 ( 19.215 -6.385 16.859) 26.348 2.664 ( -5.182 -2.323 -8.755) 10.435 2.822 ( -10.252 -2.320 0.788) 10.541 2.946 ( -10.090 -1.403 2.671) 10.531 3.284 ( 34.136 -4.114 4.127) 34.629 3.936 ( -3.991 1.922 -8.540) 9.620 4.273 ( 2.078 4.710 7.164) 8.822 4.692 ( -5.196 0.921 -3.481) 6.322 4.847 ( -4.716 -2.620 4.959) 7.328 4.998 ( 17.967 -0.549 -10.429) 20.782 5.720 ( -6.505 0.228 4.431) 7.874 5.869 ( -0.978 2.513 -2.345) 3.574 6.388 ( -3.199 -2.563 -2.116) 4.613 6.793 ( -10.138 2.329 2.862) 10.789 8.703 ( 0.176 0.899 0.164) 0.931 9.547 ( -5.316 -10.128 -0.454) 11.447 10.981 ( 0.773 -7.712 -0.563) 7.771 13.158 ( 1.190 0.560 2.328) 2.674 14.469 ( 0.998 0.277 -1.196) 1.582 14.562 ( 1.187 0.587 2.132) 2.509 14.934 ( -3.428 0.353 -4.085) 5.345 15.740 ( -2.809 0.288 -2.999) 4.119 17.028 ( 9.041 1.899 1.443) 9.350 18.478 ( 12.767 5.312 -5.586) 14.914 19.348 ( -6.107 1.655 -2.512) 6.807 19.819 ( -0.322 0.066 -1.718) 1.749 20.900 ( -6.819 -0.064 1.307) 6.944 56.074 ( 4.175 1.897 21.519) 22.002 57.148 ( -11.433 4.869 -2.451) 12.666 ======================= Grid point 58 (40/322) ======================= q-point: ( 0.46 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.535 ( 17.670 -6.241 9.328) 20.933 1.870 ( 13.987 -25.459 6.855) 29.847 2.627 ( -0.623 1.423 -7.423) 7.584 2.799 ( -7.998 -1.575 -3.951) 9.059 2.990 ( -14.195 -11.800 3.023) 18.705 3.590 ( 23.667 -4.533 2.656) 24.243 3.852 ( -1.190 3.729 -6.496) 7.585 4.162 ( 0.000 8.675 8.426) 12.094 4.684 ( -4.194 -5.024 -7.398) 9.877 4.845 ( -2.344 0.591 3.321) 4.108 5.093 ( 13.458 1.568 -5.270) 14.538 5.680 ( -9.371 -0.767 5.289) 10.788 5.782 ( -1.921 3.417 -4.853) 6.238 6.430 ( 1.218 -1.203 2.959) 3.419 6.692 ( -8.955 0.270 0.202) 8.961 8.683 ( 0.453 1.208 -0.997) 1.630 9.774 ( -4.881 -16.902 -0.136) 17.593 11.183 ( 0.019 -12.559 0.017) 12.559 13.156 ( 1.154 0.952 1.736) 2.291 14.466 ( 0.759 0.494 -0.820) 1.221 14.557 ( 0.938 0.947 1.411) 1.941 14.897 ( -2.651 0.579 -2.671) 3.808 15.714 ( -2.018 -0.020 -2.444) 3.169 17.036 ( 6.960 3.612 1.017) 7.907 18.424 ( 12.171 8.985 -2.687) 15.365 19.254 ( -6.408 2.782 -2.196) 7.322 19.814 ( -0.279 0.046 -1.115) 1.150 20.864 ( -4.942 -0.577 1.047) 5.084 56.104 ( 6.767 2.082 15.552) 17.088 56.929 ( -10.826 8.782 -3.718) 14.427 ======================= Grid point 59 (41/322) ======================= q-point: ( 0.54 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.729 ( 8.552 -1.340 3.834) 9.467 2.330 ( 16.019 -6.576 9.044) 19.535 2.673 ( 10.786 -2.916 -5.875) 12.623 2.788 ( -12.056 -9.886 -3.231) 15.923 3.128 ( -14.836 -11.740 -0.185) 18.920 3.740 ( 2.731 6.020 -5.736) 8.752 3.798 ( 7.777 -3.107 2.516) 8.744 4.000 ( -2.424 7.240 6.185) 9.825 4.761 ( 1.918 -0.053 -6.274) 6.561 4.847 ( -2.729 -6.850 2.077) 7.660 5.113 ( 10.270 4.700 -1.962) 11.464 5.615 ( -11.834 -0.570 3.779) 12.435 5.741 ( 0.875 0.003 -3.145) 3.264 6.424 ( 0.770 3.047 4.190) 5.238 6.680 ( -4.778 -3.910 -1.680) 6.398 8.663 ( 0.502 0.968 -1.202) 1.623 10.103 ( -3.776 -20.038 0.001) 20.390 11.448 ( 0.056 -14.593 0.487) 14.601 13.145 ( 0.932 1.184 0.934) 1.773 14.460 ( 0.629 0.491 -0.414) 0.899 14.545 ( 0.580 1.013 0.754) 1.390 14.864 ( -1.819 0.786 -1.451) 2.456 15.705 ( -1.338 -0.691 -1.656) 2.239 16.991 ( 4.257 5.388 0.498) 6.885 18.298 ( 9.023 11.980 -0.712) 15.015 19.155 ( -4.867 2.500 -1.454) 5.661 19.810 ( -0.205 -0.028 -0.527) 0.566 20.855 ( -2.847 -1.312 0.592) 3.190 56.146 ( 8.752 1.653 11.034) 14.180 56.653 ( -10.488 10.753 -5.082) 15.857 ======================= Grid point 60 (42/322) ======================= q-point: ( 0.62 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.719 ( 1.743 5.274 -0.412) 5.570 2.384 ( 8.415 9.762 4.628) 13.694 2.769 ( 5.398 -4.262 -1.958) 7.151 3.049 ( 2.841 -13.529 -0.694) 13.841 3.197 ( -13.234 -6.530 -0.716) 14.775 3.609 ( 0.693 6.842 -0.101) 6.878 3.883 ( 0.792 -1.772 0.342) 1.971 3.923 ( -1.058 -1.235 0.752) 1.792 4.698 ( -0.228 4.447 -0.786) 4.522 5.022 ( 5.924 -1.552 -3.093) 6.861 5.082 ( 0.110 -3.643 1.345) 3.885 5.579 ( -5.766 -2.010 2.024) 6.433 5.760 ( 0.496 -1.499 -1.226) 1.999 6.365 ( -0.101 3.365 1.790) 3.813 6.737 ( -1.427 -4.161 -0.801) 4.471 8.651 ( 0.307 0.439 -0.643) 0.837 10.466 ( -2.027 -19.282 -0.009) 19.388 11.728 ( 0.231 -13.950 0.497) 13.960 13.127 ( 0.522 1.313 0.257) 1.436 14.456 ( 0.445 0.270 -0.105) 0.532 14.530 ( 0.218 0.931 0.280) 0.996 14.837 ( -0.905 0.815 -0.587) 1.352 15.718 ( -0.666 -1.610 -0.743) 1.894 16.894 ( 1.726 6.879 0.144) 7.093 18.089 ( 3.819 14.476 -0.008) 14.972 19.096 ( -1.890 0.787 -0.547) 2.120 19.810 ( -0.102 -0.124 -0.147) 0.218 20.874 ( -1.062 -2.008 0.196) 2.280 56.189 ( 10.872 4.917 8.648) 14.737 56.376 ( -11.351 6.600 -6.642) 14.714 ======================= Grid point 61 (43/322) ======================= q-point: ( 0.69 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( 0.000 7.012 -0.000) 7.012 2.179 ( 0.000 13.315 -0.000) 13.315 2.792 ( 0.000 6.249 -0.000) 6.249 3.188 ( -0.000 -0.831 0.000) 0.831 3.313 ( -0.000 -10.518 0.000) 10.518 3.533 ( 0.000 0.016 -0.000) 0.016 3.920 ( -0.000 -1.626 0.000) 1.626 4.003 ( -0.000 -6.497 0.000) 6.497 4.609 ( 0.000 4.424 -0.000) 4.424 4.946 ( 0.000 5.448 -0.000) 5.448 5.264 ( -0.000 -8.929 0.000) 8.929 5.604 ( -0.000 -2.126 0.000) 2.126 5.795 ( -0.000 -1.914 0.000) 1.914 6.305 ( 0.000 2.973 -0.000) 2.973 6.809 ( -0.000 -3.850 0.000) 3.850 8.649 ( -0.000 -0.132 0.000) 0.132 10.789 ( -0.000 -14.565 0.000) 14.565 11.974 ( -0.000 -11.219 0.000) 11.219 13.103 ( 0.000 1.471 -0.000) 1.471 14.455 ( -0.000 -0.008 0.000) 0.008 14.514 ( 0.000 0.861 -0.000) 0.861 14.820 ( 0.000 0.488 -0.000) 0.488 15.755 ( -0.000 -2.517 0.000) 2.517 16.761 ( 0.000 7.402 -0.000) 7.402 17.813 ( 0.000 15.085 -0.000) 15.085 19.094 ( -0.000 -1.178 0.000) 1.178 19.813 ( -0.000 -0.221 0.000) 0.221 20.915 ( -0.000 -2.477 0.000) 2.477 56.021 ( 0.000 13.129 -0.000) 13.129 56.349 ( -0.000 -4.720 0.000) 4.720 ======================= Grid point 71 (44/322) ======================= q-point: ( 0.38 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.051 ( 13.326 0.000 4.107) 13.944 1.405 ( 22.029 0.000 12.990) 25.573 2.533 ( -10.156 -0.000 -6.742) 12.190 2.743 ( -7.222 -0.000 2.030) 7.502 2.863 ( -13.461 -0.000 -0.814) 13.485 3.518 ( 34.653 0.000 3.624) 34.842 3.924 ( -1.081 -0.000 -6.566) 6.655 4.333 ( 1.136 0.000 4.528) 4.668 4.695 ( -11.538 -0.000 5.700) 12.869 4.750 ( -1.115 -0.000 -1.970) 2.264 5.118 ( 18.985 0.000 -12.668) 22.823 5.662 ( -10.142 -0.000 3.677) 10.788 5.910 ( 1.600 0.000 -0.391) 1.647 6.321 ( -3.003 -0.000 -1.798) 3.500 6.752 ( -9.708 -0.000 2.700) 10.077 8.714 ( 0.008 0.000 0.786) 0.786 9.413 ( -3.859 -0.000 -0.454) 3.886 10.913 ( 1.146 0.000 -0.590) 1.289 13.175 ( 0.972 0.000 2.060) 2.278 14.476 ( 0.800 0.000 -0.924) 1.223 14.579 ( 0.996 0.000 1.751) 2.015 14.907 ( -2.873 -0.000 -3.279) 4.359 15.719 ( -2.404 -0.000 -2.554) 3.508 17.108 ( 7.249 0.000 1.197) 7.347 18.608 ( 11.537 0.000 -4.608) 12.423 19.314 ( -6.629 -0.000 -2.354) 7.035 19.815 ( -0.287 -0.000 -1.437) 1.465 20.855 ( -5.731 -0.000 1.161) 5.848 56.152 ( 3.807 0.000 17.609) 18.016 57.113 ( -10.189 -0.000 -2.466) 10.484 ======================= Grid point 72 (45/322) ======================= q-point: ( 0.46 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.430 ( 9.708 -25.572 4.390) 27.703 1.602 ( 18.642 -2.860 8.691) 20.767 2.541 ( -7.204 -7.437 -6.858) 12.419 2.694 ( -6.544 0.089 -0.172) 6.547 2.775 ( -12.311 -1.874 0.843) 12.481 3.752 ( 25.923 0.128 3.082) 26.106 3.896 ( 1.724 2.136 -5.090) 5.783 4.316 ( 1.003 4.533 6.525) 8.008 4.566 ( -10.583 0.291 -2.845) 10.962 4.800 ( -2.907 -3.359 2.076) 4.903 5.222 ( 17.002 0.844 -10.661) 20.086 5.594 ( -11.999 -0.449 4.548) 12.839 5.857 ( -0.006 5.080 -1.251) 5.232 6.370 ( 0.699 -5.254 0.612) 5.336 6.664 ( -8.106 2.428 1.520) 8.597 8.706 ( 0.148 0.879 0.097) 0.896 9.484 ( -2.967 -9.678 -0.193) 10.124 10.991 ( 0.579 -7.211 -0.282) 7.240 13.179 ( 0.751 0.513 1.447) 1.709 14.477 ( 0.542 0.293 -0.592) 0.854 14.581 ( 0.701 0.638 1.124) 1.470 14.883 ( -1.991 0.203 -2.105) 2.905 15.699 ( -1.603 0.094 -1.828) 2.433 17.136 ( 5.038 1.975 0.814) 5.472 18.633 ( 9.743 4.783 -2.568) 11.153 19.247 ( -6.182 1.594 -1.838) 6.643 19.811 ( -0.208 0.033 -0.936) 0.960 20.824 ( -3.882 -0.360 0.853) 3.991 56.195 ( 4.280 0.853 12.164) 12.923 56.991 ( -8.178 5.216 -2.708) 10.071 ======================= Grid point 73 (46/322) ======================= q-point: ( 0.54 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.765 ( 8.659 -2.331 4.702) 10.125 2.054 ( 7.311 -28.638 3.436) 29.756 2.622 ( 2.177 -2.583 -6.015) 6.898 2.677 ( -2.961 -3.436 -4.472) 6.370 2.789 ( -13.312 -9.046 5.047) 16.867 3.832 ( 0.457 2.944 -0.995) 3.141 3.887 ( 13.332 3.084 -1.289) 13.745 4.163 ( -2.792 10.061 5.317) 11.717 4.607 ( -2.866 -9.325 -3.822) 10.478 4.817 ( -1.792 0.242 2.053) 2.736 5.287 ( 14.537 3.731 -6.453) 16.337 5.515 ( -13.417 -0.747 4.808) 14.272 5.767 ( 0.091 3.040 -1.376) 3.338 6.480 ( 4.290 -1.671 2.992) 5.491 6.572 ( -7.129 -0.596 -1.538) 7.318 8.686 ( 0.214 1.192 -0.365) 1.264 9.724 ( -1.803 -16.604 -0.016) 16.701 11.185 ( 0.159 -12.371 0.040) 12.372 13.172 ( 0.435 0.920 0.660) 1.213 14.472 ( 0.297 0.457 -0.247) 0.599 14.570 ( 0.345 1.021 0.476) 1.178 14.864 ( -1.012 0.449 -0.917) 1.437 15.688 ( -0.761 -0.146 -0.936) 1.215 17.107 ( 2.458 3.916 0.355) 4.637 18.556 ( 5.676 8.975 -0.774) 10.647 19.168 ( -3.660 2.316 -0.967) 4.438 19.808 ( -0.107 0.009 -0.396) 0.410 20.817 ( -1.790 -0.950 0.402) 2.066 56.226 ( 3.916 0.515 6.493) 7.600 56.791 ( -5.382 9.785 -2.512) 11.446 ======================= Grid point 74 (47/322) ======================= q-point: ( 0.62 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.800 ( 0.000 1.955 -0.000) 1.955 2.566 ( -0.000 -18.241 0.000) 18.241 2.575 ( 0.000 4.954 -0.000) 4.954 2.867 ( -0.000 -11.093 0.000) 11.093 2.904 ( -0.000 -11.335 0.000) 11.335 3.744 ( 0.000 6.098 -0.000) 6.098 3.883 ( 0.000 1.379 -0.000) 1.379 3.981 ( 0.000 6.875 -0.000) 6.875 4.775 ( 0.000 3.289 -0.000) 3.289 4.815 ( -0.000 -12.368 0.000) 12.368 5.218 ( 0.000 7.754 -0.000) 7.754 5.506 ( -0.000 -2.854 0.000) 2.854 5.742 ( -0.000 -0.175 0.000) 0.175 6.439 ( 0.000 4.142 -0.000) 4.142 6.638 ( -0.000 -5.450 0.000) 5.450 8.665 ( 0.000 0.962 -0.000) 0.962 10.075 ( -0.000 -19.962 0.000) 19.962 11.450 ( -0.000 -14.654 0.000) 14.654 13.153 ( 0.000 1.182 -0.000) 1.182 14.464 ( 0.000 0.427 -0.000) 0.427 14.551 ( 0.000 1.077 -0.000) 1.077 14.848 ( 0.000 0.715 -0.000) 0.715 15.692 ( -0.000 -0.741 0.000) 0.741 17.023 ( 0.000 5.689 -0.000) 5.689 18.367 ( 0.000 12.539 -0.000) 12.539 19.113 ( 0.000 1.847 -0.000) 1.847 19.808 ( -0.000 -0.051 0.000) 0.051 20.835 ( -0.000 -1.570 0.000) 1.570 56.251 ( -0.000 -0.756 0.000) 0.756 56.545 ( 0.000 12.953 -0.000) 12.953 ======================= Grid point 86 (48/322) ======================= q-point: ( 0.46 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.210 ( 5.976 0.000 1.752) 6.228 1.706 ( 12.123 0.000 6.152) 13.594 2.396 ( -5.196 -0.000 -2.539) 5.783 2.664 ( -9.756 -0.000 -2.177) 9.996 2.679 ( -2.258 -0.000 0.537) 2.321 3.878 ( 4.368 0.000 0.416) 4.388 3.984 ( 17.147 0.000 -1.056) 17.180 4.355 ( 0.407 0.000 1.675) 1.724 4.516 ( -12.735 -0.000 2.140) 12.913 4.733 ( -0.430 -0.000 -0.779) 0.890 5.326 ( 14.604 0.000 -9.774) 17.573 5.511 ( -12.002 -0.000 5.498) 13.202 5.925 ( 0.574 0.000 -0.137) 0.590 6.304 ( 0.145 0.000 0.231) 0.273 6.646 ( -4.682 -0.000 0.967) 4.781 8.716 ( 0.003 0.000 0.292) 0.292 9.374 ( -1.366 -0.000 -0.161) 1.375 10.923 ( 0.392 0.000 -0.213) 0.446 13.190 ( 0.385 0.000 0.799) 0.887 14.482 ( 0.276 0.000 -0.311) 0.415 14.593 ( 0.369 0.000 0.607) 0.710 14.871 ( -1.039 -0.000 -1.124) 1.530 15.688 ( -0.861 -0.000 -0.962) 1.291 17.184 ( 2.620 0.000 0.439) 2.656 18.734 ( 5.851 0.000 -1.405) 6.017 19.222 ( -4.142 -0.000 -1.053) 4.273 19.809 ( -0.114 -0.000 -0.503) 0.516 20.800 ( -2.075 -0.000 0.472) 2.128 56.241 ( 2.274 0.000 6.520) 6.905 56.993 ( -4.475 -0.000 -1.518) 4.725 ======================= Grid point 87 (49/322) ======================= q-point: ( 0.54 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.516 ( -0.000 -25.586 0.000) 25.586 1.776 ( -0.000 -1.957 0.000) 1.957 2.462 ( -0.000 -8.610 0.000) 8.610 2.628 ( -0.000 -0.301 0.000) 0.301 2.684 ( -0.000 -1.377 0.000) 1.377 3.875 ( 0.000 1.400 -0.000) 1.400 4.019 ( 0.000 3.792 -0.000) 3.792 4.351 ( 0.000 9.373 -0.000) 9.373 4.426 ( -0.000 -6.617 0.000) 6.617 4.782 ( -0.000 -3.207 0.000) 3.207 5.408 ( -0.000 -1.616 0.000) 1.616 5.432 ( 0.000 2.267 -0.000) 2.267 5.855 ( 0.000 5.630 -0.000) 5.630 6.385 ( -0.000 -6.721 0.000) 6.721 6.598 ( 0.000 3.067 -0.000) 3.067 8.707 ( 0.000 0.850 -0.000) 0.850 9.462 ( -0.000 -9.494 0.000) 9.494 10.995 ( -0.000 -7.116 0.000) 7.116 13.188 ( 0.000 0.504 -0.000) 0.504 14.480 ( 0.000 0.284 -0.000) 0.284 14.588 ( 0.000 0.658 -0.000) 0.658 14.865 ( 0.000 0.171 -0.000) 0.171 15.684 ( 0.000 0.047 -0.000) 0.047 17.174 ( 0.000 2.030 -0.000) 2.030 18.709 ( 0.000 4.718 -0.000) 4.718 19.190 ( 0.000 1.457 -0.000) 1.457 19.808 ( 0.000 0.020 -0.000) 0.020 20.797 ( -0.000 -0.464 0.000) 0.464 56.252 ( 0.000 0.305 -0.000) 0.305 56.921 ( 0.000 5.545 -0.000) 5.545 ======================= Grid point 175 (50/322) ======================= q-point: ( 0.00 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.284 ( 6.428 0.000 13.825) 15.247 0.391 ( 0.128 0.000 19.299) 19.300 1.141 ( -6.611 -0.000 55.221) 55.616 2.872 ( 1.368 0.000 -0.533) 1.469 2.962 ( -2.062 -0.000 -9.927) 10.139 3.412 ( -0.433 -0.000 5.203) 5.221 3.772 ( -2.818 -0.000 -9.468) 9.878 4.140 ( 4.183 0.000 0.973) 4.295 4.819 ( -0.605 -0.000 -3.495) 3.547 4.863 ( -12.100 -0.000 -7.274) 14.118 5.393 ( -7.685 -0.000 2.673) 8.137 5.717 ( 2.104 0.000 1.259) 2.452 5.764 ( 0.105 0.000 -2.201) 2.203 5.958 ( 7.890 0.000 -3.874) 8.790 7.193 ( 0.390 0.000 -0.836) 0.923 8.779 ( 2.055 0.000 6.363) 6.687 9.755 ( -0.373 -0.000 -0.566) 0.677 10.832 ( -1.036 -0.000 2.495) 2.702 13.130 ( 0.560 0.000 3.613) 3.656 14.394 ( -0.063 -0.000 -0.964) 0.966 14.534 ( 0.105 0.000 4.144) 4.145 14.749 ( -7.169 -0.000 -3.079) 7.802 15.713 ( 9.980 0.000 2.796) 10.364 16.401 ( 0.692 0.000 -1.131) 1.326 17.788 ( -8.888 -0.000 -3.792) 9.664 19.514 ( 0.224 0.000 -3.648) 3.655 19.849 ( -0.792 -0.000 0.527) 0.951 21.330 ( -0.090 -0.000 4.766) 4.767 57.209 ( 34.396 0.000 2.772) 34.507 57.728 ( -0.849 -0.000 1.096) 1.387 ======================= Grid point 176 (51/322) ======================= q-point: ( 0.08 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.546 ( 23.385 -6.550 9.486) 26.072 0.715 ( 8.238 -17.945 14.756) 24.650 1.361 ( -0.933 -18.179 41.832) 45.621 2.832 ( 0.840 4.269 -1.847) 4.727 2.991 ( -1.213 -4.144 -6.586) 7.875 3.400 ( -1.436 -0.818 2.436) 2.944 3.803 ( 1.601 -3.426 -8.650) 9.441 4.352 ( 3.303 -12.101 -5.942) 13.880 4.673 ( -15.838 4.501 -3.743) 16.886 4.832 ( -2.231 -1.201 -5.366) 5.934 5.301 ( -9.832 0.393 6.664) 11.884 5.748 ( 0.835 0.764 2.002) 2.299 5.777 ( 5.544 -0.566 -1.782) 5.851 6.087 ( 16.680 -2.105 -8.946) 19.045 7.179 ( -1.488 0.906 -0.849) 1.938 8.758 ( -0.117 2.990 5.336) 6.118 9.820 ( -1.107 -7.620 0.021) 7.700 11.166 ( -6.211 -26.329 -18.407) 32.720 13.131 ( 0.491 0.882 4.299) 4.416 14.394 ( 0.221 -0.109 -0.797) 0.834 14.538 ( 0.188 0.372 3.960) 3.982 14.759 ( 6.043 -0.694 -5.488) 8.193 15.759 ( 6.620 1.606 1.835) 7.055 16.411 ( 3.868 0.495 -0.909) 4.004 17.712 ( 0.006 3.529 -3.405) 4.904 19.490 ( -0.511 1.518 -3.987) 4.296 19.845 ( -0.565 0.107 0.862) 1.036 21.314 ( -2.094 1.595 4.538) 5.246 56.799 ( 2.601 38.880 35.963) 53.026 57.666 ( -2.626 5.222 0.602) 5.876 ======================= Grid point 177 (52/322) ======================= q-point: ( 0.15 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.838 ( 14.140 -7.994 6.715) 17.576 1.105 ( 11.377 -12.919 18.164) 25.025 1.891 ( 9.320 -24.319 18.952) 32.210 2.735 ( -1.264 4.056 -1.901) 4.654 3.036 ( 2.128 -0.938 -0.348) 2.352 3.486 ( -0.121 -8.283 -4.476) 9.416 3.866 ( -0.907 -4.102 -5.816) 7.174 4.422 ( -14.271 2.971 -0.081) 14.577 4.554 ( -0.580 -1.840 -3.515) 4.010 4.831 ( -0.363 -0.506 -4.503) 4.546 5.268 ( -4.235 -1.486 0.734) 4.548 5.727 ( -1.562 1.231 2.318) 3.054 5.826 ( 6.795 0.392 -1.674) 7.009 6.213 ( 10.054 -2.127 -4.068) 11.052 7.135 ( -3.458 1.580 -0.953) 3.920 8.702 ( -1.171 2.687 1.599) 3.339 10.029 ( -0.189 -14.119 1.161) 14.168 11.505 ( -11.279 -19.096 -18.854) 29.109 13.120 ( 0.509 1.392 5.100) 5.311 14.399 ( 0.339 -0.242 -0.612) 0.741 14.534 ( 0.123 0.782 3.255) 3.349 14.809 ( 6.713 -0.431 -6.333) 9.238 15.774 ( 2.321 0.179 1.890) 2.998 16.435 ( 6.617 0.925 -0.384) 6.692 17.636 ( 5.075 5.863 -3.503) 8.509 19.440 ( -1.138 2.302 -4.040) 4.787 19.840 ( -0.551 0.101 0.758) 0.942 21.257 ( -3.477 2.789 3.603) 5.732 56.264 ( 1.247 24.007 39.512) 46.250 57.495 ( -4.679 9.557 -0.156) 10.642 ======================= Grid point 178 (53/322) ======================= q-point: ( 0.23 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.068 ( 9.236 -5.713 2.172) 11.075 1.448 ( 11.256 -11.038 16.348) 22.711 2.273 ( 9.978 -1.188 5.032) 11.237 2.798 ( 4.162 -13.413 0.738) 14.064 3.091 ( 3.541 -3.446 4.181) 6.473 3.625 ( 2.177 -4.706 -11.339) 12.469 3.942 ( -6.086 -7.062 -0.935) 9.370 4.259 ( -12.222 1.646 0.520) 12.343 4.528 ( -1.080 4.379 2.505) 5.159 4.827 ( -0.662 -0.213 -4.623) 4.675 5.292 ( -1.254 -2.856 -3.357) 4.582 5.687 ( -1.810 1.951 1.713) 3.165 5.852 ( 4.922 1.047 -1.075) 5.145 6.301 ( 5.735 -1.305 0.674) 5.921 7.069 ( -4.752 1.837 -1.197) 5.233 8.651 ( -1.431 1.583 -1.100) 2.401 10.344 ( 0.567 -17.617 1.702) 17.708 11.709 ( -10.575 -13.885 -13.173) 21.866 13.105 ( 0.493 1.393 5.705) 5.894 14.406 ( 0.157 -0.366 -0.555) 0.683 14.523 ( 0.127 0.923 2.420) 2.593 14.847 ( 4.622 -0.163 -4.755) 6.633 15.794 ( -0.567 -1.361 0.376) 1.521 16.470 ( 8.244 1.035 0.151) 8.310 17.555 ( 7.661 6.670 -1.507) 10.269 19.372 ( -1.876 3.026 -3.506) 4.997 19.836 ( -0.529 0.032 0.557) 0.769 21.174 ( -3.980 3.334 2.062) 5.587 55.987 ( 2.967 13.237 28.608) 31.661 57.242 ( -6.279 12.116 -1.254) 13.704 ======================= Grid point 179 (54/322) ======================= q-point: ( 0.31 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.173 ( 5.356 0.665 -2.052) 5.774 1.727 ( 10.502 -6.542 13.109) 18.026 2.273 ( 6.129 1.994 -0.407) 6.458 3.092 ( 12.684 -5.799 5.699) 15.066 3.287 ( 1.294 -13.552 0.984) 13.649 3.635 ( 0.718 2.520 -8.980) 9.354 3.991 ( -11.207 -4.441 -7.178) 14.030 4.242 ( -4.908 -4.692 6.001) 9.062 4.411 ( 0.246 5.710 2.331) 6.173 4.817 ( -1.751 -0.575 -4.101) 4.496 5.327 ( -1.779 -1.886 -2.134) 3.358 5.640 ( -0.351 1.794 -1.210) 2.193 5.861 ( 2.934 0.771 0.338) 3.052 6.349 ( 3.047 -0.044 3.245) 4.452 6.997 ( -4.883 1.652 -1.441) 5.352 8.620 ( -1.160 0.372 -1.962) 2.310 10.690 ( 0.677 -16.878 1.272) 16.939 11.856 ( -7.533 -10.294 -9.165) 15.707 13.094 ( 0.237 0.982 5.813) 5.900 14.412 ( -0.259 -0.374 -0.364) 0.582 14.512 ( 0.309 0.613 1.857) 1.979 14.866 ( 2.451 0.255 -2.627) 3.602 15.816 ( -2.155 -1.883 -1.273) 3.132 16.510 ( 8.039 1.134 0.347) 8.126 17.497 ( 8.771 5.244 1.195) 10.289 19.288 ( -2.523 3.425 -2.462) 4.915 19.832 ( -0.477 0.023 0.426) 0.641 21.085 ( -3.547 3.139 0.189) 4.740 55.863 ( 4.114 6.960 19.247) 20.877 56.952 ( -6.962 12.316 -2.464) 14.360 ======================= Grid point 180 (55/322) ======================= q-point: ( 0.38 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.133 ( 1.970 4.320 -4.448) 6.506 1.872 ( 9.158 0.562 9.634) 13.304 2.364 ( 5.432 -6.732 -2.171) 8.918 3.281 ( 10.671 -4.674 7.680) 13.954 3.466 ( -1.072 -2.668 -3.283) 4.364 3.542 ( -1.365 4.468 -3.616) 5.907 3.941 ( -9.367 0.595 -5.585) 10.922 4.253 ( -2.330 -0.867 -0.897) 2.643 4.445 ( 3.283 -5.157 1.605) 6.321 4.816 ( -2.144 -1.129 0.550) 2.485 5.323 ( -3.018 -0.058 -1.111) 3.216 5.622 ( 2.476 0.242 -4.768) 5.377 5.868 ( 1.126 0.207 1.931) 2.245 6.358 ( 0.889 1.182 4.105) 4.364 6.936 ( -3.737 0.994 -1.552) 4.166 8.612 ( -0.633 -0.566 -1.533) 1.752 10.976 ( 0.179 -11.782 0.122) 11.784 11.965 ( -3.390 -6.490 -6.851) 10.027 13.089 ( -0.371 0.520 5.339) 5.377 14.417 ( -0.373 -0.554 0.413) 0.786 14.509 ( 0.299 0.317 1.443) 1.507 14.866 ( 0.712 0.532 -1.024) 1.356 15.832 ( -2.170 -1.789 -1.878) 3.382 16.538 ( 5.734 1.281 0.358) 5.886 17.486 ( 7.352 2.660 3.112) 8.415 19.204 ( -2.419 2.793 -1.223) 3.893 19.829 ( -0.378 0.063 0.361) 0.526 21.009 ( -2.269 2.292 -1.585) 3.593 55.824 ( 3.822 3.518 12.646) 13.671 56.683 ( -5.992 9.479 -3.331) 11.698 ======================= Grid point 181 (56/322) ======================= q-point: ( 0.46 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.081 ( -0.571 -0.461 -5.191) 5.243 1.904 ( 6.065 2.754 8.853) 11.079 2.533 ( 1.942 -6.340 -3.943) 7.714 3.327 ( -4.308 6.957 -6.971) 10.750 3.414 ( -1.619 2.746 -2.089) 3.811 3.530 ( 9.103 -3.324 9.737) 13.738 3.876 ( -4.158 -0.181 -2.064) 4.645 4.272 ( -1.445 -1.942 -4.520) 5.127 4.552 ( 0.908 -3.692 -3.708) 5.311 4.826 ( -2.076 -0.272 8.546) 8.799 5.305 ( -0.025 -0.087 -3.748) 3.749 5.645 ( 4.015 -0.813 -5.570) 6.914 5.873 ( -0.601 -0.045 3.237) 3.292 6.330 ( -0.851 2.366 3.668) 4.447 6.905 ( -1.628 -0.049 -1.480) 2.201 8.625 ( -0.105 -1.107 -0.673) 1.300 11.126 ( -0.489 -3.788 -1.155) 3.990 12.030 ( 1.158 -2.089 -5.694) 6.175 13.083 ( -1.208 0.448 4.536) 4.716 14.431 ( -0.102 -0.879 1.487) 1.730 14.506 ( 0.002 0.443 1.102) 1.188 14.859 ( -0.295 -0.015 -0.238) 0.379 15.848 ( -1.005 -1.332 -1.490) 2.237 16.549 ( 2.229 0.588 0.523) 2.363 17.495 ( 2.330 1.049 3.572) 4.392 19.155 ( -0.920 0.620 -0.110) 1.115 19.826 ( -0.214 0.032 0.341) 0.404 20.963 ( -0.416 1.036 -2.799) 3.014 55.795 ( 0.609 3.696 7.678) 8.543 56.525 ( -2.024 2.587 -2.923) 4.397 ======================= Grid point 182 (57/322) ======================= q-point: (-0.46 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.139 ( -3.201 -7.250 -4.398) 9.064 1.894 ( 3.088 3.372 10.221) 11.197 2.537 ( -9.164 3.475 -2.897) 10.220 3.102 ( -6.326 8.270 -9.437) 14.052 3.438 ( 7.183 -4.446 -2.555) 8.825 3.698 ( 9.636 -3.637 9.289) 13.870 3.845 ( -3.980 0.664 -1.707) 4.381 4.277 ( -0.695 -0.017 -1.769) 1.900 4.580 ( -3.709 -0.893 -5.864) 6.996 4.817 ( -1.024 0.902 8.389) 8.500 5.305 ( 3.228 1.510 -3.601) 5.066 5.691 ( 4.132 -1.866 -4.855) 6.643 5.875 ( -1.625 -0.558 3.787) 4.159 6.272 ( -1.615 3.090 2.358) 4.209 6.910 ( 0.764 -1.017 -1.307) 1.824 8.648 ( 0.220 -1.213 -0.098) 1.237 11.108 ( -0.883 4.814 -1.775) 5.207 12.041 ( 5.540 2.472 -5.452) 8.156 13.067 ( -1.897 0.642 3.805) 4.300 14.451 ( 0.120 -0.798 1.720) 1.900 14.495 ( -0.315 0.687 1.197) 1.415 14.870 ( -0.614 -1.590 0.284) 1.728 15.859 ( 0.143 -0.194 -1.105) 1.131 16.553 ( -1.577 -0.593 0.690) 1.821 17.484 ( -4.277 -0.197 3.151) 5.316 19.172 ( 1.196 -2.182 0.503) 2.538 19.827 ( -0.026 -0.160 0.415) 0.445 20.956 ( 1.589 -0.350 -3.141) 3.538 55.705 ( -3.488 5.199 4.267) 7.576 56.557 ( 2.920 -5.467 -1.421) 6.359 ======================= Grid point 183 (58/322) ======================= q-point: (-0.38 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.249 ( -6.610 -6.920 -3.686) 10.255 1.836 ( 1.880 7.471 13.099) 15.197 2.328 ( -16.301 5.061 -1.892) 17.173 2.925 ( -5.996 3.633 -8.691) 11.166 3.578 ( 3.455 2.058 -0.045) 4.022 3.767 ( 9.704 -0.801 1.628) 9.872 3.881 ( 1.925 -6.069 0.118) 6.368 4.256 ( 1.231 2.993 1.615) 3.617 4.512 ( -6.982 2.384 -1.212) 7.476 4.833 ( 1.115 -1.779 1.267) 2.453 5.257 ( 2.983 5.347 -2.274) 6.531 5.756 ( 2.830 -2.586 -3.444) 5.153 5.889 ( -2.098 -1.660 3.624) 4.505 6.203 ( -1.292 3.129 0.737) 3.465 6.948 ( 2.992 -1.626 -1.151) 3.594 8.671 ( 0.261 -0.955 -0.114) 0.997 10.933 ( -1.032 11.983 -1.310) 12.098 12.000 ( 9.646 6.428 -6.146) 13.120 13.047 ( -2.010 0.397 3.325) 3.905 14.460 ( -0.325 0.214 -0.266) 0.471 14.486 ( -0.139 0.081 2.828) 2.833 14.912 ( -1.086 -3.175 1.035) 3.511 15.847 ( 0.126 1.514 -1.473) 2.116 16.544 ( -4.962 -0.639 0.673) 5.048 17.471 ( -8.603 -3.485 2.520) 9.618 19.247 ( 2.228 -3.819 0.258) 4.429 19.834 ( 0.060 -0.439 0.604) 0.749 20.988 ( 3.293 -1.648 -2.495) 4.448 55.585 ( -4.567 4.275 4.223) 7.547 56.742 ( 5.160 -10.212 -0.553) 11.455 ======================= Grid point 184 (59/322) ======================= q-point: (-0.31 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.244 ( -11.041 0.870 -2.828) 11.431 1.643 ( -2.174 14.691 15.253) 21.289 2.184 ( -13.878 -1.518 -1.469) 14.038 2.856 ( -5.042 -1.871 -6.775) 8.650 3.359 ( -5.510 15.207 4.766) 16.862 3.915 ( 7.851 -1.008 4.625) 9.167 4.049 ( 4.932 -5.391 -7.821) 10.703 4.168 ( 5.993 4.331 1.150) 7.483 4.447 ( -3.135 -0.290 2.835) 4.236 4.886 ( -1.389 -2.877 0.280) 3.207 5.157 ( 3.965 6.213 -3.547) 8.180 5.805 ( 0.786 -1.347 -2.016) 2.548 5.917 ( -3.836 -2.746 3.165) 5.681 6.140 ( -0.481 2.716 -1.084) 2.964 7.008 ( 4.589 -1.847 -1.010) 5.049 8.686 ( 0.099 -0.568 -0.502) 0.764 10.649 ( -1.095 16.090 -0.085) 16.128 11.920 ( 13.500 9.402 -8.135) 18.352 13.039 ( -1.480 -0.410 3.057) 3.421 14.444 ( -0.823 0.693 -0.640) 1.252 14.495 ( 0.012 -0.352 2.780) 2.802 14.970 ( -3.071 -3.839 1.491) 5.137 15.796 ( -1.067 3.063 -2.282) 3.966 16.507 ( -6.759 -0.006 0.471) 6.775 17.515 ( -9.742 -7.664 1.614) 12.500 19.338 ( 1.987 -3.869 -0.771) 4.417 19.845 ( -0.092 -0.595 0.763) 0.972 21.056 ( 4.296 -2.655 -0.967) 5.142 55.506 ( -3.063 1.822 8.186) 8.928 56.999 ( 5.538 -12.072 -0.128) 13.282 ======================= Grid point 185 (60/322) ======================= q-point: (-0.23 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.057 ( -14.931 7.686 -0.685) 16.807 1.337 ( -7.174 15.278 18.081) 24.735 2.083 ( -9.573 6.397 -0.310) 11.518 2.880 ( -4.523 -3.574 -4.501) 7.314 3.044 ( -4.962 10.898 8.376) 14.614 3.830 ( -2.860 12.396 -1.899) 12.863 3.990 ( 4.343 2.968 0.509) 5.285 4.390 ( 11.418 -9.932 -7.594) 16.932 4.474 ( 4.535 -1.391 5.206) 7.043 4.887 ( -6.000 0.403 1.469) 6.191 5.107 ( 7.440 2.161 -3.162) 8.368 5.810 ( -0.764 0.426 -0.858) 1.225 5.940 ( -6.465 -2.747 3.179) 7.710 6.086 ( -0.933 1.874 -4.278) 4.763 7.077 ( 4.968 -1.705 -0.892) 5.328 8.694 ( -0.038 -0.386 -0.567) 0.687 10.324 ( -1.061 16.275 0.974) 16.339 11.807 ( 16.793 12.206 -12.540) 24.254 13.052 ( -0.651 -1.177 2.956) 3.247 14.425 ( -0.894 0.505 -0.615) 1.197 14.506 ( -0.144 -0.343 2.735) 2.760 15.007 ( -7.975 -3.762 0.395) 8.826 15.715 ( -1.580 3.618 -2.284) 4.561 16.458 ( -6.277 -0.054 0.042) 6.278 17.618 ( -9.686 -9.812 0.233) 13.790 19.415 ( 1.305 -3.069 -2.043) 3.910 19.855 ( -0.474 -0.508 0.672) 0.966 21.144 ( 4.343 -3.089 1.032) 5.428 55.515 ( 1.095 -1.925 18.015) 18.151 57.269 ( 4.969 -11.679 0.266) 12.695 ======================= Grid point 186 (61/322) ======================= q-point: (-0.15 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.755 ( -18.845 10.409 1.407) 21.575 1.035 ( -9.579 13.332 21.941) 27.403 1.732 ( -8.537 22.768 11.641) 26.959 2.839 ( -3.729 0.637 2.118) 4.336 3.011 ( -1.665 -3.928 -1.001) 4.382 3.557 ( -0.836 12.477 -0.795) 12.530 3.949 ( -1.411 2.573 -4.356) 5.252 4.460 ( 5.464 3.801 -8.661) 10.923 4.686 ( 11.115 -8.441 0.756) 13.978 4.829 ( -3.884 0.665 -0.455) 3.966 5.153 ( 8.658 -0.402 3.988) 9.541 5.781 ( -1.773 1.306 -0.109) 2.205 5.920 ( -5.202 1.348 3.808) 6.587 6.046 ( -7.769 -2.131 -9.052) 12.118 7.138 ( 4.008 -1.289 -0.854) 4.297 8.703 ( 0.201 -0.643 0.643) 0.931 10.033 ( -0.831 13.013 0.908) 13.071 11.628 ( 17.701 17.870 -21.194) 32.891 13.081 ( 0.078 -1.376 2.997) 3.299 14.410 ( -0.749 0.287 -0.755) 1.102 14.516 ( -0.215 -0.287 3.183) 3.204 14.986 ( -16.284 -3.163 -3.874) 17.035 15.644 ( 0.933 2.813 0.416) 2.993 16.422 ( -4.376 -0.319 -0.523) 4.419 17.735 ( -10.126 -9.521 -1.662) 13.998 19.468 ( 0.754 -2.113 -2.924) 3.685 19.859 ( -0.900 -0.288 0.333) 1.002 21.233 ( 3.429 -2.714 2.912) 5.254 55.703 ( 11.382 -10.469 37.520) 40.582 57.506 ( 3.705 -9.281 0.721) 10.019 ======================= Grid point 187 (62/322) ======================= q-point: (-0.08 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.427 ( -19.001 8.536 6.910) 21.946 0.708 ( -11.719 17.806 14.986) 26.058 1.276 ( -6.691 18.272 40.053) 44.530 2.843 ( -1.286 -2.027 -0.748) 2.514 3.025 ( -0.789 1.868 -6.049) 6.380 3.404 ( 0.282 2.414 2.560) 3.530 3.860 ( -5.214 2.772 -7.586) 9.614 4.317 ( 5.254 13.250 -11.460) 18.289 4.809 ( -3.417 -2.103 -0.913) 4.115 4.875 ( 3.710 -3.700 -5.238) 7.408 5.278 ( 14.392 -3.206 8.357) 16.949 5.743 ( -2.803 0.770 0.480) 2.946 5.834 ( -4.562 3.847 -0.108) 5.968 6.001 ( -14.255 -2.401 -9.206) 17.138 7.178 ( 2.173 -0.692 -0.881) 2.445 8.730 ( 1.370 -1.389 3.985) 4.437 9.830 ( -0.237 7.480 -0.103) 7.485 11.241 ( 8.651 29.263 -24.482) 39.122 13.111 ( 0.498 -0.896 3.198) 3.358 14.400 ( -0.488 0.181 -0.974) 1.104 14.525 ( -0.092 -0.206 3.795) 3.802 14.874 ( -21.592 -0.882 -7.544) 22.889 15.640 ( 6.229 0.526 4.860) 7.918 16.404 ( -1.954 -0.307 -0.978) 2.206 17.812 ( -11.615 -6.551 -4.273) 14.003 19.500 ( 0.569 -1.365 -3.096) 3.431 19.855 ( -1.110 -0.083 0.085) 1.117 21.301 ( 1.847 -1.569 4.233) 4.877 56.338 ( 37.022 -32.293 51.659) 71.289 57.670 ( 1.772 -5.253 1.139) 5.660 ======================= Grid point 189 (63/322) ======================= q-point: ( 0.08 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.484 ( 4.003 0.000 17.909) 18.351 0.828 ( 39.607 0.000 10.684) 41.023 1.253 ( 1.547 0.000 48.740) 48.765 2.880 ( -4.302 -0.000 -11.283) 12.075 2.927 ( 6.060 0.000 1.209) 6.180 3.385 ( -5.657 -0.000 5.520) 7.904 3.823 ( 12.868 0.000 -12.782) 18.138 4.209 ( 4.317 0.000 2.292) 4.888 4.573 ( -20.121 -0.000 -3.886) 20.493 4.794 ( -1.024 -0.000 -4.310) 4.430 5.240 ( -9.351 -0.000 11.480) 14.807 5.767 ( 1.372 0.000 -2.317) 2.693 5.811 ( 5.020 0.000 3.190) 5.947 6.188 ( 18.426 0.000 -21.546) 28.351 7.174 ( -2.476 -0.000 -1.180) 2.743 8.803 ( -1.404 -0.000 7.140) 7.277 9.724 ( -3.460 -0.000 -0.681) 3.526 10.835 ( 0.338 0.000 2.294) 2.319 13.150 ( 0.514 0.000 4.619) 4.647 14.396 ( 0.759 0.000 -0.800) 1.103 14.552 ( 0.419 0.000 4.240) 4.261 14.811 ( 10.743 0.000 -10.648) 15.125 15.821 ( 3.878 0.000 -4.242) 5.747 16.461 ( 8.324 0.000 -1.103) 8.397 17.758 ( 5.642 0.000 -6.241) 8.414 19.492 ( -1.221 -0.000 -5.001) 5.148 19.845 ( -0.358 -0.000 1.733) 1.770 21.314 ( -4.249 -0.000 5.066) 6.612 57.191 ( -26.059 -0.000 18.663) 32.053 57.693 ( -4.281 -0.000 0.594) 4.322 ======================= Grid point 190 (64/322) ======================= q-point: ( 0.15 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.720 ( 4.982 -12.594 13.994) 19.475 1.127 ( 22.836 -4.770 20.517) 31.067 1.568 ( 18.376 -17.274 25.840) 36.107 2.834 ( -0.791 3.061 -7.632) 8.261 2.974 ( 2.565 -2.848 0.617) 3.882 3.369 ( -5.027 -2.994 4.160) 7.179 3.862 ( 10.861 2.234 -10.144) 15.029 4.355 ( -6.395 -2.511 -1.406) 7.013 4.434 ( -8.161 -5.117 -4.334) 10.562 4.794 ( -1.306 -1.282 -4.816) 5.152 5.206 ( -6.950 -0.878 8.118) 10.723 5.755 ( 0.788 1.610 0.784) 1.956 5.865 ( 4.649 -0.977 0.138) 4.752 6.260 ( 11.277 -0.070 -15.937) 19.523 7.133 ( -4.277 1.391 -1.090) 4.628 8.761 ( -1.659 3.483 5.109) 6.402 9.789 ( -3.314 -9.305 -0.243) 9.880 11.035 ( -5.133 -17.339 -5.271) 18.835 13.154 ( 0.603 0.829 5.081) 5.183 14.401 ( 0.996 0.036 -0.716) 1.227 14.556 ( 0.457 0.584 3.909) 3.978 14.857 ( 8.028 0.548 -10.144) 12.948 15.806 ( 0.256 1.610 -3.129) 3.528 16.519 ( 10.804 1.123 -0.738) 10.888 17.770 ( 9.460 3.404 -7.513) 12.551 19.459 ( -1.694 1.355 -5.238) 5.669 19.842 ( -0.423 0.304 1.913) 1.982 21.271 ( -5.723 1.426 4.816) 7.614 56.767 ( -17.293 22.681 34.520) 44.778 57.600 ( -6.625 5.483 0.287) 8.604 ======================= Grid point 191 (65/322) ======================= q-point: ( 0.23 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.000 ( 7.960 -9.465 10.894) 16.481 1.426 ( 19.108 -6.929 18.384) 27.406 2.141 ( 18.566 -21.399 10.121) 30.084 2.724 ( 0.138 4.904 -3.341) 5.935 3.066 ( 2.217 -3.774 2.445) 5.014 3.475 ( -1.720 -9.956 -0.374) 10.110 3.871 ( 5.506 1.938 -6.586) 8.800 4.205 ( -14.308 2.699 -0.974) 14.593 4.549 ( 0.820 -2.900 -1.776) 3.499 4.794 ( -2.524 -0.728 -5.948) 6.502 5.208 ( -4.464 -2.994 1.990) 5.731 5.724 ( -0.079 2.219 2.653) 3.459 5.899 ( 3.368 0.394 -1.964) 3.919 6.319 ( 6.656 -1.230 -6.254) 9.216 7.061 ( -6.196 1.827 -1.019) 6.539 8.686 ( -1.474 3.233 1.152) 3.735 10.015 ( -2.508 -15.754 0.843) 15.975 11.310 ( -8.455 -17.027 -7.867) 20.574 13.146 ( 0.694 1.355 5.497) 5.704 14.407 ( 0.988 0.056 -0.678) 1.199 14.549 ( 0.415 1.059 3.121) 3.321 14.878 ( 4.901 0.515 -7.031) 8.586 15.776 ( -1.549 0.348 -2.107) 2.638 16.571 ( 11.535 1.791 0.071) 11.673 17.743 ( 11.338 5.983 -5.527) 13.961 19.401 ( -2.277 2.246 -4.848) 5.808 19.836 ( -0.486 0.276 1.502) 1.603 21.197 ( -6.288 2.362 3.782) 7.709 56.346 ( -5.013 17.839 32.450) 37.368 57.397 ( -8.521 9.564 -0.708) 12.829 ======================= Grid point 192 (66/322) ======================= q-point: ( 0.31 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.222 ( 11.559 -4.025 4.726) 13.120 1.713 ( 16.364 -6.203 15.731) 23.531 2.404 ( 6.311 5.054 -2.007) 8.330 2.893 ( 7.882 -20.072 1.380) 21.608 3.161 ( 4.010 -3.513 5.921) 7.968 3.662 ( 5.102 -6.348 -6.406) 10.361 3.828 ( -7.052 1.232 -1.941) 7.418 4.115 ( -7.776 -3.061 1.292) 8.456 4.530 ( 0.652 4.802 1.600) 5.103 4.770 ( -3.926 -1.061 -8.534) 9.453 5.252 ( -3.157 -3.671 -0.553) 4.873 5.679 ( -0.200 2.514 1.802) 3.099 5.898 ( 1.523 1.014 -0.884) 2.032 6.373 ( 4.079 -0.599 -0.346) 4.137 6.978 ( -7.049 1.339 -1.402) 7.311 8.628 ( -0.964 1.741 -1.270) 2.361 10.337 ( -2.426 -18.802 1.270) 19.000 11.543 ( -7.116 -14.571 -6.699) 17.546 13.132 ( 0.667 1.508 5.582) 5.821 14.410 ( 0.745 0.097 -0.595) 0.958 14.535 ( 0.481 1.068 2.334) 2.611 14.886 ( 2.415 0.475 -3.989) 4.687 15.765 ( -2.539 -1.050 -2.494) 3.711 16.615 ( 10.941 2.278 0.462) 11.186 17.695 ( 12.288 6.985 -2.191) 14.303 19.324 ( -3.040 2.951 -3.863) 5.734 19.831 ( -0.505 0.122 0.999) 1.126 21.108 ( -5.857 2.602 2.097) 6.743 56.102 ( 1.254 11.453 23.827) 26.466 57.121 ( -9.634 11.706 -1.992) 15.291 ======================= Grid point 193 (67/322) ======================= q-point: ( 0.38 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.302 ( 12.660 5.565 -0.763) 13.850 1.939 ( 12.074 -3.262 13.618) 18.490 2.345 ( 5.131 1.489 -4.449) 6.952 3.277 ( 9.374 -5.501 5.347) 12.113 3.304 ( 0.342 -13.014 0.568) 13.031 3.650 ( 0.019 7.360 1.658) 7.544 3.817 ( -5.010 -5.169 -11.457) 13.531 4.182 ( -6.484 -5.385 5.113) 9.858 4.441 ( 3.808 3.318 -1.270) 5.208 4.764 ( -2.516 -2.188 -5.934) 6.807 5.279 ( -4.211 -1.764 0.498) 4.593 5.642 ( 1.033 1.311 -1.693) 2.378 5.887 ( 0.007 0.700 1.392) 1.557 6.395 ( 1.954 0.857 2.476) 3.269 6.910 ( -6.206 0.353 -1.870) 6.491 8.602 ( -0.268 0.267 -1.789) 1.829 10.677 ( -3.003 -17.712 0.742) 17.980 11.748 ( -3.778 -11.879 -5.345) 13.563 13.117 ( 0.424 1.374 5.226) 5.421 14.413 ( 0.569 -0.004 -0.154) 0.590 14.525 ( 0.518 0.734 1.793) 2.005 14.881 ( 0.498 0.703 -1.823) 2.016 15.770 ( -2.756 -1.959 -2.747) 4.356 16.638 ( 8.812 3.090 0.446) 9.349 17.651 ( 11.660 6.537 0.950) 13.402 19.236 ( -3.452 3.001 -2.487) 5.207 19.827 ( -0.472 0.024 0.646) 0.801 21.026 ( -4.482 2.094 0.079) 4.948 55.982 ( 4.261 7.075 16.374) 18.339 56.821 ( -9.660 11.140 -3.268) 15.103 ======================= Grid point 194 (68/322) ======================= q-point: ( 0.46 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.219 ( 10.807 9.811 -4.396) 15.244 2.029 ( 7.773 3.039 11.272) 14.025 2.436 ( 6.434 -5.696 -5.106) 9.996 3.385 ( 0.667 1.054 -1.202) 1.732 3.440 ( -1.734 -0.209 -1.976) 2.638 3.545 ( -0.200 -0.249 8.952) 8.957 3.837 ( -0.322 -0.897 -6.348) 6.419 4.199 ( -4.578 -2.680 -1.854) 5.619 4.487 ( 3.114 -2.928 -4.050) 5.888 4.800 ( -0.407 -2.560 2.902) 3.892 5.275 ( -2.800 -1.353 -1.093) 3.296 5.643 ( 2.138 -0.588 -4.639) 5.141 5.876 ( -1.226 0.349 3.266) 3.506 6.377 ( -0.061 2.168 3.560) 4.169 6.873 ( -3.907 -0.797 -2.059) 4.487 8.606 ( 0.334 -0.725 -1.233) 1.468 10.950 ( -3.568 -12.544 -0.376) 13.047 11.923 ( 0.006 -8.415 -4.694) 9.636 13.102 ( -0.016 1.205 4.616) 4.770 14.421 ( 0.641 -0.436 0.716) 1.056 14.519 ( 0.304 0.572 1.467) 1.604 14.863 ( -0.704 0.733 -0.723) 1.247 15.792 ( -2.169 -2.542 -2.256) 4.032 16.624 ( 5.637 3.759 0.462) 6.791 17.609 ( 7.964 5.980 2.837) 10.356 19.163 ( -2.634 1.621 -1.068) 3.273 19.825 ( -0.370 -0.016 0.454) 0.586 20.969 ( -2.441 1.000 -1.758) 3.170 55.921 ( 4.130 5.765 11.062) 13.140 56.573 ( -7.428 6.537 -3.941) 10.651 ======================= Grid point 195 (69/322) ======================= q-point: ( 0.54 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.129 ( 8.633 4.964 -6.014) 11.633 2.010 ( 3.967 4.528 11.493) 12.974 2.532 ( 0.326 0.101 -5.517) 5.528 3.226 ( -5.724 9.514 -6.966) 13.108 3.406 ( 1.177 -1.170 -1.226) 2.064 3.669 ( 2.756 -6.165 8.839) 11.123 3.849 ( 3.423 0.396 -1.803) 3.889 4.230 ( -2.881 -3.042 -2.263) 4.762 4.524 ( -1.226 -1.301 -7.629) 7.835 4.834 ( -1.137 -0.008 8.836) 8.909 5.308 ( 2.062 -2.432 -3.879) 5.021 5.672 ( 1.837 -1.556 -5.283) 5.805 5.865 ( -1.984 0.170 3.922) 4.398 6.327 ( -1.231 3.035 3.732) 4.965 6.877 ( -1.185 -1.864 -1.915) 2.923 8.627 ( 0.629 -1.160 -0.563) 1.434 11.091 ( -3.431 -4.692 -1.388) 5.976 12.049 ( 3.398 -4.171 -4.903) 7.279 13.084 ( -0.491 1.276 4.104) 4.326 14.441 ( 0.647 -0.781 1.402) 1.730 14.510 ( -0.010 0.712 1.438) 1.604 14.848 ( -1.083 -0.123 -0.262) 1.121 15.826 ( -1.204 -2.421 -1.517) 3.100 16.584 ( 2.169 3.332 0.638) 4.026 17.536 ( 1.578 5.832 3.408) 6.937 19.144 ( -0.626 -1.032 0.001) 1.207 19.824 ( -0.198 -0.105 0.392) 0.452 20.949 ( -0.215 -0.365 -2.916) 2.947 55.825 ( 0.154 7.572 6.928) 10.264 56.486 ( -1.844 -1.892 -2.932) 3.947 ======================= Grid point 196 (70/322) ======================= q-point: (-0.38 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.145 ( 5.582 -1.587 -4.949) 7.627 1.969 ( 1.317 3.471 12.569) 13.106 2.378 ( -9.998 10.274 -3.267) 14.703 2.994 ( -4.344 8.475 -7.840) 12.336 3.540 ( 7.107 -8.005 -3.000) 11.117 3.770 ( -3.529 -2.336 -3.148) 5.274 3.879 ( 9.674 0.338 7.787) 12.423 4.259 ( -1.635 -1.925 1.130) 2.767 4.498 ( -4.135 0.759 -6.114) 7.420 4.828 ( -0.825 0.486 5.739) 5.818 5.343 ( 3.233 1.237 -3.458) 4.893 5.710 ( 0.340 -2.485 -4.112) 4.816 5.859 ( -1.863 -0.467 2.496) 3.149 6.262 ( -1.002 3.295 3.719) 5.069 6.918 ( 1.112 -2.634 -1.624) 3.288 8.653 ( 0.536 -1.108 -0.387) 1.290 11.073 ( -2.647 3.890 -1.573) 4.961 12.114 ( 6.298 0.172 -6.009) 8.707 13.060 ( -0.751 1.340 3.908) 4.199 14.459 ( 0.289 -0.373 0.796) 0.926 14.497 ( -0.161 0.698 2.102) 2.221 14.857 ( -1.240 -1.693 0.243) 2.113 15.852 ( -0.425 -0.866 -1.283) 1.605 16.535 ( -1.204 2.190 0.741) 2.606 17.433 ( -3.978 3.832 3.374) 6.473 19.189 ( 0.904 -3.303 0.308) 3.439 19.828 ( -0.030 -0.289 0.451) 0.537 20.969 ( 1.659 -1.705 -3.097) 3.906 55.677 ( -2.433 7.159 5.448) 9.319 56.589 ( 2.145 -8.209 -1.737) 8.661 ======================= Grid point 197 (71/322) ======================= q-point: (-0.31 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.200 ( 1.041 -0.481 -2.381) 2.643 1.931 ( 4.617 8.281 15.379) 18.066 2.071 ( -17.474 5.847 -3.968) 18.848 2.833 ( -2.712 4.006 -6.675) 8.244 3.571 ( -2.695 8.594 0.820) 9.044 3.870 ( 2.072 -10.034 -11.096) 15.103 3.977 ( 11.549 -1.760 6.720) 13.477 4.276 ( 0.394 1.249 3.574) 3.807 4.435 ( -3.465 0.818 -0.579) 3.607 4.832 ( -1.659 -1.025 2.390) 3.085 5.291 ( 3.295 5.208 -3.975) 7.334 5.754 ( -1.773 -2.877 -2.077) 3.967 5.861 ( -2.233 -0.914 -0.192) 2.420 6.203 ( 0.372 3.142 3.955) 5.065 6.985 ( 2.559 -2.980 -1.341) 4.151 8.673 ( 0.148 -0.772 -0.764) 1.096 10.906 ( -1.738 11.282 -0.708) 11.437 12.117 ( 8.719 3.882 -8.219) 12.596 13.040 ( -0.639 0.769 3.935) 4.060 14.455 ( -0.250 0.783 -0.196) 0.845 14.495 ( -0.095 -0.083 2.645) 2.648 14.888 ( -2.494 -2.556 0.656) 3.631 15.840 ( -0.121 1.774 -1.406) 2.266 16.483 ( -3.649 1.543 0.649) 4.015 17.371 ( -6.132 -1.246 2.967) 6.925 19.271 ( 1.101 -4.112 -0.281) 4.266 19.836 ( -0.012 -0.452 0.557) 0.717 21.025 ( 2.760 -2.828 -2.242) 4.543 55.558 ( -1.917 4.265 7.771) 9.069 56.800 ( 3.198 -11.555 -1.144) 12.044 ======================= Grid point 198 (72/322) ======================= q-point: (-0.23 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.125 ( -4.316 7.066 -0.199) 8.282 1.640 ( -5.448 17.148 11.083) 21.133 2.043 ( -4.251 -4.040 2.637) 6.430 2.783 ( -1.656 -1.209 -5.193) 5.583 3.303 ( -4.058 15.555 4.596) 16.719 3.911 ( -3.863 1.472 -10.315) 11.113 4.135 ( 4.746 4.021 2.218) 6.604 4.267 ( 7.279 -6.687 -0.130) 9.885 4.466 ( 1.835 -3.343 5.324) 6.549 4.835 ( -4.941 -0.917 2.217) 5.493 5.216 ( 6.181 4.405 -5.869) 9.595 5.780 ( -3.508 -1.899 -0.743) 4.058 5.854 ( -3.955 -0.844 -2.159) 4.584 6.159 ( 2.212 3.212 3.977) 5.571 7.059 ( 2.789 -2.802 -1.144) 4.116 8.683 ( -0.295 -0.506 -1.201) 1.336 10.631 ( -1.026 15.725 0.683) 15.773 12.066 ( 9.949 6.782 -12.277) 17.196 13.039 ( -0.231 -0.339 4.009) 4.030 14.434 ( -0.379 0.963 -0.111) 1.040 14.502 ( -0.237 -0.340 2.302) 2.339 14.905 ( -5.521 -1.798 0.087) 5.807 15.784 ( 0.477 3.682 -0.579) 3.758 16.429 ( -3.966 0.992 0.244) 4.095 17.406 ( -5.779 -6.204 1.866) 8.681 19.353 ( 0.613 -3.775 -1.447) 4.089 19.845 ( -0.226 -0.427 0.533) 0.720 21.106 ( 2.852 -3.543 -0.558) 4.582 55.527 ( 0.730 -0.034 14.488) 14.506 57.059 ( 2.755 -12.836 -0.645) 13.145 ======================= Grid point 199 (73/322) ======================= q-point: (-0.15 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.887 ( -6.045 12.701 1.110) 14.110 1.309 ( -4.769 15.714 16.091) 22.991 2.031 ( 0.869 7.365 4.947) 8.915 2.805 ( -3.387 -1.782 -3.696) 5.320 3.019 ( -1.837 8.765 6.845) 11.272 3.757 ( -4.083 9.249 -8.780) 13.390 4.023 ( 0.487 6.197 -0.774) 6.264 4.481 ( 4.970 -6.091 -2.331) 8.199 4.569 ( -0.263 -5.591 3.913) 6.830 4.810 ( -2.506 -0.176 0.216) 2.521 5.213 ( 8.463 0.638 -4.050) 9.404 5.775 ( -3.510 -0.446 -0.504) 3.574 5.826 ( -6.426 -0.511 -2.117) 6.785 6.120 ( 4.387 4.086 2.825) 6.627 7.123 ( 1.793 -2.207 -1.063) 3.036 8.688 ( -0.497 -0.718 -0.805) 1.188 10.314 ( -0.577 16.240 1.624) 16.331 11.950 ( 8.166 10.065 -19.661) 23.549 13.061 ( 0.225 -1.234 4.068) 4.257 14.415 ( -0.374 0.704 -0.227) 0.829 14.512 ( -0.282 -0.435 2.559) 2.611 14.869 ( -8.345 0.160 -1.539) 8.487 15.722 ( 2.354 3.475 1.960) 4.633 16.395 ( -2.362 0.131 -0.444) 2.406 17.512 ( -4.666 -8.037 0.190) 9.296 19.417 ( 0.121 -2.981 -2.624) 3.973 19.849 ( -0.560 -0.232 0.325) 0.687 21.195 ( 1.913 -3.612 1.473) 4.344 55.643 ( 5.558 -7.092 27.263) 28.713 57.317 ( 1.460 -12.152 -0.102) 12.240 ======================= Grid point 200 (74/322) ======================= q-point: (-0.08 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.617 ( 4.656 13.213 4.641) 14.758 1.012 ( -3.292 15.578 18.875) 24.694 1.745 ( 1.983 23.555 18.920) 30.278 2.782 ( -4.077 -1.872 -0.892) 4.574 3.006 ( 1.448 -2.243 -0.257) 2.682 3.521 ( -2.175 10.010 -4.381) 11.141 3.908 ( -1.764 4.925 -5.804) 7.814 4.509 ( 2.900 4.810 -4.946) 7.484 4.658 ( -10.532 -6.858 -0.366) 12.573 4.836 ( 2.126 -1.716 -4.197) 5.008 5.284 ( 4.616 -2.295 0.362) 5.168 5.747 ( -1.722 0.908 -0.093) 1.949 5.784 ( -4.644 -0.058 -0.376) 4.659 6.079 ( 8.160 4.741 -0.124) 9.439 7.164 ( 0.043 -1.472 -1.011) 1.786 8.707 ( -0.262 -1.684 1.421) 2.219 10.026 ( -0.384 13.159 1.352) 13.234 11.688 ( 0.423 17.860 -29.020) 34.078 13.098 ( 0.470 -1.412 4.137) 4.396 14.401 ( -0.299 0.394 -0.570) 0.755 14.524 ( -0.112 -0.474 3.261) 3.298 14.790 ( -5.100 1.710 -2.749) 6.041 15.705 ( 4.797 1.290 4.502) 6.704 16.389 ( 0.265 -0.428 -0.931) 1.058 17.629 ( -3.189 -6.789 -1.597) 7.669 19.462 ( -0.167 -2.218 -3.356) 4.027 19.847 ( -0.753 -0.064 0.252) 0.797 21.270 ( 0.144 -2.914 3.298) 4.403 56.029 ( 11.722 -22.349 43.958) 50.687 57.532 ( -0.447 -9.513 0.380) 9.532 ======================= Grid point 203 (75/322) ======================= q-point: ( 0.15 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.621 ( 7.200 0.000 15.428) 17.025 1.194 ( 3.161 0.000 39.512) 39.638 1.697 ( 41.980 0.000 11.716) 43.585 2.768 ( -5.856 -0.000 -11.659) 13.047 3.040 ( 7.415 0.000 4.521) 8.684 3.290 ( -9.832 -0.000 6.112) 11.577 4.018 ( 19.434 0.000 -15.204) 24.675 4.273 ( 3.352 0.000 1.680) 3.749 4.291 ( -17.366 -0.000 -2.773) 17.586 4.764 ( -1.040 -0.000 -4.522) 4.640 5.163 ( -7.065 -0.000 9.800) 12.081 5.787 ( 2.399 0.000 -2.285) 3.314 5.875 ( 2.020 0.000 2.991) 3.609 6.296 ( 6.979 0.000 -19.461) 20.675 7.113 ( -5.095 -0.000 -2.006) 5.476 8.797 ( -2.265 -0.000 6.584) 6.963 9.655 ( -5.508 -0.000 -0.463) 5.527 10.855 ( 1.245 0.000 2.186) 2.516 13.175 ( 0.628 0.000 5.148) 5.186 14.409 ( 1.299 0.000 -0.653) 1.454 14.573 ( 0.607 0.000 4.056) 4.101 14.895 ( 5.341 0.000 -10.284) 11.588 15.808 ( -2.278 -0.000 -5.703) 6.141 16.617 ( 12.827 0.000 -1.488) 12.913 17.871 ( 12.789 0.000 -10.427) 16.501 19.448 ( -2.330 -0.000 -6.241) 6.662 19.847 ( -0.480 -0.000 2.821) 2.861 21.245 ( -7.344 -0.000 5.285) 9.048 56.869 ( -26.171 -0.000 30.020) 39.826 57.601 ( -8.647 -0.000 0.799) 8.684 ======================= Grid point 204 (76/322) ======================= q-point: ( 0.23 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.871 ( 10.090 -12.690 12.613) 20.541 1.381 ( 4.452 -10.351 32.958) 34.831 2.073 ( 38.545 -5.905 5.586) 39.393 2.756 ( -4.267 -2.500 -10.120) 11.263 3.058 ( 4.936 1.838 6.480) 8.351 3.277 ( -9.331 -5.751 5.337) 12.191 4.035 ( 16.245 6.552 -9.720) 20.033 4.145 ( -14.996 2.197 -0.907) 15.183 4.432 ( 3.529 -8.818 -5.103) 10.782 4.758 ( -1.388 -0.603 -4.516) 4.763 5.135 ( -6.523 -1.137 6.923) 9.580 5.776 ( 1.671 2.196 0.474) 2.800 5.902 ( 0.439 -1.032 -0.771) 1.361 6.319 ( 4.259 -1.416 -12.277) 13.072 7.048 ( -6.750 1.820 -1.795) 7.218 8.749 ( -1.866 3.649 4.010) 5.734 9.724 ( -5.467 -10.757 0.174) 12.068 10.982 ( -1.362 -11.077 -0.365) 11.166 13.181 ( 0.632 0.761 5.240) 5.333 14.417 ( 1.393 0.143 -0.590) 1.520 14.576 ( 0.577 0.755 3.592) 3.716 14.905 ( 2.890 0.384 -7.529) 8.074 15.769 ( -2.785 0.790 -4.800) 5.606 16.695 ( 13.027 1.469 -0.912) 13.141 17.919 ( 14.425 3.542 -9.408) 17.583 19.407 ( -2.868 1.170 -6.280) 7.003 19.844 ( -0.516 0.431 2.855) 2.933 21.186 ( -8.071 1.154 4.938) 9.532 56.621 ( -15.973 11.623 29.600) 35.586 57.477 ( -10.307 5.635 0.244) 11.750 ======================= Grid point 205 (77/322) ======================= q-point: ( 0.31 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.193 ( 13.710 -9.138 11.605) 20.153 1.714 ( 11.901 -11.476 20.321) 26.197 2.450 ( 17.670 -7.229 -2.374) 19.239 2.720 ( 2.986 -0.096 -2.518) 3.907 3.128 ( 4.131 -3.827 6.219) 8.390 3.408 ( -7.187 -13.226 1.457) 15.123 3.969 ( 1.239 7.895 2.446) 8.357 4.039 ( 0.265 0.721 -5.932) 5.982 4.562 ( 2.272 -3.281 -5.310) 6.643 4.725 ( -3.503 1.605 -6.222) 7.318 5.150 ( -4.633 -3.803 2.707) 6.577 5.737 ( 0.633 2.906 1.975) 3.570 5.906 ( -1.551 -0.111 -1.883) 2.442 6.373 ( 3.622 -2.187 -4.646) 6.284 6.951 ( -8.325 2.020 -1.504) 8.698 8.670 ( -0.987 3.369 0.455) 3.540 9.960 ( -5.231 -17.075 1.120) 17.894 11.211 ( -3.265 -14.166 -2.433) 14.740 13.174 ( 0.592 1.288 5.144) 5.336 14.422 ( 1.309 0.298 -0.518) 1.439 14.566 ( 0.536 1.216 2.794) 3.094 14.902 ( 1.196 0.400 -4.368) 4.546 15.733 ( -2.566 0.070 -3.978) 4.735 16.748 ( 12.208 2.455 -0.179) 12.453 17.919 ( 15.189 6.150 -5.942) 17.431 19.342 ( -3.586 2.113 -5.467) 6.871 19.835 ( -0.490 0.456 2.246) 2.343 21.106 ( -7.775 1.766 3.773) 8.821 56.359 ( -5.408 11.485 24.464) 27.561 57.248 ( -11.459 9.575 -1.027) 14.968 ======================= Grid point 206 (78/322) ======================= q-point: ( 0.38 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.441 ( 15.478 -2.956 6.987) 17.238 2.001 ( 16.175 -4.197 14.340) 22.020 2.445 ( 2.093 5.622 -5.841) 8.373 2.983 ( 1.936 -17.401 -0.910) 17.532 3.255 ( 5.894 -4.489 6.219) 9.673 3.607 ( -6.736 -9.330 -6.159) 13.052 3.840 ( 3.790 6.039 7.046) 10.024 4.051 ( -0.536 -2.200 -0.115) 2.267 4.563 ( 4.315 5.023 -2.076) 6.940 4.675 ( -3.894 -2.732 -11.160) 12.132 5.198 ( -4.488 -3.476 1.646) 5.911 5.685 ( 0.074 2.750 0.318) 2.769 5.888 ( -2.687 0.031 0.667) 2.769 6.421 ( 2.734 -0.421 -0.085) 2.767 6.860 ( -8.361 0.514 -1.975) 8.606 8.617 ( 0.045 1.666 -1.357) 2.149 10.282 ( -5.414 -19.612 1.353) 20.390 11.460 ( -2.435 -14.267 -3.082) 14.798 13.158 ( 0.474 1.534 4.751) 5.015 14.423 ( 1.189 0.363 -0.284) 1.275 14.550 ( 0.527 1.148 2.088) 2.441 14.892 ( -0.147 0.564 -1.972) 2.056 15.718 ( -2.263 -0.994 -3.477) 4.266 16.773 ( 10.241 3.502 0.097) 10.823 17.888 ( 14.893 7.646 -2.028) 16.863 19.258 ( -4.262 2.681 -4.054) 6.464 19.828 ( -0.454 0.266 1.503) 1.593 21.024 ( -6.457 1.668 1.925) 6.941 56.188 ( 1.318 8.527 17.870) 19.844 56.954 ( -12.021 11.318 -2.491) 16.697 ======================= Grid point 207 (79/322) ======================= q-point: ( 0.46 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.502 ( 13.520 8.384 0.538) 15.917 2.159 ( 12.229 0.918 12.030) 17.179 2.413 ( 7.509 -0.737 -5.327) 9.236 3.269 ( -6.876 -13.626 0.124) 15.263 3.380 ( 2.682 -2.794 2.079) 4.396 3.576 ( -4.733 3.461 -1.713) 6.108 3.854 ( 7.578 0.580 0.768) 7.638 4.084 ( -8.346 -3.734 2.589) 9.503 4.516 ( 7.881 2.742 -5.422) 9.951 4.727 ( 0.651 -4.986 -5.439) 7.407 5.215 ( -4.933 -1.918 1.662) 5.548 5.645 ( -0.059 0.852 -3.153) 3.267 5.872 ( -2.783 -0.074 3.398) 4.393 6.422 ( 0.658 1.707 2.429) 3.041 6.812 ( -5.923 -1.411 -2.538) 6.596 8.601 ( 0.855 0.155 -1.453) 1.694 10.614 ( -5.555 -18.245 0.808) 19.089 11.706 ( -0.419 -12.744 -3.482) 13.218 13.138 ( 0.310 1.542 4.213) 4.497 14.426 ( 1.194 0.123 0.239) 1.224 14.537 ( 0.368 0.865 1.642) 1.892 14.871 ( -1.080 0.846 -0.671) 1.527 15.727 ( -1.772 -2.027 -2.681) 3.799 16.758 ( 7.335 4.805 0.159) 8.770 17.832 ( 12.267 8.670 1.058) 15.059 19.173 ( -4.018 2.146 -2.391) 5.144 19.823 ( -0.400 0.086 0.931) 1.017 20.960 ( -4.342 0.885 -0.194) 4.436 56.097 ( 5.076 6.518 12.819) 15.251 56.653 ( -11.665 9.712 -4.010) 15.699 ======================= Grid point 208 (80/322) ======================= q-point: ( 0.54 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.376 ( 11.469 11.825 -4.076) 16.970 2.168 ( 5.845 6.223 10.677) 13.671 2.530 ( 9.393 -2.927 -5.127) 11.094 3.312 ( -7.420 3.498 -4.185) 9.209 3.408 ( -2.621 0.456 0.857) 2.795 3.548 ( -1.729 -5.153 1.973) 5.782 3.893 ( 6.305 0.074 2.997) 6.982 4.115 ( -5.979 -5.127 -0.628) 7.901 4.516 ( 3.811 1.437 -7.712) 8.722 4.825 ( 2.261 -2.567 3.479) 4.879 5.240 ( -1.217 -3.991 -2.098) 4.670 5.641 ( -0.695 -1.159 -5.281) 5.451 5.860 ( -2.322 0.070 4.482) 5.048 6.380 ( -1.178 2.736 3.682) 4.736 6.817 ( -2.565 -2.600 -2.454) 4.400 8.614 ( 1.182 -0.705 -0.838) 1.611 10.883 ( -4.940 -13.166 -0.146) 14.063 11.922 ( 1.462 -9.746 -4.240) 10.728 13.118 ( 0.173 1.506 3.847) 4.134 14.438 ( 1.132 -0.337 0.854) 1.458 14.526 ( 0.063 0.739 1.497) 1.671 14.845 ( -1.301 0.705 -0.157) 1.488 15.760 ( -1.177 -2.830 -1.677) 3.494 16.698 ( 4.226 5.639 0.317) 7.054 17.727 ( 6.658 9.901 2.751) 12.245 19.123 ( -2.266 0.083 -0.891) 2.437 19.822 ( -0.296 -0.052 0.596) 0.667 20.930 ( -1.929 -0.329 -1.997) 2.796 56.013 ( 3.887 8.781 9.214) 13.308 56.448 ( -7.605 2.159 -4.482) 9.088 ======================= Grid point 209 (81/322) ======================= q-point: (-0.38 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.260 ( 11.198 7.150 -5.243) 14.283 2.072 ( -1.609 6.428 8.858) 11.063 2.532 ( 2.604 7.964 -1.772) 8.564 3.131 ( -3.941 8.963 -5.770) 11.365 3.427 ( 2.124 -5.724 -2.615) 6.642 3.660 ( -3.214 -6.194 -1.178) 7.076 3.958 ( 7.354 -0.478 7.425) 10.461 4.175 ( -4.039 -4.628 0.531) 6.165 4.486 ( -0.253 1.635 -7.818) 7.991 4.850 ( 0.286 0.951 5.787) 5.872 5.329 ( 2.318 -3.994 -4.312) 6.318 5.654 ( -1.961 -2.034 -5.214) 5.930 5.850 ( -1.425 0.194 3.234) 3.539 6.321 ( -1.368 2.930 4.591) 5.615 6.861 ( -0.056 -3.285 -2.012) 3.853 8.637 ( 0.973 -0.943 -0.446) 1.426 11.033 ( -3.432 -5.474 -0.883) 6.521 12.080 ( 2.815 -5.828 -5.539) 8.519 13.095 ( 0.108 1.637 3.854) 4.189 14.455 ( 0.699 -0.476 1.008) 1.316 14.514 ( -0.187 0.775 1.689) 1.868 14.831 ( -0.965 -0.224 0.174) 1.005 15.807 ( -0.649 -2.786 -1.027) 3.039 16.612 ( 1.379 5.342 0.467) 5.537 17.563 ( 0.607 9.917 3.473) 10.525 19.137 ( -0.343 -2.366 -0.017) 2.391 19.823 ( -0.148 -0.207 0.469) 0.533 20.938 ( 0.155 -1.622 -3.000) 3.414 55.843 ( -0.609 10.269 6.206) 12.014 56.455 ( -1.053 -5.729 -2.881) 6.498 ======================= Grid point 210 (82/322) ======================= q-point: (-0.31 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.249 ( 9.733 2.126 -2.657) 10.311 1.947 ( -10.136 2.844 2.777) 10.887 2.298 ( 0.368 15.631 5.892) 16.709 2.937 ( -0.066 8.118 -5.148) 9.613 3.601 ( 2.486 -6.744 -3.808) 8.134 3.707 ( -2.508 -3.276 -7.601) 8.648 4.043 ( 8.321 -1.125 9.504) 12.682 4.235 ( -2.646 -4.027 3.120) 5.740 4.429 ( -2.441 1.907 -6.275) 6.998 4.836 ( -0.050 1.171 4.590) 4.737 5.370 ( 2.243 1.039 -4.412) 5.057 5.675 ( -3.114 -2.842 -3.344) 5.381 5.843 ( -0.835 0.083 0.016) 0.839 6.269 ( -0.209 2.671 5.525) 6.140 6.931 ( 1.278 -3.669 -1.586) 4.196 8.658 ( 0.365 -0.754 -0.680) 1.079 11.035 ( -1.596 3.205 -0.789) 3.666 12.167 ( 3.688 -1.822 -7.495) 8.550 13.070 ( 0.104 1.651 4.170) 4.486 14.464 ( 0.055 0.144 0.419) 0.446 14.502 ( -0.278 0.534 2.119) 2.203 14.840 ( -1.038 -1.219 0.474) 1.669 15.844 ( -0.091 -1.151 -0.874) 1.448 16.522 ( -0.931 4.183 0.405) 4.304 17.396 ( -2.561 6.429 3.780) 7.885 19.199 ( 0.285 -3.811 -0.036) 3.822 19.829 ( -0.048 -0.364 0.478) 0.603 20.982 ( 1.408 -2.748 -2.973) 4.286 55.671 ( -1.154 7.469 6.858) 10.205 56.606 ( 1.111 -9.835 -2.148) 10.128 ======================= Grid point 211 (83/322) ======================= q-point: (-0.23 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.250 ( 5.224 5.044 1.192) 7.359 1.808 ( -15.770 3.322 -5.073) 16.896 2.061 ( 6.127 9.703 13.735) 17.898 2.816 ( 2.942 4.629 -3.036) 6.269 3.534 ( -2.360 9.423 -0.013) 9.714 3.816 ( -2.968 -6.262 -13.558) 15.226 4.159 ( 9.545 -3.237 5.832) 11.645 4.290 ( -0.440 0.309 4.594) 4.625 4.382 ( -4.332 -2.791 -2.084) 5.559 4.820 ( -0.931 1.017 4.164) 4.387 5.327 ( 3.793 3.847 -5.637) 7.808 5.702 ( -4.125 -2.838 -1.048) 5.115 5.830 ( -1.114 0.306 -2.659) 2.899 6.235 ( 1.524 2.335 6.004) 6.620 7.009 ( 1.336 -3.592 -1.315) 4.052 8.668 ( -0.371 -0.459 -1.326) 1.451 10.890 ( -0.066 10.932 0.209) 10.934 12.178 ( 3.519 1.956 -10.427) 11.177 13.052 ( 0.112 0.939 4.580) 4.677 14.452 ( -0.282 0.955 0.256) 1.028 14.499 ( -0.400 -0.078 1.951) 1.994 14.853 ( -2.064 -0.942 0.063) 2.269 15.841 ( 0.803 1.505 -0.301) 1.732 16.444 ( -1.854 2.778 0.068) 3.340 17.318 ( -2.476 0.058 3.395) 4.202 19.277 ( -0.048 -4.097 -0.821) 4.178 19.837 ( -0.116 -0.396 0.483) 0.635 21.051 ( 1.580 -3.579 -1.936) 4.365 55.580 ( 0.575 3.004 11.016) 11.433 56.826 ( 0.885 -12.276 -1.691) 12.424 ======================= Grid point 212 (84/322) ======================= q-point: (-0.15 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.113 ( 1.559 10.995 1.229) 11.173 1.572 ( -5.949 11.738 7.057) 14.932 2.071 ( 4.297 -2.134 6.601) 8.160 2.789 ( 4.539 1.092 -2.008) 5.082 3.273 ( -1.981 15.265 3.696) 15.831 3.803 ( -4.510 1.429 -14.966) 15.696 4.171 ( -0.337 7.560 2.316) 7.914 4.346 ( 2.115 -7.102 1.046) 7.484 4.463 ( -5.087 -6.192 3.956) 8.937 4.804 ( 0.299 0.467 2.563) 2.623 5.290 ( 6.275 2.446 -6.543) 9.390 5.718 ( -4.205 -2.057 0.204) 4.686 5.806 ( -1.096 0.747 -2.855) 3.148 6.218 ( 3.448 2.409 5.229) 6.711 7.078 ( 0.203 -3.002 -1.205) 3.242 8.669 ( -0.935 -0.474 -1.707) 2.003 10.632 ( 0.826 15.801 1.449) 15.889 12.101 ( 0.751 5.856 -14.775) 15.911 13.054 ( 0.174 -0.336 4.911) 4.926 14.429 ( -0.430 1.041 0.168) 1.139 14.504 ( -0.434 -0.438 1.905) 2.002 14.840 ( -2.270 0.523 -1.318) 2.677 15.806 ( 1.929 2.988 1.485) 3.854 16.395 ( -0.553 1.183 -0.461) 1.385 17.364 ( -0.791 -5.158 1.892) 5.551 19.348 ( -0.541 -3.676 -1.980) 4.210 19.842 ( -0.345 -0.240 0.366) 0.557 21.131 ( 0.662 -3.962 -0.171) 4.021 55.614 ( 3.360 -2.990 19.034) 19.558 57.073 ( -0.457 -13.189 -1.152) 13.247 ======================= Grid point 213 (85/322) ======================= q-point: (-0.08 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.920 ( 8.490 11.346 2.047) 14.318 1.317 ( -0.088 14.179 15.490) 21.000 2.118 ( 7.433 6.016 7.734) 12.299 2.770 ( -0.028 4.398 -1.678) 4.707 3.037 ( 1.567 5.642 4.894) 7.632 3.671 ( -2.386 7.040 -12.568) 14.602 4.005 ( -2.597 7.713 -0.359) 8.147 4.444 ( -11.919 -5.577 0.432) 13.166 4.534 ( -0.264 -3.185 1.671) 3.606 4.822 ( 2.184 -0.796 -1.469) 2.750 5.294 ( 3.643 0.710 -4.882) 6.133 5.722 ( -3.378 -1.209 0.635) 3.643 5.790 ( 2.357 0.462 -1.064) 2.627 6.208 ( 6.069 2.869 2.540) 7.177 7.120 ( -1.671 -2.171 -1.153) 2.973 8.673 ( -1.149 -1.202 -0.942) 1.911 10.323 ( 0.935 16.731 1.965) 16.872 11.896 ( -5.711 11.323 -19.747) 23.468 13.081 ( 0.337 -1.280 5.080) 5.249 14.409 ( -0.338 0.716 -0.236) 0.826 14.516 ( -0.233 -0.683 2.440) 2.544 14.808 ( 1.160 1.434 -3.200) 3.693 15.773 ( 2.537 2.248 3.104) 4.596 16.391 ( 2.524 -0.171 -0.674) 2.618 17.489 ( 1.632 -6.905 -0.461) 7.110 19.402 ( -0.864 -2.998 -3.086) 4.388 19.842 ( -0.557 -0.055 0.293) 0.631 21.206 ( -1.156 -3.710 1.835) 4.297 55.826 ( 5.613 -11.992 30.648) 33.386 57.309 ( -2.438 -12.300 -0.592) 12.553 ======================= Grid point 217 (86/322) ======================= q-point: ( 0.23 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.793 ( 9.972 0.000 12.835) 16.254 1.365 ( 4.591 0.000 38.015) 38.291 2.362 ( 44.063 0.000 3.953) 44.240 2.637 ( -6.797 -0.000 -11.384) 13.259 3.139 ( 2.161 0.000 6.414) 6.769 3.148 ( -12.316 -0.000 6.950) 14.142 4.053 ( -12.766 -0.000 -2.307) 12.973 4.279 ( 22.046 0.000 -13.513) 25.858 4.313 ( 1.890 0.000 -0.720) 2.022 4.737 ( -0.698 -0.000 -3.792) 3.855 5.085 ( -7.945 -0.000 7.501) 10.926 5.819 ( 2.931 0.000 -2.128) 3.622 5.879 ( -2.312 -0.000 0.448) 2.355 6.301 ( 1.648 0.000 -11.116) 11.238 7.013 ( -7.640 -0.000 -2.937) 8.185 8.784 ( -2.152 -0.000 5.133) 5.566 9.568 ( -6.129 -0.000 -0.015) 6.130 10.883 ( 1.544 0.000 2.239) 2.720 13.200 ( 0.463 0.000 4.972) 4.994 14.428 ( 1.524 0.000 -0.476) 1.596 14.594 ( 0.547 0.000 3.564) 3.606 14.910 ( 0.986 0.000 -5.919) 6.000 15.746 ( -3.152 -0.000 -5.473) 6.316 16.803 ( 12.916 0.000 -1.377) 12.989 18.048 ( 16.185 0.000 -10.606) 19.351 19.384 ( -3.472 -0.000 -7.086) 7.891 19.850 ( -0.621 -0.000 3.686) 3.738 21.142 ( -8.990 -0.000 5.343) 10.458 56.645 ( -17.552 -0.000 25.247) 30.749 57.454 ( -11.777 -0.000 0.988) 11.818 ======================= Grid point 218 (87/322) ======================= q-point: ( 0.31 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.089 ( 14.299 -15.329 9.850) 23.161 1.551 ( 5.491 -9.802 30.578) 32.576 2.530 ( 10.130 1.362 -6.811) 12.282 2.754 ( 18.060 -2.978 -1.978) 18.411 3.095 ( -2.953 -3.332 5.308) 6.928 3.168 ( -6.905 -4.103 6.884) 10.578 3.962 ( -8.714 1.102 1.769) 8.959 4.237 ( 12.211 6.841 -3.360) 14.395 4.480 ( 7.461 -4.481 -11.866) 14.716 4.733 ( 0.551 0.166 -3.566) 3.613 5.054 ( -7.529 -2.236 5.064) 9.345 5.803 ( 1.711 2.701 0.449) 3.229 5.870 ( -4.026 -0.840 -2.127) 4.630 6.328 ( 1.713 -3.097 -6.129) 7.078 6.926 ( -8.964 2.008 -2.788) 9.600 8.735 ( -1.487 3.595 2.674) 4.721 9.640 ( -6.055 -11.221 0.882) 12.781 10.979 ( 0.431 -8.196 1.199) 8.294 13.204 ( 0.261 0.686 4.588) 4.646 14.436 ( 1.492 0.222 -0.370) 1.553 14.595 ( 0.424 0.838 3.017) 3.160 14.904 ( -0.063 0.124 -3.447) 3.449 15.712 ( -2.487 0.310 -4.797) 5.412 16.876 ( 11.996 1.580 -1.031) 12.144 18.119 ( 16.973 3.485 -8.507) 19.303 19.334 ( -4.135 1.061 -6.840) 8.063 19.846 ( -0.584 0.499 3.622) 3.703 21.077 ( -8.888 0.832 4.899) 10.182 56.508 ( -11.133 6.009 20.830) 24.371 57.310 ( -12.430 5.703 0.584) 13.688 ======================= Grid point 219 (88/322) ======================= q-point: ( 0.38 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.465 ( 18.058 -8.327 11.353) 22.898 1.922 ( 8.544 -17.515 17.808) 26.399 2.525 ( -0.816 2.410 -7.589) 8.005 2.807 ( 1.876 -0.717 -1.503) 2.509 3.212 ( -0.086 -4.437 5.867) 7.356 3.343 ( 5.169 -13.450 0.239) 14.411 3.894 ( -4.767 1.540 7.535) 9.048 4.182 ( 10.884 7.670 -0.327) 13.319 4.546 ( -1.665 -3.458 -12.990) 13.545 4.704 ( 5.270 4.165 -4.878) 8.302 5.088 ( -5.123 -4.730 2.427) 7.383 5.748 ( 0.025 3.787 0.054) 3.787 5.848 ( -5.308 -1.068 0.480) 5.436 6.406 ( 2.751 -3.214 -2.340) 4.834 6.811 ( -9.869 1.861 -2.475) 10.344 8.662 ( -0.148 3.120 -0.175) 3.128 9.880 ( -6.099 -17.403 1.805) 18.529 11.183 ( -0.429 -12.494 -0.395) 12.508 13.194 ( 0.058 1.175 4.034) 4.202 14.440 ( 1.380 0.411 -0.212) 1.456 14.581 ( 0.333 1.256 2.299) 2.640 14.894 ( -0.719 0.292 -1.277) 1.494 15.688 ( -1.598 -0.148 -3.831) 4.154 16.912 ( 10.223 2.990 -0.640) 10.671 18.136 ( 16.816 6.321 -4.784) 18.591 19.262 ( -4.848 1.942 -5.690) 7.724 19.837 ( -0.461 0.604 2.901) 2.998 21.003 ( -7.734 1.103 3.572) 8.590 56.357 ( -3.969 6.579 15.520) 17.317 57.068 ( -12.504 9.788 -0.455) 15.885 ======================= Grid point 220 (89/322) ======================= q-point: ( 0.46 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.688 ( 13.731 0.134 8.371) 16.082 2.266 ( 14.115 -3.992 9.349) 17.395 2.470 ( 5.744 0.680 -3.067) 6.547 2.904 ( -11.243 -13.668 -3.788) 18.098 3.310 ( -3.639 -5.719 3.863) 7.802 3.561 ( 4.812 -3.659 -4.912) 7.789 3.882 ( -1.150 -1.583 11.518) 11.683 4.087 ( 2.342 7.321 1.556) 7.842 4.599 ( -0.620 -5.434 -10.595) 11.924 4.662 ( 11.110 4.238 -7.064) 13.831 5.136 ( -4.635 -3.086 2.320) 6.032 5.667 ( -2.921 2.925 -2.526) 4.845 5.841 ( -3.784 -1.139 4.230) 5.789 6.455 ( 1.757 0.251 0.564) 1.862 6.729 ( -8.118 -1.217 -2.989) 8.736 8.621 ( 1.060 1.399 -1.269) 2.166 10.202 ( -5.932 -19.750 1.910) 20.710 11.437 ( -0.145 -13.996 -1.858) 14.119 13.175 ( -0.082 1.401 3.460) 3.734 14.441 ( 1.294 0.400 0.070) 1.356 14.562 ( 0.198 1.186 1.719) 2.098 14.877 ( -1.163 0.666 -0.001) 1.340 15.684 ( -0.817 -0.992 -2.692) 2.983 16.904 ( 7.604 4.530 -0.425) 8.861 18.102 ( 14.765 8.784 -1.115) 17.217 19.177 ( -4.911 2.112 -3.977) 6.663 19.827 ( -0.352 0.430 1.978) 2.055 20.940 ( -5.690 0.704 1.580) 5.947 56.258 ( 1.655 4.995 10.706) 11.930 56.766 ( -12.370 11.607 -1.701) 17.048 ======================= Grid point 221 (90/322) ======================= q-point: ( 0.54 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.663 ( 7.699 9.829 1.416) 12.566 2.350 ( 8.795 4.576 5.932) 11.553 2.556 ( 13.665 -1.809 -1.648) 13.883 3.117 ( -10.784 -14.638 -2.079) 18.300 3.362 ( -6.003 -2.555 2.194) 6.883 3.558 ( 1.761 3.799 -3.148) 5.239 3.947 ( 1.685 -1.328 8.001) 8.284 3.982 ( -4.906 0.038 0.687) 4.954 4.601 ( 5.111 3.652 -6.699) 9.183 4.779 ( 10.002 -5.760 -5.675) 12.862 5.152 ( -4.235 -2.506 1.616) 5.179 5.603 ( -4.359 0.079 -4.954) 6.599 5.846 ( -2.115 -0.652 5.512) 5.940 6.425 ( -1.561 2.479 2.362) 3.763 6.733 ( -3.206 -3.470 -2.913) 5.550 8.616 ( 1.613 0.087 -0.969) 1.884 10.537 ( -5.061 -18.443 1.312) 19.170 11.698 ( 0.482 -13.157 -3.346) 13.584 13.152 ( -0.107 1.392 3.151) 3.447 14.446 ( 1.164 0.104 0.452) 1.253 14.545 ( -0.074 0.942 1.381) 1.673 14.853 ( -1.141 0.925 0.506) 1.554 15.705 ( -0.223 -1.944 -1.481) 2.454 16.846 ( 4.696 6.021 -0.194) 7.638 18.000 ( 9.756 11.397 1.422) 15.070 19.110 ( -3.343 0.861 -2.120) 4.051 19.822 ( -0.268 0.192 1.207) 1.251 20.903 ( -3.199 -0.238 -0.552) 3.255 56.215 ( 6.210 5.092 8.762) 11.885 56.461 ( -12.676 8.888 -4.093) 16.013 ======================= Grid point 222 (91/322) ======================= q-point: ( 0.62 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.509 ( 8.359 10.588 -2.200) 13.668 2.233 ( -1.463 10.060 3.929) 10.899 2.682 ( 12.031 1.463 -0.537) 12.131 3.202 ( -4.387 0.256 -2.590) 5.101 3.356 ( -4.824 -1.648 0.151) 5.100 3.519 ( -1.869 -3.075 -3.398) 4.949 3.985 ( 3.312 -1.700 7.370) 8.257 4.038 ( -4.382 -6.022 1.959) 7.701 4.545 ( 3.113 4.184 -6.384) 8.244 4.889 ( 5.462 0.507 1.387) 5.658 5.222 ( -0.192 -6.684 -3.627) 7.607 5.583 ( -4.295 -2.049 -5.947) 7.616 5.851 ( -0.876 -0.013 4.537) 4.621 6.366 ( -2.425 2.384 3.702) 5.026 6.788 ( -0.192 -3.764 -2.192) 4.360 8.631 ( 1.426 -0.490 -0.375) 1.554 10.820 ( -3.289 -13.612 0.390) 14.009 11.925 ( 0.830 -10.416 -4.962) 11.567 13.131 ( -0.061 1.357 3.294) 3.563 14.455 ( 0.746 -0.222 0.767) 1.092 14.529 ( -0.363 0.765 1.310) 1.560 14.831 ( -0.559 0.638 0.729) 1.119 15.749 ( 0.119 -2.683 -0.615) 2.755 16.746 ( 2.132 6.807 0.081) 7.133 17.812 ( 3.522 13.234 2.781) 13.974 19.096 ( -1.078 -1.254 -0.664) 1.782 19.820 ( -0.178 -0.038 0.726) 0.748 20.902 ( -0.927 -1.389 -2.224) 2.781 56.077 ( 0.110 12.887 6.306) 14.347 56.343 ( -3.589 -3.596 -3.735) 6.306 ======================= Grid point 223 (92/322) ======================= q-point: (-0.31 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.407 ( 10.489 6.474 -1.795) 12.456 1.993 ( -10.838 9.717 -0.081) 14.556 2.604 ( 5.137 12.476 5.175) 14.451 3.095 ( 1.918 7.541 -3.002) 8.340 3.437 ( 0.764 -8.553 -5.340) 10.112 3.598 ( -4.078 -5.909 -4.265) 8.351 4.048 ( -1.055 -2.674 8.453) 8.928 4.146 ( 1.520 -5.111 3.384) 6.316 4.470 ( 1.290 4.050 -6.092) 7.428 4.883 ( 1.863 2.322 3.741) 4.781 5.339 ( 0.970 -4.587 -5.154) 6.968 5.592 ( -3.371 -2.646 -5.675) 7.111 5.848 ( -0.115 0.503 2.021) 2.086 6.317 ( -1.475 1.935 5.214) 5.754 6.863 ( 0.991 -3.879 -1.615) 4.317 8.649 ( 0.706 -0.497 -0.290) 0.911 10.997 ( -1.004 -6.050 -0.245) 6.138 12.087 ( 0.786 -6.665 -6.718) 9.495 13.109 ( -0.075 1.509 3.813) 4.101 14.464 ( 0.023 -0.165 0.795) 0.812 14.514 ( -0.480 0.670 1.438) 1.657 14.826 ( 0.026 -0.102 0.899) 0.905 15.803 ( 0.332 -2.666 -0.364) 2.711 16.625 ( 0.228 6.462 0.175) 6.468 17.577 ( -0.301 12.148 3.623) 12.681 19.133 ( -0.100 -2.925 -0.066) 2.927 19.823 ( -0.090 -0.249 0.517) 0.581 20.934 ( 0.523 -2.434 -3.030) 3.922 55.846 ( -1.723 10.457 5.433) 11.910 56.440 ( 0.291 -7.331 -2.630) 7.794 ======================= Grid point 224 (93/322) ======================= q-point: (-0.23 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.392 ( 8.961 4.094 2.543) 10.175 1.740 ( -14.799 4.942 -5.784) 16.640 2.374 ( 4.289 14.559 8.730) 17.509 2.971 ( 6.290 7.671 -0.258) 9.923 3.591 ( -1.613 -4.290 -4.428) 6.373 3.642 ( -2.672 -4.515 -10.059) 11.345 4.126 ( -3.626 -6.305 7.861) 10.710 4.244 ( 4.515 -1.990 4.962) 6.998 4.389 ( -0.034 3.853 -6.098) 7.213 4.857 ( 0.447 1.915 4.551) 4.958 5.378 ( 1.048 0.059 -5.155) 5.261 5.616 ( -2.744 -2.856 -4.210) 5.780 5.836 ( 0.159 0.841 -0.591) 1.040 6.289 ( 0.126 1.481 6.268) 6.442 6.942 ( 0.819 -3.832 -1.309) 4.131 8.657 ( -0.208 -0.237 -0.857) 0.913 11.029 ( 1.037 2.784 -0.068) 2.971 12.167 ( 0.082 -2.550 -8.715) 9.081 13.085 ( -0.221 1.529 4.508) 4.766 14.462 ( -0.643 0.340 0.589) 0.936 14.502 ( -0.416 0.442 1.578) 1.690 14.834 ( 0.011 -0.430 0.588) 0.728 15.846 ( 0.686 -1.329 -0.340) 1.534 16.511 ( -0.567 5.034 -0.028) 5.066 17.386 ( -0.520 7.225 4.106) 8.326 19.197 ( -0.399 -3.756 -0.324) 3.791 19.829 ( -0.087 -0.365 0.459) 0.593 20.989 ( 0.847 -3.237 -2.821) 4.376 55.687 ( -0.041 6.240 7.997) 10.144 56.607 ( 0.014 -10.169 -2.521) 10.477 ======================= Grid point 225 (94/322) ======================= q-point: (-0.15 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.301 ( -2.269 8.083 1.533) 8.534 1.634 ( -3.246 -0.185 -1.794) 3.713 2.186 ( 5.832 9.028 8.552) 13.735 2.904 ( 9.177 5.216 2.170) 10.777 3.506 ( -1.166 8.600 -1.392) 8.790 3.713 ( -4.666 -4.436 -13.401) 14.867 4.252 ( -5.149 -6.270 2.537) 8.501 4.291 ( -1.037 0.931 3.481) 3.749 4.312 ( 1.936 0.634 -0.267) 2.054 4.833 ( 0.496 1.394 3.701) 3.986 5.359 ( 2.684 1.841 -5.438) 6.338 5.643 ( -2.767 -2.586 -2.456) 4.514 5.818 ( 0.625 0.969 -1.425) 1.833 6.281 ( 1.821 1.201 6.137) 6.514 7.012 ( -0.498 -3.374 -1.231) 3.626 8.653 ( -0.975 -0.087 -1.645) 1.914 10.908 ( 2.181 10.872 0.826) 11.119 12.150 ( -2.236 2.150 -11.081) 11.507 13.067 ( -0.293 0.757 5.217) 5.279 14.444 ( -0.958 0.868 0.349) 1.339 14.498 ( -0.325 -0.049 1.586) 1.619 14.839 ( 0.275 0.087 -0.614) 0.679 15.857 ( 0.918 0.889 0.258) 1.304 16.433 ( 0.702 2.807 -0.359) 2.915 17.323 ( 1.530 0.347 3.575) 3.904 19.265 ( -1.054 -3.902 -1.178) 4.210 19.836 ( -0.228 -0.292 0.398) 0.544 21.057 ( 0.043 -3.737 -1.678) 4.097 55.642 ( 2.360 0.930 13.051) 13.295 56.814 ( -1.570 -12.243 -2.219) 12.541 ======================= Grid point 226 (95/322) ======================= q-point: (-0.08 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.140 ( 1.417 6.858 -1.120) 7.092 1.576 ( 3.682 8.186 10.242) 13.619 2.173 ( 6.498 -1.369 4.333) 7.929 2.902 ( 10.597 3.880 2.354) 11.528 3.269 ( 0.081 14.583 2.304) 14.764 3.696 ( -3.158 0.284 -14.358) 14.704 4.136 ( -5.519 7.063 -1.645) 9.113 4.309 ( -6.403 -0.521 2.247) 6.806 4.413 ( -2.273 -7.725 4.815) 9.382 4.829 ( 1.196 0.149 -0.328) 1.249 5.337 ( 2.400 1.773 -5.179) 5.977 5.666 ( -2.654 -2.100 -0.979) 3.523 5.814 ( 2.731 0.224 -0.529) 2.790 6.287 ( 3.652 1.198 4.476) 5.900 7.056 ( -2.563 -2.561 -1.262) 3.837 8.645 ( -1.375 -0.442 -1.950) 2.427 10.661 ( 2.094 16.175 1.683) 16.397 12.004 ( -6.681 7.773 -13.267) 16.765 13.073 ( 0.030 -0.567 5.668) 5.696 14.421 ( -0.716 0.841 -0.116) 1.110 14.505 ( -0.150 -0.539 1.827) 1.911 14.837 ( 2.171 0.571 -2.446) 3.319 15.831 ( 0.339 2.139 0.988) 2.380 16.418 ( 4.173 0.499 -0.321) 4.215 17.396 ( 4.353 -4.797 1.610) 6.674 19.325 ( -1.551 -3.593 -2.308) 4.543 19.838 ( -0.430 -0.095 0.325) 0.547 21.123 ( -1.690 -3.812 0.099) 4.171 55.737 ( 4.201 -5.638 20.507) 21.679 57.037 ( -3.800 -13.023 -1.745) 13.678 ======================= Grid point 231 (96/322) ======================= q-point: ( 0.31 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.988 ( 11.360 0.000 10.267) 15.312 1.587 ( 10.001 0.000 31.493) 33.043 2.499 ( -7.073 -0.000 -10.293) 12.489 2.945 ( 25.157 0.000 1.248) 25.188 2.989 ( -12.344 -0.000 7.764) 14.583 3.133 ( 3.759 0.000 2.888) 4.741 3.935 ( -3.552 -0.000 4.714) 5.902 4.322 ( 0.494 0.000 -4.342) 4.370 4.562 ( 22.204 0.000 -12.634) 25.547 4.721 ( -0.124 -0.000 -2.257) 2.260 4.975 ( -9.853 -0.000 4.362) 10.775 5.817 ( -5.805 -0.000 -0.194) 5.808 5.856 ( 2.853 0.000 -1.909) 3.433 6.288 ( 0.319 0.000 -4.404) 4.416 6.874 ( -9.689 -0.000 -4.035) 10.495 8.769 ( -1.870 -0.000 3.553) 4.015 9.484 ( -5.414 -0.000 0.533) 5.440 10.912 ( 1.366 0.000 2.452) 2.807 13.218 ( -0.139 -0.000 3.907) 3.910 14.449 ( 1.473 0.000 -0.225) 1.490 14.610 ( 0.184 0.000 2.804) 2.810 14.898 ( -0.641 -0.000 -1.707) 1.823 15.691 ( -1.896 -0.000 -4.527) 4.908 16.973 ( 10.867 0.000 -1.406) 10.957 18.265 ( 17.706 0.000 -8.471) 19.628 19.301 ( -4.643 -0.000 -7.360) 8.702 19.854 ( -0.658 -0.000 4.369) 4.418 21.027 ( -8.981 -0.000 5.256) 10.406 56.507 ( -11.428 -0.000 15.640) 19.370 57.278 ( -12.562 -0.000 1.772) 12.686 ======================= Grid point 232 (97/322) ======================= q-point: ( 0.38 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.330 ( 14.065 -20.377 6.943) 25.715 1.747 ( 8.559 -4.996 25.838) 27.673 2.479 ( -4.594 -3.346 -8.566) 10.280 2.844 ( -10.106 4.618 1.067) 11.163 3.036 ( -12.724 -6.203 6.674) 15.650 3.338 ( 30.373 -3.378 -0.313) 30.562 3.918 ( -0.481 1.467 8.280) 8.423 4.326 ( 2.315 -0.224 -3.132) 3.901 4.544 ( 2.687 7.251 -8.698) 11.638 4.802 ( 13.175 -0.442 -7.179) 15.011 4.948 ( -8.534 -4.705 2.641) 10.096 5.783 ( -6.778 -0.811 0.758) 6.868 5.829 ( 1.497 3.696 -0.513) 4.020 6.336 ( 1.467 -4.562 -2.687) 5.494 6.773 ( -10.340 2.010 -4.118) 11.310 8.724 ( -0.975 3.201 1.496) 3.665 9.561 ( -5.114 -11.025 1.529) 12.249 10.995 ( 0.791 -7.032 1.823) 7.307 13.215 ( -0.503 0.594 3.134) 3.229 14.457 ( 1.347 0.263 -0.070) 1.374 14.607 ( -0.037 0.822 2.253) 2.398 14.890 ( -0.778 0.102 0.050) 0.787 15.673 ( -0.892 0.084 -3.557) 3.668 17.027 ( 9.069 1.712 -1.370) 9.330 18.347 ( 17.458 3.457 -6.104) 18.815 19.243 ( -5.116 1.010 -6.849) 8.608 19.851 ( -0.559 0.541 4.238) 4.309 20.968 ( -8.019 0.508 4.686) 9.302 56.423 ( -8.124 2.823 10.305) 13.423 57.135 ( -11.562 5.835 2.094) 13.119 ======================= Grid point 233 (98/322) ======================= q-point: ( 0.46 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.764 ( 16.611 -6.059 11.027) 20.838 2.073 ( 4.437 -22.612 11.897) 25.933 2.483 ( -0.499 -0.358 -5.584) 5.618 2.716 ( -8.896 0.506 -3.417) 9.543 3.101 ( -13.191 -8.994 7.032) 17.445 3.583 ( 20.503 -1.731 -3.078) 20.805 3.901 ( 0.640 1.654 10.746) 10.891 4.281 ( 0.636 9.419 3.870) 10.203 4.459 ( -2.214 -4.711 -14.059) 14.991 4.828 ( 11.363 4.365 -5.179) 13.228 5.033 ( -1.036 -5.447 -0.474) 5.565 5.697 ( -7.194 3.786 -2.117) 8.401 5.805 ( -0.916 -0.569 5.149) 5.260 6.442 ( 3.167 -3.876 -1.285) 5.168 6.652 ( -10.384 1.232 -3.974) 11.187 8.665 ( 0.575 2.554 -0.550) 2.675 9.805 ( -4.908 -17.132 2.443) 17.988 11.184 ( 0.298 -11.701 0.218) 11.707 13.200 ( -0.742 0.979 2.445) 2.736 14.459 ( 1.167 0.431 0.101) 1.248 14.589 ( -0.205 1.203 1.667) 2.066 14.881 ( -0.761 0.443 1.162) 1.458 15.666 ( 0.108 -0.269 -2.264) 2.282 17.033 ( 6.631 3.438 -1.202) 7.565 18.362 ( 15.432 6.842 -2.781) 17.109 19.169 ( -5.015 1.652 -5.486) 7.614 19.841 ( -0.369 0.726 3.422) 3.517 20.912 ( -6.136 0.491 3.199) 6.938 56.334 ( -4.621 2.664 5.022) 7.326 56.903 ( -9.503 10.373 2.327) 14.259 ======================= Grid point 234 (99/322) ======================= q-point: ( 0.54 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.854 ( 4.490 4.890 7.896) 10.316 2.447 ( 10.551 -3.647 -0.148) 11.164 2.641 ( 10.056 -0.317 2.665) 10.408 2.683 ( -9.616 -19.913 -3.651) 22.412 3.187 ( -13.366 -8.326 4.763) 16.452 3.661 ( 8.343 3.832 -3.276) 9.748 3.908 ( 0.080 -0.238 8.483) 8.487 4.076 ( -4.777 8.226 2.198) 9.763 4.581 ( 2.931 -6.740 -10.283) 12.639 4.829 ( 11.633 2.121 -3.864) 12.440 5.101 ( 1.023 -1.357 0.302) 1.726 5.569 ( -8.773 2.256 -3.733) 9.798 5.828 ( -0.657 -1.038 6.708) 6.819 6.461 ( -1.975 2.482 -0.108) 3.174 6.626 ( -3.280 -4.738 -3.397) 6.689 8.637 ( 1.587 1.046 -0.961) 2.129 10.134 ( -3.998 -19.599 2.439) 20.151 11.433 ( 0.154 -13.736 -1.826) 13.858 13.178 ( -0.809 1.091 2.111) 2.510 14.459 ( 0.930 0.369 0.298) 1.044 14.566 ( -0.424 1.162 1.192) 1.718 14.866 ( -0.484 0.879 1.567) 1.860 15.678 ( 0.835 -0.928 -0.930) 1.557 16.986 ( 3.903 5.175 -0.923) 6.547 18.289 ( 10.316 10.526 0.025) 14.738 19.101 ( -3.158 1.206 -3.538) 4.893 19.830 ( -0.212 0.598 2.340) 2.425 20.875 ( -3.698 -0.089 1.138) 3.870 56.277 ( -3.279 0.630 -0.127) 3.341 56.621 ( -5.894 13.232 3.535) 14.911 ======================= Grid point 235 (100/322) ======================= q-point: ( 0.62 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.740 ( 2.465 8.657 2.544) 9.354 2.421 ( -1.856 9.434 -0.977) 9.665 2.718 ( 6.506 -6.231 -2.682) 9.399 3.062 ( 6.646 -12.117 1.929) 13.954 3.236 ( -11.291 -5.620 3.935) 13.212 3.570 ( 1.114 7.328 -4.330) 8.585 3.926 ( -2.033 -2.462 2.789) 4.239 3.982 ( -1.830 -0.204 6.985) 7.223 4.629 ( 2.532 2.126 -5.897) 6.761 4.942 ( 12.239 -3.188 -4.839) 13.542 5.108 ( -2.161 -1.103 1.112) 2.669 5.497 ( -6.566 -1.650 -6.286) 9.238 5.851 ( -0.123 -0.449 6.240) 6.257 6.389 ( -4.015 2.045 0.826) 4.581 6.709 ( 0.893 -4.441 -2.008) 4.955 8.639 ( 1.665 0.116 -0.374) 1.711 10.487 ( -2.228 -18.531 1.708) 18.742 11.691 ( 0.031 -13.139 -3.956) 13.721 13.155 ( -0.771 0.998 2.316) 2.637 14.460 ( 0.532 0.117 0.545) 0.771 14.543 ( -0.676 0.919 0.891) 1.448 14.848 ( 0.160 1.026 1.630) 1.932 15.710 ( 1.192 -1.688 0.044) 2.067 16.890 ( 1.478 6.597 -0.504) 6.779 18.106 ( 3.557 13.706 1.682) 14.259 19.074 ( -0.388 -0.153 -1.548) 1.603 19.823 ( -0.115 0.328 1.395) 1.438 20.867 ( -1.328 -1.003 -0.909) 1.896 56.238 ( -11.097 0.517 -6.406) 12.824 56.360 ( 5.692 11.380 7.638) 14.841 ======================= Grid point 236 (101/322) ======================= q-point: (-0.31 -0.69 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.611 ( 5.972 7.668 1.213) 9.794 2.144 ( -10.545 13.297 -2.820) 17.203 2.811 ( 3.677 2.880 1.045) 4.786 3.216 ( 6.971 1.172 0.251) 7.073 3.280 ( -4.627 -6.242 -0.016) 7.770 3.469 ( -2.963 -0.450 -5.532) 6.292 3.987 ( -3.651 -2.604 6.230) 7.676 4.053 ( 2.678 -6.728 4.363) 8.454 4.567 ( 2.668 4.680 -3.814) 6.601 4.970 ( 3.369 4.317 2.091) 5.862 5.206 ( -0.006 -8.199 -5.532) 9.891 5.505 ( -2.185 -3.103 -7.263) 8.195 5.862 ( 0.208 0.286 4.263) 4.277 6.336 ( -3.089 1.058 2.867) 4.346 6.796 ( 1.802 -3.838 -1.314) 4.438 8.649 ( 1.027 -0.115 0.108) 1.039 10.798 ( 0.059 -13.917 0.709) 13.935 11.911 ( -0.267 -10.458 -5.892) 12.006 13.135 ( -0.797 0.964 2.992) 3.243 14.463 ( -0.081 -0.052 0.835) 0.840 14.524 ( -0.787 0.646 0.811) 1.302 14.837 ( 0.821 0.716 1.605) 1.940 15.759 ( 1.263 -2.295 0.347) 2.642 16.760 ( -0.226 7.208 -0.128) 7.212 17.841 ( -0.805 14.512 2.734) 14.790 19.091 ( 0.749 -1.476 -0.305) 1.683 19.821 ( -0.056 0.025 0.789) 0.791 20.890 ( 0.305 -1.906 -2.403) 3.082 56.029 ( -7.509 9.350 0.791) 12.018 56.351 ( 4.702 -1.663 0.141) 4.989 ======================= Grid point 237 (102/322) ======================= q-point: (-0.23 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.546 ( 7.307 5.055 4.233) 9.842 1.790 ( -14.035 11.866 -6.355) 19.446 2.670 ( 1.503 11.955 3.780) 12.628 3.177 ( 8.822 7.288 2.471) 11.707 3.412 ( -1.434 -8.880 -6.922) 11.350 3.512 ( -5.507 -6.309 -5.484) 10.010 4.010 ( -5.056 -2.602 5.744) 8.082 4.216 ( 4.179 -5.620 4.012) 8.071 4.489 ( 3.640 5.202 -3.151) 7.088 4.910 ( -0.727 2.926 4.078) 5.071 5.324 ( -0.438 -4.732 -5.840) 7.529 5.544 ( 0.387 -2.661 -6.964) 7.465 5.857 ( 0.474 0.878 1.939) 2.180 6.312 ( -1.565 0.425 4.828) 5.093 6.876 ( 1.359 -3.510 -1.043) 3.906 8.654 ( 0.101 0.074 -0.098) 0.159 11.006 ( 2.144 -6.375 0.056) 6.726 12.061 ( -0.868 -6.578 -7.501) 10.014 13.114 ( -0.981 1.166 3.892) 4.180 14.461 ( -0.777 0.111 1.024) 1.290 14.510 ( -0.612 0.434 0.949) 1.210 14.837 ( 0.957 0.251 1.303) 1.636 15.814 ( 1.214 -2.329 0.063) 2.627 16.620 ( -0.884 6.590 -0.023) 6.649 17.578 ( -1.234 11.873 3.645) 12.481 19.134 ( 0.208 -2.492 -0.001) 2.500 19.824 ( -0.048 -0.220 0.506) 0.554 20.933 ( 0.817 -2.600 -3.036) 4.079 55.828 ( -2.950 7.624 4.563) 9.362 56.447 ( 1.787 -5.885 -2.131) 6.509 ======================= Grid point 238 (103/322) ======================= q-point: (-0.15 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.396 ( -13.330 8.632 0.702) 15.896 1.636 ( 7.032 0.322 -1.691) 7.240 2.451 ( 3.418 12.442 3.915) 13.484 3.109 ( 10.792 7.341 5.110) 14.017 3.533 ( -3.847 -5.491 -6.231) 9.153 3.564 ( -3.524 -3.641 -8.724) 10.089 4.051 ( -7.548 -5.908 4.356) 10.529 4.311 ( 1.079 -0.977 -0.027) 1.456 4.415 ( 5.687 5.153 0.243) 7.679 4.866 ( -1.442 1.541 4.322) 4.810 5.365 ( -0.790 -1.258 -4.517) 4.755 5.584 ( 1.004 -1.966 -6.019) 6.411 5.844 ( 0.929 1.098 0.566) 1.546 6.310 ( 0.041 0.099 5.721) 5.722 6.943 ( -0.160 -3.115 -1.080) 3.301 8.647 ( -0.712 0.324 -0.876) 1.175 11.062 ( 3.205 2.686 0.152) 4.185 12.119 ( -2.287 -1.791 -8.804) 9.270 13.091 ( -1.076 1.149 4.841) 5.090 14.449 ( -1.282 0.504 0.849) 1.618 14.502 ( -0.264 0.260 1.215) 1.270 14.843 ( 0.893 0.013 0.390) 0.974 15.857 ( 0.766 -1.157 -0.343) 1.429 16.508 ( 0.268 4.453 -0.144) 4.464 17.407 ( 1.338 6.120 4.142) 7.510 19.186 ( -0.893 -3.189 -0.413) 3.338 19.829 ( -0.141 -0.296 0.401) 0.518 20.988 ( 0.188 -3.061 -2.718) 4.098 55.719 ( 0.624 3.735 8.495) 9.301 56.591 ( -0.970 -9.058 -2.771) 9.522 ======================= Grid point 239 (104/322) ======================= q-point: (-0.08 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.195 ( -7.716 2.700 -3.445) 8.871 1.708 ( 8.914 0.382 6.239) 10.887 2.285 ( 5.409 7.760 2.611) 9.812 3.081 ( 12.440 5.276 6.658) 15.063 3.488 ( -0.495 6.440 -2.932) 7.093 3.607 ( -4.119 -4.074 -10.146) 11.684 4.108 ( -10.932 -3.851 -3.169) 12.016 4.279 ( -1.461 0.537 1.076) 1.892 4.382 ( 3.942 3.583 4.148) 6.751 4.840 ( -1.034 0.817 1.279) 1.836 5.360 ( -0.787 0.349 -2.934) 3.058 5.614 ( 0.434 -1.559 -4.516) 4.797 5.838 ( 2.013 0.503 0.582) 2.155 6.325 ( 1.581 -0.018 5.204) 5.438 6.986 ( -2.402 -2.447 -1.267) 3.655 8.632 ( -1.148 0.277 -1.694) 2.065 10.950 ( 2.722 11.148 0.778) 11.502 12.058 ( -4.986 4.132 -9.597) 11.578 13.078 ( -0.591 0.239 5.596) 5.632 14.428 ( -1.162 0.704 0.256) 1.383 14.501 ( 0.062 -0.103 1.490) 1.495 14.852 ( 1.525 -0.077 -1.025) 1.839 15.859 ( -0.732 0.967 -0.644) 1.373 16.466 ( 3.853 1.278 -0.078) 4.060 17.383 ( 5.043 -0.518 3.435) 6.123 19.240 ( -1.857 -3.511 -1.293) 4.177 19.833 ( -0.323 -0.172 0.345) 0.503 21.041 ( -1.377 -3.273 -1.549) 3.874 55.728 ( 3.330 -1.349 13.502) 13.972 56.766 ( -3.942 -11.340 -2.758) 12.319 ======================= Grid point 245 (105/322) ======================= q-point: ( 0.38 0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.172 ( 9.125 0.000 7.260) 11.661 1.841 ( 10.764 0.000 25.333) 27.525 2.376 ( -5.264 -0.000 -7.477) 9.144 2.834 ( -17.751 -0.000 -1.100) 17.785 2.853 ( -9.582 -0.000 7.959) 12.457 3.551 ( 32.629 0.000 -1.450) 32.661 3.953 ( 1.130 0.000 10.222) 10.284 4.301 ( -0.487 -0.000 -8.056) 8.070 4.719 ( 0.512 0.000 -0.699) 0.867 4.729 ( -6.267 -0.000 -2.827) 6.876 4.923 ( 13.314 0.000 -5.775) 14.512 5.729 ( -6.416 -0.000 3.503) 7.310 5.887 ( 2.219 0.000 -1.693) 2.791 6.282 ( 0.241 0.000 -2.320) 2.333 6.712 ( -10.023 -0.000 -5.516) 11.440 8.753 ( -1.544 -0.000 2.209) 2.695 9.420 ( -3.662 -0.000 1.066) 3.814 10.937 ( 0.871 0.000 2.760) 2.894 13.220 ( -1.015 -0.000 2.162) 2.388 14.469 ( 1.218 0.000 0.120) 1.224 14.617 ( -0.445 -0.000 1.877) 1.929 14.888 ( -0.453 -0.000 1.501) 1.568 15.665 ( 0.007 0.000 -2.690) 2.690 17.100 ( 7.138 0.000 -1.812) 7.365 18.497 ( 16.867 0.000 -5.408) 17.713 19.205 ( -4.998 -0.000 -7.119) 8.698 19.860 ( -0.590 -0.000 4.900) 4.935 20.924 ( -7.242 -0.000 4.989) 8.794 56.395 ( -9.298 -0.000 4.697) 10.417 57.120 ( -9.552 -0.000 3.737) 10.257 ======================= Grid point 246 (106/322) ======================= q-point: ( 0.46 0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.507 ( 6.587 -24.419 3.564) 25.542 1.940 ( 5.263 -0.175 20.573) 21.237 2.402 ( -1.899 -5.332 -5.135) 7.642 2.674 ( -9.886 1.977 -1.380) 10.175 2.871 ( -11.328 -5.788 7.832) 14.938 3.754 ( 25.038 1.398 -3.197) 25.280 3.962 ( 0.931 1.601 11.137) 11.290 4.322 ( 0.617 -4.066 -9.426) 10.284 4.476 ( -8.842 10.676 -1.037) 13.901 4.842 ( -5.872 -5.683 1.092) 8.244 5.033 ( 19.806 0.258 -7.727) 21.262 5.685 ( -7.677 1.080 4.367) 8.898 5.849 ( 1.285 3.588 0.518) 3.847 6.351 ( 1.445 -6.127 -2.424) 6.746 6.612 ( -8.893 2.157 -5.796) 10.832 8.717 ( -0.537 2.521 0.675) 2.665 9.507 ( -3.036 -10.594 2.004) 11.201 11.011 ( 0.434 -6.504 2.162) 6.868 13.209 ( -1.357 0.465 1.333) 1.958 14.474 ( 1.014 0.293 0.300) 1.097 14.607 ( -0.745 0.737 1.368) 1.723 14.888 ( -0.032 0.252 2.485) 2.498 15.665 ( 0.971 -0.013 -1.462) 1.755 17.123 ( 4.689 1.826 -1.944) 5.395 18.569 ( 14.244 3.736 -3.206) 15.071 19.151 ( -3.968 0.906 -6.462) 7.638 19.858 ( -0.454 0.576 4.678) 4.735 20.882 ( -5.538 0.249 4.311) 7.023 56.320 ( -8.958 0.963 -0.417) 9.019 57.012 ( -6.231 5.824 4.701) 9.739 ======================= Grid point 247 (107/322) ======================= q-point: ( 0.54 0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.949 ( -0.086 1.348 11.655) 11.733 2.080 ( -5.946 -27.585 -0.821) 28.231 2.514 ( 8.423 -4.842 -3.382) 10.287 2.652 ( 2.870 -3.029 2.040) 4.645 2.929 ( -12.828 -7.708 8.096) 17.016 3.821 ( 12.004 5.002 -3.050) 13.357 3.951 ( 0.903 1.883 8.829) 9.072 4.198 ( -11.168 9.771 -1.395) 14.904 4.446 ( 5.534 -7.521 -9.345) 13.211 4.876 ( -2.776 -1.445 2.173) 3.810 5.155 ( 17.474 0.481 -6.276) 18.573 5.559 ( -11.012 4.638 0.306) 11.953 5.829 ( 1.124 0.128 6.224) 6.326 6.491 ( 1.434 -6.955 -2.510) 7.532 6.493 ( -5.992 3.149 -4.838) 8.320 8.674 ( 0.883 1.849 -0.597) 2.134 9.760 ( -2.248 -16.806 2.816) 17.188 11.188 ( 0.040 -11.200 0.312) 11.204 13.189 ( -1.492 0.704 0.915) 1.887 14.474 ( 0.738 0.470 0.435) 0.978 14.585 ( -0.969 1.085 0.886) 1.704 14.885 ( 0.478 0.707 2.791) 2.918 15.676 ( 1.718 -0.278 -0.175) 1.749 17.092 ( 2.039 3.633 -1.788) 4.533 18.537 ( 8.050 8.000 -0.855) 11.381 19.101 ( -0.804 1.146 -4.824) 5.023 19.848 ( -0.245 0.838 3.739) 3.840 20.852 ( -3.237 0.071 2.743) 4.243 56.235 ( -9.260 0.525 -4.752) 10.421 56.835 ( -1.463 10.179 5.725) 11.770 ======================= Grid point 248 (108/322) ======================= q-point: (-0.38 -0.62 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.865 ( -6.019 4.145 6.326) 9.666 2.413 ( -15.180 -10.509 -8.225) 20.212 2.614 ( 12.004 -2.194 -0.567) 12.216 2.928 ( 14.863 -12.130 4.289) 19.658 2.999 ( -11.256 -9.549 8.677) 17.123 3.749 ( 4.626 8.463 -2.920) 10.077 3.918 ( -2.837 2.149 -0.227) 3.567 3.986 ( -7.271 3.248 7.389) 10.864 4.612 ( 5.966 -5.211 -10.510) 13.161 4.898 ( -0.663 -3.149 2.629) 4.155 5.211 ( 10.524 5.705 -0.916) 12.006 5.416 ( -7.743 0.038 -5.823) 9.688 5.855 ( 0.754 -0.480 8.001) 8.051 6.391 ( -5.453 2.047 -3.941) 7.032 6.626 ( 3.222 -5.334 -1.426) 6.393 8.658 ( 1.466 0.733 -0.469) 1.705 10.108 ( -0.607 -19.508 2.643) 19.695 11.426 ( -0.187 -13.355 -2.167) 13.531 13.166 ( -1.505 0.696 1.087) 1.983 14.470 ( 0.383 0.433 0.587) 0.824 14.557 ( -1.152 1.050 0.491) 1.634 14.877 ( 1.136 1.114 2.665) 3.103 15.700 ( 2.077 -0.755 0.793) 2.347 17.009 ( -0.320 5.266 -1.341) 5.443 18.373 ( 0.424 11.960 0.604) 11.983 19.084 ( 2.703 0.831 -2.512) 3.782 19.836 ( -0.080 0.761 2.513) 2.627 20.844 ( -0.891 -0.502 0.714) 1.247 56.147 ( -11.296 -0.016 -7.371) 13.488 56.639 ( 4.517 11.785 6.529) 14.210 ======================= Grid point 249 (109/322) ======================= q-point: (-0.31 -0.62 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.759 ( -1.283 4.563 3.764) 6.053 2.278 ( -14.427 8.427 -5.131) 17.478 2.772 ( 2.131 -5.177 -1.366) 5.763 3.065 ( -7.544 -9.440 0.525) 12.095 3.281 ( 12.961 -5.547 6.476) 15.514 3.563 ( 0.401 10.302 -4.890) 11.411 3.922 ( 0.001 -4.736 2.196) 5.221 3.959 ( -3.991 -1.922 7.104) 8.372 4.653 ( 3.578 2.293 -5.270) 6.770 5.026 ( 1.077 -8.829 -2.985) 9.382 5.093 ( -3.707 6.592 2.579) 7.991 5.438 ( 4.791 -2.412 -8.763) 10.274 5.876 ( 0.359 0.088 6.884) 6.894 6.326 ( -4.101 0.674 -1.585) 4.448 6.737 ( 3.374 -4.025 -0.828) 5.317 8.659 ( 1.151 0.247 0.221) 1.198 10.487 ( 1.484 -18.602 1.716) 18.740 11.674 ( -0.321 -12.788 -4.559) 13.580 13.145 ( -1.571 0.562 1.818) 2.467 14.465 ( -0.056 0.261 0.864) 0.905 14.531 ( -1.198 0.760 0.276) 1.445 14.869 ( 1.683 1.238 2.385) 3.171 15.737 ( 2.097 -1.342 1.119) 2.730 16.885 ( -1.923 6.441 -0.726) 6.761 18.105 ( -4.288 14.010 1.582) 14.737 19.094 ( 3.547 0.390 -0.698) 3.636 19.827 ( 0.013 0.474 1.448) 1.524 20.860 ( 0.843 -1.193 -1.196) 1.888 56.038 ( -12.530 1.375 -5.979) 13.952 56.493 ( 8.674 8.858 4.916) 13.336 ======================= Grid point 250 (110/322) ======================= q-point: (-0.23 -0.62 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.689 ( 2.933 4.366 5.581) 7.669 1.932 ( -15.386 13.711 -6.451) 21.594 2.802 ( -4.454 1.148 1.424) 4.815 3.216 ( -1.700 -8.981 -5.574) 10.706 3.363 ( 6.250 3.060 0.733) 6.997 3.415 ( 0.839 3.606 -0.813) 3.790 3.956 ( -3.602 -1.197 6.187) 7.259 4.111 ( 3.900 -8.827 2.165) 9.890 4.606 ( 4.048 4.220 -2.097) 6.212 4.960 ( -6.269 3.613 3.694) 8.124 5.191 ( 0.682 -7.596 -5.869) 9.623 5.507 ( 6.155 -1.779 -7.990) 10.241 5.880 ( 0.135 0.639 4.552) 4.599 6.299 ( -2.868 -0.468 1.341) 3.201 6.827 ( 2.708 -3.069 -0.583) 4.135 8.661 ( 0.400 0.327 0.494) 0.715 10.826 ( 3.265 -14.020 0.562) 14.406 11.884 ( -0.441 -10.020 -6.343) 11.867 13.126 ( -1.786 0.559 2.863) 3.420 14.461 ( -0.537 0.206 1.288) 1.410 14.513 ( -0.989 0.367 0.317) 1.102 14.862 ( 1.638 1.083 1.938) 2.759 15.785 ( 1.958 -1.858 0.769) 2.806 16.739 ( -2.493 6.765 -0.209) 7.213 17.806 ( -5.065 13.154 2.530) 14.321 19.115 ( 2.420 -0.282 0.156) 2.441 19.824 ( 0.036 0.127 0.771) 0.782 20.895 ( 1.519 -1.739 -2.534) 3.428 55.902 ( -9.080 3.407 -1.055) 9.756 56.444 ( 7.125 2.981 1.102) 7.802 ======================= Grid point 251 (111/322) ======================= q-point: (-0.15 -0.62 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.494 ( -16.155 13.000 0.854) 20.753 1.716 ( 6.537 2.006 -0.580) 6.863 2.681 ( -0.869 8.595 0.767) 8.673 3.315 ( 3.920 0.852 -3.207) 5.136 3.371 ( 1.913 -2.793 0.377) 3.406 3.416 ( -3.761 -4.900 -4.077) 7.401 3.957 ( -4.453 -1.141 4.216) 6.237 4.271 ( 2.509 -4.410 -0.721) 5.124 4.554 ( 5.459 4.533 -0.186) 7.098 4.880 ( -5.141 1.259 5.343) 7.521 5.295 ( -0.434 -4.159 -5.904) 7.235 5.565 ( 5.230 -1.137 -6.976) 8.793 5.871 ( 0.242 0.899 2.671) 2.829 6.303 ( -1.595 -1.081 3.630) 4.110 6.892 ( 1.117 -2.373 -0.738) 2.725 8.652 ( -0.315 0.631 0.054) 0.707 11.052 ( 3.893 -6.321 -0.232) 7.427 12.022 ( -0.783 -5.727 -7.327) 9.333 13.106 ( -1.935 0.727 3.948) 4.456 14.452 ( -0.941 0.455 1.556) 1.875 14.504 ( -0.569 0.068 0.609) 0.836 14.857 ( 1.039 0.693 1.134) 1.687 15.835 ( 1.500 -1.749 -0.003) 2.304 16.601 ( -1.625 5.590 0.034) 5.821 17.563 ( -2.369 9.191 3.464) 10.104 19.140 ( 0.642 -1.187 0.213) 1.366 19.825 ( -0.029 -0.127 0.455) 0.473 20.937 ( 1.074 -2.081 -3.061) 3.854 55.792 ( -3.813 2.972 3.857) 6.184 56.475 ( 2.862 -2.299 -1.611) 4.010 ======================= Grid point 252 (112/322) ======================= q-point: (-0.08 0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.187 ( -11.458 5.930 -3.822) 13.456 1.773 ( 8.634 -0.945 5.357) 10.205 2.503 ( 3.096 10.005 -0.651) 10.493 3.292 ( 10.335 5.698 6.537) 13.491 3.453 ( -3.775 -5.304 -4.727) 8.045 3.486 ( -3.374 -5.090 -6.420) 8.861 3.957 ( -6.579 -2.570 1.637) 7.250 4.302 ( -0.530 1.142 -4.535) 4.706 4.508 ( 5.176 4.616 1.927) 7.198 4.845 ( -3.191 0.540 5.010) 5.964 5.331 ( -1.599 -1.433 -3.775) 4.343 5.603 ( 3.996 -0.458 -6.318) 7.490 5.862 ( 0.740 0.640 2.033) 2.256 6.325 ( -0.321 -1.247 4.553) 4.731 6.930 ( -1.168 -1.725 -1.123) 2.366 8.634 ( -0.692 0.806 -0.790) 1.324 11.110 ( 2.802 3.028 -0.329) 4.138 12.058 ( -1.863 -0.032 -7.520) 7.748 13.087 ( -1.473 0.474 4.879) 5.119 14.435 ( -0.993 0.744 1.212) 1.735 14.503 ( -0.099 -0.071 1.030) 1.037 14.857 ( 0.677 0.034 0.050) 0.680 15.861 ( -0.101 -0.149 -0.932) 0.949 16.520 ( 1.441 2.348 0.153) 2.759 17.448 ( 2.353 3.223 3.894) 5.575 19.170 ( -1.060 -2.119 -0.299) 2.388 19.828 ( -0.191 -0.176 0.347) 0.433 20.978 ( -0.289 -2.267 -2.714) 3.548 55.758 ( 0.799 0.286 8.306) 8.350 56.562 ( -1.693 -6.459 -2.887) 7.274 ======================= Grid point 259 (113/322) ======================= q-point: ( 0.46 0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.268 ( 0.550 0.000 3.307) 3.352 1.987 ( -5.040 -0.000 19.161) 19.813 2.327 ( 1.839 0.000 -2.520) 3.120 2.627 ( -5.354 -0.000 -1.098) 5.465 2.771 ( -5.114 -0.000 7.367) 8.968 3.935 ( 19.048 0.000 -4.398) 19.549 3.998 ( -0.550 -0.000 10.964) 10.978 4.258 ( -0.930 -0.000 -10.889) 10.929 4.527 ( -14.526 -0.000 0.129) 14.526 4.730 ( 1.069 0.000 0.222) 1.092 5.171 ( 19.095 0.000 -5.759) 19.945 5.657 ( -6.790 -0.000 8.730) 11.060 5.907 ( 1.207 0.000 -1.515) 1.937 6.275 ( -0.110 -0.000 -3.295) 3.296 6.571 ( -5.281 -0.000 -7.115) 8.861 8.739 ( -1.178 -0.000 1.285) 1.743 9.388 ( -1.265 -0.000 1.492) 1.956 10.954 ( 0.171 0.000 3.070) 3.075 13.203 ( -1.757 -0.000 0.382) 1.798 14.485 ( 0.833 0.000 0.557) 1.002 14.609 ( -1.220 -0.000 0.910) 1.523 14.898 ( 0.742 0.000 3.485) 3.563 15.673 ( 1.792 0.000 -0.434) 1.843 17.162 ( 2.184 0.000 -2.446) 3.279 18.692 ( 10.277 0.000 -2.310) 10.533 19.129 ( -1.010 -0.000 -6.607) 6.683 19.869 ( -0.463 -0.000 5.210) 5.231 20.857 ( -3.995 -0.000 4.607) 6.098 56.251 ( -10.801 -0.000 -4.605) 11.742 57.044 ( -2.789 -0.000 5.400) 6.077 ======================= Grid point 260 (114/322) ======================= q-point: (-0.46 -0.54 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.515 ( -6.127 -23.651 -0.474) 24.436 1.931 ( -15.555 -0.081 13.964) 20.903 2.437 ( 9.085 -7.844 -0.162) 12.004 2.640 ( 5.653 -0.949 1.264) 5.870 2.779 ( -4.790 -2.632 7.553) 9.323 3.954 ( -2.908 2.946 0.053) 4.140 4.008 ( 3.549 1.986 3.979) 5.690 4.238 ( -8.158 2.251 -9.582) 12.784 4.406 ( 4.793 1.011 -0.396) 4.915 4.794 ( -1.443 -4.107 0.694) 4.408 5.291 ( 17.504 0.367 -5.261) 18.281 5.580 ( -9.838 4.157 7.156) 12.856 5.873 ( 1.470 2.432 2.297) 3.654 6.342 ( -1.598 -6.103 -4.440) 7.715 6.520 ( 0.529 1.580 -6.406) 6.619 8.713 ( -0.265 1.767 0.274) 1.808 9.489 ( -0.280 -10.266 2.264) 10.517 11.020 ( -0.213 -6.187 2.368) 6.628 13.187 ( -1.908 0.322 -0.140) 1.940 14.488 ( 0.592 0.343 0.755) 1.019 14.594 ( -1.541 0.632 0.461) 1.729 14.908 ( 1.473 0.425 3.850) 4.144 15.689 ( 2.421 -0.018 0.611) 2.497 17.146 ( -0.472 1.819 -2.585) 3.196 18.697 ( 2.769 4.421 -1.080) 5.327 19.122 ( 4.101 0.731 -5.460) 6.867 19.868 ( -0.342 0.612 4.835) 4.886 20.841 ( -1.843 0.132 3.914) 4.328 56.156 ( -11.592 0.295 -7.533) 13.828 56.994 ( 1.205 5.310 5.496) 7.737 ======================= Grid point 261 (115/322) ======================= q-point: (-0.38 -0.54 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.789 ( -20.477 -5.261 5.790) 21.921 1.981 ( -8.301 -19.690 -2.455) 21.509 2.680 ( 12.116 -1.699 0.193) 12.236 2.788 ( 9.664 -11.316 4.812) 15.639 2.812 ( -3.358 -5.259 8.314) 10.394 3.839 ( -12.610 1.671 -0.976) 12.758 3.969 ( 1.227 4.885 -6.354) 8.108 4.055 ( -4.874 7.299 7.612) 11.618 4.534 ( 9.972 -5.907 -8.182) 14.187 4.843 ( -1.979 -2.209 2.450) 3.847 5.376 ( -10.359 3.398 -2.733) 11.239 5.404 ( 13.437 4.410 -0.618) 14.156 5.872 ( 1.368 0.134 8.077) 8.193 6.368 ( -4.619 0.110 -7.712) 8.990 6.562 ( 6.225 -3.862 -2.028) 7.601 8.684 ( 0.766 1.214 -0.368) 1.482 9.761 ( 1.110 -16.726 2.863) 17.006 11.186 ( -0.347 -10.811 0.237) 10.819 13.165 ( -1.930 0.452 -0.071) 1.983 14.483 ( 0.322 0.562 0.892) 1.103 14.567 ( -1.723 0.927 0.087) 1.958 14.915 ( 2.177 0.954 3.671) 4.374 15.711 ( 2.671 -0.172 1.387) 3.015 17.079 ( -2.863 3.465 -2.303) 5.051 18.561 ( -4.219 8.823 -0.263) 9.783 19.138 ( 7.207 1.397 -3.257) 8.031 19.858 ( -0.165 0.937 3.757) 3.875 20.839 ( 0.384 -0.009 2.361) 2.392 56.050 ( -12.249 0.201 -8.745) 15.052 56.886 ( 5.298 8.964 5.327) 11.696 ======================= Grid point 262 (116/322) ======================= q-point: (-0.31 -0.54 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.735 ( -13.428 -2.891 4.931) 14.594 2.177 ( -14.699 -6.783 -5.850) 17.213 2.759 ( 3.650 1.079 0.897) 3.910 2.843 ( -3.556 -7.663 4.433) 9.540 3.205 ( 14.219 -13.416 6.646) 20.648 3.765 ( -5.645 0.218 -0.834) 5.711 3.789 ( -4.735 5.419 -8.481) 11.122 3.975 ( -0.916 2.785 11.084) 11.466 4.681 ( 7.978 -2.481 -9.845) 12.913 4.889 ( -0.856 -4.594 2.762) 5.428 5.153 ( -13.961 5.930 0.959) 15.198 5.486 ( 14.561 0.858 -6.204) 15.850 5.894 ( 0.459 0.095 9.362) 9.374 6.308 ( -3.160 1.231 -6.692) 7.502 6.687 ( 5.520 -4.280 -0.835) 7.035 8.675 ( 0.958 0.534 0.047) 1.098 10.135 ( 2.951 -19.532 2.450) 19.905 11.416 ( -0.024 -12.955 -2.480) 13.190 13.142 ( -2.021 0.402 0.587) 2.142 14.475 ( 0.065 0.573 1.060) 1.207 14.536 ( -1.726 0.832 -0.136) 1.921 14.915 ( 2.655 1.423 3.219) 4.409 15.739 ( 2.535 -0.525 1.618) 3.053 16.968 ( -4.536 4.755 -1.644) 6.774 18.311 ( -8.425 11.961 0.520) 14.639 19.155 ( 7.032 1.923 -1.280) 7.401 19.844 ( -0.010 0.898 2.450) 2.609 20.855 ( 2.086 -0.375 0.415) 2.160 55.944 ( -12.537 0.060 -7.752) 14.740 56.756 ( 8.401 10.299 4.557) 14.050 ======================= Grid point 263 (117/322) ======================= q-point: (-0.23 -0.54 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( -4.896 -2.080 4.474) 6.951 2.020 ( -18.088 8.052 -4.278) 20.256 2.731 ( -7.657 -1.108 3.227) 8.382 3.026 ( 1.753 -9.204 -3.382) 9.962 3.423 ( 3.956 -0.937 -0.803) 4.144 3.579 ( 3.369 8.602 0.049) 9.238 3.920 ( -1.793 -7.458 3.704) 8.518 3.953 ( 1.759 -3.866 4.709) 6.342 4.702 ( 5.094 2.906 -3.693) 6.930 4.944 ( -11.379 1.198 -3.123) 11.860 5.051 ( 0.382 -6.158 1.510) 6.352 5.555 ( 11.812 0.895 -6.642) 13.581 5.901 ( -0.229 0.687 7.690) 7.724 6.266 ( -2.749 -0.195 -3.809) 4.701 6.794 ( 4.525 -3.020 -0.381) 5.454 8.673 ( 0.551 0.429 0.615) 0.930 10.536 ( 4.269 -18.532 1.268) 19.059 11.659 ( 0.694 -12.298 -4.783) 13.214 13.122 ( -2.297 0.279 1.654) 2.844 14.467 ( -0.172 0.461 1.359) 1.445 14.512 ( -1.480 0.444 -0.100) 1.548 14.908 ( 2.475 1.745 2.610) 3.997 15.774 ( 2.259 -1.074 1.236) 2.790 16.831 ( -5.100 5.518 -0.806) 7.557 18.003 ( -9.833 12.604 1.363) 16.044 19.161 ( 5.354 2.002 -0.020) 5.716 19.833 ( 0.083 0.606 1.368) 1.499 20.883 ( 2.831 -0.731 -1.376) 3.231 55.845 ( -11.448 -0.041 -4.718) 12.382 56.637 ( 9.254 9.164 2.901) 13.343 ======================= Grid point 264 (118/322) ======================= q-point: (-0.15 -0.54 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.646 ( -16.236 13.832 2.139) 21.436 1.764 ( 0.207 -0.776 -0.343) 0.873 2.707 ( -9.309 -1.706 2.263) 9.731 3.162 ( -3.851 -6.367 -8.374) 11.202 3.369 ( 4.054 3.540 -6.425) 8.381 3.537 ( 7.529 3.742 7.385) 11.190 3.919 ( -3.937 -0.489 4.744) 6.184 4.176 ( 4.150 -8.142 0.236) 9.142 4.663 ( 3.679 3.676 -1.681) 5.466 4.847 ( -9.022 -0.076 3.038) 9.520 5.192 ( 1.913 -6.101 -3.921) 7.501 5.602 ( 8.865 0.861 -6.313) 10.917 5.893 ( -0.561 0.918 5.070) 5.183 6.263 ( -2.344 -1.616 -0.201) 2.854 6.866 ( 2.918 -1.766 -0.440) 3.439 8.665 ( 0.042 0.715 0.625) 0.951 10.885 ( 4.246 -13.740 -0.122) 14.382 11.868 ( 1.545 -9.269 -6.061) 11.182 13.103 ( -2.587 0.228 2.839) 3.848 14.459 ( -0.380 0.474 1.798) 1.898 14.499 ( -1.010 -0.037 0.169) 1.024 14.892 ( 1.481 1.789 1.743) 2.904 15.816 ( 1.977 -1.503 0.444) 2.523 16.688 ( -4.307 5.413 -0.084) 6.918 17.717 ( -8.087 10.056 2.309) 13.109 19.158 ( 3.216 1.520 0.515) 3.594 19.827 ( 0.085 0.249 0.708) 0.755 20.916 ( 2.524 -0.933 -2.619) 3.755 55.771 ( -8.417 -0.460 -0.581) 8.450 56.553 ( 7.331 6.038 0.712) 9.524 ======================= Grid point 265 (119/322) ======================= q-point: (-0.08 -0.54 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.269 ( -12.555 11.853 -2.813) 17.494 1.813 ( 4.770 -1.344 5.849) 7.666 2.644 ( -4.524 3.203 -1.095) 5.650 3.230 ( -6.369 -7.686 -10.238) 14.299 3.376 ( 2.034 -1.421 -3.238) 4.080 3.526 ( 9.823 4.971 8.624) 13.985 3.905 ( -4.208 -0.377 1.773) 4.582 4.287 ( 0.720 -2.002 -3.097) 3.757 4.613 ( 2.035 3.297 -2.853) 4.812 4.823 ( -4.474 -1.077 8.296) 9.486 5.283 ( 1.447 -2.736 -4.914) 5.808 5.631 ( 6.157 0.694 -5.812) 8.495 5.879 ( -0.615 0.660 3.497) 3.612 6.289 ( -1.662 -2.283 2.478) 3.757 6.903 ( 0.763 -0.767 -0.883) 1.397 8.648 ( -0.222 1.042 0.067) 1.068 11.101 ( 2.506 -5.758 -1.081) 6.372 12.005 ( 1.919 -4.341 -6.268) 7.863 13.087 ( -2.344 0.119 3.881) 4.535 14.447 ( -0.450 0.759 1.984) 2.171 14.498 ( -0.471 -0.351 0.604) 0.843 14.871 ( 0.342 1.168 0.667) 1.388 15.853 ( 1.033 -0.828 -0.513) 1.420 16.576 ( -1.825 3.456 0.346) 3.924 17.531 ( -3.558 4.907 3.220) 6.864 19.154 ( 1.059 0.555 0.445) 1.276 19.826 ( -0.026 0.010 0.413) 0.414 20.945 ( 1.345 -1.014 -3.111) 3.538 55.747 ( -4.003 -1.679 3.698) 5.702 56.516 ( 3.223 1.823 -1.349) 3.941 ======================= Grid point 273 (120/322) ======================= q-point: (-0.46 -0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.202 ( -9.751 -0.000 0.507) 9.765 1.797 ( -24.459 -0.000 14.020) 28.192 2.420 ( 10.535 0.000 1.664) 10.665 2.700 ( 11.063 0.000 1.439) 11.156 2.753 ( -0.521 -0.000 6.524) 6.545 3.886 ( -20.329 -0.000 -1.321) 20.372 4.057 ( 0.719 0.000 5.804) 5.848 4.206 ( -0.912 -0.000 -12.508) 12.541 4.472 ( 7.319 0.000 0.834) 7.366 4.750 ( 1.474 0.000 0.477) 1.549 5.393 ( 10.851 0.000 -4.181) 11.629 5.573 ( -8.244 -0.000 11.200) 13.907 5.911 ( 0.046 0.000 -1.389) 1.390 6.269 ( 2.095 0.000 -3.188) 3.815 6.540 ( 4.300 0.000 -8.117) 9.185 8.728 ( -0.806 -0.000 0.798) 1.134 9.393 ( 1.337 0.000 1.739) 2.193 10.961 ( -0.656 -0.000 3.300) 3.365 13.174 ( -2.012 -0.000 -0.775) 2.156 14.496 ( 0.401 0.000 1.069) 1.141 14.587 ( -1.976 -0.000 0.030) 1.976 14.934 ( 2.385 0.000 4.423) 5.025 15.710 ( 2.907 0.000 1.276) 3.175 17.146 ( -3.087 -0.000 -3.098) 4.373 18.736 ( -3.126 -0.000 -1.118) 3.320 19.169 ( 8.659 0.000 -4.867) 9.933 19.880 ( -0.388 -0.000 5.149) 5.163 20.843 ( 0.186 0.000 4.298) 4.302 56.057 ( -12.338 -0.000 -9.381) 15.499 57.071 ( 3.918 0.000 4.757) 6.163 ======================= Grid point 274 (121/322) ======================= q-point: (-0.38 -0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.354 ( -14.285 -20.069 -1.813) 24.701 1.671 ( -23.273 -4.717 13.261) 27.198 2.623 ( 13.999 -11.006 3.194) 18.091 2.761 ( 3.636 0.363 5.143) 6.309 2.790 ( 7.111 -0.286 2.300) 7.479 3.698 ( -27.323 0.059 -2.079) 27.403 4.046 ( 1.351 2.597 1.864) 3.470 4.152 ( -1.665 3.493 -5.046) 6.359 4.536 ( 10.799 -0.905 -2.006) 11.021 4.794 ( 0.824 -2.537 0.543) 2.722 5.367 ( -12.081 3.604 -0.249) 12.610 5.549 ( 8.939 1.795 2.837) 9.548 5.899 ( 0.487 0.524 3.102) 3.183 6.320 ( 2.372 -1.960 -4.490) 5.444 6.570 ( 7.968 -0.402 -6.282) 10.154 8.711 ( -0.143 1.156 0.196) 1.181 9.514 ( 2.583 -10.264 2.284) 10.827 11.020 ( -0.854 -6.054 2.451) 6.587 13.156 ( -1.953 0.236 -0.837) 2.138 14.497 ( 0.195 0.384 1.286) 1.357 14.566 ( -2.223 0.526 -0.315) 2.306 14.956 ( 3.179 0.580 4.424) 5.478 15.734 ( 3.021 0.065 1.653) 3.444 17.093 ( -5.448 1.681 -3.164) 6.521 18.650 ( -7.027 4.898 -0.924) 8.615 19.221 ( 9.670 1.072 -3.463) 10.327 19.879 ( -0.333 0.641 4.577) 4.634 20.857 ( 2.275 0.237 3.665) 4.321 55.949 ( -12.433 0.165 -9.875) 15.879 57.070 ( 6.643 4.744 4.084) 9.128 ======================= Grid point 275 (122/322) ======================= q-point: (-0.31 -0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.495 ( -21.079 -8.721 5.124) 23.380 1.810 ( -14.292 -18.391 1.160) 23.320 2.762 ( -2.037 0.857 6.019) 6.412 2.837 ( 7.714 0.706 0.484) 7.761 3.021 ( 13.744 -16.274 5.683) 22.046 3.537 ( -23.844 -5.083 -2.026) 24.464 3.955 ( 1.040 7.488 -11.438) 13.711 4.067 ( 0.221 4.365 11.915) 12.692 4.660 ( 10.082 -4.216 -7.185) 13.078 4.840 ( 0.435 -1.615 2.172) 2.741 5.153 ( -16.608 5.885 -0.723) 17.635 5.605 ( 11.592 1.124 -1.491) 11.742 5.911 ( 0.142 -0.265 7.734) 7.740 6.318 ( 1.182 2.154 -7.802) 8.180 6.661 ( 8.415 -3.080 -2.338) 9.261 8.693 ( 0.461 0.770 -0.066) 0.900 9.810 ( 4.175 -16.889 2.591) 17.590 11.182 ( -0.093 -10.747 0.078) 10.748 13.135 ( -1.977 0.365 -0.332) 2.037 14.490 ( 0.071 0.624 1.400) 1.534 14.537 ( -2.259 0.718 -0.480) 2.418 14.970 ( 3.672 1.269 4.025) 5.594 15.756 ( 2.619 0.021 1.579) 3.058 16.996 ( -7.283 3.004 -2.699) 8.328 18.448 ( -10.114 9.387 -0.365) 13.803 19.252 ( 8.547 2.155 -1.974) 9.033 19.867 ( -0.199 0.993 3.416) 3.563 20.878 ( 3.819 0.349 2.162) 4.402 55.841 ( -12.169 0.070 -8.555) 14.876 57.006 ( 8.764 8.211 3.467) 12.500 ======================= Grid point 276 (123/322) ======================= q-point: (-0.23 -0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.542 ( -14.398 -9.346 5.338) 17.977 1.932 ( -17.484 -4.373 -1.654) 18.098 2.697 ( -7.939 2.506 4.049) 9.257 2.919 ( 6.184 -4.150 -1.270) 7.555 3.332 ( -2.809 -8.935 5.109) 10.669 3.651 ( -0.509 -16.207 0.523) 16.223 3.773 ( 1.756 9.275 -7.175) 11.857 4.012 ( 1.556 4.166 9.082) 10.112 4.773 ( 8.524 -0.338 -8.175) 11.815 4.865 ( -7.242 -0.223 -3.343) 7.980 4.970 ( -6.756 -0.694 4.268) 8.021 5.658 ( 10.292 1.350 -2.956) 10.793 5.926 ( -0.274 0.361 9.239) 9.250 6.258 ( -0.504 2.212 -8.129) 8.440 6.776 ( 7.022 -2.917 -0.808) 7.647 8.686 ( 0.479 0.435 0.335) 0.729 10.203 ( 5.080 -19.399 1.895) 20.142 11.418 ( 1.881 -12.847 -2.725) 13.267 13.113 ( -2.248 0.363 0.621) 2.361 14.480 ( 0.029 0.666 1.340) 1.497 14.508 ( -2.016 0.498 -0.240) 2.091 14.971 ( 3.440 2.010 3.399) 5.237 15.778 ( 1.919 -0.384 1.028) 2.210 16.870 ( -8.132 3.742 -1.764) 9.124 18.157 ( -12.282 11.802 0.387) 17.037 19.256 ( 6.781 2.940 -0.716) 7.426 19.851 ( -0.036 0.966 2.163) 2.370 20.905 ( 4.484 0.296 0.294) 4.504 55.746 ( -11.293 -0.407 -5.667) 12.641 56.901 ( 9.638 10.011 2.650) 14.147 ======================= Grid point 277 (124/322) ======================= q-point: (-0.15 -0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.651 ( -7.640 -8.264 0.905) 11.291 1.750 ( -16.937 7.672 3.360) 18.895 2.599 ( -11.739 0.024 2.600) 12.023 3.026 ( -1.059 -4.206 -5.797) 7.240 3.445 ( 0.574 -3.759 -0.453) 3.829 3.628 ( 3.821 4.591 0.495) 5.993 3.933 ( 1.801 1.411 5.035) 5.530 4.017 ( 4.738 -10.735 2.218) 11.942 4.723 ( -9.636 2.730 0.002) 10.015 4.801 ( 2.688 0.948 -5.917) 6.568 5.081 ( 2.623 -6.815 0.585) 7.326 5.691 ( 8.646 1.873 -3.934) 9.682 5.920 ( -0.634 1.336 7.864) 8.002 6.219 ( -1.889 -0.420 -5.268) 5.612 6.863 ( 5.146 -1.530 -0.492) 5.392 8.680 ( 0.236 0.574 0.616) 0.875 10.605 ( 4.280 -18.026 0.460) 18.532 11.676 ( 4.329 -11.846 -4.759) 13.480 13.091 ( -2.669 0.231 1.804) 3.230 14.470 ( -0.072 0.541 1.088) 1.217 14.490 ( -1.427 0.056 0.539) 1.527 14.952 ( 2.186 2.649 2.520) 4.260 15.805 ( 1.483 -1.122 0.227) 1.873 16.736 ( -7.499 3.891 -0.637) 8.472 17.844 ( -12.185 10.876 1.272) 16.383 19.238 ( 4.912 3.253 0.156) 5.894 19.838 ( 0.085 0.687 1.202) 1.388 20.931 ( 4.220 0.255 -1.416) 4.458 55.680 ( -9.513 -1.376 -2.126) 9.844 56.777 ( 8.910 10.017 1.495) 13.489 ======================= Grid point 278 (125/322) ======================= q-point: (-0.08 -0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.412 ( -13.844 11.961 -2.858) 18.517 1.787 ( 0.362 -5.199 8.309) 9.808 2.547 ( -13.352 -3.739 0.712) 13.884 3.051 ( -6.673 -4.022 -9.449) 12.248 3.465 ( 10.192 4.267 -3.453) 11.576 3.655 ( 5.850 -0.660 5.718) 8.206 3.880 ( -2.469 1.949 2.382) 3.945 4.226 ( 2.641 -5.586 0.135) 6.180 4.631 ( -7.418 0.190 -1.901) 7.660 4.799 ( 1.631 0.396 2.032) 2.635 5.220 ( 2.998 -5.234 -2.188) 6.417 5.699 ( 6.561 2.172 -4.487) 8.240 5.897 ( -1.169 1.324 5.100) 5.397 6.229 ( -2.043 -2.445 -0.779) 3.280 6.907 ( 2.976 -0.105 -0.755) 3.072 8.668 ( 0.091 0.942 0.407) 1.030 10.932 ( 2.001 -12.956 -1.026) 13.150 11.902 ( 5.959 -8.208 -5.563) 11.569 13.073 ( -2.755 -0.063 2.956) 4.042 14.461 ( -0.083 0.525 1.394) 1.492 14.487 ( -0.805 -0.388 0.991) 1.335 14.912 ( 0.489 2.666 1.367) 3.036 15.840 ( 1.228 -1.351 -0.516) 1.897 16.618 ( -5.250 3.224 0.272) 6.167 17.596 ( -9.315 6.546 2.274) 11.610 19.206 ( 3.052 2.995 0.566) 4.314 19.831 ( 0.093 0.363 0.647) 0.747 20.949 ( 3.167 0.295 -2.621) 4.122 55.660 ( -6.830 -2.976 1.270) 7.558 56.657 ( 6.591 8.364 0.082) 10.649 ======================= Grid point 287 (126/322) ======================= q-point: (-0.38 -0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.018 ( -14.805 -0.000 0.556) 14.815 1.466 ( -26.476 -0.000 17.636) 31.812 2.613 ( 13.876 0.000 2.823) 14.161 2.796 ( 3.494 0.000 5.784) 6.758 2.859 ( 8.861 0.000 -0.680) 8.887 3.466 ( -34.076 -0.000 -1.007) 34.091 4.096 ( 2.657 0.000 6.408) 6.937 4.153 ( -0.582 -0.000 -12.846) 12.859 4.611 ( 9.041 0.000 0.989) 9.095 4.774 ( 1.684 0.000 0.298) 1.710 5.301 ( -17.635 -0.000 1.527) 17.701 5.624 ( 7.326 0.000 2.884) 7.873 5.900 ( -1.025 -0.000 -1.328) 1.678 6.342 ( 8.456 0.000 -0.359) 8.464 6.623 ( 10.137 0.000 -8.265) 13.080 8.721 ( -0.501 -0.000 0.590) 0.774 9.436 ( 3.682 0.000 1.762) 4.082 10.957 ( -1.530 -0.000 3.395) 3.724 13.143 ( -1.736 -0.000 -1.053) 2.031 14.504 ( 0.002 0.000 1.626) 1.626 14.553 ( -2.538 -0.000 -0.656) 2.621 14.996 ( 4.076 0.000 4.732) 6.246 15.760 ( 3.087 0.000 1.482) 3.424 17.056 ( -7.608 -0.000 -3.703) 8.461 18.642 ( -7.976 -0.000 -1.288) 8.079 19.297 ( 9.383 0.000 -3.129) 9.891 19.890 ( -0.466 -0.000 4.608) 4.632 20.890 ( 4.249 0.000 4.160) 5.947 55.845 ( -12.056 -0.000 -10.031) 15.683 57.175 ( 8.211 0.000 3.106) 8.779 ======================= Grid point 288 (127/322) ======================= q-point: (-0.31 -0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.120 ( -16.827 -16.048 0.595) 23.260 1.392 ( -21.365 -10.130 17.610) 29.482 2.793 ( 2.690 -0.961 3.710) 4.683 2.852 ( 10.820 -7.181 4.150) 13.633 2.907 ( 6.662 -0.624 -0.806) 6.740 3.240 ( -32.672 -3.694 0.319) 32.882 4.061 ( 1.722 4.685 -9.480) 10.714 4.148 ( 2.429 1.084 5.048) 5.705 4.667 ( 7.230 -0.684 -1.317) 7.381 4.817 ( 2.217 -2.214 0.322) 3.150 5.123 ( -18.787 3.971 0.023) 19.202 5.678 ( 6.262 -0.080 1.614) 6.467 5.902 ( -1.000 -1.147 1.065) 1.857 6.387 ( 7.617 2.430 -3.043) 8.555 6.692 ( 11.070 -0.612 -5.309) 12.293 8.710 ( -0.119 0.771 0.204) 0.807 9.576 ( 4.928 -10.602 2.043) 11.868 11.013 ( -1.120 -6.415 2.367) 6.929 13.127 ( -1.577 0.273 -0.730) 1.759 14.502 ( -0.099 0.369 1.790) 1.831 14.529 ( -2.635 0.404 -0.794) 2.781 15.028 ( 4.672 0.804 4.600) 6.605 15.780 ( 2.555 0.269 0.827) 2.699 16.973 ( -9.339 1.514 -3.688) 10.155 18.523 ( -9.411 5.787 -1.236) 11.116 19.343 ( 7.926 1.272 -2.458) 8.395 19.887 ( -0.477 0.637 3.883) 3.963 20.928 ( 5.612 0.593 3.564) 6.674 55.743 ( -11.378 0.086 -8.392) 14.138 57.201 ( 9.479 4.484 2.483) 10.776 ======================= Grid point 289 (128/322) ======================= q-point: (-0.23 -0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.235 ( -17.331 -10.887 9.066) 22.385 1.594 ( -16.177 -16.720 4.581) 23.712 2.706 ( -11.222 3.689 0.272) 11.816 2.920 ( 3.045 -0.294 1.296) 3.322 3.105 ( -10.945 -8.370 6.340) 15.167 3.319 ( 4.152 -18.408 0.957) 18.895 3.936 ( 1.419 7.457 -9.052) 11.814 4.135 ( 4.616 4.196 8.980) 10.934 4.746 ( 2.185 -3.349 -10.914) 11.623 4.865 ( 2.066 0.407 1.987) 2.896 4.928 ( -10.697 2.120 1.858) 11.062 5.723 ( 4.952 -0.189 1.246) 5.110 5.927 ( -0.432 -1.368 4.059) 4.305 6.334 ( 3.341 5.834 -7.168) 9.827 6.789 ( 9.968 -1.785 -1.807) 10.286 8.697 ( 0.196 0.498 0.063) 0.539 9.892 ( 5.794 -16.895 2.014) 17.974 11.193 ( 1.965 -11.591 -0.374) 11.763 13.107 ( -1.708 0.517 0.031) 1.785 14.494 ( -0.379 0.637 0.169) 0.761 14.501 ( -2.123 0.401 0.958) 2.363 15.044 ( 4.469 1.860 4.153) 6.378 15.789 ( 1.205 0.272 -0.176) 1.248 16.856 ( -10.480 2.414 -2.903) 11.139 18.284 ( -11.911 10.493 -0.699) 15.889 19.356 ( 6.308 2.412 -1.644) 6.951 19.873 ( -0.353 0.963 2.767) 2.951 20.959 ( 6.058 1.058 2.119) 6.505 55.653 ( -10.300 -0.158 -4.918) 11.415 57.153 ( 9.938 8.090 2.009) 12.971 ======================= Grid point 290 (129/322) ======================= q-point: (-0.15 -0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.375 ( -11.161 -12.715 7.125) 18.358 1.668 ( -18.592 -3.503 3.072) 19.167 2.546 ( -14.330 2.601 -0.860) 14.590 2.970 ( 1.527 -1.721 -2.280) 3.239 3.217 ( -10.804 -11.977 6.412) 17.357 3.738 ( 7.598 -15.940 3.402) 17.983 3.802 ( 5.052 5.084 -3.345) 7.909 4.086 ( 5.645 6.028 4.770) 9.537 4.669 ( -12.499 2.264 -7.718) 14.863 4.872 ( 7.094 1.691 -3.200) 7.964 4.976 ( 1.671 -5.836 2.771) 6.673 5.759 ( 4.516 0.266 0.080) 4.524 5.950 ( -0.107 0.117 7.105) 7.107 6.225 ( -0.837 3.962 -8.740) 9.632 6.882 ( 7.762 -1.161 -0.786) 7.887 8.692 ( 0.228 0.369 0.237) 0.495 10.280 ( 4.318 -18.614 1.144) 19.143 11.467 ( 6.870 -13.311 -3.457) 15.373 13.083 ( -2.115 0.594 1.092) 2.453 14.473 ( -1.563 0.281 -1.397) 2.115 14.490 ( -0.335 0.451 2.838) 2.893 15.031 ( 2.869 3.039 3.390) 5.381 15.793 ( -0.063 -0.611 -1.089) 1.250 16.728 ( -10.256 2.403 -1.494) 10.640 17.970 ( -13.296 11.771 0.237) 17.760 19.339 ( 4.847 3.284 -0.832) 5.913 19.857 ( -0.148 0.926 1.719) 1.958 20.981 ( 5.731 1.287 0.358) 5.885 55.588 ( -8.681 -0.850 -0.919) 8.770 57.046 ( 9.316 10.369 1.402) 14.010 ======================= Grid point 291 (130/322) ======================= q-point: (-0.08 -0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.451 ( -15.005 1.887 -5.305) 16.027 1.641 ( -5.125 -9.069 14.462) 17.823 2.406 ( -15.015 0.448 -0.426) 15.028 2.956 ( -5.013 0.191 -7.021) 8.630 3.422 ( -4.501 -12.561 3.762) 13.864 3.740 ( 11.131 4.747 2.091) 12.280 3.996 ( 5.075 7.565 -0.353) 9.117 4.090 ( 4.201 -11.961 2.375) 12.898 4.550 ( -10.421 0.108 -1.570) 10.539 4.863 ( 4.481 2.911 -2.301) 5.818 5.119 ( 2.589 -6.731 -0.720) 7.247 5.774 ( 4.310 1.482 -2.105) 5.020 5.933 ( -1.135 2.220 6.766) 7.211 6.173 ( -2.015 -1.018 -5.128) 5.603 6.938 ( 5.301 0.256 -0.778) 5.364 8.685 ( 0.185 0.617 0.190) 0.671 10.649 ( 1.444 -17.014 -0.206) 17.076 11.764 ( 10.094 -11.175 -5.456) 16.016 13.060 ( -2.430 0.340 2.273) 3.344 14.461 ( -1.029 -0.214 -1.016) 1.462 14.486 ( -0.119 0.344 2.981) 3.003 14.981 ( 0.421 3.695 2.252) 4.348 15.813 ( -0.119 -1.791 -1.493) 2.335 16.617 ( -8.262 1.835 -0.101) 8.464 17.670 ( -12.012 9.250 1.363) 15.222 19.300 ( 3.524 3.792 -0.154) 5.179 19.843 ( 0.022 0.688 0.995) 1.210 20.992 ( 4.750 1.482 -1.279) 5.137 55.561 ( -6.702 -2.146 2.224) 7.381 56.902 ( 7.647 11.064 0.535) 13.459 ======================= Grid point 301 (131/322) ======================= q-point: (-0.31 -0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.798 ( -15.697 -0.000 2.425) 15.883 1.176 ( -22.711 -0.000 26.748) 35.090 2.807 ( 10.415 0.000 1.742) 10.560 2.847 ( -26.360 -0.000 -5.941) 27.021 2.899 ( 8.939 0.000 5.395) 10.441 3.006 ( -12.326 -0.000 4.369) 13.078 4.107 ( -0.051 -0.000 -11.825) 11.825 4.188 ( 7.613 0.000 4.306) 8.746 4.712 ( 2.729 0.000 0.978) 2.899 4.799 ( 1.659 0.000 -0.132) 1.664 5.025 ( -17.782 -0.000 1.530) 17.848 5.713 ( 3.673 0.000 1.863) 4.119 5.874 ( -1.799 -0.000 -1.352) 2.250 6.483 ( 10.280 0.000 -1.686) 10.418 6.765 ( 12.208 0.000 -6.044) 13.623 8.717 ( -0.341 -0.000 0.385) 0.514 9.508 ( 5.323 0.000 1.543) 5.542 10.939 ( -2.340 -0.000 3.344) 4.081 13.119 ( -1.156 -0.000 -0.609) 1.307 14.508 ( -0.254 -0.000 1.815) 1.833 14.511 ( -2.796 -0.000 -0.702) 2.883 15.081 ( 5.476 0.000 4.799) 7.281 15.802 ( 2.218 0.000 -0.728) 2.334 16.908 ( -10.646 -0.000 -4.357) 11.503 18.516 ( -8.443 -0.000 -2.120) 8.705 19.404 ( 6.477 0.000 -2.556) 6.963 19.895 ( -0.676 -0.000 3.665) 3.727 20.987 ( 6.852 0.000 4.045) 7.957 55.653 ( -10.246 -0.000 -6.314) 12.035 57.319 ( 10.075 0.000 1.858) 10.244 ======================= Grid point 302 (132/322) ======================= q-point: (-0.23 -0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.895 ( -14.909 -14.618 5.558) 21.607 1.179 ( -17.068 -12.451 23.684) 31.737 2.570 ( -36.326 -0.297 -1.974) 36.381 2.937 ( 1.893 -0.934 0.009) 2.111 2.964 ( -1.140 -2.263 6.014) 6.526 3.076 ( 11.145 -10.813 2.272) 15.694 4.044 ( 0.783 4.311 -9.235) 10.222 4.252 ( 8.673 1.356 5.419) 10.316 4.681 ( -7.038 -0.013 -7.961) 10.627 4.850 ( 0.292 -2.768 -0.882) 2.920 4.917 ( -4.167 1.678 6.474) 7.879 5.740 ( 1.740 -0.473 2.733) 3.275 5.884 ( -1.360 -2.313 -0.762) 2.789 6.485 ( 6.682 6.264 -5.697) 10.786 6.846 ( 11.666 -0.296 -2.877) 12.019 8.708 ( -0.170 0.551 0.088) 0.584 9.664 ( 6.141 -11.014 1.489) 12.698 11.008 ( -0.254 -8.080 1.909) 8.306 13.107 ( -1.021 0.436 -0.066) 1.112 14.486 ( -2.569 0.285 -1.381) 2.931 14.506 ( -0.359 0.272 2.662) 2.699 15.119 ( 5.521 1.268 4.625) 7.313 15.803 ( 0.609 0.727 -2.779) 2.936 16.806 ( -11.591 1.388 -4.111) 12.377 18.377 ( -9.789 7.284 -2.435) 12.442 19.429 ( 5.033 1.247 -2.344) 5.691 19.890 ( -0.710 0.591 2.885) 3.029 21.034 ( 7.085 1.084 3.458) 7.958 55.577 ( -8.639 0.007 -1.670) 8.799 57.352 ( 10.102 4.508 1.533) 11.167 ======================= Grid point 303 (133/322) ======================= q-point: (-0.15 -0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.061 ( -11.786 -12.675 13.041) 21.671 1.380 ( -16.329 -13.006 8.895) 22.692 2.378 ( -29.438 -5.425 -2.854) 30.070 2.923 ( -3.501 -2.036 5.251) 6.632 3.035 ( -0.235 -2.027 2.734) 3.412 3.445 ( 7.979 -17.930 2.154) 19.743 3.944 ( 2.366 5.353 -3.062) 6.606 4.263 ( 9.813 5.255 5.824) 12.563 4.597 ( -10.082 0.154 -14.461) 17.629 4.895 ( -0.217 -3.452 2.674) 4.372 4.938 ( 6.115 0.111 2.346) 6.551 5.771 ( 1.113 -1.098 3.334) 3.682 5.929 ( -0.546 -2.692 1.519) 3.139 6.336 ( -0.444 9.092 -8.595) 12.520 6.930 ( 9.730 -0.393 -0.990) 9.788 8.699 ( 0.055 0.316 -0.021) 0.321 9.978 ( 4.837 -16.005 1.220) 16.765 11.253 ( 7.522 -14.055 -2.121) 16.081 13.087 ( -1.248 0.848 0.801) 1.708 14.461 ( -2.150 0.231 -1.307) 2.527 14.502 ( -0.207 0.393 2.816) 2.851 15.119 ( 3.540 3.064 3.988) 6.150 15.778 ( -2.197 0.364 -4.084) 4.651 16.683 ( -11.550 1.702 -2.524) 11.945 18.102 ( -12.585 11.660 -1.436) 17.216 19.423 ( 3.848 2.334 -1.926) 4.895 19.875 ( -0.573 0.833 1.928) 2.177 21.060 ( 6.584 1.825 2.195) 7.176 55.524 ( -6.487 -0.114 3.810) 7.524 57.299 ( 9.297 8.373 1.221) 12.571 ======================= Grid point 304 (134/322) ======================= q-point: (-0.08 -0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.249 ( -10.440 -10.791 3.594) 15.439 1.437 ( -15.024 -7.584 12.052) 20.700 2.296 ( -17.294 -2.366 -3.213) 17.749 2.950 ( -2.685 1.639 -3.803) 4.935 3.108 ( -7.692 -12.177 8.482) 16.715 3.831 ( 2.807 -15.921 2.872) 16.419 3.896 ( 7.341 2.168 1.783) 7.859 4.216 ( 11.591 8.382 -1.102) 14.347 4.500 ( -6.646 1.336 -5.659) 8.830 4.932 ( 0.196 1.018 0.927) 1.391 5.020 ( 5.130 -4.718 -1.814) 7.202 5.803 ( 1.582 -0.525 0.913) 1.900 5.966 ( -0.982 -0.080 6.476) 6.550 6.163 ( -3.808 3.956 -9.387) 10.875 6.990 ( 7.118 0.536 -0.774) 7.180 8.694 ( 0.128 0.316 -0.157) 0.375 10.324 ( 1.174 -17.227 0.699) 17.281 11.603 ( 13.952 -13.670 -6.224) 20.500 13.061 ( -1.580 0.941 1.899) 2.643 14.445 ( -1.514 -0.179 -1.043) 1.847 14.498 ( -0.036 0.407 2.843) 2.872 15.062 ( -0.623 4.314 2.760) 5.159 15.764 ( -2.704 -1.805 -3.537) 4.804 16.576 ( -9.634 0.988 -0.613) 9.704 17.781 ( -12.503 11.241 0.146) 16.814 19.391 ( 2.876 3.228 -1.370) 4.535 19.858 ( -0.313 0.766 1.191) 1.450 21.067 ( 5.658 2.283 0.616) 6.133 55.499 ( -4.511 -0.523 7.242) 8.548 57.175 ( 7.688 11.014 0.686) 13.449 ======================= Grid point 315 (135/322) ======================= q-point: (-0.23 -0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.592 ( -14.179 -0.000 5.842) 15.335 0.998 ( -16.165 -0.000 37.699) 41.018 2.248 ( -45.834 -0.000 -0.321) 45.835 2.922 ( 6.015 0.000 -0.258) 6.020 2.963 ( -2.676 -0.000 0.335) 2.697 3.075 ( 11.515 0.000 4.746) 12.455 4.076 ( 0.670 0.000 -9.411) 9.434 4.328 ( 8.194 0.000 0.708) 8.224 4.597 ( -13.442 -0.000 -4.282) 14.108 4.820 ( 1.370 0.000 -0.740) 1.557 4.936 ( 1.515 0.000 9.384) 9.506 5.748 ( 0.467 0.000 2.202) 2.251 5.841 ( -2.111 -0.000 -1.479) 2.578 6.602 ( 7.431 0.000 -8.270) 11.118 6.925 ( 11.408 0.000 -2.586) 11.697 8.713 ( -0.346 -0.000 0.041) 0.348 9.595 ( 5.864 0.000 1.098) 5.966 10.912 ( -2.906 -0.000 3.177) 4.305 13.106 ( -0.555 -0.000 0.241) 0.605 14.468 ( -2.534 -0.000 -1.360) 2.875 14.510 ( -0.449 -0.000 2.868) 2.903 15.183 ( 6.179 0.000 4.626) 7.718 15.807 ( -0.460 -0.000 -6.916) 6.931 16.727 ( -11.867 -0.000 -4.847) 12.818 18.386 ( -7.900 -0.000 -4.905) 9.299 19.469 ( 3.765 0.000 -2.672) 4.616 19.894 ( -0.909 -0.000 2.472) 2.634 21.105 ( 7.230 0.000 3.787) 8.162 55.526 ( -5.815 -0.000 5.652) 8.110 57.471 ( 9.813 0.000 1.346) 9.905 ======================= Grid point 316 (136/322) ======================= q-point: (-0.15 -0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.731 ( -11.014 -16.092 8.479) 21.264 1.054 ( -12.787 -10.054 30.947) 34.961 1.969 ( -43.398 -6.701 1.396) 43.935 2.914 ( -3.420 1.894 1.675) 4.253 3.016 ( 3.770 -3.355 -0.224) 5.051 3.239 ( 9.279 -8.778 3.076) 13.138 4.027 ( -0.403 3.421 -4.653) 5.790 4.390 ( 2.225 -2.946 -3.654) 5.195 4.510 ( -0.533 2.226 -5.101) 5.591 4.848 ( 0.059 -1.739 0.384) 1.782 4.978 ( 4.412 -0.579 8.660) 9.737 5.758 ( -0.313 -0.831 3.619) 3.726 5.859 ( -1.573 -3.243 -1.349) 3.848 6.513 ( -0.073 10.207 -11.719) 15.541 6.999 ( 9.916 0.118 -0.965) 9.964 8.705 ( -0.178 0.360 0.059) 0.406 9.755 ( 5.520 -10.807 0.559) 12.149 11.030 ( 3.400 -12.715 0.042) 13.162 13.098 ( -0.485 0.659 0.877) 1.199 14.447 ( -2.181 0.133 -1.309) 2.547 14.510 ( -0.380 0.179 3.069) 3.098 15.210 ( 4.448 2.503 3.729) 6.321 15.761 ( -4.372 1.373 -9.949) 10.953 16.622 ( -11.421 1.106 -3.594) 12.024 18.219 ( -10.506 9.303 -5.166) 14.953 19.477 ( 2.768 1.148 -2.680) 4.021 19.885 ( -0.965 0.515 1.691) 2.015 21.146 ( 6.520 1.475 3.376) 7.489 55.512 ( -1.534 0.666 15.158) 15.250 57.495 ( 8.821 4.711 1.235) 10.076 ======================= Grid point 317 (137/322) ======================= q-point: (-0.08 -0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.954 ( -9.862 -13.129 9.228) 18.836 1.176 ( -17.448 -8.672 16.722) 25.676 1.956 ( -25.047 -16.514 1.631) 30.045 2.882 ( -4.080 -1.908 4.985) 6.719 3.038 ( -0.835 2.405 -0.597) 2.615 3.536 ( 3.606 -15.563 1.512) 16.047 3.966 ( 0.554 1.524 -0.468) 1.688 4.447 ( 3.926 -0.542 0.735) 4.031 4.472 ( 9.633 5.032 -10.597) 15.180 4.883 ( -2.642 -2.573 1.148) 3.863 5.037 ( 6.181 -0.357 3.598) 7.161 5.789 ( 0.057 -1.557 2.585) 3.018 5.925 ( -0.667 -3.946 2.552) 4.746 6.241 ( -8.579 10.150 -11.136) 17.339 7.055 ( 7.540 0.688 -0.678) 7.602 8.700 ( 0.095 0.249 0.032) 0.269 10.029 ( 1.550 -14.184 0.678) 14.285 11.409 ( 16.150 -17.283 -8.088) 24.999 13.077 ( -0.657 1.192 1.815) 2.269 14.430 ( -1.580 -0.049 -1.058) 1.902 14.509 ( -0.221 0.278 3.033) 3.054 15.144 ( -3.279 5.156 1.441) 6.279 15.697 ( -5.416 -1.110 -6.625) 8.629 16.522 ( -9.086 0.790 -1.152) 9.193 17.911 ( -12.636 11.721 -2.055) 17.357 19.457 ( 1.993 2.172 -2.463) 3.842 19.869 ( -0.796 0.603 1.025) 1.431 21.157 ( 5.596 2.373 2.468) 6.560 55.516 ( 1.072 1.997 19.549) 19.680 57.424 ( 7.114 8.838 0.902) 11.382 ======================= Grid point 329 (138/322) ======================= q-point: (-0.15 -0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.436 ( -10.685 -0.000 11.239) 15.507 0.942 ( -11.338 -0.000 42.976) 44.447 1.562 ( -48.398 -0.000 5.057) 48.662 2.916 ( -3.362 -0.000 -0.123) 3.364 2.987 ( 3.635 0.000 -3.659) 5.157 3.243 ( 9.087 0.000 4.767) 10.261 4.067 ( 1.678 0.000 -5.880) 6.115 4.225 ( -15.290 -0.000 -12.760) 19.915 4.624 ( 13.652 0.000 7.250) 15.458 4.833 ( 0.820 0.000 -1.523) 1.730 5.018 ( 3.923 0.000 12.417) 13.022 5.750 ( -1.003 -0.000 3.168) 3.323 5.806 ( -1.865 -0.000 -1.702) 2.525 6.609 ( -2.029 -0.000 -20.245) 20.347 7.068 ( 8.625 0.000 -0.614) 8.647 8.708 ( -0.178 -0.000 0.386) 0.425 9.679 ( 5.029 0.000 0.497) 5.053 10.878 ( -2.974 -0.000 2.953) 4.191 13.104 ( -0.084 -0.000 1.259) 1.262 14.431 ( -1.923 -0.000 -1.316) 2.330 14.514 ( -0.407 -0.000 3.391) 3.415 15.276 ( 3.891 0.000 1.060) 4.033 15.714 ( -7.785 -0.000 -17.027) 18.723 16.548 ( -10.118 -0.000 -3.526) 10.715 18.242 ( -9.148 -0.000 -11.220) 14.477 19.500 ( 1.971 0.000 -2.937) 3.537 19.885 ( -1.175 -0.000 0.989) 1.536 21.212 ( 5.670 0.000 3.642) 6.739 55.593 ( 10.496 0.000 34.459) 36.022 57.604 ( 7.737 0.000 1.389) 7.861 ======================= Grid point 330 (139/322) ======================= q-point: (-0.08 -0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.617 ( -9.462 -15.884 8.441) 20.325 0.953 ( -19.285 -4.209 26.530) 33.068 1.410 ( -31.032 -17.043 16.344) 38.994 2.871 ( -2.755 1.609 0.986) 3.340 3.045 ( 1.036 -2.303 -4.163) 4.869 3.356 ( 5.166 -5.724 3.330) 8.398 3.972 ( -5.908 2.185 -3.837) 7.376 4.305 ( 0.588 -10.940 -15.253) 18.779 4.699 ( 16.655 4.587 3.960) 17.723 4.841 ( -1.157 -0.466 -0.113) 1.253 5.081 ( 6.048 -0.661 11.314) 12.846 5.762 ( -0.846 -1.237 3.070) 3.416 5.836 ( -0.670 -4.282 -0.126) 4.335 6.362 ( -15.420 12.639 -18.862) 27.446 7.118 ( 6.466 0.514 -0.597) 6.514 8.707 ( 0.409 0.279 1.272) 1.365 9.817 ( 2.600 -9.203 -0.350) 9.569 11.122 ( 10.986 -21.688 -7.807) 25.535 13.099 ( 0.001 0.837 1.979) 2.149 14.417 ( -1.398 -0.029 -1.150) 1.811 14.516 ( -0.297 0.140 3.480) 3.496 15.206 ( -9.619 5.796 -6.857) 13.158 15.625 ( -5.973 -0.648 -8.186) 10.154 16.473 ( -7.248 0.476 -1.443) 7.405 18.027 ( -13.224 10.167 -7.680) 18.364 19.496 ( 1.375 1.123 -2.938) 3.433 19.873 ( -1.231 0.358 0.453) 1.359 21.239 ( 4.609 1.565 3.684) 6.104 55.713 ( 18.978 7.752 44.396) 48.901 57.608 ( 5.940 5.002 1.268) 7.869 ======================= Grid point 343 (140/322) ======================= q-point: (-0.08 -0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.366 ( -5.262 -0.000 17.155) 17.944 0.728 ( -41.211 -0.000 7.807) 41.943 1.096 ( -15.469 -0.000 48.108) 50.534 2.877 ( -1.549 -0.000 -0.505) 1.629 3.001 ( 0.744 0.000 -7.282) 7.320 3.362 ( 4.889 0.000 5.017) 7.005 3.957 ( -14.420 -0.000 -13.886) 20.019 4.088 ( 3.014 0.000 -2.040) 3.639 4.833 ( 0.093 0.000 -2.477) 2.478 4.868 ( 12.743 0.000 0.612) 12.758 5.163 ( 13.456 0.000 16.827) 21.546 5.750 ( -0.702 -0.000 4.130) 4.189 5.778 ( -1.072 -0.000 -1.970) 2.243 6.322 ( -28.033 -0.000 -30.994) 41.791 7.162 ( 4.425 0.000 -0.728) 4.485 8.723 ( 1.840 0.000 3.875) 4.290 9.738 ( 2.792 0.000 -0.123) 2.795 10.848 ( -2.321 -0.000 2.721) 3.576 13.112 ( 0.339 0.000 2.436) 2.460 14.405 ( -1.029 -0.000 -1.155) 1.546 14.521 ( -0.204 -0.000 3.837) 3.842 15.125 ( -25.956 -0.000 -22.118) 34.102 15.590 ( 2.120 0.000 1.489) 2.591 16.432 ( -4.514 -0.000 -1.116) 4.650 18.021 ( -15.439 -0.000 -14.012) 20.849 19.512 ( 1.212 0.000 -2.845) 3.093 19.866 ( -1.453 -0.000 -0.188) 1.465 21.290 ( 3.243 0.000 4.280) 5.370 56.234 ( 59.481 0.000 56.714) 82.186 57.698 ( 4.195 0.000 1.551) 4.472 ======================= Grid point 344 (141/322) ======================= q-point: ( 0.00 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.533 ( 4.712 0.000 10.793) 11.777 0.749 ( 0.297 0.000 16.226) 16.228 2.110 ( -4.432 -0.000 39.883) 40.128 2.717 ( -2.078 -0.000 -13.371) 13.532 2.852 ( 2.554 0.000 -1.558) 2.992 3.556 ( -1.559 -0.000 8.678) 8.817 3.562 ( -1.886 -0.000 -10.093) 10.268 4.137 ( 6.162 0.000 -1.749) 6.405 4.735 ( -1.292 -0.000 -4.351) 4.539 4.784 ( -10.473 -0.000 1.614) 10.596 5.398 ( -0.192 -0.000 -2.869) 2.875 5.713 ( 0.140 0.000 -2.588) 2.592 5.727 ( -1.696 -0.000 -0.372) 1.737 5.895 ( 5.066 0.000 -2.196) 5.521 7.170 ( 0.374 0.000 -1.320) 1.372 8.882 ( 1.999 0.000 2.855) 3.485 9.742 ( -0.544 -0.000 -0.611) 0.818 10.889 ( -1.196 -0.000 2.906) 3.143 13.241 ( 1.081 0.000 7.253) 7.333 14.385 ( -0.043 -0.000 -0.022) 0.048 14.619 ( 0.088 0.000 3.985) 3.986 14.657 ( -4.590 -0.000 -5.914) 7.486 15.768 ( 4.754 0.000 2.310) 5.285 16.377 ( 0.484 0.000 -1.118) 1.218 17.711 ( -4.877 -0.000 -3.273) 5.873 19.401 ( -0.407 -0.000 -6.603) 6.616 19.900 ( 0.028 0.000 3.948) 3.948 21.427 ( -0.222 -0.000 4.327) 4.333 57.283 ( 15.773 0.000 4.342) 16.360 57.746 ( -1.660 -0.000 0.470) 1.726 ======================= Grid point 345 (142/322) ======================= q-point: ( 0.08 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.719 ( 23.780 -3.425 7.444) 25.152 1.000 ( 4.934 -18.278 13.910) 23.493 2.118 ( -4.347 -0.429 27.384) 27.730 2.735 ( -4.260 -3.419 -5.223) 7.558 2.912 ( 6.031 -3.650 -0.762) 7.090 3.420 ( 1.554 6.195 -2.872) 7.003 3.687 ( -2.191 -7.452 0.341) 7.774 4.269 ( 5.410 -8.297 -4.651) 10.943 4.672 ( -14.206 2.367 5.520) 15.424 4.727 ( -0.903 -0.643 -4.539) 4.673 5.337 ( -2.864 3.747 -2.353) 5.270 5.735 ( 1.372 -1.077 -1.735) 2.460 5.757 ( 2.402 -2.057 -1.281) 3.412 5.970 ( 7.227 -3.946 -3.302) 8.871 7.155 ( -1.544 0.912 -1.403) 2.276 8.847 ( -0.131 4.365 2.603) 5.084 9.818 ( -1.182 -8.581 -0.381) 8.670 11.010 ( -1.038 -11.661 -1.932) 11.865 13.253 ( 0.766 0.632 7.512) 7.577 14.388 ( 0.214 -0.209 0.057) 0.305 14.611 ( 0.079 1.166 1.766) 2.118 14.656 ( 1.272 -1.477 -3.952) 4.406 15.793 ( 0.942 -0.118 1.195) 1.526 16.390 ( 4.483 0.342 -1.031) 4.613 17.656 ( -1.030 2.726 -1.882) 3.469 19.378 ( -0.975 0.677 -6.142) 6.256 19.899 ( -0.014 0.773 3.870) 3.947 21.403 ( -1.989 2.347 3.832) 4.915 57.168 ( 3.954 18.041 8.837) 20.475 57.674 ( -3.161 5.639 0.136) 6.466 ======================= Grid point 346 (143/322) ======================= q-point: ( 0.15 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.960 ( 18.425 -3.973 5.182) 19.548 1.424 ( 10.318 -15.003 14.221) 23.104 2.206 ( 2.301 -5.923 6.431) 9.040 2.743 ( -4.433 -2.444 4.167) 6.557 3.044 ( 6.360 -4.054 2.427) 7.923 3.355 ( 4.703 1.843 -8.453) 9.847 3.822 ( -4.685 -9.019 1.818) 10.325 4.449 ( 2.159 -7.287 -6.355) 9.907 4.520 ( -13.959 3.370 9.084) 16.992 4.729 ( -0.896 -0.546 -4.491) 4.612 5.235 ( -1.274 4.043 -3.422) 5.448 5.764 ( 1.025 -0.763 -0.526) 1.382 5.795 ( 2.918 -0.193 0.064) 2.925 6.124 ( 6.684 -6.523 -4.134) 10.213 7.109 ( -3.422 1.655 -1.453) 4.070 8.749 ( -1.811 4.878 2.432) 5.744 10.042 ( -0.523 -15.000 -0.122) 15.010 11.252 ( -2.520 -14.510 -7.225) 16.405 13.253 ( 0.310 1.089 7.548) 7.632 14.395 ( 0.119 -0.405 0.194) 0.464 14.587 ( 0.343 1.676 1.244) 2.116 14.705 ( 4.132 -1.999 -3.632) 5.853 15.794 ( -2.534 -0.614 0.008) 2.608 16.424 ( 7.653 0.642 -0.537) 7.699 17.595 ( 3.105 4.043 -0.523) 5.124 19.343 ( -1.452 1.125 -4.998) 5.325 19.885 ( -0.236 1.103 3.233) 3.424 21.325 ( -3.279 4.230 2.775) 6.029 56.796 ( -0.826 21.448 15.504) 26.477 57.488 ( -5.067 10.391 -0.505) 11.571 ======================= Grid point 347 (144/322) ======================= q-point: ( 0.23 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.137 ( 11.905 -1.636 4.021) 12.671 1.745 ( 10.585 -8.656 13.268) 19.053 2.278 ( 4.028 2.886 -4.408) 6.632 2.892 ( 2.206 -13.776 6.449) 15.370 3.168 ( 7.571 -3.536 4.819) 9.646 3.365 ( 5.997 -0.041 -13.710) 14.964 3.941 ( -9.145 -6.793 1.020) 11.437 4.397 ( -10.541 0.827 11.700) 15.770 4.539 ( 0.051 -1.139 -2.911) 3.127 4.698 ( -4.842 0.115 -6.446) 8.063 5.187 ( 2.900 0.363 -5.067) 5.849 5.756 ( -1.768 1.654 3.236) 4.041 5.825 ( 4.291 -0.281 -1.165) 4.455 6.274 ( 4.707 -4.896 -2.719) 7.316 7.041 ( -4.760 1.946 -1.447) 5.342 8.660 ( -2.136 2.976 1.846) 4.102 10.363 ( 0.056 -17.854 -0.102) 17.854 11.486 ( -3.347 -13.157 -8.426) 15.978 13.242 ( -0.263 1.268 7.168) 7.284 14.405 ( -0.193 -0.617 0.415) 0.768 14.560 ( 0.517 1.520 1.103) 1.948 14.771 ( 4.634 -1.834 -2.574) 5.609 15.784 ( -4.369 -1.285 -1.346) 4.749 16.471 ( 9.059 0.821 0.056) 9.096 17.550 ( 6.355 4.086 1.020) 7.624 19.297 ( -2.002 1.592 -3.511) 4.344 19.868 ( -0.374 0.939 2.321) 2.531 21.209 ( -3.847 5.283 1.183) 6.641 56.439 ( -0.579 17.122 15.283) 22.959 57.213 ( -6.724 13.188 -1.430) 14.872 ======================= Grid point 348 (145/322) ======================= q-point: ( 0.31 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.187 ( 5.799 4.038 2.709) 7.568 1.962 ( 11.671 -3.092 10.154) 15.776 2.224 ( 2.384 1.328 -3.739) 4.629 3.206 ( 8.168 -10.373 4.019) 13.801 3.317 ( 4.511 -6.540 3.510) 8.686 3.392 ( 9.203 0.143 -14.427) 17.113 3.918 ( -14.351 -0.509 -0.279) 14.362 4.375 ( -6.567 -0.706 5.273) 8.451 4.461 ( -1.292 4.962 2.071) 5.529 4.718 ( -4.315 -6.570 -4.366) 8.991 5.225 ( 3.911 -1.532 -5.369) 6.817 5.692 ( -2.594 3.751 4.007) 6.071 5.861 ( 3.612 -0.578 -0.231) 3.665 6.366 ( 2.674 -2.304 -1.092) 3.695 6.966 ( -5.004 1.701 -1.414) 5.471 8.613 ( -1.598 0.812 1.269) 2.196 10.700 ( 0.048 -16.459 -0.410) 16.464 11.677 ( -2.504 -10.285 -7.910) 13.214 13.225 ( -0.885 1.164 6.432) 6.596 14.418 ( -0.441 -0.924 0.868) 1.343 14.543 ( 0.645 0.883 1.157) 1.592 14.825 ( 3.290 -0.998 -1.214) 3.646 15.780 ( -4.309 -1.905 -2.176) 5.189 16.518 ( 8.373 1.070 0.462) 8.454 17.538 ( 7.933 2.873 2.610) 8.831 19.242 ( -2.493 1.962 -1.920) 3.709 19.853 ( -0.405 0.626 1.492) 1.668 21.079 ( -3.528 5.222 -0.775) 6.350 56.192 ( 1.112 11.111 12.053) 16.431 56.897 ( -7.451 13.416 -2.547) 15.556 ======================= Grid point 349 (146/322) ======================= q-point: ( 0.38 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.090 ( 0.760 7.332 -0.198) 7.374 2.057 ( 11.532 2.400 8.587) 14.577 2.302 ( 2.649 -6.803 -3.033) 7.905 3.306 ( -0.052 2.205 -8.329) 8.616 3.440 ( 1.105 -1.680 1.421) 2.463 3.507 ( 16.293 -3.061 0.012) 16.578 3.815 ( -13.334 -1.048 -2.778) 13.660 4.286 ( -5.320 1.668 3.369) 6.515 4.449 ( -1.257 -1.263 -1.574) 2.377 4.844 ( -0.455 -8.099 1.318) 8.218 5.250 ( 1.044 0.748 -4.535) 4.713 5.608 ( -0.841 3.398 2.157) 4.111 5.896 ( 2.333 -0.736 0.844) 2.588 6.400 ( 0.852 -0.093 0.275) 0.901 6.904 ( -3.973 0.978 -1.423) 4.332 8.605 ( -0.818 -0.609 0.810) 1.302 10.967 ( -0.460 -11.065 -0.887) 11.110 11.816 ( -0.261 -6.444 -7.405) 9.819 13.206 ( -1.414 0.959 5.649) 5.902 14.439 ( -0.427 -1.363 1.484) 2.060 14.537 ( 0.566 0.455 1.338) 1.522 14.850 ( 1.179 -0.092 -0.450) 1.265 15.791 ( -2.842 -2.301 -2.042) 4.188 16.549 ( 5.871 1.187 0.713) 6.032 17.559 ( 6.659 1.344 3.763) 7.766 19.185 ( -2.312 1.617 -0.578) 2.880 19.843 ( -0.349 0.357 0.970) 1.091 20.964 ( -2.285 3.973 -2.670) 5.304 56.058 ( 1.987 6.464 9.632) 11.769 56.607 ( -6.441 10.157 -3.933) 12.654 ======================= Grid point 350 (147/322) ======================= q-point: ( 0.46 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.988 ( -1.800 0.942 -3.835) 4.340 2.101 ( 8.879 2.212 10.243) 13.735 2.451 ( 0.384 -6.828 -3.157) 7.533 3.147 ( -4.698 9.750 -11.358) 15.689 3.410 ( -0.496 3.207 2.036) 3.831 3.677 ( 12.199 -2.773 -0.714) 12.531 3.791 ( -6.402 -4.220 -0.081) 7.668 4.284 ( -1.967 -2.388 5.007) 5.886 4.449 ( -3.019 -1.102 -5.656) 6.505 4.992 ( 0.479 -4.612 6.441) 7.936 5.194 ( 0.222 2.924 -6.496) 7.128 5.579 ( 2.506 0.287 -1.032) 2.725 5.921 ( 0.514 -0.448 1.465) 1.616 6.385 ( -0.485 1.913 1.687) 2.596 6.872 ( -1.908 -0.160 -1.544) 2.460 8.621 ( -0.222 -1.134 0.294) 1.192 11.101 ( -0.933 -3.364 -1.106) 3.662 11.893 ( 2.552 -1.960 -7.361) 8.033 13.186 ( -1.731 0.955 5.170) 5.535 14.465 ( -0.444 -1.158 1.569) 2.000 14.536 ( 0.459 0.313 1.861) 1.942 14.853 ( -0.259 -0.336 -0.338) 0.542 15.815 ( -1.096 -1.809 -1.602) 2.653 16.563 ( 2.335 0.497 0.854) 2.535 17.579 ( 1.851 0.803 4.366) 4.810 19.155 ( -0.839 0.013 0.108) 0.846 19.838 ( -0.216 0.078 0.784) 0.817 20.892 ( -0.337 1.809 -3.882) 4.296 55.966 ( -0.516 6.231 8.893) 10.871 56.446 ( -1.774 1.606 -4.882) 5.437 ======================= Grid point 351 (148/322) ======================= q-point: (-0.46 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.040 ( -2.922 -8.222 -4.754) 9.937 2.130 ( 5.064 2.082 11.878) 13.079 2.495 ( -9.243 0.517 -0.265) 9.262 2.901 ( -5.016 8.082 -10.920) 14.482 3.400 ( 5.384 -1.747 -0.651) 5.698 3.746 ( 0.321 -0.434 -5.847) 5.871 3.867 ( 3.766 -2.770 5.328) 7.088 4.329 ( 0.349 -1.313 5.852) 6.007 4.444 ( -3.929 -2.466 -6.545) 8.022 4.952 ( -2.556 6.491 3.987) 8.035 5.212 ( 4.023 -1.751 -4.724) 6.447 5.620 ( 3.607 -2.303 -2.200) 4.811 5.925 ( -1.477 -0.226 1.281) 1.968 6.332 ( -0.648 3.382 3.115) 4.644 6.878 ( 0.564 -1.223 -1.610) 2.098 8.642 ( 0.016 -1.024 -0.340) 1.079 11.079 ( -0.934 4.561 -0.769) 4.718 11.902 ( 5.174 2.655 -7.743) 9.684 13.161 ( -1.736 1.095 5.152) 5.546 14.474 ( -0.467 0.086 0.851) 0.975 14.538 ( 0.113 0.147 2.405) 2.412 14.871 ( -0.594 -2.084 -0.261) 2.183 15.828 ( -0.014 -0.031 -1.779) 1.779 16.569 ( -1.500 -0.562 0.829) 1.804 17.565 ( -4.338 0.299 4.511) 6.265 19.177 ( 1.122 -2.020 -0.096) 2.313 19.840 ( -0.080 -0.284 0.817) 0.868 20.881 ( 1.839 -0.755 -3.883) 4.363 55.842 ( -3.013 6.013 8.885) 11.144 56.504 ( 3.106 -6.921 -3.901) 8.531 ======================= Grid point 352 (149/322) ======================= q-point: (-0.38 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.185 ( -4.875 -8.575 -2.304) 10.129 2.120 ( 3.009 5.263 13.101) 14.436 2.312 ( -18.010 4.827 0.480) 18.652 2.766 ( -4.377 1.340 -6.335) 7.816 3.526 ( 7.186 -2.427 -4.735) 8.942 3.714 ( -2.315 -0.776 -4.307) 4.951 3.930 ( 5.269 0.233 2.281) 5.746 4.328 ( 1.181 3.538 3.848) 5.359 4.474 ( -3.337 -3.616 -1.086) 5.039 4.835 ( 2.851 4.167 -1.626) 5.304 5.214 ( 0.245 2.863 -1.638) 3.307 5.702 ( 2.847 -3.608 -1.730) 4.910 5.917 ( -3.368 -0.647 -0.153) 3.433 6.265 ( 0.461 3.960 4.339) 5.893 6.918 ( 2.903 -1.825 -1.565) 3.769 8.657 ( -0.039 -0.733 -0.828) 1.107 10.918 ( -0.605 11.257 -0.085) 11.273 11.843 ( 7.290 6.748 -8.538) 13.099 13.139 ( -1.313 0.849 5.495) 5.713 14.462 ( -0.371 0.872 0.471) 1.059 14.539 ( -0.338 -0.026 2.086) 2.113 14.920 ( -1.342 -3.460 -0.474) 3.742 15.805 ( 0.306 2.204 -2.412) 3.282 16.560 ( -4.904 -0.580 0.778) 4.999 17.539 ( -8.306 -2.184 3.881) 9.425 19.238 ( 1.989 -2.928 -1.085) 3.703 19.849 ( -0.104 -0.606 0.886) 1.078 20.934 ( 3.669 -3.164 -2.561) 5.480 55.755 ( -1.862 2.307 11.606) 11.979 56.709 ( 4.914 -11.366 -2.720) 12.679 ======================= Grid point 353 (150/322) ======================= q-point: (-0.31 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.232 ( -9.759 -1.082 1.030) 9.873 1.946 ( -5.781 12.197 13.017) 18.752 2.187 ( -10.710 -1.257 1.390) 10.872 2.754 ( -4.013 -3.833 -1.989) 5.895 3.417 ( -3.767 10.706 0.205) 11.352 3.774 ( -6.916 -3.322 -14.442) 16.353 4.016 ( 15.336 -3.516 2.741) 15.971 4.221 ( 2.265 8.792 3.903) 9.883 4.507 ( 2.077 -0.436 1.654) 2.690 4.858 ( 3.833 -3.567 -2.967) 6.018 5.120 ( -2.476 4.979 -0.538) 5.587 5.774 ( 0.490 -2.481 -0.804) 2.654 5.901 ( -5.056 -1.114 -2.400) 5.707 6.202 ( 1.543 4.341 4.805) 6.657 6.981 ( 4.570 -2.004 -1.529) 5.219 8.669 ( -0.126 -0.792 -0.654) 1.035 10.653 ( -0.224 15.568 0.373) 15.574 11.724 ( 8.481 10.025 -9.842) 16.410 13.132 ( -0.521 0.088 5.975) 5.998 14.441 ( -0.417 1.017 0.289) 1.136 14.544 ( -0.468 -0.532 1.892) 2.021 14.966 ( -4.357 -3.165 -2.079) 5.773 15.747 ( 1.094 3.615 -2.200) 4.371 16.521 ( -6.949 0.111 0.819) 6.998 17.554 ( -9.274 -5.549 2.134) 11.016 19.304 ( 1.752 -2.645 -2.455) 4.012 19.862 ( -0.385 -0.695 0.939) 1.230 21.041 ( 4.635 -4.819 -0.398) 6.698 55.784 ( 1.929 -3.274 17.273) 17.686 56.982 ( 5.211 -13.143 -1.591) 14.228 ======================= Grid point 354 (151/322) ======================= q-point: (-0.23 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.092 ( -15.943 5.473 3.629) 17.242 1.688 ( -9.495 11.335 14.940) 21.020 2.122 ( -3.649 3.644 2.907) 5.920 2.833 ( -3.701 -6.554 0.796) 7.569 3.163 ( -5.269 11.039 2.670) 12.520 3.668 ( -10.701 3.619 -13.471) 17.580 4.040 ( 2.534 10.102 5.471) 11.765 4.232 ( 16.209 -1.979 -6.302) 17.504 4.553 ( 6.762 -1.634 1.694) 7.160 4.921 ( -4.811 0.331 1.502) 5.050 5.065 ( 3.324 -2.808 -2.330) 4.936 5.798 ( -1.704 -0.684 -0.012) 1.837 5.880 ( -6.289 -1.672 -4.596) 7.967 6.124 ( 1.421 5.893 3.688) 7.096 7.051 ( 4.919 -1.847 -1.495) 5.462 8.690 ( 0.130 -1.576 0.596) 1.690 10.339 ( 0.132 16.617 0.193) 16.619 11.547 ( 7.835 12.824 -11.210) 18.749 13.148 ( 0.335 -0.662 6.414) 6.457 14.420 ( -0.528 0.837 0.113) 0.996 14.559 ( -0.444 -0.977 2.248) 2.491 14.954 ( -9.700 -1.332 -5.248) 11.109 15.693 ( 3.836 3.284 -0.023) 5.050 16.466 ( -7.085 0.241 0.602) 7.115 17.616 ( -8.857 -7.226 -0.269) 11.434 19.354 ( 1.217 -1.999 -3.784) 4.449 19.872 ( -0.746 -0.607 1.235) 1.565 21.175 ( 4.499 -5.221 1.781) 7.118 55.982 ( 8.266 -10.319 24.348) 27.706 57.269 ( 4.616 -12.702 -0.477) 13.524 ======================= Grid point 355 (152/322) ======================= q-point: (-0.15 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.844 ( -19.255 6.874 6.681) 21.509 1.382 ( -11.193 16.084 13.428) 23.755 2.033 ( 1.382 4.499 13.363) 14.168 2.897 ( -5.985 -0.906 4.565) 7.581 2.977 ( -1.975 4.615 -2.265) 5.507 3.491 ( -7.964 3.943 -7.202) 11.439 3.877 ( -0.450 8.013 0.386) 8.035 4.275 ( 11.841 6.363 -8.047) 15.666 4.675 ( 6.842 -4.294 -1.112) 8.153 4.847 ( -6.656 1.167 2.015) 7.052 5.200 ( 5.367 -5.955 -1.048) 8.085 5.781 ( -2.683 0.629 0.375) 2.781 5.858 ( -7.911 -2.058 -5.830) 10.040 6.004 ( 1.390 7.830 1.119) 8.031 7.113 ( 3.906 -1.410 -1.429) 4.392 8.739 ( 1.043 -2.917 2.609) 4.050 10.040 ( 0.502 14.137 -0.332) 14.150 11.305 ( 4.421 15.064 -10.127) 18.683 13.180 ( 0.943 -0.917 6.737) 6.864 14.402 ( -0.589 0.574 -0.030) 0.823 14.581 ( -0.317 -1.096 2.965) 3.177 14.862 ( -13.210 0.717 -7.517) 15.216 15.685 ( 6.622 1.708 2.549) 7.298 16.417 ( -5.665 -0.029 -0.016) 5.665 17.687 ( -8.162 -6.512 -2.526) 10.743 19.387 ( 0.756 -1.436 -4.946) 5.206 19.880 ( -0.819 -0.545 2.079) 2.300 21.301 ( 3.399 -4.294 3.379) 6.434 56.386 ( 16.710 -17.636 27.152) 36.435 57.520 ( 3.180 -10.161 0.416) 10.655 ======================= Grid point 356 (153/322) ======================= q-point: (-0.08 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.614 ( -16.939 3.659 10.113) 20.065 0.973 ( -7.057 19.327 12.963) 24.318 2.044 ( 0.561 -0.686 30.174) 30.187 2.819 ( -5.342 3.668 -2.263) 6.864 2.880 ( 0.318 4.320 -5.130) 6.715 3.451 ( -3.922 -4.794 -0.783) 6.244 3.720 ( -2.713 7.112 -2.250) 7.938 4.183 ( 8.167 8.079 -4.687) 12.407 4.748 ( 0.489 -0.507 -4.535) 4.590 4.815 ( -5.517 -1.872 1.528) 6.023 5.337 ( 4.704 -4.273 -1.693) 6.576 5.745 ( -1.853 1.278 -0.336) 2.276 5.797 ( -9.352 1.747 -3.003) 9.977 5.896 ( 3.966 3.646 -2.303) 5.858 7.155 ( 2.203 -0.787 -1.337) 2.694 8.821 ( 2.240 -3.328 3.669) 5.437 9.824 ( 0.569 8.227 -0.539) 8.264 11.029 ( -0.158 12.542 -3.003) 12.897 13.214 ( 1.179 -0.614 6.985) 7.110 14.390 ( -0.451 0.293 -0.068) 0.542 14.604 ( -0.124 -0.796 3.643) 3.731 14.738 ( -10.871 1.154 -6.919) 12.937 15.722 ( 6.953 0.417 3.218) 7.673 16.386 ( -3.083 -0.165 -0.719) 3.170 17.727 ( -7.151 -3.705 -3.776) 8.895 19.404 ( 0.253 -0.831 -6.032) 6.095 19.890 ( -0.406 -0.482 3.260) 3.320 21.392 ( 1.695 -2.381 4.212) 5.127 56.931 ( 22.198 -17.452 16.900) 32.908 57.692 ( 0.883 -5.748 0.738) 5.862 ======================= Grid point 358 (154/322) ======================= q-point: ( 0.08 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.820 ( 2.328 0.000 14.955) 15.135 0.981 ( 41.730 0.000 5.918) 42.148 2.116 ( -10.183 -0.000 33.036) 34.570 2.633 ( -3.575 -0.000 -12.231) 12.743 2.959 ( 11.247 0.000 2.222) 11.464 3.528 ( -6.005 -0.000 8.404) 10.330 3.585 ( 9.211 0.000 -10.198) 13.742 4.204 ( 3.869 0.000 -3.426) 5.168 4.594 ( -16.061 -0.000 7.975) 17.932 4.704 ( -0.883 -0.000 -3.819) 3.919 5.340 ( -5.209 -0.000 -0.833) 5.275 5.717 ( 1.544 0.000 -2.415) 2.866 5.771 ( 5.559 0.000 -4.919) 7.423 5.987 ( 8.183 0.000 -2.722) 8.624 7.144 ( -3.169 -0.000 -1.563) 3.533 8.897 ( -0.766 -0.000 1.581) 1.756 9.713 ( -3.179 -0.000 -0.353) 3.198 10.892 ( 0.161 0.000 3.036) 3.040 13.276 ( 0.408 0.000 7.346) 7.357 14.390 ( 0.725 0.000 0.062) 0.728 14.633 ( 0.182 0.000 3.616) 3.621 14.655 ( 5.639 0.000 -6.177) 8.364 15.787 ( -2.232 -0.000 -0.919) 2.414 16.440 ( 8.375 0.000 -0.951) 8.429 17.682 ( 2.119 0.000 -1.794) 2.777 19.365 ( -1.560 -0.000 -6.404) 6.592 19.915 ( 0.063 0.000 4.194) 4.194 21.410 ( -3.952 -0.000 4.060) 5.666 57.343 ( -7.560 -0.000 1.778) 7.766 57.705 ( -3.871 -0.000 0.671) 3.929 ======================= Grid point 359 (155/322) ======================= q-point: ( 0.15 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.980 ( 6.824 -8.434 11.474) 15.791 1.363 ( 36.753 -6.999 7.407) 38.140 2.107 ( -5.933 -2.854 18.477) 19.615 2.659 ( -3.733 -5.133 -6.223) 8.889 3.046 ( 10.199 -0.526 5.303) 11.507 3.456 ( 0.853 3.469 2.310) 4.254 3.677 ( 4.135 -3.496 -4.947) 7.334 4.304 ( 1.880 -7.278 -6.904) 10.206 4.476 ( -15.664 1.624 11.190) 19.318 4.704 ( -0.431 -0.824 -3.251) 3.381 5.273 ( -4.773 2.460 -1.224) 5.507 5.747 ( 1.264 -1.567 -0.985) 2.241 5.807 ( 4.064 -0.740 -4.676) 6.239 6.074 ( 8.441 -3.356 -4.015) 9.932 7.102 ( -4.918 1.037 -1.696) 5.304 8.837 ( -2.061 4.790 1.766) 5.506 9.785 ( -3.119 -9.800 -0.330) 10.290 10.995 ( -0.503 -9.276 0.205) 9.292 13.283 ( -0.032 0.643 6.998) 7.027 14.397 ( 0.916 0.001 0.123) 0.924 14.624 ( 0.575 1.417 2.256) 2.726 14.708 ( 6.952 -1.204 -4.604) 8.424 15.760 ( -4.333 -0.081 -2.183) 4.853 16.503 ( 10.686 0.572 -0.768) 10.729 17.687 ( 5.889 2.176 -1.339) 6.420 19.337 ( -2.019 0.493 -5.777) 6.139 19.912 ( -0.112 0.985 3.983) 4.105 21.361 ( -5.386 2.201 3.683) 6.886 57.126 ( -11.310 13.522 6.346) 18.736 57.609 ( -6.047 6.319 0.866) 8.789 ======================= Grid point 360 (156/322) ======================= q-point: ( 0.23 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.200 ( 12.062 -4.599 8.868) 15.661 1.732 ( 23.102 -5.872 12.035) 26.702 2.244 ( 3.316 -8.795 -3.074) 9.889 2.713 ( -1.349 -4.584 3.753) 6.076 3.154 ( 5.936 -3.453 5.353) 8.707 3.439 ( 7.379 1.346 -3.764) 8.392 3.765 ( -1.037 -4.919 -1.725) 5.315 4.348 ( -13.172 1.293 14.534) 19.657 4.438 ( -1.330 -6.346 -9.955) 11.881 4.694 ( -2.027 1.391 -2.928) 3.823 5.202 ( -2.011 1.239 -2.298) 3.296 5.768 ( -0.257 0.081 1.309) 1.337 5.841 ( 3.040 -0.756 -2.896) 4.266 6.211 ( 6.915 -5.078 -4.357) 9.622 7.031 ( -6.563 1.623 -1.635) 6.955 8.723 ( -2.516 4.898 2.021) 5.865 10.021 ( -2.393 -16.221 -0.518) 16.405 11.200 ( -1.888 -12.570 -3.180) 13.102 13.274 ( -0.516 1.145 6.389) 6.512 14.403 ( 0.885 -0.011 0.261) 0.923 14.600 ( 0.591 1.829 1.725) 2.583 14.777 ( 6.463 -1.305 -2.719) 7.132 15.727 ( -5.015 -0.635 -2.872) 5.814 16.567 ( 11.410 1.155 -0.424) 11.476 17.684 ( 9.204 3.609 -0.474) 9.897 19.298 ( -2.519 0.918 -4.592) 5.318 19.893 ( -0.265 1.368 3.362) 3.640 21.265 ( -6.060 3.862 2.641) 7.656 56.766 ( -8.320 16.420 10.047) 20.971 57.389 ( -8.297 10.854 0.363) 13.667 ======================= Grid point 361 (157/322) ======================= q-point: ( 0.31 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.343 ( 14.400 1.599 6.785) 15.998 1.980 ( 14.803 -4.477 10.500) 18.693 2.309 ( 3.323 3.473 -6.452) 8.046 2.950 ( 3.522 -17.031 3.719) 17.785 3.267 ( 3.425 -3.864 1.903) 5.503 3.487 ( 12.909 0.574 -6.880) 14.639 3.809 ( -6.499 -1.420 0.256) 6.657 4.292 ( -9.657 -2.069 13.311) 16.574 4.519 ( -1.299 -4.091 -7.174) 8.360 4.594 ( -5.779 3.854 -3.721) 7.880 5.203 ( 0.910 -1.795 -3.095) 3.692 5.739 ( -2.144 2.384 2.987) 4.382 5.873 ( 2.675 -0.751 -1.357) 3.092 6.333 ( 4.721 -3.556 -3.033) 6.643 6.947 ( -7.400 1.333 -1.458) 7.659 8.636 ( -1.860 2.683 1.793) 3.725 10.346 ( -2.332 -18.758 -0.659) 18.914 11.424 ( -1.947 -12.575 -4.792) 13.597 13.254 ( -0.960 1.383 5.625) 5.871 14.411 ( 0.741 -0.140 0.555) 0.936 14.573 ( 0.666 1.535 1.457) 2.219 14.835 ( 4.469 -0.747 -0.816) 4.604 15.708 ( -4.446 -1.542 -3.105) 5.638 16.619 ( 10.647 1.849 -0.054) 10.807 17.683 ( 11.267 4.229 0.853) 12.064 19.249 ( -3.123 1.372 -3.099) 4.609 19.870 ( -0.346 1.173 2.492) 2.776 21.141 ( -5.817 4.619 0.976) 7.491 56.446 ( -3.621 13.429 9.300) 16.732 57.089 ( -9.623 13.146 -0.493) 16.299 ======================= Grid point 362 (158/322) ======================= q-point: ( 0.38 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.338 ( 12.799 10.495 3.573) 16.933 2.162 ( 10.386 -3.179 7.515) 13.208 2.260 ( 5.424 1.988 -2.102) 6.147 3.271 ( 2.440 -9.398 -1.818) 9.878 3.358 ( 1.767 -5.117 -3.098) 6.238 3.580 ( 10.736 -1.646 -5.495) 12.173 3.735 ( -4.950 3.119 4.405) 7.324 4.269 ( -9.420 0.395 2.721) 9.813 4.452 ( -0.943 3.215 1.116) 3.531 4.657 ( -2.046 -9.770 -3.371) 10.536 5.241 ( 0.102 -1.414 -2.901) 3.229 5.665 ( -2.747 3.444 2.634) 5.133 5.902 ( 1.899 -0.603 0.180) 2.001 6.401 ( 2.754 -1.139 -1.406) 3.296 6.876 ( -6.737 0.359 -1.286) 6.868 8.599 ( -0.762 0.503 1.393) 1.666 10.677 ( -2.827 -17.120 -0.812) 17.371 11.632 ( -0.597 -10.769 -5.693) 12.196 13.228 ( -1.224 1.318 4.996) 5.310 14.424 ( 0.644 -0.543 1.038) 1.337 14.557 ( 0.642 0.928 1.372) 1.776 14.863 ( 1.842 0.241 0.203) 1.869 15.715 ( -3.044 -2.550 -2.567) 4.728 16.645 ( 8.477 2.789 0.271) 8.928 17.686 ( 11.109 4.282 2.277) 12.121 19.193 ( -3.423 1.470 -1.564) 4.041 19.852 ( -0.370 0.767 1.666) 1.871 21.016 ( -4.580 4.196 -1.053) 6.300 56.235 ( 0.616 8.912 7.361) 11.575 56.763 ( -9.915 12.660 -1.675) 16.167 ======================= Grid point 363 (159/322) ======================= q-point: ( 0.46 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.173 ( 9.637 13.544 -0.488) 16.630 2.236 ( 8.473 3.169 9.091) 12.825 2.348 ( 5.809 -5.425 -2.632) 8.372 3.267 ( -1.379 6.119 -9.784) 11.622 3.457 ( 0.145 0.376 2.563) 2.595 3.605 ( -9.540 -5.003 -8.663) 13.824 3.769 ( 14.517 -0.765 6.611) 15.970 4.219 ( -5.192 -2.132 3.794) 6.775 4.414 ( -2.047 0.520 -3.168) 3.807 4.854 ( 0.927 -10.227 1.159) 10.334 5.228 ( -2.086 1.609 -2.706) 3.777 5.600 ( -1.089 1.504 -0.112) 1.861 5.921 ( 0.489 -0.269 1.200) 1.323 6.416 ( 1.200 0.867 0.441) 1.545 6.836 ( -4.538 -0.853 -1.331) 4.805 8.603 ( 0.131 -0.704 0.918) 1.164 10.936 ( -3.227 -11.742 -0.905) 12.211 11.803 ( 1.403 -7.556 -6.694) 10.192 13.204 ( -1.229 1.134 4.785) 5.068 14.445 ( 0.515 -1.003 1.427) 1.819 14.550 ( 0.463 0.498 1.562) 1.703 14.857 ( -0.066 0.772 0.266) 0.819 15.751 ( -1.613 -3.127 -1.618) 3.873 16.635 ( 5.385 3.459 0.550) 6.424 17.676 ( 7.567 4.694 3.461) 9.554 19.148 ( -2.600 0.483 -0.387) 2.673 19.841 ( -0.321 0.369 1.105) 1.209 20.919 ( -2.506 2.605 -2.915) 4.644 56.118 ( 2.476 6.872 7.471) 10.448 56.488 ( -8.083 7.344 -3.921) 11.604 ======================= Grid point 364 (160/322) ======================= q-point: ( 0.54 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.032 ( 8.721 6.206 -3.268) 11.191 2.222 ( 1.378 3.449 8.117) 8.926 2.464 ( 4.179 -1.479 0.468) 4.458 3.046 ( -3.861 11.194 -11.181) 16.286 3.410 ( -0.622 1.191 1.904) 2.330 3.657 ( -4.743 -5.394 -7.676) 10.513 3.906 ( 12.666 -1.345 5.841) 14.012 4.271 ( -2.370 -4.222 5.462) 7.299 4.384 ( -2.839 -0.242 -5.489) 6.184 4.996 ( -2.958 -1.695 6.820) 7.625 5.188 ( 2.161 -1.054 -7.796) 8.158 5.595 ( 0.088 -1.303 -2.466) 2.791 5.920 ( -1.307 0.338 1.558) 2.061 6.392 ( 0.460 2.390 2.467) 3.465 6.840 ( -1.603 -2.053 -1.545) 3.028 8.624 ( 0.490 -0.959 0.300) 1.118 11.067 ( -2.916 -4.258 -0.705) 5.209 11.914 ( 3.328 -3.356 -7.904) 9.210 13.182 ( -1.021 1.141 5.060) 5.287 14.468 ( 0.226 -0.696 1.297) 1.489 14.548 ( 0.093 0.350 1.966) 1.999 14.846 ( -0.567 -0.110 0.079) 0.583 15.797 ( -0.640 -2.502 -1.171) 2.836 16.597 ( 1.909 3.138 0.661) 3.732 17.618 ( 1.433 5.357 4.370) 7.060 19.144 ( -0.702 -1.488 0.065) 1.646 19.837 ( -0.202 -0.006 0.852) 0.876 20.876 ( -0.095 0.249 -3.959) 3.968 55.985 ( -0.917 8.837 8.598) 12.363 56.405 ( -1.501 -3.166 -5.160) 6.237 ======================= Grid point 365 (161/322) ======================= q-point: (-0.38 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.066 ( 7.851 -3.081 -2.647) 8.840 2.152 ( -9.150 1.859 3.734) 10.056 2.412 ( -0.323 9.209 7.674) 11.992 2.822 ( -0.788 7.259 -8.803) 11.437 3.466 ( 3.722 -5.496 -3.315) 7.420 3.678 ( -4.487 -0.863 -5.289) 6.989 4.005 ( 10.604 0.706 3.548) 11.204 4.347 ( -1.696 -4.341 5.703) 7.365 4.369 ( -2.699 -0.978 -4.502) 5.339 4.931 ( -1.875 4.362 3.445) 5.866 5.238 ( 1.969 -0.742 -6.087) 6.440 5.640 ( 0.181 -3.612 -2.605) 4.457 5.896 ( -2.891 0.692 1.131) 3.180 6.346 ( 0.878 3.208 3.998) 5.200 6.883 ( 0.960 -2.883 -1.619) 3.443 8.643 ( 0.325 -0.700 -0.355) 0.849 11.054 ( -1.983 3.615 -0.099) 4.125 11.951 ( 4.963 1.142 -9.244) 10.554 13.162 ( -0.668 1.208 5.687) 5.852 14.475 ( 0.130 0.332 0.986) 1.049 14.542 ( -0.517 0.349 1.838) 1.941 14.860 ( -0.852 -1.757 -0.064) 1.954 15.823 ( 0.162 -0.424 -1.410) 1.481 16.549 ( -1.581 2.119 0.545) 2.699 17.520 ( -3.770 4.084 4.847) 7.375 19.189 ( 0.673 -2.951 -0.297) 3.041 19.841 ( -0.111 -0.345 0.788) 0.867 20.897 ( 1.978 -2.297 -3.741) 4.815 55.838 ( -1.772 6.023 9.899) 11.722 56.529 ( 2.219 -9.345 -4.166) 10.470 ======================= Grid point 366 (162/322) ======================= q-point: (-0.31 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.180 ( 4.468 -1.992 0.057) 4.893 2.033 ( -18.625 0.784 -0.162) 18.643 2.209 ( 1.990 10.806 10.270) 15.041 2.728 ( 1.618 2.510 -1.911) 3.545 3.550 ( -0.706 3.697 -3.920) 5.434 3.639 ( -4.290 -3.464 -9.763) 11.212 4.074 ( 11.722 -0.687 2.613) 12.029 4.339 ( -0.995 2.675 1.280) 3.128 4.446 ( -1.451 -5.932 2.815) 6.725 4.868 ( 2.153 2.024 0.156) 2.959 5.194 ( -1.138 4.207 -4.846) 6.517 5.713 ( -0.464 -3.867 -1.284) 4.100 5.860 ( -3.935 0.452 0.071) 3.961 6.298 ( 1.794 3.556 4.481) 5.995 6.953 ( 2.525 -3.180 -1.600) 4.364 8.654 ( -0.109 -0.508 -0.666) 0.844 10.905 ( -0.946 10.561 0.649) 10.623 11.912 ( 6.071 5.404 -10.843) 13.552 13.148 ( -0.177 0.784 6.431) 6.481 14.463 ( 0.164 1.123 0.868) 1.428 14.536 ( -0.800 -0.057 1.346) 1.567 14.886 ( -2.849 -1.972 -1.047) 3.620 15.811 ( 1.481 1.895 -1.287) 2.728 16.494 ( -4.298 1.488 0.349) 4.562 17.448 ( -5.778 0.068 4.336) 7.224 19.254 ( 0.829 -3.122 -1.279) 3.474 19.850 ( -0.190 -0.521 0.784) 0.960 20.977 ( 3.144 -4.462 -2.318) 5.930 55.786 ( 0.360 0.345 13.642) 13.651 56.758 ( 2.996 -12.649 -3.098) 13.363 ======================= Grid point 367 (163/322) ======================= q-point: (-0.23 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.144 ( -2.886 6.621 1.709) 7.422 1.840 ( -11.400 7.668 8.355) 16.080 2.133 ( 0.120 0.334 4.037) 4.052 2.732 ( 1.545 -1.630 1.728) 2.833 3.359 ( -3.986 11.554 0.266) 12.226 3.615 ( -7.039 0.593 -15.837) 17.341 4.223 ( 6.532 1.694 5.750) 8.866 4.260 ( 5.527 -0.211 -1.388) 5.703 4.547 ( 1.481 -3.867 1.942) 4.573 4.877 ( -0.901 -0.962 1.324) 1.868 5.086 ( 0.429 3.803 -6.284) 7.358 5.762 ( -1.400 -1.879 -0.277) 2.359 5.825 ( -4.235 -0.087 -0.595) 4.278 6.245 ( 2.380 4.440 3.584) 6.182 7.030 ( 2.778 -2.934 -1.584) 4.340 8.664 ( -0.473 -0.957 -0.161) 1.079 10.650 ( -0.165 15.242 1.034) 15.278 11.795 ( 5.883 9.340 -12.787) 16.892 13.154 ( 0.382 -0.116 7.065) 7.076 14.440 ( 0.045 1.353 0.660) 1.506 14.540 ( -0.770 -0.751 1.262) 1.658 14.874 ( -6.152 -0.309 -3.113) 6.902 15.781 ( 3.649 2.710 0.273) 4.553 16.433 ( -5.108 1.101 0.072) 5.225 17.453 ( -5.484 -4.037 2.628) 7.300 19.311 ( 0.439 -2.559 -2.540) 3.632 19.859 ( -0.425 -0.510 0.949) 1.158 21.097 ( 3.120 -5.685 -0.286) 6.491 55.890 ( 4.057 -7.026 19.233) 20.875 57.033 ( 2.434 -13.964 -1.987) 14.313 ======================= Grid point 368 (164/322) ======================= q-point: (-0.15 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.935 ( -5.398 10.721 3.441) 12.486 1.614 ( -6.218 11.488 13.681) 18.915 2.142 ( 3.514 1.832 3.595) 5.351 2.805 ( -0.893 -4.181 4.343) 6.094 3.103 ( -3.521 10.722 1.172) 11.346 3.494 ( -6.583 3.540 -14.943) 16.709 4.068 ( -1.024 10.243 4.585) 11.269 4.408 ( 9.997 -1.205 -4.559) 11.054 4.626 ( 0.913 -3.495 1.347) 3.855 4.826 ( -7.235 2.455 1.761) 7.840 5.115 ( 4.807 -4.872 -5.782) 8.960 5.763 ( -1.896 0.111 -0.621) 1.998 5.804 ( -3.127 -0.409 0.240) 3.163 6.165 ( 2.978 6.497 1.149) 7.239 7.096 ( 1.795 -2.308 -1.541) 3.305 8.691 ( -0.503 -2.360 1.268) 2.726 10.341 ( 0.248 16.546 0.777) 16.566 11.592 ( 3.621 13.128 -13.963) 19.504 13.180 ( 0.816 -0.858 7.447) 7.541 14.416 ( -0.202 1.140 0.354) 1.210 14.557 ( -0.640 -1.298 1.627) 2.178 14.802 ( -7.357 1.684 -4.697) 8.890 15.769 ( 5.019 2.006 2.302) 5.875 16.385 ( -3.563 0.396 -0.452) 3.614 17.518 ( -4.418 -5.783 0.500) 7.294 19.350 ( 0.030 -1.907 -3.829) 4.278 19.867 ( -0.574 -0.541 1.609) 1.792 21.228 ( 1.999 -5.633 1.633) 6.196 56.188 ( 8.257 -15.649 23.907) 29.743 57.308 ( 0.980 -13.197 -0.972) 13.269 ======================= Grid point 369 (165/322) ======================= q-point: (-0.08 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.731 ( 4.722 9.371 6.144) 12.160 1.331 ( -2.388 17.244 14.126) 22.419 2.125 ( 4.076 3.628 12.693) 13.816 2.813 ( -7.146 1.386 5.487) 9.115 2.974 ( 2.845 3.358 -2.232) 4.935 3.375 ( -3.093 1.139 -9.636) 10.185 3.866 ( -2.244 9.580 2.433) 10.136 4.396 ( 7.781 7.383 -6.604) 12.596 4.687 ( -8.968 -4.492 3.665) 10.678 4.752 ( -2.057 1.022 -2.775) 3.602 5.249 ( 1.819 -6.114 -3.887) 7.470 5.743 ( -0.150 0.714 -0.885) 1.147 5.789 ( -1.648 0.525 0.884) 1.943 6.050 ( 4.804 7.722 -2.184) 9.353 7.138 ( 0.140 -1.598 -1.443) 2.158 8.756 ( -0.228 -4.224 2.730) 5.035 10.043 ( 0.141 14.148 0.145) 14.150 11.304 ( 0.148 15.610 -10.794) 18.979 13.218 ( 0.946 -1.013 7.566) 7.692 14.397 ( -0.265 0.694 0.123) 0.753 14.584 ( -0.458 -1.461 2.045) 2.555 14.709 ( -4.029 2.261 -4.656) 6.559 15.780 ( 3.895 0.893 2.781) 4.868 16.369 ( -0.015 -0.219 -0.925) 0.951 17.598 ( -3.052 -5.063 -1.160) 6.024 19.373 ( -0.395 -1.331 -5.095) 5.281 19.880 ( -0.386 -0.762 2.809) 2.936 21.338 ( 0.144 -4.389 3.032) 5.336 56.670 ( 9.984 -22.465 21.272) 32.510 57.535 ( -1.145 -10.296 -0.276) 10.363 ======================= Grid point 372 (166/322) ======================= q-point: ( 0.15 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.915 ( 4.580 0.000 12.914) 13.702 1.618 ( 39.237 0.000 7.379) 39.924 2.092 ( -1.804 -0.000 20.764) 20.842 2.535 ( -4.694 -0.000 -10.375) 11.388 3.144 ( 10.566 0.000 5.459) 11.893 3.441 ( -9.629 -0.000 8.700) 12.977 3.743 ( 16.661 0.000 -10.807) 19.860 4.222 ( 0.968 0.000 -7.298) 7.362 4.400 ( -14.800 -0.000 13.959) 20.344 4.689 ( 0.103 0.000 -2.157) 2.159 5.253 ( -6.551 -0.000 -0.969) 6.622 5.740 ( 2.660 0.000 -2.147) 3.418 5.815 ( 2.664 0.000 -5.864) 6.441 6.099 ( 8.009 0.000 -3.040) 8.566 7.069 ( -6.355 -0.000 -2.146) 6.708 8.877 ( -2.324 -0.000 0.772) 2.449 9.652 ( -4.929 -0.000 0.209) 4.934 10.912 ( 1.132 0.000 3.198) 3.393 13.298 ( -0.478 -0.000 6.227) 6.246 14.405 ( 1.283 0.000 0.126) 1.289 14.647 ( 0.122 0.000 3.053) 3.056 14.745 ( 8.215 0.000 -4.552) 9.392 15.720 ( -4.964 -0.000 -3.830) 6.270 16.591 ( 12.194 0.000 -1.159) 12.249 17.759 ( 9.086 0.000 -1.620) 9.229 19.315 ( -2.542 -0.000 -5.770) 6.305 19.928 ( -0.185 -0.000 4.117) 4.121 21.343 ( -6.962 -0.000 4.021) 8.040 57.148 ( -17.934 -0.000 2.437) 18.099 57.628 ( -7.591 -0.000 1.969) 7.842 ======================= Grid point 373 (167/322) ======================= q-point: ( 0.23 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.117 ( 7.866 -11.763 11.029) 17.941 1.874 ( 19.598 -1.261 15.083) 24.763 2.156 ( 14.990 -1.636 0.848) 15.103 2.597 ( -1.295 -8.035 -3.834) 8.997 3.187 ( 4.423 1.736 5.389) 7.185 3.409 ( -8.197 -2.726 7.529) 11.459 3.818 ( 17.169 2.815 -8.697) 19.451 4.281 ( -1.085 -6.133 -11.099) 12.727 4.312 ( -11.886 1.517 16.558) 20.439 4.693 ( -0.018 -0.200 -1.531) 1.544 5.190 ( -6.187 0.813 -1.553) 6.430 5.766 ( 1.752 -0.600 -0.848) 2.037 5.830 ( 1.315 -1.061 -4.348) 4.665 6.176 ( 6.971 -2.934 -3.504) 8.335 7.002 ( -7.911 1.112 -2.318) 8.319 8.805 ( -2.710 4.797 1.060) 5.610 9.727 ( -4.657 -10.854 0.007) 11.810 10.999 ( 0.562 -7.213 1.692) 7.430 13.296 ( -0.963 0.635 5.297) 5.421 14.414 ( 1.406 0.130 0.207) 1.427 14.638 ( 0.227 1.329 2.391) 2.745 14.804 ( 7.088 -0.661 -2.054) 7.409 15.679 ( -4.548 -0.152 -4.408) 6.336 16.672 ( 12.456 0.792 -1.264) 12.545 17.814 ( 12.080 1.995 -1.383) 12.321 19.282 ( -3.059 0.374 -5.090) 5.950 19.922 ( -0.257 1.077 3.903) 4.057 21.276 ( -7.767 1.980 3.659) 8.811 56.931 ( -16.503 8.536 3.517) 18.910 57.502 ( -9.405 6.799 2.351) 11.841 ======================= Grid point 374 (168/322) ======================= q-point: ( 0.31 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.413 ( 13.857 -7.373 10.180) 18.708 2.041 ( 10.700 -3.900 10.363) 15.397 2.331 ( 11.935 -2.976 -7.283) 14.294 2.745 ( 4.756 -6.791 4.211) 9.299 3.211 ( -0.266 -3.249 0.375) 3.281 3.457 ( -4.590 -5.599 4.505) 8.527 3.871 ( 17.026 3.529 -5.200) 18.149 4.232 ( -9.864 0.943 17.644) 20.236 4.364 ( -3.289 -5.953 -13.162) 14.815 4.656 ( -2.142 3.600 -1.494) 4.448 5.158 ( -3.233 -1.730 -1.798) 4.084 5.765 ( -0.843 1.299 0.941) 1.812 5.860 ( 0.896 -1.603 -2.000) 2.716 6.290 ( 5.681 -4.198 -3.621) 7.938 6.910 ( -9.201 1.409 -2.069) 9.536 8.694 ( -2.165 4.477 1.547) 5.208 9.970 ( -4.265 -17.064 -0.435) 17.595 11.179 ( -0.252 -10.893 -0.734) 10.921 13.279 ( -1.361 1.101 4.360) 4.698 14.421 ( 1.376 0.214 0.382) 1.444 14.613 ( 0.357 1.753 1.841) 2.567 14.857 ( 4.791 -0.422 0.318) 4.820 15.651 ( -3.311 -0.763 -4.107) 5.331 16.734 ( 11.603 1.705 -1.027) 11.773 17.854 ( 14.202 3.668 -0.544) 14.678 19.239 ( -3.707 0.778 -3.970) 5.487 19.900 ( -0.274 1.535 3.370) 3.714 21.172 ( -7.659 3.359 2.534) 8.739 56.644 ( -11.008 10.625 3.839) 15.774 57.255 ( -10.476 11.292 2.152) 15.552 ======================= Grid point 375 (169/322) ======================= q-point: ( 0.38 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.597 ( 16.711 2.494 8.038) 18.710 2.184 ( 8.717 -1.562 1.156) 8.931 2.377 ( 9.142 2.733 1.919) 9.733 2.986 ( -2.388 -15.545 1.577) 15.807 3.296 ( 2.638 -4.056 -4.421) 6.554 3.536 ( -3.527 -4.061 1.194) 5.509 3.897 ( 16.768 6.007 0.058) 17.812 4.193 ( -9.339 -0.852 10.182) 13.842 4.447 ( -3.250 -8.493 -8.966) 12.770 4.539 ( -1.484 5.739 -0.793) 5.980 5.189 ( -1.753 -2.921 -1.790) 3.849 5.708 ( -3.395 3.035 1.555) 4.812 5.894 ( 0.779 -1.350 0.001) 1.559 6.389 ( 4.204 -2.553 -2.643) 5.584 6.820 ( -9.232 0.297 -1.600) 9.374 8.621 ( -0.848 2.144 1.596) 2.804 10.293 ( -4.403 -19.263 -0.559) 19.768 11.397 ( -0.153 -11.991 -2.892) 12.336 13.251 ( -1.504 1.258 3.701) 4.188 14.429 ( 1.284 0.086 0.684) 1.458 14.587 ( 0.392 1.471 1.480) 2.123 14.885 ( 2.073 0.398 1.474) 2.574 15.651 ( -1.700 -1.734 -3.010) 3.867 16.767 ( 9.638 2.897 -0.618) 10.083 17.876 ( 14.657 5.072 0.733) 15.527 19.186 ( -4.290 1.082 -2.601) 5.133 19.874 ( -0.294 1.377 2.590) 2.948 21.052 ( -6.551 3.764 0.751) 7.593 56.403 ( -4.870 8.538 2.508) 10.144 56.940 ( -10.816 13.393 1.761) 17.305 ======================= Grid point 376 (170/322) ======================= q-point: ( 0.46 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.546 ( 13.042 14.274 3.302) 19.615 2.279 ( 6.750 -3.418 -0.767) 7.605 2.411 ( 12.019 3.120 6.236) 13.895 3.231 ( -8.946 -11.838 -2.727) 15.086 3.360 ( 2.214 -2.049 -7.580) 8.158 3.537 ( -3.675 1.468 1.197) 4.134 3.915 ( 14.343 3.668 3.642) 15.246 4.148 ( -7.152 -0.910 4.976) 8.760 4.443 ( 0.411 3.662 -2.777) 4.615 4.636 ( 0.670 -12.349 -3.185) 12.771 5.213 ( -2.780 -0.994 -1.273) 3.215 5.621 ( -4.342 2.658 0.101) 5.092 5.918 ( 0.187 -0.587 1.258) 1.401 6.436 ( 2.423 -0.212 -0.805) 2.562 6.769 ( -6.975 -1.515 -1.358) 7.266 8.601 ( 0.407 0.198 1.345) 1.419 10.619 ( -4.554 -17.520 -0.489) 18.109 11.617 ( 0.617 -11.044 -4.946) 12.116 13.224 ( -1.300 1.100 3.584) 3.968 14.441 ( 1.158 -0.330 1.054) 1.600 14.568 ( 0.224 0.908 1.318) 1.616 14.878 ( 0.086 1.180 1.464) 1.882 15.682 ( -0.464 -2.665 -1.551) 3.118 16.758 ( 6.867 4.280 -0.152) 8.093 17.866 ( 12.203 6.686 2.119) 14.075 19.133 ( -4.003 0.646 -1.269) 4.248 19.853 ( -0.315 0.919 1.787) 2.034 20.945 ( -4.511 2.974 -1.327) 5.564 56.260 ( 0.578 5.186 1.580) 5.452 56.608 ( -10.766 12.672 0.930) 16.654 ======================= Grid point 377 (171/322) ======================= q-point: ( 0.54 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.333 ( 11.744 15.353 -0.187) 19.331 2.308 ( -0.776 4.178 2.119) 4.748 2.503 ( 14.268 -1.825 3.829) 14.885 3.192 ( -4.794 7.052 -8.483) 12.028 3.447 ( -3.404 3.368 3.575) 5.976 3.467 ( -4.285 -8.360 -7.978) 12.325 3.989 ( 11.314 -0.912 5.135) 12.458 4.178 ( -2.462 -3.883 7.204) 8.546 4.381 ( 0.038 2.375 -5.585) 6.069 4.871 ( 1.248 -10.147 0.097) 10.224 5.182 ( -2.677 0.934 -2.944) 4.087 5.564 ( -3.652 -0.133 -2.622) 4.498 5.921 ( -0.872 0.281 1.695) 1.927 6.436 ( 0.763 1.306 1.748) 2.312 6.773 ( -3.216 -2.831 -1.616) 4.579 8.615 ( 1.012 -0.622 0.878) 1.478 10.878 ( -4.032 -12.352 -0.331) 12.998 11.803 ( 1.483 -8.341 -6.958) 10.963 13.203 ( -0.851 0.894 4.047) 4.231 14.461 ( 0.870 -0.661 1.278) 1.682 14.558 ( -0.154 0.482 1.419) 1.507 14.854 ( -0.413 1.132 1.073) 1.614 15.736 ( 0.008 -3.067 -0.605) 3.126 16.704 ( 3.860 5.232 0.219) 6.506 17.792 ( 6.570 8.651 3.434) 11.393 19.110 ( -2.280 -0.934 -0.345) 2.488 19.841 ( -0.282 0.404 1.188) 1.286 20.876 ( -1.971 1.155 -3.105) 3.855 56.181 ( 3.054 8.130 6.160) 10.647 56.351 ( -8.714 3.152 -4.206) 10.176 ======================= Grid point 378 (172/322) ======================= q-point: (-0.38 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.192 ( 13.545 7.711 -1.345) 15.643 2.160 ( -10.247 6.455 0.540) 12.123 2.598 ( 9.908 4.453 7.435) 13.163 2.974 ( -0.383 9.599 -9.587) 13.572 3.399 ( -1.468 -1.491 0.574) 2.170 3.574 ( -3.697 -5.887 -6.102) 9.250 4.103 ( 11.467 -0.591 5.303) 12.648 4.240 ( -4.368 -3.611 3.905) 6.882 4.344 ( -0.323 0.020 -3.437) 3.452 4.969 ( -2.747 0.225 5.547) 6.194 5.194 ( 2.092 -3.627 -8.899) 9.835 5.562 ( -3.202 -2.747 -3.731) 5.632 5.900 ( -1.792 1.136 1.647) 2.686 6.410 ( 0.340 2.134 3.779) 4.353 6.821 ( -0.154 -3.573 -1.806) 4.006 8.635 ( 0.865 -0.564 0.262) 1.065 11.023 ( -2.674 -5.094 -0.019) 5.753 11.928 ( 2.229 -4.497 -8.763) 10.099 13.189 ( -0.391 0.947 4.892) 4.998 14.478 ( 0.495 -0.351 1.310) 1.444 14.549 ( -0.670 0.448 1.465) 1.672 14.841 ( -0.110 0.075 0.756) 0.768 15.791 ( 0.140 -2.504 -0.528) 2.563 16.620 ( 0.976 5.178 0.309) 5.278 17.648 ( 0.632 9.219 4.573) 10.311 19.136 ( -0.465 -2.634 -0.061) 2.676 19.837 ( -0.199 -0.055 0.860) 0.884 20.865 ( 0.336 -1.190 -3.971) 4.159 55.994 ( -1.864 9.894 8.364) 13.089 56.373 ( -0.330 -6.746 -5.258) 8.559 ======================= Grid point 379 (173/322) ======================= q-point: (-0.31 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.229 ( 14.117 0.170 0.482) 14.126 1.940 ( -17.873 4.887 -1.425) 18.584 2.467 ( 1.341 12.473 6.450) 14.106 2.848 ( 7.426 6.035 -1.483) 9.683 3.476 ( -0.108 -5.989 -6.232) 8.644 3.601 ( -3.895 -0.354 -4.482) 5.948 4.174 ( 10.891 1.959 1.137) 11.124 4.283 ( -5.296 -4.947 -0.887) 7.301 4.363 ( -1.203 -1.920 4.612) 5.139 4.927 ( -0.096 2.389 3.551) 4.281 5.231 ( 0.603 0.569 -8.582) 8.622 5.612 ( -2.601 -4.991 -2.228) 6.053 5.861 ( -2.099 1.616 1.224) 2.918 6.375 ( 0.899 2.574 4.479) 5.243 6.895 ( 1.378 -3.892 -1.779) 4.495 8.647 ( 0.221 -0.220 -0.259) 0.406 11.031 ( -0.983 2.872 0.500) 3.077 11.976 ( 2.789 -0.182 -10.368) 10.738 13.177 ( -0.050 1.018 5.892) 5.980 14.483 ( 0.263 0.458 1.376) 1.474 14.536 ( -0.920 0.446 1.120) 1.517 14.847 ( -0.771 -0.620 0.064) 0.992 15.826 ( 0.759 -0.923 -0.718) 1.394 16.527 ( -1.471 4.219 0.111) 4.470 17.491 ( -2.404 6.501 5.177) 8.651 19.194 ( 0.087 -3.314 -0.424) 3.342 19.842 ( -0.167 -0.358 0.716) 0.818 20.912 ( 1.740 -3.502 -3.613) 5.324 55.854 ( -0.764 4.768 10.520) 11.575 56.540 ( 1.201 -10.698 -4.369) 11.618 ======================= Grid point 380 (174/322) ======================= q-point: (-0.23 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.290 ( 8.276 5.464 2.294) 10.179 1.771 ( -15.976 -2.166 0.446) 16.128 2.254 ( 0.909 9.889 4.343) 10.839 2.809 ( 8.844 4.516 4.010) 10.710 3.511 ( -2.809 6.203 -2.395) 7.219 3.537 ( -4.055 -2.154 -12.975) 13.763 4.236 ( 7.401 -2.168 -0.819) 7.756 4.309 ( -2.149 0.496 1.832) 2.867 4.431 ( -2.636 -6.171 4.511) 8.086 4.899 ( 1.039 1.835 3.157) 3.796 5.164 ( 0.928 4.337 -9.520) 10.503 5.688 ( -2.470 -4.518 0.248) 5.155 5.817 ( -1.729 1.489 0.561) 2.350 6.338 ( 1.655 3.036 3.810) 5.146 6.978 ( 1.433 -3.729 -1.707) 4.344 8.648 ( -0.541 -0.219 -0.295) 0.654 10.903 ( 0.398 10.204 1.007) 10.261 11.938 ( 2.628 4.389 -11.975) 13.022 13.172 ( 0.209 0.529 6.861) 6.885 14.469 ( -0.029 1.257 1.310) 1.816 14.527 ( -0.808 -0.104 0.774) 1.124 14.840 ( -2.425 0.293 -1.433) 2.832 15.837 ( 2.065 0.689 -0.114) 2.180 16.442 ( -2.551 2.938 -0.211) 3.896 17.403 ( -2.407 1.398 4.630) 5.402 19.254 ( -0.202 -3.057 -1.294) 3.326 19.849 ( -0.271 -0.439 0.725) 0.890 21.007 ( 1.897 -5.273 -2.215) 6.025 55.849 ( 1.692 -2.098 14.329) 14.580 56.774 ( 0.682 -13.314 -3.402) 13.758 ======================= Grid point 381 (175/322) ======================= q-point: (-0.15 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.141 ( 0.466 10.842 1.616) 10.971 1.740 ( -4.592 2.112 8.802) 10.150 2.164 ( 2.178 0.592 1.468) 2.692 2.818 ( 8.601 2.043 5.377) 10.347 3.309 ( -2.768 11.742 -0.371) 12.070 3.479 ( -4.304 1.749 -15.599) 16.276 4.215 ( -4.752 5.264 1.443) 7.237 4.374 ( 5.064 -4.778 2.109) 7.274 4.541 ( -3.296 -5.775 2.422) 7.076 4.850 ( -3.308 3.483 2.355) 5.350 5.106 ( 5.732 1.245 -10.241) 11.801 5.743 ( -1.783 -2.606 1.945) 3.708 5.784 ( -0.763 0.975 0.089) 1.241 6.290 ( 2.493 4.172 1.880) 5.211 7.048 ( 0.269 -3.094 -1.621) 3.503 8.653 ( -1.139 -1.069 0.434) 1.621 10.660 ( 1.075 15.346 1.107) 15.423 11.802 ( 1.022 9.121 -13.282) 16.145 13.185 ( 0.412 -0.397 7.553) 7.575 14.441 ( -0.528 1.508 0.911) 1.839 14.533 ( -0.569 -0.876 0.735) 1.277 14.796 ( -2.502 1.844 -2.860) 4.224 15.834 ( 2.350 1.397 1.110) 2.951 16.385 ( -0.937 1.446 -0.515) 1.798 17.415 ( -0.996 -2.926 2.935) 4.262 19.301 ( -0.618 -2.431 -2.459) 3.512 19.856 ( -0.427 -0.453 1.089) 1.254 21.126 ( 0.855 -6.054 -0.357) 6.124 56.014 ( 4.033 -10.229 18.614) 21.619 57.038 ( -0.859 -14.298 -2.367) 14.518 ======================= Grid point 382 (176/322) ======================= q-point: (-0.08 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.973 ( 7.975 8.677 2.909) 12.139 1.616 ( 0.841 10.525 13.972) 17.513 2.216 ( 5.143 -0.891 0.282) 5.227 2.837 ( 1.991 3.691 7.750) 8.812 3.085 ( 1.594 7.682 0.447) 7.858 3.385 ( -1.581 2.668 -14.257) 14.590 4.038 ( -4.914 9.331 2.920) 10.943 4.481 ( -0.155 -3.537 0.490) 3.575 4.570 ( -6.677 0.267 3.656) 7.617 4.763 ( -2.141 1.937 -3.611) 4.623 5.158 ( 3.881 -3.382 -6.820) 8.545 5.769 ( 2.209 0.904 -0.951) 2.569 5.774 ( -1.337 -1.335 3.003) 3.548 6.216 ( 4.040 6.053 -1.200) 7.375 7.092 ( -1.583 -2.284 -1.509) 3.163 8.682 ( -1.517 -2.892 1.688) 3.676 10.353 ( 0.865 17.009 0.627) 17.043 11.561 ( -1.543 13.325 -12.503) 18.338 13.216 ( 0.472 -1.056 7.778) 7.864 14.412 ( -0.639 1.101 0.437) 1.346 14.554 ( -0.217 -1.467 0.933) 1.752 14.738 ( 0.368 2.480 -3.380) 4.208 15.820 ( 0.238 1.283 1.385) 1.903 16.378 ( 3.232 0.041 -0.596) 3.287 17.494 ( 0.868 -4.638 0.968) 4.817 19.331 ( -0.988 -1.775 -3.755) 4.269 19.866 ( -0.431 -0.695 2.024) 2.183 21.241 ( -1.033 -5.649 1.398) 5.910 56.355 ( 4.242 -18.223 20.329) 27.629 57.289 ( -3.002 -13.298 -1.424) 13.707 ======================= Grid point 386 (177/322) ======================= q-point: ( 0.23 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.037 ( 6.843 0.000 10.198) 12.281 1.964 ( 3.823 0.000 21.048) 21.393 2.404 ( 38.278 0.000 -0.509) 38.282 2.432 ( -5.164 -0.000 -7.769) 9.329 3.243 ( -0.827 -0.000 3.584) 3.678 3.313 ( -11.872 -0.000 9.255) 15.053 3.978 ( 18.549 0.000 -6.440) 19.635 4.188 ( -1.098 -0.000 -11.562) 11.614 4.292 ( -5.230 -0.000 16.022) 16.854 4.691 ( 0.732 0.000 -0.559) 0.921 5.138 ( -8.809 -0.000 -2.192) 9.078 5.777 ( 3.195 0.000 -1.882) 3.708 5.817 ( 0.119 0.000 -3.462) 3.464 6.187 ( 5.154 0.000 -2.589) 5.767 6.947 ( -9.199 -0.000 -3.048) 9.691 8.840 ( -2.739 -0.000 0.003) 2.739 9.577 ( -5.455 -0.000 0.895) 5.528 10.943 ( 1.536 0.000 3.394) 3.725 13.301 ( -1.488 -0.000 4.093) 4.355 14.427 ( 1.602 0.000 0.240) 1.620 14.656 ( -0.162 -0.000 2.351) 2.357 14.845 ( 6.241 0.000 -0.004) 6.241 15.641 ( -3.322 -0.000 -5.125) 6.108 16.769 ( 12.466 0.000 -1.911) 12.611 17.928 ( 14.659 0.000 -1.679) 14.755 19.253 ( -3.587 -0.000 -4.925) 6.093 19.938 ( -0.293 -0.000 4.002) 4.013 21.241 ( -8.695 -0.000 4.044) 9.589 56.879 ( -19.020 -0.000 0.343) 19.023 57.501 ( -10.794 -0.000 3.277) 11.281 ======================= Grid point 387 (178/322) ======================= q-point: ( 0.31 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.283 ( 10.365 -15.184 8.099) 20.090 2.016 ( 2.413 -1.273 13.923) 14.188 2.400 ( 5.045 -0.946 -2.943) 5.916 2.745 ( 26.643 -3.892 -0.408) 26.929 3.158 ( -8.493 1.437 1.420) 8.730 3.315 ( -8.494 -4.912 7.890) 12.590 4.065 ( 16.209 2.486 -0.453) 16.405 4.195 ( -4.352 -2.726 -7.925) 9.444 4.286 ( 2.815 1.880 7.603) 8.323 4.690 ( 0.006 1.115 -0.965) 1.475 5.081 ( -8.043 -1.704 -2.191) 8.508 5.787 ( 1.135 0.987 -1.047) 1.833 5.828 ( 0.186 -1.466 -1.172) 1.886 6.247 ( 4.119 -3.251 -2.985) 6.037 6.859 ( -10.485 1.077 -3.211) 11.018 8.770 ( -2.435 4.423 0.384) 5.064 9.656 ( -5.079 -11.243 0.562) 12.349 11.019 ( 1.129 -5.980 2.446) 6.559 13.289 ( -1.924 0.560 2.983) 3.594 14.437 ( 1.623 0.206 0.351) 1.673 14.646 ( -0.217 1.139 1.902) 2.228 14.888 ( 4.192 -0.111 2.145) 4.710 15.617 ( -1.571 -0.253 -4.628) 4.894 16.843 ( 11.528 1.023 -2.038) 11.751 18.020 ( 16.534 2.041 -1.348) 16.714 19.214 ( -4.213 0.344 -4.272) 6.010 19.931 ( -0.264 1.113 3.835) 4.002 21.166 ( -8.715 1.725 3.636) 9.599 56.694 ( -16.309 4.896 -0.892) 17.051 57.359 ( -11.147 6.688 3.715) 13.520 ======================= Grid point 388 (179/322) ======================= q-point: ( 0.38 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.667 ( 16.324 -10.158 8.034) 20.837 2.143 ( 3.908 -7.782 1.291) 8.804 2.467 ( 5.630 -1.192 4.538) 7.329 2.818 ( -2.932 2.117 3.253) 4.864 3.223 ( 8.320 -5.797 -5.139) 11.368 3.392 ( -5.441 -7.523 5.773) 10.933 4.117 ( 7.223 2.723 3.072) 8.308 4.193 ( 5.757 2.300 1.911) 6.487 4.282 ( -2.324 -2.172 -3.803) 4.958 4.630 ( 0.246 4.353 -2.726) 5.142 5.094 ( -4.699 -4.352 -1.574) 6.595 5.742 ( -2.909 2.911 0.010) 4.116 5.865 ( 0.592 -1.946 0.922) 2.233 6.350 ( 4.168 -4.263 -3.166) 6.750 6.753 ( -11.240 0.864 -2.683) 11.589 8.674 ( -1.201 3.722 1.078) 4.056 9.901 ( -4.823 -17.241 0.020) 17.903 11.182 ( 0.600 -9.817 0.312) 9.840 13.264 ( -2.076 0.872 2.234) 3.172 14.444 ( 1.513 0.321 0.508) 1.628 14.620 ( -0.177 1.546 1.476) 2.144 14.911 ( 1.815 0.454 3.051) 3.579 15.616 ( 0.227 -0.849 -3.088) 3.211 16.886 ( 9.661 2.274 -1.722) 10.073 18.083 ( 17.122 4.137 -0.455) 17.621 19.164 ( -4.896 0.689 -3.304) 5.947 19.907 ( -0.222 1.658 3.369) 3.761 21.066 ( -7.767 2.799 2.407) 8.600 56.483 ( -11.263 5.747 -2.260) 12.845 57.111 ( -10.383 11.318 4.108) 15.899 ======================= Grid point 389 (180/322) ======================= q-point: ( 0.46 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.851 ( 13.407 5.254 6.967) 15.997 2.279 ( 7.664 -2.551 -3.034) 8.628 2.564 ( 12.286 1.167 6.953) 14.165 2.846 ( -15.195 -14.590 -0.542) 21.073 3.336 ( 1.709 -2.745 -3.289) 4.612 3.512 ( 1.765 -3.484 1.402) 4.149 4.057 ( -3.570 3.539 -2.263) 5.512 4.172 ( 6.724 5.062 13.120) 15.587 4.399 ( 0.275 -10.221 -7.433) 12.641 4.551 ( 6.482 4.700 -4.146) 9.016 5.145 ( -3.470 -3.576 -1.065) 5.095 5.641 ( -6.415 3.644 -0.354) 7.386 5.905 ( 0.658 -1.250 2.163) 2.583 6.437 ( 3.320 -1.828 -2.086) 4.326 6.675 ( -9.671 -1.643 -1.920) 9.995 8.622 ( 0.334 1.494 1.316) 2.019 10.224 ( -4.647 -19.319 -0.066) 19.870 11.393 ( 0.428 -11.498 -2.285) 11.731 13.236 ( -1.836 0.834 2.084) 2.900 14.450 ( 1.329 0.167 0.723) 1.522 14.592 ( -0.268 1.338 1.125) 1.769 14.906 ( 0.137 1.216 2.801) 3.057 15.642 ( 1.368 -1.594 -1.223) 2.430 16.887 ( 7.083 3.806 -1.154) 8.123 18.100 ( 15.260 6.649 0.801) 16.665 19.110 ( -4.921 0.587 -2.188) 5.417 19.879 ( -0.233 1.566 2.630) 3.070 20.962 ( -5.881 2.856 0.537) 6.560 56.321 ( -6.357 3.680 -3.916) 8.324 56.804 ( -8.714 13.754 4.747) 16.960 ======================= Grid point 390 (181/322) ======================= q-point: ( 0.54 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.715 ( 8.443 14.974 3.568) 17.557 2.376 ( 5.657 1.070 -1.043) 5.850 2.596 ( 9.564 0.671 3.273) 10.131 3.073 ( -7.374 -13.076 -1.973) 15.141 3.360 ( -0.304 -0.724 -5.788) 5.841 3.504 ( -2.441 4.057 1.399) 4.938 4.004 ( -1.125 -1.564 2.418) 3.091 4.166 ( 1.900 1.205 12.862) 13.057 4.457 ( 3.697 3.265 -7.737) 9.175 4.675 ( 8.022 -10.549 -4.977) 14.156 5.161 ( -3.569 -0.682 -0.558) 3.676 5.531 ( -7.670 1.583 -2.545) 8.235 5.924 ( 0.117 0.016 2.293) 2.296 6.456 ( -0.278 0.374 0.819) 0.942 6.679 ( -3.884 -3.918 -2.082) 5.896 8.619 ( 1.291 -0.007 1.140) 1.722 10.553 ( -4.006 -17.719 0.089) 18.166 11.610 ( 0.455 -11.029 -4.965) 12.103 13.215 ( -1.299 0.544 2.585) 2.944 14.461 ( 1.048 -0.223 0.977) 1.450 14.570 ( -0.565 0.849 0.943) 1.389 14.882 ( -0.228 1.552 2.230) 2.727 15.689 ( 1.557 -2.182 0.020) 2.681 16.839 ( 4.313 5.362 -0.525) 6.901 18.039 ( 9.970 9.761 2.201) 14.126 19.074 ( -3.259 -0.541 -1.150) 3.498 19.855 ( -0.259 1.075 1.826) 2.134 20.881 ( -3.366 1.802 -1.535) 4.115 56.242 ( -3.389 -0.028 -5.436) 6.406 56.487 ( -5.866 14.230 5.906) 16.485 ======================= Grid point 391 (182/322) ======================= q-point: ( 0.62 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.500 ( 10.839 13.544 1.461) 17.409 2.249 ( -7.436 9.107 -1.524) 11.856 2.722 ( 11.813 -1.678 3.545) 12.447 3.109 ( -1.226 4.814 -7.023) 8.603 3.400 ( -3.145 3.056 4.292) 6.136 3.405 ( -2.765 -6.552 -6.123) 9.385 4.103 ( 2.700 -6.111 6.222) 9.129 4.178 ( -2.945 -0.597 8.689) 9.193 4.404 ( 6.101 4.397 -6.630) 10.025 4.906 ( 4.476 -7.328 -1.013) 8.646 5.134 ( -2.383 -0.696 -4.216) 4.893 5.476 ( -6.448 -1.808 -4.611) 8.131 5.915 ( -0.480 1.011 1.910) 2.214 6.440 ( -1.685 0.711 3.454) 3.908 6.742 ( 0.113 -4.114 -2.219) 4.675 8.635 ( 1.330 -0.359 0.694) 1.543 10.828 ( -2.581 -12.863 0.246) 13.122 11.795 ( 0.526 -8.678 -7.313) 11.361 13.204 ( -0.757 0.351 3.528) 3.626 14.476 ( 0.639 -0.467 1.236) 1.467 14.554 ( -0.951 0.468 0.951) 1.424 14.858 ( 0.317 1.165 1.770) 2.142 15.745 ( 1.164 -2.438 0.267) 2.715 16.746 ( 1.835 6.388 -0.069) 6.647 17.879 ( 3.461 12.011 3.579) 13.002 19.084 ( -0.976 -2.097 -0.416) 2.350 19.841 ( -0.238 0.461 1.194) 1.302 20.844 ( -0.910 -0.041 -3.209) 3.335 56.189 ( -9.051 8.372 3.089) 12.711 56.270 ( 4.236 0.073 -1.940) 4.659 ======================= Grid point 392 (183/322) ======================= q-point: (-0.31 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.398 ( 14.381 6.299 1.016) 15.732 1.967 ( -15.266 10.455 -1.931) 18.603 2.705 ( 1.042 9.869 2.477) 10.228 3.024 ( 10.541 4.537 -2.682) 11.785 3.376 ( -1.631 -2.119 0.406) 2.705 3.499 ( -4.320 -5.904 -5.384) 9.083 4.172 ( -5.885 -1.597 1.837) 6.368 4.251 ( 4.599 -4.554 6.324) 9.049 4.360 ( 4.684 3.474 -2.161) 6.219 4.967 ( 0.290 1.239 4.108) 4.301 5.186 ( 1.022 -4.316 -9.741) 10.704 5.488 ( -4.476 -4.380 -4.110) 7.491 5.887 ( -0.541 1.747 1.634) 2.452 6.419 ( -1.134 1.084 4.513) 4.778 6.824 ( 1.458 -4.078 -2.070) 4.800 8.648 ( 0.663 -0.034 0.185) 0.689 10.998 ( -0.639 -5.761 0.394) 5.810 11.919 ( 0.615 -5.103 -9.072) 10.427 13.199 ( -0.467 0.491 4.632) 4.681 14.489 ( 0.161 -0.182 1.540) 1.559 14.540 ( -1.057 0.404 0.944) 1.474 14.848 ( 0.522 0.539 1.134) 1.360 15.797 ( 0.847 -2.195 -0.126) 2.356 16.627 ( -0.049 6.398 0.059) 6.398 17.665 ( -0.413 11.283 4.744) 12.246 19.131 ( -0.088 -3.019 -0.137) 3.024 19.837 ( -0.194 -0.055 0.817) 0.841 20.860 ( 0.732 -2.158 -3.957) 4.566 55.983 ( -3.326 7.863 7.846) 11.596 56.365 ( 1.533 -7.039 -4.836) 8.676 ======================= Grid point 393 (184/322) ======================= q-point: (-0.23 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.457 ( 15.690 1.590 3.773) 16.215 1.656 ( -19.626 6.137 -2.783) 20.751 2.477 ( -0.878 12.085 0.545) 12.129 3.011 ( 12.928 6.473 5.111) 15.335 3.432 ( -2.257 -4.277 -7.573) 8.986 3.532 ( -3.751 -1.131 -4.233) 5.768 4.175 ( -6.669 -3.692 -4.090) 8.651 4.335 ( 6.131 2.058 2.984) 7.123 4.353 ( 0.028 -2.674 5.074) 5.736 4.945 ( 0.312 1.667 3.963) 4.311 5.210 ( 1.441 0.830 -10.683) 10.812 5.562 ( -3.153 -6.037 -0.876) 6.867 5.850 ( 0.079 2.109 1.323) 2.491 6.396 ( -0.081 1.590 4.087) 4.386 6.909 ( 1.149 -3.929 -1.899) 4.512 8.646 ( -0.268 0.304 -0.087) 0.415 11.034 ( 1.104 2.396 0.589) 2.703 11.965 ( 0.431 -0.733 -10.362) 10.397 13.194 ( -0.398 0.577 5.781) 5.823 14.487 ( -0.500 0.563 1.723) 1.880 14.527 ( -0.648 0.359 0.838) 1.119 14.841 ( -0.088 0.687 -0.078) 0.697 15.838 ( 0.912 -1.352 -0.416) 1.683 16.510 ( -0.763 5.227 -0.060) 5.282 17.486 ( -0.704 7.205 5.254) 8.945 19.190 ( -0.426 -3.162 -0.387) 3.214 19.841 ( -0.216 -0.328 0.650) 0.759 20.921 ( 1.124 -4.095 -3.568) 5.546 55.882 ( -0.233 2.594 10.556) 10.872 56.536 ( 0.182 -10.686 -4.484) 11.590 ======================= Grid point 394 (185/322) ======================= q-point: (-0.15 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.321 ( -8.269 9.306 0.896) 12.481 1.676 ( 5.198 -6.352 4.204) 9.221 2.272 ( 0.744 8.509 0.366) 8.549 2.994 ( 13.460 5.917 6.882) 16.234 3.438 ( -3.202 0.599 -10.951) 11.425 3.471 ( -1.708 4.422 -4.458) 6.508 4.178 ( -8.612 -2.165 -3.740) 9.635 4.375 ( 2.653 -2.127 3.526) 4.899 4.404 ( -1.165 -2.861 4.269) 5.270 4.903 ( -2.297 3.278 3.250) 5.156 5.175 ( 5.199 2.539 -10.951) 12.385 5.650 ( -3.047 -5.118 2.227) 6.359 5.818 ( 1.391 1.814 0.746) 2.404 6.369 ( 1.070 2.271 2.538) 3.570 6.981 ( -0.320 -3.431 -1.730) 3.856 8.636 ( -1.094 0.091 0.155) 1.109 10.924 ( 1.969 10.165 0.703) 10.378 11.913 ( -0.618 4.387 -11.263) 12.102 13.194 ( -0.347 0.063 6.825) 6.834 14.465 ( -1.248 1.323 1.446) 2.324 14.522 ( -0.139 -0.091 0.741) 0.760 14.818 ( 0.105 1.480 -1.429) 2.060 15.856 ( 0.229 -0.008 -0.288) 0.368 16.428 ( 0.927 3.041 -0.142) 3.182 17.409 ( 1.149 1.699 4.581) 5.019 19.241 ( -1.051 -2.816 -1.131) 3.212 19.847 ( -0.327 -0.386 0.742) 0.898 21.015 ( 0.254 -5.450 -2.264) 5.907 55.923 ( 2.066 -4.289 13.606) 14.415 56.755 ( -1.819 -13.165 -3.653) 13.782 ======================= Grid point 395 (186/322) ======================= q-point: (-0.08 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.146 ( 0.005 5.063 1.509) 5.283 1.788 ( 6.514 2.129 10.078) 12.187 2.199 ( 2.480 -0.558 -1.474) 2.938 3.004 ( 13.518 5.248 6.974) 16.090 3.283 ( -0.305 10.863 -0.602) 10.884 3.395 ( -0.336 1.625 -14.577) 14.671 4.105 ( -10.525 2.321 -0.521) 10.791 4.414 ( -1.125 -0.476 5.668) 5.798 4.490 ( -3.849 -6.194 2.290) 7.643 4.796 ( -4.327 4.697 -2.235) 6.766 5.169 ( 6.539 1.090 -8.385) 10.689 5.717 ( -2.736 -3.506 3.841) 5.877 5.808 ( 3.318 0.995 -0.143) 3.467 6.330 ( 2.540 3.418 0.127) 4.260 7.026 ( -2.492 -2.630 -1.557) 3.944 8.634 ( -1.688 -1.024 0.944) 2.189 10.685 ( 1.621 15.778 0.481) 15.869 11.748 ( -2.425 9.622 -11.074) 14.870 13.211 ( -0.247 -0.790 7.365) 7.412 14.429 ( -1.261 1.334 0.833) 2.016 14.533 ( 0.244 -0.841 0.802) 1.188 14.788 ( 2.094 1.975 -2.211) 3.629 15.836 ( -2.220 1.204 -0.429) 2.562 16.415 ( 5.117 0.603 0.009) 5.153 17.444 ( 3.658 -2.465 2.905) 5.281 19.278 ( -1.555 -2.251 -2.239) 3.535 19.854 ( -0.419 -0.508 1.290) 1.448 21.119 ( -1.567 -5.881 -0.535) 6.109 56.120 ( 2.562 -11.681 15.953) 19.937 56.992 ( -4.288 -14.077 -2.634) 14.949 ======================= Grid point 400 (187/322) ======================= q-point: ( 0.31 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.173 ( 7.640 0.000 6.687) 10.153 2.083 ( 5.750 0.000 16.911) 17.862 2.342 ( -4.244 -0.000 -4.061) 5.874 2.967 ( 35.193 0.000 -0.533) 35.197 3.136 ( -11.716 -0.000 0.109) 11.716 3.167 ( -12.186 -0.000 9.763) 15.615 4.121 ( -1.950 -0.000 -14.953) 15.080 4.170 ( 4.664 0.000 13.125) 13.929 4.411 ( 17.945 0.000 0.146) 17.945 4.703 ( 0.886 0.000 0.177) 0.904 4.982 ( -11.347 -0.000 -2.792) 11.686 5.808 ( -0.309 -0.000 0.804) 0.862 5.817 ( 3.059 0.000 -1.705) 3.502 6.227 ( 1.495 0.000 -2.844) 3.213 6.784 ( -11.475 -0.000 -4.123) 12.193 8.801 ( -2.474 -0.000 -0.680) 2.566 9.505 ( -4.807 -0.000 1.538) 5.048 10.977 ( 1.430 0.000 3.582) 3.857 13.282 ( -2.424 -0.000 1.756) 2.994 14.452 ( 1.690 0.000 0.453) 1.749 14.656 ( -0.672 -0.000 1.602) 1.737 14.918 ( 2.846 0.000 3.771) 4.724 15.603 ( 0.358 0.000 -4.054) 4.070 16.930 ( 10.514 0.000 -2.633) 10.839 18.164 ( 18.054 0.000 -1.516) 18.118 19.178 ( -4.703 -0.000 -4.074) 6.222 19.947 ( -0.251 -0.000 3.968) 3.976 21.125 ( -8.832 -0.000 4.039) 9.712 56.610 ( -17.124 -0.000 -3.474) 17.472 57.349 ( -11.260 -0.000 4.156) 12.003 ======================= Grid point 401 (188/322) ======================= q-point: ( 0.38 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.450 ( 8.928 -19.108 3.258) 21.341 2.117 ( 6.513 1.210 9.514) 11.593 2.407 ( -0.622 -6.525 3.359) 7.365 2.895 ( -14.221 7.478 5.020) 16.833 3.180 ( -9.278 -5.248 5.408) 11.953 3.282 ( 26.874 -4.073 -2.637) 27.308 4.103 ( -3.143 -1.894 -14.889) 15.335 4.201 ( 1.061 0.584 12.827) 12.884 4.469 ( 14.435 7.446 1.963) 16.360 4.703 ( 5.212 1.668 -3.208) 6.343 4.950 ( -8.506 -5.086 -1.656) 10.048 5.782 ( -1.457 2.889 0.154) 3.240 5.844 ( 1.939 -1.156 1.682) 2.815 6.277 ( 1.624 -4.634 -3.556) 6.062 6.681 ( -12.164 0.959 -4.179) 12.897 8.740 ( -1.705 3.698 -0.152) 4.075 9.590 ( -4.262 -11.073 1.109) 11.916 11.044 ( 1.035 -5.285 2.788) 6.065 13.261 ( -2.644 0.386 0.932) 2.830 14.463 ( 1.600 0.278 0.583) 1.726 14.643 ( -0.853 0.934 1.233) 1.766 14.937 ( 1.263 0.367 4.239) 4.438 15.609 ( 2.039 -0.300 -2.401) 3.164 16.984 ( 8.654 1.250 -2.655) 9.138 18.273 ( 18.416 2.267 -1.108) 18.588 19.132 ( -5.224 0.374 -3.563) 6.334 19.940 ( -0.207 1.144 3.828) 4.001 21.055 ( -7.996 1.473 3.587) 8.886 56.458 ( -14.753 2.450 -5.006) 15.771 57.216 ( -9.911 6.256 4.507) 12.557 ======================= Grid point 402 (189/322) ======================= q-point: ( 0.46 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.899 ( 11.364 -14.559 0.713) 18.483 2.220 ( 6.674 -6.007 3.779) 9.742 2.521 ( -3.844 -5.312 9.399) 11.460 2.691 ( -7.427 3.330 1.296) 8.242 3.228 ( -9.663 -5.808 4.538) 12.153 3.514 ( 18.928 -2.166 -2.652) 19.235 4.063 ( -5.017 1.422 -8.998) 10.400 4.237 ( -1.346 -3.640 2.222) 4.472 4.376 ( 3.263 7.577 8.182) 11.619 4.712 ( 15.012 4.466 -5.493) 16.598 5.020 ( -4.187 -6.205 -1.277) 7.594 5.674 ( -6.416 4.980 -0.395) 8.131 5.893 ( 2.288 -1.509 3.617) 4.538 6.394 ( 3.530 -5.232 -3.401) 7.169 6.571 ( -12.269 0.006 -3.268) 12.696 8.667 ( -0.178 2.768 0.682) 2.856 9.838 ( -3.794 -17.000 0.503) 17.425 11.193 ( 0.507 -9.072 0.661) 9.110 13.235 ( -2.467 0.464 0.715) 2.610 14.467 ( 1.378 0.422 0.693) 1.600 14.616 ( -0.948 1.315 0.880) 1.845 14.935 ( 0.210 1.038 3.710) 3.858 15.635 ( 2.960 -0.714 -0.467) 3.081 16.996 ( 6.177 2.723 -2.210) 7.103 18.332 ( 16.573 5.116 -0.212) 17.347 19.079 ( -5.161 0.487 -2.881) 5.930 19.915 ( -0.189 1.771 3.349) 3.793 20.970 ( -6.274 2.275 2.296) 7.058 56.304 ( -11.399 2.387 -6.090) 13.142 56.995 ( -7.168 10.738 5.067) 13.869 ======================= Grid point 403 (190/322) ======================= q-point: ( 0.54 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.004 ( 4.732 8.483 6.025) 11.431 2.421 ( 11.948 -5.003 -0.314) 12.958 2.548 ( -17.454 -5.814 -4.039) 18.835 2.810 ( 12.296 -10.786 6.837) 17.728 3.272 ( -8.437 -5.108 2.644) 10.211 3.591 ( 6.497 3.905 -2.585) 8.009 3.977 ( -4.592 1.058 -2.207) 5.204 4.244 ( -2.542 3.584 14.689) 15.332 4.382 ( 1.075 -6.642 -9.511) 11.651 4.737 ( 17.856 3.888 -4.688) 18.866 5.098 ( -1.397 -3.747 -0.850) 4.088 5.516 ( -10.327 4.374 -1.830) 11.363 5.933 ( 1.962 -0.257 3.632) 4.136 6.448 ( -3.580 0.175 -0.614) 3.636 6.558 ( -2.532 -5.812 -3.148) 7.078 8.637 ( 1.116 0.889 0.973) 1.727 10.167 ( -3.000 -19.198 0.385) 19.435 11.390 ( 0.082 -10.959 -2.170) 11.172 13.213 ( -1.974 0.224 1.161) 2.301 14.470 ( 1.058 0.266 0.820) 1.364 14.585 ( -1.109 1.184 0.603) 1.730 14.916 ( 0.108 1.539 2.975) 3.352 15.675 ( 2.961 -1.111 0.791) 3.260 16.961 ( 3.538 4.354 -1.491) 5.805 18.301 ( 10.953 8.927 1.024) 14.167 19.040 ( -3.038 -0.280 -2.099) 3.703 19.884 ( -0.211 1.734 2.582) 3.118 20.892 ( -3.900 2.088 0.406) 4.443 56.190 ( -9.100 0.620 -6.522) 11.213 56.733 ( -3.149 13.067 5.634) 14.574 ======================= Grid point 404 (191/322) ======================= q-point: (-0.38 -0.69 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.821 ( 4.384 12.511 5.685) 14.424 2.372 ( -6.764 8.228 -3.530) 11.221 2.678 ( 3.675 -9.135 -0.929) 9.890 3.076 ( 4.972 -6.793 -1.040) 8.482 3.309 ( -3.364 -2.428 -1.561) 4.433 3.490 ( 0.817 6.489 1.883) 6.806 3.996 ( -1.804 -5.296 4.616) 7.253 4.187 ( -3.599 2.202 12.046) 12.763 4.476 ( 2.935 -1.958 -9.196) 9.850 4.837 ( 13.872 -3.346 -5.653) 15.349 5.122 ( -0.707 0.909 0.334) 1.199 5.386 ( -9.952 -0.237 -4.665) 10.994 5.940 ( 1.064 1.081 2.496) 2.920 6.418 ( -5.445 -0.874 2.456) 6.037 6.660 ( 2.176 -4.790 -2.746) 5.934 8.643 ( 1.492 -0.044 0.782) 1.685 10.512 ( -1.633 -17.854 0.475) 17.935 11.595 ( -0.179 -10.742 -5.004) 11.851 13.203 ( -1.440 -0.128 2.109) 2.557 14.477 ( 0.644 -0.109 1.023) 1.214 14.558 ( -1.284 0.762 0.523) 1.583 14.892 ( 0.676 1.575 2.442) 2.983 15.721 ( 2.359 -1.444 1.013) 2.946 16.877 ( 1.251 5.864 -0.733) 6.040 18.149 ( 3.490 12.342 2.360) 13.042 19.044 ( 0.036 -1.426 -1.238) 1.889 19.857 ( -0.217 1.213 1.768) 2.155 20.841 ( -1.436 0.975 -1.626) 2.378 56.122 ( -9.447 -1.152 -5.138) 10.815 56.488 ( 2.422 12.356 5.033) 13.560 ======================= Grid point 405 (192/322) ======================= q-point: (-0.31 -0.69 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.654 ( 8.934 10.026 3.315) 13.832 2.089 ( -12.957 12.439 -2.670) 18.159 2.817 ( 1.413 -0.738 -0.303) 1.622 3.120 ( 3.005 1.329 -6.318) 7.121 3.330 ( -4.708 -5.315 -4.699) 8.514 3.424 ( 4.283 4.470 7.719) 9.895 4.130 ( -3.874 -2.955 2.475) 5.465 4.151 ( -0.773 -3.896 9.752) 10.530 4.480 ( 5.974 2.998 -4.263) 7.928 4.998 ( 7.822 -2.632 -1.938) 8.477 5.078 ( -3.779 -1.582 -4.483) 6.073 5.373 ( -3.810 -3.640 -5.463) 7.590 5.922 ( 0.552 1.631 1.716) 2.431 6.408 ( -4.166 -1.018 4.173) 5.984 6.759 ( 2.842 -3.938 -2.331) 5.387 8.655 ( 0.996 0.031 0.380) 1.066 10.811 ( 0.170 -13.242 0.454) 13.251 11.772 ( -0.236 -8.632 -7.213) 11.252 13.202 ( -1.164 -0.229 3.252) 3.462 14.486 ( 0.182 -0.337 1.389) 1.441 14.539 ( -1.280 0.365 0.643) 1.478 14.875 ( 1.083 1.281 1.893) 2.529 15.767 ( 1.662 -1.722 0.483) 2.441 16.756 ( -0.335 6.794 -0.177) 6.805 17.909 ( -1.134 13.254 3.662) 13.797 19.083 ( 1.110 -2.123 -0.485) 2.444 19.841 ( -0.185 0.533 1.143) 1.275 20.830 ( 0.372 -0.665 -3.237) 3.326 56.052 ( -9.727 1.510 1.364) 9.938 56.351 ( 6.337 4.728 -0.117) 7.908 ======================= Grid point 406 (193/322) ======================= q-point: (-0.23 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.586 ( 6.727 4.596 -1.319) 8.253 1.740 ( -11.158 12.310 2.145) 16.752 2.689 ( -1.845 10.635 -1.814) 10.946 3.174 ( 7.087 -1.970 -2.889) 7.903 3.380 ( 3.046 2.998 4.187) 5.983 3.411 ( -5.337 -6.303 -4.553) 9.431 4.087 ( -6.147 0.066 0.136) 6.149 4.281 ( -0.833 -4.575 4.713) 6.621 4.457 ( 7.230 3.467 -0.377) 8.027 4.988 ( 0.120 2.253 3.466) 4.136 5.164 ( 0.505 -4.925 -9.730) 10.917 5.434 ( -0.248 -4.776 -3.339) 5.833 5.895 ( 0.752 1.907 1.533) 2.560 6.406 ( -2.593 -0.443 4.229) 4.980 6.844 ( 2.021 -3.479 -2.073) 4.526 8.654 ( 0.095 0.505 0.070) 0.519 11.008 ( 1.824 -6.153 0.277) 6.424 11.891 ( -0.227 -5.111 -8.591) 9.999 13.203 ( -1.190 -0.004 4.409) 4.567 14.492 ( -0.375 0.065 1.872) 1.910 14.528 ( -0.912 0.129 0.784) 1.209 14.862 ( 0.774 1.124 0.925) 1.649 15.812 ( 1.153 -1.768 -0.245) 2.125 16.621 ( -0.849 6.557 0.090) 6.612 17.666 ( -1.646 10.926 4.712) 12.013 19.133 ( 0.426 -2.450 -0.091) 2.489 19.837 ( -0.172 -0.006 0.772) 0.791 20.859 ( 1.006 -2.416 -3.960) 4.746 55.950 ( -4.454 3.302 7.269) 9.142 56.385 ( 3.104 -4.101 -4.125) 6.593 ======================= Grid point 407 (194/322) ======================= q-point: (-0.15 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.361 ( -18.831 7.486 -2.823) 20.460 1.700 ( 14.812 -0.226 5.919) 15.952 2.462 ( -0.440 10.787 -2.079) 10.994 3.220 ( 11.803 4.450 5.155) 13.627 3.374 ( -1.368 -1.723 -7.513) 7.828 3.466 ( -3.350 -2.815 -2.808) 5.199 4.053 ( -8.306 -2.138 -3.335) 9.202 4.321 ( -2.720 -1.124 3.956) 4.931 4.455 ( 5.426 1.985 0.705) 5.821 4.950 ( -1.103 2.527 3.780) 4.679 5.211 ( 2.868 -0.850 -9.708) 10.158 5.529 ( -0.865 -5.400 0.336) 5.479 5.868 ( 1.616 1.923 1.349) 2.852 6.400 ( -0.958 0.359 3.058) 3.224 6.913 ( 0.168 -3.080 -1.860) 3.603 8.639 ( -0.741 0.762 0.096) 1.067 11.063 ( 2.559 2.281 0.072) 3.429 11.928 ( -0.616 -0.377 -9.313) 9.341 13.201 ( -1.247 0.042 5.562) 5.700 14.480 ( -1.122 0.987 1.963) 2.467 14.523 ( -0.285 0.030 0.907) 0.951 14.845 ( 0.646 1.161 -0.288) 1.360 15.845 ( 0.139 -0.960 -0.833) 1.278 16.508 ( 0.597 4.582 0.235) 4.627 17.504 ( 0.783 6.101 5.017) 7.938 19.180 ( -0.750 -2.531 -0.209) 2.648 19.840 ( -0.238 -0.263 0.639) 0.731 20.920 ( 0.372 -3.959 -3.626) 5.381 55.913 ( -0.152 -0.152 10.095) 10.098 56.517 ( -0.730 -9.103 -4.556) 10.206 ======================= Grid point 408 (195/322) ======================= q-point: (-0.08 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.162 ( -9.831 0.984 -0.098) 9.881 1.851 ( 12.864 -2.713 7.124) 14.953 2.283 ( 1.297 7.372 -1.994) 7.747 3.225 ( 14.012 5.304 7.440) 16.728 3.374 ( 0.496 -0.223 -12.333) 12.345 3.443 ( -0.437 3.652 -2.221) 4.297 4.014 ( -12.106 -1.337 -3.334) 12.628 4.345 ( -4.472 -4.174 3.957) 7.285 4.448 ( 1.839 1.791 1.093) 2.790 4.866 ( -2.946 5.307 1.160) 6.179 5.224 ( 4.972 0.758 -7.788) 9.271 5.620 ( -2.169 -4.856 3.124) 6.168 5.854 ( 2.883 1.342 0.761) 3.270 6.387 ( 0.745 1.237 1.150) 1.846 6.956 ( -2.322 -2.451 -1.614) 3.742 8.619 ( -1.287 0.385 0.549) 1.451 10.956 ( 1.916 10.471 -0.130) 10.646 11.859 ( -1.661 5.255 -9.291) 10.803 13.205 ( -1.090 -0.490 6.405) 6.516 14.448 ( -1.380 1.477 1.439) 2.481 14.527 ( 0.321 -0.270 1.018) 1.101 14.829 ( 1.714 1.113 -1.057) 2.301 15.837 ( -2.312 0.872 -1.432) 2.856 16.469 ( 4.474 1.303 0.448) 4.681 17.464 ( 4.341 0.824 4.220) 6.110 19.217 ( -1.752 -2.369 -0.859) 3.069 19.845 ( -0.353 -0.361 0.833) 0.974 21.000 ( -1.288 -4.984 -2.432) 5.693 55.995 ( 1.957 -5.744 11.855) 13.318 56.698 ( -4.273 -12.109 -3.841) 13.403 ======================= Grid point 414 (196/322) ======================= q-point: ( 0.38 0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.283 ( 4.524 0.000 2.458) 5.148 2.244 ( 8.786 0.000 13.455) 16.069 2.298 ( -0.406 -0.000 0.908) 0.995 2.863 ( -20.752 -0.000 4.453) 21.225 3.033 ( -10.333 -0.000 9.904) 14.313 3.477 ( 31.012 0.000 -4.977) 31.409 4.039 ( -1.869 -0.000 -17.295) 17.396 4.231 ( -1.914 -0.000 12.965) 13.105 4.689 ( 9.669 0.000 1.532) 9.789 4.717 ( 0.956 0.000 0.253) 0.989 4.835 ( 1.326 0.000 -3.515) 3.757 5.820 ( 0.390 0.000 5.635) 5.648 5.852 ( 2.356 0.000 -1.640) 2.871 6.214 ( -1.301 -0.000 -4.793) 4.967 6.595 ( -11.910 -0.000 -5.082) 12.949 8.766 ( -1.852 -0.000 -1.100) 2.153 9.452 ( -3.238 -0.000 2.018) 3.815 11.006 ( 0.940 0.000 3.702) 3.820 13.245 ( -2.945 -0.000 0.050) 2.945 14.478 ( 1.565 0.000 0.764) 1.742 14.646 ( -1.332 -0.000 0.921) 1.620 14.955 ( 0.679 0.000 4.454) 4.505 15.624 ( 3.340 0.000 -0.960) 3.475 17.048 ( 6.773 0.000 -3.107) 7.451 18.428 ( 18.354 0.000 -1.223) 18.394 19.092 ( -5.291 -0.000 -3.525) 6.357 19.956 ( -0.217 -0.000 3.980) 3.986 21.019 ( -7.221 -0.000 4.022) 8.265 56.361 ( -15.055 -0.000 -6.267) 16.307 57.216 ( -8.507 -0.000 4.319) 9.541 ======================= Grid point 415 (197/322) ======================= q-point: ( 0.46 0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.534 ( 1.594 -20.827 -1.657) 20.953 2.267 ( 9.166 0.954 9.871) 13.505 2.419 ( -2.152 -5.356 8.231) 10.053 2.683 ( -11.969 2.722 3.015) 12.640 3.042 ( -10.706 -5.420 8.847) 14.908 3.665 ( 23.354 0.958 -4.877) 23.877 4.009 ( -2.158 -0.934 -17.931) 18.084 4.212 ( -4.736 0.712 6.989) 8.473 4.539 ( -3.554 8.000 8.257) 12.034 4.843 ( -4.672 -5.444 -0.420) 7.187 4.917 ( 21.465 0.608 -3.995) 21.842 5.745 ( -4.288 6.361 1.089) 7.748 5.894 ( 3.602 -1.481 4.360) 5.846 6.274 ( -0.275 -6.973 -5.251) 8.733 6.494 ( -10.368 1.013 -4.861) 11.496 8.720 ( -0.905 2.767 -0.465) 2.948 9.544 ( -2.445 -10.651 1.499) 11.030 11.065 ( 0.483 -4.812 2.908) 5.643 13.222 ( -2.853 0.150 -0.240) 2.867 14.487 ( 1.379 0.363 0.896) 1.684 14.629 ( -1.578 0.773 0.635) 1.868 14.960 ( 0.408 0.635 3.865) 3.938 15.652 ( 3.894 -0.217 0.613) 3.948 17.070 ( 4.313 1.388 -2.995) 5.431 18.527 ( 15.917 2.830 -0.820) 16.187 19.046 ( -4.447 0.294 -3.366) 5.585 19.949 ( -0.239 1.180 3.789) 3.976 20.966 ( -5.590 1.278 3.574) 6.757 56.234 ( -13.498 0.975 -6.587) 15.052 57.115 ( -5.696 5.630 4.304) 9.092 ======================= Grid point 416 (198/322) ======================= q-point: (-0.46 -0.62 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.962 ( -1.275 -20.837 -6.003) 21.722 2.253 ( -13.317 3.507 14.429) 19.946 2.500 ( 10.088 -2.629 1.171) 10.491 2.735 ( 7.466 -7.870 5.067) 11.973 3.090 ( -10.543 -6.256 7.922) 14.596 3.731 ( 9.818 4.479 -5.226) 11.990 3.954 ( -5.589 1.362 -10.345) 11.837 4.212 ( -2.048 -3.771 -2.349) 4.892 4.404 ( -0.115 5.919 11.094) 12.575 4.883 ( 1.875 -0.568 -1.477) 2.454 5.056 ( 15.417 -1.262 -3.450) 15.848 5.554 ( -9.711 7.559 -0.682) 12.324 5.955 ( 4.131 -0.653 5.625) 7.009 6.381 ( -10.972 -3.110 -4.122) 12.126 6.440 ( 3.829 -4.280 -3.508) 6.730 8.671 ( 0.478 1.821 0.362) 1.918 9.800 ( -1.524 -16.699 0.791) 16.787 11.199 ( -0.051 -8.442 0.754) 8.476 13.200 ( -2.449 0.012 0.106) 2.451 14.488 ( 1.068 0.557 0.945) 1.532 14.599 ( -1.692 1.123 0.403) 2.071 14.951 ( 0.672 1.261 3.101) 3.414 15.688 ( 3.677 -0.393 1.556) 4.012 17.047 ( 1.715 2.875 -2.419) 4.130 18.528 ( 8.851 6.812 0.028) 11.169 19.017 ( -0.680 -0.118 -3.053) 3.130 19.923 ( -0.270 1.861 3.217) 3.726 20.906 ( -3.371 1.922 2.293) 4.507 56.116 ( -11.634 0.593 -6.035) 13.120 56.944 ( -1.818 9.659 4.376) 10.758 ======================= Grid point 417 (199/322) ======================= q-point: (-0.38 -0.62 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.036 ( -4.622 8.041 10.243) 13.818 2.276 ( -15.228 -11.851 -4.918) 19.912 2.603 ( 11.944 -0.804 -0.499) 11.981 2.973 ( 3.172 -7.192 0.488) 7.876 3.197 ( 0.668 -8.697 8.308) 12.046 3.634 ( 1.147 6.983 -4.927) 8.623 3.896 ( -6.999 -2.146 -0.483) 7.336 4.236 ( -4.155 1.904 11.528) 12.401 4.397 ( 6.102 -3.465 -8.666) 11.151 4.900 ( 3.661 0.182 -2.251) 4.301 5.174 ( 13.896 -0.279 -2.560) 14.132 5.335 ( -12.915 5.560 -2.105) 14.217 5.984 ( 3.105 1.345 3.971) 5.217 6.337 ( -8.828 -2.129 -0.162) 9.082 6.580 ( 4.652 -5.674 -3.089) 7.961 8.658 ( 1.235 0.469 0.557) 1.434 10.145 ( -0.144 -19.124 0.549) 19.133 11.380 ( -0.388 -10.396 -2.088) 10.611 13.188 ( -1.992 -0.334 0.974) 2.242 14.486 ( 0.652 0.424 0.957) 1.233 14.566 ( -1.663 1.007 0.346) 1.975 14.934 ( 1.289 1.613 2.549) 3.280 15.724 ( 2.939 -0.573 1.551) 3.373 16.978 ( -0.509 4.366 -1.573) 4.669 18.390 ( 0.128 10.686 1.051) 10.739 19.032 ( 3.531 -0.609 -2.325) 4.271 19.889 ( -0.261 1.843 2.407) 3.042 20.856 ( -1.022 1.694 0.428) 2.024 56.026 ( -10.532 -0.502 -4.405) 11.427 56.746 ( 2.470 11.560 3.964) 12.468 ======================= Grid point 418 (200/322) ======================= q-point: (-0.31 -0.62 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.875 ( -0.612 7.654 7.922) 11.032 2.196 ( -13.537 7.017 -3.292) 15.598 2.742 ( 4.970 -5.723 -1.320) 7.694 3.065 ( -5.344 -5.456 -0.309) 7.643 3.290 ( 0.879 2.930 -7.860) 8.435 3.565 ( 6.709 3.148 7.801) 10.760 3.968 ( -3.202 -9.195 2.732) 10.112 4.168 ( -4.351 2.920 12.028) 13.119 4.504 ( 5.654 -3.142 -9.160) 11.214 4.933 ( 0.429 -2.822 -6.376) 6.986 5.142 ( -3.177 5.635 1.838) 6.725 5.291 ( 6.389 -2.789 -5.157) 8.671 5.969 ( 1.679 2.220 1.969) 3.410 6.335 ( -6.664 -2.942 2.979) 7.869 6.704 ( 4.530 -4.218 -2.444) 6.655 8.664 ( 1.067 0.082 0.294) 1.110 10.512 ( 1.435 -17.947 0.467) 18.010 11.574 ( -0.337 -10.357 -4.769) 11.407 13.187 ( -1.769 -0.642 2.106) 2.824 14.486 ( 0.144 0.025 1.025) 1.035 14.540 ( -1.380 0.599 0.592) 1.617 14.917 ( 1.682 1.704 2.110) 3.191 15.758 ( 2.107 -0.869 0.831) 2.426 16.870 ( -1.947 5.659 -0.709) 6.026 18.146 ( -4.825 12.631 2.268) 13.710 19.072 ( 4.270 -0.684 -1.371) 4.536 19.860 ( -0.191 1.298 1.636) 2.097 20.831 ( 0.818 0.757 -1.584) 1.937 55.965 ( -10.122 -1.388 -1.332) 10.303 56.565 ( 6.087 10.671 2.280) 12.495 ======================= Grid point 419 (201/322) ======================= q-point: (-0.23 -0.62 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.741 ( -2.305 8.902 -1.569) 9.329 1.906 ( -7.356 10.510 4.746) 13.678 2.809 ( -2.071 1.771 -0.464) 2.764 3.101 ( -2.729 -2.107 -5.851) 6.792 3.249 ( -3.003 -4.327 -5.212) 7.410 3.547 ( 7.256 5.478 7.179) 11.584 4.066 ( -4.998 0.606 1.887) 5.377 4.184 ( 0.864 -6.208 7.819) 10.021 4.548 ( 5.286 1.440 -3.728) 6.626 4.975 ( -8.058 -4.686 -5.487) 10.817 5.083 ( 4.368 0.312 -1.308) 4.570 5.384 ( 7.520 -2.158 -3.821) 8.707 5.939 ( 0.953 1.963 1.385) 2.585 6.354 ( -4.888 -2.665 3.970) 6.838 6.799 ( 3.492 -3.008 -2.101) 5.066 8.665 ( 0.359 0.434 -0.020) 0.564 10.834 ( 2.677 -13.369 0.182) 13.636 11.746 ( 0.093 -8.366 -6.650) 10.688 13.191 ( -1.861 -0.643 3.259) 3.808 14.490 ( -0.366 -0.272 1.297) 1.375 14.525 ( -0.871 0.221 1.030) 1.367 14.898 ( 1.290 1.738 1.414) 2.585 15.792 ( 1.544 -1.269 -0.089) 2.001 16.736 ( -2.346 6.326 -0.041) 6.747 17.871 ( -5.598 11.822 3.567) 13.558 19.111 ( 2.899 -0.794 -0.505) 3.048 19.843 ( -0.121 0.604 1.082) 1.246 20.834 ( 1.626 -0.536 -3.203) 3.631 55.924 ( -8.641 -1.304 3.120) 9.280 56.447 ( 6.974 6.355 -0.852) 9.474 ======================= Grid point 420 (202/322) ======================= q-point: (-0.15 -0.62 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.414 ( -16.554 12.639 -5.917) 21.652 1.834 ( 9.851 2.550 9.061) 13.626 2.656 ( -1.787 9.915 -2.476) 10.374 3.157 ( -5.158 -7.339 -7.958) 11.991 3.339 ( -2.192 -6.012 -1.749) 6.633 3.503 ( 9.386 6.119 5.693) 12.567 3.997 ( -6.084 1.667 -0.776) 6.355 4.287 ( -0.229 -2.423 4.410) 5.037 4.530 ( 2.747 2.551 -3.065) 4.842 4.987 ( -1.735 -0.372 4.996) 5.302 5.144 ( 1.487 -4.038 -8.757) 9.757 5.468 ( 5.601 -2.178 -2.201) 6.400 5.914 ( 1.032 1.616 1.465) 2.413 6.376 ( -3.067 -1.885 3.415) 4.962 6.864 ( 1.521 -2.217 -1.929) 3.309 8.652 ( -0.357 0.919 -0.078) 0.989 11.045 ( 2.916 -6.108 -0.311) 6.776 11.865 ( 0.544 -4.640 -7.648) 8.962 13.193 ( -2.008 -0.435 4.372) 4.831 14.490 ( -0.798 0.267 1.824) 2.009 14.521 ( -0.344 -0.061 1.237) 1.286 14.874 ( 0.501 1.562 0.378) 1.683 15.826 ( 0.932 -1.184 -0.831) 1.721 16.605 ( -1.285 5.483 0.392) 5.645 17.648 ( -2.941 8.282 4.523) 9.884 19.143 ( 0.942 -1.093 0.012) 1.443 19.837 ( -0.131 0.081 0.766) 0.781 20.863 ( 1.237 -1.909 -3.979) 4.583 55.906 ( -4.684 -1.279 7.232) 8.711 56.423 ( 3.787 -0.096 -3.701) 5.296 ======================= Grid point 421 (203/322) ======================= q-point: (-0.08 0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.112 ( -13.024 4.670 -3.442) 14.258 1.919 ( 11.950 -1.070 8.370) 14.629 2.454 ( 0.506 9.479 -3.213) 10.021 3.249 ( -3.986 -6.555 -9.286) 12.045 3.418 ( -0.653 -3.107 -0.167) 3.179 3.480 ( 11.851 4.881 4.139) 13.469 3.917 ( -8.634 0.834 -3.472) 9.343 4.299 ( -2.243 0.306 4.391) 4.940 4.491 ( 0.081 1.902 -3.503) 3.987 4.958 ( 0.692 4.305 4.900) 6.560 5.212 ( 0.846 -3.265 -7.081) 7.843 5.542 ( 2.280 -2.732 0.121) 3.560 5.899 ( 1.734 1.256 1.373) 2.544 6.392 ( -1.126 -0.901 2.015) 2.478 6.900 ( -1.099 -1.634 -1.706) 2.605 8.628 ( -0.755 1.061 0.229) 1.322 11.097 ( 1.761 2.623 -0.734) 3.244 11.896 ( 0.421 0.629 -7.953) 7.989 13.195 ( -1.842 -0.501 5.337) 5.668 14.470 ( -1.035 1.336 1.934) 2.568 14.526 ( 0.181 -0.254 1.287) 1.324 14.853 ( 0.480 0.811 -0.406) 1.026 15.835 ( -0.827 0.398 -1.455) 1.720 16.529 ( 1.883 2.360 0.686) 3.096 17.538 ( 1.675 3.294 4.634) 5.927 19.168 ( -0.872 -1.445 -0.001) 1.688 19.838 ( -0.234 -0.175 0.694) 0.753 20.909 ( -0.186 -3.139 -3.752) 4.896 55.942 ( -0.302 -3.183 9.436) 9.963 56.485 ( -1.432 -5.964 -4.667) 7.707 ======================= Grid point 428 (204/322) ======================= q-point: (-0.54 -0.54 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.301 ( -2.693 -0.000 -0.461) 2.732 2.350 ( 6.141 0.000 5.017) 7.930 2.356 ( -6.573 -0.000 15.891) 17.197 2.634 ( -5.360 -0.000 2.156) 5.778 2.940 ( -6.675 -0.000 9.551) 11.652 3.827 ( 18.351 0.000 -5.500) 19.157 3.958 ( -1.029 -0.000 -18.490) 18.519 4.174 ( -10.459 -0.000 2.476) 10.748 4.624 ( -6.724 -0.000 11.692) 13.487 4.732 ( 1.094 0.000 -0.020) 1.094 5.083 ( 20.425 0.000 -3.519) 20.726 5.837 ( -2.847 -0.000 8.873) 9.319 5.873 ( 1.294 0.000 -1.668) 2.111 6.173 ( -0.511 -0.000 -6.569) 6.589 6.433 ( -6.739 -0.000 -5.803) 8.894 8.740 ( -1.143 -0.000 -1.227) 1.676 9.427 ( -1.097 -0.000 2.257) 2.509 11.027 ( 0.181 0.000 3.708) 3.712 13.201 ( -2.831 -0.000 -0.617) 2.898 14.502 ( 1.244 0.000 1.096) 1.658 14.624 ( -1.989 -0.000 0.459) 2.042 14.976 ( 0.796 0.000 3.405) 3.497 15.682 ( 4.101 0.000 1.595) 4.400 17.101 ( 1.844 0.000 -3.287) 3.769 18.658 ( 11.862 0.000 -0.985) 11.903 19.019 ( -1.570 -0.000 -3.778) 4.091 19.965 ( -0.358 -0.000 3.881) 3.897 20.950 ( -3.994 -0.000 4.079) 5.709 56.133 ( -13.416 -0.000 -6.034) 14.711 57.142 ( -3.294 -0.000 3.648) 4.915 ======================= Grid point 429 (205/322) ======================= q-point: (-0.46 -0.54 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.485 ( -6.735 -20.047 -2.393) 21.283 2.249 ( -18.693 2.940 16.321) 24.989 2.495 ( 12.691 -7.156 5.319) 15.511 2.676 ( 7.047 -2.662 2.205) 7.849 2.947 ( -6.158 -3.214 9.406) 11.693 3.859 ( 4.493 4.081 -10.333) 11.984 3.922 ( -5.654 1.166 -9.501) 11.117 4.120 ( -4.352 -2.977 -4.376) 6.852 4.547 ( 1.177 5.627 13.861) 15.006 4.800 ( -1.348 -4.429 0.057) 4.630 5.197 ( 16.114 1.237 -4.560) 16.792 5.663 ( -6.717 9.652 1.329) 11.834 5.966 ( 2.647 -3.386 6.571) 7.852 6.224 ( -2.957 -4.569 -6.250) 8.287 6.401 ( 0.856 -1.394 -5.260) 5.508 8.709 ( -0.313 1.857 -0.600) 1.977 9.531 ( -0.037 -10.280 1.633) 10.409 11.076 ( -0.292 -4.449 2.884) 5.310 13.181 ( -2.486 -0.053 -0.388) 2.517 14.508 ( 0.955 0.445 1.141) 1.553 14.603 ( -2.150 0.654 0.373) 2.278 14.982 ( 1.425 0.726 2.755) 3.185 15.714 ( 3.651 -0.063 1.994) 4.161 17.086 ( -0.768 1.360 -3.035) 3.413 18.675 ( 2.601 3.821 -0.893) 4.708 19.023 ( 4.935 -0.020 -3.863) 6.267 19.957 ( -0.478 1.197 3.558) 3.785 20.923 ( -1.861 1.211 3.688) 4.304 56.027 ( -12.174 0.244 -4.582) 13.010 57.086 ( -0.006 4.995 3.301) 5.987 ======================= Grid point 430 (206/322) ======================= q-point: (-0.38 -0.54 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.832 ( -13.597 -20.450 -1.963) 24.636 2.093 ( -12.433 2.258 13.312) 18.355 2.694 ( 12.693 -0.426 1.110) 12.749 2.855 ( 3.882 -7.505 1.406) 8.566 3.031 ( 1.183 -10.028 12.830) 16.327 3.726 ( -6.947 5.180 -13.190) 15.782 3.825 ( -8.049 1.404 -0.449) 8.182 4.187 ( 0.443 -3.991 -4.512) 6.040 4.484 ( 6.071 5.267 8.753) 11.884 4.864 ( -1.322 -3.278 -0.416) 3.559 5.237 ( 1.463 1.642 -7.617) 7.928 5.451 ( 2.694 8.751 2.245) 9.428 6.039 ( 3.793 -0.263 7.417) 8.335 6.224 ( -7.600 -1.901 -5.306) 9.462 6.504 ( 6.569 -5.583 -3.601) 9.343 8.680 ( 0.629 1.085 0.078) 1.257 9.801 ( 1.336 -16.579 0.760) 16.650 11.197 ( -0.584 -7.964 0.760) 8.021 13.167 ( -2.086 -0.287 0.346) 2.134 14.503 ( 0.500 0.690 0.953) 1.279 14.572 ( -1.980 0.928 0.497) 2.242 14.979 ( 2.173 1.344 2.249) 3.404 15.742 ( 2.729 -0.094 1.591) 3.160 17.029 ( -3.041 2.643 -2.324) 4.651 18.551 ( -5.114 7.692 -0.555) 9.254 19.068 ( 8.412 0.227 -3.357) 9.060 19.928 ( -0.505 1.870 2.883) 3.473 20.891 ( 0.330 1.896 2.459) 3.122 55.937 ( -10.708 -0.113 -2.385) 10.971 56.970 ( 3.489 8.672 2.945) 9.800 ======================= Grid point 431 (207/322) ======================= q-point: (-0.31 -0.54 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.908 ( -15.966 -1.566 10.741) 19.307 2.111 ( -7.977 -5.100 -0.035) 9.468 2.756 ( 8.402 1.456 -0.827) 8.567 2.915 ( -6.414 -4.321 2.084) 8.009 3.321 ( 8.106 -4.463 0.726) 9.282 3.628 ( 1.339 -2.068 -1.198) 2.740 3.768 ( -9.517 -4.209 0.189) 10.408 4.205 ( -4.000 1.474 7.167) 8.339 4.491 ( 8.731 -0.485 -6.188) 10.713 4.894 ( -2.250 -0.487 -2.550) 3.435 5.125 ( -11.541 1.434 -3.268) 12.080 5.419 ( 16.252 4.307 -0.425) 16.819 6.043 ( 3.133 3.192 3.118) 5.452 6.218 ( -7.358 -3.860 0.287) 8.314 6.651 ( 6.366 -4.900 -2.636) 8.456 8.674 ( 0.851 0.293 0.089) 0.905 10.167 ( 2.832 -19.124 0.328) 19.335 11.367 ( -0.292 -10.013 -1.968) 10.209 13.163 ( -1.920 -0.603 1.392) 2.447 14.493 ( -0.183 0.552 0.536) 0.791 14.544 ( -1.335 0.768 1.011) 1.843 14.970 ( 2.625 1.814 1.910) 3.719 15.763 ( 1.694 -0.285 0.585) 1.815 16.936 ( -4.510 3.792 -1.352) 6.045 18.320 ( -9.158 10.496 0.442) 13.936 19.115 ( 7.840 0.691 -2.547) 8.272 19.892 ( -0.380 1.826 2.103) 2.810 20.866 ( 2.064 1.855 0.622) 2.844 55.870 ( -9.513 -0.800 0.276) 9.550 56.822 ( 6.339 10.597 2.107) 12.526 ======================= Grid point 432 (208/322) ======================= q-point: (-0.23 -0.54 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.825 ( -10.319 3.034 4.146) 11.527 2.020 ( -8.954 5.793 4.805) 11.697 2.763 ( -3.959 -1.090 -0.155) 4.109 2.997 ( -2.825 -5.759 0.519) 6.435 3.274 ( 2.973 5.998 -10.471) 12.429 3.660 ( 1.647 1.489 4.895) 5.375 3.962 ( 1.883 -11.480 3.222) 12.071 4.137 ( -4.506 1.509 9.621) 10.730 4.580 ( 8.058 -2.353 -7.378) 11.176 4.825 ( -10.408 -0.168 -7.740) 12.972 5.094 ( -0.567 -1.893 1.657) 2.579 5.465 ( 14.021 2.462 -2.079) 14.386 5.997 ( 1.288 3.141 0.929) 3.520 6.254 ( -5.794 -4.155 3.352) 7.879 6.768 ( 5.156 -3.210 -2.103) 6.427 8.675 ( 0.439 0.294 -0.242) 0.582 10.552 ( 3.657 -17.848 0.071) 18.218 11.560 ( 0.723 -10.111 -4.446) 11.069 13.166 ( -2.093 -0.822 2.529) 3.384 14.484 ( -0.791 0.022 0.293) 0.844 14.528 ( -0.526 0.424 1.689) 1.819 14.952 ( 2.225 2.268 1.472) 3.502 15.782 ( 1.054 -0.788 -0.514) 1.413 16.818 ( -4.850 4.710 -0.399) 6.772 18.038 ( -10.362 11.058 1.932) 15.277 19.145 ( 5.852 0.995 -1.545) 6.134 19.862 ( -0.186 1.291 1.462) 1.959 20.853 ( 2.913 1.248 -1.405) 3.466 55.831 ( -8.443 -1.690 3.081) 9.145 56.671 ( 7.732 10.414 0.525) 12.981 ======================= Grid point 433 (209/322) ======================= q-point: (-0.15 -0.54 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.554 ( -15.422 13.498 -5.284) 21.165 1.944 ( 3.122 1.571 11.794) 12.301 2.735 ( -8.933 0.314 0.672) 8.964 3.006 ( -6.708 -0.924 -7.632) 10.203 3.255 ( 6.348 -1.682 -3.711) 7.543 3.653 ( 4.941 2.369 3.313) 6.403 3.997 ( -5.595 2.152 2.146) 6.367 4.231 ( 2.425 -5.417 5.971) 8.419 4.595 ( 1.896 3.835 -4.833) 6.455 4.842 ( -6.365 -9.150 -3.922) 11.816 5.139 ( 4.144 -0.568 -0.688) 4.239 5.514 ( 10.169 1.287 -2.282) 10.501 5.954 ( 0.315 1.981 1.029) 2.254 6.299 ( -4.171 -3.706 3.599) 6.640 6.842 ( 3.232 -1.667 -1.883) 4.095 8.666 ( -0.097 0.727 -0.428) 0.849 10.880 ( 3.251 -13.045 -0.358) 13.449 11.739 ( 2.113 -8.045 -6.141) 10.340 13.171 ( -2.374 -0.831 3.629) 4.415 14.483 ( -0.963 -0.411 0.553) 1.184 14.524 ( -0.049 0.183 2.157) 2.166 14.919 ( 0.971 2.552 0.702) 2.820 15.809 ( 0.934 -1.263 -1.223) 1.991 16.691 ( -3.908 4.958 0.311) 6.320 17.777 ( -8.494 8.704 3.449) 12.642 19.158 ( 3.516 0.966 -0.587) 3.693 19.845 ( -0.066 0.653 1.033) 1.224 20.855 ( 2.700 0.315 -3.082) 4.110 55.826 ( -6.832 -2.871 5.730) 9.367 56.545 ( 6.973 7.988 -1.612) 10.725 ======================= Grid point 434 (210/322) ======================= q-point: (-0.08 -0.54 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.175 ( -12.621 12.060 -5.485) 18.298 1.996 ( 7.758 -0.453 10.995) 13.464 2.606 ( -4.909 6.546 -1.841) 8.386 3.028 ( -7.237 -8.178 -10.396) 15.077 3.339 ( 2.425 -3.271 0.099) 4.073 3.654 ( 9.278 3.222 2.456) 10.124 3.906 ( -5.986 2.987 -0.476) 6.706 4.305 ( 0.466 -0.423 4.981) 5.021 4.514 ( -2.264 2.633 -6.260) 7.158 4.974 ( -2.452 -5.897 5.290) 8.293 5.163 ( 4.345 0.397 -6.015) 7.431 5.553 ( 6.200 0.523 -1.864) 6.495 5.929 ( 0.215 1.011 1.439) 1.772 6.345 ( -2.360 -2.923 2.835) 4.707 6.875 ( 0.788 -0.589 -1.752) 2.009 8.645 ( -0.353 1.107 -0.231) 1.184 11.078 ( 1.530 -5.516 -0.875) 5.791 11.865 ( 2.985 -3.834 -7.089) 8.594 13.176 ( -2.301 -0.803 4.624) 5.227 14.482 ( -0.920 0.146 1.157) 1.486 14.527 ( 0.247 -0.029 2.193) 2.207 14.877 ( -0.085 1.887 -0.121) 1.893 15.832 ( 0.387 -0.508 -1.506) 1.636 16.587 ( -1.434 3.311 0.740) 3.683 17.612 ( -3.978 4.164 4.394) 7.244 19.159 ( 1.227 0.572 0.032) 1.355 19.838 ( -0.091 0.187 0.796) 0.822 20.869 ( 1.526 -0.764 -3.968) 4.320 55.866 ( -4.106 -4.472 7.861) 9.932 56.466 ( 3.700 3.702 -3.685) 6.401 ======================= Grid point 442 (211/322) ======================= q-point: (-0.46 -0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.211 ( -9.064 -0.000 0.245) 9.067 2.154 ( -22.052 -0.000 19.087) 29.165 2.494 ( 10.589 0.000 5.061) 11.736 2.729 ( 10.430 0.000 1.680) 10.564 2.907 ( -2.016 -0.000 9.280) 9.496 3.852 ( -18.727 -0.000 -1.441) 18.783 3.892 ( 0.447 0.000 -18.259) 18.264 4.063 ( 3.112 0.000 -4.069) 5.123 4.650 ( 3.160 0.000 14.070) 14.420 4.749 ( 1.250 0.000 -0.470) 1.336 5.285 ( 6.630 0.000 -6.672) 9.406 5.771 ( -7.319 -0.000 7.990) 10.836 5.878 ( 0.102 0.000 -1.759) 1.762 6.199 ( 5.757 0.000 -2.978) 6.482 6.390 ( 4.182 0.000 -6.152) 7.439 8.724 ( -0.575 -0.000 -1.175) 1.308 9.435 ( 1.213 0.000 2.217) 2.527 11.035 ( -0.738 -0.000 3.588) 3.663 13.163 ( -2.147 -0.000 -0.292) 2.167 14.520 ( 0.605 0.000 1.127) 1.279 14.593 ( -2.311 -0.000 0.561) 2.379 15.007 ( 2.305 0.000 2.228) 3.206 15.742 ( 2.998 0.000 1.803) 3.498 17.079 ( -3.388 -0.000 -3.173) 4.642 18.702 ( -4.464 -0.000 -1.940) 4.867 19.075 ( 10.164 0.000 -4.152) 10.980 19.970 ( -0.748 -0.000 3.498) 3.577 20.935 ( 0.216 0.000 4.263) 4.268 55.938 ( -11.245 -0.000 -2.179) 11.454 57.147 ( 2.490 0.000 2.664) 3.647 ======================= Grid point 443 (212/322) ======================= q-point: (-0.38 -0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.345 ( -11.447 -18.572 0.495) 21.822 2.021 ( -19.090 0.434 19.147) 27.041 2.696 ( 11.473 -9.957 2.647) 15.420 2.806 ( 8.349 -0.602 1.662) 8.534 2.933 ( 0.126 -2.311 10.968) 11.209 3.659 ( -23.796 1.953 -3.411) 24.118 3.841 ( 0.216 2.671 -12.434) 12.720 4.122 ( 3.633 -3.113 -4.256) 6.404 4.645 ( 5.007 4.726 10.347) 12.429 4.795 ( 0.644 -2.976 -0.276) 3.057 5.247 ( -7.504 2.784 -8.679) 11.806 5.644 ( 4.665 7.047 4.150) 9.415 5.975 ( -3.513 -6.468 3.994) 8.374 6.215 ( 4.404 2.202 -5.009) 7.024 6.466 ( 9.504 -3.364 -3.831) 10.786 8.705 ( -0.025 1.149 -0.622) 1.307 9.554 ( 2.430 -10.158 1.450) 10.545 11.075 ( -1.071 -4.267 2.743) 5.185 13.150 ( -1.719 -0.126 0.293) 1.749 14.519 ( -0.117 0.496 0.628) 0.809 14.573 ( -1.902 0.530 1.139) 2.280 15.023 ( 3.194 0.777 1.779) 3.737 15.761 ( 1.846 0.057 0.884) 2.048 17.029 ( -5.696 1.162 -2.773) 6.441 18.612 ( -8.313 4.096 -2.463) 9.589 19.142 ( 10.699 0.482 -4.097) 11.467 19.958 ( -0.917 1.151 3.030) 3.368 20.938 ( 2.268 1.334 3.922) 4.723 55.861 ( -9.527 0.043 0.909) 9.570 57.134 ( 5.176 4.584 2.309) 7.290 ======================= Grid point 444 (213/322) ======================= q-point: (-0.31 -0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.613 ( -15.654 -15.876 4.435) 22.732 1.962 ( -12.307 -3.999 13.679) 18.830 2.837 ( -2.566 -1.074 1.375) 3.103 2.855 ( 6.368 2.085 0.971) 6.771 3.192 ( 11.483 -16.319 11.162) 22.864 3.478 ( -19.221 -2.183 -5.766) 20.185 3.759 ( -0.275 3.930 -6.269) 7.404 4.191 ( 1.523 -1.730 -1.005) 2.515 4.586 ( 3.132 4.941 1.069) 5.947 4.856 ( 0.387 -2.452 -0.695) 2.578 5.083 ( -11.517 3.647 -4.625) 12.935 5.609 ( 11.574 4.236 1.265) 12.390 6.062 ( -4.885 -5.098 5.931) 9.221 6.168 ( 3.144 4.346 -5.462) 7.655 6.611 ( 9.544 -4.369 -2.574) 10.808 8.688 ( 0.456 0.659 -0.136) 0.813 9.842 ( 3.891 -16.655 0.350) 17.107 11.189 ( -0.628 -7.874 0.628) 7.924 13.143 ( -1.524 -0.298 1.203) 1.964 14.502 ( -1.112 0.706 -0.177) 1.329 14.553 ( -0.894 0.733 1.984) 2.296 15.029 ( 3.759 1.546 1.496) 4.331 15.769 ( 0.457 -0.015 -0.522) 0.694 16.946 ( -7.290 2.075 -1.882) 7.810 18.421 ( -11.080 7.885 -1.935) 13.737 19.192 ( 9.135 1.146 -3.711) 9.927 19.927 ( -0.842 1.731 2.344) 3.033 20.931 ( 3.811 2.260 2.755) 5.217 55.802 ( -7.738 -0.044 4.057) 8.737 57.058 ( 7.325 8.231 1.841) 11.171 ======================= Grid point 445 (214/322) ======================= q-point: (-0.23 -0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.710 ( -14.981 -5.960 8.752) 18.345 1.986 ( -11.102 -2.795 7.652) 13.770 2.738 ( -10.483 2.885 0.001) 10.873 2.916 ( 3.959 -2.221 1.112) 4.674 3.354 ( -1.514 0.123 -5.812) 6.007 3.676 ( -0.856 -3.302 -0.548) 3.454 3.704 ( 6.905 -13.282 6.011) 16.132 4.172 ( -3.408 3.449 4.495) 6.612 4.550 ( 0.343 -1.733 -10.324) 10.475 4.824 ( -2.754 4.755 -2.839) 6.185 5.030 ( -1.382 -3.498 2.091) 4.304 5.624 ( 11.791 3.465 -0.480) 12.299 6.085 ( 1.643 4.913 -0.986) 5.274 6.130 ( -5.231 -4.893 3.006) 7.768 6.747 ( 7.715 -3.324 -2.065) 8.651 8.683 ( 0.379 0.327 -0.312) 0.590 10.223 ( 4.569 -18.979 -0.211) 19.522 11.364 ( 1.043 -10.108 -2.142) 10.385 13.142 ( -1.704 -0.491 2.271) 2.882 14.480 ( -1.483 0.391 -0.425) 1.592 14.539 ( -0.194 0.647 2.372) 2.466 15.020 ( 3.416 2.401 1.223) 4.351 15.771 ( -0.521 -0.549 -1.830) 1.980 16.842 ( -7.765 2.725 -0.756) 8.264 18.155 ( -12.821 9.975 -0.387) 16.248 19.218 ( 7.083 1.737 -2.917) 7.855 19.892 ( -0.544 1.639 1.712) 2.432 20.918 ( 4.573 2.550 0.957) 5.322 55.763 ( -6.376 -0.363 6.555) 9.152 56.936 ( 8.371 10.496 0.918) 13.456 ======================= Grid point 446 (215/322) ======================= q-point: (-0.15 -0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.630 ( -15.440 5.326 0.029) 16.333 1.959 ( -4.818 -1.695 13.079) 14.041 2.625 ( -13.643 -0.599 -0.123) 13.657 2.944 ( -5.270 -0.159 -2.390) 5.789 3.351 ( 10.609 2.004 -6.991) 12.863 3.671 ( 0.376 -1.104 2.314) 2.591 4.001 ( -0.304 -0.928 2.015) 2.239 4.122 ( -0.190 -7.098 6.640) 9.721 4.616 ( -6.721 -7.078 -8.593) 13.004 4.705 ( 4.893 5.608 -3.401) 8.183 5.118 ( 1.869 -3.928 2.073) 4.819 5.638 ( 10.012 3.318 -1.321) 10.630 6.005 ( -0.422 3.415 -0.841) 3.542 6.195 ( -3.764 -4.564 4.168) 7.237 6.839 ( 5.435 -1.593 -1.806) 5.945 8.676 ( 0.028 0.497 -0.682) 0.844 10.608 ( 3.626 -17.315 -0.380) 17.695 11.574 ( 3.499 -10.170 -4.736) 11.752 13.144 ( -2.097 -0.671 3.373) 4.028 14.468 ( -1.247 -0.255 -0.154) 1.282 14.533 ( 0.036 0.379 2.452) 2.482 14.987 ( 1.887 3.262 0.716) 3.836 15.782 ( -0.407 -1.467 -2.444) 2.880 16.731 ( -6.909 3.152 0.189) 7.597 17.875 ( -12.378 9.119 1.676) 15.465 19.220 ( 5.020 2.150 -1.852) 5.766 19.864 ( -0.222 1.169 1.265) 1.736 20.904 ( 4.436 2.303 -1.089) 5.116 55.747 ( -5.432 -1.302 8.069) 9.814 56.787 ( 8.042 11.022 -0.515) 13.653 ======================= Grid point 447 (216/322) ======================= q-point: (-0.08 -0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.328 ( -12.663 12.622 -3.965) 18.314 2.030 ( 3.017 -2.855 13.511) 14.135 2.556 ( -15.230 -2.646 0.383) 15.463 2.877 ( -7.050 -0.660 -7.817) 10.547 3.387 ( 11.952 2.740 -3.490) 12.749 3.716 ( 2.776 -1.638 -0.046) 3.224 3.925 ( -4.259 2.799 1.621) 5.348 4.286 ( 2.399 -4.102 5.103) 6.973 4.549 ( -4.809 3.854 -4.784) 7.802 4.803 ( 1.660 -8.365 -2.131) 8.790 5.193 ( 3.006 -1.526 -0.326) 3.387 5.636 ( 7.074 3.021 -1.825) 7.906 5.950 ( -1.289 1.569 0.434) 2.076 6.264 ( -2.156 -4.124 3.729) 5.963 6.881 ( 2.986 0.040 -1.686) 3.429 8.662 ( -0.162 0.827 -0.732) 1.117 10.914 ( 1.475 -12.218 -0.570) 12.320 11.773 ( 5.341 -7.629 -6.629) 11.431 13.149 ( -2.232 -0.863 4.419) 5.025 14.470 ( -0.865 -0.625 0.311) 1.111 14.533 ( 0.065 0.104 2.504) 2.507 14.929 ( 0.141 3.401 0.071) 3.405 15.811 ( 0.235 -1.709 -2.298) 2.873 16.628 ( -4.784 2.890 0.697) 5.633 17.657 ( -9.356 5.224 3.533) 11.283 19.204 ( 3.038 2.272 -0.806) 3.878 19.848 ( -0.055 0.657 0.975) 1.177 20.891 ( 3.453 1.662 -2.853) 4.778 55.767 ( -4.451 -3.218 8.742) 10.324 56.636 ( 6.275 9.723 -2.235) 11.786 ======================= Grid point 456 (217/322) ======================= q-point: (-0.38 -0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.059 ( -11.960 -0.000 3.385) 12.429 1.921 ( -18.885 -0.000 23.654) 30.268 2.660 ( 10.027 0.000 0.425) 10.036 2.859 ( 5.003 0.000 1.056) 5.113 2.948 ( 3.465 0.000 10.680) 11.228 3.475 ( -29.478 -0.000 1.299) 29.507 3.855 ( 2.339 0.000 -16.350) 16.517 4.119 ( 5.191 0.000 -0.775) 5.249 4.747 ( 2.658 0.000 7.701) 8.147 4.765 ( 1.312 0.000 -1.019) 1.661 5.190 ( -12.310 -0.000 -8.278) 14.834 5.765 ( 1.450 0.000 8.321) 8.447 5.865 ( -1.007 -0.000 -1.897) 2.148 6.276 ( 6.513 0.000 -6.306) 9.066 6.513 ( 13.200 0.000 -2.085) 13.364 8.715 ( -0.232 -0.000 -0.971) 0.999 9.475 ( 3.270 0.000 1.903) 3.783 11.029 ( -1.702 -0.000 3.370) 3.775 13.139 ( -1.185 -0.000 0.723) 1.388 14.519 ( -1.308 -0.000 -0.193) 1.322 14.570 ( -1.127 -0.000 2.250) 2.517 15.060 ( 4.192 0.000 1.331) 4.398 15.771 ( 0.419 0.000 -0.629) 0.755 16.985 ( -7.950 -0.000 -2.768) 8.418 18.581 ( -9.523 -0.000 -4.056) 10.351 19.216 ( 10.021 0.000 -4.568) 11.013 19.966 ( -1.290 -0.000 2.788) 3.073 20.983 ( 4.167 0.000 4.486) 6.123 55.805 ( -7.198 -0.000 5.210) 8.886 57.226 ( 7.092 0.000 2.044) 7.380 ======================= Grid point 457 (218/322) ======================= q-point: (-0.31 -0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.176 ( -12.347 -17.394 4.468) 21.794 1.839 ( -15.268 -1.061 22.998) 27.625 2.798 ( 0.497 -3.073 -2.594) 4.052 2.887 ( 0.878 -3.138 0.430) 3.287 3.033 ( 7.516 -5.616 11.682) 14.983 3.281 ( -24.011 -1.359 2.791) 24.210 3.825 ( 3.453 2.531 -12.212) 12.941 4.182 ( 6.216 -1.619 -0.143) 6.425 4.682 ( -5.643 5.196 -1.719) 7.861 4.811 ( 1.358 -2.681 -1.208) 3.239 5.070 ( -7.913 2.682 -1.379) 8.468 5.742 ( 5.073 2.953 2.910) 6.551 5.927 ( -3.725 -5.358 1.796) 6.768 6.276 ( 5.526 3.573 -6.813) 9.472 6.630 ( 13.308 -1.891 -1.315) 13.506 8.704 ( 0.099 0.707 -0.406) 0.821 9.608 ( 4.369 -10.276 0.942) 11.206 11.064 ( -1.599 -4.486 2.463) 5.362 13.134 ( -0.844 -0.034 1.482) 1.705 14.501 ( -2.128 0.422 -0.707) 2.282 14.564 ( -0.385 0.456 2.927) 2.987 15.087 ( 4.861 0.924 1.005) 5.049 15.764 ( -1.419 0.041 -2.607) 2.968 16.909 ( -9.510 0.852 -2.150) 9.787 18.456 ( -10.975 4.596 -4.553) 12.740 19.269 ( 8.315 0.740 -4.638) 9.550 19.949 ( -1.409 1.010 2.270) 2.856 21.010 ( 5.489 1.620 4.174) 7.084 55.772 ( -4.423 0.392 9.592) 10.570 57.243 ( 8.599 4.508 1.843) 9.882 ======================= Grid point 458 (219/322) ======================= q-point: (-0.23 -0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.422 ( -13.420 -14.455 7.729) 21.185 1.830 ( -12.306 -4.625 16.638) 21.205 2.693 ( -17.938 2.571 -1.013) 18.150 2.943 ( 3.559 0.178 1.212) 3.764 3.219 ( -12.217 -6.201 -0.071) 13.701 3.389 ( 10.092 -18.238 9.037) 22.719 3.780 ( 6.291 3.927 -6.168) 9.646 4.231 ( 3.813 2.199 0.971) 4.507 4.502 ( -11.587 2.831 -11.459) 16.540 4.876 ( 2.738 -1.545 -0.837) 3.253 4.994 ( -0.364 1.735 3.907) 4.291 5.744 ( 6.368 1.869 0.692) 6.672 6.003 ( -3.895 -5.205 1.729) 6.726 6.199 ( 1.765 5.835 -4.227) 7.419 6.757 ( 11.058 -2.102 -1.499) 11.355 8.693 ( 0.319 0.542 -0.072) 0.633 9.910 ( 5.151 -16.640 -0.366) 17.423 11.187 ( 0.388 -8.561 0.015) 8.570 13.132 ( -0.896 -0.030 2.438) 2.598 14.474 ( -2.130 0.441 -0.725) 2.293 14.556 ( -0.061 0.696 2.990) 3.070 15.094 ( 4.502 2.081 0.694) 5.008 15.744 ( -2.978 -0.446 -4.170) 5.143 16.813 ( -10.068 1.312 -0.987) 10.201 18.236 ( -12.801 8.336 -3.389) 15.647 19.294 ( 6.503 1.455 -4.206) 7.880 19.919 ( -1.173 1.428 1.730) 2.531 21.014 ( 6.068 2.876 3.100) 7.396 55.753 ( -2.302 1.069 12.718) 12.969 57.186 ( 9.175 8.381 1.317) 12.497 ======================= Grid point 459 (220/322) ======================= q-point: (-0.15 -0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.526 ( -14.403 -4.973 6.644) 16.622 1.857 ( -10.773 -4.651 13.904) 18.194 2.521 ( -17.989 0.718 -1.402) 18.058 2.938 ( -1.311 2.038 -0.649) 2.508 3.297 ( -4.135 -8.153 -0.250) 9.145 3.754 ( 11.657 4.101 -1.619) 12.463 3.831 ( 6.605 -17.714 6.829) 20.101 4.108 ( -6.910 6.729 -4.085) 10.475 4.460 ( -3.500 -4.117 -7.946) 9.610 4.854 ( 5.383 5.584 -1.112) 7.835 5.042 ( 0.532 -4.557 3.120) 5.548 5.753 ( 6.049 2.201 -0.205) 6.440 6.056 ( -2.201 0.517 -7.285) 7.628 6.107 ( -2.043 -0.338 7.367) 7.653 6.858 ( 8.202 -1.173 -1.609) 8.440 8.685 ( 0.156 0.520 -0.429) 0.692 10.287 ( 4.029 -18.361 -0.684) 18.810 11.391 ( 4.052 -10.895 -3.422) 12.117 13.130 ( -1.256 -0.099 3.504) 3.724 14.455 ( -1.647 -0.005 -0.464) 1.711 14.548 ( 0.022 0.663 2.740) 2.819 15.069 ( 2.406 3.389 0.160) 4.160 15.735 ( -2.798 -1.741 -4.413) 5.508 16.714 ( -9.394 1.440 0.190) 9.506 17.960 ( -13.388 9.445 -0.952) 16.412 19.295 ( 4.845 2.077 -3.334) 6.238 19.887 ( -0.713 1.299 1.330) 1.992 20.999 ( 5.924 3.525 1.360) 7.026 55.737 ( -1.522 1.332 13.811) 13.958 57.063 ( 8.652 11.039 0.285) 14.029 ======================= Grid point 460 (221/322) ======================= q-point: (-0.08 -0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.409 ( -14.395 5.465 0.304) 15.401 1.951 ( -3.062 -7.827 15.073) 17.258 2.398 ( -16.423 -0.734 -0.380) 16.444 2.843 ( -6.411 3.290 -3.569) 8.041 3.445 ( 1.937 -6.863 -2.138) 7.445 3.755 ( 11.604 5.062 -1.217) 12.718 3.947 ( -5.513 2.798 -3.505) 7.107 4.168 ( 2.750 -11.416 5.212) 12.847 4.509 ( -3.159 -2.960 -2.169) 4.842 4.792 ( 6.672 3.627 -3.978) 8.573 5.140 ( -0.188 -4.642 1.587) 4.910 5.741 ( 4.727 3.028 -0.961) 5.696 5.973 ( -3.240 2.527 -2.657) 4.893 6.177 ( -0.727 -4.356 5.129) 6.768 6.913 ( 5.391 0.352 -1.588) 5.631 8.673 ( -0.073 0.649 -0.851) 1.073 10.645 ( 1.563 -16.381 -0.305) 16.458 11.633 ( 7.069 -10.330 -6.561) 14.132 13.130 ( -1.546 -0.359 4.597) 4.863 14.451 ( -0.988 -0.632 -0.029) 1.173 14.541 ( -0.096 0.404 2.382) 2.418 15.002 ( -0.266 4.067 -0.389) 4.094 15.760 ( -0.978 -2.828 -3.528) 4.626 16.625 ( -7.605 1.378 0.794) 7.770 17.702 ( -11.778 7.269 1.742) 13.950 19.275 ( 3.364 2.594 -2.202) 4.785 19.864 ( -0.302 0.947 1.067) 1.458 20.971 ( 5.076 3.607 -0.704) 6.267 55.730 ( -1.660 0.302 13.158) 13.266 56.896 ( 7.155 12.057 -1.147) 14.067 ======================= Grid point 470 (222/322) ======================= q-point: (-0.31 -0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.901 ( -11.803 -0.000 7.428) 13.946 1.771 ( -13.353 -0.000 27.925) 30.953 2.769 ( -23.323 -0.000 -1.794) 23.392 2.769 ( 6.260 0.000 -5.881) 8.589 3.076 ( 8.316 0.000 12.434) 14.958 3.127 ( -14.000 -0.000 7.195) 15.740 3.855 ( 4.258 0.000 -12.946) 13.628 4.226 ( 9.264 0.000 2.829) 9.686 4.660 ( -15.390 -0.000 -10.217) 18.472 4.779 ( 1.166 0.000 -1.638) 2.011 5.070 ( -0.267 -0.000 5.308) 5.315 5.808 ( 0.677 0.000 5.656) 5.697 5.837 ( -1.839 -0.000 -2.077) 2.774 6.342 ( 5.630 0.000 -9.951) 11.433 6.716 ( 14.299 0.000 -0.286) 14.302 8.711 ( 0.094 0.000 -0.279) 0.294 9.539 ( 4.664 0.000 1.362) 4.858 11.008 ( -2.561 -0.000 3.116) 4.033 13.133 ( -0.278 -0.000 2.086) 2.104 14.486 ( -2.568 -0.000 -0.834) 2.700 14.572 ( -0.189 -0.000 3.423) 3.428 15.136 ( 5.602 0.000 0.488) 5.623 15.739 ( -3.764 -0.000 -5.316) 6.514 16.838 ( -10.841 -0.000 -1.909) 11.008 18.414 ( -10.876 -0.000 -6.596) 12.720 19.323 ( 6.797 0.000 -5.126) 8.513 19.951 ( -1.789 -0.000 1.934) 2.635 21.078 ( 6.576 0.000 4.664) 8.062 55.783 ( 0.144 0.000 15.801) 15.802 57.357 ( 9.600 0.000 1.972) 9.801 ======================= Grid point 471 (223/322) ======================= q-point: (-0.23 -0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.027 ( -10.855 -16.680 8.091) 21.483 1.730 ( -11.143 -0.546 25.628) 27.951 2.540 ( -32.100 0.377 -0.713) 32.110 2.897 ( 2.581 -7.513 -5.800) 9.836 3.068 ( -5.461 -0.951 5.413) 7.747 3.225 ( 8.083 -7.248 12.767) 16.759 3.862 ( 6.366 0.862 -9.095) 11.135 4.309 ( 9.743 -0.487 3.298) 10.297 4.452 ( -17.541 5.573 -14.365) 23.348 4.823 ( 1.127 -3.531 -1.692) 4.074 5.070 ( 3.415 2.477 6.813) 8.014 5.794 ( 1.395 0.664 0.899) 1.787 5.885 ( -2.680 -4.531 1.317) 5.427 6.308 ( 1.798 4.770 -9.763) 11.014 6.820 ( 12.751 -0.466 -0.615) 12.774 8.707 ( 0.461 0.540 0.476) 0.855 9.681 ( 5.209 -10.377 0.185) 11.612 11.047 ( -1.525 -5.485 1.900) 6.002 13.135 ( -0.090 0.175 2.902) 2.909 14.463 ( -2.466 0.244 -0.762) 2.593 14.573 ( -0.106 0.441 3.521) 3.551 15.164 ( 5.039 1.341 -0.253) 5.220 15.695 ( -5.829 -0.362 -7.208) 9.277 16.750 ( -11.169 0.499 -0.961) 11.222 18.271 ( -11.896 5.167 -6.671) 14.585 19.351 ( 5.293 0.772 -5.082) 7.378 19.932 ( -1.780 0.782 1.565) 2.496 21.116 ( 6.917 1.939 4.408) 8.429 55.815 ( 4.295 1.760 20.532) 21.050 57.385 ( 9.792 4.730 1.836) 11.028 ======================= Grid point 472 (224/322) ======================= q-point: (-0.15 -0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.266 ( -12.325 -12.971 8.530) 19.822 1.717 ( -11.922 -3.037 19.088) 22.709 2.341 ( -26.313 -2.899 -0.762) 26.483 2.969 ( 0.109 0.548 -0.223) 0.601 3.106 ( -5.884 -6.280 2.495) 8.960 3.538 ( 5.980 -16.635 8.616) 19.666 3.893 ( 9.930 1.129 -2.914) 10.410 4.190 ( -10.253 7.332 -16.549) 20.803 4.391 ( 5.938 -1.464 1.229) 6.238 4.907 ( 1.362 -3.657 -0.733) 3.970 5.044 ( 3.963 3.636 4.677) 7.127 5.802 ( 1.728 0.157 0.381) 1.776 5.967 ( -1.509 -5.167 -0.085) 5.384 6.172 ( -3.679 6.229 -5.350) 8.998 6.910 ( 10.124 -0.204 -1.171) 10.194 8.700 ( 0.555 0.776 0.575) 1.114 9.980 ( 4.404 -16.085 -1.027) 16.709 11.206 ( 2.817 -10.374 -1.858) 10.910 13.134 ( -0.266 0.372 3.882) 3.909 14.442 ( -1.955 0.095 -0.550) 2.033 14.566 ( -0.074 0.715 3.229) 3.309 15.146 ( 1.498 3.047 -1.584) 3.746 15.661 ( -5.059 -1.878 -6.393) 8.366 16.660 ( -10.444 0.573 0.253) 10.463 18.035 ( -12.868 8.477 -4.267) 15.989 19.354 ( 3.950 1.469 -4.555) 6.206 19.905 ( -1.365 1.022 1.317) 2.154 21.119 ( 6.668 3.499 3.418) 8.269 55.832 ( 5.618 4.093 22.057) 23.126 57.324 ( 8.959 8.942 1.135) 12.708 ======================= Grid point 473 (225/322) ======================= q-point: (-0.08 -0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.322 ( -16.402 -2.974 4.607) 17.295 1.769 ( -8.889 -8.233 16.702) 20.634 2.259 ( -15.390 -3.045 -0.634) 15.701 2.892 ( -3.915 5.433 -1.071) 6.782 3.232 ( -5.353 -10.666 2.736) 12.244 3.864 ( -8.989 -9.223 -3.248) 13.282 3.948 ( 10.217 -1.354 3.952) 11.038 4.027 ( 9.601 2.154 -10.485) 14.379 4.460 ( 4.339 -1.736 0.445) 4.694 4.924 ( 3.909 4.213 -1.557) 5.955 5.050 ( -0.604 -2.926 2.317) 3.781 5.803 ( 1.269 1.130 0.032) 1.700 5.986 ( -4.590 2.483 -7.509) 9.144 6.104 ( -0.970 -3.624 6.155) 7.208 6.967 ( 7.231 0.700 -1.454) 7.409 8.686 ( 0.200 0.912 -0.089) 0.938 10.327 ( 1.787 -17.349 -0.538) 17.449 11.460 ( 7.462 -12.058 -6.673) 15.672 13.131 ( -0.533 0.347 4.969) 5.010 14.432 ( -1.202 -0.433 -0.195) 1.292 14.556 ( -0.179 0.755 2.616) 2.729 15.067 ( -3.082 3.789 -2.499) 5.486 15.681 ( -1.448 -3.448 -3.947) 5.437 16.581 ( -8.952 0.360 0.928) 9.007 17.771 ( -11.954 8.548 -0.901) 14.724 19.338 ( 2.778 2.078 -3.632) 5.023 19.880 ( -0.806 0.903 1.124) 1.652 21.092 ( 5.890 4.480 1.688) 7.590 55.813 ( 4.119 4.924 20.535) 21.515 57.181 ( 7.315 11.890 -0.092) 13.961 ======================= Grid point 484 (226/322) ======================= q-point: (-0.23 -0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.777 ( -9.319 -0.000 11.559) 14.847 1.701 ( -10.868 -0.000 28.879) 30.856 2.276 ( -37.821 -0.000 2.921) 37.934 2.813 ( 3.633 0.000 -10.008) 10.647 3.038 ( -6.171 -0.000 7.195) 9.479 3.247 ( 9.095 0.000 12.009) 15.065 3.892 ( 5.743 0.000 -8.910) 10.600 4.280 ( -15.928 -0.000 -7.572) 17.636 4.468 ( 9.436 0.000 -2.880) 9.866 4.786 ( 0.724 0.000 -2.335) 2.445 5.137 ( 4.416 0.000 7.631) 8.817 5.800 ( -2.215 -0.000 -2.286) 3.183 5.822 ( -0.674 -0.000 3.556) 3.619 6.346 ( -0.777 -0.000 -13.932) 13.954 6.908 ( 11.962 0.000 -0.478) 11.972 8.720 ( 1.017 0.000 1.504) 1.816 9.615 ( 5.050 0.000 0.687) 5.097 10.976 ( -3.117 -0.000 2.904) 4.260 13.144 ( 0.389 0.000 3.559) 3.580 14.446 ( -2.433 -0.000 -0.682) 2.527 14.582 ( -0.148 -0.000 3.852) 3.855 15.209 ( 3.479 0.000 -2.311) 4.177 15.627 ( -7.512 -0.000 -8.865) 11.620 16.672 ( -11.097 -0.000 -0.442) 11.106 18.225 ( -11.584 -0.000 -8.844) 14.574 19.384 ( 4.147 0.000 -5.426) 6.830 19.928 ( -2.050 -0.000 1.399) 2.482 21.195 ( 7.006 0.000 4.856) 8.525 55.938 ( 12.383 0.000 27.130) 29.823 57.507 ( 9.756 0.000 2.175) 9.995 ======================= Grid point 485 (227/322) ======================= q-point: (-0.15 -0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.916 ( -8.724 -15.128 10.910) 20.591 1.631 ( -18.367 0.476 20.707) 27.683 2.068 ( -27.174 -3.469 8.612) 28.717 2.904 ( 1.502 -6.753 -8.542) 10.992 3.006 ( -6.288 -0.816 6.236) 8.893 3.379 ( 6.804 -5.813 10.830) 14.049 3.937 ( 5.585 -1.000 -4.665) 7.345 4.123 ( -15.371 0.155 -16.550) 22.588 4.518 ( 13.909 3.965 2.754) 14.723 4.831 ( 0.619 -3.855 -1.480) 4.175 5.155 ( 4.787 2.779 5.781) 8.004 5.796 ( -0.923 -0.969 -0.777) 1.547 5.860 ( -1.245 -4.188 1.430) 4.598 6.240 ( -6.679 5.373 -12.856) 15.451 6.984 ( 9.934 0.298 -0.897) 9.979 8.725 ( 1.547 0.819 2.281) 2.875 9.753 ( 4.534 -10.017 -0.563) 11.010 11.035 ( -0.617 -7.671 0.672) 7.725 13.150 ( 0.484 0.400 4.392) 4.437 14.428 ( -2.028 0.046 -0.520) 2.094 14.583 ( -0.147 0.466 3.782) 3.813 15.186 ( -3.509 1.979 -6.209) 7.402 15.581 ( -3.832 -1.451 -5.643) 6.973 16.592 ( -10.104 0.204 0.376) 10.113 18.071 ( -12.101 5.352 -7.679) 15.299 19.393 ( 3.110 0.785 -5.307) 6.201 19.910 ( -1.813 0.514 1.423) 2.361 21.231 ( 6.546 2.173 4.619) 8.301 56.049 ( 16.797 5.241 29.528) 34.374 57.528 ( 8.716 5.142 1.905) 10.297 ======================= Grid point 486 (228/322) ======================= q-point: (-0.08 -0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.096 ( -16.024 -8.566 7.778) 19.765 1.564 ( -17.858 -7.077 15.770) 24.853 2.052 ( -11.388 -6.869 6.842) 14.956 2.950 ( -2.582 1.702 0.334) 3.111 3.034 ( -5.218 -5.842 1.863) 8.052 3.593 ( -2.633 -11.451 3.519) 12.266 3.919 ( -5.252 -0.900 -4.698) 7.104 4.125 ( 11.743 -2.732 -13.418) 18.039 4.536 ( 10.727 3.584 2.655) 11.617 4.904 ( -2.010 -3.520 0.681) 4.111 5.121 ( 4.944 4.892 2.050) 7.251 5.806 ( -0.992 -0.661 0.290) 1.227 5.953 ( -0.275 -3.712 -4.056) 5.505 6.059 ( -8.974 2.717 -2.796) 9.784 7.035 ( 7.450 0.902 -1.291) 7.614 8.715 ( 1.086 1.562 1.724) 2.567 10.024 ( 2.182 -14.988 -1.029) 15.181 11.255 ( 5.302 -12.977 -5.745) 15.150 13.150 ( 0.381 0.720 5.394) 5.455 14.416 ( -1.327 -0.258 -0.265) 1.377 14.575 ( -0.211 0.832 3.211) 3.324 15.076 ( -9.923 2.407 -7.270) 12.535 15.612 ( 1.702 -2.805 -1.635) 3.666 16.521 ( -8.665 0.120 0.805) 8.703 17.843 ( -11.450 7.846 -3.912) 14.421 19.382 ( 2.107 1.449 -4.752) 5.397 19.890 ( -1.253 0.656 1.431) 2.012 21.222 ( 5.706 3.982 3.557) 7.815 56.060 ( 13.935 9.994 28.170) 32.979 57.444 ( 6.829 9.641 0.923) 11.850 ======================= Grid point 498 (229/322) ======================= q-point: (-0.15 -0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.712 ( -5.606 -0.000 14.828) 15.852 1.451 ( -38.101 -0.000 9.753) 39.329 1.936 ( -9.611 -0.000 27.800) 29.414 2.813 ( 1.579 0.000 -12.539) 12.638 2.961 ( -7.061 -0.000 5.295) 8.826 3.405 ( 7.042 0.000 10.929) 13.001 3.960 ( 6.643 0.000 -5.250) 8.467 3.965 ( -18.073 -0.000 -13.276) 22.425 4.679 ( 14.390 0.000 2.258) 14.566 4.783 ( -0.013 -0.000 -3.117) 3.117 5.229 ( 5.309 0.000 5.754) 7.829 5.761 ( -1.996 -0.000 -2.486) 3.188 5.820 ( -0.721 -0.000 2.602) 2.700 6.205 ( -11.872 -0.000 -16.841) 20.605 7.053 ( 8.298 0.000 -1.014) 8.360 8.757 ( 2.908 0.000 3.897) 4.862 9.685 ( 4.215 0.000 0.018) 4.215 10.939 ( -3.136 -0.000 2.798) 4.202 13.167 ( 0.855 0.000 5.028) 5.100 14.413 ( -1.797 -0.000 -0.419) 1.846 14.593 ( -0.142 -0.000 4.088) 4.090 15.129 ( -13.201 -0.000 -12.154) 17.944 15.557 ( 2.827 0.000 -0.800) 2.938 16.525 ( -8.900 -0.000 0.517) 8.915 18.024 ( -11.754 -0.000 -9.061) 14.841 19.412 ( 2.424 0.000 -5.675) 6.171 19.904 ( -1.752 -0.000 1.801) 2.512 21.305 ( 5.803 0.000 4.999) 7.659 56.329 ( 27.697 0.000 30.760) 41.392 57.643 ( 7.630 0.000 2.164) 7.931 ======================= Grid point 499 (230/322) ======================= q-point: (-0.08 -0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.828 ( -10.530 -9.375 12.214) 18.653 1.238 ( -33.859 -8.594 8.278) 35.901 1.950 ( -2.469 -0.971 26.457) 26.590 2.883 ( -0.725 -6.273 -8.060) 10.239 2.928 ( -6.030 -1.463 3.065) 6.921 3.473 ( 1.094 -1.361 7.340) 7.545 3.829 ( -10.551 -1.251 -9.473) 14.235 4.076 ( 8.636 -6.517 -7.356) 13.083 4.701 ( 8.902 4.309 -0.914) 9.932 4.834 ( 0.279 -2.724 0.053) 2.738 5.246 ( 5.997 3.268 3.060) 7.483 5.772 ( -1.690 -1.862 -1.038) 2.720 5.860 ( 0.678 -4.452 0.936) 4.599 6.032 ( -15.073 3.765 -12.067) 19.672 7.098 ( 6.168 0.633 -1.234) 6.322 8.768 ( 2.807 1.855 3.859) 5.120 9.803 ( 2.595 -9.034 -0.823) 9.435 11.033 ( 0.361 -10.689 -1.477) 10.797 13.177 ( 0.956 0.552 5.834) 5.938 14.402 ( -1.261 -0.153 -0.259) 1.296 14.593 ( -0.148 0.572 3.857) 3.902 14.987 ( -16.714 0.419 -11.302) 20.181 15.606 ( 6.452 -1.063 1.809) 6.785 16.466 ( -7.353 0.097 0.402) 7.364 17.878 ( -10.913 4.792 -6.426) 13.541 19.409 ( 1.603 0.844 -5.605) 5.891 19.893 ( -1.259 0.356 2.174) 2.537 21.329 ( 4.725 2.312 4.590) 6.981 56.476 ( 26.970 11.516 28.313) 40.763 57.640 ( 5.558 5.581 1.593) 8.036 ======================= Grid point 512 (231/322) ======================= q-point: (-0.08 -0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.708 ( -2.172 -0.000 16.367) 16.510 0.858 ( -41.408 -0.000 7.193) 42.028 2.003 ( -0.267 -0.000 37.821) 37.822 2.779 ( -0.334 -0.000 -13.584) 13.588 2.879 ( -5.055 -0.000 1.302) 5.220 3.514 ( 3.132 0.000 9.654) 10.149 3.702 ( -11.841 -0.000 -11.872) 16.767 4.047 ( 6.966 0.000 -2.606) 7.438 4.765 ( -0.844 -0.000 -3.902) 3.992 4.832 ( 4.384 0.000 -0.060) 4.385 5.334 ( 7.212 0.000 1.629) 7.393 5.729 ( -1.155 -0.000 -2.607) 2.852 5.819 ( -1.947 -0.000 2.878) 3.474 5.934 ( -14.230 -0.000 -11.918) 18.562 7.141 ( 4.261 0.000 -1.252) 4.441 8.824 ( 3.921 0.000 4.395) 5.890 9.732 ( 2.199 0.000 -0.469) 2.248 10.907 ( -2.453 -0.000 2.813) 3.732 13.201 ( 1.193 0.000 6.356) 6.467 14.392 ( -0.934 -0.000 -0.180) 0.952 14.605 ( -0.052 -0.000 4.139) 4.140 14.844 ( -16.655 -0.000 -10.035) 19.445 15.656 ( 8.119 0.000 3.074) 8.682 16.420 ( -5.476 -0.000 -0.175) 5.478 17.838 ( -9.897 -0.000 -6.427) 11.801 19.418 ( 1.007 0.000 -6.214) 6.295 19.893 ( -0.775 -0.000 3.021) 3.119 21.389 ( 3.302 0.000 4.786) 5.815 56.876 ( 32.555 0.000 18.549) 37.469 57.732 ( 3.416 0.000 1.465) 3.717 ======================= Grid point 513 (232/322) ======================= q-point: ( 0.00 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.688 ( 1.783 0.000 4.262) 4.620 0.995 ( 0.209 0.000 7.270) 7.273 2.499 ( -0.873 -0.000 -6.798) 6.854 2.637 ( -2.381 -0.000 12.869) 13.087 2.818 ( 2.264 0.000 -1.378) 2.650 3.421 ( -0.986 -0.000 -3.651) 3.782 3.719 ( -1.829 -0.000 6.224) 6.488 4.073 ( 3.965 0.000 -3.578) 5.340 4.671 ( -0.788 -0.000 -1.771) 1.939 4.956 ( -5.938 -0.000 13.816) 15.038 5.263 ( 1.888 0.000 -10.683) 10.848 5.674 ( 0.064 0.000 -1.093) 1.094 5.714 ( -1.640 -0.000 -0.559) 1.733 5.865 ( 2.908 0.000 -0.831) 3.025 7.148 ( 0.143 0.000 -0.654) 0.670 8.893 ( 0.729 0.000 -0.641) 0.971 9.733 ( -0.265 -0.000 -0.248) 0.363 10.933 ( -0.503 -0.000 1.231) 1.330 13.376 ( 0.758 0.000 4.771) 4.831 14.387 ( -0.015 -0.000 0.136) 0.137 14.546 ( -1.980 -0.000 -3.943) 4.412 14.677 ( 0.033 0.000 1.627) 1.627 15.798 ( 1.814 0.000 0.714) 1.950 16.361 ( 0.038 0.000 -0.403) 0.405 17.669 ( -1.777 -0.000 -0.980) 2.029 19.298 ( -0.277 -0.000 -2.984) 2.997 19.968 ( 0.158 0.000 2.104) 2.110 21.486 ( -0.129 -0.000 1.504) 1.510 57.358 ( 5.466 0.000 2.421) 5.978 57.746 ( -1.147 -0.000 -0.283) 1.182 ======================= Grid point 514 (233/322) ======================= q-point: ( 0.08 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.816 ( 20.588 -2.190 1.763) 20.779 1.217 ( 3.830 -18.256 6.138) 19.637 2.310 ( -3.192 9.144 -1.137) 9.752 2.751 ( -10.069 -8.108 2.793) 13.227 2.935 ( 12.675 -5.276 2.157) 13.898 3.346 ( 3.327 7.173 -1.946) 8.144 3.770 ( -3.594 -5.929 4.799) 8.432 4.152 ( 1.672 -6.093 -6.132) 8.804 4.670 ( 0.042 -0.453 -1.027) 1.123 4.902 ( -9.181 2.312 15.374) 18.056 5.216 ( 0.458 3.487 -9.483) 10.114 5.715 ( 0.766 -0.620 -0.073) 0.988 5.732 ( 0.619 -4.572 -0.747) 4.674 5.919 ( 5.218 -3.071 -2.174) 6.433 7.132 ( -1.803 0.913 -0.656) 2.124 8.862 ( -0.583 3.015 -0.334) 3.089 9.809 ( -1.046 -8.362 -0.301) 8.433 11.003 ( 0.008 -6.924 0.322) 6.931 13.380 ( -0.078 0.586 3.556) 3.605 14.391 ( 0.253 -0.283 0.173) 0.417 14.553 ( 2.807 -0.656 -1.975) 3.494 14.673 ( 0.213 0.507 1.201) 1.321 15.797 ( -2.850 -0.417 -0.680) 2.959 16.376 ( 4.714 0.216 -0.299) 4.729 17.644 ( 1.001 2.188 0.487) 2.455 19.289 ( -0.735 0.135 -2.204) 2.327 19.961 ( 0.058 1.082 1.649) 1.973 21.454 ( -1.803 2.829 1.221) 3.570 57.250 ( -2.460 11.588 -0.171) 11.847 57.676 ( -1.841 6.101 0.416) 6.387 ======================= Grid point 515 (234/322) ======================= q-point: ( 0.15 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.022 ( 20.419 -2.782 0.523) 20.614 1.650 ( 9.093 -17.785 6.636) 21.048 2.165 ( -2.049 2.999 -4.934) 6.127 2.840 ( -4.494 -7.100 3.619) 9.149 3.120 ( 7.411 -4.770 2.097) 9.060 3.226 ( 8.319 8.126 -1.754) 11.761 3.892 ( -6.408 -8.981 4.182) 11.799 4.277 ( -0.802 -7.256 -8.950) 11.549 4.669 ( -0.918 1.110 -1.142) 1.838 4.798 ( -9.596 3.247 15.204) 18.270 5.130 ( 1.425 3.856 -7.052) 8.163 5.745 ( 2.376 -1.171 -0.251) 2.661 5.805 ( 0.556 -2.053 0.204) 2.137 6.057 ( 5.130 -7.066 -2.645) 9.124 7.087 ( -3.599 1.607 -0.590) 3.985 8.782 ( -1.737 3.996 0.867) 4.443 10.029 ( -0.910 -14.961 -0.750) 15.007 11.176 ( -0.427 -10.689 -1.204) 10.765 13.365 ( -0.902 1.047 2.243) 2.634 14.402 ( 0.204 -0.569 0.338) 0.693 14.582 ( 3.581 0.824 0.163) 3.678 14.686 ( 3.058 -1.191 0.689) 3.353 15.774 ( -5.953 -0.880 -1.781) 6.275 16.418 ( 7.930 0.319 -0.075) 7.937 17.608 ( 3.943 3.398 1.478) 5.411 19.275 ( -1.194 0.296 -1.309) 1.796 19.936 ( -0.054 1.653 1.254) 2.076 21.359 ( -3.158 5.178 0.667) 6.101 56.931 ( -5.886 16.794 -1.086) 17.829 57.488 ( -3.678 11.271 0.873) 11.888 ======================= Grid point 516 (235/322) ======================= q-point: ( 0.23 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.195 ( 15.468 -0.788 1.181) 15.533 1.969 ( 9.070 -6.827 8.814) 14.372 2.139 ( 1.509 -0.542 -8.288) 8.442 3.005 ( 0.074 -11.487 5.067) 12.555 3.122 ( 5.116 3.888 -9.966) 11.858 3.288 ( 12.014 -2.351 6.347) 13.789 3.990 ( -10.681 -5.772 3.904) 12.753 4.381 ( -2.051 -6.038 -9.152) 11.154 4.574 ( -5.581 5.268 0.259) 7.679 4.720 ( -6.769 1.099 10.446) 12.495 5.100 ( 4.789 0.349 -4.113) 6.322 5.783 ( 1.530 -0.693 0.135) 1.685 5.825 ( 1.191 0.119 0.714) 1.393 6.219 ( 3.552 -6.249 -2.443) 7.592 7.020 ( -4.781 1.913 -0.457) 5.170 8.701 ( -1.959 2.995 1.661) 3.946 10.345 ( -0.609 -18.017 -1.121) 18.062 11.382 ( -1.226 -11.178 -2.153) 11.449 13.337 ( -1.480 1.215 1.191) 2.255 14.417 ( -0.027 -0.894 0.622) 1.089 14.573 ( 1.719 1.586 0.715) 2.446 14.759 ( 5.954 -1.999 1.516) 6.461 15.747 ( -6.585 -1.550 -2.205) 7.115 16.474 ( 9.056 0.401 0.189) 9.067 17.582 ( 6.479 3.361 1.722) 7.499 19.254 ( -1.729 0.625 -0.445) 1.891 19.905 ( -0.108 1.593 0.988) 1.878 21.218 ( -3.948 6.599 -0.154) 7.691 56.569 ( -5.131 15.411 -2.114) 16.380 57.207 ( -5.428 14.312 1.200) 15.354 ======================= Grid point 517 (236/322) ======================= q-point: ( 0.31 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.244 ( 7.597 5.565 2.154) 9.660 2.122 ( 11.377 -0.923 5.971) 12.882 2.157 ( 2.649 -1.957 -2.606) 4.200 3.086 ( 3.590 1.312 -14.262) 14.765 3.265 ( 4.645 -10.953 2.700) 12.200 3.434 ( 11.122 -2.675 6.108) 12.968 3.953 ( -13.474 0.470 3.273) 13.874 4.412 ( -6.040 0.024 -0.842) 6.098 4.455 ( -1.636 2.542 -1.886) 3.563 4.715 ( -4.708 -4.629 3.330) 7.395 5.152 ( 5.209 -1.643 -2.161) 5.875 5.753 ( -2.270 3.282 1.891) 4.416 5.856 ( 3.383 -1.197 -0.060) 3.589 6.329 ( 1.874 -3.662 -2.168) 4.650 6.948 ( -4.787 1.771 -0.324) 5.114 8.650 ( -1.455 1.359 1.734) 2.640 10.679 ( -0.545 -16.643 -1.267) 16.700 11.567 ( -1.369 -9.273 -2.728) 9.762 13.304 ( -1.659 1.016 0.734) 2.079 14.438 ( -0.221 -1.280 0.922) 1.593 14.560 ( 1.199 0.902 0.639) 1.631 14.831 ( 4.597 -0.772 1.954) 5.055 15.739 ( -5.006 -2.425 -1.708) 5.819 16.528 ( 8.188 0.699 0.453) 8.231 17.583 ( 7.819 2.145 1.497) 8.245 19.223 ( -2.228 1.063 0.290) 2.486 19.879 ( -0.136 1.186 0.803) 1.439 21.059 ( -3.895 6.649 -1.098) 7.784 56.288 ( -2.346 10.106 -2.886) 10.768 56.882 ( -6.328 14.856 1.482) 16.215 ======================= Grid point 518 (237/322) ======================= q-point: ( 0.38 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.109 ( 0.623 10.404 1.686) 10.558 2.202 ( 13.446 1.412 5.809) 14.715 2.278 ( 2.651 -7.056 0.917) 7.593 3.044 ( 0.577 3.245 -15.468) 15.815 3.445 ( 2.360 -4.762 -1.480) 5.516 3.540 ( 6.336 0.519 3.848) 7.431 3.854 ( -7.725 0.015 4.575) 8.978 4.376 ( -4.959 -1.478 4.731) 7.012 4.407 ( -1.520 1.664 -1.447) 2.678 4.827 ( -0.144 -8.169 -2.670) 8.595 5.199 ( 2.413 0.289 -0.673) 2.522 5.656 ( -2.651 4.625 1.971) 5.683 5.903 ( 2.545 -1.205 -0.014) 2.816 6.385 ( 0.653 -1.635 -1.513) 2.322 6.887 ( -3.583 1.264 -0.266) 3.808 8.631 ( -0.765 0.164 1.271) 1.493 10.947 ( -0.667 -11.322 -1.036) 11.389 11.703 ( -0.512 -5.910 -3.241) 6.760 13.278 ( -1.450 0.664 0.992) 1.878 14.465 ( -0.345 -1.474 0.928) 1.776 14.559 ( 1.020 0.179 0.752) 1.280 14.857 ( 1.732 0.598 1.244) 2.214 15.761 ( -2.569 -2.766 -0.769) 3.853 16.564 ( 5.673 0.961 0.609) 5.786 17.614 ( 6.740 0.656 1.362) 6.908 19.185 ( -2.169 1.136 0.664) 2.536 19.861 ( -0.141 0.694 0.655) 0.964 20.916 ( -2.809 5.064 -1.859) 6.082 56.143 ( 0.516 4.020 -2.290) 4.655 56.570 ( -6.077 12.548 1.308) 14.004 ======================= Grid point 519 (238/322) ======================= q-point: ( 0.46 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.942 ( -1.429 4.428 -0.533) 4.683 2.272 ( 8.088 0.906 5.506) 9.826 2.452 ( 2.664 -8.010 4.263) 9.457 2.891 ( -4.246 8.346 -13.546) 16.467 3.485 ( -0.235 3.566 4.959) 6.113 3.541 ( 0.608 -3.172 -7.233) 7.922 3.883 ( 1.670 -2.610 4.591) 5.539 4.357 ( -2.594 0.653 -3.090) 4.087 4.411 ( -1.517 -2.259 6.052) 6.635 4.994 ( 3.308 -7.414 -4.735) 9.398 5.149 ( -1.832 4.845 1.657) 5.438 5.579 ( -0.149 1.769 0.490) 1.841 5.933 ( 0.850 -0.542 0.038) 1.009 6.400 ( 0.045 0.140 -0.067) 0.162 6.852 ( -1.548 0.278 -0.410) 1.625 8.631 ( -0.246 -0.305 0.536) 0.664 11.088 ( -0.656 -3.766 -0.334) 3.837 11.774 ( 0.943 -1.876 -3.695) 4.250 13.260 ( -1.003 0.543 1.813) 2.142 14.486 ( -0.404 -0.732 0.559) 1.006 14.568 ( 0.684 -0.186 1.056) 1.272 14.851 ( 0.048 0.317 0.195) 0.376 15.793 ( -0.782 -1.585 -0.500) 1.837 16.578 ( 2.130 0.467 0.528) 2.244 17.645 ( 2.384 0.215 1.765) 2.974 19.160 ( -0.897 0.235 0.366) 0.997 19.852 ( -0.096 0.194 0.528) 0.571 20.829 ( -0.824 2.074 -2.061) 3.038 56.102 ( 0.497 2.565 2.640) 3.715 56.358 ( -2.679 4.036 -2.068) 5.267 ======================= Grid point 520 (239/322) ======================= q-point: (-0.46 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.965 ( -0.773 -7.552 -2.648) 8.040 2.292 ( -1.040 0.435 3.305) 3.492 2.547 ( -5.434 3.974 1.834) 6.977 2.715 ( -0.999 0.145 -2.852) 3.025 3.426 ( 1.983 2.011 3.458) 4.464 3.612 ( 0.034 -3.699 -6.942) 7.866 3.928 ( 2.048 0.271 0.392) 2.103 4.344 ( -0.829 -1.304 -2.105) 2.612 4.448 ( -0.128 -1.234 3.187) 3.420 4.956 ( -1.088 9.073 -1.439) 9.251 5.168 ( 1.420 -4.331 -0.298) 4.567 5.592 ( 2.163 -2.257 -0.879) 3.247 5.934 ( -1.158 0.357 -0.062) 1.213 6.382 ( 0.014 1.786 1.780) 2.522 6.855 ( 0.841 -0.911 -0.678) 1.413 8.638 ( 0.043 -0.368 -0.149) 0.399 11.079 ( -0.319 4.231 0.494) 4.271 11.776 ( 2.409 2.286 -3.938) 5.152 13.248 ( -0.433 0.625 2.949) 3.045 14.488 ( -0.145 0.429 0.390) 0.598 14.571 ( -0.314 0.224 0.789) 0.878 14.861 ( -0.293 -1.561 -0.676) 1.726 15.798 ( 0.268 0.796 -1.036) 1.333 16.581 ( -1.751 -0.516 0.277) 1.846 17.639 ( -3.516 0.293 2.379) 4.255 19.169 ( 1.018 -1.167 -0.545) 1.641 19.854 ( -0.049 -0.291 0.416) 0.510 20.823 ( 1.514 -1.537 -1.531) 2.645 56.024 ( -2.025 4.260 8.421) 9.652 56.409 ( 3.318 -7.964 -5.161) 10.053 ======================= Grid point 521 (240/322) ======================= q-point: (-0.38 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.146 ( -2.370 -10.596 -1.932) 11.028 2.257 ( -8.137 -0.251 0.813) 8.181 2.324 ( -8.762 9.315 -1.628) 12.892 2.774 ( -1.363 -2.842 9.116) 9.646 3.443 ( 3.133 0.467 -2.299) 3.914 3.627 ( -4.869 -0.402 -4.489) 6.634 3.932 ( 6.216 0.683 -2.311) 6.667 4.366 ( 0.397 -0.116 1.107) 1.182 4.469 ( 1.274 -0.430 -1.692) 2.161 4.794 ( 2.702 6.366 -0.705) 6.952 5.198 ( -2.122 0.893 -0.258) 2.317 5.681 ( 2.863 -4.397 -0.800) 5.308 5.906 ( -2.833 0.827 -0.489) 2.992 6.342 ( 0.218 2.895 3.028) 4.195 6.893 ( 3.046 -1.649 -0.859) 3.569 8.646 ( 0.244 -0.571 -0.415) 0.746 10.928 ( 0.175 11.383 0.866) 11.417 11.709 ( 3.468 6.139 -4.009) 8.111 13.242 ( 0.263 0.409 4.192) 4.220 14.472 ( 0.021 1.176 0.255) 1.204 14.563 ( -0.898 -0.004 0.402) 0.983 14.893 ( -1.708 -2.272 -2.014) 3.484 15.766 ( 1.448 2.810 -1.270) 3.407 16.569 ( -5.243 -0.754 0.107) 5.298 17.604 ( -7.502 -0.968 2.250) 7.892 19.209 ( 2.016 -1.755 -1.568) 3.099 19.863 ( -0.100 -0.698 0.385) 0.803 20.901 ( 3.468 -4.724 -0.515) 5.883 55.993 ( 0.046 -0.846 11.195) 11.227 56.638 ( 5.051 -12.718 -4.252) 14.330 ======================= Grid point 522 (241/322) ======================= q-point: (-0.31 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.256 ( -9.060 -4.028 0.777) 9.945 2.105 ( -7.758 7.136 3.778) 11.197 2.198 ( -8.256 0.146 -1.437) 8.381 2.834 ( -2.604 -3.969 9.934) 11.010 3.353 ( -2.080 8.530 -5.619) 10.424 3.554 ( -10.621 0.951 -7.190) 12.861 4.019 ( 14.051 -1.453 -2.417) 14.331 4.322 ( 1.095 5.944 5.936) 8.472 4.487 ( 4.650 -0.371 -2.972) 5.531 4.789 ( 4.936 -2.725 -3.721) 6.755 5.124 ( -5.163 3.313 0.852) 6.194 5.769 ( 0.983 -2.896 -0.061) 3.059 5.865 ( -3.454 0.796 -1.056) 3.699 6.281 ( -0.192 4.172 3.014) 5.150 6.955 ( 4.571 -1.920 -0.945) 5.047 8.666 ( 0.543 -1.344 -0.034) 1.450 10.661 ( 0.631 16.306 0.538) 16.327 11.580 ( 3.676 9.257 -4.088) 10.766 13.252 ( 0.996 -0.209 5.287) 5.384 14.447 ( -0.064 1.301 0.087) 1.306 14.566 ( -0.976 -0.918 0.265) 1.365 14.897 ( -5.305 -0.947 -4.182) 6.821 15.722 ( 3.857 3.218 -0.194) 5.027 16.532 ( -7.604 -0.253 0.169) 7.610 17.588 ( -8.457 -3.232 0.979) 9.107 19.252 ( 1.894 -1.428 -2.383) 3.363 19.880 ( -0.247 -1.009 0.624) 1.212 21.042 ( 4.439 -6.554 0.491) 7.931 56.108 ( 4.049 -7.553 13.989) 16.405 56.935 ( 5.244 -14.532 -3.028) 15.744 ======================= Grid point 523 (242/322) ======================= q-point: (-0.23 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.171 ( -16.793 2.485 3.361) 17.305 1.925 ( -8.958 8.577 9.991) 15.926 2.126 ( -1.770 2.109 -3.263) 4.270 2.925 ( -1.812 -4.730 7.672) 9.193 3.136 ( -4.076 8.500 -4.891) 10.621 3.426 ( -12.418 1.792 -9.023) 15.454 4.084 ( 9.734 6.348 -4.557) 12.482 4.216 ( 6.299 6.540 6.967) 11.444 4.563 ( 5.888 -3.477 0.259) 6.843 4.902 ( 4.183 -4.474 -5.614) 8.309 5.034 ( -5.264 0.696 1.361) 5.481 5.794 ( -2.771 -0.369 -0.899) 2.936 5.831 ( -1.628 0.490 -0.339) 1.733 6.178 ( -1.470 6.528 1.966) 6.974 7.025 ( 4.828 -1.891 -0.921) 5.267 8.710 ( 0.998 -2.608 0.762) 2.895 10.335 ( 1.010 17.582 -0.143) 17.611 11.398 ( 2.647 11.121 -3.923) 12.086 13.281 ( 1.528 -0.757 5.958) 6.197 14.423 ( -0.259 1.039 0.058) 1.073 14.585 ( -1.075 -1.735 0.156) 2.047 14.834 ( -8.810 1.127 -5.811) 10.614 15.708 ( 6.725 2.264 1.494) 7.251 16.475 ( -8.299 0.020 0.204) 8.302 17.607 ( -7.599 -4.607 -0.749) 8.918 19.282 ( 1.355 -0.883 -2.976) 3.387 19.901 ( -0.324 -1.261 1.230) 1.791 21.205 ( 4.271 -6.650 1.162) 7.989 56.385 ( 8.741 -13.616 15.512) 22.414 57.245 ( 4.445 -13.988 -1.910) 14.801 ======================= Grid point 524 (243/322) ======================= q-point: (-0.15 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.973 ( -20.279 3.857 5.223) 21.293 1.611 ( -9.272 18.311 9.123) 22.460 2.142 ( 3.602 -3.787 -0.584) 5.259 2.897 ( 2.032 7.050 -2.822) 7.861 3.053 ( -7.334 -0.067 6.769) 9.981 3.316 ( -10.510 -2.812 -8.175) 13.609 3.935 ( 2.292 10.271 1.714) 10.662 4.173 ( 9.331 6.328 -0.534) 11.287 4.662 ( 2.699 -2.310 -0.231) 3.560 4.929 ( -2.207 -0.284 5.549) 5.979 5.100 ( 3.403 -6.168 -7.842) 10.541 5.764 ( -3.746 0.131 -2.172) 4.332 5.804 ( -0.840 1.863 0.135) 2.048 6.021 ( -2.587 7.909 1.022) 8.384 7.089 ( 3.777 -1.524 -0.804) 4.152 8.781 ( 1.403 -3.512 1.144) 3.951 10.027 ( 1.231 14.613 -0.570) 14.676 11.190 ( 0.714 10.837 -2.646) 11.178 13.319 ( 1.672 -0.865 6.070) 6.355 14.404 ( -0.428 0.683 0.100) 0.812 14.611 ( -2.041 -1.922 -0.709) 2.892 14.726 ( -8.129 2.046 -4.733) 9.627 15.732 ( 7.672 1.202 2.272) 8.092 16.418 ( -7.232 -0.071 0.009) 7.233 17.643 ( -6.027 -4.276 -1.963) 7.646 19.297 ( 0.786 -0.477 -3.354) 3.478 19.927 ( -0.187 -1.345 1.954) 2.380 21.351 ( 3.212 -5.250 1.487) 6.332 56.781 ( 12.228 -16.066 13.580) 24.332 57.514 ( 2.691 -11.101 -1.116) 11.477 ======================= Grid point 525 (244/322) ======================= q-point: (-0.08 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.778 ( -17.935 2.234 5.582) 18.916 1.195 ( -4.007 18.475 7.814) 20.456 2.308 ( 3.606 -10.141 0.283) 10.767 2.780 ( 7.648 8.922 -1.068) 11.800 2.909 ( -12.738 5.517 4.958) 14.741 3.370 ( -5.220 -7.078 -4.098) 9.703 3.782 ( -0.158 6.360 4.136) 7.588 4.104 ( 6.574 5.846 -2.230) 9.076 4.682 ( -0.704 -0.023 -2.076) 2.193 4.949 ( -2.572 -1.444 11.009) 11.397 5.217 ( 3.779 -4.144 -10.161) 11.606 5.730 ( -1.482 2.373 -0.943) 2.953 5.740 ( -2.281 2.129 -2.029) 3.721 5.887 ( -0.927 3.662 0.890) 3.881 7.133 ( 2.056 -0.872 -0.688) 2.337 8.856 ( 1.383 -2.770 0.397) 3.121 9.811 ( 0.893 8.174 -0.522) 8.239 11.008 ( -0.685 7.079 -0.200) 7.115 13.354 ( 1.390 -0.546 5.647) 5.841 14.392 ( -0.365 0.329 0.138) 0.511 14.592 ( -6.273 0.317 -5.249) 8.186 14.670 ( -0.632 -0.174 1.300) 1.456 15.771 ( 5.885 0.493 1.880) 6.197 16.377 ( -4.379 -0.143 -0.276) 4.390 17.669 ( -4.102 -2.486 -2.045) 5.214 19.302 ( 0.238 -0.202 -3.401) 3.415 19.953 ( 0.063 -0.965 2.308) 2.503 21.451 ( 1.633 -2.856 1.581) 3.650 57.166 ( 11.697 -11.471 7.990) 18.228 57.691 ( 0.341 -6.108 -0.724) 6.161 ======================= Grid point 527 (245/322) ======================= q-point: ( 0.08 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.028 ( 1.588 0.000 4.622) 4.888 1.048 ( 38.808 0.000 0.370) 38.809 2.461 ( -1.956 -0.000 -3.390) 3.914 2.491 ( -14.472 -0.000 6.760) 15.973 3.004 ( 15.856 0.000 1.027) 15.889 3.463 ( 7.787 0.000 -1.620) 7.954 3.689 ( -5.251 -0.000 6.651) 8.474 4.078 ( -0.676 -0.000 -8.043) 8.072 4.666 ( 0.582 0.000 -0.005) 0.582 4.878 ( -11.288 -0.000 17.201) 20.574 5.228 ( -1.918 -0.000 -9.071) 9.271 5.683 ( 1.563 0.000 -0.816) 1.763 5.722 ( 2.210 0.000 0.099) 2.213 5.938 ( 7.446 0.000 -2.887) 7.986 7.120 ( -3.686 -0.000 -0.699) 3.752 8.886 ( -1.167 -0.000 -1.441) 1.854 9.712 ( -2.600 -0.000 0.251) 2.612 10.940 ( 0.825 0.000 1.542) 1.749 13.387 ( -0.911 -0.000 2.166) 2.350 14.393 ( 0.737 0.000 0.122) 0.747 14.583 ( 7.420 0.000 -0.039) 7.421 14.682 ( -0.015 -0.000 1.032) 1.032 15.758 ( -6.097 -0.000 -2.153) 6.466 16.426 ( 8.250 0.000 -0.394) 8.260 17.683 ( 3.575 0.000 1.657) 3.940 19.280 ( -1.215 -0.000 -1.628) 2.032 19.975 ( 0.037 0.000 1.246) 1.246 21.464 ( -3.547 -0.000 1.236) 3.756 57.310 ( -10.558 -0.000 -5.032) 11.696 57.725 ( -2.352 -0.000 1.262) 2.669 ======================= Grid point 528 (246/322) ======================= q-point: ( 0.15 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.124 ( 12.092 -4.529 1.906) 13.052 1.453 ( 31.563 -11.938 0.918) 33.757 2.228 ( -6.694 7.606 -0.079) 10.133 2.646 ( -5.611 -10.536 2.468) 12.190 3.130 ( 11.869 -1.518 1.493) 12.059 3.449 ( 10.926 7.092 0.468) 13.034 3.712 ( -6.256 -5.254 4.899) 9.526 4.116 ( -2.521 -5.892 -10.452) 12.260 4.675 ( 0.456 0.003 0.097) 0.467 4.800 ( -11.770 1.904 17.313) 21.021 5.173 ( -2.261 2.083 -7.410) 8.023 5.736 ( 1.501 -2.680 0.298) 3.086 5.753 ( 2.548 -1.979 -0.460) 3.259 6.011 ( 8.128 -2.408 -3.136) 9.038 7.077 ( -5.507 0.886 -0.700) 5.622 8.840 ( -2.124 3.079 -0.734) 3.812 9.779 ( -2.869 -9.000 -0.060) 9.447 11.011 ( 0.835 -6.116 0.970) 6.249 13.374 ( -1.632 0.575 0.817) 1.913 14.401 ( 0.958 -0.111 0.197) 0.984 14.638 ( 6.013 1.230 1.570) 6.336 14.694 ( 4.107 -1.069 1.232) 4.418 15.707 ( -7.442 -0.489 -3.079) 8.068 16.490 ( 10.123 0.292 -0.549) 10.142 17.702 ( 6.385 2.041 2.514) 7.159 19.266 ( -1.701 0.096 -0.896) 1.925 19.965 ( 0.002 1.117 0.933) 1.455 21.408 ( -4.946 2.732 0.977) 5.734 57.111 ( -13.803 9.278 -6.667) 17.918 57.637 ( -4.552 6.699 1.638) 8.263 ======================= Grid point 529 (247/322) ======================= q-point: ( 0.23 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.314 ( 17.406 -2.626 1.654) 17.681 1.902 ( 23.222 -11.504 3.014) 26.090 2.110 ( -2.495 0.613 -5.269) 5.862 2.811 ( -1.259 -9.324 4.657) 10.498 3.194 ( 2.801 1.363 -1.625) 3.514 3.427 ( 16.566 4.293 3.742) 17.518 3.793 ( -7.850 -7.089 3.510) 11.144 4.202 ( -4.371 -7.270 -11.840) 14.565 4.623 ( -6.136 4.002 1.875) 7.562 4.726 ( -6.107 1.477 13.106) 14.535 5.121 ( 0.062 0.641 -5.106) 5.147 5.781 ( 1.834 -1.025 0.791) 2.244 5.815 ( 1.020 -2.000 0.001) 2.245 6.137 ( 6.881 -5.114 -3.240) 9.165 7.008 ( -6.990 1.339 -0.540) 7.138 8.753 ( -2.519 3.701 0.831) 4.553 10.002 ( -2.479 -15.731 -0.880) 15.949 11.170 ( 0.021 -9.556 -0.186) 9.558 13.346 ( -2.072 0.956 -0.183) 2.289 14.412 ( 0.951 -0.233 0.394) 1.055 14.624 ( 1.393 2.130 0.979) 2.727 14.782 ( 8.796 -1.529 3.328) 9.528 15.665 ( -6.912 -1.243 -3.193) 7.715 16.557 ( 10.662 0.618 -0.571) 10.695 17.709 ( 9.037 3.397 2.570) 9.991 19.247 ( -2.275 0.271 -0.185) 2.298 19.939 ( 0.007 1.695 0.853) 1.897 21.295 ( -5.784 4.903 0.384) 7.592 56.780 ( -12.146 12.937 -7.233) 19.163 57.419 ( -6.672 11.673 2.122) 13.612 ======================= Grid point 530 (248/322) ======================= q-point: ( 0.31 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.446 ( 17.628 3.472 2.404) 18.127 2.101 ( 2.761 -1.943 -0.283) 3.388 2.211 ( 14.564 -3.618 -0.539) 15.016 3.031 ( 2.182 -11.865 2.811) 12.387 3.157 ( 2.119 1.521 -6.569) 7.068 3.518 ( 14.827 0.304 5.764) 15.911 3.845 ( -8.456 -3.222 3.140) 9.578 4.288 ( -6.240 -7.000 -9.568) 13.398 4.491 ( -5.548 4.027 0.098) 6.856 4.666 ( -5.669 1.889 10.482) 12.065 5.141 ( 2.265 -2.002 -3.143) 4.361 5.783 ( -1.967 1.340 1.616) 2.877 5.857 ( 2.793 -1.331 -0.080) 3.095 6.270 ( 4.608 -4.384 -3.194) 7.118 6.929 ( -7.479 1.045 -0.197) 7.554 8.678 ( -1.917 2.485 1.798) 3.617 10.320 ( -2.378 -18.695 -1.338) 18.893 11.362 ( -0.622 -10.396 -1.388) 10.507 13.310 ( -2.102 0.973 -0.576) 2.387 14.425 ( 0.808 -0.484 0.667) 1.154 14.595 ( 0.922 1.727 0.690) 2.076 14.865 ( 6.490 -0.335 3.923) 7.591 15.651 ( -4.714 -2.356 -2.267) 5.737 16.615 ( 9.936 1.204 -0.367) 10.015 17.715 ( 10.903 3.861 1.983) 11.735 19.221 ( -2.944 0.583 0.441) 3.033 19.907 ( -0.018 1.663 0.867) 1.876 21.145 ( -5.823 6.021 -0.475) 8.389 56.455 ( -7.763 11.240 -7.449) 15.559 57.116 ( -7.800 14.261 2.715) 16.480 ======================= Grid point 531 (249/322) ======================= q-point: ( 0.38 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.406 ( 12.917 12.848 2.490) 18.388 2.189 ( 4.163 -5.013 -0.168) 6.518 2.330 ( 12.769 1.043 4.410) 13.550 3.101 ( 5.012 2.495 -13.511) 14.625 3.300 ( -2.071 -10.373 0.571) 10.593 3.603 ( 5.141 0.666 3.976) 6.533 3.829 ( 0.021 0.282 4.513) 4.521 4.313 ( -6.598 -2.025 2.631) 7.387 4.423 ( -1.997 1.171 -3.553) 4.241 4.664 ( -4.067 -5.648 2.818) 7.509 5.194 ( 1.339 -1.870 -1.733) 2.880 5.712 ( -4.533 3.599 1.674) 6.025 5.901 ( 2.645 -1.042 0.076) 2.844 6.356 ( 2.965 -2.362 -2.942) 4.798 6.865 ( -6.494 0.274 0.245) 6.505 8.638 ( -0.881 0.966 1.866) 2.279 10.653 ( -2.570 -17.295 -1.276) 17.532 11.545 ( -0.500 -9.163 -2.629) 9.545 13.280 ( -1.699 0.623 -0.244) 1.826 14.445 ( 0.646 -0.870 0.890) 1.402 14.577 ( 0.761 0.892 0.529) 1.287 14.895 ( 2.719 1.245 2.988) 4.228 15.680 ( -2.097 -3.323 -0.672) 3.986 16.648 ( 7.922 2.204 -0.019) 8.223 17.726 ( 10.956 3.710 1.315) 11.642 19.185 ( -3.362 0.778 0.881) 3.562 19.880 ( -0.096 1.261 0.820) 1.507 20.990 ( -4.853 5.630 -1.375) 7.559 56.232 ( -2.821 6.479 -7.071) 9.996 56.785 ( -7.958 14.398 3.377) 16.794 ======================= Grid point 532 (250/322) ======================= q-point: ( 0.46 0.08 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.194 ( 9.354 16.092 2.439) 18.772 2.312 ( 1.476 -2.536 -0.132) 2.937 2.411 ( 12.456 -1.466 6.970) 14.348 3.019 ( 2.205 7.529 -13.783) 15.859 3.412 ( -5.170 -6.237 -5.638) 9.870 3.568 ( -2.465 3.588 4.655) 6.373 3.890 ( 9.081 -1.328 4.500) 10.221 4.337 ( -2.354 -1.968 6.163) 6.885 4.372 ( -3.057 0.520 0.244) 3.110 4.818 ( 0.221 -10.776 -4.136) 11.545 5.200 ( -1.871 1.504 -0.216) 2.411 5.609 ( -4.525 2.952 0.488) 5.425 5.931 ( 1.152 -0.486 0.149) 1.259 6.401 ( 2.397 -0.821 -1.863) 3.145 6.828 ( -4.458 -0.542 0.455) 4.513 8.629 ( -0.033 0.056 1.304) 1.305 10.919 ( -2.647 -12.120 -0.662) 12.424 11.690 ( 0.297 -6.410 -3.816) 7.466 13.262 ( -1.025 0.219 0.693) 1.256 14.470 ( 0.477 -1.015 0.863) 1.415 14.573 ( 0.488 0.134 0.571) 0.763 14.877 ( 0.441 1.849 1.635) 2.507 15.736 ( -0.658 -3.272 0.288) 3.349 16.643 ( 4.954 3.108 0.206) 5.851 17.727 ( 7.925 3.880 1.235) 8.910 19.152 ( -2.746 0.238 0.872) 2.891 19.861 ( -0.153 0.717 0.677) 0.998 20.867 ( -2.912 3.591 -1.978) 5.029 56.143 ( 1.268 1.505 -5.486) 5.829 56.479 ( -7.327 11.532 3.563) 14.120 ======================= Grid point 533 (251/322) ======================= q-point: ( 0.54 0.08 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.012 ( 10.054 8.637 1.341) 13.323 2.284 ( -6.463 2.107 -0.945) 6.863 2.580 ( 10.674 -3.100 8.976) 14.287 2.812 ( -1.168 10.268 -10.927) 15.040 3.481 ( -2.803 2.911 4.480) 6.034 3.499 ( -1.537 -5.731 -6.617) 8.888 3.976 ( 8.493 0.464 0.664) 8.532 4.313 ( -2.561 -0.081 0.176) 2.569 4.414 ( -0.807 -2.801 5.825) 6.514 5.017 ( 2.251 -7.353 -6.153) 9.849 5.108 ( -4.440 3.961 2.428) 6.426 5.560 ( -2.441 -0.778 -1.284) 2.865 5.934 ( -0.722 0.359 0.243) 0.842 6.417 ( 2.184 0.767 -0.004) 2.314 6.826 ( -1.890 -1.635 0.163) 2.504 8.634 ( 0.379 -0.182 0.539) 0.683 11.065 ( -2.257 -4.763 0.311) 5.280 11.778 ( 1.385 -2.730 -4.695) 5.605 13.257 ( -0.336 0.141 1.937) 1.971 14.489 ( 0.463 -0.456 0.741) 0.986 14.574 ( -0.282 0.137 0.518) 0.606 14.852 ( 0.065 0.743 0.581) 0.946 15.786 ( -0.086 -1.907 0.113) 1.912 16.606 ( 1.511 3.069 0.128) 3.423 17.685 ( 2.232 4.568 1.905) 5.429 19.147 ( -0.926 -1.136 0.272) 1.491 19.852 ( -0.138 0.164 0.494) 0.538 20.812 ( -0.501 0.352 -1.998) 2.090 56.121 ( 0.882 4.310 2.533) 5.076 56.310 ( -2.916 -0.808 -2.063) 3.662 ======================= Grid point 534 (252/322) ======================= q-point: (-0.38 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.040 ( 11.075 -2.493 -0.146) 11.353 2.161 ( -14.850 1.748 -1.808) 15.062 2.502 ( -1.746 11.500 -3.557) 12.164 2.778 ( 7.599 -1.025 8.519) 11.461 3.442 ( -1.191 -0.084 1.209) 1.699 3.568 ( -2.674 -2.812 -5.659) 6.861 3.999 ( 7.480 1.629 -3.665) 8.487 4.332 ( -0.606 -2.407 1.696) 3.006 4.459 ( 0.005 -1.379 2.888) 3.200 4.937 ( -0.544 6.971 -1.520) 7.155 5.160 ( -2.002 -3.297 -1.432) 4.114 5.601 ( -0.240 -4.584 -1.567) 4.851 5.908 ( -2.204 1.235 0.318) 2.546 6.403 ( 1.795 2.256 1.570) 3.283 6.863 ( 0.587 -2.666 -0.322) 2.748 8.641 ( 0.439 -0.207 0.001) 0.485 11.067 ( -1.475 3.248 1.102) 3.734 11.797 ( 2.439 1.363 -5.105) 5.820 13.257 ( 0.252 0.222 3.248) 3.265 14.494 ( 0.690 0.592 0.716) 1.158 14.562 ( -1.080 0.517 0.151) 1.207 14.853 ( -0.551 -0.692 -0.517) 1.025 15.804 ( 0.883 0.224 -0.369) 0.982 16.553 ( -2.008 2.163 -0.142) 2.955 17.599 ( -2.888 4.002 2.567) 5.563 19.180 ( 0.641 -2.142 -0.583) 2.311 19.854 ( -0.108 -0.307 0.348) 0.477 20.841 ( 1.607 -3.176 -1.427) 3.835 56.029 ( -1.056 3.513 8.146) 8.934 56.434 ( 2.399 -10.339 -4.761) 11.633 ======================= Grid point 535 (253/322) ======================= q-point: (-0.31 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.183 ( 7.463 -2.638 -0.106) 7.916 2.028 ( -17.728 -1.528 -1.128) 17.830 2.279 ( -1.346 9.167 -1.521) 9.390 2.834 ( 4.529 1.281 11.585) 12.504 3.425 ( -3.394 1.458 -5.464) 6.596 3.527 ( -5.608 2.973 -4.256) 7.642 4.064 ( 10.909 -2.473 -3.141) 11.618 4.371 ( -0.608 -0.914 2.648) 2.866 4.486 ( 1.096 -1.295 -0.356) 1.733 4.837 ( 4.135 3.872 -1.642) 5.898 5.137 ( -5.694 1.936 -1.037) 6.103 5.701 ( 0.536 -4.970 -0.369) 5.013 5.861 ( -2.932 1.513 0.100) 3.301 6.363 ( 1.264 3.421 2.013) 4.166 6.929 ( 2.203 -3.082 -0.657) 3.845 8.651 ( 0.355 -0.583 0.007) 0.683 10.926 ( -0.625 10.643 1.219) 10.731 11.743 ( 3.037 5.524 -5.197) 8.169 13.265 ( 0.755 -0.048 4.435) 4.499 14.479 ( 0.759 1.538 0.449) 1.773 14.548 ( -1.229 -0.067 -0.027) 1.231 14.851 ( -2.926 -0.180 -2.107) 3.610 15.797 ( 2.948 1.651 -0.035) 3.379 16.494 ( -4.858 1.397 -0.358) 5.067 17.520 ( -5.007 1.232 2.350) 5.666 19.227 ( 1.024 -2.049 -1.319) 2.644 19.863 ( -0.143 -0.666 0.375) 0.777 20.946 ( 2.760 -5.966 -0.574) 6.599 56.038 ( 1.060 -3.264 10.368) 10.922 56.685 ( 3.177 -13.857 -3.816) 14.720 ======================= Grid point 536 (254/322) ======================= q-point: (-0.23 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.176 ( -2.508 5.265 1.122) 5.939 1.964 ( -10.274 -0.593 3.832) 10.982 2.148 ( -0.376 3.143 -1.518) 3.511 2.862 ( 1.865 -0.736 9.857) 10.059 3.293 ( -2.806 8.633 -6.471) 11.148 3.390 ( -8.407 3.928 -6.111) 11.111 4.197 ( 9.663 -1.367 -3.964) 10.534 4.350 ( 0.776 3.029 6.046) 6.807 4.537 ( 2.877 -2.903 -2.052) 4.574 4.853 ( 5.953 -1.847 -3.479) 7.139 5.029 ( -8.004 3.315 0.532) 8.680 5.771 ( -0.381 -1.509 0.785) 1.743 5.818 ( -2.521 0.328 -0.369) 2.569 6.292 ( 0.592 5.125 1.364) 5.336 7.005 ( 2.580 -2.909 -0.813) 3.973 8.674 ( 0.269 -1.640 0.562) 1.755 10.667 ( 0.072 15.832 0.658) 15.846 11.612 ( 2.650 9.281 -5.107) 10.920 13.286 ( 1.091 -0.639 5.205) 5.356 14.452 ( 0.545 1.733 0.253) 1.834 14.548 ( -1.324 -0.961 -0.337) 1.670 14.803 ( -5.115 1.576 -3.311) 6.293 15.794 ( 5.082 1.676 1.000) 5.444 16.430 ( -5.926 0.967 -0.416) 6.018 17.496 ( -4.642 -2.022 1.266) 5.219 19.264 ( 0.712 -1.395 -1.875) 2.443 19.878 ( -0.204 -1.003 0.717) 1.249 21.096 ( 2.719 -7.269 0.190) 7.763 56.210 ( 3.820 -10.876 11.779) 16.481 56.983 ( 2.519 -15.164 -2.690) 15.605 ======================= Grid point 537 (255/322) ======================= q-point: (-0.15 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.000 ( -6.563 8.303 2.451) 10.864 1.850 ( -4.902 8.906 9.455) 13.883 2.128 ( 2.215 -0.155 -3.740) 4.349 2.943 ( 0.562 -5.111 7.669) 9.233 3.075 ( -1.465 10.173 -3.072) 10.727 3.254 ( -7.271 2.876 -8.315) 11.414 4.140 ( -0.208 8.753 0.970) 8.809 4.337 ( 7.524 3.755 -0.817) 8.448 4.628 ( 2.775 -3.688 -0.396) 4.632 4.897 ( -6.258 0.543 4.319) 7.623 4.991 ( 2.679 -5.477 -6.010) 8.561 5.756 ( -1.427 1.113 -0.135) 1.815 5.815 ( -0.755 -0.119 0.479) 0.903 6.173 ( 0.253 7.741 0.122) 7.746 7.070 ( 1.713 -2.355 -0.799) 3.019 8.722 ( 0.142 -3.102 1.164) 3.316 10.344 ( 0.457 17.271 -0.111) 17.278 11.414 ( 1.274 11.678 -4.395) 12.542 13.320 ( 1.086 -1.050 5.298) 5.509 14.424 ( 0.084 1.421 0.227) 1.442 14.561 ( -1.689 -1.461 -1.179) 2.526 14.720 ( -4.036 2.427 -2.567) 5.364 15.806 ( 4.897 1.213 1.480) 5.257 16.377 ( -4.341 0.407 -0.414) 4.380 17.527 ( -3.157 -3.809 0.166) 4.950 19.284 ( 0.243 -0.778 -2.270) 2.411 19.901 ( -0.176 -1.369 1.297) 1.894 21.252 ( 1.681 -6.939 0.711) 7.175 56.537 ( 5.537 -16.985 10.985) 20.972 57.278 ( 0.975 -14.205 -1.671) 14.336 ======================= Grid point 538 (256/322) ======================= q-point: (-0.08 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.827 ( 1.707 6.954 2.807) 7.691 1.570 ( -0.717 18.704 8.334) 20.489 2.182 ( 1.764 -4.615 -2.653) 5.608 2.903 ( -3.229 5.597 0.061) 6.462 3.013 ( 2.142 4.205 6.616) 8.127 3.201 ( -1.899 -5.393 -6.707) 8.814 3.943 ( -2.285 10.004 3.349) 10.794 4.271 ( 4.852 6.974 -4.671) 9.695 4.677 ( 0.312 -0.380 -1.513) 1.591 4.883 ( -7.597 -3.056 11.583) 14.185 5.124 ( 3.141 -5.994 -8.730) 11.045 5.728 ( -0.395 0.914 -0.443) 1.090 5.798 ( 0.115 1.883 0.089) 1.889 6.014 ( 1.523 8.467 -1.104) 8.673 7.115 ( 0.067 -1.664 -0.701) 1.807 8.794 ( -0.157 -3.949 0.959) 4.067 10.036 ( 0.219 14.477 -0.532) 14.488 11.187 ( -0.025 11.257 -2.349) 11.499 13.355 ( 0.660 -1.003 4.689) 4.840 14.401 ( -0.144 0.839 0.217) 0.879 14.563 ( -1.404 -0.076 -2.753) 3.091 14.669 ( -0.472 0.668 0.273) 0.862 15.814 ( 1.601 0.822 0.795) 1.967 16.356 ( -0.167 -0.107 -0.354) 0.406 17.586 ( -1.229 -3.714 -0.164) 3.915 19.291 ( -0.242 -0.374 -2.422) 2.463 19.932 ( -0.040 -1.532 1.722) 2.305 21.379 ( 0.044 -5.299 1.034) 5.400 56.938 ( 4.019 -18.176 6.604) 19.752 57.522 ( -0.908 -10.978 -0.733) 11.039 ======================= Grid point 541 (257/322) ======================= q-point: ( 0.15 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.073 ( 3.287 0.000 1.668) 3.686 1.670 ( 44.767 0.000 -1.140) 44.782 2.329 ( -9.620 -0.000 4.216) 10.503 2.422 ( -2.686 -0.000 0.386) 2.714 3.211 ( 10.754 0.000 0.071) 10.755 3.612 ( -8.478 -0.000 7.681) 11.440 3.631 ( 15.830 0.000 -0.193) 15.831 4.010 ( -3.635 -0.000 -12.511) 13.028 4.682 ( 1.156 0.000 1.140) 1.624 4.755 ( -12.726 -0.000 16.308) 20.685 5.156 ( -4.435 -0.000 -6.013) 7.472 5.712 ( 2.662 0.000 -0.565) 2.722 5.762 ( 2.739 0.000 0.619) 2.808 6.047 ( 8.227 0.000 -2.773) 8.682 7.038 ( -7.303 -0.000 -0.877) 7.356 8.853 ( -2.403 -0.000 -1.949) 3.095 9.663 ( -4.214 -0.000 0.782) 4.286 10.965 ( 1.749 0.000 1.813) 2.519 13.366 ( -2.230 -0.000 -0.470) 2.279 14.409 ( 1.371 0.000 0.156) 1.380 14.683 ( -0.173 -0.000 0.414) 0.448 14.738 ( 12.006 0.000 4.328) 12.762 15.642 ( -7.316 -0.000 -3.960) 8.318 16.570 ( 11.119 0.000 -1.093) 11.172 17.783 ( 8.917 0.000 3.456) 9.563 19.252 ( -2.238 -0.000 -0.295) 2.258 19.978 ( 0.070 0.000 0.581) 0.585 21.394 ( -6.365 -0.000 1.060) 6.453 57.065 ( -18.373 -0.000 -9.507) 20.687 57.667 ( -6.487 -0.000 1.461) 6.650 ======================= Grid point 542 (258/322) ======================= q-point: ( 0.23 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.244 ( 6.767 -12.042 0.384) 13.819 2.000 ( 39.104 -1.621 -2.199) 39.200 2.148 ( -3.565 5.847 2.428) 7.266 2.602 ( -1.410 -12.418 3.057) 12.866 3.244 ( 2.479 2.179 0.154) 3.304 3.569 ( -5.646 -0.458 8.684) 10.368 3.726 ( 16.517 1.662 -1.350) 16.655 4.023 ( -4.435 -5.505 -13.268) 15.034 4.646 ( -7.691 2.983 5.649) 9.998 4.716 ( -3.674 -0.687 9.459) 10.170 5.107 ( -4.111 0.291 -4.153) 5.851 5.760 ( 1.596 -2.280 0.303) 2.800 5.793 ( 2.725 -1.134 0.755) 3.046 6.117 ( 7.235 -2.091 -2.799) 8.034 6.969 ( -8.904 0.764 -0.883) 8.981 8.800 ( -2.737 2.904 -1.008) 4.115 9.728 ( -4.156 -9.582 0.231) 10.447 11.033 ( 1.505 -5.190 1.400) 5.582 13.342 ( -2.582 0.490 -1.374) 2.966 14.420 ( 1.525 0.029 0.254) 1.547 14.667 ( 0.078 1.437 0.352) 1.482 14.841 ( 10.783 -0.626 5.861) 12.289 15.594 ( -5.654 -0.695 -3.947) 6.930 16.646 ( 11.304 0.401 -1.419) 11.400 17.843 ( 11.372 2.046 3.623) 12.110 19.232 ( -2.861 0.101 0.289) 2.877 19.969 ( 0.172 1.113 0.527) 1.243 21.321 ( -7.216 2.576 0.794) 7.703 56.844 ( -17.883 6.552 -10.636) 21.815 57.548 ( -8.292 6.703 1.715) 10.799 ======================= Grid point 543 (259/322) ======================= q-point: ( 0.31 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.538 ( 13.500 -8.517 0.583) 15.973 2.080 ( 1.050 -0.879 -3.557) 3.811 2.289 ( 26.097 -1.701 2.305) 26.254 2.842 ( 4.082 -10.585 4.881) 12.350 3.178 ( -4.682 2.319 -1.923) 5.567 3.581 ( -4.115 -2.578 7.229) 8.709 3.826 ( 17.894 0.979 0.035) 17.921 4.079 ( -6.749 -6.748 -13.026) 16.148 4.524 ( -7.615 4.018 2.842) 9.067 4.694 ( -3.984 2.258 9.824) 10.839 5.096 ( -1.698 -2.229 -3.382) 4.392 5.787 ( -1.348 0.103 1.419) 1.960 5.845 ( 2.707 -1.826 0.609) 3.322 6.222 ( 5.893 -3.989 -3.336) 7.859 6.883 ( -9.876 0.766 -0.542) 9.921 8.720 ( -2.297 3.109 0.810) 3.949 9.952 ( -3.858 -16.276 -0.792) 16.746 11.176 ( 0.729 -8.415 0.265) 8.451 13.308 ( -2.560 0.702 -1.714) 3.160 14.431 ( 1.461 0.011 0.423) 1.521 14.636 ( 0.169 1.829 0.286) 1.859 14.922 ( 6.988 0.196 5.981) 9.200 15.580 ( -2.607 -1.713 -2.601) 4.061 16.710 ( 10.640 1.013 -1.372) 10.776 17.883 ( 13.359 3.669 2.919) 14.158 19.206 ( -3.633 0.301 0.766) 3.725 19.943 ( 0.208 1.740 0.707) 1.889 21.199 ( -7.310 4.498 0.168) 8.585 56.558 ( -13.594 8.621 -10.835) 19.404 57.311 ( -9.054 11.419 2.491) 14.784 ======================= Grid point 544 (260/322) ======================= q-point: ( 0.38 0.15 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.704 ( 16.324 4.064 1.195) 16.864 2.143 ( 5.258 -3.370 -2.041) 6.570 2.452 ( 15.775 0.846 3.177) 16.114 3.060 ( -5.360 -10.125 5.997) 12.931 3.138 ( 3.329 -0.642 -9.355) 9.951 3.609 ( -3.709 -1.938 4.569) 6.196 3.920 ( 15.603 2.798 2.263) 16.012 4.162 ( -5.001 -8.645 -7.539) 12.514 4.416 ( -4.539 2.079 -1.573) 5.235 4.619 ( -5.443 2.753 9.633) 11.402 5.142 ( -0.710 -3.351 -2.633) 4.320 5.738 ( -5.099 2.672 1.282) 5.898 5.898 ( 2.643 -1.381 0.756) 3.077 6.326 ( 4.494 -3.159 -3.720) 6.634 6.806 ( -9.343 -0.364 0.225) 9.353 8.661 ( -1.135 1.832 1.838) 2.832 10.269 ( -3.852 -19.132 -1.200) 19.553 11.355 ( 0.189 -9.626 -1.276) 9.712 13.276 ( -2.092 0.511 -1.390) 2.564 14.443 ( 1.277 -0.217 0.618) 1.435 14.604 ( 0.176 1.498 0.190) 1.520 14.949 ( 2.572 1.518 4.534) 5.429 15.613 ( 0.252 -2.672 -0.387) 2.712 16.751 ( 8.949 2.087 -0.966) 9.239 17.905 ( 14.089 4.839 1.822) 15.008 19.170 ( -4.369 0.496 1.108) 4.534 19.911 ( 0.101 1.779 0.860) 1.979 21.052 ( -6.466 5.236 -0.672) 8.347 56.310 ( -7.825 6.711 -10.255) 14.541 57.004 ( -8.814 13.798 3.521) 16.748 ======================= Grid point 545 (261/322) ======================= q-point: ( 0.46 0.15 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.608 ( 13.086 15.920 2.451) 20.753 2.268 ( 6.311 -4.041 -0.542) 7.514 2.518 ( 11.006 1.877 4.095) 11.892 3.142 ( 6.000 3.072 -11.715) 13.516 3.190 ( -11.397 -9.062 -0.802) 14.583 3.607 ( -2.070 1.124 4.306) 4.908 3.973 ( 10.910 0.855 2.726) 11.277 4.287 ( 2.664 -3.802 7.988) 9.239 4.369 ( -3.489 0.665 -4.833) 5.998 4.609 ( -4.136 -6.876 0.350) 8.032 5.183 ( -1.896 -1.621 -1.528) 2.926 5.627 ( -7.622 3.530 0.245) 8.403 5.932 ( 1.475 -0.424 0.628) 1.658 6.396 ( 3.843 -1.731 -3.244) 5.319 6.766 ( -7.178 -1.610 0.987) 7.422 8.638 ( 0.002 0.600 1.794) 1.891 10.601 ( -3.810 -17.785 -0.920) 18.212 11.534 ( 0.131 -8.970 -2.926) 9.436 13.257 ( -1.296 0.027 -0.472) 1.379 14.461 ( 1.057 -0.599 0.753) 1.430 14.584 ( 0.007 0.749 0.129) 0.760 14.925 ( 0.229 2.316 2.907) 3.724 15.676 ( 1.156 -3.010 1.039) 3.388 16.752 ( 6.393 3.589 -0.441) 7.345 17.901 ( 12.241 6.056 1.092) 13.701 19.132 ( -4.313 0.195 1.172) 4.473 19.881 ( -0.073 1.381 0.830) 1.613 20.915 ( -4.654 4.399 -1.464) 6.569 56.166 ( -2.537 2.576 -9.109) 9.801 56.680 ( -7.895 13.887 4.653) 16.638 ======================= Grid point 546 (262/322) ======================= q-point: ( 0.54 0.15 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.369 ( 12.633 17.187 3.628) 21.636 2.292 ( -3.805 3.028 -3.187) 5.815 2.623 ( 13.216 -2.989 6.725) 15.127 2.996 ( -0.547 10.167 -9.712) 14.071 3.317 ( -3.266 -9.108 -6.114) 11.446 3.544 ( -3.018 3.880 5.712) 7.536 4.062 ( 11.814 0.007 1.566) 11.918 4.304 ( -4.740 1.410 -0.510) 4.971 4.368 ( 1.204 -2.093 9.526) 9.827 4.807 ( 0.820 -12.969 -5.647) 14.169 5.152 ( -4.118 2.561 -0.255) 4.856 5.523 ( -7.042 0.846 -1.631) 7.278 5.938 ( -0.120 0.351 0.449) 0.582 6.440 ( 3.530 -0.456 -1.472) 3.852 6.765 ( -4.296 -2.445 0.913) 5.027 8.638 ( 0.613 0.043 1.133) 1.289 10.872 ( -3.317 -12.821 -0.146) 13.244 11.683 ( 0.461 -6.747 -4.306) 8.018 13.254 ( -0.487 -0.348 0.761) 0.968 14.483 ( 0.873 -0.770 0.806) 1.416 14.574 ( -0.453 0.180 0.130) 0.505 14.885 ( 0.046 2.107 1.788) 2.764 15.740 ( 0.730 -2.697 1.091) 2.999 16.705 ( 3.510 4.871 -0.135) 6.005 17.843 ( 7.223 7.672 1.293) 10.616 19.114 ( -2.737 -1.017 0.773) 3.020 19.861 ( -0.173 0.766 0.650) 1.020 20.822 ( -2.264 2.058 -1.925) 3.615 56.143 ( 1.601 -1.779 -7.612) 7.979 56.388 ( -6.904 11.292 5.701) 14.411 ======================= Grid point 547 (263/322) ======================= q-point: (-0.38 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.211 ( 15.289 9.088 3.137) 18.060 2.129 ( -12.756 5.944 -3.584) 14.522 2.703 ( 0.431 9.359 -2.433) 9.679 2.850 ( 11.551 0.039 3.086) 11.956 3.442 ( -2.361 -3.967 -2.499) 5.249 3.463 ( -2.621 0.286 1.179) 2.888 4.092 ( 6.732 3.413 -5.135) 9.129 4.295 ( 0.077 -1.840 4.783) 5.125 4.423 ( -0.798 -2.285 5.719) 6.210 5.017 ( 0.719 -4.295 -7.333) 8.529 5.053 ( -3.574 0.476 2.627) 4.461 5.502 ( -4.479 -3.453 -2.439) 6.159 5.920 ( -1.211 1.136 0.561) 1.753 6.455 ( 2.519 1.194 0.526) 2.837 6.802 ( -1.319 -3.361 0.112) 3.612 8.644 ( 0.662 0.007 0.448) 0.799 11.032 ( -2.297 -5.596 0.714) 6.091 11.780 ( 1.020 -3.449 -5.110) 6.249 13.262 ( 0.060 -0.332 2.001) 2.029 14.502 ( 0.838 -0.395 0.934) 1.316 14.565 ( -1.010 0.411 0.045) 1.091 14.857 ( 0.312 1.093 0.786) 1.382 15.790 ( 0.419 -1.830 0.445) 1.929 16.622 ( 0.716 5.163 -0.156) 5.215 17.720 ( 1.474 8.363 2.099) 8.748 19.136 ( -0.704 -2.334 0.104) 2.440 19.852 ( -0.166 0.153 0.440) 0.495 20.802 ( -0.061 -1.164 -1.900) 2.229 56.141 ( 0.034 7.158 4.136) 8.267 56.266 ( -1.611 -6.514 -3.485) 7.561 ======================= Grid point 548 (264/322) ======================= q-point: (-0.31 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.257 ( 17.338 0.399 2.125) 17.472 1.903 ( -18.951 3.951 -2.746) 19.552 2.466 ( -1.310 11.470 -3.865) 12.174 2.953 ( 11.241 1.999 10.162) 15.285 3.398 ( -4.483 0.761 -1.991) 4.964 3.510 ( -2.813 -1.763 -4.448) 5.550 4.084 ( 5.024 -0.510 -5.768) 7.666 4.343 ( 1.163 -1.326 4.218) 4.572 4.462 ( -1.056 -1.658 3.143) 3.707 4.943 ( 2.438 4.149 -1.585) 5.067 5.105 ( -4.444 -1.267 -2.790) 5.398 5.582 ( -1.406 -6.791 -1.131) 7.027 5.880 ( -1.577 1.930 0.693) 2.587 6.434 ( 1.446 2.563 1.393) 3.256 6.870 ( 0.611 -3.895 -0.515) 3.976 8.648 ( 0.369 -0.029 0.168) 0.406 11.051 ( -1.074 2.555 1.143) 2.997 11.809 ( 1.510 0.551 -5.346) 5.582 13.273 ( 0.345 -0.242 3.115) 3.143 14.509 ( 0.825 0.611 1.006) 1.437 14.545 ( -1.032 0.631 -0.084) 1.213 14.841 ( -0.714 0.784 -0.495) 1.170 15.820 ( 1.131 -0.741 0.067) 1.354 16.525 ( -1.621 4.379 -0.328) 4.681 17.574 ( -1.720 6.420 2.593) 7.135 19.184 ( 0.212 -2.656 -0.464) 2.705 19.853 ( -0.141 -0.315 0.321) 0.471 20.858 ( 1.251 -4.367 -1.457) 4.770 56.044 ( -0.466 2.297 7.344) 7.710 56.447 ( 1.342 -11.722 -4.247) 12.540 ======================= Grid point 549 (265/322) ======================= q-point: (-0.23 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.327 ( 9.601 6.789 1.242) 11.824 1.783 ( -13.783 -6.802 -0.122) 15.370 2.261 ( -0.475 8.343 -1.466) 8.484 2.966 ( 8.227 5.003 10.031) 13.905 3.329 ( -5.680 1.786 -7.843) 9.847 3.456 ( -2.656 4.789 -2.796) 6.148 4.172 ( 3.835 -4.960 -3.366) 7.116 4.375 ( 0.606 -0.732 3.004) 3.151 4.489 ( -0.970 -1.998 1.012) 2.441 4.913 ( 7.194 2.356 -1.690) 7.756 5.035 ( -7.257 2.945 -2.060) 8.099 5.701 ( -0.490 -5.581 0.496) 5.625 5.830 ( -1.271 2.153 0.488) 2.547 6.384 ( 0.808 3.697 1.056) 3.929 6.951 ( 1.017 -3.795 -0.764) 4.003 8.654 ( -0.048 -0.561 0.449) 0.720 10.924 ( -0.042 10.257 0.883) 10.295 11.758 ( 1.411 5.027 -5.236) 7.395 13.288 ( 0.448 -0.517 3.930) 3.989 14.492 ( 0.551 1.716 0.729) 1.944 14.531 ( -0.841 0.070 -0.145) 0.856 14.806 ( -1.947 1.762 -1.561) 3.055 15.839 ( 2.167 0.010 0.292) 2.187 16.436 ( -2.523 3.095 -0.404) 4.013 17.477 ( -1.908 2.410 2.274) 3.823 19.231 ( 0.132 -2.101 -0.877) 2.281 19.862 ( -0.158 -0.669 0.420) 0.805 20.974 ( 1.356 -6.666 -0.833) 6.853 56.086 ( 1.178 -5.212 8.185) 9.774 56.703 ( 0.856 -14.423 -3.089) 14.775 ======================= Grid point 550 (266/322) ======================= q-point: (-0.15 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.169 ( 0.056 10.214 0.903) 10.254 1.883 ( -1.825 -4.506 4.625) 6.710 2.148 ( 0.638 2.817 -1.630) 3.317 2.948 ( 6.220 2.649 5.405) 8.656 3.240 ( -1.946 3.000 -6.547) 7.460 3.285 ( -3.080 9.681 -1.987) 10.352 4.229 ( -3.594 1.031 0.262) 3.748 4.406 ( 4.226 -0.611 0.753) 4.336 4.546 ( -0.963 -4.805 -0.877) 4.978 4.902 ( -8.116 4.034 2.226) 9.333 4.951 ( 7.634 -0.734 -4.441) 8.862 5.776 ( 0.819 -0.882 1.272) 1.751 5.790 ( -1.304 -0.077 0.005) 1.307 6.304 ( 0.725 5.408 0.015) 5.456 7.022 ( 0.129 -3.178 -0.768) 3.272 8.675 ( -0.524 -1.767 1.078) 2.136 10.672 ( 0.502 15.746 0.147) 15.755 11.619 ( 0.488 9.258 -4.773) 10.427 13.313 ( 0.296 -0.999 4.106) 4.236 14.458 ( -0.293 1.970 0.548) 2.065 14.532 ( -0.334 -0.650 -0.490) 0.880 14.748 ( -0.951 2.571 -1.433) 3.093 15.847 ( 1.050 0.557 0.314) 1.229 16.377 ( -0.502 1.604 -0.231) 1.696 17.463 ( -0.441 -1.374 1.495) 2.078 19.262 ( -0.272 -1.315 -1.202) 1.802 19.878 ( -0.177 -1.063 0.777) 1.329 21.119 ( 0.386 -7.521 -0.243) 7.535 56.285 ( 1.913 -12.745 7.645) 14.985 56.989 ( -0.622 -15.348 -1.856) 15.473 ======================= Grid point 551 (267/322) ======================= q-point: (-0.08 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.016 ( 7.562 7.479 0.935) 10.677 1.857 ( 1.946 8.195 9.214) 12.483 2.143 ( 1.666 -0.742 -5.813) 6.093 2.979 ( 1.331 1.925 4.647) 5.203 3.090 ( 3.254 4.570 -1.626) 5.841 3.174 ( 0.796 3.057 -3.736) 4.893 4.101 ( -6.035 7.749 3.335) 10.373 4.402 ( 2.743 4.275 -5.847) 7.745 4.633 ( -1.969 -4.374 -0.462) 4.819 4.800 ( -8.583 -0.017 8.534) 12.104 5.039 ( 5.510 -3.683 -5.746) 8.771 5.757 ( 1.452 1.523 -0.257) 2.120 5.813 ( 0.160 -0.517 0.878) 1.032 6.186 ( 1.823 7.608 -1.322) 7.935 7.069 ( -1.606 -2.342 -0.651) 2.914 8.719 ( -1.111 -3.232 1.451) 3.713 10.349 ( 0.296 17.440 -0.567) 17.452 11.406 ( -0.537 11.685 -3.484) 12.205 13.342 ( -0.190 -1.231 3.471) 3.687 14.421 ( -0.562 1.386 0.417) 1.553 14.549 ( 0.909 -0.994 -0.563) 1.460 14.701 ( 1.594 2.237 -0.292) 2.763 15.827 ( -2.654 0.970 -0.492) 2.868 16.372 ( 4.005 0.270 0.022) 4.014 17.518 ( 1.636 -3.354 1.072) 3.883 19.275 ( -0.720 -0.687 -1.393) 1.711 19.903 ( -0.134 -1.504 1.178) 1.915 21.257 ( -1.262 -6.916 0.250) 7.034 56.604 ( 0.008 -17.703 4.613) 18.294 57.264 ( -2.427 -14.217 -0.556) 14.433 ======================= Grid point 555 (268/322) ======================= q-point: ( 0.23 0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.134 ( 4.956 0.000 -1.308) 5.126 2.232 ( 3.697 0.000 7.337) 8.216 2.325 ( 36.813 0.000 -7.041) 37.480 2.390 ( -2.606 -0.000 4.292) 5.021 3.284 ( -0.954 -0.000 0.265) 0.990 3.498 ( -10.761 -0.000 8.860) 13.939 3.901 ( -4.622 -0.000 -15.961) 16.617 3.920 ( 23.131 0.000 1.426) 23.175 4.625 ( -10.757 -0.000 9.619) 14.431 4.702 ( 0.893 0.000 1.345) 1.614 5.066 ( -6.149 -0.000 -0.654) 6.184 5.753 ( 3.087 0.000 -0.422) 3.116 5.804 ( 2.631 0.000 1.869) 3.227 6.139 ( 4.992 0.000 -2.201) 5.455 6.904 ( -10.529 -0.000 -1.198) 10.597 8.808 ( -2.733 -0.000 -2.294) 3.568 9.600 ( -4.770 -0.000 1.207) 4.920 11.000 ( 2.081 0.000 1.992) 2.881 13.323 ( -2.916 -0.000 -2.174) 3.637 14.433 ( 1.830 0.000 0.299) 1.854 14.679 ( -0.486 -0.000 -0.151) 0.509 14.923 ( 9.285 0.000 7.423) 11.887 15.548 ( -2.864 -0.000 -3.772) 4.736 16.729 ( 11.303 0.000 -2.024) 11.482 17.960 ( 13.440 0.000 4.134) 14.062 19.211 ( -3.519 -0.000 0.783) 3.605 19.982 ( 0.364 0.000 0.375) 0.523 21.291 ( -8.043 -0.000 0.915) 8.095 56.748 ( -19.479 -0.000 -12.147) 22.956 57.550 ( -9.843 -0.000 1.188) 9.915 ======================= Grid point 556 (269/322) ======================= q-point: ( 0.31 0.23 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.341 ( 7.074 -15.434 -2.969) 17.235 2.136 ( 2.390 5.460 1.788) 6.223 2.457 ( 12.951 -2.305 5.714) 14.342 2.711 ( 24.112 -9.600 -2.197) 26.046 3.196 ( -9.237 4.926 2.181) 10.694 3.471 ( -9.063 -3.338 7.541) 12.254 3.883 ( -4.100 -4.266 -16.145) 17.195 4.064 ( 22.717 3.196 1.725) 23.006 4.538 ( -7.741 2.592 2.918) 8.669 4.714 ( -0.977 0.252 5.271) 5.367 5.031 ( -5.391 -1.244 0.258) 5.539 5.781 ( 0.997 -0.339 0.228) 1.078 5.838 ( 3.031 -1.090 2.292) 3.953 6.188 ( 3.487 -2.653 -2.764) 5.180 6.815 ( -11.741 0.507 -1.151) 11.809 8.758 ( -2.431 2.440 -1.131) 3.625 9.665 ( -4.491 -9.764 0.485) 10.758 11.062 ( 1.711 -4.456 1.568) 5.024 13.294 ( -2.930 0.315 -2.460) 3.839 14.446 ( 1.877 0.167 0.422) 1.931 14.663 ( -0.544 1.085 -0.272) 1.244 14.985 ( 4.975 0.412 6.872) 8.494 15.544 ( 0.933 -0.874 -1.974) 2.351 16.801 ( 10.603 0.578 -2.187) 10.842 18.049 ( 15.128 2.150 3.685) 15.718 19.183 ( -4.328 0.154 1.148) 4.480 19.975 ( 0.477 1.141 0.533) 1.347 21.210 ( -8.124 2.372 0.652) 8.488 56.549 ( -16.914 4.094 -12.406) 21.372 57.416 ( -10.244 6.237 1.472) 12.084 ======================= Grid point 557 (270/322) ======================= q-point: ( 0.38 0.23 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.711 ( 10.752 -13.902 -4.245) 18.080 2.134 ( 7.441 -1.033 0.619) 7.538 2.591 ( 12.278 -0.763 5.479) 13.467 2.945 ( -2.368 1.974 8.836) 9.358 3.094 ( 4.913 -4.815 -6.761) 9.645 3.509 ( -5.476 -4.991 5.234) 9.071 3.926 ( -7.695 -6.620 -13.670) 17.027 4.147 ( 20.523 3.978 1.626) 20.968 4.441 ( -2.439 3.364 -0.634) 4.203 4.671 ( -3.473 3.696 9.539) 10.803 5.050 ( -3.315 -4.010 -1.900) 5.539 5.752 ( -4.071 2.403 0.681) 4.777 5.893 ( 3.332 -1.501 2.191) 4.261 6.281 ( 3.816 -4.260 -3.761) 6.845 6.721 ( -11.931 -0.256 -0.429) 11.941 8.695 ( -1.432 2.317 0.812) 2.843 9.890 ( -4.205 -16.374 -0.624) 16.917 11.191 ( 1.000 -7.517 0.345) 7.591 13.264 ( -2.519 0.288 -2.165) 3.334 14.456 ( 1.708 0.233 0.549) 1.809 14.633 ( -0.526 1.493 -0.289) 1.610 14.998 ( 0.950 1.336 4.882) 5.150 15.585 ( 3.497 -1.588 0.583) 3.884 16.850 ( 9.041 1.509 -1.870) 9.355 18.107 ( 15.966 4.160 2.504) 16.688 19.145 ( -5.224 0.344 1.350) 5.407 19.950 ( 0.394 1.858 0.795) 2.059 21.091 ( -7.339 4.001 0.061) 8.359 56.332 ( -11.890 4.844 -11.613) 17.311 57.182 ( -9.395 10.668 2.387) 14.414 ======================= Grid point 558 (271/322) ======================= q-point: ( 0.46 0.23 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.911 ( 12.060 3.000 -1.285) 12.493 2.255 ( 10.308 -3.541 -0.315) 10.904 2.647 ( 7.381 3.872 2.652) 8.746 2.905 ( -12.693 -8.719 5.244) 16.268 3.212 ( 6.763 0.079 -6.941) 9.692 3.587 ( -0.062 -3.048 4.649) 5.560 3.978 ( -4.518 -5.636 -4.019) 8.266 4.247 ( 7.374 -3.926 -4.158) 9.332 4.389 ( 8.559 3.857 1.338) 9.482 4.573 ( -4.631 4.142 8.134) 10.235 5.108 ( -2.504 -4.011 -2.197) 5.214 5.640 ( -8.781 4.121 -0.112) 9.701 5.939 ( 2.487 -0.497 1.738) 3.075 6.375 ( 4.101 -2.995 -4.171) 6.572 6.666 ( -9.971 -2.438 0.966) 10.310 8.657 ( -0.199 1.188 1.698) 2.082 10.207 ( -3.926 -19.255 -0.955) 19.674 11.356 ( 0.409 -8.964 -1.320) 9.070 13.243 ( -1.742 -0.109 -1.331) 2.195 14.465 ( 1.412 0.017 0.644) 1.551 14.601 ( -0.591 1.251 -0.287) 1.413 14.971 ( -0.692 2.018 3.210) 3.854 15.648 ( 3.585 -1.846 1.983) 4.494 16.863 ( 6.702 2.947 -1.232) 7.425 18.124 ( 14.782 6.308 1.320) 16.126 19.102 ( -5.536 0.188 1.336) 5.698 19.915 ( 0.146 1.963 0.908) 2.167 20.960 ( -5.658 4.363 -0.675) 7.176 56.170 ( -6.609 2.871 -10.029) 12.349 56.893 ( -7.667 13.018 3.506) 15.510 ======================= Grid point 559 (272/322) ======================= q-point: ( 0.54 0.23 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.794 ( 11.032 15.711 4.000) 19.610 2.333 ( 2.240 2.444 -4.250) 5.390 2.656 ( 4.776 -2.544 3.273) 6.324 3.045 ( -5.275 -7.197 -0.337) 8.930 3.185 ( 3.935 2.314 -9.112) 10.191 3.599 ( -0.939 2.149 6.087) 6.523 4.087 ( 4.013 -5.529 5.226) 8.602 4.292 ( -3.817 0.293 -7.635) 8.541 4.426 ( 5.464 3.223 12.055) 13.622 4.574 ( 4.386 -8.572 -5.278) 10.981 5.141 ( -2.634 -1.057 -1.210) 3.086 5.490 ( -10.903 2.948 -1.775) 11.433 5.950 ( 0.800 0.649 0.911) 1.375 6.443 ( 3.682 -1.739 -2.623) 4.843 6.670 ( -6.219 -3.710 1.362) 7.369 8.648 ( 0.598 0.352 1.438) 1.597 10.545 ( -3.296 -18.081 -0.572) 18.388 11.527 ( 0.115 -8.710 -2.941) 9.194 13.240 ( -0.886 -0.637 -0.172) 1.105 14.479 ( 1.077 -0.407 0.699) 1.347 14.577 ( -0.794 0.647 -0.222) 1.048 14.929 ( -0.478 2.184 2.258) 3.178 15.709 ( 2.355 -1.843 1.907) 3.547 16.827 ( 4.077 4.678 -0.602) 6.234 18.073 ( 10.335 8.931 0.948) 13.692 19.072 ( -4.115 -0.840 0.958) 4.307 19.883 ( -0.085 1.527 0.809) 1.730 20.851 ( -3.364 3.222 -1.336) 4.846 56.100 ( -2.684 -0.645 -8.046) 8.506 56.596 ( -5.414 13.307 4.445) 15.038 ======================= Grid point 560 (273/322) ======================= q-point: ( 0.62 0.23 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.568 ( 12.293 15.535 5.047) 20.443 2.184 ( -8.716 8.182 -5.176) 13.027 2.789 ( 4.793 -2.978 2.271) 6.082 2.975 ( 3.480 6.558 -4.155) 8.508 3.278 ( -0.705 -7.978 -5.307) 9.608 3.533 ( -0.577 4.847 7.006) 8.539 4.200 ( 0.927 4.902 -5.913) 7.736 4.244 ( 2.399 -5.647 7.023) 9.326 4.417 ( 0.501 0.841 6.941) 7.009 4.822 ( 4.231 -11.896 -5.786) 13.889 5.096 ( -2.963 3.055 -0.084) 4.256 5.400 ( -8.376 -1.768 -3.115) 9.110 5.936 ( -0.237 1.074 0.517) 1.215 6.482 ( 1.965 -0.282 0.088) 1.987 6.717 ( -2.189 -4.118 0.185) 4.667 8.651 ( 0.736 0.124 0.741) 1.052 10.831 ( -2.177 -13.323 0.120) 13.500 11.674 ( 0.152 -6.903 -4.079) 8.020 13.252 ( -0.313 -0.882 0.984) 1.358 14.498 ( 0.814 -0.697 0.815) 1.346 14.563 ( -1.051 0.249 -0.097) 1.085 14.893 ( 0.307 1.870 1.520) 2.429 15.759 ( 1.101 -1.780 1.067) 2.350 16.743 ( 1.723 6.060 -0.239) 6.305 17.934 ( 4.219 10.969 1.494) 11.847 19.083 ( -1.611 -2.255 0.354) 2.794 19.860 ( -0.168 0.823 0.603) 1.034 20.791 ( -1.141 0.852 -1.754) 2.259 56.128 ( -1.138 -4.758 -5.644) 7.469 56.333 ( -2.502 11.493 4.635) 12.642 ======================= Grid point 561 (274/322) ======================= q-point: (-0.31 0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.448 ( 14.399 6.882 3.770) 16.398 1.914 ( -14.039 9.906 -3.688) 17.574 2.671 ( -1.687 11.021 -3.671) 11.738 3.046 ( 10.873 -3.195 3.988) 12.014 3.392 ( -3.096 -4.422 -3.928) 6.676 3.439 ( -1.262 3.763 3.279) 5.148 4.106 ( -1.404 2.527 -4.986) 5.763 4.363 ( 5.724 -1.299 4.230) 7.235 4.421 ( -2.057 -1.157 4.793) 5.343 4.999 ( 0.484 -3.100 -7.046) 7.713 5.030 ( -0.770 0.063 1.777) 1.938 5.430 ( -3.637 -6.385 -1.927) 7.596 5.909 ( -0.405 1.592 0.589) 1.746 6.481 ( 0.353 1.257 1.471) 1.967 6.792 ( 0.253 -4.307 -0.769) 4.383 8.653 ( 0.398 0.213 0.261) 0.521 11.010 ( -0.798 -6.127 0.633) 6.211 11.774 ( 0.371 -3.875 -4.583) 6.013 13.269 ( -0.141 -0.743 1.943) 2.085 14.516 ( 0.546 -0.394 1.040) 1.239 14.549 ( -0.952 0.376 0.015) 1.023 14.865 ( 0.365 1.589 0.546) 1.720 15.799 ( 0.554 -1.678 0.247) 1.785 16.627 ( 0.032 6.403 -0.127) 6.404 17.740 ( 0.241 10.516 2.200) 10.746 19.129 ( -0.205 -2.940 -0.048) 2.948 19.851 ( -0.147 0.161 0.418) 0.472 20.797 ( 0.282 -2.101 -1.843) 2.809 56.136 ( -3.307 6.126 6.883) 9.790 56.254 ( 2.315 -7.470 -5.843) 9.762 ======================= Grid point 562 (275/322) ======================= q-point: (-0.23 0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.530 ( 16.455 -2.209 3.166) 16.902 1.610 ( -17.844 8.348 -2.124) 19.814 2.439 ( -0.999 10.816 -2.201) 11.083 3.152 ( 11.262 2.560 7.708) 13.885 3.307 ( -5.862 3.146 -6.035) 8.982 3.465 ( -1.682 -1.806 -1.949) 3.145 4.087 ( -2.327 -2.697 -2.937) 4.617 4.387 ( 2.594 0.773 1.329) 3.015 4.452 ( -1.449 -1.599 3.823) 4.389 4.999 ( 5.059 1.362 0.141) 5.241 5.025 ( -3.999 0.950 -5.015) 6.484 5.561 ( -1.117 -8.026 0.273) 8.108 5.871 ( 0.093 2.234 0.625) 2.321 6.448 ( -0.223 2.419 1.232) 2.724 6.877 ( 0.586 -4.182 -1.006) 4.341 8.651 ( -0.132 0.137 0.302) 0.357 11.048 ( 0.388 2.233 0.605) 2.346 11.806 ( 0.337 0.185 -4.619) 4.635 13.284 ( -0.222 -0.633 2.658) 2.742 14.518 ( -0.170 0.677 1.131) 1.329 14.536 ( -0.267 0.530 0.052) 0.595 14.833 ( -0.077 1.875 -0.405) 1.919 15.832 ( 0.423 -1.339 -0.161) 1.413 16.509 ( -0.359 5.378 -0.038) 5.390 17.567 ( -0.335 7.197 2.397) 7.593 19.183 ( -0.165 -2.703 -0.210) 2.716 19.852 ( -0.132 -0.310 0.357) 0.490 20.866 ( 0.525 -4.865 -1.622) 5.155 56.061 ( -0.249 0.957 6.133) 6.213 56.445 ( 0.221 -11.822 -3.669) 12.380 ======================= Grid point 563 (276/322) ======================= q-point: (-0.15 0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.335 ( -9.961 8.255 0.328) 12.941 1.752 ( 10.128 -8.369 2.938) 13.463 2.253 ( -0.190 7.626 -0.926) 7.685 3.116 ( 7.469 7.574 0.758) 10.664 3.241 ( -1.228 0.355 -3.904) 4.108 3.429 ( -0.212 4.815 -0.524) 4.848 4.138 ( -6.795 -4.933 -0.212) 8.399 4.408 ( 2.258 -1.156 -0.175) 2.543 4.469 ( -2.394 -1.608 2.545) 3.847 4.926 ( -6.203 4.053 -2.414) 7.793 5.026 ( 8.555 1.405 -1.599) 8.816 5.692 ( -1.097 -5.967 1.478) 6.244 5.831 ( 1.226 2.327 0.391) 2.659 6.391 ( -0.045 3.454 0.190) 3.460 6.952 ( -0.484 -3.653 -0.895) 3.792 8.651 ( -0.694 -0.473 0.819) 1.173 10.932 ( 0.957 10.254 0.044) 10.298 11.750 ( -0.318 4.976 -4.350) 6.617 13.300 ( -0.462 -0.843 2.900) 3.056 14.490 ( -1.178 1.781 0.891) 2.313 14.529 ( 0.536 0.168 0.086) 0.568 14.794 ( 0.888 2.217 -0.510) 2.442 15.847 ( -1.110 -0.279 -0.527) 1.260 16.429 ( 1.745 3.163 0.235) 3.619 17.480 ( 1.322 2.524 2.007) 3.485 19.225 ( -0.660 -1.982 -0.324) 2.114 19.861 ( -0.155 -0.682 0.500) 0.860 20.978 ( -0.359 -6.733 -1.204) 6.849 56.122 ( 0.724 -6.091 5.005) 7.917 56.689 ( -1.650 -14.321 -2.027) 14.558 ======================= Grid point 564 (277/322) ======================= q-point: (-0.08 0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.177 ( 1.371 4.430 1.069) 4.758 1.950 ( 8.090 -2.775 5.513) 10.176 2.150 ( 0.563 2.539 -2.318) 3.483 3.056 ( 7.241 2.471 -6.947) 10.334 3.203 ( 0.453 5.592 0.374) 5.622 3.302 ( 4.569 7.308 2.835) 9.073 4.126 ( -10.684 0.328 2.613) 11.004 4.446 ( 1.416 -0.409 -2.686) 3.064 4.508 ( -4.073 -4.715 0.506) 6.251 4.790 ( -7.141 4.083 2.053) 8.479 5.062 ( 8.082 0.839 -2.764) 8.582 5.772 ( -1.241 -2.689 1.250) 3.215 5.809 ( 2.844 1.235 0.343) 3.119 6.314 ( 1.020 4.876 -1.131) 5.108 7.003 ( -2.446 -2.770 -0.643) 3.751 8.665 ( -1.294 -1.661 1.467) 2.566 10.680 ( 0.643 16.048 -0.682) 16.075 11.598 ( -1.205 9.286 -3.624) 10.040 13.319 ( -0.899 -1.150 2.371) 2.784 14.446 ( -1.141 1.736 0.717) 2.198 14.540 ( 1.207 -0.653 0.247) 1.394 14.765 ( 3.281 2.242 0.289) 3.984 15.818 ( -4.359 1.096 -1.271) 4.671 16.420 ( 5.859 0.796 0.481) 5.933 17.493 ( 3.820 -1.385 1.572) 4.357 19.248 ( -1.205 -1.213 -0.446) 1.767 19.878 ( -0.163 -1.129 0.796) 1.391 21.105 ( -2.004 -7.304 -0.698) 7.606 56.312 ( -0.577 -12.456 2.400) 12.698 56.954 ( -3.713 -15.197 -0.410) 15.649 ======================= Grid point 569 (278/322) ======================= q-point: ( 0.31 0.31 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.203 ( 5.336 0.000 -3.737) 6.514 2.269 ( 4.397 0.000 2.548) 5.082 2.381 ( -1.155 -0.000 7.703) 7.789 2.880 ( 34.770 0.000 -6.575) 35.386 3.206 ( -8.347 -0.000 4.988) 9.724 3.366 ( -11.386 -0.000 9.952) 15.122 3.778 ( -4.367 -0.000 -18.362) 18.874 4.272 ( 20.905 0.000 2.816) 21.094 4.519 ( -3.660 -0.000 -0.408) 3.683 4.716 ( 0.526 0.000 1.069) 1.191 4.980 ( -6.758 -0.000 6.014) 9.047 5.795 ( 2.817 0.000 -0.409) 2.847 5.857 ( 3.652 0.000 3.418) 5.002 6.164 ( -0.578 -0.000 -2.820) 2.878 6.728 ( -12.928 -0.000 -1.552) 13.021 8.763 ( -2.271 -0.000 -2.316) 3.244 9.537 ( -4.267 -0.000 1.439) 4.503 11.036 ( 1.870 0.000 2.035) 2.764 13.271 ( -3.041 -0.000 -2.716) 4.078 14.463 ( 2.055 0.000 0.559) 2.129 14.667 ( -0.929 -0.000 -0.576) 1.093 15.024 ( 1.473 0.000 5.755) 5.941 15.555 ( 4.477 0.000 0.060) 4.477 16.877 ( 9.827 0.000 -2.563) 10.156 18.191 ( 16.275 0.000 3.672) 16.684 19.153 ( -5.097 -0.000 1.406) 5.288 19.992 ( 0.666 0.000 0.579) 0.882 21.175 ( -8.141 -0.000 0.815) 8.182 56.441 ( -16.585 -0.000 -12.507) 20.772 57.402 ( -10.515 -0.000 0.920) 10.555 ======================= Grid point 570 (279/322) ======================= q-point: ( 0.38 0.31 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.421 ( 5.506 -17.254 -5.375) 18.892 2.225 ( 8.514 3.650 3.110) 9.771 2.538 ( 1.462 -8.928 7.614) 11.824 3.011 ( -13.787 3.531 1.659) 14.329 3.142 ( 23.576 2.685 0.301) 23.730 3.383 ( -3.210 -5.306 7.120) 9.442 3.753 ( -5.175 -3.565 -17.403) 18.503 4.319 ( 1.060 3.345 -0.520) 3.548 4.536 ( 15.792 2.603 -0.638) 16.018 4.720 ( -0.272 1.030 4.933) 5.047 4.956 ( -5.681 -1.869 4.255) 7.340 5.783 ( -1.093 2.842 -0.185) 3.050 5.902 ( 4.531 -0.894 3.773) 5.964 6.199 ( -0.348 -4.884 -3.788) 6.191 6.626 ( -13.387 0.138 -1.350) 13.456 8.725 ( -1.606 1.774 -1.017) 2.600 9.606 ( -3.745 -9.564 0.619) 10.289 11.090 ( 1.402 -3.936 1.557) 4.459 13.244 ( -2.756 0.070 -2.455) 3.691 14.476 ( 1.969 0.308 0.690) 2.109 14.650 ( -1.077 0.888 -0.644) 1.537 15.026 ( -0.906 0.733 3.815) 3.989 15.602 ( 5.873 -0.575 2.185) 6.292 16.932 ( 8.250 0.802 -2.420) 8.635 18.295 ( 16.686 2.326 2.763) 17.073 19.113 ( -5.957 0.226 1.459) 6.137 19.986 ( 0.636 1.225 0.796) 1.594 21.098 ( -7.316 2.146 0.617) 7.649 56.287 ( -13.354 2.154 -11.410) 17.696 57.274 ( -9.375 5.637 1.213) 11.007 ======================= Grid point 571 (280/322) ======================= q-point: ( 0.46 0.31 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.816 ( 6.338 -17.522 -6.563) 19.755 2.293 ( 13.031 -1.248 1.874) 13.224 2.721 ( 3.248 -7.008 7.364) 10.673 2.770 ( -15.856 7.910 7.277) 19.156 3.238 ( 3.962 -0.739 -2.019) 4.507 3.537 ( 10.640 -5.076 3.841) 12.399 3.775 ( -6.449 -6.577 -13.643) 16.461 4.235 ( -5.658 1.815 -3.783) 7.044 4.598 ( 18.189 4.762 3.740) 19.171 4.665 ( 0.348 5.325 6.522) 8.427 4.996 ( -2.900 -4.845 -0.487) 5.667 5.667 ( -7.780 5.321 -0.692) 9.451 5.958 ( 4.385 -0.492 3.246) 5.478 6.313 ( 2.892 -5.798 -4.526) 7.903 6.540 ( -12.589 -1.751 0.121) 12.711 8.684 ( -0.528 1.505 0.757) 1.765 9.833 ( -3.212 -16.163 -0.492) 16.486 11.205 ( 0.715 -6.844 0.348) 6.890 13.223 ( -2.098 -0.196 -1.720) 2.721 14.483 ( 1.666 0.460 0.750) 1.884 14.619 ( -1.129 1.261 -0.594) 1.794 15.001 ( -1.429 1.364 2.477) 3.168 15.660 ( 5.088 -0.732 2.970) 5.937 16.954 ( 5.991 1.977 -1.852) 6.575 18.347 ( 15.459 4.945 1.487) 16.298 19.065 ( -6.311 0.221 1.288) 6.445 19.958 ( 0.373 2.040 0.956) 2.283 20.995 ( -5.684 3.503 0.157) 6.679 56.145 ( -9.013 2.071 -9.365) 13.161 57.066 ( -7.090 9.780 1.983) 12.241 ======================= Grid point 572 (281/322) ======================= q-point: ( 0.54 0.31 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.058 ( 8.994 0.112 -0.266) 8.998 2.405 ( 9.188 1.381 -3.875) 10.067 2.563 ( -15.324 -1.357 6.090) 16.545 2.899 ( 6.373 -6.898 2.712) 9.775 3.239 ( -0.285 1.353 -4.567) 4.771 3.640 ( 3.459 0.472 6.748) 7.597 3.924 ( -0.471 -11.906 -3.037) 12.297 4.188 ( -5.678 -2.953 -8.319) 10.496 4.534 ( -3.552 6.412 11.023) 13.238 4.661 ( 18.808 4.095 -1.741) 19.327 5.075 ( -0.112 -4.118 -1.002) 4.240 5.482 ( -12.159 5.555 -1.800) 13.489 5.981 ( 2.388 1.151 1.731) 3.166 6.417 ( 3.022 -2.966 -3.624) 5.573 6.534 ( -7.911 -5.410 1.502) 9.701 8.664 ( 0.342 0.698 1.279) 1.497 10.157 ( -2.413 -19.219 -0.761) 19.384 11.356 ( 0.133 -8.419 -1.139) 8.497 13.218 ( -1.307 -0.711 -0.674) 1.633 14.487 ( 1.215 0.256 0.720) 1.435 14.587 ( -1.129 1.074 -0.433) 1.618 14.966 ( -0.814 1.706 1.822) 2.626 15.710 ( 3.397 -0.720 2.456) 4.253 16.934 ( 3.480 3.552 -1.110) 5.095 18.321 ( 10.859 8.270 0.767) 13.671 19.027 ( -4.569 -0.615 0.779) 4.676 19.920 ( 0.054 2.154 0.925) 2.345 20.891 ( -3.491 3.623 -0.423) 5.049 56.056 ( -5.361 0.308 -6.750) 8.626 56.815 ( -4.162 12.147 2.614) 13.104 ======================= Grid point 573 (282/322) ======================= q-point: ( 0.62 0.31 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.954 ( 8.278 14.597 6.928) 18.155 2.278 ( -7.167 7.673 -6.265) 12.227 2.681 ( 0.313 -9.598 0.978) 9.653 3.053 ( 3.553 -2.992 0.053) 4.645 3.179 ( -1.082 1.387 -7.046) 7.263 3.639 ( 3.265 3.322 8.101) 9.344 4.108 ( -5.142 -7.271 6.213) 10.859 4.259 ( 4.953 -5.220 -9.433) 11.864 4.417 ( -5.672 2.497 6.753) 9.165 4.735 ( 12.215 -0.920 -3.202) 12.661 5.128 ( 2.534 0.539 0.487) 2.636 5.309 ( -12.135 1.154 -3.267) 12.620 5.963 ( 0.720 1.660 0.451) 1.865 6.466 ( -1.018 -1.981 0.979) 2.433 6.615 ( -0.572 -5.323 -0.921) 5.433 8.661 ( 0.600 0.262 0.805) 1.037 10.509 ( -1.235 -18.244 -0.395) 18.290 11.517 ( -0.134 -8.448 -2.408) 8.785 13.229 ( -0.733 -1.162 0.408) 1.433 14.495 ( 0.703 -0.260 0.663) 1.001 14.562 ( -1.019 0.586 -0.130) 1.183 14.932 ( 0.106 1.770 1.388) 2.252 15.746 ( 1.770 -0.829 1.319) 2.358 16.865 ( 1.283 5.248 -0.481) 5.424 18.186 ( 4.000 11.347 1.045) 12.077 19.031 ( -1.229 -1.887 0.066) 2.253 19.884 ( -0.113 1.639 0.758) 1.809 20.812 ( -1.315 2.447 -1.018) 2.958 56.035 ( -3.599 -2.365 -3.738) 5.702 56.561 ( -0.883 12.522 2.402) 12.781 ======================= Grid point 574 (283/322) ======================= q-point: (-0.31 -0.69 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.732 ( 6.024 13.712 3.474) 15.374 2.035 ( -7.542 10.382 -2.337) 13.044 2.800 ( -0.414 1.077 -1.156) 1.633 3.036 ( 2.445 0.073 -1.598) 2.922 3.241 ( -2.444 -7.009 -2.904) 7.971 3.577 ( 2.896 6.592 5.238) 8.904 4.131 ( -3.939 1.431 -1.321) 4.395 4.343 ( 2.085 -2.126 7.752) 8.304 4.423 ( 1.265 -1.918 -1.508) 2.748 4.865 ( 2.272 -7.234 -6.508) 9.993 5.080 ( 0.237 3.594 1.037) 3.748 5.298 ( -2.180 -4.541 -1.989) 5.416 5.937 ( 0.329 1.435 0.160) 1.481 6.484 ( -2.456 -0.807 2.674) 3.719 6.712 ( 1.911 -4.430 -1.812) 5.153 8.661 ( 0.326 0.259 0.204) 0.464 10.815 ( 0.111 -13.583 0.074) 13.583 11.662 ( -0.071 -6.910 -3.174) 7.605 13.249 ( -0.579 -1.228 1.282) 1.867 14.509 ( 0.195 -0.706 0.686) 1.004 14.548 ( -0.681 0.262 0.263) 0.776 14.902 ( 0.497 1.789 0.768) 2.009 15.775 ( 0.773 -1.184 0.242) 1.435 16.754 ( -0.170 6.482 -0.090) 6.485 17.967 ( -0.557 12.271 1.734) 12.405 19.075 ( 0.560 -2.607 -0.273) 2.681 19.860 ( -0.118 0.863 0.570) 1.041 20.779 ( 0.160 0.315 -1.528) 1.569 56.075 ( -4.589 -4.704 0.742) 6.613 56.348 ( 3.120 9.940 -0.160) 10.419 ======================= Grid point 575 (284/322) ======================= q-point: (-0.23 0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.528 ( -9.157 7.248 -3.821) 12.288 1.823 ( 7.043 9.584 5.066) 12.928 2.643 ( -1.056 10.991 -1.286) 11.116 3.123 ( -2.246 -6.135 -2.863) 7.133 3.348 ( -0.873 -4.914 -0.564) 5.023 3.465 ( 3.817 7.116 1.974) 8.313 4.056 ( -3.567 2.121 -0.600) 4.193 4.397 ( -2.589 -1.864 3.378) 4.646 4.446 ( 3.795 0.747 -0.007) 3.868 4.987 ( 0.937 -4.312 -6.149) 7.569 5.037 ( 0.739 1.311 1.183) 1.914 5.408 ( 1.450 -6.829 0.230) 6.985 5.912 ( 0.667 1.622 0.262) 1.773 6.472 ( -2.403 0.573 2.236) 3.332 6.803 ( 1.656 -3.911 -1.708) 4.578 8.656 ( -0.168 0.384 0.034) 0.421 11.015 ( 1.192 -6.288 0.202) 6.403 11.762 ( 0.021 -3.917 -3.500) 5.253 13.269 ( -0.728 -0.989 1.891) 2.254 14.522 ( -0.415 -0.380 0.699) 0.897 14.541 ( -0.088 0.313 0.652) 0.728 14.870 ( 0.235 1.905 0.011) 1.920 15.805 ( 0.359 -1.485 -0.384) 1.576 16.623 ( -0.461 6.472 0.174) 6.491 17.740 ( -1.216 10.352 2.176) 10.648 19.130 ( 0.435 -2.673 -0.158) 2.713 19.850 ( -0.085 0.187 0.441) 0.486 20.797 ( 0.517 -2.235 -1.830) 2.934 56.100 ( -4.535 0.559 7.384) 8.684 56.285 ( 4.162 -2.591 -5.810) 7.602 ======================= Grid point 576 (285/322) ======================= q-point: (-0.15 0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.306 ( -18.961 3.343 -2.674) 19.438 1.820 ( 17.650 1.951 5.522) 18.596 2.423 ( -0.524 10.340 -0.445) 10.362 3.164 ( -7.218 -2.052 -9.894) 12.418 3.349 ( 10.410 5.809 3.592) 12.451 3.452 ( 0.067 -1.776 1.026) 2.052 4.013 ( -6.784 -1.515 0.670) 6.984 4.403 ( -0.350 -0.379 0.190) 0.549 4.452 ( -0.761 0.298 1.879) 2.049 4.963 ( -1.457 3.461 -3.395) 5.063 5.085 ( 5.631 -1.379 -0.838) 5.858 5.556 ( 0.006 -7.271 1.643) 7.454 5.885 ( 1.520 2.010 0.273) 2.535 6.437 ( -1.629 1.731 0.886) 2.537 6.879 ( 0.133 -3.473 -1.287) 3.706 8.646 ( -0.643 0.267 0.399) 0.802 11.064 ( 1.549 2.328 -0.158) 2.801 11.792 ( -0.307 0.394 -3.584) 3.619 13.283 ( -0.972 -0.826 2.153) 2.503 14.512 ( -1.077 1.063 0.877) 1.749 14.537 ( 0.430 0.251 0.573) 0.759 14.837 ( 0.675 1.662 -0.200) 1.805 15.828 ( -0.718 -0.766 -0.729) 1.278 16.516 ( 1.218 4.547 0.486) 4.732 17.580 ( 0.962 6.234 2.077) 6.641 19.178 ( -0.470 -2.291 0.086) 2.340 19.852 ( -0.101 -0.283 0.434) 0.528 20.862 ( -0.264 -4.588 -1.842) 4.951 56.076 ( -0.171 -0.288 4.761) 4.772 56.429 ( -0.891 -10.505 -3.076) 10.983 ======================= Grid point 577 (286/322) ======================= q-point: (-0.08 0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.173 ( -9.522 -1.594 0.798) 9.687 1.971 ( 15.528 -2.923 4.696) 16.484 2.253 ( 0.712 7.281 -0.148) 7.317 3.102 ( -1.431 1.300 -14.289) 14.419 3.346 ( 10.012 4.260 4.138) 11.641 3.448 ( 2.546 3.428 2.729) 5.067 4.002 ( -11.535 -3.249 1.907) 12.135 4.420 ( -0.929 -1.766 0.883) 2.182 4.435 ( -3.073 -0.165 1.007) 3.237 4.852 ( -2.682 5.788 -2.344) 6.797 5.135 ( 6.551 0.645 -1.162) 6.684 5.679 ( -1.629 -5.646 2.178) 6.267 5.863 ( 2.705 1.848 0.099) 3.278 6.387 ( -0.263 2.678 -0.703) 2.781 6.931 ( -2.123 -2.742 -0.767) 3.552 8.641 ( -1.044 -0.324 1.096) 1.548 10.947 ( 0.935 10.634 -0.779) 10.703 11.726 ( -1.043 5.356 -3.412) 6.435 13.294 ( -1.274 -0.892 1.784) 2.367 14.474 ( -1.211 1.858 0.926) 2.403 14.542 ( 0.969 -0.114 0.520) 1.106 14.821 ( 2.430 1.138 0.533) 2.736 15.809 ( -3.244 1.196 -1.176) 3.652 16.482 ( 4.913 1.362 0.728) 5.150 17.528 ( 4.342 1.516 1.654) 4.887 19.210 ( -1.422 -1.684 0.228) 2.215 19.861 ( -0.145 -0.688 0.588) 0.917 20.957 ( -1.888 -6.171 -1.578) 6.644 56.140 ( 0.333 -5.648 1.343) 5.815 56.643 ( -4.060 -13.621 -0.570) 14.225 ======================= Grid point 583 (287/322) ======================= q-point: ( 0.38 0.38 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.254 ( 3.288 0.000 -4.494) 5.569 2.379 ( 9.594 0.000 1.056) 9.652 2.412 ( 1.671 0.000 9.147) 9.298 2.950 ( -14.962 -0.000 1.469) 15.034 3.242 ( -10.039 -0.000 10.951) 14.856 3.417 ( 27.625 0.000 0.635) 27.632 3.660 ( -3.013 -0.000 -19.558) 19.789 4.305 ( -9.203 -0.000 -4.683) 10.326 4.723 ( 23.671 0.000 0.394) 23.674 4.725 ( 0.367 0.000 0.607) 0.709 4.915 ( -5.742 -0.000 10.719) 12.160 5.829 ( 2.013 0.000 -0.495) 2.073 5.938 ( 5.631 0.000 5.304) 7.736 6.104 ( -5.676 -0.000 -5.136) 7.655 6.528 ( -13.362 -0.000 -1.924) 13.500 8.729 ( -1.436 -0.000 -1.953) 2.424 9.489 ( -2.907 -0.000 1.447) 3.247 11.065 ( 1.252 0.000 1.925) 2.296 13.221 ( -2.620 -0.000 -2.243) 3.449 14.495 ( 1.972 0.000 0.856) 2.150 14.648 ( -1.386 -0.000 -0.757) 1.579 15.028 ( -1.656 -0.000 2.377) 2.897 15.647 ( 6.206 0.000 3.363) 7.058 16.990 ( 6.619 0.000 -2.474) 7.066 18.442 ( 16.373 0.000 2.240) 16.525 19.072 ( -6.565 -0.000 1.309) 6.694 20.004 ( 0.659 0.000 0.925) 1.136 21.070 ( -6.395 -0.000 0.868) 6.454 56.195 ( -12.085 -0.000 -9.926) 15.639 57.266 ( -8.146 -0.000 0.759) 8.181 ======================= Grid point 584 (288/322) ======================= q-point: ( 0.46 0.38 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.459 ( 1.809 -17.948 -4.798) 18.666 2.391 ( 12.451 1.051 3.008) 12.853 2.587 ( 1.581 -8.358 6.616) 10.776 2.792 ( -15.817 4.273 5.937) 17.426 3.208 ( -6.742 -1.389 7.926) 10.497 3.610 ( 20.683 -1.265 -5.141) 21.350 3.633 ( -1.624 -1.774 -12.699) 12.925 4.202 ( -10.945 1.509 -5.635) 12.402 4.725 ( 0.906 1.241 5.236) 5.457 4.836 ( 11.007 3.721 -0.604) 11.634 4.922 ( 5.243 -1.725 6.387) 8.441 5.739 ( -4.634 7.289 -1.170) 8.717 5.996 ( 6.297 -0.305 5.005) 8.049 6.167 ( -1.526 -8.871 -4.695) 10.152 6.431 ( -12.058 -0.183 -1.721) 12.181 8.705 ( -0.765 1.099 -0.749) 1.534 9.564 ( -2.099 -9.214 0.610) 9.469 11.111 ( 0.723 -3.572 1.436) 3.918 13.201 ( -2.107 -0.172 -1.597) 2.650 14.506 ( 1.692 0.438 0.913) 1.972 14.629 ( -1.471 0.766 -0.668) 1.788 15.013 ( -1.332 0.659 1.417) 2.053 15.696 ( 4.985 -0.122 3.386) 6.028 17.017 ( 4.357 0.977 -2.071) 4.922 18.533 ( 14.329 2.703 1.174) 14.629 19.024 ( -6.382 0.149 0.884) 6.445 19.997 ( 0.413 1.333 1.044) 1.743 21.011 ( -4.709 1.951 0.818) 5.162 56.092 ( -9.150 0.886 -7.442) 11.827 57.166 ( -5.692 5.099 0.987) 7.706 ======================= Grid point 585 (289/322) ======================= q-point: ( 0.54 0.38 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.852 ( 0.820 -20.448 -4.282) 20.908 2.493 ( 11.402 0.090 1.448) 11.493 2.545 ( -13.765 6.505 8.929) 17.649 2.813 ( 4.407 -7.668 2.592) 9.216 3.214 ( -3.266 -1.903 3.616) 5.231 3.634 ( -5.235 -3.815 -5.633) 8.584 3.777 ( 14.078 -2.750 -2.785) 14.612 4.098 ( -9.281 -0.306 -6.574) 11.377 4.667 ( -0.852 6.433 10.812) 12.609 4.828 ( 5.405 1.512 -3.697) 6.721 5.028 ( 9.708 -1.912 0.883) 9.934 5.531 ( -9.090 8.175 -1.570) 12.326 6.035 ( 4.524 1.499 2.657) 5.456 6.340 ( 0.178 -9.208 -2.728) 9.606 6.374 ( -6.980 -1.960 -0.487) 7.266 8.682 ( 0.007 0.872 0.540) 1.026 9.799 ( -1.140 -15.919 -0.428) 15.965 11.212 ( 0.125 -6.372 0.414) 6.387 13.194 ( -1.428 -0.580 -0.665) 1.679 14.507 ( 1.141 0.665 0.785) 1.536 14.599 ( -1.308 1.098 -0.385) 1.750 14.990 ( -0.445 1.150 0.978) 1.574 15.732 ( 3.161 -0.047 2.401) 3.969 17.007 ( 1.882 2.217 -1.387) 3.222 18.534 ( 8.188 6.251 0.424) 10.310 18.989 ( -3.122 -0.428 0.095) 3.152 19.965 ( 0.056 2.189 1.019) 2.415 20.935 ( -2.555 3.163 0.541) 4.102 56.012 ( -6.086 0.515 -4.382) 7.516 57.000 ( -2.539 9.036 1.349) 9.483 ======================= Grid point 586 (290/322) ======================= q-point: (-0.38 -0.62 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.155 ( 1.822 -7.426 -0.101) 7.647 2.309 ( -13.880 7.753 8.203) 17.890 2.567 ( 9.316 -1.017 -3.500) 10.004 2.969 ( 0.849 -5.963 -0.271) 6.029 3.217 ( 0.527 1.872 -3.469) 3.977 3.701 ( 1.744 -2.811 8.714) 9.321 3.901 ( -5.879 -7.983 1.252) 9.993 4.111 ( 2.280 -6.358 -11.489) 13.327 4.529 ( -1.506 7.989 8.750) 11.944 4.827 ( 3.946 2.033 -4.078) 6.028 5.132 ( 4.648 -3.334 -1.222) 5.850 5.315 ( -5.127 7.793 -0.327) 9.334 6.014 ( 1.580 2.705 0.107) 3.134 6.387 ( -6.502 -3.950 3.729) 8.473 6.510 ( 4.627 -6.533 -3.590) 8.774 8.673 ( 0.348 0.455 0.617) 0.842 10.137 ( 0.127 -19.188 -0.672) 19.200 11.352 ( -0.231 -8.061 -0.689) 8.093 13.201 ( -0.911 -1.072 0.332) 1.445 14.502 ( 0.355 0.442 0.483) 0.745 14.570 ( -0.817 0.931 0.120) 1.244 14.967 ( 0.505 1.466 0.743) 1.720 15.752 ( 1.442 -0.094 0.960) 1.735 16.954 ( -0.267 3.690 -0.676) 3.761 18.409 ( -0.082 9.691 0.582) 9.709 19.000 ( 1.628 -1.213 -0.844) 2.199 19.922 ( -0.154 2.240 0.868) 2.407 20.861 ( -0.445 3.294 0.067) 3.324 55.973 ( -4.150 -0.741 -1.173) 4.376 56.796 ( 0.705 11.444 1.169) 11.525 ======================= Grid point 587 (291/322) ======================= q-point: (-0.31 -0.62 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.027 ( -5.956 14.123 3.381) 15.696 2.157 ( -2.354 5.369 1.955) 6.179 2.711 ( 3.774 -7.385 -1.887) 8.506 3.076 ( -1.968 -5.699 1.605) 6.239 3.127 ( -1.924 5.116 -5.835) 7.995 3.705 ( 1.301 3.924 2.855) 5.024 4.053 ( -2.566 -8.070 6.867) 10.902 4.287 ( -0.649 -9.017 -7.681) 11.863 4.404 ( 3.243 4.007 6.167) 8.038 4.788 ( -3.314 0.509 -7.216) 7.957 5.145 ( -6.010 1.466 -1.110) 6.285 5.259 ( 12.386 0.419 1.409) 12.473 5.974 ( 0.658 2.078 -0.593) 2.259 6.421 ( -5.465 -3.142 4.565) 7.783 6.646 ( 4.844 -4.680 -3.102) 7.416 8.669 ( 0.181 0.316 0.054) 0.369 10.509 ( 1.418 -18.295 -0.404) 18.354 11.508 ( -0.171 -8.293 -1.541) 8.437 13.220 ( -0.782 -1.371 1.165) 1.962 14.499 ( -0.425 -0.210 0.237) 0.530 14.554 ( -0.129 0.519 0.695) 0.877 14.942 ( 0.929 1.764 0.377) 2.029 15.764 ( 0.363 -0.514 -0.318) 0.704 16.861 ( -1.644 5.152 -0.140) 5.410 18.183 ( -4.748 11.446 1.229) 12.453 19.045 ( 3.270 -1.542 -1.199) 3.809 19.885 ( -0.141 1.650 0.690) 1.794 20.807 ( 1.020 2.355 -0.577) 2.630 55.976 ( -3.898 -2.484 2.046) 5.055 56.585 ( 3.634 11.841 -0.134) 12.387 ======================= Grid point 588 (292/322) ======================= q-point: (-0.23 -0.62 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.673 ( -11.729 15.121 -4.779) 19.725 2.047 ( 5.816 7.195 8.016) 12.241 2.798 ( -0.330 2.416 -0.074) 2.440 2.994 ( -6.108 0.812 -4.483) 7.620 3.210 ( -0.866 -7.830 1.178) 7.965 3.623 ( 2.134 5.491 -0.643) 5.926 4.095 ( -2.337 2.791 3.228) 4.865 4.327 ( -3.108 -3.435 1.953) 5.027 4.483 ( 4.869 -0.167 -1.133) 5.002 4.818 ( -4.680 -9.462 -6.674) 12.489 5.094 ( 2.117 2.604 0.517) 3.395 5.358 ( 8.861 -2.040 0.818) 9.130 5.945 ( 0.672 1.362 -0.385) 1.567 6.438 ( -4.796 -1.787 3.912) 6.442 6.750 ( 3.825 -3.351 -2.576) 5.701 8.662 ( -0.216 0.395 -0.315) 0.550 10.834 ( 2.270 -13.544 -0.145) 13.734 11.653 ( 0.171 -6.825 -2.125) 7.150 13.243 ( -0.968 -1.311 1.735) 2.380 14.504 ( -0.910 -0.741 0.190) 1.189 14.550 ( 0.425 0.227 1.145) 1.242 14.911 ( 0.493 2.120 -0.194) 2.185 15.781 ( 0.146 -1.204 -0.987) 1.564 16.738 ( -1.971 6.028 0.207) 6.345 17.929 ( -5.251 10.853 1.892) 12.204 19.096 ( 2.560 -1.645 -0.889) 3.170 19.861 ( -0.050 0.868 0.549) 1.028 20.786 ( 1.449 0.611 -1.265) 2.018 56.014 ( -4.906 -3.962 5.522) 8.382 56.409 ( 5.764 9.263 -2.949) 11.301 ======================= Grid point 589 (293/322) ======================= q-point: (-0.15 -0.62 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.300 ( -16.078 11.029 -5.385) 20.227 2.012 ( 12.216 4.455 8.075) 15.307 2.631 ( -0.701 11.206 1.182) 11.289 2.998 ( -10.151 -6.017 -8.404) 14.488 3.354 ( 0.550 -6.488 3.123) 7.222 3.540 ( 5.718 5.511 -2.232) 8.249 4.001 ( -4.696 3.604 2.740) 6.523 4.375 ( -1.006 -2.089 -0.095) 2.321 4.467 ( -0.506 1.613 -0.755) 1.852 4.984 ( 0.709 -6.846 -4.488) 8.216 5.065 ( 3.007 1.777 1.387) 3.758 5.465 ( 5.191 -3.520 1.206) 6.387 5.927 ( 1.103 1.246 -0.067) 1.666 6.434 ( -3.526 -0.408 2.309) 4.235 6.824 ( 1.855 -2.613 -1.874) 3.713 8.650 ( -0.552 0.477 -0.147) 0.744 11.041 ( 2.240 -6.009 -0.213) 6.416 11.754 ( 0.360 -3.607 -2.644) 4.487 13.261 ( -1.192 -1.036 2.025) 2.568 14.510 ( -1.136 -0.402 0.230) 1.226 14.551 ( 0.700 0.384 1.368) 1.584 14.871 ( -0.024 1.896 -0.526) 1.968 15.806 ( 0.055 -1.235 -1.059) 1.628 16.615 ( -0.853 5.296 0.495) 5.387 17.719 ( -2.548 7.932 2.132) 8.599 19.140 ( 0.963 -1.614 -0.267) 1.898 19.851 ( -0.024 0.225 0.475) 0.526 20.801 ( 0.779 -1.538 -1.796) 2.489 56.061 ( -4.120 -2.735 7.782) 9.220 56.329 ( 4.379 1.467 -5.586) 7.248 ======================= Grid point 590 (294/322) ======================= q-point: (-0.08 0.38 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.058 ( -13.140 0.844 -1.893) 13.302 2.076 ( 14.579 0.602 6.731) 16.069 2.425 ( 0.655 9.773 1.323) 9.884 3.019 ( -6.936 -4.587 -13.030) 15.457 3.464 ( 0.861 -3.323 4.176) 5.406 3.493 ( 7.668 3.868 -2.353) 8.905 3.914 ( -6.717 1.534 3.333) 7.653 4.393 ( -0.787 -1.009 -1.749) 2.167 4.428 ( -3.004 1.461 3.084) 4.546 4.962 ( 2.478 5.944 -3.655) 7.405 5.144 ( 2.255 -3.803 0.361) 4.436 5.569 ( 0.745 -4.693 1.780) 5.075 5.912 ( 1.857 1.382 0.044) 2.315 6.413 ( -1.633 0.759 0.335) 1.832 6.871 ( -0.712 -2.066 -1.047) 2.423 8.637 ( -0.710 0.333 0.478) 0.918 11.085 ( 1.161 2.868 -0.596) 3.151 11.778 ( 0.028 1.038 -3.125) 3.293 13.272 ( -1.319 -0.787 1.842) 2.398 14.497 ( -1.167 1.029 0.555) 1.652 14.551 ( 0.966 0.285 1.105) 1.495 14.847 ( 0.523 0.596 -0.034) 0.793 15.810 ( -1.186 0.562 -0.910) 1.597 16.544 ( 2.145 2.283 0.727) 3.215 17.607 ( 1.928 3.637 1.819) 4.500 19.170 ( -0.719 -1.442 0.305) 1.640 19.852 ( -0.081 -0.239 0.506) 0.566 20.848 ( -0.773 -3.594 -2.011) 4.191 56.088 ( 0.047 -1.397 3.508) 3.776 56.400 ( -1.904 -7.844 -2.512) 8.454 ======================= Grid point 597 (295/322) ======================= q-point: ( 0.46 0.46 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.263 ( -0.619 -0.000 -2.628) 2.700 2.483 ( 4.140 0.000 6.690) 7.867 2.534 ( 9.193 0.000 1.809) 9.369 2.723 ( -14.833 -0.000 5.188) 15.714 3.157 ( -6.460 -0.000 12.229) 13.830 3.569 ( -0.475 -0.000 -19.050) 19.056 3.766 ( 19.266 0.000 0.253) 19.267 4.113 ( -14.155 -0.000 -6.161) 15.437 4.732 ( 0.397 0.000 0.069) 0.403 4.878 ( -2.844 -0.000 9.346) 9.769 5.037 ( 16.260 0.000 0.109) 16.261 5.849 ( 0.894 0.000 -0.639) 1.099 5.965 ( -8.157 -0.000 0.931) 8.210 6.073 ( 8.356 0.000 -0.023) 8.356 6.347 ( -9.446 -0.000 -3.085) 9.937 8.709 ( -0.644 -0.000 -1.361) 1.506 9.465 ( -1.005 -0.000 1.244) 1.600 11.083 ( 0.377 0.000 1.682) 1.724 13.183 ( -1.716 -0.000 -1.034) 2.003 14.523 ( 1.354 0.000 0.919) 1.636 14.624 ( -1.511 -0.000 -0.455) 1.578 15.013 ( -0.574 -0.000 0.623) 0.847 15.733 ( 3.684 0.000 2.862) 4.664 17.047 ( 2.076 0.000 -1.849) 2.780 18.653 ( 10.288 0.000 0.402) 10.296 18.984 ( -4.389 -0.000 0.067) 4.390 20.014 ( 0.167 0.000 1.120) 1.133 21.003 ( -2.935 -0.000 1.206) 3.173 56.029 ( -7.421 -0.000 -4.513) 8.685 57.183 ( -3.275 -0.000 0.723) 3.354 ======================= Grid point 598 (296/322) ======================= q-point: (-0.46 -0.54 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.442 ( -2.683 -18.045 -1.436) 18.299 2.518 ( -14.825 2.184 9.300) 17.636 2.584 ( 11.400 -3.365 2.022) 12.057 2.713 ( 4.312 -3.880 1.038) 5.893 3.159 ( -3.084 -1.973 11.440) 12.011 3.542 ( -1.157 -0.390 -15.729) 15.776 3.869 ( 7.881 1.019 1.147) 8.029 4.006 ( -8.986 -0.683 -5.721) 10.674 4.752 ( 1.005 -0.647 2.790) 3.035 4.839 ( -2.409 2.859 5.227) 6.427 5.112 ( 8.037 1.169 -3.321) 8.774 5.667 ( -2.623 10.379 -0.191) 10.707 6.087 ( 1.592 -5.122 4.450) 6.969 6.136 ( -1.266 -4.243 -2.265) 4.973 6.312 ( -0.044 -2.046 -3.298) 3.881 8.697 ( -0.167 0.605 -0.441) 0.767 9.551 ( 0.059 -8.967 0.461) 8.979 11.120 ( -0.136 -3.358 1.252) 3.586 13.175 ( -1.118 -0.311 -0.188) 1.176 14.527 ( 0.570 0.529 0.606) 0.986 14.607 ( -1.104 0.680 0.076) 1.298 15.008 ( 0.475 0.585 0.221) 0.785 15.756 ( 1.850 0.117 1.534) 2.406 17.041 ( -0.407 1.008 -1.295) 1.691 18.665 ( 0.888 3.396 -0.236) 3.519 18.975 ( 2.179 -0.232 -1.118) 2.460 20.002 ( -0.225 1.384 1.084) 1.772 20.973 ( -0.762 1.873 1.321) 2.415 55.975 ( -4.912 0.343 -1.032) 5.030 57.125 ( -0.223 4.754 0.840) 4.832 ======================= Grid point 599 (297/322) ======================= q-point: (-0.38 -0.54 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.806 ( -5.996 -20.630 0.260) 21.486 2.366 ( -13.059 3.796 11.858) 18.043 2.691 ( 13.457 2.693 -2.921) 14.031 2.850 ( 0.000 -6.368 -1.371) 6.514 3.232 ( 4.283 -2.441 3.998) 6.347 3.541 ( -5.953 -6.566 -1.449) 8.981 3.819 ( -9.837 0.534 -1.699) 9.997 4.047 ( 7.732 -2.557 -4.137) 9.135 4.689 ( -1.445 7.572 8.071) 11.161 4.829 ( -0.686 -1.659 -3.228) 3.693 5.098 ( -3.932 0.654 -5.894) 7.115 5.494 ( 6.566 8.476 2.125) 10.930 6.081 ( 0.314 2.957 -2.071) 3.623 6.241 ( -6.192 -6.661 5.567) 10.663 6.428 ( 8.302 -5.794 -3.895) 10.847 8.685 ( 0.189 0.565 0.230) 0.638 9.799 ( 1.383 -15.850 -0.460) 15.917 11.211 ( -0.483 -6.162 0.522) 6.203 13.179 ( -0.639 -0.702 0.741) 1.204 14.514 ( -0.481 0.752 0.073) 0.895 14.586 ( -0.302 0.987 0.796) 1.303 14.999 ( 1.475 1.094 0.032) 1.837 15.760 ( 0.052 0.157 -0.132) 0.211 16.998 ( -2.574 2.107 -0.612) 3.382 18.542 ( -6.842 6.604 -0.360) 9.516 19.013 ( 6.495 -0.277 -2.135) 6.842 19.966 ( -0.467 2.176 0.941) 2.416 20.928 ( 1.289 3.156 1.159) 3.601 55.943 ( -2.859 0.220 2.399) 3.738 57.005 ( 2.775 8.656 0.721) 9.119 ======================= Grid point 600 (298/322) ======================= q-point: (-0.31 -0.54 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.030 ( -13.918 -6.445 2.127) 15.484 2.245 ( -4.748 3.380 11.093) 12.531 2.699 ( 9.679 2.697 -5.505) 11.457 2.933 ( -3.460 -5.402 -0.312) 6.423 3.221 ( 0.428 4.628 -4.629) 6.559 3.744 ( -4.056 0.861 -1.135) 4.299 3.789 ( -2.245 -17.518 9.499) 20.054 4.158 ( 5.570 -4.316 -5.574) 8.985 4.532 ( -3.062 6.976 5.479) 9.384 4.785 ( -5.174 3.476 -8.158) 10.266 5.074 ( -3.906 -2.857 -1.189) 4.984 5.442 ( 13.843 5.673 2.061) 15.102 6.021 ( -0.267 2.558 -2.469) 3.565 6.313 ( -5.380 -4.387 6.255) 9.344 6.590 ( 7.574 -5.181 -3.353) 9.770 8.677 ( 0.127 0.484 -0.047) 0.502 10.156 ( 2.702 -19.204 -0.714) 19.406 11.346 ( -0.355 -8.005 -0.200) 8.015 13.194 ( -0.524 -1.051 1.553) 1.947 14.496 ( -1.130 0.404 -0.179) 1.213 14.569 ( 0.306 0.877 1.246) 1.554 14.986 ( 1.960 1.640 -0.216) 2.565 15.754 ( -1.125 -0.208 -1.542) 1.920 16.922 ( -3.964 3.290 -0.029) 5.152 18.327 ( -10.230 8.908 0.142) 13.566 19.063 ( 6.685 -0.185 -2.485) 7.134 19.921 ( -0.404 2.131 0.767) 2.301 20.879 ( 2.708 3.544 0.676) 4.512 55.933 ( -2.084 -0.325 5.284) 5.689 56.841 ( 5.146 11.210 -0.137) 12.336 ======================= Grid point 601 (299/322) ======================= q-point: (-0.23 -0.54 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.851 ( -14.321 11.631 -1.253) 18.492 2.187 ( -0.353 3.063 9.770) 10.245 2.726 ( -3.286 -2.727 -3.272) 5.380 3.045 ( -3.597 -4.733 4.073) 7.207 3.099 ( 3.377 4.600 -5.656) 8.035 3.691 ( -1.702 1.715 -2.187) 3.259 4.073 ( -0.714 -6.642 7.067) 9.724 4.239 ( -1.835 -3.287 -0.842) 3.858 4.492 ( 4.468 -4.584 0.939) 6.469 4.648 ( -7.863 2.580 -10.052) 13.021 5.118 ( 1.289 -1.831 1.045) 2.472 5.460 ( 13.201 3.303 1.024) 13.646 5.976 ( -0.012 1.669 -1.695) 2.379 6.357 ( -5.355 -3.259 5.580) 8.393 6.717 ( 6.019 -3.397 -2.822) 7.466 8.667 ( -0.182 0.474 -0.548) 0.747 10.544 ( 3.391 -18.169 -0.503) 18.489 11.505 ( 0.291 -8.341 -0.871) 8.391 13.214 ( -0.754 -1.213 2.129) 2.564 14.486 ( -1.215 -0.327 -0.067) 1.260 14.561 ( 0.502 0.481 1.360) 1.527 14.960 ( 1.473 2.341 -0.661) 2.844 15.754 ( -1.164 -1.082 -2.198) 2.713 16.817 ( -4.314 4.382 0.308) 6.157 18.071 ( -10.601 9.446 1.111) 14.243 19.106 ( 5.294 -0.139 -2.145) 5.713 19.884 ( -0.180 1.536 0.615) 1.664 20.837 ( 3.163 2.998 -0.091) 4.359 55.942 ( -2.618 -1.405 7.405) 7.979 56.658 ( 6.557 11.822 -1.859) 13.646 ======================= Grid point 602 (300/322) ======================= q-point: (-0.15 -0.54 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.458 ( -14.195 16.231 -4.803) 22.091 2.165 ( 5.363 2.601 9.577) 11.281 2.730 ( -9.924 -2.779 -2.432) 10.589 2.891 ( -5.301 7.424 -1.323) 9.218 3.238 ( 4.767 -6.630 1.770) 8.356 3.646 ( 2.425 2.828 -3.653) 5.218 4.041 ( -6.915 3.053 2.619) 8.000 4.320 ( 1.547 -3.394 0.379) 3.749 4.512 ( -0.383 3.932 -3.676) 5.396 4.746 ( -1.350 -14.105 -2.427) 14.376 5.147 ( 4.156 1.344 0.630) 4.413 5.501 ( 9.373 1.317 0.496) 9.478 5.950 ( 0.146 0.861 -0.772) 1.166 6.382 ( -4.443 -2.271 4.072) 6.441 6.799 ( 3.947 -1.878 -2.203) 4.895 8.655 ( -0.428 0.492 -0.641) 0.914 10.873 ( 3.009 -13.122 -0.222) 13.464 11.655 ( 1.090 -6.708 -1.698) 7.005 13.234 ( -1.037 -1.145 2.453) 2.899 14.489 ( -1.083 -0.788 0.091) 1.342 14.562 ( 0.494 0.123 1.377) 1.468 14.915 ( 0.350 2.755 -1.026) 2.961 15.774 ( -0.342 -1.835 -2.017) 2.748 16.699 ( -3.506 4.754 0.457) 5.925 17.836 ( -8.129 7.649 1.977) 11.336 19.137 ( 3.314 -0.135 -1.342) 3.578 19.862 ( -0.018 0.831 0.510) 0.975 20.812 ( 2.588 1.661 -0.961) 3.221 55.975 ( -3.581 -2.989 8.659) 9.836 56.489 ( 6.583 9.933 -4.064) 12.590 ======================= Grid point 603 (301/322) ======================= q-point: (-0.08 -0.54 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.074 ( -11.684 11.053 -4.466) 16.692 2.197 ( 9.058 1.131 8.029) 12.157 2.615 ( -3.378 8.543 3.566) 9.854 2.818 ( -9.027 -5.901 -10.245) 14.875 3.382 ( 1.725 -5.388 4.099) 6.986 3.601 ( 4.213 3.642 -5.949) 8.149 3.942 ( -4.095 3.079 3.105) 5.991 4.363 ( -0.304 -0.879 -3.207) 3.339 4.449 ( -1.369 1.762 2.001) 2.997 4.974 ( -0.476 -9.497 -2.345) 9.794 5.125 ( 4.034 3.847 0.687) 5.616 5.543 ( 4.644 -0.268 0.381) 4.667 5.939 ( 0.430 0.541 -0.170) 0.712 6.395 ( -2.491 -1.208 2.030) 3.433 6.842 ( 1.367 -0.938 -1.366) 2.148 8.641 ( -0.439 0.470 -0.212) 0.677 11.070 ( 1.495 -5.265 -0.141) 5.475 11.758 ( 1.407 -3.051 -2.783) 4.362 13.250 ( -1.096 -0.904 2.428) 2.813 14.495 ( -0.921 -0.347 0.201) 1.004 14.565 ( 0.548 0.174 1.351) 1.468 14.867 ( -0.222 1.798 -0.782) 1.973 15.801 ( -0.050 -1.023 -1.342) 1.688 16.601 ( -1.283 3.153 0.557) 3.449 17.682 ( -3.396 4.020 2.193) 5.701 19.155 ( 1.169 -0.179 -0.410) 1.251 19.853 ( -0.009 0.263 0.471) 0.540 20.809 ( 1.150 -0.172 -1.687) 2.049 56.034 ( -3.154 -4.143 8.229) 9.738 56.373 ( 4.016 4.933 -5.420) 8.357 ======================= Grid point 611 (302/322) ======================= q-point: (-0.46 -0.46 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.222 ( -4.482 -0.000 1.219) 4.645 2.457 ( -15.706 -0.000 9.931) 18.583 2.557 ( 3.931 0.000 -0.045) 3.931 2.761 ( 11.684 0.000 0.919) 11.720 3.147 ( -0.652 -0.000 14.519) 14.533 3.528 ( 2.915 0.000 -16.668) 16.921 3.818 ( -19.415 -0.000 -3.001) 19.646 4.015 ( 10.116 0.000 1.585) 10.239 4.737 ( 0.492 0.000 -0.506) 0.706 4.878 ( -1.940 -0.000 7.160) 7.418 5.140 ( -1.235 -0.000 -7.525) 7.626 5.851 ( -0.328 -0.000 -0.811) 0.875 5.893 ( -1.173 -0.000 5.025) 5.160 6.146 ( -0.945 -0.000 -3.587) 3.709 6.317 ( 9.268 0.000 -0.736) 9.298 8.701 ( -0.011 -0.000 -0.633) 0.634 9.469 ( 1.069 0.000 0.876) 1.382 11.087 ( -0.611 -0.000 1.359) 1.490 13.166 ( -0.541 -0.000 0.596) 0.805 14.533 ( -0.539 -0.000 0.065) 0.543 14.609 ( -0.397 -0.000 0.930) 1.011 15.021 ( 1.603 0.000 -0.263) 1.625 15.765 ( -0.054 -0.000 -0.018) 0.056 17.036 ( -2.900 -0.000 -0.872) 3.029 18.670 ( -7.434 -0.000 -1.240) 7.537 19.010 ( 7.987 0.000 -2.356) 8.328 20.014 ( -0.686 -0.000 1.065) 1.267 20.997 ( 1.403 0.000 1.804) 2.286 55.953 ( -2.489 -0.000 2.901) 3.822 57.180 ( 2.565 0.000 0.861) 2.705 ======================= Grid point 612 (303/322) ======================= q-point: (-0.38 -0.46 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.377 ( -6.216 -17.535 2.973) 18.840 2.329 ( -14.397 2.181 10.053) 17.695 2.689 ( 3.309 -8.734 -3.269) 9.896 2.836 ( 10.449 1.046 0.920) 10.542 3.207 ( 3.495 -3.364 14.513) 15.302 3.473 ( -5.155 3.785 -10.830) 12.577 3.698 ( -14.513 -2.988 -4.779) 15.569 4.091 ( 9.277 -0.094 2.990) 9.747 4.761 ( -1.056 -1.082 0.192) 1.524 4.815 ( -5.324 3.599 2.310) 6.828 5.079 ( -4.986 1.950 -7.984) 9.613 5.705 ( 5.407 7.939 2.310) 9.879 6.037 ( -6.670 -6.033 1.802) 9.172 6.138 ( 2.430 -1.528 -2.553) 3.841 6.421 ( 12.590 -2.116 -0.754) 12.789 8.697 ( 0.301 0.406 -0.016) 0.506 9.569 ( 2.228 -8.958 0.185) 9.233 11.115 ( -0.998 -3.338 1.030) 3.633 13.168 ( -0.026 -0.284 1.486) 1.514 14.520 ( -1.515 0.505 -0.405) 1.648 14.604 ( 0.300 0.654 1.640) 1.791 15.030 ( 2.639 0.604 -0.543) 2.761 15.755 ( -2.048 0.085 -1.827) 2.746 16.998 ( -5.086 0.865 -0.260) 5.165 18.566 ( -11.335 3.222 -2.032) 11.958 19.068 ( 8.940 0.215 -3.229) 9.508 19.996 ( -1.009 1.308 0.974) 1.918 20.998 ( 3.373 1.971 1.969) 4.375 55.948 ( 0.043 0.537 6.701) 6.723 57.165 ( 5.199 4.689 0.874) 7.055 ======================= Grid point 613 (304/322) ======================= q-point: (-0.31 -0.46 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.697 ( -9.577 -17.957 4.950) 20.945 2.223 ( -11.776 0.337 9.628) 15.214 2.812 ( -4.040 -1.580 -3.236) 5.412 2.872 ( 11.693 2.080 -0.554) 11.889 3.284 ( -4.279 3.784 -7.335) 9.297 3.452 ( -2.826 -14.685 10.699) 18.387 3.696 ( -2.146 -3.005 -2.527) 4.474 4.161 ( 7.187 -0.390 1.335) 7.320 4.605 ( -14.324 6.353 -0.169) 15.671 4.810 ( 0.867 0.674 -4.423) 4.557 5.014 ( -1.025 -0.044 -2.212) 2.439 5.641 ( 9.722 5.266 1.745) 11.194 6.031 ( -4.159 -0.035 -4.287) 5.973 6.216 ( -1.311 -3.740 5.369) 6.673 6.564 ( 11.387 -3.580 -2.007) 12.105 8.690 ( 0.365 0.636 0.094) 0.740 9.834 ( 3.542 -15.966 -0.622) 16.366 11.203 ( -0.864 -6.316 0.537) 6.397 13.180 ( 0.154 -0.514 2.303) 2.365 14.495 ( -1.830 0.587 -0.479) 1.980 14.594 ( 0.565 1.016 1.843) 2.179 15.032 ( 3.147 1.314 -0.843) 3.513 15.730 ( -3.460 -0.231 -3.262) 4.761 16.931 ( -6.530 1.667 0.335) 6.748 18.382 ( -13.329 6.077 -1.893) 14.770 19.117 ( 7.957 0.488 -3.593) 8.744 19.958 ( -0.954 1.952 0.855) 2.335 20.978 ( 4.703 3.512 1.782) 6.134 55.951 ( 1.497 1.190 9.631) 9.819 57.080 ( 7.061 8.774 0.338) 11.267 ======================= Grid point 614 (305/322) ======================= q-point: (-0.23 -0.46 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.839 ( -13.971 -3.091 4.994) 15.156 2.178 ( -8.390 -1.528 8.435) 11.995 2.704 ( -8.715 3.882 -2.896) 9.970 2.956 ( 5.231 -2.980 1.765) 6.274 3.190 ( -0.517 2.081 -6.752) 7.085 3.657 ( -1.877 -3.472 -2.011) 4.429 3.874 ( 5.686 -14.127 7.975) 17.190 4.192 ( -2.389 0.208 0.077) 2.399 4.417 ( -9.921 0.882 -3.231) 10.471 4.736 ( 3.055 6.221 -6.456) 9.472 5.068 ( 1.406 -3.935 1.877) 4.581 5.630 ( 10.729 4.209 0.718) 11.547 5.992 ( -2.076 0.869 -3.907) 4.509 6.270 ( -3.824 -3.052 6.496) 8.133 6.701 ( 8.844 -3.125 -2.291) 9.656 8.678 ( 0.129 0.761 -0.393) 0.866 10.206 ( 4.232 -19.149 -0.840) 19.629 11.343 ( 0.036 -8.346 -0.086) 8.346 13.197 ( -0.043 -0.681 2.925) 3.004 14.474 ( -1.625 0.123 -0.285) 1.655 14.581 ( 0.492 0.955 1.665) 1.982 15.018 ( 2.538 2.256 -1.345) 3.652 15.711 ( -3.409 -1.204 -3.742) 5.203 16.842 ( -6.967 2.455 0.678) 7.418 18.145 ( -13.878 7.674 -0.737) 15.876 19.152 ( 6.452 0.693 -3.350) 7.303 19.916 ( -0.601 1.848 0.710) 2.069 20.940 ( 5.147 4.282 1.212) 6.805 55.953 ( 1.289 1.485 11.254) 11.424 56.936 ( 7.874 11.586 -0.948) 14.041 ======================= Grid point 615 (306/322) ======================= q-point: (-0.15 -0.46 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.635 ( -14.913 11.864 -0.243) 19.058 2.191 ( -3.054 -2.703 8.501) 9.429 2.590 ( -12.339 -0.582 -3.185) 12.757 2.961 ( -8.145 3.102 5.106) 10.101 3.228 ( 12.946 -2.085 -4.560) 13.883 3.675 ( 0.800 0.001 -1.983) 2.138 4.016 ( -8.175 0.858 -0.911) 8.270 4.249 ( 0.613 -7.861 6.315) 10.102 4.451 ( -3.102 -7.759 -8.004) 11.571 4.642 ( 6.267 4.409 -2.710) 8.128 5.153 ( 1.971 -2.858 1.543) 3.799 5.628 ( 9.413 3.825 0.015) 10.161 5.959 ( -1.476 0.646 -2.246) 2.765 6.307 ( -3.864 -2.874 5.579) 7.369 6.799 ( 6.250 -1.635 -2.041) 6.775 8.662 ( -0.131 0.705 -0.770) 1.052 10.596 ( 3.671 -17.752 -0.445) 18.133 11.513 ( 1.436 -8.619 -1.035) 8.799 13.214 ( -0.390 -0.786 3.305) 3.419 14.468 ( -1.190 -0.578 -0.035) 1.324 14.572 ( 0.207 0.523 1.326) 1.440 14.976 ( 0.933 3.142 -1.798) 3.739 15.721 ( -1.761 -2.432 -3.212) 4.397 16.741 ( -6.343 3.108 0.663) 7.094 17.903 ( -12.400 7.047 0.869) 14.289 19.173 ( 4.749 0.887 -2.600) 5.487 19.883 ( -0.233 1.332 0.556) 1.462 20.895 ( 4.658 4.154 0.330) 6.250 55.953 ( -0.156 0.737 11.517) 11.542 56.756 ( 7.632 12.505 -2.713) 14.899 ======================= Grid point 616 (307/322) ======================= q-point: (-0.08 -0.46 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.257 ( -10.828 15.310 -3.499) 19.076 2.252 ( 2.455 -1.900 7.336) 7.966 2.534 ( -14.170 -4.444 -4.237) 15.443 2.812 ( -6.071 6.041 4.189) 9.534 3.351 ( 8.770 -1.820 0.371) 8.965 3.665 ( 1.358 1.532 -4.385) 4.839 3.940 ( -5.695 0.255 -0.565) 5.729 4.350 ( 1.661 -1.370 0.664) 2.253 4.475 ( -1.258 1.337 -3.908) 4.318 4.758 ( 2.318 -10.351 -0.034) 10.608 5.198 ( 2.037 0.181 0.341) 2.073 5.617 ( 6.342 3.326 -0.451) 7.175 5.940 ( -1.352 0.024 -0.830) 1.586 6.344 ( -2.282 -2.502 3.773) 5.069 6.848 ( 3.606 -0.140 -1.460) 3.893 8.648 ( -0.174 0.545 -0.669) 0.880 10.911 ( 1.932 -12.319 0.171) 12.471 11.675 ( 2.505 -6.532 -2.449) 7.412 13.232 ( -0.547 -0.815 3.383) 3.522 14.476 ( -0.707 -0.907 0.138) 1.158 14.569 ( -0.147 0.003 1.016) 1.026 14.912 ( -0.258 3.110 -1.598) 3.506 15.762 ( -0.038 -2.672 -2.190) 3.455 16.641 ( -4.647 2.893 0.451) 5.493 17.717 ( -8.756 4.059 2.091) 9.875 19.178 ( 2.930 1.069 -1.576) 3.495 19.863 ( -0.045 0.763 0.444) 0.884 20.853 ( 3.357 3.167 -0.672) 4.664 55.968 ( -1.686 -1.381 10.579) 10.802 56.569 ( 6.255 11.271 -4.379) 13.614 ======================= Grid point 625 (308/322) ======================= q-point: (-0.38 -0.38 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.148 ( -6.848 -0.000 5.388) 8.713 2.283 ( -12.456 -0.000 11.520) 16.967 2.590 ( 2.395 0.000 -7.275) 7.660 2.908 ( 4.881 0.000 3.635) 6.086 3.230 ( 4.676 0.000 16.246) 16.906 3.474 ( -24.106 -0.000 -2.422) 24.227 3.546 ( 6.308 0.000 -13.177) 14.609 4.167 ( 9.200 0.000 6.197) 11.092 4.742 ( 0.509 0.000 -1.098) 1.210 4.773 ( -16.561 -0.000 -3.611) 16.950 5.074 ( 0.550 0.000 -4.776) 4.808 5.834 ( -1.461 -0.000 -0.994) 1.767 5.914 ( -1.344 -0.000 6.483) 6.621 6.134 ( 3.681 0.000 -6.907) 7.826 6.506 ( 14.458 0.000 0.558) 14.469 8.705 ( 0.666 0.000 0.324) 0.741 9.500 ( 2.926 0.000 0.411) 2.955 11.075 ( -1.572 -0.000 1.032) 1.880 13.171 ( 0.598 0.000 2.359) 2.434 14.510 ( -2.163 -0.000 -0.615) 2.249 14.618 ( 0.595 0.000 2.196) 2.275 15.058 ( 3.644 0.000 -1.009) 3.781 15.727 ( -4.371 -0.000 -3.697) 5.725 16.960 ( -7.237 -0.000 0.276) 7.243 18.503 ( -13.022 -0.000 -3.655) 13.525 19.129 ( 8.488 0.000 -4.010) 9.387 20.002 ( -1.464 -0.000 0.989) 1.767 21.053 ( 5.200 0.000 2.393) 5.724 55.982 ( 3.647 0.000 10.958) 11.549 57.258 ( 7.453 0.000 1.175) 7.545 ======================= Grid point 626 (309/322) ======================= q-point: (-0.31 -0.38 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.290 ( -7.730 -16.667 6.795) 19.589 2.178 ( -10.675 2.670 9.630) 14.623 2.694 ( 0.031 -7.083 -7.520) 10.330 2.930 ( -4.560 -2.459 4.443) 6.825 3.233 ( -14.304 4.325 0.090) 14.944 3.349 ( 6.922 -3.377 9.390) 12.145 3.621 ( 4.050 -3.675 -6.665) 8.622 4.236 ( 8.915 1.168 5.607) 10.596 4.573 ( -21.050 4.262 -5.828) 22.254 4.779 ( 0.638 -2.965 -1.797) 3.526 5.057 ( 3.334 2.642 -2.834) 5.112 5.774 ( 2.690 3.323 0.758) 4.342 5.954 ( -4.941 -3.062 -0.283) 5.820 6.172 ( 2.556 -1.664 -2.325) 3.835 6.617 ( 13.903 -0.733 -0.178) 13.923 8.707 ( 0.959 0.540 0.693) 1.301 9.614 ( 3.886 -9.129 -0.181) 9.923 11.098 ( -1.678 -3.588 0.775) 4.036 13.183 ( 0.927 -0.110 3.189) 3.322 14.488 ( -2.306 0.366 -0.574) 2.405 14.619 ( 0.620 0.695 2.338) 2.516 15.077 ( 3.982 0.772 -1.586) 4.355 15.683 ( -6.075 -0.308 -4.994) 7.870 16.897 ( -8.645 0.603 0.837) 8.706 18.366 ( -13.993 3.239 -4.246) 14.977 19.175 ( 7.240 0.371 -4.388) 8.473 19.981 ( -1.524 1.117 1.011) 2.143 21.078 ( 6.368 2.203 2.458) 7.173 56.028 ( 6.445 1.528 14.196) 15.665 57.273 ( 8.899 4.923 1.048) 10.224 ======================= Grid point 627 (310/322) ======================= q-point: (-0.23 -0.38 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.572 ( -10.449 -15.145 7.904) 20.026 2.092 ( -9.846 -0.346 7.402) 12.323 2.666 ( -16.997 2.039 -2.184) 17.257 2.984 ( -1.049 -2.636 3.664) 4.634 3.124 ( -2.496 -1.783 -7.919) 8.493 3.557 ( 9.721 -8.449 2.952) 13.213 3.729 ( 4.897 -5.993 3.943) 8.686 4.207 ( -9.051 5.171 -3.564) 11.016 4.378 ( -5.305 1.391 0.898) 5.558 4.829 ( 3.277 0.180 -4.565) 5.622 5.037 ( 2.774 0.373 0.289) 2.813 5.755 ( 5.384 2.241 0.398) 5.845 5.959 ( -3.671 -1.270 -4.179) 5.706 6.208 ( -2.310 -1.989 3.262) 4.464 6.730 ( 11.731 -1.266 -1.107) 11.851 8.699 ( 0.874 1.073 0.351) 1.428 9.892 ( 4.586 -16.055 -0.867) 16.720 11.192 ( -0.763 -6.938 0.240) 6.984 13.198 ( 0.869 -0.117 3.867) 3.965 14.465 ( -2.024 0.293 -0.384) 2.081 14.609 ( 0.455 1.130 2.076) 2.407 15.075 ( 2.761 1.827 -2.532) 4.168 15.645 ( -5.741 -1.372 -4.933) 7.692 16.817 ( -9.140 1.062 1.196) 9.279 18.167 ( -14.460 5.810 -3.346) 15.939 19.206 ( 5.905 0.681 -4.245) 7.304 19.945 ( -1.166 1.613 0.967) 2.213 21.069 ( 6.731 4.066 2.166) 8.156 56.054 ( 7.053 3.512 15.772) 17.630 57.202 ( 9.206 9.349 0.142) 13.121 ======================= Grid point 628 (311/322) ======================= q-point: (-0.15 -0.38 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.647 ( -15.364 -0.125 5.496) 16.318 2.081 ( -7.573 -4.235 6.574) 10.886 2.493 ( -17.322 0.661 -1.447) 17.395 2.978 ( -3.329 2.491 5.484) 6.882 3.206 ( 4.000 -6.387 -7.555) 10.671 3.697 ( 8.008 -0.053 -4.072) 8.984 3.979 ( -1.222 -1.731 0.129) 2.123 4.018 ( -9.972 -9.839 3.619) 14.469 4.386 ( 4.210 -0.409 -0.317) 4.242 4.787 ( 5.722 5.641 -6.054) 10.060 5.094 ( 0.586 -3.810 2.280) 4.478 5.752 ( 5.954 2.725 -0.136) 6.550 5.941 ( -3.104 -0.289 -3.935) 5.020 6.237 ( -3.553 -2.763 5.418) 7.044 6.825 ( 8.782 -0.890 -1.500) 8.954 8.681 ( 0.536 1.255 -0.255) 1.388 10.265 ( 4.052 -18.832 -0.844) 19.282 11.349 ( 1.113 -9.110 -0.777) 9.210 13.212 ( 0.569 -0.140 4.330) 4.369 14.450 ( -1.459 -0.240 -0.151) 1.486 14.591 ( 0.099 1.130 1.512) 1.890 15.035 ( 0.030 2.819 -3.436) 4.445 15.646 ( -2.892 -2.841 -3.661) 5.462 16.730 ( -8.735 1.459 1.133) 8.928 17.937 ( -13.707 6.603 -1.353) 15.275 19.221 ( 4.599 0.970 -3.612) 5.928 19.909 ( -0.654 1.519 0.790) 1.833 21.030 ( 6.289 5.213 1.504) 8.306 56.045 ( 5.311 4.684 15.572) 17.107 57.054 ( 8.506 12.411 -1.397) 15.111 ======================= Grid point 629 (312/322) ======================= q-point: (-0.08 -0.38 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.424 ( -13.725 10.189 0.445) 17.099 2.162 ( -3.750 -7.019 4.891) 9.340 2.383 ( -14.238 -0.485 -1.363) 14.311 2.872 ( -6.415 4.894 7.504) 11.019 3.358 ( 5.228 -5.627 -4.975) 9.151 3.688 ( -1.193 2.285 -4.367) 5.071 3.899 ( -1.502 -0.497 -2.388) 2.865 4.281 ( 1.447 -8.744 5.690) 10.533 4.438 ( 3.190 -2.420 -4.640) 6.129 4.723 ( 5.775 2.967 -3.024) 7.163 5.167 ( -1.099 -3.260 1.202) 3.644 5.730 ( 4.777 3.601 -0.434) 5.998 5.918 ( -3.004 -0.336 -1.929) 3.586 6.283 ( -1.888 -3.131 4.629) 5.899 6.882 ( 5.822 0.299 -1.339) 5.981 8.661 ( 0.263 1.003 -0.553) 1.175 10.640 ( 2.290 -17.046 -0.014) 17.200 11.540 ( 2.957 -9.009 -2.321) 9.762 13.226 ( 0.311 -0.269 4.500) 4.519 14.453 ( -0.763 -0.902 0.028) 1.182 14.574 ( -0.414 0.685 0.871) 1.183 14.964 ( -1.858 3.023 -3.259) 4.818 15.696 ( 0.179 -3.621 -2.304) 4.296 16.641 ( -7.483 1.643 0.654) 7.689 17.730 ( -11.323 4.927 0.805) 12.375 19.223 ( 3.320 1.325 -2.650) 4.450 19.881 ( -0.265 1.127 0.554) 1.284 20.969 ( 5.134 5.450 0.550) 7.508 56.012 ( 2.457 3.868 13.865) 14.602 56.855 ( 7.084 13.546 -3.033) 15.584 ======================= Grid point 639 (313/322) ======================= q-point: (-0.31 -0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.067 ( -7.130 -0.000 8.614) 11.182 2.178 ( -7.370 -0.000 12.387) 14.413 2.588 ( 1.858 0.000 -11.364) 11.514 2.777 ( -27.270 -0.000 2.861) 27.420 3.242 ( -4.957 -0.000 2.623) 5.608 3.371 ( 6.847 0.000 15.572) 17.011 3.620 ( 8.779 0.000 -9.462) 12.908 4.333 ( 8.759 0.000 4.278) 9.748 4.443 ( -21.178 -0.000 -5.462) 21.871 4.744 ( 0.311 0.000 -1.693) 1.721 5.111 ( 4.529 0.000 -3.121) 5.500 5.803 ( -2.308 -0.000 -1.173) 2.589 5.889 ( -2.969 -0.000 1.547) 3.348 6.174 ( 2.630 0.000 -5.235) 5.858 6.715 ( 13.763 0.000 0.082) 13.763 8.724 ( 1.669 0.000 1.500) 2.244 9.554 ( 4.195 0.000 -0.061) 4.195 11.049 ( -2.346 -0.000 0.780) 2.472 13.197 ( 1.455 0.000 4.024) 4.280 14.474 ( -2.455 -0.000 -0.508) 2.507 14.634 ( 0.555 0.000 2.605) 2.664 15.110 ( 3.658 0.000 -2.799) 4.606 15.619 ( -7.718 -0.000 -5.771) 9.637 16.836 ( -9.915 -0.000 1.321) 10.002 18.288 ( -13.942 -0.000 -5.826) 15.111 19.219 ( 6.010 0.000 -4.829) 7.709 19.981 ( -1.758 -0.000 1.239) 2.150 21.155 ( 7.329 0.000 2.703) 7.812 56.137 ( 11.283 0.000 17.722) 21.009 57.393 ( 10.048 0.000 1.468) 10.155 ======================= Grid point 640 (314/322) ======================= q-point: (-0.23 -0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.205 ( -7.455 -15.423 9.164) 19.427 2.083 ( -7.290 4.525 9.411) 12.735 2.530 ( -27.730 0.838 -1.095) 27.764 2.747 ( -4.454 -12.562 -6.852) 14.986 3.183 ( 0.247 3.647 4.423) 5.738 3.498 ( 7.408 -5.283 11.576) 14.724 3.700 ( 8.513 -2.598 -4.802) 10.113 4.186 ( -21.547 4.615 -10.684) 24.489 4.433 ( 9.644 1.817 8.437) 12.942 4.787 ( 1.301 -3.897 -1.967) 4.555 5.108 ( 4.311 2.932 -3.344) 6.194 5.790 ( -0.244 -0.398 -0.584) 0.748 5.892 ( -3.210 -1.960 -1.740) 4.144 6.172 ( -2.002 -0.200 -2.614) 3.298 6.809 ( 12.357 0.076 -0.366) 12.363 8.731 ( 1.970 0.986 1.555) 2.697 9.676 ( 4.592 -9.247 -0.551) 10.340 11.073 ( -1.978 -4.200 0.467) 4.665 13.215 ( 1.600 0.128 4.724) 4.989 14.453 ( -2.242 0.186 -0.350) 2.277 14.635 ( 0.399 0.783 2.485) 2.636 15.112 ( 0.620 1.060 -4.903) 5.054 15.567 ( -6.058 -1.121 -4.478) 7.617 16.761 ( -10.321 0.336 1.614) 10.452 18.146 ( -13.796 3.275 -5.727) 15.293 19.247 ( 4.831 0.353 -4.817) 6.831 19.962 ( -1.521 0.906 1.415) 2.266 21.190 ( 7.521 2.463 2.615) 8.335 56.230 ( 13.749 3.424 19.346) 23.980 57.417 ( 10.034 5.381 1.100) 11.439 ======================= Grid point 641 (315/322) ======================= q-point: (-0.15 -0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.440 ( -11.993 -11.177 8.483) 18.459 1.986 ( -9.290 -0.300 7.686) 12.061 2.329 ( -24.165 -1.446 -1.153) 24.235 2.928 ( -2.628 -7.746 -3.622) 8.946 3.143 ( 0.764 1.067 1.926) 2.331 3.716 ( 10.330 -8.359 0.791) 13.312 3.800 ( -3.314 -2.947 -0.741) 4.496 3.951 ( -9.282 1.608 -3.897) 10.194 4.462 ( 8.142 2.856 4.973) 9.959 4.867 ( 3.944 -1.417 -4.341) 6.033 5.072 ( 1.899 1.783 -0.747) 2.710 5.806 ( 1.744 -0.222 -0.153) 1.765 5.896 ( -3.052 -1.082 -4.575) 5.605 6.162 ( -5.280 -2.246 2.383) 6.213 6.887 ( 10.084 0.258 -0.879) 10.126 8.719 ( 1.647 1.820 0.867) 2.603 9.954 ( 4.160 -15.828 -1.006) 16.396 11.185 ( -0.077 -8.085 -0.575) 8.106 13.230 ( 1.447 0.315 5.241) 5.446 14.436 ( -1.705 -0.033 -0.166) 1.714 14.619 ( 0.087 1.338 1.906) 2.330 15.060 ( -4.237 1.795 -6.620) 8.062 15.570 ( -1.183 -2.547 -2.084) 3.497 16.681 ( -10.038 0.530 1.520) 10.166 17.953 ( -13.104 5.462 -3.925) 14.729 19.261 ( 3.756 0.652 -4.321) 5.762 19.933 ( -1.008 1.327 1.340) 2.139 21.178 ( 7.023 4.609 2.206) 8.685 56.256 ( 12.447 7.213 19.076) 23.892 57.336 ( 8.918 10.156 -0.125) 13.516 ======================= Grid point 642 (316/322) ======================= q-point: (-0.08 -0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.420 ( -18.023 1.158 4.332) 18.573 2.008 ( -6.233 -5.818 7.575) 11.405 2.247 ( -13.961 -3.449 -1.428) 14.451 2.943 ( -3.506 3.955 6.131) 8.095 3.201 ( -1.830 -8.118 -5.101) 9.761 3.664 ( -14.470 1.536 -9.955) 17.631 3.915 ( 12.112 -3.008 -3.408) 12.937 4.111 ( 5.471 -10.837 8.714) 14.944 4.469 ( 6.335 2.044 0.833) 6.708 4.850 ( 5.585 5.089 -6.581) 10.020 5.088 ( -2.569 -2.900 2.021) 4.369 5.805 ( 1.591 1.679 -0.324) 2.336 5.879 ( -3.655 -0.719 -2.982) 4.771 6.202 ( -3.114 -4.342 3.898) 6.614 6.939 ( 7.335 0.839 -1.099) 7.465 8.692 ( 1.030 1.918 0.231) 2.189 10.312 ( 2.521 -18.218 -0.542) 18.400 11.370 ( 2.404 -10.154 -2.323) 10.690 13.241 ( 1.199 0.369 5.488) 5.629 14.432 ( -0.951 -0.627 -0.030) 1.140 14.593 ( -0.425 1.421 1.022) 1.801 14.974 ( -6.372 1.601 -6.126) 8.983 15.633 ( 2.576 -3.346 -0.695) 4.279 16.602 ( -9.188 0.599 0.968) 9.258 17.749 ( -11.315 5.580 -1.346) 12.688 19.263 ( 2.787 0.969 -3.447) 4.537 19.903 ( -0.532 1.296 1.008) 1.726 21.125 ( 5.944 6.055 1.472) 8.612 56.202 ( 8.401 9.021 17.172) 21.138 57.165 ( 7.204 13.334 -1.712) 15.252 ======================= Grid point 653 (317/322) ======================= q-point: (-0.23 -0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.005 ( -5.600 -0.000 10.342) 11.761 2.109 ( -17.325 -0.000 13.999) 22.275 2.317 ( -23.943 -0.000 -0.292) 23.945 2.574 ( 1.678 0.000 -12.517) 12.629 3.211 ( -4.914 -0.000 7.937) 9.335 3.517 ( 6.419 0.000 12.867) 14.380 3.733 ( 9.970 0.000 -5.611) 11.440 4.049 ( -22.304 -0.000 -11.182) 24.950 4.566 ( 13.884 0.000 9.023) 16.559 4.739 ( -0.194 -0.000 -2.270) 2.278 5.165 ( 4.478 0.000 -4.803) 6.567 5.762 ( -2.668 -0.000 -1.316) 2.975 5.851 ( -2.255 -0.000 -1.212) 2.560 6.145 ( -4.692 -0.000 -4.730) 6.662 6.897 ( 11.260 0.000 -0.341) 11.265 8.764 ( 2.873 0.000 2.327) 3.697 9.618 ( 4.568 0.000 -0.442) 4.589 11.014 ( -2.748 -0.000 0.670) 2.828 13.238 ( 1.955 0.000 5.401) 5.744 14.438 ( -2.173 -0.000 -0.237) 2.186 14.650 ( 0.321 0.000 2.664) 2.683 15.095 ( -5.587 -0.000 -8.505) 10.175 15.519 ( -1.602 -0.000 -1.580) 2.250 16.690 ( -10.588 -0.000 1.771) 10.735 18.070 ( -12.895 -0.000 -6.756) 14.558 19.274 ( 3.813 0.000 -5.016) 6.301 19.962 ( -1.435 -0.000 1.886) 2.370 21.274 ( 7.508 0.000 2.669) 7.968 56.422 ( 18.865 0.000 20.609) 27.939 57.546 ( 9.857 0.000 1.403) 9.956 ======================= Grid point 654 (318/322) ======================= q-point: (-0.15 -0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.135 ( -6.627 -12.912 9.893) 17.564 1.886 ( -32.726 0.455 8.175) 33.735 2.192 ( -6.050 3.236 1.150) 6.957 2.715 ( 1.238 -11.329 -8.520) 14.230 3.169 ( -5.621 0.925 7.793) 9.653 3.617 ( 2.244 -3.989 10.583) 11.530 3.791 ( -0.943 1.448 -11.576) 11.704 3.888 ( -5.116 -2.038 -2.605) 6.092 4.610 ( 9.174 4.447 5.308) 11.494 4.812 ( 3.325 -5.052 -0.158) 6.050 5.152 ( 3.800 3.394 -5.275) 7.334 5.774 ( -1.349 -2.684 -1.026) 3.174 5.845 ( -2.250 -1.169 -3.229) 4.105 6.090 ( -8.116 -0.344 -1.593) 8.278 6.967 ( 9.461 0.524 -0.586) 9.493 8.773 ( 2.885 1.649 1.937) 3.846 9.739 ( 4.137 -9.055 -0.777) 9.985 11.046 ( -1.792 -5.206 0.089) 5.507 13.259 ( 1.974 0.335 5.885) 6.216 14.423 ( -1.778 -0.005 -0.101) 1.781 14.646 ( 0.126 0.948 2.338) 2.526 15.010 ( -11.113 0.374 -10.038) 14.980 15.541 ( 3.909 -1.241 0.844) 4.187 16.615 ( -10.269 0.165 1.575) 10.390 17.938 ( -11.821 3.144 -5.788) 13.533 19.287 ( 2.895 0.313 -4.740) 5.563 19.949 ( -1.015 0.788 2.060) 2.428 21.305 ( 6.851 2.674 2.439) 7.748 56.541 ( 19.403 6.170 19.892) 28.465 57.558 ( 8.491 5.898 0.731) 10.365 ======================= Grid point 655 (319/322) ======================= q-point: (-0.08 -0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.254 ( -18.093 -4.590 6.892) 19.897 1.796 ( -19.414 -10.798 9.400) 24.122 2.121 ( -2.753 0.447 -1.055) 2.982 2.895 ( -0.216 -7.374 -4.114) 8.447 3.125 ( -4.677 1.292 5.206) 7.117 3.550 ( -17.421 1.897 -7.470) 19.050 3.861 ( 7.977 -8.789 -1.867) 12.015 4.025 ( 9.383 -5.774 3.710) 11.625 4.589 ( 6.740 4.144 2.801) 8.394 4.911 ( 3.107 -1.926 -1.524) 3.960 5.086 ( 1.304 4.097 -3.434) 5.502 5.813 ( -0.524 -1.370 -0.054) 1.468 5.835 ( -3.462 -0.395 -4.463) 5.663 6.081 ( -6.136 -4.963 2.369) 8.239 7.011 ( 7.246 1.110 -0.850) 7.379 8.750 ( 2.047 2.725 1.199) 3.613 10.001 ( 2.692 -15.226 -0.856) 15.486 11.186 ( 0.710 -9.574 -1.791) 9.766 13.273 ( 1.804 0.648 6.122) 6.415 14.415 ( -1.108 -0.364 -0.000) 1.167 14.623 ( -0.362 1.681 1.371) 2.199 14.907 ( -11.646 -0.281 -8.574) 14.465 15.615 ( 6.461 -1.993 1.569) 6.941 16.542 ( -9.561 0.206 1.005) 9.616 17.770 ( -10.115 4.919 -3.384) 11.746 19.289 ( 2.069 0.574 -3.999) 4.539 19.926 ( -0.584 1.233 1.779) 2.242 21.280 ( 5.720 5.018 1.934) 7.851 56.523 ( 15.009 11.823 18.240) 26.414 57.449 ( 6.469 10.854 -0.624) 12.651 ======================= Grid point 667 (320/322) ======================= q-point: (-0.15 -0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.975 ( -3.297 -0.000 10.503) 11.009 1.594 ( -44.230 -0.000 5.854) 44.616 2.299 ( 6.871 0.000 8.044) 10.579 2.555 ( 1.163 0.000 -11.710) 11.767 3.121 ( -11.247 -0.000 8.586) 14.150 3.632 ( 4.310 0.000 9.279) 10.231 3.729 ( -16.534 -0.000 -9.424) 19.031 3.866 ( 9.839 0.000 -2.211) 10.085 4.722 ( -0.921 -0.000 -2.730) 2.882 4.790 ( 11.979 0.000 8.052) 14.434 5.209 ( 4.300 0.000 -7.007) 8.221 5.720 ( -2.371 -0.000 -1.372) 2.739 5.816 ( -1.654 -0.000 -3.397) 3.778 6.016 ( -10.585 -0.000 -1.674) 10.717 7.035 ( 7.857 0.000 -0.569) 7.877 8.818 ( 3.434 0.000 2.002) 3.975 9.678 ( 3.862 0.000 -0.634) 3.913 10.976 ( -2.592 -0.000 0.729) 2.693 13.287 ( 2.127 0.000 6.255) 6.607 14.410 ( -1.578 -0.000 -0.008) 1.578 14.661 ( 0.140 0.000 2.491) 2.495 14.897 ( -14.685 -0.000 -10.649) 18.140 15.577 ( 7.586 0.000 2.337) 7.938 16.546 ( -9.812 -0.000 1.273) 9.894 17.879 ( -10.330 -0.000 -5.997) 11.944 19.300 ( 2.124 0.000 -4.769) 5.220 19.954 ( -0.681 -0.000 2.549) 2.638 21.382 ( 6.001 0.000 2.355) 6.447 56.795 ( 22.593 0.000 17.771) 28.744 57.675 ( 6.988 0.000 0.733) 7.026 ======================= Grid point 668 (321/322) ======================= q-point: (-0.08 -0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.049 ( -12.552 -5.086 8.686) 16.089 1.387 ( -30.673 -11.739 6.535) 33.486 2.227 ( 5.426 8.330 2.729) 10.310 2.719 ( 2.959 -10.772 -5.832) 12.602 3.069 ( -11.245 -2.291 7.375) 13.641 3.516 ( -12.120 6.357 -4.490) 14.404 3.751 ( 2.498 -6.116 1.940) 6.886 3.989 ( 9.275 -5.156 -0.261) 10.615 4.689 ( 1.314 2.086 -0.815) 2.597 4.896 ( 5.318 -1.597 6.089) 8.240 5.186 ( 4.040 3.986 -7.929) 9.751 5.750 ( -1.327 -3.898 -0.988) 4.235 5.799 ( -2.614 -0.156 -4.876) 5.535 5.955 ( -8.906 -2.342 1.942) 9.412 7.077 ( 5.894 0.759 -0.690) 5.983 8.822 ( 2.792 2.309 1.391) 3.881 9.787 ( 2.732 -8.553 -0.738) 9.009 11.023 ( -1.276 -6.364 -0.241) 6.495 13.308 ( 2.008 0.469 6.349) 6.675 14.402 ( -1.093 -0.189 0.064) 1.111 14.653 ( -0.334 1.305 1.689) 2.160 14.785 ( -13.306 -1.010 -8.667) 15.912 15.649 ( 8.609 -0.759 2.588) 9.022 16.478 ( -8.871 0.111 0.690) 8.899 17.773 ( -8.481 2.847 -4.390) 9.966 19.303 ( 1.408 0.267 -4.272) 4.506 19.947 ( -0.330 0.825 2.482) 2.636 21.398 ( 4.721 2.806 2.036) 5.857 56.891 ( 19.515 9.201 15.344) 26.475 57.657 ( 4.727 6.227 -0.111) 7.819 ======================= Grid point 681 (322/322) ======================= q-point: (-0.08 -0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.975 ( -1.272 -0.000 9.347) 9.433 0.993 ( -38.226 -0.000 5.515) 38.622 2.472 ( 11.921 0.000 9.546) 15.272 2.530 ( 0.250 0.000 -9.657) 9.660 2.955 ( -14.028 -0.000 5.403) 15.033 3.514 ( -9.357 -0.000 -6.420) 11.347 3.701 ( 1.414 0.000 6.918) 7.061 3.992 ( 7.906 0.000 -1.293) 8.011 4.696 ( -1.387 -0.000 -2.752) 3.082 4.938 ( 3.688 0.000 9.648) 10.329 5.246 ( 4.523 0.000 -9.732) 10.731 5.688 ( -1.387 -0.000 -1.298) 1.900 5.771 ( -3.305 -0.000 -4.924) 5.930 5.878 ( -6.329 -0.000 2.920) 6.970 7.120 ( 4.052 0.000 -0.647) 4.103 8.868 ( 2.597 0.000 0.672) 2.682 9.721 ( 2.121 0.000 -0.571) 2.197 10.946 ( -1.789 -0.000 0.937) 2.020 13.338 ( 1.853 0.000 6.195) 6.467 14.393 ( -0.818 -0.000 0.114) 0.826 14.666 ( -11.400 -0.000 -7.614) 13.709 14.670 ( 0.057 0.000 2.132) 2.132 15.709 ( 8.346 0.000 2.521) 8.718 16.421 ( -7.234 -0.000 0.177) 7.236 17.739 ( -6.533 -0.000 -3.820) 7.568 19.306 ( 0.791 0.000 -4.092) 4.168 19.958 ( -0.015 -0.000 2.668) 2.668 21.458 ( 3.268 0.000 1.906) 3.783 57.152 ( 18.500 0.000 10.670) 21.356 57.744 ( 2.274 0.000 -0.327) 2.297 =================== 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 3/35490 10.0 101.296 53.132 52.650 0.000 6.709 0.000 3/35490 20.0 53.472 29.792 30.981 -0.000 -0.172 0.000 3/35490 30.0 32.594 17.090 18.529 -0.000 -0.279 0.000 3/35490 40.0 22.571 11.318 12.122 -0.000 -0.118 0.000 3/35490 50.0 17.018 8.308 8.758 -0.000 -0.039 0.000 3/35490 60.0 13.599 6.537 6.814 -0.000 -0.007 0.000 3/35490 70.0 11.316 5.394 5.579 -0.000 0.005 0.000 3/35490 80.0 9.694 4.606 4.732 -0.000 0.009 0.000 3/35490 90.0 8.485 4.034 4.118 -0.000 0.010 0.000 3/35490 100.0 7.551 3.601 3.651 -0.000 0.010 0.000 3/35490 110.0 6.807 3.262 3.285 -0.000 0.010 0.000 3/35490 120.0 6.201 2.987 2.990 -0.000 0.010 0.000 3/35490 130.0 5.697 2.760 2.746 -0.000 0.009 0.000 3/35490 140.0 5.272 2.568 2.541 -0.000 0.009 0.000 3/35490 150.0 4.908 2.403 2.366 -0.000 0.009 0.000 3/35490 160.0 4.592 2.260 2.215 -0.000 0.009 0.000 3/35490 170.0 4.317 2.133 2.083 -0.000 0.009 0.000 3/35490 180.0 4.073 2.021 1.967 -0.000 0.009 0.000 3/35490 190.0 3.856 1.920 1.863 -0.000 0.009 0.000 3/35490 200.0 3.662 1.829 1.771 -0.000 0.008 0.000 3/35490 210.0 3.487 1.747 1.687 -0.000 0.008 0.000 3/35490 220.0 3.329 1.671 1.611 -0.000 0.008 0.000 3/35490 230.0 3.185 1.603 1.542 -0.000 0.008 0.000 3/35490 240.0 3.053 1.539 1.479 -0.000 0.008 0.000 3/35490 250.0 2.932 1.481 1.422 -0.000 0.008 0.000 3/35490 260.0 2.820 1.427 1.369 -0.000 0.008 0.000 3/35490 270.0 2.717 1.377 1.320 -0.000 0.008 0.000 3/35490 280.0 2.621 1.331 1.275 -0.000 0.008 0.000 3/35490 290.0 2.532 1.288 1.233 -0.000 0.009 0.000 3/35490 300.0 2.450 1.248 1.195 -0.000 0.009 0.000 3/35490 310.0 2.372 1.210 1.159 -0.000 0.009 0.000 3/35490 320.0 2.300 1.175 1.126 -0.000 0.010 0.000 3/35490 330.0 2.233 1.142 1.096 -0.000 0.010 0.000 3/35490 340.0 2.169 1.111 1.067 -0.000 0.011 0.000 3/35490 350.0 2.109 1.082 1.041 -0.000 0.011 0.000 3/35490 360.0 2.053 1.055 1.016 -0.000 0.012 0.000 3/35490 370.0 2.000 1.030 0.993 -0.000 0.012 0.000 3/35490 380.0 1.950 1.005 0.972 -0.000 0.013 0.000 3/35490 390.0 1.903 0.983 0.952 -0.000 0.014 0.000 3/35490 400.0 1.858 0.961 0.933 -0.000 0.015 0.000 3/35490 410.0 1.815 0.941 0.916 -0.000 0.016 0.000 3/35490 420.0 1.775 0.922 0.900 -0.000 0.017 0.000 3/35490 430.0 1.737 0.904 0.885 -0.000 0.018 0.000 3/35490 440.0 1.700 0.887 0.871 -0.000 0.019 0.000 3/35490 450.0 1.666 0.871 0.858 -0.000 0.020 0.000 3/35490 460.0 1.633 0.855 0.845 -0.000 0.021 0.000 3/35490 470.0 1.601 0.841 0.834 -0.000 0.022 0.000 3/35490 480.0 1.571 0.827 0.823 -0.000 0.023 0.000 3/35490 490.0 1.542 0.814 0.813 -0.000 0.024 0.000 3/35490 500.0 1.515 0.801 0.803 -0.000 0.025 0.000 3/35490 510.0 1.488 0.789 0.794 -0.000 0.026 0.000 3/35490 520.0 1.463 0.778 0.786 -0.000 0.028 0.000 3/35490 530.0 1.439 0.767 0.778 -0.000 0.029 0.000 3/35490 540.0 1.416 0.756 0.771 -0.000 0.030 0.000 3/35490 550.0 1.393 0.746 0.764 -0.000 0.031 0.000 3/35490 560.0 1.372 0.737 0.757 -0.000 0.032 0.000 3/35490 570.0 1.351 0.728 0.750 -0.000 0.033 0.000 3/35490 580.0 1.331 0.719 0.744 -0.000 0.035 0.000 3/35490 590.0 1.312 0.710 0.739 -0.000 0.036 0.000 3/35490 600.0 1.293 0.702 0.733 -0.000 0.037 0.000 3/35490 610.0 1.276 0.694 0.728 0.000 0.038 0.000 3/35490 620.0 1.258 0.686 0.723 0.000 0.039 0.000 3/35490 630.0 1.242 0.679 0.718 0.000 0.040 0.000 3/35490 640.0 1.225 0.672 0.713 0.000 0.041 0.000 3/35490 650.0 1.210 0.665 0.709 0.000 0.042 0.000 3/35490 660.0 1.194 0.658 0.704 0.000 0.043 0.000 3/35490 670.0 1.180 0.652 0.700 0.000 0.044 0.000 3/35490 680.0 1.165 0.646 0.696 0.000 0.045 0.000 3/35490 690.0 1.152 0.640 0.692 0.000 0.046 0.000 3/35490 700.0 1.138 0.634 0.688 0.000 0.047 0.000 3/35490 710.0 1.125 0.628 0.685 0.000 0.048 0.000 3/35490 720.0 1.112 0.622 0.681 0.000 0.049 0.000 3/35490 730.0 1.100 0.617 0.677 0.000 0.049 0.000 3/35490 740.0 1.088 0.612 0.674 0.000 0.050 0.000 3/35490 750.0 1.076 0.606 0.671 0.000 0.051 0.000 3/35490 760.0 1.065 0.601 0.667 0.000 0.052 0.000 3/35490 770.0 1.053 0.596 0.664 0.000 0.052 0.000 3/35490 780.0 1.043 0.592 0.661 0.000 0.053 0.000 3/35490 790.0 1.032 0.587 0.658 0.000 0.054 0.000 3/35490 800.0 1.022 0.582 0.654 0.000 0.055 0.000 3/35490 810.0 1.011 0.578 0.651 0.000 0.055 0.000 3/35490 820.0 1.001 0.573 0.648 0.000 0.056 0.000 3/35490 830.0 0.992 0.569 0.645 0.000 0.056 0.000 3/35490 840.0 0.982 0.565 0.642 0.000 0.057 0.000 3/35490 850.0 0.973 0.560 0.639 0.000 0.058 0.000 3/35490 860.0 0.964 0.556 0.637 0.000 0.058 0.000 3/35490 870.0 0.955 0.552 0.634 0.000 0.059 0.000 3/35490 880.0 0.946 0.548 0.631 0.000 0.059 0.000 3/35490 890.0 0.938 0.545 0.628 0.000 0.060 0.000 3/35490 900.0 0.930 0.541 0.625 0.000 0.060 0.000 3/35490 910.0 0.921 0.537 0.623 0.000 0.061 0.000 3/35490 920.0 0.913 0.533 0.620 0.000 0.061 0.000 3/35490 930.0 0.906 0.530 0.617 0.000 0.061 0.000 3/35490 940.0 0.898 0.526 0.614 0.000 0.062 0.000 3/35490 950.0 0.890 0.522 0.612 0.000 0.062 0.000 3/35490 960.0 0.883 0.519 0.609 0.000 0.062 0.000 3/35490 970.0 0.876 0.516 0.606 0.000 0.063 0.000 3/35490 980.0 0.868 0.512 0.604 0.000 0.063 0.000 3/35490 990.0 0.861 0.509 0.601 0.000 0.063 0.000 3/35490 1000.0 0.855 0.506 0.599 0.000 0.064 0.000 3/35490 Thermal conductivity related properties were written into "kappa-m13137.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 04:56:37]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|