----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 10:54:34]------------------------- 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 1] 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: 24 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.867750923342706 -2.110057059999999 0.000000000000000 b 6.867750923342706 2.110057059999999 0.000000000000000 c -0.752309090982622 0.000000000000000 10.996754523180464 Atomic positions (fractional): *1 Ba 0.24884974331893 0.24884974331893 0.71117754275995 137.327 2 Ba 0.75115025668107 0.75115025668107 0.28882245724005 137.327 *3 La 0.50000000000000 0.50000000000000 0.50000000000000 138.905 *4 Ag 0.35658753683678 0.35658753683678 0.03368940950517 107.868 5 Ag 0.64341246316322 0.64341246316322 0.96631059049483 107.868 *6 Ag 0.97796146316893 0.97796146316893 0.74279145856895 107.868 7 Ag 0.02203853683107 0.02203853683107 0.25720854143105 107.868 *8 Ag 0.00000000000000 0.00000000000000 0.00000000000000 107.868 *9 S 0.58216142552689 0.58216142552689 0.74568313334506 32.065 *10 S 0.84038050116936 0.84038050116936 0.90110267902436 32.065 11 S 0.15961949883064 0.15961949883064 0.09889732097564 32.065 12 S 0.41783857447311 0.41783857447311 0.25431686665494 32.065 *13 S 0.13421818160547 0.13421818160547 0.44903477180679 32.065 14 S 0.86578181839453 0.86578181839453 0.55096522819321 32.065 -------------------------------- unit cell --------------------------------- Lattice vectors: a 13.735501846685413 0.000000000000000 0.000000000000000 b 0.000000000000000 4.220114119999999 0.000000000000000 c -0.752309090982622 0.000000000000000 10.996754523180464 Atomic positions (fractional): *1 Ba 0.24884974331893 0.00000000000000 0.71117754275995 137.327 > 1 2 Ba 0.25115025668107 0.50000000000000 0.28882245724005 137.327 > 2 3 Ba 0.74884974331893 0.50000000000000 0.71117754275995 137.327 > 1 4 Ba 0.75115025668107 0.00000000000000 0.28882245724005 137.327 > 2 *5 La 0.00000000000000 0.50000000000000 0.50000000000000 138.905 > 3 6 La 0.50000000000000 0.00000000000000 0.50000000000000 138.905 > 3 *7 Ag 0.35658753683678 0.00000000000000 0.03368940950517 107.868 > 4 8 Ag 0.14341246316322 0.50000000000000 0.96631059049483 107.868 > 5 *9 Ag 0.47796146316893 0.50000000000000 0.74279145856895 107.868 > 6 10 Ag 0.02203853683107 0.00000000000000 0.25720854143105 107.868 > 7 *11 Ag 0.00000000000000 0.00000000000000 0.00000000000000 107.868 > 8 12 Ag 0.85658753683678 0.50000000000000 0.03368940950517 107.868 > 4 13 Ag 0.64341246316322 0.00000000000000 0.96631059049483 107.868 > 5 14 Ag 0.97796146316893 0.00000000000000 0.74279145856895 107.868 > 6 15 Ag 0.52203853683107 0.50000000000000 0.25720854143105 107.868 > 7 16 Ag 0.50000000000000 0.50000000000000 0.00000000000000 107.868 > 8 *17 S 0.08216142552689 0.50000000000000 0.74568313334506 32.065 > 9 *18 S 0.34038050116936 0.50000000000000 0.90110267902436 32.065 > 10 19 S 0.15961949883064 0.00000000000000 0.09889732097564 32.065 > 11 20 S 0.41783857447311 0.00000000000000 0.25431686665494 32.065 > 12 *21 S 0.13421818160547 0.00000000000000 0.44903477180679 32.065 > 13 22 S 0.36578181839453 0.50000000000000 0.55096522819321 32.065 > 14 23 S 0.58216142552689 0.00000000000000 0.74568313334506 32.065 > 9 24 S 0.84038050116936 0.00000000000000 0.90110267902436 32.065 > 10 25 S 0.65961949883064 0.50000000000000 0.09889732097564 32.065 > 11 26 S 0.91783857447311 0.50000000000000 0.25431686665494 32.065 > 12 27 S 0.63421818160547 0.50000000000000 0.44903477180679 32.065 > 13 28 S 0.86578181839453 0.00000000000000 0.55096522819321 32.065 > 14 -------------------------------- super cell -------------------------------- Lattice vectors: a 13.735501846685413 0.000000000000000 0.000000000000000 b 0.000000000000000 12.660342359999998 0.000000000000000 c -0.752309090982622 0.000000000000000 10.996754523180464 Atomic positions (fractional): *1 Ba 0.24884974331893 0.00000000000000 0.71117754275995 137.327 > 1 2 Ba 0.24884974331893 0.33333333333333 0.71117754275995 137.327 > 1 3 Ba 0.24884974331893 0.66666666666667 0.71117754275995 137.327 > 1 4 Ba 0.25115025668107 0.16666666666667 0.28882245724005 137.327 > 2 5 Ba 0.25115025668107 0.50000000000000 0.28882245724005 137.327 > 2 6 Ba 0.25115025668107 0.83333333333333 0.28882245724005 137.327 > 2 7 Ba 0.74884974331893 0.16666666666667 0.71117754275995 137.327 > 1 8 Ba 0.74884974331893 0.50000000000000 0.71117754275995 137.327 > 1 9 Ba 0.74884974331893 0.83333333333333 0.71117754275995 137.327 > 1 10 Ba 0.75115025668107 0.00000000000000 0.28882245724005 137.327 > 2 11 Ba 0.75115025668107 0.33333333333333 0.28882245724005 137.327 > 2 12 Ba 0.75115025668107 0.66666666666667 0.28882245724005 137.327 > 2 *13 La 0.00000000000000 0.16666666666667 0.50000000000000 138.905 > 3 14 La 0.00000000000000 0.50000000000000 0.50000000000000 138.905 > 3 15 La 0.00000000000000 0.83333333333333 0.50000000000000 138.905 > 3 16 La 0.50000000000000 0.00000000000000 0.50000000000000 138.905 > 3 17 La 0.50000000000000 0.33333333333333 0.50000000000000 138.905 > 3 18 La 0.50000000000000 0.66666666666667 0.50000000000000 138.905 > 3 *19 Ag 0.35658753683678 0.00000000000000 0.03368940950517 107.868 > 4 20 Ag 0.35658753683678 0.33333333333333 0.03368940950517 107.868 > 4 21 Ag 0.35658753683678 0.66666666666667 0.03368940950517 107.868 > 4 22 Ag 0.14341246316322 0.16666666666667 0.96631059049483 107.868 > 5 23 Ag 0.14341246316322 0.50000000000000 0.96631059049483 107.868 > 5 24 Ag 0.14341246316322 0.83333333333333 0.96631059049483 107.868 > 5 *25 Ag 0.47796146316893 0.16666666666667 0.74279145856895 107.868 > 6 26 Ag 0.47796146316893 0.50000000000000 0.74279145856895 107.868 > 6 27 Ag 0.47796146316893 0.83333333333333 0.74279145856895 107.868 > 6 28 Ag 0.02203853683107 0.00000000000000 0.25720854143105 107.868 > 7 29 Ag 0.02203853683107 0.33333333333333 0.25720854143105 107.868 > 7 30 Ag 0.02203853683107 0.66666666666667 0.25720854143105 107.868 > 7 *31 Ag 0.00000000000000 0.00000000000000 0.00000000000000 107.868 > 8 32 Ag 0.00000000000000 0.33333333333333 0.00000000000000 107.868 > 8 33 Ag 0.00000000000000 0.66666666666667 0.00000000000000 107.868 > 8 34 Ag 0.85658753683678 0.16666666666667 0.03368940950517 107.868 > 4 35 Ag 0.85658753683678 0.50000000000000 0.03368940950517 107.868 > 4 36 Ag 0.85658753683678 0.83333333333333 0.03368940950517 107.868 > 4 37 Ag 0.64341246316322 0.00000000000000 0.96631059049483 107.868 > 5 38 Ag 0.64341246316322 0.33333333333333 0.96631059049483 107.868 > 5 39 Ag 0.64341246316322 0.66666666666667 0.96631059049483 107.868 > 5 40 Ag 0.97796146316893 0.00000000000000 0.74279145856895 107.868 > 6 41 Ag 0.97796146316893 0.33333333333333 0.74279145856895 107.868 > 6 42 Ag 0.97796146316893 0.66666666666667 0.74279145856895 107.868 > 6 43 Ag 0.52203853683107 0.16666666666667 0.25720854143105 107.868 > 7 44 Ag 0.52203853683107 0.50000000000000 0.25720854143105 107.868 > 7 45 Ag 0.52203853683107 0.83333333333333 0.25720854143105 107.868 > 7 46 Ag 0.50000000000000 0.16666666666667 0.00000000000000 107.868 > 8 47 Ag 0.50000000000000 0.50000000000000 0.00000000000000 107.868 > 8 48 Ag 0.50000000000000 0.83333333333333 0.00000000000000 107.868 > 8 *49 S 0.08216142552689 0.16666666666667 0.74568313334506 32.065 > 9 50 S 0.08216142552689 0.50000000000000 0.74568313334506 32.065 > 9 51 S 0.08216142552689 0.83333333333333 0.74568313334506 32.065 > 9 *52 S 0.34038050116936 0.16666666666667 0.90110267902436 32.065 > 10 53 S 0.34038050116936 0.50000000000000 0.90110267902436 32.065 > 10 54 S 0.34038050116936 0.83333333333333 0.90110267902436 32.065 > 10 55 S 0.15961949883064 0.00000000000000 0.09889732097564 32.065 > 11 56 S 0.15961949883064 0.33333333333333 0.09889732097564 32.065 > 11 57 S 0.15961949883064 0.66666666666667 0.09889732097564 32.065 > 11 58 S 0.41783857447311 0.00000000000000 0.25431686665494 32.065 > 12 59 S 0.41783857447311 0.33333333333333 0.25431686665494 32.065 > 12 60 S 0.41783857447311 0.66666666666667 0.25431686665494 32.065 > 12 *61 S 0.13421818160547 0.00000000000000 0.44903477180679 32.065 > 13 62 S 0.13421818160547 0.33333333333333 0.44903477180679 32.065 > 13 63 S 0.13421818160547 0.66666666666667 0.44903477180679 32.065 > 13 64 S 0.36578181839453 0.16666666666667 0.55096522819321 32.065 > 14 65 S 0.36578181839453 0.50000000000000 0.55096522819321 32.065 > 14 66 S 0.36578181839453 0.83333333333333 0.55096522819321 32.065 > 14 67 S 0.58216142552689 0.00000000000000 0.74568313334506 32.065 > 9 68 S 0.58216142552689 0.33333333333333 0.74568313334506 32.065 > 9 69 S 0.58216142552689 0.66666666666667 0.74568313334506 32.065 > 9 70 S 0.84038050116936 0.00000000000000 0.90110267902436 32.065 > 10 71 S 0.84038050116936 0.33333333333333 0.90110267902436 32.065 > 10 72 S 0.84038050116936 0.66666666666667 0.90110267902436 32.065 > 10 73 S 0.65961949883064 0.16666666666667 0.09889732097564 32.065 > 11 74 S 0.65961949883064 0.50000000000000 0.09889732097564 32.065 > 11 75 S 0.65961949883064 0.83333333333333 0.09889732097564 32.065 > 11 76 S 0.91783857447311 0.16666666666667 0.25431686665494 32.065 > 12 77 S 0.91783857447311 0.50000000000000 0.25431686665494 32.065 > 12 78 S 0.91783857447311 0.83333333333333 0.25431686665494 32.065 > 12 79 S 0.63421818160547 0.16666666666667 0.44903477180679 32.065 > 13 80 S 0.63421818160547 0.50000000000000 0.44903477180679 32.065 > 13 81 S 0.63421818160547 0.83333333333333 0.44903477180679 32.065 > 13 82 S 0.86578181839453 0.00000000000000 0.55096522819321 32.065 > 14 83 S 0.86578181839453 0.33333333333333 0.55096522819321 32.065 > 14 84 S 0.86578181839453 0.66666666666667 0.55096522819321 32.065 > 14 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 7.6473713 0.0000000 0.1007355 0.0000000 7.6514237 0.0000000 0.1007376 0.0000000 7.9019421 -------------------------- Born effective charges -------------------------- 1 Ba 3.2200699 0.0000000 0.2133993 0.0000000 2.8270127 0.0000000 0.2123191 0.0000000 2.7730604 2 Ba 3.2200699 0.0000000 0.2133993 0.0000000 2.8270127 0.0000000 0.2123191 0.0000000 2.7730604 3 La 2.7419926 0.0000000 -0.0495995 0.0000000 4.4815556 0.0000000 -0.1202209 0.0000000 4.8441608 4 Ag 0.9711969 0.0000000 0.0119988 0.0000000 1.1748426 0.0000000 0.1203809 0.0000000 1.0471143 5 Ag 0.9711969 0.0000000 0.0119988 0.0000000 1.1748426 0.0000000 0.1203809 0.0000000 1.0471143 6 Ag 0.8058914 0.0000000 -0.1172978 0.0000000 0.8663404 0.0000000 -0.0553690 0.0000000 0.7027440 7 Ag 0.8058914 0.0000000 -0.1172978 0.0000000 0.8663404 0.0000000 -0.0553690 0.0000000 0.7027440 8 Ag 0.9468429 0.0000000 0.3730321 0.0000000 0.4718734 0.0000000 0.0252128 0.0000000 0.8140523 9 S -2.2465952 0.0000000 -0.2673348 0.0000000 -2.3768363 0.0000000 -0.4470550 0.0000000 -2.7880875 10 S -2.1260367 0.0000000 -0.1704532 0.0000000 -2.0815933 0.0000000 -0.0627136 0.0000000 -2.1295155 11 S -2.1260367 0.0000000 -0.1704532 0.0000000 -2.0815933 0.0000000 -0.0627136 0.0000000 -2.1295155 12 S -2.2465952 0.0000000 -0.2673348 0.0000000 -2.3768363 0.0000000 -0.4470550 0.0000000 -2.7880875 13 S -2.4689441 0.0000000 0.1679714 0.0000000 -2.8864807 0.0000000 0.2799416 0.0000000 -2.4344223 14 S -2.4689441 0.0000000 0.1679714 0.0000000 -2.8864807 0.0000000 0.2799416 0.0000000 -2.4344223 ---------------------------------------------------------------------------- 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: 252/252 Permutation basis: 6288/6288 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1468 Number of blocks in projector: 1468 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: 228 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 228 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 228 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 192 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 192 Use standard eigh solver. Tree of FC basis block matrices: - (1468, 1429), data: False |-- (192, 192), data: True |-- (192, 192), data: True |-- (228, 220), data: True |-- (228, 220), data: True |-- (228, 220), data: True |-- (400, 385), data: True ----- Solver_atoms: 1 -- 84 / 84 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 480 - Time: 1.429 Solver_block: 200 / 480 - Time: 1.426 Solver_block: 300 / 480 - Time: 1.426 Solver_block: 400 / 480 - Time: 1.426 Solver_block: 480 / 480 - Time: 1.176 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 6.917 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (yy) 0.00000000 (yy) Permutation basis: 252/252 Permutation basis: 6288/6288 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1468 Number of blocks in projector: 1468 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: 228 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 228 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 228 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 192 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 192 Use standard eigh solver. Tree of FC basis block matrices: - (1468, 1429), data: False |-- (192, 192), data: True |-- (192, 192), data: True |-- (228, 220), data: True |-- (228, 220), data: True |-- (228, 220), data: True |-- (400, 385), data: True Max drift after symmetrization by symfc projector: 0.00000000 (yy) 0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 10:54:56]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 10:54:56]------------------------- 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 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.867750923342706 -2.110057059999999 0.000000000000000 b 6.867750923342706 2.110057059999999 0.000000000000000 c -0.752309090982622 0.000000000000000 10.996754523180464 Atomic positions (fractional): 1 Ba 0.24884974331893 0.24884974331893 0.71117754275995 137.327 2 Ba 0.75115025668107 0.75115025668107 0.28882245724005 137.327 3 La 0.50000000000000 0.50000000000000 0.50000000000000 138.905 4 Ag 0.35658753683678 0.35658753683678 0.03368940950517 107.868 5 Ag 0.64341246316322 0.64341246316322 0.96631059049483 107.868 6 Ag 0.97796146316893 0.97796146316893 0.74279145856895 107.868 7 Ag 0.02203853683107 0.02203853683107 0.25720854143105 107.868 8 Ag 0.00000000000000 0.00000000000000 0.00000000000000 107.868 9 S 0.58216142552689 0.58216142552689 0.74568313334506 32.065 10 S 0.84038050116936 0.84038050116936 0.90110267902436 32.065 11 S 0.15961949883064 0.15961949883064 0.09889732097564 32.065 12 S 0.41783857447311 0.41783857447311 0.25431686665494 32.065 13 S 0.13421818160547 0.13421818160547 0.44903477180679 32.065 14 S 0.86578181839453 0.86578181839453 0.55096522819321 32.065 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.735501846685413 0.000000000000000 0.000000000000000 b 0.000000000000000 12.660342359999998 0.000000000000000 c -0.752309090982622 0.000000000000000 10.996754523180464 Atomic positions (fractional): 1 Ba 0.24884974331893 0.00000000000000 0.71117754275995 137.327 > 1 2 Ba 0.24884974331893 0.33333333333333 0.71117754275995 137.327 > 1 3 Ba 0.24884974331893 0.66666666666667 0.71117754275995 137.327 > 1 4 Ba 0.25115025668107 0.16666666666667 0.28882245724005 137.327 > 4 5 Ba 0.25115025668107 0.50000000000000 0.28882245724005 137.327 > 4 6 Ba 0.25115025668107 0.83333333333333 0.28882245724005 137.327 > 4 7 Ba 0.74884974331893 0.16666666666667 0.71117754275995 137.327 > 1 8 Ba 0.74884974331893 0.50000000000000 0.71117754275995 137.327 > 1 9 Ba 0.74884974331893 0.83333333333333 0.71117754275995 137.327 > 1 10 Ba 0.75115025668107 0.00000000000000 0.28882245724005 137.327 > 4 11 Ba 0.75115025668107 0.33333333333333 0.28882245724005 137.327 > 4 12 Ba 0.75115025668107 0.66666666666667 0.28882245724005 137.327 > 4 13 La 0.00000000000000 0.16666666666667 0.50000000000000 138.905 > 13 14 La 0.00000000000000 0.50000000000000 0.50000000000000 138.905 > 13 15 La 0.00000000000000 0.83333333333333 0.50000000000000 138.905 > 13 16 La 0.50000000000000 0.00000000000000 0.50000000000000 138.905 > 13 17 La 0.50000000000000 0.33333333333333 0.50000000000000 138.905 > 13 18 La 0.50000000000000 0.66666666666667 0.50000000000000 138.905 > 13 19 Ag 0.35658753683678 0.00000000000000 0.03368940950517 107.868 > 19 20 Ag 0.35658753683678 0.33333333333333 0.03368940950517 107.868 > 19 21 Ag 0.35658753683678 0.66666666666667 0.03368940950517 107.868 > 19 22 Ag 0.14341246316322 0.16666666666667 0.96631059049483 107.868 > 22 23 Ag 0.14341246316322 0.50000000000000 0.96631059049483 107.868 > 22 24 Ag 0.14341246316322 0.83333333333333 0.96631059049483 107.868 > 22 25 Ag 0.47796146316893 0.16666666666667 0.74279145856895 107.868 > 25 26 Ag 0.47796146316893 0.50000000000000 0.74279145856895 107.868 > 25 27 Ag 0.47796146316893 0.83333333333333 0.74279145856895 107.868 > 25 28 Ag 0.02203853683107 0.00000000000000 0.25720854143105 107.868 > 28 29 Ag 0.02203853683107 0.33333333333333 0.25720854143105 107.868 > 28 30 Ag 0.02203853683107 0.66666666666667 0.25720854143105 107.868 > 28 31 Ag 0.00000000000000 0.00000000000000 0.00000000000000 107.868 > 31 32 Ag 0.00000000000000 0.33333333333333 0.00000000000000 107.868 > 31 33 Ag 0.00000000000000 0.66666666666667 0.00000000000000 107.868 > 31 34 Ag 0.85658753683678 0.16666666666667 0.03368940950517 107.868 > 19 35 Ag 0.85658753683678 0.50000000000000 0.03368940950517 107.868 > 19 36 Ag 0.85658753683678 0.83333333333333 0.03368940950517 107.868 > 19 37 Ag 0.64341246316322 0.00000000000000 0.96631059049483 107.868 > 22 38 Ag 0.64341246316322 0.33333333333333 0.96631059049483 107.868 > 22 39 Ag 0.64341246316322 0.66666666666667 0.96631059049483 107.868 > 22 40 Ag 0.97796146316893 0.00000000000000 0.74279145856895 107.868 > 25 41 Ag 0.97796146316893 0.33333333333333 0.74279145856895 107.868 > 25 42 Ag 0.97796146316893 0.66666666666667 0.74279145856895 107.868 > 25 43 Ag 0.52203853683107 0.16666666666667 0.25720854143105 107.868 > 28 44 Ag 0.52203853683107 0.50000000000000 0.25720854143105 107.868 > 28 45 Ag 0.52203853683107 0.83333333333333 0.25720854143105 107.868 > 28 46 Ag 0.50000000000000 0.16666666666667 0.00000000000000 107.868 > 31 47 Ag 0.50000000000000 0.50000000000000 0.00000000000000 107.868 > 31 48 Ag 0.50000000000000 0.83333333333333 0.00000000000000 107.868 > 31 49 S 0.08216142552689 0.16666666666667 0.74568313334506 32.065 > 49 50 S 0.08216142552689 0.50000000000000 0.74568313334506 32.065 > 49 51 S 0.08216142552689 0.83333333333333 0.74568313334506 32.065 > 49 52 S 0.34038050116936 0.16666666666667 0.90110267902436 32.065 > 52 53 S 0.34038050116936 0.50000000000000 0.90110267902436 32.065 > 52 54 S 0.34038050116936 0.83333333333333 0.90110267902436 32.065 > 52 55 S 0.15961949883064 0.00000000000000 0.09889732097564 32.065 > 55 56 S 0.15961949883064 0.33333333333333 0.09889732097564 32.065 > 55 57 S 0.15961949883064 0.66666666666667 0.09889732097564 32.065 > 55 58 S 0.41783857447311 0.00000000000000 0.25431686665494 32.065 > 58 59 S 0.41783857447311 0.33333333333333 0.25431686665494 32.065 > 58 60 S 0.41783857447311 0.66666666666667 0.25431686665494 32.065 > 58 61 S 0.13421818160547 0.00000000000000 0.44903477180679 32.065 > 61 62 S 0.13421818160547 0.33333333333333 0.44903477180679 32.065 > 61 63 S 0.13421818160547 0.66666666666667 0.44903477180679 32.065 > 61 64 S 0.36578181839453 0.16666666666667 0.55096522819321 32.065 > 64 65 S 0.36578181839453 0.50000000000000 0.55096522819321 32.065 > 64 66 S 0.36578181839453 0.83333333333333 0.55096522819321 32.065 > 64 67 S 0.58216142552689 0.00000000000000 0.74568313334506 32.065 > 49 68 S 0.58216142552689 0.33333333333333 0.74568313334506 32.065 > 49 69 S 0.58216142552689 0.66666666666667 0.74568313334506 32.065 > 49 70 S 0.84038050116936 0.00000000000000 0.90110267902436 32.065 > 52 71 S 0.84038050116936 0.33333333333333 0.90110267902436 32.065 > 52 72 S 0.84038050116936 0.66666666666667 0.90110267902436 32.065 > 52 73 S 0.65961949883064 0.16666666666667 0.09889732097564 32.065 > 55 74 S 0.65961949883064 0.50000000000000 0.09889732097564 32.065 > 55 75 S 0.65961949883064 0.83333333333333 0.09889732097564 32.065 > 55 76 S 0.91783857447311 0.16666666666667 0.25431686665494 32.065 > 58 77 S 0.91783857447311 0.50000000000000 0.25431686665494 32.065 > 58 78 S 0.91783857447311 0.83333333333333 0.25431686665494 32.065 > 58 79 S 0.63421818160547 0.16666666666667 0.44903477180679 32.065 > 61 80 S 0.63421818160547 0.50000000000000 0.44903477180679 32.065 > 61 81 S 0.63421818160547 0.83333333333333 0.44903477180679 32.065 > 61 82 S 0.86578181839453 0.00000000000000 0.55096522819321 32.065 > 64 83 S 0.86578181839453 0.33333333333333 0.55096522819321 32.065 > 64 84 S 0.86578181839453 0.66666666666667 0.55096522819321 32.065 > 64 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 7.6473713 0.0000000 0.1007355 0.0000000 7.6514237 0.0000000 0.1007376 0.0000000 7.9019421 -------------------------- Born effective charges -------------------------- 1 Ba 3.2200699 0.0000000 0.2133993 0.0000000 2.8270127 0.0000000 0.2123191 0.0000000 2.7730604 2 Ba 3.2200699 0.0000000 0.2133993 0.0000000 2.8270127 0.0000000 0.2123191 0.0000000 2.7730604 3 La 2.7419926 0.0000000 -0.0495995 0.0000000 4.4815556 0.0000000 -0.1202209 0.0000000 4.8441608 4 Ag 0.9711969 0.0000000 0.0119988 0.0000000 1.1748426 0.0000000 0.1203809 0.0000000 1.0471143 5 Ag 0.9711969 0.0000000 0.0119988 0.0000000 1.1748426 0.0000000 0.1203809 0.0000000 1.0471143 6 Ag 0.8058914 0.0000000 -0.1172978 0.0000000 0.8663404 0.0000000 -0.0553690 0.0000000 0.7027440 7 Ag 0.8058914 0.0000000 -0.1172978 0.0000000 0.8663404 0.0000000 -0.0553690 0.0000000 0.7027440 8 Ag 0.9468429 0.0000000 0.3730321 0.0000000 0.4718734 0.0000000 0.0252128 0.0000000 0.8140523 9 S -2.2465952 0.0000000 -0.2673348 0.0000000 -2.3768363 0.0000000 -0.4470550 0.0000000 -2.7880875 10 S -2.1260367 0.0000000 -0.1704532 0.0000000 -2.0815933 0.0000000 -0.0627136 0.0000000 -2.1295155 11 S -2.1260367 0.0000000 -0.1704532 0.0000000 -2.0815933 0.0000000 -0.0627136 0.0000000 -2.1295155 12 S -2.2465952 0.0000000 -0.2673348 0.0000000 -2.3768363 0.0000000 -0.4470550 0.0000000 -2.7880875 13 S -2.4689441 0.0000000 0.1679714 0.0000000 -2.8864807 0.0000000 0.2799416 0.0000000 -2.4344223 14 S -2.4689441 0.0000000 0.1679714 0.0000000 -2.8864807 0.0000000 0.2799416 0.0000000 -2.4344223 ---------------------------------------------------------------------------- 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] [-0.0007 0.0000 0.0100] [ 0.0007 0.0000 -0.0100] Computing fc3[ 13, 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] [-0.0007 0.0000 0.0100] [ 0.0007 0.0000 -0.0100] Computing fc3[ 19, 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] [-0.0007 0.0000 0.0100] [ 0.0007 0.0000 -0.0100] 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] [-0.0007 0.0000 0.0100] [ 0.0007 0.0000 -0.0100] Computing fc3[ 31, 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] [-0.0007 0.0000 0.0100] [ 0.0007 0.0000 -0.0100] 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] [-0.0007 0.0000 0.0100] [ 0.0007 0.0000 -0.0100] Computing fc3[ 52, 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] [-0.0007 0.0000 0.0100] [ 0.0007 0.0000 -0.0100] 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] [-0.0007 0.0000 0.0100] [ 0.0007 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000000 (xxx) 0.00000000 (xxx) 0.00000000 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (xz) 0.00000000 (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 2026-01-08 10:55:11]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 10:55:12]------------------------- 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 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.867750923342706 -2.110057059999999 0.000000000000000 b 6.867750923342706 2.110057059999999 0.000000000000000 c -0.752309090982622 0.000000000000000 10.996754523180464 Atomic positions (fractional): 1 Ba 0.24884974331893 0.24884974331893 0.71117754275995 137.327 2 Ba 0.75115025668107 0.75115025668107 0.28882245724005 137.327 3 La 0.50000000000000 0.50000000000000 0.50000000000000 138.905 4 Ag 0.35658753683678 0.35658753683678 0.03368940950517 107.868 5 Ag 0.64341246316322 0.64341246316322 0.96631059049483 107.868 6 Ag 0.97796146316893 0.97796146316893 0.74279145856895 107.868 7 Ag 0.02203853683107 0.02203853683107 0.25720854143105 107.868 8 Ag 0.00000000000000 0.00000000000000 0.00000000000000 107.868 9 S 0.58216142552689 0.58216142552689 0.74568313334506 32.065 10 S 0.84038050116936 0.84038050116936 0.90110267902436 32.065 11 S 0.15961949883064 0.15961949883064 0.09889732097564 32.065 12 S 0.41783857447311 0.41783857447311 0.25431686665494 32.065 13 S 0.13421818160547 0.13421818160547 0.44903477180679 32.065 14 S 0.86578181839453 0.86578181839453 0.55096522819321 32.065 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.735501846685413 0.000000000000000 0.000000000000000 b 0.000000000000000 12.660342359999998 0.000000000000000 c -0.752309090982622 0.000000000000000 10.996754523180464 Atomic positions (fractional): 1 Ba 0.24884974331893 0.00000000000000 0.71117754275995 137.327 > 1 2 Ba 0.24884974331893 0.33333333333333 0.71117754275995 137.327 > 1 3 Ba 0.24884974331893 0.66666666666667 0.71117754275995 137.327 > 1 4 Ba 0.25115025668107 0.16666666666667 0.28882245724005 137.327 > 4 5 Ba 0.25115025668107 0.50000000000000 0.28882245724005 137.327 > 4 6 Ba 0.25115025668107 0.83333333333333 0.28882245724005 137.327 > 4 7 Ba 0.74884974331893 0.16666666666667 0.71117754275995 137.327 > 1 8 Ba 0.74884974331893 0.50000000000000 0.71117754275995 137.327 > 1 9 Ba 0.74884974331893 0.83333333333333 0.71117754275995 137.327 > 1 10 Ba 0.75115025668107 0.00000000000000 0.28882245724005 137.327 > 4 11 Ba 0.75115025668107 0.33333333333333 0.28882245724005 137.327 > 4 12 Ba 0.75115025668107 0.66666666666667 0.28882245724005 137.327 > 4 13 La 0.00000000000000 0.16666666666667 0.50000000000000 138.905 > 13 14 La 0.00000000000000 0.50000000000000 0.50000000000000 138.905 > 13 15 La 0.00000000000000 0.83333333333333 0.50000000000000 138.905 > 13 16 La 0.50000000000000 0.00000000000000 0.50000000000000 138.905 > 13 17 La 0.50000000000000 0.33333333333333 0.50000000000000 138.905 > 13 18 La 0.50000000000000 0.66666666666667 0.50000000000000 138.905 > 13 19 Ag 0.35658753683678 0.00000000000000 0.03368940950517 107.868 > 19 20 Ag 0.35658753683678 0.33333333333333 0.03368940950517 107.868 > 19 21 Ag 0.35658753683678 0.66666666666667 0.03368940950517 107.868 > 19 22 Ag 0.14341246316322 0.16666666666667 0.96631059049483 107.868 > 22 23 Ag 0.14341246316322 0.50000000000000 0.96631059049483 107.868 > 22 24 Ag 0.14341246316322 0.83333333333333 0.96631059049483 107.868 > 22 25 Ag 0.47796146316893 0.16666666666667 0.74279145856895 107.868 > 25 26 Ag 0.47796146316893 0.50000000000000 0.74279145856895 107.868 > 25 27 Ag 0.47796146316893 0.83333333333333 0.74279145856895 107.868 > 25 28 Ag 0.02203853683107 0.00000000000000 0.25720854143105 107.868 > 28 29 Ag 0.02203853683107 0.33333333333333 0.25720854143105 107.868 > 28 30 Ag 0.02203853683107 0.66666666666667 0.25720854143105 107.868 > 28 31 Ag 0.00000000000000 0.00000000000000 0.00000000000000 107.868 > 31 32 Ag 0.00000000000000 0.33333333333333 0.00000000000000 107.868 > 31 33 Ag 0.00000000000000 0.66666666666667 0.00000000000000 107.868 > 31 34 Ag 0.85658753683678 0.16666666666667 0.03368940950517 107.868 > 19 35 Ag 0.85658753683678 0.50000000000000 0.03368940950517 107.868 > 19 36 Ag 0.85658753683678 0.83333333333333 0.03368940950517 107.868 > 19 37 Ag 0.64341246316322 0.00000000000000 0.96631059049483 107.868 > 22 38 Ag 0.64341246316322 0.33333333333333 0.96631059049483 107.868 > 22 39 Ag 0.64341246316322 0.66666666666667 0.96631059049483 107.868 > 22 40 Ag 0.97796146316893 0.00000000000000 0.74279145856895 107.868 > 25 41 Ag 0.97796146316893 0.33333333333333 0.74279145856895 107.868 > 25 42 Ag 0.97796146316893 0.66666666666667 0.74279145856895 107.868 > 25 43 Ag 0.52203853683107 0.16666666666667 0.25720854143105 107.868 > 28 44 Ag 0.52203853683107 0.50000000000000 0.25720854143105 107.868 > 28 45 Ag 0.52203853683107 0.83333333333333 0.25720854143105 107.868 > 28 46 Ag 0.50000000000000 0.16666666666667 0.00000000000000 107.868 > 31 47 Ag 0.50000000000000 0.50000000000000 0.00000000000000 107.868 > 31 48 Ag 0.50000000000000 0.83333333333333 0.00000000000000 107.868 > 31 49 S 0.08216142552689 0.16666666666667 0.74568313334506 32.065 > 49 50 S 0.08216142552689 0.50000000000000 0.74568313334506 32.065 > 49 51 S 0.08216142552689 0.83333333333333 0.74568313334506 32.065 > 49 52 S 0.34038050116936 0.16666666666667 0.90110267902436 32.065 > 52 53 S 0.34038050116936 0.50000000000000 0.90110267902436 32.065 > 52 54 S 0.34038050116936 0.83333333333333 0.90110267902436 32.065 > 52 55 S 0.15961949883064 0.00000000000000 0.09889732097564 32.065 > 55 56 S 0.15961949883064 0.33333333333333 0.09889732097564 32.065 > 55 57 S 0.15961949883064 0.66666666666667 0.09889732097564 32.065 > 55 58 S 0.41783857447311 0.00000000000000 0.25431686665494 32.065 > 58 59 S 0.41783857447311 0.33333333333333 0.25431686665494 32.065 > 58 60 S 0.41783857447311 0.66666666666667 0.25431686665494 32.065 > 58 61 S 0.13421818160547 0.00000000000000 0.44903477180679 32.065 > 61 62 S 0.13421818160547 0.33333333333333 0.44903477180679 32.065 > 61 63 S 0.13421818160547 0.66666666666667 0.44903477180679 32.065 > 61 64 S 0.36578181839453 0.16666666666667 0.55096522819321 32.065 > 64 65 S 0.36578181839453 0.50000000000000 0.55096522819321 32.065 > 64 66 S 0.36578181839453 0.83333333333333 0.55096522819321 32.065 > 64 67 S 0.58216142552689 0.00000000000000 0.74568313334506 32.065 > 49 68 S 0.58216142552689 0.33333333333333 0.74568313334506 32.065 > 49 69 S 0.58216142552689 0.66666666666667 0.74568313334506 32.065 > 49 70 S 0.84038050116936 0.00000000000000 0.90110267902436 32.065 > 52 71 S 0.84038050116936 0.33333333333333 0.90110267902436 32.065 > 52 72 S 0.84038050116936 0.66666666666667 0.90110267902436 32.065 > 52 73 S 0.65961949883064 0.16666666666667 0.09889732097564 32.065 > 55 74 S 0.65961949883064 0.50000000000000 0.09889732097564 32.065 > 55 75 S 0.65961949883064 0.83333333333333 0.09889732097564 32.065 > 55 76 S 0.91783857447311 0.16666666666667 0.25431686665494 32.065 > 58 77 S 0.91783857447311 0.50000000000000 0.25431686665494 32.065 > 58 78 S 0.91783857447311 0.83333333333333 0.25431686665494 32.065 > 58 79 S 0.63421818160547 0.16666666666667 0.44903477180679 32.065 > 61 80 S 0.63421818160547 0.50000000000000 0.44903477180679 32.065 > 61 81 S 0.63421818160547 0.83333333333333 0.44903477180679 32.065 > 61 82 S 0.86578181839453 0.00000000000000 0.55096522819321 32.065 > 64 83 S 0.86578181839453 0.33333333333333 0.55096522819321 32.065 > 64 84 S 0.86578181839453 0.66666666666667 0.55096522819321 32.065 > 64 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 7.6473713 0.0000000 0.1007355 0.0000000 7.6514237 0.0000000 0.1007376 0.0000000 7.9019421 -------------------------- Born effective charges -------------------------- 1 Ba 3.2200699 0.0000000 0.2133993 0.0000000 2.8270127 0.0000000 0.2123191 0.0000000 2.7730604 2 Ba 3.2200699 0.0000000 0.2133993 0.0000000 2.8270127 0.0000000 0.2123191 0.0000000 2.7730604 3 La 2.7419926 0.0000000 -0.0495995 0.0000000 4.4815556 0.0000000 -0.1202209 0.0000000 4.8441608 4 Ag 0.9711969 0.0000000 0.0119988 0.0000000 1.1748426 0.0000000 0.1203809 0.0000000 1.0471143 5 Ag 0.9711969 0.0000000 0.0119988 0.0000000 1.1748426 0.0000000 0.1203809 0.0000000 1.0471143 6 Ag 0.8058914 0.0000000 -0.1172978 0.0000000 0.8663404 0.0000000 -0.0553690 0.0000000 0.7027440 7 Ag 0.8058914 0.0000000 -0.1172978 0.0000000 0.8663404 0.0000000 -0.0553690 0.0000000 0.7027440 8 Ag 0.9468429 0.0000000 0.3730321 0.0000000 0.4718734 0.0000000 0.0252128 0.0000000 0.8140523 9 S -2.2465952 0.0000000 -0.2673348 0.0000000 -2.3768363 0.0000000 -0.4470550 0.0000000 -2.7880875 10 S -2.1260367 0.0000000 -0.1704532 0.0000000 -2.0815933 0.0000000 -0.0627136 0.0000000 -2.1295155 11 S -2.1260367 0.0000000 -0.1704532 0.0000000 -2.0815933 0.0000000 -0.0627136 0.0000000 -2.1295155 12 S -2.2465952 0.0000000 -0.2673348 0.0000000 -2.3768363 0.0000000 -0.4470550 0.0000000 -2.7880875 13 S -2.4689441 0.0000000 0.1679714 0.0000000 -2.8864807 0.0000000 0.2799416 0.0000000 -2.4344223 14 S -2.4689441 0.0000000 0.1679714 0.0000000 -2.8864807 0.0000000 0.2799416 0.0000000 -2.4344223 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000000 (xxx) 0.00000000 (xxx) 0.00000000 (xxx) Max drift of fc2: 0.00000000 (yy) 0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 12 12 5 ] 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: 0.61, Number of G-points: 307, Lambda: 0.18 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/199) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 1.105 ( 0.000 0.000 0.000) 0.000 1.264 ( 0.000 0.000 0.000) 0.000 1.332 ( 0.000 0.000 0.000) 0.000 1.541 ( 0.000 0.000 0.000) 0.000 1.785 ( 0.000 0.000 0.000) 0.000 1.888 ( 0.000 0.000 0.000) 0.000 2.162 ( 0.000 0.000 0.000) 0.000 2.206 ( 0.000 0.000 0.000) 0.000 2.257 ( 0.000 0.000 0.000) 0.000 2.269 ( 0.000 0.000 0.000) 0.000 2.439 ( 0.000 0.000 0.000) 0.000 2.440 ( 0.000 0.000 0.000) 0.000 2.678 ( 0.000 0.000 0.000) 0.000 2.704 ( 0.000 0.000 0.000) 0.000 2.753 ( 0.000 0.000 0.000) 0.000 2.854 ( 0.000 0.000 0.000) 0.000 3.030 ( 0.000 0.000 0.000) 0.000 3.138 ( 0.000 0.000 0.000) 0.000 3.366 ( 0.000 0.000 0.000) 0.000 3.501 ( 0.000 0.000 0.000) 0.000 3.597 ( 0.000 0.000 0.000) 0.000 4.961 ( 0.000 0.000 0.000) 0.000 5.289 ( 0.000 0.000 0.000) 0.000 5.476 ( 0.000 0.000 0.000) 0.000 5.717 ( 0.000 0.000 0.000) 0.000 5.836 ( 0.000 0.000 0.000) 0.000 5.874 ( 0.000 0.000 0.000) 0.000 6.014 ( 0.000 0.000 0.000) 0.000 6.033 ( 0.000 0.000 0.000) 0.000 6.274 ( 0.000 0.000 0.000) 0.000 6.708 ( 0.000 0.000 0.000) 0.000 6.800 ( 0.000 0.000 0.000) 0.000 6.832 ( 0.000 0.000 0.000) 0.000 7.210 ( 0.000 0.000 0.000) 0.000 7.469 ( 0.000 0.000 0.000) 0.000 7.753 ( 0.000 0.000 0.000) 0.000 8.560 ( 0.000 0.000 0.000) 0.000 8.584 ( 0.000 0.000 0.000) 0.000 9.670 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/199) ======================= q-point: ( 0.08 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.389 ( 5.763 -17.614 4.332) 19.032 0.446 ( 0.027 -21.612 1.318) 21.652 0.800 ( 10.252 -29.280 1.424) 31.056 1.124 ( 1.022 -4.587 -1.279) 4.871 1.291 ( 0.368 -3.567 0.606) 3.637 1.460 ( 1.570 -10.534 1.276) 10.727 1.599 ( 1.266 -5.118 -1.032) 5.372 1.822 ( -0.425 -3.424 -0.570) 3.498 1.891 ( -1.892 -0.782 0.720) 2.170 2.157 ( -3.378 -0.515 -0.496) 3.453 2.247 ( -0.177 -3.553 -0.001) 3.557 2.250 ( 1.438 0.597 -3.710) 4.023 2.273 ( 2.403 0.631 2.333) 3.408 2.445 ( -1.038 -0.732 -2.698) 2.982 2.467 ( -0.034 -2.404 2.252) 3.294 2.676 ( -0.872 -0.223 1.725) 1.945 2.684 ( 0.084 1.864 -1.730) 2.545 2.767 ( -1.205 -0.211 -0.474) 1.312 2.866 ( -3.208 -2.486 1.332) 4.271 3.044 ( -1.704 -2.104 -3.626) 4.525 3.135 ( 3.725 1.715 2.489) 4.797 3.381 ( 4.979 1.636 -1.022) 5.340 3.492 ( 1.877 2.053 1.543) 3.181 3.599 ( 1.228 0.120 -0.107) 1.238 4.987 ( 0.966 -2.093 -3.103) 3.866 5.480 ( 0.570 -0.658 0.897) 1.250 5.624 ( -1.105 -7.738 -1.716) 8.003 5.826 ( -1.472 1.579 0.315) 2.181 5.883 ( -2.051 -2.820 -0.310) 3.501 6.032 ( -6.214 -2.230 3.512) 7.478 6.107 ( 0.283 -8.417 -0.373) 8.430 6.248 ( -1.409 -1.470 -1.237) 2.383 6.714 ( 0.001 -0.732 -6.907) 6.945 6.729 ( -0.482 -1.770 0.746) 1.980 6.801 ( -1.894 -2.079 -2.498) 3.761 7.193 ( -15.288 -9.320 -24.685) 30.495 7.447 ( -3.121 0.309 3.465) 4.674 7.631 ( -0.323 -3.486 10.426) 10.998 7.789 ( 8.586 3.882 18.991) 21.200 8.553 ( 3.002 1.784 0.637) 3.550 8.562 ( -1.058 1.655 -1.381) 2.402 9.672 ( 4.062 2.646 1.488) 5.072 ======================= Grid point 2 (3/199) ======================= q-point: ( 0.17 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.753 ( 3.054 -15.505 4.615) 16.463 0.835 ( 1.741 -16.441 1.357) 16.589 0.983 ( 2.260 0.572 -1.087) 2.573 1.380 ( -2.878 -9.504 0.254) 9.933 1.599 ( 8.370 -20.735 1.984) 22.448 1.696 ( 1.204 -10.870 1.279) 11.011 1.745 ( 1.952 -9.147 -1.562) 9.482 1.879 ( -2.109 -2.059 -1.195) 3.180 1.900 ( -2.578 -2.108 1.156) 3.525 2.149 ( -4.990 -1.543 -2.359) 5.731 2.258 ( 2.956 -0.245 -2.465) 3.857 2.281 ( 3.226 -0.101 0.989) 3.375 2.342 ( -0.673 -5.283 -0.705) 5.372 2.476 ( -1.734 -4.709 -2.321) 5.529 2.523 ( -2.147 -3.679 1.060) 4.389 2.639 ( 0.400 2.153 0.314) 2.213 2.672 ( 2.064 0.989 2.234) 3.198 2.755 ( -1.679 0.199 -0.123) 1.695 2.916 ( -2.439 -3.462 0.336) 4.248 3.064 ( -2.104 0.128 -1.816) 2.783 3.170 ( 2.538 -5.313 -0.445) 5.905 3.341 ( 2.131 4.840 -0.545) 5.316 3.483 ( 1.367 -0.488 2.226) 2.657 3.609 ( 1.723 -0.243 -0.420) 1.789 5.058 ( -0.010 -4.890 -2.205) 5.364 5.511 ( 0.701 -2.017 1.591) 2.663 5.727 ( -1.468 -1.001 1.979) 2.660 5.774 ( -2.230 1.675 -2.167) 3.532 5.928 ( -1.720 -2.270 -0.420) 2.878 6.072 ( -7.927 -5.592 2.336) 9.978 6.266 ( 6.132 -6.389 -1.344) 8.956 6.398 ( -0.071 -14.519 0.600) 14.532 6.675 ( 1.948 4.488 0.911) 4.976 6.768 ( -1.306 -2.755 -5.279) 6.096 6.885 ( -4.217 -7.323 -2.281) 8.753 7.305 ( -8.598 -9.702 -8.001) 15.234 7.444 ( -3.557 -2.041 1.903) 4.521 7.705 ( 2.349 -2.851 3.867) 5.348 7.766 ( 2.839 2.433 8.798) 9.559 8.501 ( -0.196 3.369 -0.631) 3.433 8.542 ( 3.702 1.682 -0.802) 4.144 9.637 ( 1.081 2.394 0.697) 2.718 ======================= Grid point 3 (4/199) ======================= q-point: ( 0.25 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.903 ( -1.188 1.082 1.813) 2.422 1.064 ( 4.138 -9.616 -0.428) 10.477 1.167 ( 4.798 -12.600 2.886) 13.788 1.581 ( -4.056 -12.621 0.992) 13.294 1.825 ( -2.432 -1.603 1.923) 3.490 1.838 ( -1.948 -5.215 -1.398) 5.740 1.895 ( 1.011 -5.464 -0.064) 5.557 1.921 ( -0.338 -1.867 -0.137) 1.902 1.995 ( 0.208 -6.268 -0.624) 6.303 2.160 ( -4.815 -2.737 -4.625) 7.216 2.287 ( 1.675 -0.990 -1.928) 2.739 2.310 ( 3.884 -0.530 0.862) 4.014 2.410 ( -2.181 -2.596 -0.173) 3.395 2.496 ( -4.535 0.112 -1.358) 4.735 2.586 ( 0.548 2.801 -0.316) 2.872 2.678 ( 1.155 -2.908 2.793) 4.194 2.707 ( 2.498 -2.429 2.110) 4.073 2.797 ( -0.406 -9.556 -0.123) 9.565 2.952 ( 0.600 -1.476 0.596) 1.701 3.030 ( 1.109 2.238 -0.045) 2.498 3.233 ( 2.126 4.872 -0.466) 5.336 3.384 ( 0.080 -13.089 -2.823) 13.390 3.522 ( 2.123 -2.560 3.106) 4.550 3.630 ( 0.573 -1.295 -1.185) 1.847 5.173 ( -0.775 -6.888 -1.814) 7.165 5.566 ( 0.798 -2.748 1.700) 3.328 5.663 ( -4.723 3.603 4.411) 7.399 5.737 ( 0.181 2.051 -2.388) 3.153 5.948 ( -2.081 -1.186 -0.898) 2.557 6.112 ( -0.183 -0.913 -2.086) 2.284 6.486 ( 1.730 -10.838 0.109) 10.976 6.572 ( 1.186 4.710 2.830) 5.621 6.730 ( -0.705 -16.274 -1.233) 16.336 6.822 ( -0.785 -3.817 -3.757) 5.413 7.017 ( -2.785 -8.377 -1.046) 8.890 7.441 ( -6.319 -7.504 -1.071) 9.868 7.475 ( -4.766 -3.538 -0.179) 5.939 7.742 ( 0.532 0.996 5.070) 5.194 7.778 ( 2.363 -3.249 1.645) 4.341 8.434 ( -0.565 2.942 -1.389) 3.302 8.537 ( 4.877 1.362 -0.473) 5.085 9.597 ( 0.079 1.980 0.502) 2.044 ======================= Grid point 4 (5/199) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.850 ( -0.779 3.170 0.259) 3.274 1.245 ( 3.348 -6.422 0.665) 7.272 1.411 ( 3.053 -9.045 2.740) 9.932 1.793 ( -4.803 -9.278 1.709) 10.586 1.811 ( -1.962 -1.576 0.326) 2.538 1.894 ( -3.013 -1.991 -0.953) 3.735 1.954 ( -0.161 -1.809 0.745) 1.963 1.990 ( 0.617 -2.943 -0.328) 3.025 2.043 ( -2.483 -0.392 -1.787) 3.084 2.196 ( -4.478 -3.863 -6.206) 8.572 2.306 ( 0.960 -0.405 -1.814) 2.092 2.356 ( 1.945 -1.875 1.880) 3.291 2.400 ( -4.301 1.078 -1.896) 4.823 2.481 ( 1.114 0.404 1.836) 2.186 2.541 ( 0.719 1.740 -0.493) 1.946 2.665 ( 0.368 1.748 2.274) 2.891 2.753 ( 1.282 -0.597 2.015) 2.462 2.875 ( -2.647 1.357 -0.589) 3.033 2.976 ( 2.258 5.131 -1.085) 5.710 3.034 ( 1.257 -3.460 2.433) 4.413 3.261 ( 6.397 -5.744 0.645) 8.622 3.526 ( 1.031 -1.869 -0.269) 2.151 3.646 ( -1.745 -2.562 -1.348) 3.380 3.759 ( 1.501 -15.724 -0.129) 15.796 5.306 ( -1.852 -7.168 -1.350) 7.526 5.551 ( -4.495 3.832 4.719) 7.560 5.620 ( 1.126 -0.268 -1.629) 1.999 5.713 ( 1.452 -0.131 0.238) 1.477 5.964 ( -2.157 -2.054 -0.799) 3.084 6.114 ( 1.679 0.761 -2.919) 3.453 6.455 ( 0.492 6.089 2.025) 6.436 6.670 ( -0.345 -5.912 -0.560) 5.948 6.911 ( 1.439 -4.921 -1.738) 5.414 7.019 ( -2.527 -12.706 -0.812) 12.980 7.191 ( 0.154 -9.862 0.375) 9.870 7.458 ( -6.911 -0.643 0.227) 6.945 7.542 ( -2.466 -2.748 1.274) 3.906 7.757 ( -0.523 -2.568 1.849) 3.207 7.866 ( 0.988 -4.319 0.498) 4.459 8.383 ( -0.401 1.796 -1.534) 2.396 8.546 ( 4.373 0.605 -0.230) 4.420 9.563 ( -0.236 1.332 0.384) 1.407 ======================= Grid point 5 (6/199) ======================= q-point: ( 0.42 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.783 ( -0.892 2.583 0.004) 2.733 1.362 ( 2.431 -3.559 0.915) 4.406 1.551 ( 1.019 -3.734 0.889) 3.971 1.826 ( -1.077 -1.279 -0.330) 1.705 1.861 ( -3.102 -1.262 1.761) 3.784 1.937 ( -4.315 -1.867 -0.182) 4.705 1.981 ( 2.378 0.646 1.591) 2.933 2.026 ( -0.418 -1.153 0.583) 1.358 2.048 ( -2.542 -4.665 -3.020) 6.111 2.230 ( -2.726 -0.568 -4.302) 5.125 2.317 ( -0.233 -0.387 -0.246) 0.514 2.328 ( -0.135 2.068 -2.077) 2.934 2.423 ( -2.527 -2.880 0.462) 3.859 2.488 ( 3.190 -0.426 1.633) 3.609 2.520 ( -0.210 0.448 -0.072) 0.500 2.647 ( 0.881 0.516 0.712) 1.245 2.757 ( 0.932 1.913 3.840) 4.390 2.801 ( -0.109 3.143 -0.151) 3.148 2.878 ( 0.524 4.427 -3.022) 5.386 3.099 ( 1.187 -2.134 2.176) 3.271 3.404 ( 4.153 -3.766 -0.606) 5.639 3.565 ( 2.683 -1.433 1.993) 3.637 3.663 ( -4.198 -1.208 -1.962) 4.789 4.042 ( 0.789 -10.373 -0.338) 10.409 5.421 ( -2.798 -5.575 -0.691) 6.276 5.464 ( -3.016 2.380 2.444) 4.554 5.596 ( 2.666 3.007 -1.362) 4.243 5.757 ( 1.125 -2.271 0.475) 2.579 5.998 ( -2.110 -2.256 0.505) 3.130 6.120 ( 2.109 -0.982 -3.576) 4.266 6.337 ( -0.035 5.907 2.312) 6.343 6.743 ( -0.570 -2.318 -0.674) 2.480 7.016 ( 2.843 -4.163 -1.029) 5.145 7.164 ( -3.562 -3.349 0.051) 4.890 7.372 ( 1.691 -6.830 0.935) 7.098 7.435 ( -4.955 -1.548 -0.219) 5.196 7.548 ( -1.123 0.338 1.191) 1.672 7.816 ( -0.421 -2.822 0.419) 2.884 7.946 ( 0.052 -3.004 0.097) 3.006 8.356 ( -0.154 0.750 -1.005) 1.264 8.561 ( 2.527 0.107 -0.075) 2.530 9.542 ( -0.205 0.652 0.216) 0.717 ======================= Grid point 6 (7/199) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.753 ( 0.000 -0.000 -0.000) 0.000 1.408 ( 0.000 -0.000 -0.000) 0.000 1.586 ( 0.000 -0.000 -0.000) 0.000 1.821 ( 0.000 -0.000 -0.000) 0.000 1.888 ( -0.000 -0.000 0.000) 0.000 1.919 ( 0.000 -0.000 -0.000) 0.000 1.977 ( 0.000 -0.000 -0.000) 0.000 2.036 ( -0.000 -0.000 -0.000) 0.000 2.149 ( 0.000 0.000 -0.000) 0.000 2.163 ( 0.000 -0.000 -0.000) 0.000 2.320 ( -0.000 0.000 0.000) 0.000 2.320 ( 0.000 -0.000 -0.000) 0.000 2.438 ( 0.000 -0.000 -0.000) 0.000 2.500 ( -0.000 -0.000 0.000) 0.000 2.546 ( -0.000 -0.000 -0.000) 0.000 2.646 ( -0.000 0.000 -0.000) 0.000 2.695 ( 0.000 -0.000 -0.000) 0.000 2.809 ( 0.000 -0.000 0.000) 0.000 2.816 ( 0.000 -0.000 0.000) 0.000 3.125 ( -0.000 -0.000 0.000) 0.000 3.450 ( -0.000 -0.000 -0.000) 0.000 3.603 ( 0.000 -0.000 0.000) 0.000 3.651 ( 0.000 -0.000 -0.000) 0.000 4.149 ( 0.000 -0.000 -0.000) 0.000 5.428 ( 0.000 -0.000 -0.000) 0.000 5.479 ( 0.000 -0.000 -0.000) 0.000 5.563 ( 0.000 0.000 -0.000) 0.000 5.786 ( 0.000 -0.000 -0.000) 0.000 6.013 ( 0.000 -0.000 0.000) 0.000 6.162 ( 0.000 0.000 0.000) 0.000 6.253 ( 0.000 -0.000 -0.000) 0.000 6.764 ( 0.000 -0.000 -0.000) 0.000 7.087 ( 0.000 -0.000 0.000) 0.000 7.154 ( -0.000 -0.000 -0.000) 0.000 7.440 ( 0.000 -0.000 0.000) 0.000 7.457 ( -0.000 -0.000 -0.000) 0.000 7.536 ( 0.000 -0.000 0.000) 0.000 7.844 ( 0.000 -0.000 0.000) 0.000 7.976 ( 0.000 -0.000 -0.000) 0.000 8.348 ( 0.000 -0.000 -0.000) 0.000 8.569 ( 0.000 -0.000 -0.000) 0.000 9.535 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 14 (8/199) ======================= q-point: ( 0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.254 ( 20.374 -0.000 5.818) 21.188 0.278 ( 22.079 -0.000 3.675) 22.383 0.455 ( 36.327 -0.000 9.444) 37.535 1.092 ( -1.480 0.000 -4.814) 5.037 1.261 ( -1.011 0.000 1.202) 1.571 1.365 ( 4.785 -0.000 4.506) 6.572 1.563 ( 3.735 -0.000 -3.002) 4.792 1.780 ( -0.689 0.000 -1.079) 1.280 1.872 ( -2.710 0.000 0.584) 2.772 2.129 ( -5.173 0.000 -1.237) 5.319 2.203 ( -0.515 0.000 0.175) 0.543 2.266 ( 0.862 -0.000 -5.029) 5.103 2.305 ( 1.109 -0.000 3.096) 3.288 2.428 ( -0.797 0.000 -3.903) 3.983 2.446 ( -0.062 0.000 3.816) 3.816 2.646 ( -5.298 0.000 -1.331) 5.463 2.705 ( 0.175 -0.000 -2.388) 2.394 2.750 ( -0.583 0.000 -0.065) 0.586 2.820 ( -4.544 0.000 3.930) 6.008 3.010 ( -2.581 0.000 -6.838) 7.309 3.200 ( 3.481 -0.000 5.616) 6.607 3.458 ( 3.204 -0.000 2.997) 4.388 3.612 ( 2.509 -0.000 0.233) 2.520 3.759 ( -4.671 0.000 2.832) 5.462 5.103 ( 1.517 -0.000 -52.550) 52.572 5.296 ( 1.219 -0.000 -0.135) 1.226 5.493 ( 2.850 -0.000 -2.281) 3.650 5.714 ( -0.455 0.000 -0.475) 0.657 5.836 ( -0.036 0.000 0.667) 0.668 5.933 ( -4.424 0.000 -0.013) 4.424 6.004 ( -4.433 0.000 0.238) 4.439 6.011 ( -0.474 0.000 0.024) 0.475 6.690 ( 4.441 -0.000 -44.541) 44.761 6.704 ( -0.570 0.000 -0.234) 0.616 6.813 ( 2.192 -0.000 -0.838) 2.347 6.836 ( 0.660 -0.000 0.132) 0.673 7.424 ( -5.706 0.000 4.955) 7.557 7.598 ( 3.571 -0.000 22.910) 23.187 7.949 ( -5.571 0.000 49.771) 50.081 8.568 ( -1.393 0.000 -2.708) 3.045 8.601 ( 5.188 -0.000 2.517) 5.766 9.831 ( -2.174 0.000 8.378) 8.655 ======================= Grid point 15 (9/199) ======================= q-point: ( 0.17 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.472 ( 9.156 -13.852 4.320) 17.157 0.551 ( 14.446 -13.106 6.950) 20.706 0.947 ( 9.520 -10.077 1.518) 13.946 1.175 ( 8.128 -12.526 -1.293) 14.988 1.310 ( 4.213 -7.927 1.908) 9.178 1.498 ( 4.280 -9.124 3.110) 10.546 1.626 ( 3.301 -4.061 -2.687) 5.884 1.810 ( -1.464 -3.103 -1.679) 3.820 1.854 ( -3.955 -0.522 1.451) 4.245 2.096 ( -5.878 -0.407 -2.652) 6.461 2.238 ( -1.312 -3.381 -0.499) 3.660 2.270 ( 1.674 -0.649 -3.317) 3.772 2.305 ( 1.842 0.361 2.664) 3.259 2.426 ( -1.423 -0.302 -4.010) 4.265 2.461 ( -1.510 -1.530 2.468) 3.273 2.649 ( -4.264 -3.076 0.136) 5.259 2.687 ( 0.606 1.014 -1.235) 1.709 2.740 ( -2.568 0.485 0.201) 2.621 2.820 ( -3.398 -2.423 3.326) 5.336 3.008 ( -3.150 -1.830 -7.472) 8.313 3.194 ( 4.429 2.161 2.800) 5.668 3.456 ( 5.892 3.870 -0.088) 7.050 3.522 ( 1.661 5.823 2.227) 6.452 3.627 ( 3.219 0.351 -0.127) 3.240 5.000 ( 1.633 -0.445 -7.027) 7.228 5.491 ( 0.536 -0.907 2.912) 3.096 5.599 ( -1.973 -10.238 -5.552) 11.813 5.784 ( -5.371 1.026 1.265) 5.613 5.851 ( -2.470 -3.773 0.055) 4.510 5.937 ( -8.346 -1.421 4.929) 9.797 6.104 ( -0.704 -9.061 0.034) 9.088 6.200 ( -5.857 -13.016 -4.707) 15.029 6.685 ( -1.824 -1.790 -18.458) 18.634 6.729 ( 0.028 -2.029 2.505) 3.224 6.788 ( 1.073 1.599 -0.724) 2.058 7.033 ( -6.017 -12.111 -10.373) 17.044 7.394 ( -5.350 -0.520 2.785) 6.054 7.663 ( 2.831 -2.799 9.954) 10.721 7.864 ( 1.060 4.862 19.102) 19.739 8.535 ( -2.830 1.795 -3.685) 4.981 8.621 ( 7.658 1.813 2.055) 8.134 9.721 ( 2.291 5.372 2.405) 6.316 ======================= Grid point 16 (10/199) ======================= q-point: ( 0.25 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.788 ( 2.512 -12.162 5.719) 13.672 0.900 ( 8.086 -13.306 3.361) 15.928 1.024 ( 4.939 -2.277 -1.392) 5.614 1.354 ( -1.525 -7.722 0.464) 7.884 1.689 ( 4.216 -9.436 0.676) 10.357 1.718 ( 2.279 -10.121 3.782) 11.043 1.790 ( 5.100 -9.821 -1.110) 11.122 1.846 ( -1.952 -4.106 -0.672) 4.596 1.865 ( -2.878 -2.832 -0.258) 4.046 2.080 ( -5.796 -1.792 -4.449) 7.523 2.289 ( 2.321 -0.349 -2.732) 3.602 2.309 ( -1.523 -4.040 -1.024) 4.437 2.333 ( 1.101 -1.252 1.657) 2.351 2.441 ( -3.041 -2.235 -3.404) 5.083 2.509 ( 0.043 -6.825 1.070) 6.908 2.646 ( 0.624 1.520 0.844) 1.848 2.700 ( 1.898 -0.268 2.684) 3.299 2.737 ( -0.818 -1.303 -0.179) 1.549 2.880 ( -3.332 -5.361 1.122) 6.411 3.031 ( -2.802 -2.189 -3.487) 4.980 3.201 ( 2.382 -2.084 -0.657) 3.233 3.364 ( 1.304 5.496 -0.933) 5.725 3.510 ( 2.570 -0.344 3.366) 4.249 3.636 ( 2.755 0.517 -0.706) 2.890 5.055 ( -0.026 -4.426 -3.574) 5.689 5.524 ( 0.950 -1.947 2.541) 3.340 5.695 ( -4.490 2.089 4.381) 6.612 5.742 ( -2.029 -1.603 -4.646) 5.317 5.899 ( -3.052 -2.243 -0.529) 3.824 5.991 ( -5.461 -8.789 1.922) 10.525 6.315 ( 1.864 -10.039 -0.436) 10.220 6.403 ( 0.676 -12.192 0.911) 12.244 6.700 ( -1.165 2.613 -0.259) 2.873 6.725 ( -1.603 -2.310 -10.882) 11.239 6.839 ( -1.960 -6.498 0.332) 6.796 7.219 ( -4.470 -10.668 -2.639) 11.864 7.387 ( -5.574 -2.041 0.818) 5.992 7.733 ( 1.321 -2.661 5.140) 5.937 7.797 ( 1.202 3.378 8.165) 8.917 8.467 ( -3.907 2.580 -4.865) 6.752 8.627 ( 8.766 2.641 2.151) 9.405 9.649 ( 0.449 3.227 0.976) 3.401 ======================= Grid point 17 (11/199) ======================= q-point: ( 0.33 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.896 ( -0.118 0.815 1.959) 2.125 1.121 ( 5.047 -8.169 0.495) 9.615 1.241 ( 6.803 -10.986 3.491) 13.385 1.533 ( -3.710 -11.727 1.347) 12.373 1.787 ( -3.655 -0.340 0.585) 3.717 1.815 ( -1.899 -4.636 -1.267) 5.167 1.883 ( -3.224 -4.003 0.266) 5.147 1.922 ( 1.028 -4.188 0.472) 4.338 2.008 ( 1.583 -3.601 -0.319) 3.946 2.090 ( -5.910 -3.028 -6.380) 9.209 2.302 ( 0.644 -0.353 -2.749) 2.845 2.352 ( 0.267 -0.671 3.056) 3.140 2.361 ( -2.557 -1.560 -2.035) 3.622 2.462 ( -1.240 -2.158 -0.931) 2.657 2.594 ( 0.938 2.276 -0.622) 2.539 2.697 ( 1.392 -0.327 3.435) 3.721 2.726 ( 0.622 -3.194 1.863) 3.750 2.804 ( 1.423 -6.459 -0.207) 6.617 2.965 ( 1.470 -4.189 1.115) 4.578 3.043 ( 0.938 0.031 -0.130) 0.947 3.256 ( 1.571 1.601 -0.679) 2.343 3.390 ( 1.238 -11.429 -2.582) 11.782 3.550 ( 1.935 -3.004 2.987) 4.657 3.639 ( 1.063 0.336 -1.565) 1.922 5.161 ( -0.853 -6.391 -2.469) 6.904 5.574 ( -1.081 -1.368 4.033) 4.393 5.607 ( -3.696 2.128 2.119) 4.762 5.734 ( -0.380 0.885 -1.342) 1.652 5.916 ( -2.845 -1.521 -1.320) 3.485 6.109 ( 0.039 -3.292 -2.325) 4.031 6.502 ( 0.841 -6.751 -0.302) 6.809 6.597 ( 2.409 2.200 4.223) 5.337 6.718 ( -0.943 -14.094 -1.408) 14.196 6.797 ( -2.672 -6.554 -6.911) 9.892 6.984 ( -1.918 -9.341 0.403) 9.544 7.379 ( -4.570 -4.768 1.795) 6.844 7.417 ( -3.990 -6.540 -0.557) 7.682 7.749 ( -0.226 1.632 6.234) 6.448 7.797 ( 0.692 -2.994 0.414) 3.101 8.394 ( -4.602 1.771 -5.727) 7.557 8.627 ( 8.575 2.757 2.610) 9.377 9.596 ( -0.291 2.180 0.523) 2.260 ======================= Grid point 18 (12/199) ======================= q-point: ( 0.42 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.842 ( -0.409 3.586 0.270) 3.620 1.286 ( 3.111 -5.808 1.489) 6.755 1.457 ( 3.954 -7.094 2.452) 8.483 1.736 ( -4.504 -9.593 1.227) 10.669 1.790 ( -1.725 -2.458 0.763) 3.098 1.849 ( -4.097 -1.279 -0.517) 4.323 1.934 ( -2.564 -3.498 -0.189) 4.341 1.995 ( 0.318 -2.456 1.020) 2.678 2.030 ( 0.129 0.696 -1.316) 1.494 2.129 ( -5.130 -4.725 -7.354) 10.135 2.310 ( -0.759 -0.714 -1.585) 1.897 2.343 ( -3.280 0.148 -1.030) 3.441 2.379 ( 0.867 -0.576 0.708) 1.259 2.491 ( 0.188 -0.918 1.424) 1.705 2.555 ( 1.704 2.250 -0.220) 2.831 2.675 ( 0.964 1.589 1.810) 2.594 2.767 ( 0.661 -0.695 1.597) 1.863 2.846 ( -1.740 1.245 -0.873) 2.311 2.999 ( 1.542 5.032 -0.219) 5.268 3.068 ( 3.662 -2.849 2.736) 5.386 3.329 ( 4.517 -6.004 0.645) 7.541 3.536 ( 0.512 -2.477 -0.454) 2.570 3.632 ( -0.282 -0.020 -1.513) 1.539 3.774 ( 1.004 -15.981 -0.281) 16.015 5.282 ( -1.841 -6.503 -1.584) 6.942 5.494 ( -5.300 3.071 3.939) 7.283 5.639 ( 1.969 -0.842 -0.665) 2.243 5.727 ( 0.849 -0.704 0.336) 1.153 5.934 ( -2.564 -2.224 -0.801) 3.487 6.132 ( 1.667 0.403 -3.144) 3.581 6.466 ( 1.114 6.255 2.229) 6.733 6.661 ( -1.080 -4.924 -1.191) 5.179 6.929 ( 1.628 -6.358 -2.112) 6.895 6.990 ( -2.128 -12.145 -0.376) 12.335 7.182 ( -1.489 -11.099 0.635) 11.216 7.385 ( -5.236 -1.218 0.728) 5.424 7.529 ( 0.360 -3.236 2.963) 4.403 7.748 ( -1.078 -2.251 1.729) 3.036 7.870 ( -0.285 -4.144 -0.132) 4.156 8.342 ( -4.893 0.274 -5.760) 7.563 8.624 ( 7.162 2.549 3.085) 8.204 9.560 ( -0.356 1.303 0.213) 1.367 ======================= Grid point 19 (13/199) ======================= q-point: ( 0.50 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.775 ( -0.468 2.417 -0.003) 2.461 1.386 ( 1.332 -2.679 1.092) 3.185 1.565 ( 1.205 -2.455 0.251) 2.746 1.809 ( -1.804 -1.067 0.042) 2.097 1.829 ( -2.066 -3.020 1.473) 3.945 1.889 ( -3.391 -3.523 0.771) 4.950 2.004 ( 0.375 1.263 1.374) 1.904 2.015 ( -0.214 -5.299 0.429) 5.320 2.035 ( 0.182 -1.808 -2.452) 3.052 2.192 ( -2.652 -3.139 -4.809) 6.325 2.311 ( -0.664 1.359 -2.183) 2.655 2.319 ( -1.143 -0.497 0.318) 1.286 2.392 ( -2.493 -1.557 0.869) 3.065 2.516 ( -0.081 -1.050 0.183) 1.069 2.530 ( 2.928 0.866 0.729) 3.139 2.659 ( 1.011 0.859 0.751) 1.525 2.753 ( -1.512 3.049 0.395) 3.426 2.810 ( 1.195 0.457 1.662) 2.097 2.885 ( 0.803 5.979 -2.116) 6.393 3.132 ( 3.753 -0.806 3.050) 4.903 3.437 ( 0.953 -2.013 -0.402) 2.263 3.571 ( -2.672 -1.568 -1.166) 3.310 3.645 ( 2.512 -1.433 0.187) 2.899 4.048 ( 0.240 -9.964 -0.316) 9.972 5.387 ( -2.546 -5.435 -0.460) 6.020 5.428 ( -3.063 0.834 1.799) 3.649 5.629 ( 2.832 2.783 -0.898) 4.071 5.769 ( 0.735 -1.936 0.231) 2.083 5.971 ( -2.282 -2.795 0.723) 3.680 6.144 ( 2.165 -1.055 -3.721) 4.432 6.341 ( 0.372 6.644 2.535) 7.121 6.730 ( -1.497 -2.872 -1.394) 3.526 7.049 ( 2.394 -4.218 -0.868) 4.927 7.126 ( -2.426 -3.107 0.641) 3.994 7.357 ( -3.509 -6.721 0.484) 7.597 7.414 ( 0.582 -4.055 0.556) 4.134 7.554 ( 1.982 0.704 2.841) 3.535 7.807 ( -1.125 -3.277 -0.273) 3.476 7.943 ( -0.336 -3.092 -0.472) 3.145 8.317 ( -4.959 -0.909 -4.933) 7.054 8.614 ( 5.012 2.408 3.354) 6.494 9.540 ( -0.148 0.547 -0.056) 0.569 ======================= Grid point 20 (14/199) ======================= q-point: (-0.42 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.755 ( 0.429 -0.548 0.002) 0.696 1.398 ( -1.369 1.362 -0.293) 1.954 1.589 ( 0.399 0.417 0.095) 0.585 1.826 ( 0.590 -1.277 0.641) 1.546 1.882 ( -0.915 -2.010 -0.422) 2.249 1.924 ( 0.942 -1.900 -0.103) 2.123 1.978 ( 0.140 1.211 0.733) 1.422 2.039 ( 0.346 0.155 -0.677) 0.776 2.153 ( 0.667 -4.807 0.418) 4.871 2.173 ( 1.727 2.159 -0.531) 2.815 2.310 ( -1.757 0.423 3.369) 3.823 2.319 ( -0.254 -1.580 -1.886) 2.474 2.415 ( -2.837 -2.219 -2.057) 4.148 2.512 ( 1.002 0.304 -0.369) 1.110 2.555 ( 1.599 1.995 1.527) 2.978 2.644 ( -0.411 0.663 -0.277) 0.828 2.688 ( -1.073 -0.371 -0.181) 1.149 2.795 ( -0.844 2.656 -2.958) 4.064 2.833 ( 1.315 -1.409 2.613) 3.247 3.142 ( 2.680 1.791 1.063) 3.394 3.431 ( -3.230 1.368 0.458) 3.538 3.559 ( -3.685 0.179 -2.733) 4.592 3.701 ( 4.990 -0.748 1.432) 5.245 4.146 ( -0.480 0.230 0.041) 0.533 5.428 ( 0.040 -1.851 -0.533) 1.926 5.467 ( -1.695 -3.628 0.873) 4.099 5.577 ( 1.849 3.591 -0.302) 4.050 5.785 ( -0.191 0.719 -0.192) 0.768 6.007 ( -0.996 -1.697 0.772) 2.114 6.172 ( 1.481 2.628 -1.000) 3.178 6.252 ( -0.303 -0.945 0.463) 1.095 6.757 ( -1.020 -0.724 -0.747) 1.457 7.065 ( -2.476 2.262 0.822) 3.453 7.182 ( 3.421 -2.789 -0.083) 4.414 7.409 ( -2.751 -0.735 -0.219) 2.856 7.491 ( 2.887 -0.978 0.710) 3.130 7.552 ( 2.693 0.486 1.344) 3.049 7.840 ( -0.737 -0.467 -0.733) 1.140 7.975 ( -0.125 -0.104 -0.513) 0.538 8.311 ( -4.924 -1.675 -3.705) 6.386 8.592 ( 2.819 2.391 3.351) 4.989 9.536 ( 0.082 -0.105 -0.246) 0.280 ======================= Grid point 21 (15/199) ======================= q-point: (-0.33 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.795 ( 0.980 -2.695 -0.010) 2.868 1.330 ( -2.513 4.101 -0.469) 4.833 1.541 ( -0.408 4.855 -1.098) 4.994 1.837 ( 0.743 0.663 0.239) 1.024 1.893 ( 2.152 0.439 -1.030) 2.426 1.948 ( -2.277 -0.168 -1.216) 2.587 1.992 ( 4.093 0.927 1.119) 4.343 2.027 ( -0.073 1.196 0.090) 1.201 2.094 ( 4.471 3.761 1.294) 5.984 2.253 ( -0.055 -0.366 1.251) 1.305 2.317 ( -0.099 -2.583 0.359) 2.610 2.332 ( 0.595 -0.654 4.336) 4.425 2.443 ( -0.911 -1.612 -4.024) 4.430 2.457 ( 0.065 5.329 1.439) 5.520 2.522 ( -0.012 -0.380 -0.030) 0.381 2.639 ( -0.164 -0.386 -0.513) 0.663 2.733 ( -2.011 -1.747 -4.049) 4.847 2.803 ( -0.102 -5.208 0.093) 5.210 2.878 ( 0.125 -2.594 2.716) 3.758 3.100 ( 1.399 3.453 -0.936) 3.842 3.344 ( -5.380 4.987 0.191) 7.339 3.533 ( -1.978 0.441 -1.498) 2.520 3.716 ( 3.902 2.071 1.245) 4.590 4.031 ( -1.075 10.792 0.249) 10.848 5.452 ( 2.155 5.468 0.759) 5.926 5.495 ( 2.497 -3.601 -2.936) 5.275 5.568 ( -2.114 -3.279 1.930) 4.353 5.742 ( -1.090 2.763 -0.501) 3.013 6.019 ( 1.226 1.166 -0.177) 1.701 6.101 ( -1.282 1.735 2.473) 3.282 6.337 ( 0.221 -5.495 -1.589) 5.725 6.746 ( -0.146 1.614 -0.013) 1.620 6.987 ( -1.948 3.858 0.939) 4.423 7.208 ( 3.591 3.828 0.552) 5.278 7.340 ( -3.016 5.856 -1.153) 6.688 7.506 ( 5.714 0.591 1.202) 5.869 7.572 ( 2.851 -0.315 -0.117) 2.871 7.816 ( -0.375 2.356 -1.019) 2.594 7.941 ( -0.552 3.302 -0.465) 3.379 8.321 ( -4.663 -2.472 -2.630) 5.897 8.559 ( 1.167 2.158 3.104) 3.956 9.544 ( 0.180 -0.703 -0.327) 0.796 ======================= Grid point 22 (16/199) ======================= q-point: (-0.25 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.859 ( 0.711 -2.963 -0.158) 3.051 1.209 ( -2.326 6.687 -0.190) 7.082 1.381 ( -1.595 10.540 -1.736) 10.801 1.835 ( 2.261 6.327 -0.594) 6.745 1.844 ( 3.043 2.801 -1.003) 4.256 1.917 ( 0.218 0.964 -0.924) 1.353 1.948 ( -0.122 2.252 1.791) 2.880 1.981 ( -0.694 3.509 0.411) 3.600 2.084 ( 3.384 2.424 0.910) 4.261 2.235 ( 0.900 1.532 2.355) 2.950 2.302 ( 0.411 1.588 2.961) 3.385 2.330 ( -1.842 3.437 -0.951) 4.014 2.442 ( 1.723 -1.014 0.232) 2.013 2.470 ( 0.154 -3.185 -1.192) 3.404 2.535 ( -0.399 -1.348 0.423) 1.468 2.662 ( 0.031 -1.736 -1.667) 2.407 2.737 ( -0.929 0.764 -1.267) 1.747 2.904 ( 1.883 -2.149 -0.893) 2.993 2.948 ( -2.278 -5.069 1.611) 5.787 3.041 ( 2.845 4.577 -0.885) 5.461 3.178 ( -6.986 5.544 -0.614) 8.939 3.515 ( -0.729 0.765 0.207) 1.077 3.672 ( 2.177 4.850 0.851) 5.384 3.739 ( -1.814 15.605 -0.086) 15.710 5.326 ( 1.118 7.641 0.792) 7.763 5.585 ( 1.231 -2.543 -3.649) 4.615 5.623 ( 1.616 -2.202 1.545) 3.138 5.693 ( -1.775 -0.142 0.052) 1.781 5.985 ( 1.207 1.971 0.505) 2.365 6.099 ( -1.081 -1.023 1.782) 2.321 6.450 ( -0.161 -5.834 -1.228) 5.964 6.672 ( 0.017 6.569 0.119) 6.570 6.899 ( -0.810 4.014 1.009) 4.217 7.049 ( 2.132 13.675 0.878) 13.868 7.180 ( -1.242 7.645 -0.621) 7.770 7.542 ( 5.623 0.419 0.995) 5.726 7.580 ( 3.943 2.144 0.038) 4.488 7.757 ( -0.232 2.638 -2.239) 3.468 7.845 ( -2.293 5.162 -0.453) 5.666 8.353 ( -3.729 -3.499 -1.769) 5.411 8.529 ( 0.329 1.295 2.560) 2.888 9.565 ( 0.102 -1.278 -0.304) 1.318 ======================= Grid point 23 (17/199) ======================= q-point: (-0.17 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.917 ( 0.928 -2.362 -0.891) 2.690 1.026 ( -1.879 11.182 0.483) 11.349 1.125 ( -1.757 13.519 -1.144) 13.681 1.620 ( 1.974 12.533 -0.388) 12.694 1.840 ( 0.566 6.296 -0.513) 6.343 1.861 ( 1.354 5.035 -0.806) 5.275 1.881 ( -1.033 4.446 0.741) 4.624 1.919 ( -0.284 0.483 0.635) 0.847 1.999 ( 0.366 7.329 0.045) 7.338 2.214 ( 3.641 1.955 2.648) 4.908 2.261 ( -3.325 1.668 -1.416) 3.980 2.274 ( -1.083 1.277 0.860) 1.883 2.421 ( 0.268 2.261 0.272) 2.293 2.555 ( 3.809 -1.934 1.080) 4.406 2.581 ( -0.313 -3.352 -0.269) 3.377 2.667 ( -0.448 4.655 -2.295) 5.209 2.670 ( -2.619 4.085 0.151) 4.855 2.806 ( 0.698 10.218 -0.076) 10.242 2.948 ( -0.013 -0.088 -0.182) 0.202 3.018 ( -0.669 -3.397 0.004) 3.462 3.211 ( -1.141 -6.882 0.130) 6.977 3.389 ( 0.312 14.778 1.480) 14.856 3.499 ( -1.001 1.427 -1.528) 2.318 3.626 ( -0.173 2.318 0.426) 2.363 5.181 ( 0.301 7.175 0.671) 7.213 5.558 ( -0.327 2.834 -0.600) 2.915 5.706 ( 2.764 -3.244 -3.910) 5.783 5.732 ( -1.061 -3.185 3.083) 4.558 5.966 ( 0.758 0.955 0.314) 1.259 6.116 ( 0.154 -1.162 0.872) 1.461 6.467 ( -0.956 13.331 -0.154) 13.366 6.562 ( -0.271 -5.522 -0.979) 5.615 6.737 ( 0.292 17.511 0.498) 17.521 6.828 ( 0.093 3.068 1.112) 3.264 7.041 ( 0.996 6.598 0.524) 6.694 7.513 ( 2.721 4.848 1.927) 5.884 7.529 ( 4.782 5.950 0.605) 7.657 7.724 ( -1.897 0.636 -5.594) 5.941 7.745 ( -1.794 2.234 1.263) 3.131 8.412 ( -2.104 -4.183 -0.928) 4.774 8.519 ( 0.158 -0.118 1.544) 1.557 9.595 ( -0.099 -1.714 -0.209) 1.729 ======================= Grid point 24 (18/199) ======================= q-point: (-0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.727 ( -0.000 17.249 -0.000) 17.249 0.830 ( -0.000 16.613 -0.000) 16.613 0.969 ( 0.000 -1.781 0.000) 1.781 1.408 ( -0.000 8.787 -0.000) 8.787 1.533 ( -0.000 25.880 -0.000) 25.880 1.688 ( -0.000 11.351 -0.000) 11.351 1.735 ( -0.000 8.611 -0.000) 8.611 1.893 ( -0.000 2.734 -0.000) 2.734 1.917 ( -0.000 1.315 -0.000) 1.315 2.193 ( -0.000 1.908 -0.000) 1.908 2.230 ( 0.000 -0.372 0.000) 0.372 2.257 ( 0.000 -0.040 0.000) 0.040 2.346 ( -0.000 5.730 -0.000) 5.730 2.487 ( -0.000 4.638 -0.000) 4.638 2.540 ( -0.000 4.544 -0.000) 4.544 2.636 ( 0.000 -2.551 0.000) 2.551 2.656 ( 0.000 -2.277 0.000) 2.277 2.767 ( 0.000 -0.507 0.000) 0.507 2.932 ( -0.000 2.221 -0.000) 2.221 3.080 ( 0.000 -2.760 0.000) 2.760 3.151 ( -0.000 8.629 -0.000) 8.629 3.326 ( 0.000 -4.164 0.000) 4.164 3.474 ( -0.000 0.530 -0.000) 0.530 3.598 ( -0.000 0.551 -0.000) 0.551 5.059 ( -0.000 5.092 -0.000) 5.092 5.506 ( -0.000 2.073 -0.000) 2.073 5.735 ( -0.000 1.860 -0.000) 1.860 5.790 ( 0.000 -2.554 0.000) 2.554 5.939 ( -0.000 2.167 -0.000) 2.167 6.157 ( 0.000 -2.307 0.000) 2.307 6.191 ( -0.000 11.923 -0.000) 11.923 6.399 ( -0.000 15.393 -0.000) 15.393 6.662 ( 0.000 -4.398 0.000) 4.398 6.776 ( -0.000 2.439 -0.000) 2.439 6.914 ( -0.000 6.769 -0.000) 6.769 7.385 ( -0.000 8.146 -0.000) 8.146 7.462 ( -0.000 1.628 -0.000) 1.628 7.683 ( -0.000 2.155 -0.000) 2.155 7.736 ( 0.000 -0.516 0.000) 0.516 8.486 ( 0.000 -3.771 0.000) 3.771 8.535 ( 0.000 -1.277 0.000) 1.277 9.629 ( 0.000 -1.716 0.000) 1.716 ======================= Grid point 27 (19/199) ======================= q-point: ( 0.17 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.502 ( 19.532 -0.000 5.697) 20.346 0.534 ( 19.160 -0.000 4.011) 19.576 0.887 ( 32.653 -0.000 8.845) 33.829 1.075 ( 0.080 -0.000 -6.381) 6.381 1.256 ( 0.952 -0.000 2.009) 2.224 1.444 ( 7.048 -0.000 5.808) 9.133 1.620 ( 5.700 -0.000 -4.132) 7.040 1.765 ( -1.652 0.000 -2.053) 2.635 1.828 ( -4.387 0.000 1.028) 4.506 2.054 ( -6.553 0.000 -3.394) 7.380 2.193 ( -1.202 0.000 0.266) 1.231 2.259 ( -1.893 0.000 -1.179) 2.230 2.319 ( 0.692 -0.000 1.323) 1.493 2.415 ( -0.745 0.000 -3.743) 3.816 2.444 ( -0.768 0.000 3.576) 3.657 2.545 ( -10.358 0.000 -2.494) 10.654 2.705 ( 0.158 -0.000 -2.611) 2.616 2.740 ( -0.958 0.000 -0.082) 0.961 2.782 ( -1.900 0.000 6.163) 6.449 2.965 ( -3.386 0.000 -9.615) 10.194 3.246 ( 2.972 -0.000 2.719) 4.028 3.508 ( 4.282 -0.000 4.619) 6.298 3.650 ( 1.574 -0.000 -2.720) 3.142 3.685 ( -5.731 0.000 2.065) 6.092 5.070 ( -1.722 0.000 -21.142) 21.212 5.317 ( 2.225 -0.000 -0.250) 2.239 5.534 ( 4.028 -0.000 -3.259) 5.182 5.705 ( -0.904 0.000 -0.713) 1.151 5.837 ( 0.026 -0.000 1.060) 1.060 5.863 ( -6.698 0.000 -0.635) 6.728 5.934 ( -6.782 0.000 0.766) 6.825 6.002 ( -0.904 0.000 0.037) 0.905 6.695 ( -0.776 0.000 -0.337) 0.846 6.706 ( 2.167 -0.000 -17.431) 17.565 6.846 ( 0.934 -0.000 0.167) 0.949 6.848 ( 3.571 -0.000 -0.846) 3.670 7.358 ( -5.517 0.000 2.894) 6.230 7.658 ( 3.589 -0.000 12.776) 13.271 7.922 ( -3.186 0.000 19.738) 19.994 8.535 ( -3.220 0.000 -3.906) 5.062 8.691 ( 8.694 -0.000 2.493) 9.044 9.803 ( -3.240 0.000 3.681) 4.904 ======================= Grid point 28 (20/199) ======================= q-point: ( 0.25 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.627 ( 14.433 -5.259 4.244) 15.937 0.746 ( 15.735 -8.589 7.051) 19.263 1.023 ( 5.130 -0.804 -1.498) 5.405 1.238 ( 1.505 -5.320 -0.178) 5.532 1.464 ( 18.897 -17.802 5.024) 26.443 1.563 ( 5.496 -6.890 3.656) 9.542 1.673 ( 4.762 -2.925 -3.450) 6.568 1.782 ( -3.004 -2.405 -2.575) 4.630 1.803 ( -4.402 -0.580 1.588) 4.716 2.018 ( -6.338 -0.652 -4.788) 7.970 2.207 ( -4.130 -2.511 -1.030) 4.942 2.280 ( 0.191 -3.096 -0.189) 3.107 2.318 ( 0.264 0.015 1.065) 1.097 2.408 ( -1.087 -0.023 -2.832) 3.033 2.434 ( -2.919 -0.932 0.235) 3.074 2.580 ( -6.084 -7.463 0.244) 9.632 2.696 ( 1.017 0.328 -1.340) 1.714 2.720 ( -0.903 0.981 1.386) 1.923 2.797 ( -1.114 -1.454 4.002) 4.401 2.962 ( -3.308 -1.983 -8.165) 9.030 3.236 ( 2.087 2.114 1.228) 3.214 3.497 ( -1.893 7.808 -2.961) 8.562 3.534 ( 2.795 0.666 4.919) 5.697 3.673 ( 4.181 0.961 0.174) 4.294 5.008 ( 0.572 0.174 -7.136) 7.161 5.488 ( -1.313 -4.775 3.210) 5.902 5.588 ( 1.351 -7.714 -7.082) 10.559 5.717 ( -5.479 1.420 2.069) 6.026 5.822 ( -2.481 -3.455 0.568) 4.292 5.850 ( -6.554 -0.946 4.523) 8.019 6.088 ( -2.362 -9.754 -0.144) 10.037 6.124 ( -4.728 -16.261 -5.327) 17.752 6.664 ( -0.036 2.256 -11.375) 11.597 6.730 ( -0.156 -3.454 1.039) 3.610 6.819 ( 3.606 2.831 -0.456) 4.607 6.992 ( -1.342 -9.463 -2.057) 9.776 7.330 ( -5.384 -0.510 1.621) 5.646 7.701 ( 1.901 -1.638 9.277) 9.610 7.876 ( -0.134 3.227 10.660) 11.139 8.490 ( -3.996 2.139 -5.089) 6.815 8.729 ( 9.347 1.742 2.320) 9.787 9.727 ( -1.233 4.292 1.864) 4.839 ======================= Grid point 29 (21/199) ======================= q-point: ( 0.33 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.838 ( 5.017 -7.105 5.114) 10.090 1.007 ( 8.383 -8.238 2.524) 12.021 1.109 ( 9.272 -5.595 0.554) 10.844 1.343 ( -0.402 -6.257 0.549) 6.294 1.702 ( -1.155 -4.635 -0.917) 4.864 1.745 ( 0.303 -4.833 2.834) 5.611 1.778 ( -4.022 -2.123 -0.520) 4.577 1.841 ( -0.022 -4.345 0.011) 4.345 1.903 ( 6.788 -9.561 0.401) 11.732 2.003 ( -5.878 -1.813 -5.490) 8.245 2.252 ( -6.030 -4.281 -0.819) 7.440 2.310 ( 1.637 -0.455 -1.949) 2.585 2.356 ( 1.106 -1.967 3.366) 4.052 2.413 ( -0.816 -0.822 -4.353) 4.504 2.524 ( 2.036 -9.655 0.150) 9.869 2.654 ( 0.478 -0.269 1.305) 1.416 2.717 ( 0.673 -0.641 1.552) 1.809 2.742 ( 1.559 -3.736 -0.294) 4.059 2.844 ( -2.449 -5.999 2.572) 6.971 2.995 ( -2.599 -3.432 -3.476) 5.533 3.221 ( 0.915 -1.026 -1.399) 1.961 3.363 ( -1.355 4.329 -1.273) 4.712 3.548 ( 3.149 0.281 3.326) 4.589 3.670 ( 2.798 1.421 -0.777) 3.233 5.051 ( -0.040 -4.073 -3.746) 5.534 5.536 ( 0.525 -1.852 2.501) 3.156 5.634 ( -5.564 2.866 3.460) 7.152 5.719 ( -1.485 -2.494 -3.329) 4.417 5.857 ( -3.440 -2.621 -0.911) 4.419 5.944 ( -2.775 -10.461 1.631) 10.945 6.318 ( -0.827 -13.538 0.191) 13.564 6.405 ( -0.789 -13.880 -0.125) 13.903 6.626 ( -5.186 -1.197 -8.810) 10.293 6.760 ( 4.175 4.467 -0.711) 6.156 6.833 ( 0.525 -5.928 0.632) 5.984 7.184 ( -1.661 -10.790 0.326) 10.922 7.317 ( -5.959 -1.632 0.252) 6.183 7.741 ( -0.776 -1.600 7.303) 7.516 7.819 ( 1.824 3.152 4.104) 5.487 8.408 ( -4.936 2.846 -6.453) 8.608 8.740 ( 9.057 2.838 2.577) 9.835 9.647 ( -0.847 3.222 0.854) 3.439 ======================= Grid point 30 (22/199) ======================= q-point: ( 0.42 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.904 ( 1.126 1.684 1.596) 2.579 1.184 ( 5.053 -6.557 1.599) 8.431 1.333 ( 7.633 -8.786 2.933) 12.002 1.499 ( -1.899 -10.166 1.493) 10.449 1.736 ( -4.830 -1.974 -0.370) 5.230 1.789 ( -2.176 -2.758 -0.528) 3.553 1.839 ( -3.505 -4.162 -0.567) 5.471 1.934 ( 0.453 -3.764 1.594) 4.113 2.012 ( -5.523 -3.340 -7.044) 9.554 2.023 ( 0.742 -1.935 0.052) 2.074 2.264 ( -5.633 -1.669 -1.697) 6.115 2.328 ( 0.285 -0.261 -0.389) 0.548 2.387 ( 2.089 -0.077 -0.133) 2.095 2.452 ( -0.625 -2.872 0.073) 2.940 2.607 ( 1.147 1.444 -0.637) 1.951 2.713 ( 0.698 1.430 1.801) 2.404 2.734 ( 0.649 -3.851 2.052) 4.412 2.822 ( 1.264 -3.029 -0.199) 3.288 2.988 ( 1.990 -6.332 1.536) 6.813 3.054 ( 1.067 -2.445 0.038) 2.668 3.271 ( 1.116 -1.125 -0.498) 1.661 3.407 ( 1.680 -11.766 -2.107) 12.071 3.570 ( 0.995 -1.941 2.010) 2.966 3.652 ( 1.222 1.505 -1.360) 2.368 5.151 ( -0.399 -5.866 -2.539) 6.405 5.521 ( -5.970 2.825 4.501) 7.992 5.605 ( 1.247 -2.393 0.787) 2.811 5.727 ( -0.696 -0.190 -0.585) 0.929 5.880 ( -2.807 -1.770 -1.426) 3.611 6.109 ( 0.181 -5.015 -1.887) 5.361 6.507 ( 0.203 -3.956 -0.564) 4.001 6.631 ( 2.296 -0.629 4.902) 5.449 6.703 ( -1.650 -12.137 -1.018) 12.290 6.753 ( -2.788 -9.429 -8.098) 12.738 6.978 ( 0.765 -8.169 1.710) 8.381 7.315 ( -5.818 -2.221 0.441) 6.243 7.393 ( -0.445 -9.970 1.335) 10.068 7.748 ( -0.818 1.083 7.121) 7.249 7.802 ( 0.511 -1.461 -0.946) 1.814 8.325 ( -5.551 1.759 -7.013) 9.115 8.731 ( 7.750 3.292 3.041) 8.953 9.590 ( -0.697 2.088 0.328) 2.225 ======================= Grid point 31 (23/199) ======================= q-point: ( 0.50 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.840 ( -0.051 4.115 0.201) 4.120 1.321 ( 2.336 -4.849 2.008) 5.745 1.506 ( 3.583 -4.943 1.147) 6.212 1.691 ( -2.892 -9.336 0.568) 9.790 1.763 ( -3.096 -3.011 1.345) 4.523 1.807 ( -2.221 -1.362 0.720) 2.703 1.904 ( -2.084 -4.419 -1.511) 5.114 1.998 ( -0.135 -2.337 2.273) 3.263 2.030 ( -0.288 0.169 -0.346) 0.481 2.066 ( -4.054 -5.264 -7.342) 9.902 2.274 ( -3.606 -2.204 -1.503) 4.485 2.330 ( 0.257 0.126 -1.761) 1.785 2.384 ( -0.222 1.119 1.421) 1.822 2.490 ( -0.380 -1.476 0.892) 1.766 2.579 ( 1.943 2.023 0.006) 2.805 2.689 ( 1.038 1.374 1.042) 2.012 2.770 ( -0.220 -0.262 0.360) 0.496 2.833 ( -0.389 1.018 -0.214) 1.111 3.014 ( 0.960 5.242 0.320) 5.339 3.120 ( 4.306 -3.677 2.483) 6.183 3.368 ( 1.711 -5.448 0.554) 5.738 3.538 ( 0.145 -0.826 -0.966) 1.280 3.637 ( 1.004 -0.086 -0.983) 1.408 3.783 ( 0.512 -16.051 -0.337) 16.063 5.263 ( -1.020 -5.768 -1.521) 6.052 5.434 ( -4.987 2.166 3.113) 6.265 5.665 ( 2.240 -1.383 -0.247) 2.644 5.733 ( 0.069 -1.146 0.225) 1.169 5.903 ( -2.254 -2.427 -0.566) 3.359 6.148 ( 1.234 0.050 -2.556) 2.838 6.486 ( 1.870 6.381 2.011) 6.947 6.642 ( -1.962 -3.998 -1.592) 4.729 6.945 ( 1.173 -8.187 -1.953) 8.498 6.968 ( -1.339 -11.751 -0.104) 11.827 7.163 ( -1.465 -10.009 1.556) 10.234 7.330 ( -3.815 -3.106 0.039) 4.920 7.553 ( 2.813 -4.406 3.906) 6.526 7.735 ( -1.249 -1.326 1.629) 2.444 7.863 ( -0.737 -4.188 -0.725) 4.313 8.270 ( -5.701 0.045 -6.361) 8.542 8.708 ( 5.808 3.357 3.323) 7.486 9.555 ( -0.371 1.154 -0.027) 1.213 ======================= Grid point 32 (24/199) ======================= q-point: ( 0.58 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.772 ( -0.091 2.201 -0.003) 2.203 1.396 ( 0.261 -1.435 0.701) 1.618 1.577 ( 0.713 -1.677 0.037) 1.822 1.791 ( -0.935 -2.587 0.330) 2.770 1.811 ( -1.246 -3.843 0.505) 4.071 1.857 ( -2.050 -3.886 1.489) 4.639 2.001 ( 0.233 -3.327 -1.931) 3.854 2.021 ( 0.011 -2.838 4.058) 4.952 2.036 ( 0.157 -0.882 -2.619) 2.768 2.162 ( -1.677 -5.580 -3.415) 6.754 2.295 ( -1.401 -0.693 -3.383) 3.727 2.308 ( -0.673 1.524 1.684) 2.369 2.366 ( -1.810 -0.589 0.924) 2.116 2.513 ( -0.193 -0.765 -0.102) 0.795 2.564 ( 2.354 0.158 0.566) 2.426 2.671 ( 0.706 1.301 0.602) 1.598 2.733 ( -1.606 3.364 -0.666) 3.787 2.825 ( 0.942 -0.271 1.314) 1.639 2.892 ( 0.575 6.609 -1.072) 6.720 3.192 ( 5.568 -0.074 3.323) 6.485 3.419 ( -3.905 -0.445 -0.898) 4.031 3.539 ( -1.368 -0.100 -1.890) 2.335 3.688 ( 3.403 -3.073 0.672) 4.634 4.048 ( -0.143 -9.584 -0.208) 9.588 5.361 ( -1.491 -5.076 -0.238) 5.295 5.395 ( -2.543 -0.671 1.114) 2.856 5.660 ( 2.332 2.721 -0.529) 3.622 5.775 ( 0.243 -1.860 -0.005) 1.876 5.947 ( -1.754 -3.019 0.705) 3.561 6.164 ( 1.561 -1.526 -2.829) 3.574 6.350 ( 0.632 7.592 2.047) 7.889 6.708 ( -1.780 -3.244 -1.413) 3.961 7.062 ( -0.272 -2.182 -0.090) 2.200 7.116 ( 0.670 -5.225 0.209) 5.272 7.318 ( -2.617 -6.624 0.479) 7.138 7.420 ( 0.266 -6.047 0.368) 6.064 7.598 ( 4.431 1.128 4.054) 6.111 7.788 ( -1.844 -3.738 -1.213) 4.341 7.938 ( -0.365 -3.337 -0.753) 3.440 8.247 ( -5.339 -1.219 -4.744) 7.245 8.672 ( 3.758 3.323 3.175) 5.937 9.539 ( -0.066 0.418 -0.219) 0.476 ======================= Grid point 33 (25/199) ======================= q-point: (-0.33 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.761 ( 0.448 -0.965 0.001) 1.064 1.380 ( -1.297 2.220 -0.231) 2.582 1.594 ( 0.369 0.689 0.001) 0.781 1.830 ( -0.086 -1.260 0.737) 1.462 1.871 ( -0.529 -2.735 -0.469) 2.825 1.940 ( 1.470 -4.353 -0.083) 4.595 1.982 ( 0.406 1.488 0.694) 1.692 2.041 ( 0.053 0.170 -0.627) 0.652 2.162 ( 0.608 -6.613 0.096) 6.642 2.199 ( 2.347 1.834 -0.572) 3.033 2.286 ( -2.272 1.441 2.726) 3.830 2.312 ( -0.549 -3.851 -0.674) 3.948 2.381 ( -2.109 -1.706 -2.035) 3.391 2.517 ( 0.143 -0.140 -0.346) 0.400 2.583 ( 2.282 3.569 1.685) 4.559 2.637 ( -0.508 -0.108 -0.755) 0.916 2.670 ( -1.568 0.036 -0.267) 1.591 2.787 ( -0.254 3.362 -1.600) 3.732 2.847 ( 0.739 -1.288 1.363) 2.016 3.187 ( 4.164 3.530 1.479) 5.656 3.376 ( -5.140 1.461 -0.399) 5.359 3.528 ( -1.334 0.263 -1.558) 2.068 3.753 ( 3.119 -0.857 0.698) 3.309 4.139 ( -0.535 0.438 0.040) 0.692 5.429 ( 0.183 -3.389 -0.920) 3.516 5.448 ( -1.385 -4.481 1.165) 4.832 5.598 ( 1.413 4.630 -0.210) 4.845 5.782 ( -0.195 1.242 -0.195) 1.272 5.995 ( -0.886 -2.544 0.694) 2.782 6.192 ( 1.669 5.027 -1.155) 5.422 6.247 ( -0.601 -2.497 0.706) 2.663 6.742 ( -1.026 -1.253 -0.706) 1.767 7.041 ( -1.386 2.456 0.670) 2.899 7.220 ( 2.526 -3.551 0.018) 4.358 7.380 ( -1.900 -0.466 -0.150) 1.962 7.515 ( 1.172 -2.658 0.450) 2.939 7.600 ( 4.137 1.091 2.111) 4.770 7.826 ( -1.280 -0.884 -1.227) 1.982 7.973 ( -0.117 -0.100 -0.568) 0.588 8.247 ( -4.364 -1.925 -2.907) 5.586 8.626 ( 2.013 3.208 2.533) 4.556 9.536 ( 0.082 -0.177 -0.246) 0.314 ======================= Grid point 34 (26/199) ======================= q-point: (-0.25 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.805 ( 0.445 -2.764 -0.005) 2.800 1.307 ( -1.083 4.400 -0.131) 4.533 1.538 ( -0.064 5.501 -0.488) 5.523 1.845 ( 0.393 -0.521 0.130) 0.665 1.908 ( 0.374 -0.689 -0.320) 0.847 1.927 ( -0.716 1.507 -0.417) 1.720 2.026 ( -0.017 1.351 0.308) 1.385 2.031 ( 1.707 1.224 0.320) 2.125 2.151 ( 4.084 2.508 0.386) 4.808 2.230 ( -2.945 0.647 -0.078) 3.017 2.316 ( -0.144 -5.981 -0.052) 5.982 2.352 ( 1.477 1.390 3.766) 4.278 2.416 ( -1.658 -3.195 -3.005) 4.689 2.471 ( 0.742 5.899 0.590) 5.975 2.520 ( -0.150 -0.175 -0.017) 0.231 2.641 ( 0.297 -0.085 -0.114) 0.329 2.710 ( -1.123 -2.563 -1.756) 3.304 2.800 ( -0.206 -5.403 -0.023) 5.406 2.882 ( 0.134 -1.842 1.006) 2.103 3.123 ( 1.720 4.084 -0.088) 4.433 3.288 ( -3.134 5.548 -0.112) 6.373 3.516 ( -0.662 0.178 -0.507) 0.852 3.752 ( 1.576 2.377 0.414) 2.882 4.020 ( -0.560 11.135 0.088) 11.150 5.471 ( 0.819 5.216 0.386) 5.294 5.518 ( 1.391 -4.093 -2.302) 4.898 5.549 ( -1.220 -3.582 1.836) 4.206 5.732 ( -0.467 3.179 -0.219) 3.220 6.027 ( 0.267 -0.051 0.035) 0.274 6.094 ( -0.298 2.846 0.818) 2.976 6.339 ( 0.115 -5.336 -0.565) 5.367 6.743 ( -0.175 1.089 -0.114) 1.109 6.971 ( -0.657 3.746 0.395) 3.824 7.250 ( 2.945 3.209 0.784) 4.425 7.302 ( -2.786 6.649 -0.974) 7.274 7.555 ( 1.827 -1.097 0.519) 2.193 7.612 ( 2.659 0.032 0.592) 2.724 7.807 ( -0.635 2.010 -0.850) 2.273 7.934 ( -0.448 3.888 -0.268) 3.923 8.270 ( -2.542 -2.715 -1.347) 3.956 8.575 ( 0.766 2.717 1.448) 3.173 9.546 ( 0.071 -0.714 -0.155) 0.734 ======================= Grid point 35 (27/199) ======================= q-point: (-0.17 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.864 ( 0.000 -2.918 0.000) 2.918 1.194 ( -0.000 6.764 -0.000) 6.764 1.370 ( -0.000 11.107 -0.000) 11.107 1.853 ( -0.000 8.723 -0.000) 8.723 1.862 ( 0.000 -0.760 0.000) 0.760 1.910 ( 0.000 -0.232 0.000) 0.232 1.953 ( -0.000 3.569 -0.000) 3.569 1.976 ( -0.000 3.968 -0.000) 3.968 2.109 ( -0.000 3.747 -0.000) 3.747 2.235 ( 0.000 -0.858 0.000) 0.858 2.314 ( 0.000 3.029 0.000) 3.029 2.314 ( 0.000 4.018 0.000) 4.018 2.446 ( -0.000 0.018 -0.000) 0.018 2.477 ( 0.000 -5.359 0.000) 5.359 2.533 ( 0.000 -1.264 0.000) 1.264 2.661 ( 0.000 -1.692 0.000) 1.692 2.731 ( -0.000 1.008 -0.000) 1.008 2.918 ( 0.000 -1.570 0.000) 1.570 2.930 ( 0.000 -5.946 0.000) 5.946 3.095 ( 0.000 -2.222 0.000) 2.222 3.099 ( -0.000 12.678 -0.000) 12.678 3.510 ( -0.000 0.353 -0.000) 0.353 3.691 ( -0.000 3.795 -0.000) 3.795 3.723 ( -0.000 17.417 -0.000) 17.417 5.333 ( -0.000 7.815 -0.000) 7.815 5.588 ( 0.000 -1.371 0.000) 1.371 5.642 ( 0.000 -4.892 0.000) 4.892 5.677 ( -0.000 0.823 -0.000) 0.823 5.993 ( -0.000 1.952 -0.000) 1.952 6.093 ( 0.000 -1.117 0.000) 1.117 6.448 ( 0.000 -5.702 0.000) 5.702 6.672 ( -0.000 6.785 -0.000) 6.785 6.894 ( -0.000 3.707 -0.000) 3.707 7.064 ( -0.000 14.572 -0.000) 14.572 7.170 ( -0.000 6.285 -0.000) 6.285 7.574 ( -0.000 0.687 -0.000) 0.687 7.618 ( -0.000 0.804 -0.000) 0.804 7.751 ( -0.000 2.732 -0.000) 2.732 7.825 ( -0.000 6.142 -0.000) 6.142 8.325 ( 0.000 -3.707 0.000) 3.707 8.535 ( -0.000 1.538 -0.000) 1.538 9.565 ( 0.000 -1.242 0.000) 1.242 ======================= Grid point 40 (28/199) ======================= q-point: ( 0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.734 ( 12.461 -0.000 3.647) 12.984 0.736 ( 18.205 -0.000 5.508) 19.020 1.099 ( 5.342 -0.000 -5.461) 7.640 1.166 ( 7.438 -0.000 3.304) 8.139 1.378 ( 23.157 -0.000 5.885) 23.894 1.539 ( 7.725 -0.000 5.417) 9.435 1.688 ( 5.995 -0.000 -3.931) 7.169 1.735 ( -3.107 0.000 -2.766) 4.160 1.773 ( -4.491 0.000 1.213) 4.652 1.971 ( -6.291 0.000 -5.329) 8.245 2.173 ( -2.038 0.000 0.206) 2.048 2.205 ( -7.541 0.000 1.415) 7.673 2.323 ( -0.033 0.000 -0.868) 0.869 2.405 ( -0.432 0.000 -3.551) 3.578 2.420 ( -8.818 0.000 -0.995) 8.874 2.433 ( -1.374 0.000 3.328) 3.601 2.707 ( 0.616 -0.000 -1.775) 1.879 2.728 ( -1.013 0.000 -0.041) 1.014 2.780 ( 0.538 -0.000 5.688) 5.713 2.918 ( -3.023 0.000 -8.990) 9.485 3.268 ( 0.184 -0.000 0.771) 0.793 3.551 ( -10.037 0.000 -1.763) 10.191 3.566 ( 3.321 -0.000 2.467) 4.137 3.717 ( 4.561 -0.000 1.270) 4.734 5.029 ( -2.750 0.000 -10.126) 10.493 5.348 ( 2.798 -0.000 -0.324) 2.816 5.579 ( 3.484 -0.000 -3.210) 4.738 5.691 ( -1.263 0.000 -0.634) 1.413 5.778 ( -6.705 0.000 -1.813) 6.945 5.839 ( 0.197 -0.000 1.063) 1.081 5.852 ( -6.601 0.000 2.127) 6.935 5.989 ( -1.215 0.000 0.040) 1.215 6.686 ( -0.676 0.000 -0.314) 0.745 6.711 ( 0.425 -0.000 -8.925) 8.935 6.857 ( 0.860 -0.000 0.129) 0.870 6.894 ( 3.825 -0.000 0.127) 3.827 7.297 ( -4.823 0.000 1.693) 5.111 7.703 ( 2.145 -0.000 10.447) 10.665 7.911 ( -0.498 0.000 8.803) 8.817 8.487 ( -3.939 0.000 -4.747) 6.169 8.805 ( 9.367 -0.000 1.975) 9.573 9.760 ( -4.043 0.000 2.002) 4.512 ======================= Grid point 41 (29/199) ======================= q-point: ( 0.33 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.797 ( 11.612 -1.690 4.288) 12.493 0.924 ( 12.535 -6.222 4.067) 14.573 1.110 ( 10.269 -0.303 -0.491) 10.285 1.246 ( 0.435 -4.083 -0.580) 4.147 1.624 ( 3.555 -3.103 2.531) 5.355 1.671 ( 8.900 -6.111 4.542) 11.713 1.731 ( -4.919 -1.060 -2.242) 5.509 1.754 ( 6.525 -5.728 0.122) 8.684 1.766 ( 4.033 -4.316 -0.851) 5.968 1.942 ( -4.914 -0.931 -5.090) 7.136 2.133 ( -7.373 -2.260 -1.372) 7.833 2.277 ( -0.447 -6.160 1.909) 6.464 2.319 ( 0.082 -0.019 -0.096) 0.127 2.380 ( -3.178 -2.215 0.542) 3.912 2.414 ( 0.168 -1.191 -4.090) 4.263 2.516 ( -4.485 -8.122 1.430) 9.388 2.708 ( 1.028 0.308 -0.260) 1.104 2.718 ( 0.556 -0.195 0.510) 0.780 2.797 ( 0.495 -0.621 4.439) 4.510 2.918 ( -2.662 -2.124 -6.726) 7.539 3.240 ( -2.055 1.846 -0.905) 2.907 3.431 ( -6.696 4.237 -2.681) 8.366 3.584 ( 3.785 0.690 3.674) 5.320 3.723 ( 3.885 1.751 0.271) 4.270 5.002 ( -0.758 -0.610 -5.047) 5.140 5.478 ( -0.224 -6.585 1.479) 6.753 5.610 ( 2.594 -4.062 -6.154) 7.817 5.654 ( -5.207 2.412 1.215) 5.865 5.784 ( -4.381 -2.670 5.536) 7.548 5.794 ( -2.875 -2.178 0.465) 3.637 6.041 ( -3.943 -13.406 -2.844) 14.260 6.092 ( -1.151 -11.857 -1.373) 11.991 6.656 ( -0.175 3.685 -6.275) 7.279 6.729 ( -0.033 -4.340 0.381) 4.356 6.867 ( 4.107 2.550 -0.568) 4.868 6.981 ( -0.561 -7.968 0.492) 8.002 7.269 ( -4.850 -0.093 0.852) 4.925 7.723 ( 0.653 -0.489 8.555) 8.594 7.889 ( 1.188 2.342 5.158) 5.788 8.434 ( -4.263 2.555 -5.511) 7.421 8.843 ( 8.797 1.811 1.872) 9.174 9.702 ( -2.839 2.938 1.207) 4.260 ======================= Grid point 42 (30/199) ======================= q-point: ( 0.42 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.909 ( 5.595 -2.501 3.519) 7.067 1.105 ( 7.684 -5.493 1.525) 9.568 1.240 ( 11.484 -5.545 2.044) 12.915 1.345 ( 0.704 -5.762 0.644) 5.841 1.661 ( -5.314 -1.575 -1.003) 5.632 1.722 ( -3.355 -2.474 -0.275) 4.178 1.737 ( -2.553 -3.372 0.011) 4.229 1.862 ( 1.333 -4.212 2.074) 4.881 1.914 ( -3.550 -3.443 -7.772) 9.212 1.977 ( 1.560 -3.011 1.739) 3.811 2.186 ( -4.041 -3.667 0.042) 5.457 2.326 ( 1.219 -0.534 -0.610) 1.464 2.364 ( 0.030 -3.560 2.837) 4.552 2.409 ( 0.253 -0.616 -3.459) 3.522 2.552 ( 2.437 -8.831 -0.798) 9.196 2.652 ( -1.240 -4.785 1.142) 5.073 2.726 ( 0.763 -1.189 0.262) 1.437 2.771 ( 3.286 -4.298 -0.549) 5.438 2.833 ( 0.272 -5.510 4.056) 6.847 2.966 ( -1.574 -4.468 -1.760) 5.054 3.216 ( -1.684 -2.480 -2.798) 4.100 3.335 ( -2.704 2.420 -1.110) 3.794 3.587 ( 2.624 1.076 2.520) 3.794 3.700 ( 2.125 2.318 -0.629) 3.208 5.048 ( -0.034 -4.166 -2.910) 5.082 5.532 ( -1.979 0.534 1.412) 2.489 5.584 ( -2.236 0.417 2.743) 3.564 5.699 ( -1.456 -2.040 -1.611) 2.980 5.820 ( -2.381 -2.845 -1.530) 4.013 5.921 ( -1.406 -11.308 1.526) 11.497 6.302 ( -1.564 -15.481 0.300) 15.563 6.384 ( -2.088 -16.707 -1.707) 16.924 6.579 ( -1.912 2.574 -4.524) 5.545 6.809 ( 3.559 5.441 -1.083) 6.591 6.847 ( 1.611 -6.708 1.242) 7.010 7.171 ( -0.714 -11.129 0.995) 11.196 7.247 ( -5.369 -0.999 -0.109) 5.463 7.734 ( -1.020 -0.582 6.360) 6.467 7.846 ( 1.992 3.006 2.557) 4.421 8.342 ( -4.720 3.323 -6.345) 8.578 8.843 ( 7.320 3.129 2.119) 8.238 9.632 ( -1.580 2.662 0.544) 3.143 ======================= Grid point 43 (31/199) ======================= q-point: ( 0.50 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.922 ( 1.516 3.216 0.922) 3.673 1.242 ( 4.047 -4.744 2.109) 6.583 1.425 ( 6.918 -6.104 1.628) 9.369 1.492 ( 0.676 -8.766 1.130) 8.864 1.670 ( -5.988 -3.476 0.027) 6.924 1.764 ( -1.717 -2.359 -0.336) 2.937 1.801 ( -2.741 -4.668 -0.577) 5.444 1.912 ( -4.159 -4.056 -2.370) 6.274 1.972 ( -0.082 -2.843 -1.621) 3.274 2.025 ( -0.318 -1.110 -0.292) 1.191 2.201 ( -4.130 -2.014 -0.989) 4.700 2.334 ( 0.458 0.181 -0.869) 0.999 2.407 ( 1.218 0.320 -0.128) 1.265 2.445 ( -0.584 -2.838 0.534) 2.947 2.619 ( 0.859 0.646 -0.450) 1.165 2.717 ( 0.029 0.321 0.042) 0.325 2.746 ( 0.868 -2.147 2.121) 3.141 2.831 ( 0.438 -1.146 -0.324) 1.269 3.013 ( 1.765 -7.631 1.552) 7.985 3.068 ( 1.037 -3.181 0.164) 3.350 3.283 ( 0.866 -2.563 -0.186) 2.711 3.424 ( 1.385 -14.510 -1.552) 14.658 3.578 ( 0.257 0.248 1.043) 1.102 3.663 ( 0.706 1.969 -0.908) 2.280 5.148 ( 0.251 -5.561 -2.010) 5.918 5.457 ( -4.830 3.091 3.036) 6.489 5.622 ( 1.266 -2.891 0.746) 3.243 5.717 ( -0.833 -0.993 -0.235) 1.317 5.849 ( -1.981 -1.857 -1.109) 2.933 6.110 ( 0.171 -6.007 -1.164) 6.121 6.508 ( 0.126 -2.593 -0.558) 2.655 6.649 ( -0.640 -7.824 2.331) 8.189 6.684 ( -0.402 -11.199 1.646) 11.327 6.727 ( -0.689 -5.128 -6.649) 8.424 6.999 ( 2.167 -7.196 1.736) 7.713 7.247 ( -5.118 -2.364 -0.391) 5.651 7.396 ( 0.441 -11.126 1.409) 11.223 7.742 ( -0.827 -0.140 5.229) 5.295 7.810 ( 0.909 0.665 -0.267) 1.157 8.255 ( -4.756 2.059 -6.016) 7.941 8.814 ( 5.239 3.717 2.294) 6.821 9.581 ( -0.756 1.775 0.104) 1.932 ======================= Grid point 44 (32/199) ======================= q-point: ( 0.58 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.840 ( 0.069 4.554 0.099) 4.556 1.345 ( 1.302 -3.916 1.473) 4.382 1.540 ( 1.880 -2.818 -0.003) 3.387 1.667 ( -1.067 -7.827 -0.065) 7.900 1.727 ( -2.613 -4.671 1.422) 5.538 1.794 ( -0.412 -1.924 1.284) 2.349 1.884 ( -1.036 -5.191 -1.491) 5.499 1.992 ( -1.246 -4.207 2.194) 4.906 2.023 ( -0.637 -0.273 -1.388) 1.551 2.027 ( -1.338 -4.131 -3.728) 5.723 2.237 ( -2.102 -3.065 -1.013) 3.852 2.334 ( 0.551 -0.062 -1.432) 1.535 2.379 ( -0.712 2.484 1.274) 2.881 2.487 ( -0.232 -1.705 0.413) 1.769 2.598 ( 1.138 1.638 0.047) 1.995 2.700 ( 0.587 1.201 0.395) 1.394 2.767 ( -0.232 0.554 -0.128) 0.614 2.832 ( 0.023 0.482 0.077) 0.488 3.023 ( 0.455 5.509 0.320) 5.537 3.170 ( 3.297 -5.566 1.687) 6.686 3.374 ( -0.458 -3.100 0.147) 3.137 3.541 ( 0.376 0.614 -0.807) 1.082 3.649 ( 0.902 -1.198 -0.382) 1.548 3.787 ( 0.153 -16.161 -0.246) 16.163 5.256 ( -0.006 -5.173 -1.109) 5.291 5.383 ( -3.394 1.477 1.939) 4.178 5.691 ( 2.060 -2.000 -0.053) 2.872 5.729 ( -0.756 -1.235 0.059) 1.449 5.881 ( -1.306 -2.571 -0.258) 2.896 6.158 ( 0.631 -0.204 -1.414) 1.562 6.513 ( 2.175 7.101 1.541) 7.585 6.613 ( -2.292 -3.990 -1.465) 4.829 6.950 ( -0.213 -10.531 -0.231) 10.535 6.960 ( 0.135 -10.882 -0.988) 10.928 7.152 ( -0.550 -7.588 1.496) 7.754 7.293 ( -2.163 -5.365 -0.342) 5.795 7.594 ( 2.823 -6.994 2.967) 8.104 7.722 ( -1.004 0.756 1.056) 1.642 7.854 ( -0.479 -4.168 -0.712) 4.255 8.204 ( -4.018 0.173 -4.284) 5.876 8.765 ( 3.124 3.780 2.036) 5.310 9.551 ( -0.238 0.969 -0.111) 1.004 ======================= Grid point 45 (33/199) ======================= q-point: ( 0.67 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.772 ( 0.021 2.031 -0.001) 2.031 1.397 ( -0.073 -0.464 0.196) 0.509 1.583 ( 0.204 -1.551 0.055) 1.565 1.787 ( 0.126 -4.966 -0.101) 4.969 1.798 ( -0.790 -3.298 0.275) 3.403 1.842 ( -0.613 -3.519 0.781) 3.657 2.008 ( 1.024 -5.217 -2.587) 5.912 2.019 ( -0.802 -1.815 4.080) 4.537 2.034 ( -0.107 -1.001 -1.728) 2.000 2.147 ( -0.528 -7.006 -1.139) 7.117 2.279 ( -0.680 -1.685 -1.274) 2.219 2.304 ( -0.207 3.229 0.555) 3.282 2.352 ( -0.672 -0.554 0.361) 0.942 2.511 ( -0.071 -0.791 -0.054) 0.796 2.585 ( 0.931 -0.258 0.218) 0.991 2.677 ( 0.238 1.560 0.237) 1.596 2.717 ( -0.675 3.839 -0.365) 3.915 2.833 ( 0.325 -0.513 0.416) 0.736 2.896 ( 0.198 6.784 -0.299) 6.794 3.268 ( 6.253 -0.598 2.948) 6.939 3.353 ( -6.071 1.251 -2.141) 6.558 3.532 ( -0.103 0.573 -0.608) 0.842 3.718 ( 1.356 -3.821 0.234) 4.062 4.046 ( -0.127 -9.323 -0.070) 9.324 5.351 ( -0.265 -4.669 -0.112) 4.678 5.371 ( -1.200 -1.718 0.422) 2.138 5.681 ( 0.957 2.837 -0.181) 2.999 5.776 ( -0.007 -1.995 -0.044) 1.995 5.932 ( -0.664 -3.083 0.306) 3.169 6.176 ( 0.562 -1.916 -1.059) 2.261 6.357 ( 0.336 8.330 0.801) 8.375 6.690 ( -0.825 -3.495 -0.593) 3.640 7.055 ( -0.436 -1.038 0.152) 1.136 7.128 ( 0.717 -6.557 -0.085) 6.596 7.296 ( -0.986 -6.750 0.200) 6.824 7.422 ( 0.059 -6.784 0.150) 6.786 7.653 ( 3.212 1.834 2.819) 4.651 7.762 ( -1.794 -4.597 -1.517) 5.163 7.934 ( -0.132 -3.524 -0.386) 3.547 8.194 ( -2.364 -1.168 -1.935) 3.271 8.706 ( 1.334 3.657 1.237) 4.084 9.538 ( -0.014 0.329 -0.118) 0.350 ======================= Grid point 46 (34/199) ======================= q-point: (-0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.764 ( 0.000 -1.125 0.000) 1.125 1.372 ( -0.000 2.505 -0.000) 2.505 1.596 ( -0.000 0.756 -0.000) 0.756 1.829 ( 0.000 -1.082 0.000) 1.082 1.868 ( 0.000 -2.832 0.000) 2.832 1.951 ( 0.000 -5.174 0.000) 5.174 1.986 ( -0.000 1.116 -0.000) 1.116 2.040 ( -0.000 0.132 -0.000) 0.132 2.166 ( 0.000 -6.993 0.000) 6.993 2.217 ( -0.000 1.064 -0.000) 1.064 2.270 ( -0.000 2.581 -0.000) 2.581 2.308 ( 0.000 -5.540 0.000) 5.540 2.366 ( 0.000 -0.801 0.000) 0.801 2.518 ( 0.000 -0.164 0.000) 0.164 2.602 ( -0.000 6.164 -0.000) 6.164 2.632 ( 0.000 -3.804 0.000) 3.804 2.658 ( -0.000 1.419 -0.000) 1.419 2.785 ( -0.000 3.595 -0.000) 3.595 2.853 ( 0.000 -1.260 0.000) 1.260 3.224 ( -0.000 5.157 -0.000) 5.157 3.334 ( -0.000 0.325 -0.000) 0.325 3.520 ( -0.000 0.438 -0.000) 0.438 3.773 ( 0.000 -0.897 0.000) 0.897 4.136 ( -0.000 0.532 -0.000) 0.532 5.431 ( 0.000 -4.260 0.000) 4.260 5.439 ( 0.000 -4.315 0.000) 4.315 5.607 ( -0.000 4.855 -0.000) 4.855 5.780 ( -0.000 1.430 -0.000) 1.430 5.989 ( 0.000 -2.771 0.000) 2.771 6.203 ( -0.000 7.112 -0.000) 7.112 6.242 ( 0.000 -4.350 0.000) 4.350 6.735 ( 0.000 -1.448 0.000) 1.448 7.033 ( -0.000 2.461 -0.000) 2.461 7.237 ( 0.000 -3.921 0.000) 3.921 7.367 ( 0.000 -0.184 0.000) 0.184 7.522 ( 0.000 -3.102 0.000) 3.102 7.631 ( -0.000 1.114 -0.000) 1.114 7.815 ( 0.000 -1.108 0.000) 1.108 7.972 ( 0.000 -0.053 0.000) 0.053 8.217 ( 0.000 -1.883 0.000) 1.883 8.640 ( -0.000 3.389 -0.000) 3.389 9.537 ( 0.000 -0.202 0.000) 0.202 ======================= Grid point 53 (35/199) ======================= q-point: ( 0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.834 ( 4.287 -0.000 1.443) 4.523 0.950 ( 16.110 -0.000 5.067) 16.888 1.201 ( 1.187 -0.000 0.394) 1.251 1.202 ( 11.496 -0.000 -1.935) 11.658 1.634 ( 6.957 -0.000 3.713) 7.886 1.655 ( 12.880 -0.000 3.720) 13.407 1.684 ( -4.968 0.000 -2.620) 5.617 1.725 ( -3.069 0.000 1.685) 3.501 1.775 ( 12.231 -0.000 -3.247) 12.654 1.907 ( -2.643 0.000 -3.690) 4.539 2.083 ( -11.460 0.000 0.425) 11.468 2.144 ( -2.667 0.000 -0.005) 2.667 2.318 ( -0.994 0.000 1.746) 2.009 2.347 ( -2.919 0.000 -1.713) 3.384 2.399 ( -0.093 0.000 -3.569) 3.571 2.418 ( -1.544 0.000 3.345) 3.684 2.716 ( -0.789 0.000 0.015) 0.789 2.720 ( 1.757 -0.000 0.101) 1.760 2.799 ( 1.681 -0.000 4.318) 4.634 2.880 ( -2.082 0.000 -6.408) 6.738 3.234 ( -7.007 0.000 -2.350) 7.391 3.424 ( -8.076 0.000 -2.697) 8.514 3.615 ( 3.441 -0.000 3.247) 4.731 3.769 ( 3.704 -0.000 0.715) 3.772 4.990 ( -2.691 0.000 -4.740) 5.451 5.382 ( 2.705 -0.000 -0.327) 2.725 5.605 ( 0.679 -0.000 -1.465) 1.614 5.675 ( -1.350 0.000 -0.368) 1.400 5.708 ( -3.675 0.000 -4.859) 6.092 5.784 ( -4.784 0.000 4.112) 6.309 5.843 ( 0.369 -0.000 0.773) 0.857 5.974 ( -1.269 0.000 0.040) 1.270 6.679 ( -0.452 0.000 -0.223) 0.504 6.703 ( -0.518 0.000 -5.102) 5.128 6.867 ( 0.612 -0.000 0.072) 0.616 6.939 ( 3.398 -0.000 0.938) 3.525 7.244 ( -4.032 0.000 0.878) 4.127 7.730 ( 1.150 -0.000 8.112) 8.193 7.921 ( 1.075 -0.000 3.870) 4.017 8.436 ( -3.652 0.000 -4.543) 5.829 8.914 ( 8.056 -0.000 1.312) 8.162 9.711 ( -4.055 0.000 1.105) 4.203 ======================= Grid point 54 (36/199) ======================= q-point: ( 0.42 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.896 ( 4.529 -3.104 2.060) 5.864 1.073 ( 11.737 -2.984 2.743) 12.417 1.244 ( 4.452 -3.106 2.495) 5.974 1.268 ( 9.336 -1.178 -1.525) 9.533 1.635 ( -5.195 1.602 -0.349) 5.447 1.664 ( -0.753 -0.976 -0.473) 1.320 1.690 ( -3.159 -0.366 -0.969) 3.325 1.784 ( 1.991 -4.556 1.076) 5.086 1.851 ( 0.333 -0.621 -5.050) 5.098 1.942 ( 3.567 -2.062 3.325) 5.295 2.064 ( -0.865 -6.152 -0.356) 6.222 2.274 ( -0.621 -8.692 0.591) 8.734 2.320 ( -0.333 -0.845 2.889) 3.028 2.349 ( -1.182 -2.927 -2.588) 4.082 2.423 ( 1.924 -3.178 -3.678) 5.228 2.473 ( -2.682 -6.431 2.314) 7.342 2.714 ( 0.133 -0.281 0.007) 0.311 2.744 ( 3.582 -1.183 1.189) 3.955 2.812 ( 1.255 -0.056 4.017) 4.208 2.889 ( -1.290 -2.254 -3.765) 4.574 3.167 ( -9.702 0.216 -4.312) 10.620 3.364 ( -3.356 1.982 -1.171) 4.070 3.626 ( 2.637 0.913 2.384) 3.670 3.764 ( 2.643 2.328 0.209) 3.529 4.986 ( -1.168 -1.701 -2.664) 3.369 5.485 ( 0.997 -6.089 0.337) 6.179 5.592 ( -4.263 2.027 1.150) 4.859 5.638 ( 2.272 -1.664 -6.401) 6.993 5.745 ( -2.753 -2.377 6.304) 7.278 5.763 ( -2.231 -3.260 0.066) 3.951 6.001 ( -2.297 -12.577 -2.061) 12.950 6.081 ( -0.631 -11.234 -0.517) 11.264 6.648 ( -0.462 3.930 -3.322) 5.167 6.729 ( 0.100 -5.052 0.058) 5.054 6.914 ( 3.633 1.729 -0.845) 4.111 6.976 ( -0.547 -6.744 1.606) 6.955 7.216 ( -3.799 0.380 0.263) 3.827 7.735 ( 0.367 0.358 6.045) 6.066 7.910 ( 1.427 1.947 2.533) 3.499 8.382 ( -3.376 2.972 -4.483) 6.350 8.938 ( 6.453 2.032 1.189) 6.869 9.667 ( -2.811 1.953 0.656) 3.485 ======================= Grid point 55 (37/199) ======================= q-point: ( 0.50 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.968 ( 3.394 -0.490 1.535) 3.757 1.193 ( 6.038 -3.336 1.689) 7.102 1.359 ( 2.046 -5.910 2.578) 6.764 1.377 ( 9.668 -3.825 -1.095) 10.455 1.581 ( -7.441 -0.854 0.184) 7.492 1.687 ( -2.207 -3.234 -0.593) 3.959 1.707 ( -1.904 -2.696 -0.370) 3.321 1.817 ( -5.387 -2.605 -3.974) 7.184 1.924 ( 2.887 -3.000 1.418) 4.398 1.980 ( -0.822 -2.689 -1.103) 3.020 2.157 ( -1.098 -1.390 0.679) 1.897 2.338 ( 0.655 -0.203 0.273) 0.738 2.366 ( 0.157 -3.921 1.353) 4.151 2.407 ( -0.276 -1.919 -1.845) 2.676 2.576 ( 1.458 -6.088 -0.840) 6.316 2.631 ( -1.747 -8.664 0.448) 8.850 2.734 ( 0.472 -1.061 -0.074) 1.163 2.807 ( 1.909 -1.648 -0.301) 2.540 2.859 ( 3.194 -6.075 2.570) 7.329 2.959 ( 0.771 -5.641 1.371) 5.857 3.172 ( -4.658 -7.416 -3.940) 9.603 3.308 ( -1.377 2.031 -0.342) 2.478 3.613 ( 1.435 1.653 1.331) 2.562 3.719 ( 1.123 3.041 -0.337) 3.259 5.046 ( -0.011 -4.610 -1.535) 4.859 5.500 ( -2.513 3.334 0.650) 4.225 5.580 ( 0.363 -2.287 1.483) 2.750 5.682 ( -1.170 -1.642 -0.454) 2.067 5.798 ( -1.081 -2.516 -1.322) 3.041 5.910 ( -0.601 -11.964 1.011) 12.022 6.284 ( -1.247 -17.092 0.045) 17.138 6.362 ( -1.170 -16.376 -1.291) 16.469 6.563 ( -0.608 3.583 -1.696) 4.011 6.838 ( 1.418 3.046 -1.379) 3.632 6.874 ( 2.217 -4.633 1.631) 5.389 7.165 ( -0.394 -11.283 0.589) 11.305 7.191 ( -3.475 -0.568 -0.176) 3.526 7.729 ( -0.456 0.081 3.588) 3.618 7.869 ( 1.319 2.974 1.644) 3.645 8.289 ( -3.025 3.814 -4.153) 6.399 8.915 ( 4.149 3.482 1.191) 5.546 9.614 ( -1.247 2.041 0.233) 2.403 ======================= Grid point 56 (38/199) ======================= q-point: ( 0.58 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.937 ( 0.683 4.383 0.275) 4.445 1.280 ( 1.653 -3.292 1.065) 3.835 1.486 ( 2.134 -4.603 1.280) 5.233 1.524 ( 4.614 -6.476 -1.255) 8.050 1.597 ( -5.746 -5.153 1.055) 7.790 1.749 ( -0.682 -2.611 -0.076) 2.700 1.776 ( -1.147 -5.481 -0.200) 5.603 1.866 ( -2.209 -5.082 -1.858) 5.844 1.977 ( 0.476 -2.039 0.373) 2.126 2.019 ( -0.428 -0.599 -0.426) 0.850 2.167 ( -1.442 -2.076 -0.360) 2.553 2.337 ( 0.181 0.246 -0.390) 0.495 2.417 ( 0.429 0.890 -0.110) 0.994 2.439 ( -0.279 -2.973 0.336) 3.005 2.626 ( 0.301 0.228 -0.163) 0.411 2.717 ( -0.022 -0.344 -0.103) 0.360 2.755 ( 0.345 -1.451 0.784) 1.685 2.834 ( 0.062 -0.443 -0.163) 0.476 3.030 ( 0.745 -8.756 0.716) 8.817 3.077 ( 0.389 -2.244 0.043) 2.278 3.291 ( 0.358 -2.976 -0.018) 2.997 3.436 ( 0.569 -17.511 -0.606) 17.530 3.580 ( -0.005 2.083 0.328) 2.109 3.668 ( 0.168 2.243 -0.336) 2.274 5.151 ( 0.290 -5.556 -0.808) 5.622 5.416 ( -1.927 3.327 1.135) 4.009 5.635 ( 0.594 -3.121 0.328) 3.193 5.708 ( -0.457 -1.423 -0.097) 1.498 5.832 ( -0.696 -1.846 -0.417) 2.016 6.111 ( 0.067 -6.435 -0.386) 6.447 6.509 ( 0.086 -1.774 -0.234) 1.792 6.634 ( -0.961 -14.269 -0.099) 14.301 6.690 ( 0.325 -14.138 2.407) 14.345 6.720 ( -0.023 3.293 -3.194) 4.587 7.025 ( 1.440 -6.833 0.848) 7.035 7.198 ( -2.404 -2.561 -0.388) 3.534 7.401 ( 0.236 -11.800 0.544) 11.815 7.738 ( -0.335 -0.785 1.796) 1.988 7.821 ( 0.564 1.798 0.262) 1.902 8.208 ( -1.974 2.362 -2.493) 3.961 8.858 ( 1.850 4.006 0.851) 4.494 9.574 ( -0.330 1.499 0.006) 1.535 ======================= Grid point 57 (39/199) ======================= q-point: ( 0.67 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.841 ( -0.000 4.722 -0.000) 4.722 1.354 ( 0.000 -3.512 0.000) 3.512 1.551 ( 0.000 -1.841 0.000) 1.841 1.662 ( 0.000 -6.452 0.000) 6.452 1.710 ( 0.000 -6.268 0.000) 6.268 1.793 ( 0.000 -2.064 0.000) 2.064 1.877 ( 0.000 -5.586 0.000) 5.586 1.983 ( 0.000 -6.064 0.000) 6.064 2.016 ( 0.000 -0.069 0.000) 0.069 2.022 ( 0.000 -3.016 0.000) 3.016 2.224 ( 0.000 -3.315 0.000) 3.315 2.338 ( 0.000 -0.391 0.000) 0.391 2.374 ( -0.000 3.217 -0.000) 3.217 2.485 ( 0.000 -1.764 0.000) 1.764 2.605 ( -0.000 1.473 -0.000) 1.473 2.703 ( -0.000 1.138 -0.000) 1.138 2.765 ( -0.000 0.895 -0.000) 0.895 2.832 ( -0.000 0.265 -0.000) 0.265 3.025 ( -0.000 5.614 -0.000) 5.614 3.193 ( 0.000 -6.939 0.000) 6.939 3.368 ( 0.000 -1.258 0.000) 1.258 3.543 ( -0.000 0.890 -0.000) 0.890 3.655 ( 0.000 -1.617 0.000) 1.617 3.788 ( 0.000 -16.263 0.000) 16.263 5.256 ( 0.000 -4.976 0.000) 4.976 5.362 ( -0.000 1.255 -0.000) 1.255 5.710 ( 0.000 -4.031 0.000) 4.031 5.718 ( -0.000 0.533 -0.000) 0.533 5.873 ( 0.000 -2.619 0.000) 2.619 6.161 ( 0.000 -0.296 0.000) 0.296 6.531 ( -0.000 8.903 -0.000) 8.903 6.595 ( 0.000 -5.530 0.000) 5.530 6.948 ( 0.000 -11.065 0.000) 11.065 6.961 ( 0.000 -10.994 0.000) 10.994 7.150 ( 0.000 -6.243 0.000) 6.243 7.280 ( 0.000 -6.491 0.000) 6.491 7.614 ( 0.000 -9.209 0.000) 9.209 7.715 ( -0.000 2.674 -0.000) 2.674 7.851 ( 0.000 -4.105 0.000) 4.105 8.176 ( -0.000 0.265 -0.000) 0.265 8.785 ( -0.000 3.926 -0.000) 3.926 9.550 ( -0.000 0.884 -0.000) 0.884 ======================= Grid point 67 (40/199) ======================= q-point: ( 0.42 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.863 ( 1.031 -0.000 0.170) 1.045 1.124 ( 10.907 -0.000 3.034) 11.321 1.215 ( 1.528 -0.000 0.851) 1.749 1.349 ( 12.078 -0.000 0.903) 12.112 1.603 ( -7.456 0.000 -3.381) 8.187 1.657 ( -4.981 0.000 -2.697) 5.664 1.712 ( 4.661 -0.000 2.755) 5.414 1.729 ( 2.441 -0.000 -1.048) 2.656 1.865 ( -3.615 0.000 -0.517) 3.652 1.945 ( 1.448 -0.000 3.331) 3.632 1.993 ( 3.906 -0.000 -1.402) 4.150 2.113 ( -2.267 0.000 -0.180) 2.275 2.316 ( 0.781 -0.000 2.584) 2.700 2.337 ( 1.279 -0.000 -1.873) 2.268 2.395 ( 0.020 -0.000 -3.560) 3.560 2.404 ( -1.000 0.000 3.416) 3.559 2.709 ( -0.417 0.000 0.030) 0.418 2.755 ( 4.000 -0.000 1.462) 4.259 2.823 ( 1.544 -0.000 2.789) 3.188 2.861 ( 0.174 -0.000 -1.835) 1.843 3.091 ( -14.328 0.000 -5.882) 15.488 3.367 ( -2.054 0.000 -0.673) 2.161 3.651 ( 1.967 -0.000 1.757) 2.638 3.805 ( 2.008 -0.000 0.343) 2.037 4.960 ( -1.675 0.000 -1.829) 2.480 5.410 ( 1.742 -0.000 -0.221) 1.756 5.590 ( -2.214 0.000 0.349) 2.241 5.660 ( -0.942 0.000 -0.125) 0.951 5.690 ( 0.808 -0.000 -6.817) 6.865 5.742 ( -2.835 0.000 5.249) 5.965 5.848 ( 0.343 -0.000 0.381) 0.512 5.961 ( -0.877 0.000 0.030) 0.877 6.674 ( -0.217 0.000 -0.111) 0.244 6.693 ( -0.544 0.000 -2.457) 2.517 6.872 ( 0.309 -0.000 0.028) 0.310 6.975 ( 2.300 -0.000 0.902) 2.471 7.203 ( -2.667 0.000 0.263) 2.679 7.746 ( 0.663 -0.000 4.489) 4.538 7.937 ( 0.965 -0.000 1.574) 1.846 8.396 ( -2.252 0.000 -2.885) 3.660 8.995 ( 4.842 -0.000 0.652) 4.886 9.669 ( -2.733 0.000 0.498) 2.778 ======================= Grid point 68 (41/199) ======================= q-point: ( 0.50 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.928 ( 1.125 -4.646 0.453) 4.802 1.185 ( 4.879 -1.290 0.866) 5.120 1.268 ( 2.025 -3.871 1.449) 4.603 1.405 ( 9.862 0.400 0.039) 9.871 1.538 ( -8.378 0.945 -0.323) 8.437 1.644 ( -2.876 -0.919 -1.064) 3.201 1.688 ( 2.940 1.355 -0.306) 3.252 1.756 ( -4.318 0.338 -2.378) 4.941 1.868 ( 1.322 -4.374 3.154) 5.552 1.943 ( -0.550 -0.102 -2.485) 2.547 2.098 ( 2.496 -5.260 1.887) 6.121 2.257 ( -1.514 -11.249 -0.241) 11.353 2.316 ( -0.260 -0.599 1.088) 1.269 2.348 ( 0.407 -0.257 -1.300) 1.386 2.445 ( 0.667 -5.145 -2.112) 5.602 2.460 ( 0.657 -5.629 1.914) 5.982 2.715 ( 0.035 -0.789 -0.077) 0.793 2.794 ( 2.887 -1.223 0.093) 3.136 2.833 ( 1.593 -0.374 2.333) 2.849 2.896 ( 4.246 -2.301 2.557) 5.465 3.021 ( -12.044 -2.672 -5.999) 13.718 3.342 ( -0.724 1.577 -0.235) 1.751 3.649 ( 0.950 1.069 0.826) 1.652 3.786 ( 0.927 2.619 0.077) 2.779 4.973 ( -0.532 -2.360 -0.793) 2.546 5.497 ( 0.738 -5.971 -0.111) 6.017 5.554 ( -1.794 2.370 0.482) 3.011 5.655 ( 0.988 -0.374 -3.230) 3.399 5.727 ( -0.875 -3.919 3.512) 5.335 5.742 ( -1.034 -2.746 -0.192) 2.941 5.981 ( -0.747 -11.701 -0.723) 11.748 6.075 ( -0.213 -11.206 -0.150) 11.209 6.641 ( -0.237 3.907 -1.065) 4.057 6.731 ( 0.063 -5.472 -0.016) 5.472 6.950 ( 2.274 0.860 -1.526) 2.871 6.969 ( -0.933 -5.736 1.986) 6.142 7.182 ( -1.595 0.666 -0.015) 1.728 7.742 ( 0.188 0.780 2.185) 2.328 7.924 ( 0.595 1.795 0.832) 2.066 8.350 ( -1.311 3.258 -1.776) 3.935 8.994 ( 2.431 2.249 0.410) 3.337 9.641 ( -1.206 1.397 0.203) 1.857 ======================= Grid point 69 (42/199) ======================= q-point: ( 0.58 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.990 ( 0.000 -0.117 0.000) 0.117 1.235 ( 0.000 -2.126 0.000) 2.126 1.375 ( 0.000 -6.040 0.000) 6.040 1.469 ( 0.000 -3.351 0.000) 3.351 1.501 ( 0.000 -0.747 0.000) 0.747 1.670 ( 0.000 -3.593 0.000) 3.593 1.698 ( 0.000 -1.691 0.000) 1.691 1.775 ( 0.000 -3.454 0.000) 3.454 1.948 ( 0.000 -1.041 0.000) 1.041 1.968 ( 0.000 -4.160 0.000) 4.160 2.152 ( 0.000 -0.043 0.000) 0.043 2.342 ( 0.000 -0.048 0.000) 0.048 2.368 ( 0.000 -3.546 0.000) 3.546 2.403 ( 0.000 -3.093 0.000) 3.093 2.585 ( 0.000 -4.929 0.000) 4.929 2.620 ( 0.000 -9.830 0.000) 9.830 2.737 ( 0.000 -1.057 0.000) 1.057 2.817 ( 0.000 -0.952 0.000) 0.952 2.883 ( 0.000 -4.547 0.000) 4.547 2.976 ( 0.000 -4.936 0.000) 4.936 3.130 ( 0.000 -12.128 0.000) 12.128 3.300 ( -0.000 2.132 -0.000) 2.132 3.623 ( -0.000 1.866 -0.000) 1.866 3.726 ( -0.000 3.323 -0.000) 3.323 5.045 ( 0.000 -4.869 0.000) 4.869 5.484 ( -0.000 3.782 -0.000) 3.782 5.584 ( 0.000 -2.643 0.000) 2.643 5.673 ( 0.000 -1.509 0.000) 1.509 5.791 ( 0.000 -2.303 0.000) 2.303 5.907 ( 0.000 -12.211 0.000) 12.211 6.276 ( 0.000 -17.680 0.000) 17.680 6.354 ( 0.000 -15.922 0.000) 15.922 6.559 ( -0.000 3.647 -0.000) 3.647 6.845 ( -0.000 1.516 -0.000) 1.516 6.890 ( 0.000 -3.335 0.000) 3.335 7.161 ( 0.000 -7.785 0.000) 7.785 7.171 ( 0.000 -3.895 0.000) 3.895 7.728 ( -0.000 0.333 -0.000) 0.333 7.878 ( -0.000 2.926 -0.000) 2.926 8.268 ( -0.000 4.044 -0.000) 4.044 8.942 ( -0.000 3.652 -0.000) 3.652 9.606 ( -0.000 1.770 -0.000) 1.770 ======================= Grid point 82 (43/199) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 109 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.868 ( 0.000 -0.000 0.000) 0.000 1.186 ( 0.000 -0.000 -0.000) 0.000 1.240 ( 0.000 -0.000 -0.000) 0.000 1.469 ( 0.000 -0.000 0.000) 0.000 1.512 ( -0.000 0.000 -0.000) 0.000 1.614 ( 0.000 -0.000 -0.000) 0.000 1.744 ( -0.000 0.000 -0.000) 0.000 1.766 ( 0.000 -0.000 -0.000) 0.000 1.803 ( -0.000 0.000 -0.000) 0.000 1.946 ( 0.000 -0.000 0.000) 0.000 2.036 ( 0.000 -0.000 0.000) 0.000 2.097 ( 0.000 -0.000 -0.000) 0.000 2.321 ( 0.000 -0.000 -0.000) 0.000 2.358 ( 0.000 -0.000 -0.000) 0.000 2.393 ( 0.000 -0.000 -0.000) 0.000 2.400 ( -0.000 0.000 0.000) 0.000 2.707 ( 0.000 -0.000 -0.000) 0.000 2.790 ( 0.000 -0.000 0.000) 0.000 2.835 ( 0.000 -0.000 -0.000) 0.000 2.917 ( 0.000 -0.000 0.000) 0.000 2.927 ( -0.000 0.000 -0.000) 0.000 3.355 ( 0.000 -0.000 -0.000) 0.000 3.664 ( 0.000 -0.000 -0.000) 0.000 3.817 ( 0.000 -0.000 -0.000) 0.000 4.948 ( 0.000 -0.000 -0.000) 0.000 5.421 ( 0.000 -0.000 -0.000) 0.000 5.574 ( 0.000 -0.000 -0.000) 0.000 5.654 ( 0.000 -0.000 -0.000) 0.000 5.696 ( 0.000 -0.000 -0.000) 0.000 5.726 ( -0.000 0.000 0.000) 0.000 5.851 ( 0.000 -0.000 -0.000) 0.000 5.955 ( -0.000 0.000 -0.000) 0.000 6.673 ( 0.000 -0.000 -0.000) 0.000 6.688 ( 0.000 -0.000 -0.000) 0.000 6.874 ( 0.000 -0.000 -0.000) 0.000 6.991 ( 0.000 -0.000 -0.000) 0.000 7.185 ( 0.000 -0.000 -0.000) 0.000 7.752 ( 0.000 -0.000 0.000) 0.000 7.944 ( 0.000 -0.000 0.000) 0.000 8.381 ( 0.000 -0.000 -0.000) 0.000 9.026 ( 0.000 -0.000 -0.000) 0.000 9.652 ( 0.000 -0.000 -0.000) 0.000 ======================= Grid point 151 (44/199) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.306 ( 3.750 -0.000 16.250) 16.677 0.326 ( -1.537 0.000 17.479) 17.547 0.780 ( 7.734 -0.000 41.705) 42.416 1.017 ( -4.629 0.000 -8.110) 9.338 1.172 ( 2.830 -0.000 -9.247) 9.671 1.399 ( 4.223 -0.000 5.588) 7.004 1.588 ( -3.918 0.000 4.108) 5.677 1.763 ( -1.364 0.000 -2.310) 2.682 1.857 ( 1.478 -0.000 -3.261) 3.581 2.145 ( 1.004 -0.000 -1.927) 2.173 2.183 ( -3.970 0.000 -4.666) 6.127 2.207 ( 0.227 -0.000 0.125) 0.259 2.305 ( 2.192 -0.000 0.100) 2.194 2.371 ( -0.491 0.000 -3.301) 3.337 2.508 ( 0.383 -0.000 3.306) 3.329 2.675 ( -4.114 0.000 -2.522) 4.825 2.711 ( -3.379 0.000 -4.590) 5.700 2.749 ( -0.062 0.000 -0.434) 0.438 2.800 ( 0.554 -0.000 -5.881) 5.907 2.906 ( -0.635 0.000 -3.291) 3.351 3.202 ( 7.235 -0.000 1.540) 7.397 3.413 ( -4.526 0.000 2.211) 5.037 3.534 ( 3.548 -0.000 1.844) 3.999 3.664 ( -0.898 0.000 2.521) 2.676 5.283 ( -0.116 0.000 -0.557) 0.569 5.503 ( 4.086 -0.000 2.810) 4.959 5.613 ( -45.173 0.000 -0.640) 45.177 5.708 ( -0.420 0.000 -0.771) 0.878 5.853 ( 0.597 -0.000 1.542) 1.654 5.870 ( 9.538 -0.000 -5.533) 11.027 6.012 ( 0.036 -0.000 -0.182) 0.185 6.090 ( -6.393 0.000 3.234) 7.164 6.304 ( -2.471 0.000 3.322) 4.140 6.718 ( -0.425 0.000 1.089) 1.169 6.755 ( 1.415 -0.000 -4.517) 4.733 6.820 ( 0.306 -0.000 -1.164) 1.203 7.488 ( 0.447 -0.000 1.930) 1.981 7.678 ( -1.333 0.000 1.078) 1.714 8.347 ( 24.472 -0.000 -3.043) 24.661 8.568 ( -0.065 0.000 0.622) 0.625 8.586 ( 2.619 -0.000 0.173) 2.624 9.698 ( 6.069 -0.000 0.991) 6.150 ======================= Grid point 152 (45/199) ======================= q-point: ( 0.08 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.550 ( 3.570 -14.968 9.542) 18.106 0.620 ( 5.078 -15.576 12.495) 20.604 1.004 ( -0.134 -2.462 6.030) 6.515 1.108 ( 9.727 -21.365 12.650) 26.666 1.235 ( 2.392 -5.324 -5.806) 8.233 1.515 ( 3.545 -8.603 4.558) 10.361 1.611 ( -1.565 -4.167 2.207) 4.969 1.796 ( -1.907 -3.691 -2.333) 4.764 1.874 ( 0.321 -1.275 -2.495) 2.820 2.124 ( -6.536 0.308 -2.687) 7.074 2.166 ( 2.575 0.269 -4.091) 4.841 2.237 ( 0.046 -2.497 -1.335) 2.831 2.308 ( 1.464 0.699 0.965) 1.887 2.382 ( -1.555 -1.602 -2.658) 3.471 2.527 ( -0.903 -1.459 2.706) 3.204 2.670 ( -0.080 0.038 -0.163) 0.185 2.692 ( -2.428 -1.140 -3.276) 4.234 2.769 ( -2.333 -1.486 1.227) 3.026 2.820 ( -1.149 -3.871 -12.049) 12.708 2.897 ( -0.887 -0.293 -0.716) 1.178 3.190 ( 3.787 3.117 2.505) 5.508 3.392 ( 0.601 1.634 1.048) 2.032 3.542 ( 2.572 1.044 2.008) 3.425 3.635 ( 0.833 1.527 3.558) 3.960 5.061 ( -6.759 2.457 7.657) 10.505 5.506 ( 1.057 -1.091 1.194) 1.932 5.606 ( -3.984 -6.762 0.576) 7.870 5.818 ( -2.105 -0.252 -1.766) 2.759 5.876 ( -1.344 -2.672 0.245) 3.001 6.054 ( 4.268 -6.583 -4.550) 9.070 6.122 ( -0.690 -6.469 3.959) 7.616 6.232 ( -11.261 -7.901 -2.956) 14.070 6.362 ( -1.253 -12.796 -11.743) 17.413 6.719 ( 1.238 2.105 -5.244) 5.785 6.782 ( -1.858 -4.140 1.975) 4.949 6.960 ( -0.334 -12.758 -3.347) 13.194 7.490 ( -2.862 -0.492 2.077) 3.570 7.673 ( 1.790 0.111 0.868) 1.993 8.167 ( 5.098 15.761 8.107) 18.443 8.531 ( -2.674 2.263 -0.759) 3.584 8.573 ( 5.537 2.780 0.880) 6.258 9.696 ( 3.944 2.965 0.816) 5.001 ======================= Grid point 153 (46/199) ======================= q-point: ( 0.17 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.847 ( 5.441 -11.043 3.080) 12.690 0.912 ( 0.596 -8.280 4.407) 9.399 1.037 ( 2.420 -5.926 8.481) 10.625 1.376 ( -0.988 -9.837 0.114) 9.888 1.627 ( 7.346 -16.519 -0.448) 18.084 1.707 ( -0.050 -6.757 -1.213) 6.866 1.773 ( 3.517 -12.818 5.522) 14.393 1.848 ( -3.188 -2.368 -1.435) 4.223 1.904 ( -1.583 -2.377 -0.743) 2.951 2.081 ( -5.966 -0.356 -3.845) 7.106 2.200 ( 3.337 -1.916 -2.496) 4.587 2.288 ( -0.551 -3.051 -4.593) 5.542 2.301 ( 0.391 -0.123 1.128) 1.200 2.449 ( -1.847 -6.589 -0.314) 6.851 2.561 ( -2.191 -2.794 2.455) 4.317 2.643 ( 0.765 1.340 -0.049) 1.544 2.704 ( 2.103 0.053 0.237) 2.117 2.785 ( -0.546 -0.824 2.982) 3.141 2.904 ( -1.889 -2.307 -4.774) 5.629 2.963 ( -2.612 -9.451 -5.458) 11.222 3.162 ( 2.778 0.889 1.112) 3.121 3.337 ( 0.535 4.294 -0.291) 4.337 3.542 ( 1.849 0.033 2.541) 3.143 3.620 ( 1.312 0.965 1.718) 2.367 5.068 ( -3.542 -4.491 3.009) 6.463 5.540 ( 2.343 -1.147 0.861) 2.747 5.684 ( -0.904 -1.940 -2.791) 3.517 5.799 ( -3.248 0.623 1.328) 3.564 5.919 ( -1.428 -2.199 -0.408) 2.653 6.143 ( -7.397 -0.439 5.272) 9.094 6.252 ( 6.628 -9.541 -0.950) 11.656 6.406 ( 1.193 -13.878 0.462) 13.937 6.570 ( -4.019 -8.413 -8.842) 12.850 6.673 ( -1.331 0.881 -5.028) 5.276 6.873 ( -1.688 -5.995 1.041) 6.314 7.222 ( -2.240 -13.419 -1.749) 13.717 7.479 ( -5.001 -1.133 1.773) 5.425 7.702 ( 3.245 -1.246 -0.428) 3.502 7.960 ( 1.587 7.836 6.681) 10.419 8.453 ( -5.024 2.854 -2.804) 6.423 8.559 ( 7.926 2.765 1.460) 8.521 9.653 ( 1.108 2.745 0.797) 3.065 ======================= Grid point 154 (47/199) ======================= q-point: ( 0.25 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.908 ( 0.264 2.246 -0.871) 2.423 1.092 ( 3.760 -8.802 2.506) 9.894 1.277 ( 4.928 -10.882 8.372) 14.588 1.598 ( -2.624 -12.987 1.069) 13.292 1.792 ( -3.260 -0.459 -5.847) 6.710 1.819 ( -1.471 -5.308 -0.249) 5.513 1.902 ( -0.497 -6.079 -0.069) 6.100 1.928 ( 0.777 -1.701 0.820) 2.041 1.981 ( -2.481 -4.855 -1.440) 5.639 2.070 ( -3.507 -1.599 -3.215) 5.019 2.248 ( 1.118 -1.566 -1.849) 2.668 2.311 ( 2.489 -0.710 -0.096) 2.590 2.385 ( 0.885 -4.654 -1.935) 5.118 2.482 ( -5.389 0.711 -0.422) 5.452 2.570 ( 0.253 2.271 -0.827) 2.430 2.734 ( 2.167 -2.179 0.790) 3.174 2.766 ( 1.081 -1.688 5.178) 5.553 2.806 ( -0.641 -8.741 1.210) 8.848 2.951 ( 1.144 -3.215 -1.099) 3.585 3.041 ( 0.645 0.552 1.195) 1.466 3.222 ( 1.945 1.588 -0.744) 2.619 3.326 ( 1.156 -10.651 -2.757) 11.063 3.577 ( 1.534 -2.947 2.164) 3.965 3.614 ( 0.197 0.065 -0.290) 0.357 5.168 ( -2.638 -7.032 1.262) 7.616 5.574 ( 1.842 -0.691 -1.203) 2.306 5.690 ( -0.688 0.028 -1.373) 1.536 5.744 ( -2.001 3.230 2.762) 4.697 5.936 ( -2.602 -1.016 -0.123) 2.796 6.110 ( -1.466 0.736 2.061) 2.634 6.491 ( 0.941 -9.861 0.171) 9.907 6.544 ( 2.950 4.119 -5.304) 7.335 6.725 ( -1.391 -14.543 1.275) 14.665 6.773 ( -2.829 -9.928 -1.464) 10.426 7.004 ( -1.104 -8.541 -0.102) 8.612 7.447 ( -2.122 -10.568 1.195) 10.846 7.477 ( -5.992 -1.568 0.180) 6.196 7.749 ( 1.984 -1.578 -0.609) 2.607 7.861 ( 0.019 3.021 2.944) 4.218 8.369 ( -5.526 1.982 -4.043) 7.129 8.562 ( 8.972 2.246 2.125) 9.489 9.607 ( -0.068 2.174 0.475) 2.226 ======================= Grid point 155 (48/199) ======================= q-point: ( 0.33 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.850 ( -0.741 3.280 -0.234) 3.371 1.261 ( 4.029 -5.778 0.869) 7.097 1.481 ( 2.596 -6.640 4.561) 8.464 1.768 ( -3.115 -1.008 -5.363) 6.283 1.823 ( -3.221 -10.619 0.712) 11.120 1.895 ( -2.270 -2.865 0.972) 3.782 1.946 ( 0.750 0.831 -1.294) 1.712 1.978 ( -3.719 -3.446 0.974) 5.163 2.030 ( -1.414 -2.747 -2.321) 3.864 2.095 ( -2.266 -2.651 -1.855) 3.950 2.286 ( 0.547 -1.963 -0.858) 2.212 2.344 ( -1.000 -1.067 -1.707) 2.247 2.403 ( -0.446 2.215 1.226) 2.571 2.476 ( 1.334 -2.143 -1.371) 2.872 2.531 ( 0.376 1.623 -0.723) 1.816 2.724 ( -0.603 3.092 3.492) 4.703 2.775 ( -0.118 -1.518 -0.391) 1.572 2.859 ( -2.629 2.314 -0.857) 3.606 2.984 ( 2.341 6.189 1.443) 6.773 3.076 ( 2.697 -5.068 2.134) 6.124 3.275 ( 5.616 -4.870 0.402) 7.445 3.525 ( 0.842 -4.926 0.065) 4.998 3.617 ( -1.268 -1.062 -1.266) 2.083 3.762 ( 1.045 -15.011 0.306) 15.050 5.299 ( -2.564 -7.377 0.489) 7.825 5.574 ( 0.484 1.622 -2.520) 3.035 5.641 ( -2.278 3.880 3.755) 5.860 5.715 ( 1.040 -1.141 -0.083) 1.546 5.950 ( -2.438 -2.500 -0.369) 3.512 6.091 ( 0.653 1.176 0.547) 1.452 6.449 ( 1.695 5.427 -2.450) 6.191 6.646 ( -1.349 -5.604 -1.763) 6.028 6.903 ( 1.218 -5.838 0.911) 6.033 7.024 ( -1.557 -12.981 1.204) 13.130 7.200 ( -0.223 -10.872 0.544) 10.888 7.452 ( -5.955 0.352 -1.126) 6.071 7.594 ( -0.533 -4.125 4.267) 5.959 7.770 ( -0.538 -0.980 -0.323) 1.163 7.865 ( -0.563 -3.149 -1.181) 3.410 8.313 ( -5.117 0.199 -4.501) 6.818 8.579 ( 8.515 1.588 2.724) 9.080 9.569 ( -0.561 1.457 0.159) 1.569 ======================= Grid point 156 (49/199) ======================= q-point: ( 0.42 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.782 ( -0.947 2.603 -0.146) 2.774 1.365 ( 2.414 -2.550 -0.600) 3.562 1.572 ( 0.382 -2.247 1.766) 2.883 1.800 ( -1.002 -2.941 -4.586) 5.539 1.885 ( -3.659 2.010 -0.963) 4.285 1.918 ( -2.080 -0.568 0.972) 2.365 1.949 ( 1.206 -1.788 -0.627) 2.246 2.033 ( -3.046 -3.010 -0.472) 4.308 2.086 ( 0.654 -4.251 3.953) 5.842 2.147 ( -1.833 -3.734 -3.516) 5.446 2.289 ( -2.055 3.650 -1.295) 4.384 2.332 ( 1.145 -2.053 0.559) 2.417 2.423 ( 0.207 -2.413 -0.062) 2.422 2.509 ( 0.223 0.766 -0.371) 0.880 2.513 ( 1.313 -0.792 0.346) 1.572 2.669 ( 0.270 2.124 1.724) 2.749 2.757 ( -3.425 2.796 -2.885) 5.279 2.811 ( 0.088 1.493 -0.911) 1.751 2.876 ( 3.009 4.371 3.309) 6.254 3.147 ( 2.438 -0.596 2.753) 3.725 3.392 ( 3.994 -3.379 -0.690) 5.276 3.582 ( -2.221 -1.724 -1.351) 3.119 3.638 ( -0.161 -1.724 0.572) 1.823 4.042 ( 0.691 -10.550 0.306) 10.577 5.416 ( -2.225 -5.665 0.109) 6.087 5.508 ( -3.003 3.223 1.748) 4.740 5.581 ( 2.398 2.485 0.242) 3.462 5.754 ( 0.508 -1.779 -0.838) 2.031 6.005 ( -1.427 -3.388 -0.005) 3.676 6.076 ( 0.953 0.130 -0.839) 1.276 6.351 ( 0.944 5.113 -0.640) 5.239 6.718 ( -1.334 -2.923 -1.645) 3.610 7.011 ( 3.004 -4.016 0.519) 5.042 7.191 ( -2.654 -4.030 2.634) 5.498 7.387 ( 0.373 -7.068 0.601) 7.103 7.417 ( -3.466 -0.879 -1.993) 4.094 7.603 ( 1.083 2.203 4.766) 5.361 7.813 ( -1.478 -3.030 -0.854) 3.477 7.928 ( -1.040 -3.032 -2.184) 3.878 8.293 ( -4.476 -1.269 -4.316) 6.346 8.600 ( 6.627 1.211 3.148) 7.436 9.543 ( -0.613 0.736 -0.098) 0.963 ======================= Grid point 157 (50/199) ======================= q-point: (-0.50 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.751 ( 0.007 -0.025 -0.150) 0.152 1.386 ( -0.189 0.901 -2.042) 2.240 1.596 ( -0.161 0.249 1.134) 1.172 1.831 ( 0.208 -0.159 -1.546) 1.568 1.836 ( 1.324 1.395 -4.270) 4.683 1.917 ( -1.685 -0.825 2.222) 2.908 1.966 ( 1.728 0.534 0.197) 1.820 2.045 ( -0.586 0.151 -0.475) 0.769 2.162 ( -0.333 1.987 0.216) 2.026 2.195 ( -0.433 -4.189 2.401) 4.848 2.245 ( 0.850 -1.645 -2.849) 3.398 2.373 ( 1.182 -1.023 0.994) 1.852 2.443 ( -3.209 -0.310 0.604) 3.280 2.501 ( -0.135 0.108 0.195) 0.261 2.541 ( 2.595 0.084 0.067) 2.597 2.633 ( -0.777 1.967 -1.166) 2.415 2.691 ( -0.302 0.739 -0.544) 0.966 2.764 ( -1.023 0.625 -1.461) 1.890 2.878 ( 0.570 -1.364 2.772) 3.142 3.142 ( 1.502 2.051 1.965) 3.213 3.452 ( 1.105 -0.845 0.095) 1.394 3.565 ( -5.116 0.631 -3.008) 5.968 3.676 ( 2.889 -0.648 1.616) 3.373 4.153 ( 0.032 -0.251 0.402) 0.475 5.441 ( -0.700 1.585 1.201) 2.108 5.483 ( 1.149 0.122 0.419) 1.229 5.569 ( -0.593 -1.444 0.616) 1.678 5.774 ( -0.021 0.183 -1.267) 1.280 6.015 ( 0.947 1.408 0.339) 1.731 6.139 ( -0.886 -5.421 -2.266) 5.942 6.264 ( 0.217 3.670 0.927) 3.792 6.748 ( -0.842 -0.803 -1.458) 1.865 7.086 ( 1.151 -0.908 0.110) 1.470 7.186 ( -0.420 0.670 3.045) 3.146 7.426 ( -1.795 -0.034 -1.656) 2.443 7.460 ( 2.568 0.702 0.379) 2.690 7.570 ( 1.763 1.682 3.626) 4.368 7.840 ( -0.954 -0.237 -0.338) 1.040 7.955 ( -0.879 -0.256 -2.429) 2.596 8.300 ( -4.179 -2.079 -3.982) 6.135 8.610 ( 3.860 1.141 3.384) 5.259 9.533 ( -0.327 0.054 -0.245) 0.412 ======================= Grid point 158 (51/199) ======================= q-point: (-0.42 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.782 ( 0.933 -2.480 -0.166) 2.655 1.338 ( -1.281 3.152 -1.317) 3.648 1.541 ( -1.739 4.882 0.052) 5.183 1.804 ( 1.332 2.204 -4.031) 4.783 1.846 ( 4.298 0.999 0.860) 4.495 1.924 ( 0.689 0.726 -0.108) 1.007 1.962 ( 2.566 1.071 0.162) 2.785 2.020 ( 1.003 2.034 -0.146) 2.273 2.107 ( 0.490 2.171 1.694) 2.797 2.262 ( -1.469 -2.444 -1.568) 3.254 2.300 ( 2.828 -1.626 -0.191) 3.268 2.367 ( -0.407 1.994 -1.208) 2.367 2.433 ( -1.163 -0.742 2.389) 2.759 2.474 ( 0.350 4.408 1.303) 4.609 2.518 ( 0.011 -0.952 0.012) 0.952 2.622 ( 0.081 -0.283 -2.224) 2.244 2.712 ( -1.033 -2.034 -0.395) 2.316 2.804 ( -0.171 -4.350 -0.029) 4.354 2.916 ( -0.860 -2.723 0.440) 2.889 3.099 ( 0.547 2.797 2.786) 3.985 3.405 ( -4.655 4.858 -0.874) 6.785 3.534 ( -1.759 -0.229 -1.153) 2.115 3.688 ( 2.791 1.236 0.751) 3.144 4.052 ( -0.836 10.202 0.526) 10.249 5.430 ( 2.238 1.121 -0.935) 2.672 5.444 ( 2.167 3.103 1.509) 4.074 5.622 ( -1.701 -3.644 1.341) 4.239 5.740 ( -0.548 2.736 -1.190) 3.033 5.991 ( 1.904 1.766 -0.270) 2.611 6.192 ( -2.990 -0.209 3.926) 4.939 6.270 ( 1.024 -4.763 -4.665) 6.745 6.737 ( -0.217 1.686 -1.264) 2.118 7.036 ( -2.896 3.661 0.840) 4.743 7.195 ( 3.884 2.764 3.301) 5.799 7.353 ( -2.259 6.122 -1.299) 6.653 7.436 ( 6.634 2.948 -0.343) 7.267 7.557 ( 2.782 1.293 2.477) 3.943 7.808 ( -0.115 3.172 -0.159) 3.179 7.925 ( -0.764 2.608 -2.295) 3.557 8.319 ( -4.180 -2.669 -3.791) 6.242 8.605 ( 0.874 0.976 3.397) 3.641 9.537 ( 0.106 -0.622 -0.239) 0.674 ======================= Grid point 159 (52/199) ======================= q-point: (-0.33 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.841 ( 0.914 -2.457 -0.505) 2.670 1.245 ( -2.558 5.082 0.816) 5.748 1.392 ( -1.805 8.909 0.795) 9.124 1.765 ( 4.315 7.781 -1.846) 9.087 1.786 ( 3.094 3.171 -1.576) 4.702 1.896 ( 0.454 1.526 -0.784) 1.775 1.951 ( 1.599 1.685 0.618) 2.404 1.992 ( 2.335 2.985 0.350) 3.806 2.077 ( 1.002 2.003 0.768) 2.368 2.257 ( 0.128 2.491 0.464) 2.537 2.299 ( -1.250 2.305 -4.690) 5.373 2.336 ( -1.525 -0.252 0.920) 1.798 2.415 ( 0.012 1.056 -1.591) 1.910 2.468 ( 2.605 -1.848 3.095) 4.447 2.549 ( -0.563 -1.730 0.247) 1.836 2.631 ( 0.802 -0.675 -1.503) 1.833 2.744 ( -0.101 -1.106 1.309) 1.716 2.869 ( 0.457 -1.573 -1.101) 1.974 2.974 ( 0.527 -1.007 -1.162) 1.625 3.052 ( -1.160 1.129 4.496) 4.778 3.248 ( -6.208 5.401 -1.121) 8.305 3.528 ( -1.343 0.253 -0.211) 1.383 3.662 ( 1.120 3.257 0.497) 3.480 3.764 ( -1.817 16.199 0.201) 16.302 5.342 ( 1.579 6.279 2.091) 6.804 5.474 ( 2.808 -1.825 -3.157) 4.602 5.648 ( 0.420 2.284 1.356) 2.689 5.710 ( -0.721 -2.260 0.014) 2.372 5.972 ( 1.864 1.275 0.054) 2.259 6.188 ( -2.730 -0.929 4.882) 5.670 6.378 ( 0.462 -5.437 -6.066) 8.159 6.665 ( 0.025 6.048 -1.063) 6.141 6.942 ( -2.082 4.165 1.135) 4.793 7.052 ( 1.585 12.668 2.454) 13.001 7.188 ( -0.543 8.828 0.073) 8.845 7.451 ( 8.727 1.002 -1.014) 8.843 7.552 ( 4.782 1.950 3.019) 5.982 7.719 ( 0.604 5.549 -1.607) 5.809 7.850 ( -1.486 3.711 -1.402) 4.236 8.353 ( -3.843 -3.476 -3.533) 6.272 8.589 ( -1.714 0.359 3.115) 3.574 9.558 ( 0.427 -1.311 -0.081) 1.382 ======================= Grid point 160 (53/199) ======================= q-point: (-0.25 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.863 ( 1.266 1.859 -1.540) 2.726 1.117 ( -4.323 5.242 3.589) 7.684 1.175 ( -1.685 11.840 4.573) 12.804 1.564 ( 4.478 12.720 -0.743) 13.505 1.767 ( 2.322 3.367 -3.213) 5.201 1.849 ( 0.269 4.582 -1.209) 4.747 1.896 ( 1.243 4.363 0.065) 4.537 1.929 ( 0.637 3.359 0.367) 3.439 2.011 ( 0.157 5.923 0.866) 5.988 2.186 ( 1.609 4.378 -2.049) 5.095 2.254 ( -3.665 0.533 -3.568) 5.143 2.323 ( -3.895 -0.326 1.282) 4.113 2.397 ( 1.747 2.103 -1.353) 3.050 2.531 ( 5.009 -1.788 2.230) 5.767 2.578 ( -0.977 -1.913 -1.578) 2.666 2.638 ( -0.813 0.829 -0.841) 1.433 2.721 ( 0.494 6.878 3.415) 7.695 2.809 ( -0.102 7.413 1.157) 7.504 2.928 ( 0.184 -0.368 -1.753) 1.801 3.055 ( -1.275 -1.280 2.301) 2.926 3.240 ( -2.379 -5.800 0.123) 6.271 3.366 ( -2.528 16.876 -4.291) 17.596 3.522 ( 0.341 1.476 2.648) 3.051 3.646 ( -1.537 0.947 0.459) 1.863 5.224 ( 0.196 5.914 3.126) 6.692 5.509 ( 1.475 0.432 -3.948) 4.237 5.622 ( 2.765 -0.157 0.149) 2.774 5.770 ( 0.846 -3.017 1.044) 3.303 5.958 ( 1.420 1.387 0.092) 1.987 6.178 ( -1.018 1.826 4.909) 5.336 6.474 ( -0.128 -1.024 -6.498) 6.579 6.490 ( -0.944 7.747 -0.166) 7.806 6.745 ( 0.912 15.724 0.511) 15.759 6.876 ( -3.078 3.431 1.087) 4.735 7.026 ( 1.615 7.467 -0.259) 7.644 7.459 ( 6.917 4.171 0.069) 8.077 7.528 ( 6.756 3.943 6.008) 9.863 7.613 ( 1.559 5.158 -6.214) 8.225 7.785 ( -1.715 1.292 0.622) 2.236 8.408 ( -2.848 -4.250 -2.898) 5.880 8.576 ( -3.411 -0.581 2.444) 4.236 9.593 ( 0.408 -1.907 0.183) 1.959 ======================= Grid point 161 (54/199) ======================= q-point: (-0.17 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.741 ( 1.627 11.192 2.126) 11.507 0.902 ( -1.363 14.580 7.739) 16.563 1.039 ( -2.817 0.977 5.784) 6.507 1.356 ( 2.797 10.055 -2.430) 10.716 1.575 ( -4.110 17.920 -0.210) 18.386 1.699 ( -0.448 9.740 -0.092) 9.750 1.784 ( -2.983 9.591 3.513) 10.640 1.864 ( 3.042 2.803 -2.615) 4.894 1.892 ( 0.698 3.330 0.356) 3.421 2.129 ( 2.857 2.176 -4.453) 5.721 2.227 ( -4.590 -0.336 -2.875) 5.426 2.300 ( -1.531 1.461 0.126) 2.120 2.342 ( -1.295 3.486 0.362) 3.737 2.480 ( -0.850 7.335 -0.796) 7.427 2.559 ( 2.896 2.692 3.850) 5.519 2.633 ( -0.392 -1.669 -0.422) 1.766 2.647 ( 1.518 -3.294 -1.173) 3.812 2.783 ( 0.487 -0.435 2.570) 2.651 2.912 ( 2.096 3.582 -0.349) 4.165 3.061 ( -2.928 10.905 -10.160) 15.190 3.095 ( 0.620 -2.416 1.814) 3.084 3.353 ( -1.687 -5.769 0.224) 6.015 3.505 ( 0.558 0.709 3.071) 3.201 3.629 ( -2.213 -0.310 1.667) 2.788 5.131 ( -1.306 2.904 4.675) 5.656 5.488 ( 1.215 1.418 -1.093) 2.164 5.668 ( 2.615 -1.589 -2.394) 3.885 5.826 ( 0.895 -1.413 1.766) 2.433 5.929 ( 1.026 2.298 -0.314) 2.537 6.058 ( 6.396 11.523 0.817) 13.204 6.312 ( -4.629 4.758 3.767) 7.633 6.381 ( 0.602 12.307 -1.480) 12.410 6.605 ( -0.912 -1.995 -4.946) 5.411 6.777 ( -3.203 4.490 -5.089) 7.505 6.911 ( -0.119 5.090 0.645) 5.132 7.325 ( -3.243 10.723 -6.732) 13.069 7.510 ( 2.810 1.444 3.962) 5.067 7.572 ( 12.175 1.794 1.965) 12.462 7.785 ( 2.661 -1.027 4.213) 5.088 8.479 ( -1.626 -4.197 -1.793) 4.845 8.573 ( -4.054 -1.266 1.371) 4.463 9.635 ( -0.046 -2.044 0.493) 2.103 ======================= Grid point 162 (55/199) ======================= q-point: (-0.08 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.487 ( 2.872 15.217 8.701) 17.763 0.608 ( -2.110 14.355 14.988) 20.860 0.976 ( -1.687 13.884 18.258) 22.999 1.098 ( -5.060 11.196 -2.235) 12.488 1.219 ( 0.707 6.346 -6.000) 8.762 1.482 ( 1.317 9.965 3.532) 10.655 1.639 ( -3.332 3.433 2.996) 5.645 1.815 ( -1.091 3.631 -1.379) 4.034 1.854 ( 3.118 0.977 -3.120) 4.518 2.129 ( 3.402 0.084 -3.769) 5.078 2.205 ( -5.444 -0.630 -3.337) 6.416 2.238 ( 0.024 3.012 -1.027) 3.183 2.298 ( 0.238 0.611 1.006) 1.200 2.398 ( -0.701 2.112 -2.963) 3.705 2.526 ( 0.427 1.524 3.746) 4.067 2.667 ( 0.450 -1.288 0.355) 1.410 2.712 ( -0.514 -1.818 -0.685) 2.010 2.788 ( -0.878 0.577 2.610) 2.814 2.823 ( 3.352 4.791 -6.083) 8.438 2.918 ( -3.069 1.723 -10.234) 10.822 3.145 ( 2.446 -1.668 2.634) 3.963 3.421 ( -4.923 -2.769 1.075) 5.749 3.509 ( 2.280 -0.275 2.614) 3.479 3.637 ( -1.484 -1.690 3.244) 3.947 5.122 ( -3.907 -4.537 7.412) 9.528 5.482 ( 2.327 0.179 1.011) 2.544 5.650 ( -3.151 4.065 1.114) 5.262 5.817 ( 2.830 0.994 -0.990) 3.159 5.879 ( 1.545 2.828 0.042) 3.223 5.962 ( 8.764 3.283 -4.994) 10.608 6.111 ( 0.971 9.511 0.437) 9.571 6.299 ( -1.625 0.633 4.316) 4.655 6.531 ( -15.835 9.849 -16.427) 24.851 6.719 ( -0.629 -1.019 -7.115) 7.215 6.810 ( -2.871 4.417 1.348) 5.438 6.997 ( -6.147 16.876 -10.322) 20.716 7.493 ( 1.817 1.318 1.428) 2.660 7.659 ( 2.983 -2.359 3.251) 5.003 7.939 ( 25.789 -9.415 16.211) 31.883 8.542 ( -0.769 -2.561 -0.356) 2.697 8.576 ( -3.663 -1.391 0.175) 3.922 9.668 ( -0.073 -1.276 1.020) 1.636 ======================= Grid point 164 (56/199) ======================= q-point: ( 0.08 0.08 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.437 ( 14.936 -0.000 12.688) 19.597 0.453 ( 15.860 -0.000 12.957) 20.480 0.965 ( -2.601 0.000 -8.379) 8.774 0.976 ( 17.871 -0.000 34.403) 38.768 1.200 ( 2.612 -0.000 -6.022) 6.564 1.464 ( 5.542 -0.000 5.274) 7.651 1.563 ( -0.182 0.000 2.791) 2.797 1.742 ( -1.688 0.000 -2.872) 3.331 1.854 ( -1.633 0.000 -2.708) 3.162 2.088 ( -6.978 0.000 -2.470) 7.402 2.188 ( 2.478 -0.000 -2.796) 3.736 2.208 ( -0.154 0.000 0.331) 0.365 2.338 ( 2.754 -0.000 0.559) 2.810 2.360 ( -0.845 0.000 -3.261) 3.369 2.511 ( -0.364 0.000 3.060) 3.081 2.588 ( -7.734 0.000 -11.046) 13.485 2.686 ( -1.915 0.000 -0.342) 1.946 2.745 ( -0.566 0.000 -0.431) 0.712 2.782 ( -2.284 0.000 -9.142) 9.423 2.892 ( -1.250 0.000 2.977) 3.228 3.256 ( 1.505 -0.000 0.697) 1.658 3.444 ( 6.672 -0.000 -3.673) 7.616 3.579 ( 3.091 -0.000 -0.084) 3.092 3.673 ( 2.015 -0.000 2.561) 3.259 5.125 ( -27.311 0.000 14.417) 30.883 5.289 ( 1.132 -0.000 -0.579) 1.272 5.548 ( 2.343 -0.000 5.054) 5.571 5.702 ( -0.490 0.000 -0.654) 0.817 5.859 ( 0.139 -0.000 1.478) 1.484 5.884 ( -3.730 0.000 -4.407) 5.774 6.009 ( -0.506 0.000 -0.223) 0.553 6.095 ( -1.031 0.000 6.529) 6.610 6.375 ( 12.035 -0.000 -3.722) 12.598 6.711 ( -0.809 0.000 0.987) 1.276 6.775 ( 2.380 -0.000 -4.176) 4.806 6.827 ( 0.862 -0.000 -1.053) 1.361 7.465 ( -4.205 0.000 2.289) 4.788 7.687 ( 2.660 -0.000 1.482) 3.045 8.316 ( -14.306 0.000 -3.552) 14.740 8.565 ( -1.500 0.000 1.286) 1.976 8.664 ( 5.225 -0.000 1.528) 5.443 9.788 ( 5.035 -0.000 -4.427) 6.704 ======================= Grid point 165 (57/199) ======================= q-point: ( 0.17 0.08 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.613 ( 7.651 -11.984 9.772) 17.253 0.742 ( 11.004 -10.425 9.109) 17.685 0.994 ( -0.080 -2.459 -0.986) 2.650 1.245 ( 2.723 -4.288 4.642) 6.881 1.318 ( 16.929 -18.519 5.943) 25.785 1.576 ( 5.594 -8.018 6.008) 11.475 1.608 ( 1.183 -3.557 1.305) 3.970 1.765 ( -2.828 -3.128 -3.204) 5.296 1.858 ( -2.426 -1.586 -1.220) 3.145 2.038 ( -6.860 0.233 -2.265) 7.228 2.189 ( 1.089 -0.247 -3.422) 3.600 2.239 ( 0.580 -1.601 -1.079) 2.016 2.330 ( 1.687 1.287 -0.995) 2.343 2.359 ( -1.789 -1.312 -1.366) 2.606 2.507 ( -2.709 -1.221 1.534) 3.344 2.647 ( -3.448 -7.122 -4.539) 9.122 2.669 ( -0.751 0.295 -0.709) 1.074 2.739 ( -2.608 -0.559 -0.033) 2.667 2.794 ( -1.488 -3.156 -10.317) 10.892 2.886 ( -0.775 -0.131 3.367) 3.457 3.228 ( 2.071 2.988 0.962) 3.761 3.419 ( 2.209 4.016 -2.773) 5.357 3.572 ( 2.172 1.308 1.852) 3.140 3.662 ( 2.905 1.716 3.303) 4.721 4.986 ( -5.711 -1.093 4.553) 7.385 5.501 ( -1.593 -8.442 -3.231) 9.178 5.572 ( -1.361 -3.189 4.080) 5.354 5.775 ( -4.057 -0.929 -1.503) 4.425 5.857 ( -1.777 -2.758 0.497) 3.318 6.024 ( -7.389 -9.614 -0.920) 12.161 6.092 ( -1.190 -8.014 0.235) 8.105 6.142 ( -4.828 -10.966 1.777) 12.113 6.431 ( 9.519 0.295 -5.991) 11.251 6.733 ( 1.380 1.192 -4.148) 4.531 6.770 ( -0.187 -2.545 1.504) 2.962 6.964 ( 1.047 -10.965 -1.433) 11.108 7.437 ( -5.554 -0.063 2.355) 6.033 7.709 ( 3.606 -0.261 0.822) 3.708 8.124 ( -8.927 8.498 2.577) 12.591 8.497 ( -3.130 4.118 0.433) 5.191 8.664 ( 8.150 2.495 1.851) 8.722 9.736 ( 1.869 4.669 -0.583) 5.063 ======================= Grid point 166 (58/199) ======================= q-point: ( 0.25 0.08 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.908 ( 3.186 -11.388 6.998) 13.741 0.935 ( 4.114 -2.787 -1.727) 5.260 1.098 ( 6.239 -9.163 8.016) 13.680 1.372 ( 0.248 -8.229 2.986) 8.757 1.690 ( 0.999 -6.388 -0.334) 6.474 1.714 ( 3.165 -8.866 -5.322) 10.814 1.797 ( -4.454 -2.129 -2.914) 5.733 1.833 ( 2.819 -10.175 2.760) 10.913 1.879 ( -0.972 -2.593 1.674) 3.236 2.016 ( -3.526 -1.738 -0.487) 3.962 2.241 ( 3.070 -0.868 -1.558) 3.550 2.269 ( -0.737 -5.926 -3.160) 6.756 2.319 ( 1.187 0.475 -1.267) 1.800 2.419 ( -2.801 -3.995 0.213) 4.884 2.542 ( -0.976 -5.182 2.376) 5.783 2.650 ( 0.562 0.630 -0.542) 1.003 2.726 ( 1.700 -1.808 0.452) 2.522 2.780 ( -0.916 -2.572 3.327) 4.304 2.876 ( -1.670 -3.948 -5.855) 7.256 2.934 ( -1.492 -8.324 -1.932) 8.674 3.188 ( 1.359 1.130 -0.261) 1.786 3.341 ( 0.033 4.000 -1.445) 4.253 3.568 ( 2.048 0.411 1.984) 2.881 3.645 ( 2.530 1.790 1.688) 3.529 5.030 ( -2.769 -5.116 1.020) 5.906 5.566 ( 1.588 -1.034 1.277) 2.285 5.661 ( -2.392 -3.127 -3.454) 5.237 5.754 ( -4.036 -0.516 1.710) 4.414 5.896 ( -2.404 -1.684 0.202) 2.942 6.065 ( -5.715 -3.384 6.042) 8.979 6.310 ( 2.771 -11.023 -1.410) 11.453 6.413 ( -1.605 -14.938 -0.362) 15.028 6.513 ( -1.731 -7.536 -6.563) 10.142 6.680 ( 2.326 4.053 -3.682) 5.949 6.863 ( -0.249 -5.919 2.083) 6.279 7.204 ( -0.816 -12.402 0.188) 12.430 7.409 ( -6.455 -0.955 1.317) 6.656 7.740 ( 2.769 -0.761 -0.445) 2.906 7.945 ( -3.759 5.763 2.583) 7.350 8.392 ( -4.531 3.826 -1.943) 6.240 8.669 ( 9.234 2.537 1.871) 9.758 9.662 ( 0.089 3.422 0.288) 3.436 ======================= Grid point 167 (59/199) ======================= q-point: ( 0.33 0.08 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.911 ( 0.430 2.838 -0.341) 2.890 1.151 ( 5.388 -8.303 2.387) 10.182 1.343 ( 4.665 -9.751 6.470) 12.598 1.570 ( -1.983 -11.616 3.235) 12.220 1.741 ( -4.007 0.051 -6.203) 7.385 1.797 ( -1.988 -4.892 -0.917) 5.360 1.873 ( -4.299 -4.629 -0.882) 6.379 1.933 ( 0.043 -4.118 -1.554) 4.402 1.944 ( -2.920 -2.102 -3.362) 4.924 2.056 ( 0.971 -2.224 2.516) 3.495 2.252 ( -0.469 -1.030 -2.604) 2.839 2.321 ( -1.293 -0.445 -1.467) 2.005 2.398 ( 1.054 -3.239 1.522) 3.731 2.436 ( -1.150 -1.565 -0.749) 2.081 2.576 ( 0.891 1.997 -1.214) 2.501 2.737 ( -1.250 -2.295 -0.477) 2.656 2.781 ( 0.695 0.945 4.440) 4.592 2.812 ( 1.052 -5.721 1.114) 5.922 2.966 ( 1.390 -6.158 -2.151) 6.670 3.055 ( 1.444 -1.523 2.026) 2.917 3.247 ( 2.150 -1.717 -0.109) 2.754 3.344 ( 2.044 -10.198 -2.291) 10.650 3.590 ( 0.442 -2.329 1.033) 2.586 3.625 ( 1.571 1.329 0.395) 2.095 5.139 ( -2.173 -7.041 0.211) 7.371 5.592 ( 1.255 -0.317 -1.048) 1.666 5.655 ( -4.597 0.267 0.570) 4.640 5.734 ( -0.329 1.463 1.876) 2.402 5.898 ( -3.388 -1.125 -0.140) 3.572 6.104 ( 0.258 -1.169 1.977) 2.311 6.496 ( 0.086 -6.135 -0.483) 6.155 6.574 ( 2.399 2.897 -6.548) 7.551 6.715 ( -0.757 -13.687 2.011) 13.855 6.737 ( -2.515 -13.286 0.122) 13.522 7.000 ( 0.328 -8.204 1.168) 8.294 7.397 ( -7.011 -1.586 -0.204) 7.191 7.430 ( -0.990 -10.786 1.851) 10.988 7.771 ( 1.671 -0.995 -0.598) 2.035 7.842 ( -2.867 2.695 0.433) 3.959 8.300 ( -4.861 2.190 -3.008) 6.122 8.676 ( 8.869 2.442 2.178) 9.454 9.603 ( -0.671 2.371 0.110) 2.466 ======================= Grid point 168 (60/199) ======================= q-point: ( 0.42 0.08 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.842 ( -0.410 3.812 -0.291) 3.845 1.310 ( 3.677 -4.877 0.990) 6.187 1.510 ( 1.725 -4.872 3.274) 6.118 1.728 ( -2.768 -3.343 -4.630) 6.346 1.788 ( -2.343 -8.920 0.140) 9.224 1.862 ( -3.534 -2.546 1.472) 4.598 1.906 ( -4.651 -1.865 -2.079) 5.425 1.963 ( -0.567 -2.422 -0.956) 2.665 2.006 ( -1.356 -4.132 -3.454) 5.554 2.096 ( 1.297 -0.968 3.710) 4.047 2.280 ( -2.217 -2.348 -1.782) 3.688 2.311 ( -1.851 0.147 -0.932) 2.077 2.416 ( 1.179 0.019 2.096) 2.405 2.488 ( 0.566 -1.988 -0.743) 2.196 2.543 ( 1.852 1.826 -1.187) 2.858 2.717 ( -0.945 2.184 2.086) 3.164 2.763 ( -1.326 0.776 -1.800) 2.366 2.839 ( -0.678 1.146 -0.032) 1.332 3.008 ( 1.519 5.210 0.590) 5.459 3.118 ( 3.681 -4.782 2.780) 6.645 3.334 ( 3.867 -4.791 -0.665) 6.192 3.527 ( -0.298 -2.721 -0.590) 2.800 3.617 ( 1.249 -0.742 0.529) 1.546 3.773 ( 0.722 -15.420 0.046) 15.437 5.269 ( -2.212 -7.219 0.223) 7.553 5.552 ( -3.944 3.164 1.155) 5.186 5.635 ( 0.791 0.845 0.783) 1.397 5.724 ( 0.453 -0.822 -0.670) 1.153 5.921 ( -2.235 -3.081 -0.371) 3.824 6.107 ( 1.862 1.244 0.586) 2.314 6.466 ( 1.532 5.543 -2.044) 6.103 6.626 ( -1.513 -5.156 -2.055) 5.753 6.921 ( 1.533 -7.184 1.232) 7.448 7.007 ( -1.383 -12.844 2.058) 13.081 7.195 ( -0.608 -10.789 0.563) 10.820 7.378 ( -5.915 -0.776 -1.415) 6.131 7.602 ( 1.080 -5.628 4.385) 7.216 7.761 ( -1.065 0.949 -0.231) 1.445 7.846 ( -1.752 -3.755 -2.971) 5.099 8.249 ( -4.395 0.057 -3.106) 5.382 8.679 ( 7.111 2.261 2.399) 7.838 9.561 ( -0.728 1.437 -0.133) 1.617 ======================= Grid point 169 (61/199) ======================= q-point: ( 0.50 0.08 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.773 ( -0.474 2.415 -0.192) 2.469 1.384 ( 0.833 -1.212 -1.184) 1.888 1.580 ( 0.595 -1.976 1.499) 2.551 1.787 ( -0.558 -3.423 -5.157) 6.215 1.840 ( -3.200 -0.133 0.027) 3.202 1.889 ( -2.548 -1.788 1.144) 3.316 1.951 ( -1.256 -3.306 -1.407) 3.806 2.014 ( -0.004 -2.426 -0.366) 2.453 2.092 ( -0.031 -4.690 1.479) 4.918 2.137 ( 0.384 -3.301 0.388) 3.346 2.264 ( -1.753 2.084 -1.370) 3.048 2.340 ( 0.167 -2.690 1.027) 2.885 2.420 ( -0.903 0.014 1.816) 2.029 2.505 ( -0.345 0.170 -0.903) 0.981 2.538 ( 2.409 -0.453 0.163) 2.457 2.676 ( 0.644 1.926 1.187) 2.353 2.715 ( -2.847 2.214 -3.691) 5.160 2.811 ( 0.102 2.053 -1.011) 2.290 2.908 ( 1.748 4.430 2.747) 5.497 3.189 ( 4.033 0.228 2.955) 5.005 3.423 ( 0.275 -2.598 -1.292) 2.914 3.532 ( -3.384 -0.334 -2.085) 3.989 3.667 ( 3.205 -2.257 1.566) 4.221 4.048 ( 0.215 -10.197 0.277) 10.203 5.390 ( -2.044 -6.189 0.658) 6.551 5.469 ( -3.613 2.248 2.314) 4.844 5.613 ( 2.676 2.432 -0.730) 3.689 5.756 ( 0.049 -1.709 -1.423) 2.224 5.986 ( -1.565 -4.044 0.473) 4.362 6.095 ( 2.223 0.668 -1.112) 2.574 6.360 ( 0.586 5.572 -0.347) 5.614 6.700 ( -1.286 -3.201 -1.375) 3.713 7.045 ( 2.302 -4.218 0.488) 4.830 7.163 ( -2.167 -3.378 3.106) 5.075 7.355 ( -3.596 -5.377 -1.100) 6.562 7.410 ( 0.445 -5.381 -0.769) 5.454 7.635 ( 3.267 2.492 5.510) 6.873 7.789 ( -2.312 -3.686 -1.678) 4.664 7.912 ( -0.968 -3.231 -2.982) 4.502 8.238 ( -3.802 -1.357 -2.760) 4.890 8.672 ( 4.390 2.207 2.373) 5.456 9.537 ( -0.361 0.616 -0.243) 0.755 ======================= Grid point 170 (62/199) ======================= q-point: (-0.42 0.08 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.754 ( 0.458 -0.590 -0.140) 0.760 1.377 ( -0.870 1.513 -1.753) 2.474 1.593 ( -0.382 1.108 0.472) 1.264 1.831 ( 0.283 -0.666 -4.409) 4.468 1.861 ( 2.330 -2.004 -0.644) 3.140 1.897 ( -1.339 -0.884 1.732) 2.361 1.979 ( 0.260 -0.825 0.764) 1.154 2.045 ( 0.661 -0.282 -0.503) 0.877 2.159 ( -0.187 0.279 -1.384) 1.424 2.201 ( 1.139 -1.565 2.632) 3.267 2.245 ( -0.410 -3.846 -2.473) 4.591 2.385 ( 0.370 -0.847 0.600) 1.102 2.402 ( -3.181 0.016 2.311) 3.932 2.501 ( 0.133 -0.148 -0.532) 0.568 2.574 ( 2.561 0.845 0.874) 2.835 2.620 ( -1.060 1.860 -2.181) 3.056 2.681 ( -1.164 -0.127 -0.357) 1.224 2.759 ( 0.257 1.361 -0.839) 1.619 2.884 ( 0.115 -0.370 2.176) 2.210 3.173 ( 3.100 3.219 2.180) 4.972 3.430 ( -5.083 0.702 -0.954) 5.219 3.520 ( -0.908 -0.154 -0.999) 1.359 3.720 ( 3.647 -0.479 0.466) 3.707 4.150 ( -0.548 -0.015 0.370) 0.661 5.432 ( -0.895 0.049 0.832) 1.223 5.488 ( -0.429 -3.885 1.177) 4.082 5.573 ( 1.124 2.282 -0.013) 2.544 5.771 ( -0.234 0.425 -1.111) 1.212 6.023 ( 0.020 -0.030 0.767) 0.768 6.134 ( 0.589 -3.239 -2.521) 4.147 6.267 ( -0.014 3.332 0.807) 3.428 6.736 ( -0.764 -1.117 -1.200) 1.809 7.076 ( -2.257 1.627 0.254) 2.794 7.208 ( 2.811 -2.567 2.652) 4.639 7.399 ( -2.202 -0.262 -0.991) 2.429 7.492 ( 2.021 -1.267 -0.619) 2.464 7.608 ( 3.635 2.057 4.291) 5.988 7.826 ( -1.121 -0.844 -0.446) 1.472 7.944 ( -0.386 -0.338 -2.885) 2.930 8.248 ( -3.391 -1.924 -2.481) 4.621 8.646 ( 1.381 2.214 2.060) 3.325 9.531 ( 0.129 -0.086 -0.183) 0.240 ======================= Grid point 171 (63/199) ======================= q-point: (-0.33 0.08 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.794 ( 1.050 -2.621 -0.098) 2.825 1.319 ( -1.681 3.580 -0.600) 4.000 1.530 ( 0.050 5.173 0.307) 5.183 1.817 ( 1.565 1.465 -3.828) 4.387 1.892 ( 2.105 0.483 0.673) 2.262 1.913 ( -0.927 -0.245 0.394) 1.037 2.003 ( 2.949 1.951 0.089) 3.537 2.036 ( 1.449 0.480 0.425) 1.584 2.119 ( 1.737 1.869 -0.096) 2.553 2.241 ( -1.744 -1.421 -1.875) 2.929 2.325 ( 0.959 -2.676 0.587) 2.903 2.346 ( -2.678 1.997 -3.193) 4.622 2.415 ( -0.756 -0.413 0.156) 0.876 2.487 ( 0.464 3.961 2.316) 4.612 2.518 ( -0.058 -1.060 0.122) 1.068 2.637 ( 2.733 -0.135 0.237) 2.747 2.700 ( -0.891 -2.572 0.404) 2.752 2.800 ( -0.420 -4.576 -0.349) 4.609 2.904 ( -1.285 -2.172 0.047) 2.524 3.120 ( 2.336 3.491 3.199) 5.280 3.335 ( -5.947 5.299 -1.270) 8.066 3.521 ( -0.364 -0.132 0.209) 0.440 3.722 ( 2.490 2.043 -0.540) 3.266 4.039 ( -1.242 10.664 0.490) 10.747 5.452 ( 1.414 -1.702 -1.522) 2.685 5.470 ( 2.028 5.237 0.954) 5.697 5.605 ( -1.345 -4.499 1.871) 5.055 5.733 ( -0.425 2.890 -0.350) 2.942 6.011 ( 1.380 1.444 -0.629) 2.094 6.156 ( -3.175 -0.253 3.138) 4.471 6.284 ( 1.698 -4.039 -3.840) 5.826 6.733 ( -0.068 1.282 -1.135) 1.713 7.002 ( -2.663 3.548 0.521) 4.467 7.244 ( 3.695 3.204 3.238) 5.865 7.321 ( -2.715 6.102 -1.002) 6.753 7.507 ( 4.304 0.550 -1.604) 4.626 7.606 ( 4.416 0.835 3.858) 5.923 7.805 ( -0.092 2.621 0.250) 2.635 7.914 ( -0.484 2.962 -2.611) 3.978 8.271 ( -2.804 -2.490 -2.354) 4.428 8.605 ( -1.288 1.923 1.493) 2.754 9.541 ( 0.471 -0.717 0.008) 0.858 ======================= Grid point 172 (64/199) ======================= q-point: (-0.25 0.08 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.853 ( 0.980 -2.368 -0.350) 2.586 1.214 ( -2.272 5.709 0.680) 6.182 1.387 ( 0.702 9.491 2.611) 9.869 1.807 ( 3.300 2.950 -3.702) 5.770 1.834 ( 4.020 7.371 0.754) 8.430 1.886 ( -1.524 0.580 -1.545) 2.246 1.958 ( -0.320 1.899 0.797) 2.084 2.011 ( 0.330 3.432 0.960) 3.579 2.100 ( 2.264 2.787 0.329) 3.606 2.241 ( -2.363 -0.065 -3.166) 3.951 2.276 ( -1.719 3.140 -2.928) 4.625 2.310 ( -1.933 2.632 -0.380) 3.287 2.422 ( 0.928 -0.493 -1.794) 2.079 2.493 ( 0.681 -2.887 1.499) 3.324 2.542 ( -0.528 -1.315 -0.067) 1.419 2.659 ( 3.272 0.100 1.918) 3.794 2.747 ( 0.265 -1.254 1.986) 2.364 2.873 ( 0.694 -2.925 -1.624) 3.417 2.974 ( -0.785 -3.872 0.226) 3.957 3.068 ( 3.114 5.339 4.181) 7.462 3.167 ( -6.677 4.630 -1.014) 8.188 3.513 ( -0.972 0.961 -0.360) 1.413 3.676 ( 0.953 3.589 -0.427) 3.738 3.742 ( -1.692 16.664 0.342) 16.753 5.355 ( 0.131 6.783 2.145) 7.115 5.504 ( 2.653 -1.890 -4.211) 5.324 5.660 ( 1.290 1.825 1.928) 2.952 5.701 ( -0.904 -3.357 0.685) 3.543 5.988 ( 0.782 1.326 -0.263) 1.561 6.154 ( -3.336 -1.306 4.099) 5.444 6.386 ( 1.648 -5.039 -5.325) 7.514 6.665 ( 0.126 6.324 -0.848) 6.382 6.918 ( -1.952 3.422 0.801) 4.020 7.068 ( 0.461 14.208 0.868) 14.242 7.180 ( -0.317 7.390 0.786) 7.438 7.533 ( 4.146 0.077 -1.931) 4.575 7.624 ( 4.969 1.301 4.101) 6.573 7.728 ( 2.093 5.009 0.014) 5.429 7.828 ( -1.887 4.382 -1.645) 5.047 8.316 ( -1.307 -3.500 -2.002) 4.239 8.562 ( -3.225 1.028 0.712) 3.459 9.564 ( 0.546 -1.315 0.267) 1.449 ======================= Grid point 173 (65/199) ======================= q-point: (-0.17 0.08 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.883 ( 1.952 0.999 -1.566) 2.694 1.074 ( -2.746 6.619 2.621) 7.630 1.179 ( 1.341 11.847 7.498) 14.084 1.610 ( 2.729 12.961 -0.704) 13.263 1.794 ( 2.496 5.391 -1.911) 6.241 1.844 ( -0.668 4.300 -3.313) 5.469 1.901 ( 0.064 3.404 1.166) 3.599 1.931 ( -0.707 3.480 0.444) 3.579 2.015 ( 0.122 6.732 1.342) 6.866 2.189 ( -3.246 2.032 -5.786) 6.939 2.218 ( 0.700 2.757 -2.107) 3.540 2.283 ( -2.349 -0.638 1.436) 2.826 2.399 ( -0.786 2.581 -2.285) 3.536 2.566 ( -0.277 -2.638 -2.192) 3.441 2.581 ( 0.682 -3.131 0.457) 3.237 2.640 ( 2.375 3.636 2.055) 4.805 2.732 ( 0.717 7.065 4.541) 8.429 2.813 ( 0.470 8.598 0.940) 8.662 2.934 ( 0.827 -0.752 -0.986) 1.490 3.042 ( -1.076 -2.265 1.874) 3.130 3.214 ( -1.567 -6.893 -0.245) 7.073 3.337 ( -1.558 15.645 -4.549) 16.367 3.534 ( 1.190 2.197 3.047) 3.941 3.629 ( -1.195 1.548 -0.018) 1.956 5.219 ( -1.372 6.284 3.153) 7.163 5.526 ( 2.003 1.071 -3.202) 3.926 5.655 ( 2.630 -0.872 -0.504) 2.816 5.776 ( -0.121 -3.663 1.319) 3.895 5.967 ( 0.069 1.292 -0.299) 1.328 6.162 ( -2.192 -0.982 4.110) 4.761 6.467 ( 0.029 10.028 -1.385) 10.123 6.494 ( 1.573 -1.462 -4.078) 4.609 6.751 ( -0.096 16.599 0.774) 16.617 6.839 ( -2.915 3.811 -0.428) 4.817 7.032 ( -0.223 7.061 -1.203) 7.166 7.501 ( 0.339 7.197 -1.151) 7.296 7.564 ( -0.961 3.320 -0.194) 3.462 7.679 ( 7.196 3.738 1.424) 8.233 7.777 ( 1.434 -1.020 2.653) 3.184 8.391 ( 0.744 -4.223 -1.244) 4.465 8.531 ( -4.255 -0.291 -0.269) 4.273 9.599 ( 0.443 -1.781 0.572) 1.923 ======================= Grid point 174 (66/199) ======================= q-point: (-0.08 0.08 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.781 ( 4.497 11.158 3.127) 12.430 0.904 ( 0.135 12.942 6.553) 14.508 1.022 ( -0.766 1.708 7.053) 7.297 1.382 ( 0.995 10.347 -2.309) 10.648 1.557 ( 2.280 21.181 1.943) 21.392 1.702 ( 0.819 8.976 -0.191) 9.015 1.759 ( -1.385 10.675 4.029) 11.494 1.876 ( -0.951 2.345 -1.552) 2.968 1.906 ( 1.305 3.155 -1.063) 3.576 2.153 ( -2.848 -0.272 -5.636) 6.320 2.169 ( 0.036 1.958 -2.229) 2.967 2.285 ( -0.433 0.201 0.559) 0.735 2.321 ( -1.972 3.411 -1.492) 4.212 2.467 ( -1.224 7.019 -0.730) 7.162 2.578 ( -0.481 3.627 2.751) 4.577 2.633 ( 0.586 -2.233 0.198) 2.317 2.674 ( 2.689 -2.478 0.011) 3.657 2.787 ( -0.115 0.001 2.242) 2.245 2.922 ( -0.327 1.449 -1.914) 2.423 3.007 ( -3.626 10.261 -9.679) 14.564 3.124 ( 2.959 -0.612 2.244) 3.764 3.337 ( -0.741 -4.764 0.521) 4.849 3.520 ( 1.406 0.357 2.906) 3.248 3.613 ( -0.494 -0.373 1.722) 1.830 5.107 ( -3.113 3.568 4.486) 6.523 5.511 ( 2.340 1.279 -0.023) 2.667 5.687 ( 0.786 0.047 -2.485) 2.606 5.826 ( -1.247 -1.107 1.531) 2.264 5.931 ( -0.498 2.198 -0.650) 2.345 6.148 ( 7.693 6.476 -0.260) 10.060 6.241 ( -6.829 4.245 4.463) 9.196 6.393 ( 1.135 14.467 -0.774) 14.532 6.596 ( -0.235 0.042 -5.327) 5.332 6.723 ( -4.726 4.587 -7.126) 9.703 6.897 ( -1.947 5.922 -0.188) 6.237 7.266 ( -4.503 13.669 -5.365) 15.359 7.519 ( -1.508 1.289 2.101) 2.889 7.664 ( 3.544 1.056 0.041) 3.698 7.882 ( 9.522 -6.298 9.237) 14.685 8.483 ( 2.519 -3.976 -0.289) 4.715 8.521 ( -4.198 -1.283 -1.230) 4.559 9.639 ( 0.767 -1.948 0.978) 2.311 ======================= Grid point 177 (67/199) ======================= q-point: ( 0.17 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.652 ( 17.691 -0.000 9.044) 19.868 0.666 ( 16.141 -0.000 9.674) 18.818 0.947 ( 1.441 -0.000 -7.459) 7.597 1.215 ( 4.548 -0.000 -6.515) 7.946 1.243 ( 16.844 -0.000 24.901) 30.063 1.537 ( 5.710 -0.000 3.603) 6.752 1.595 ( 5.048 -0.000 2.872) 5.808 1.718 ( -1.845 0.000 -2.502) 3.109 1.818 ( -3.785 0.000 -2.289) 4.423 2.001 ( -6.684 0.000 -1.038) 6.765 2.202 ( -0.873 0.000 0.738) 1.143 2.215 ( 1.948 -0.000 -1.988) 2.783 2.346 ( -0.849 0.000 -3.442) 3.545 2.353 ( -1.595 0.000 1.573) 2.241 2.492 ( -5.957 0.000 -8.066) 10.027 2.504 ( -1.124 0.000 2.741) 2.962 2.648 ( -3.569 0.000 -6.076) 7.047 2.735 ( -0.857 0.000 -0.362) 0.930 2.746 ( -1.771 0.000 -6.986) 7.207 2.888 ( -0.061 0.000 5.045) 5.045 3.269 ( 0.565 -0.000 0.004) 0.565 3.486 ( -0.288 0.000 -8.175) 8.180 3.603 ( 1.369 -0.000 1.084) 1.746 3.711 ( 3.554 -0.000 2.645) 4.431 4.943 ( -7.266 0.000 5.059) 8.854 5.309 ( 2.180 -0.000 -0.570) 2.254 5.574 ( 1.322 -0.000 4.803) 4.982 5.695 ( -0.546 0.000 -0.293) 0.620 5.814 ( -6.696 0.000 -3.624) 7.614 5.859 ( -0.265 0.000 1.128) 1.159 6.000 ( -0.972 0.000 -0.322) 1.024 6.057 ( -5.172 0.000 9.460) 10.782 6.522 ( 10.853 -0.000 -4.053) 11.585 6.702 ( -0.813 0.000 1.029) 1.312 6.808 ( 3.734 -0.000 -4.193) 5.614 6.838 ( 1.016 -0.000 -1.012) 1.434 7.405 ( -5.630 0.000 2.680) 6.235 7.731 ( 3.715 -0.000 1.323) 3.943 8.133 ( -13.875 0.000 -1.778) 13.989 8.530 ( -3.939 0.000 3.054) 4.984 8.738 ( 7.039 -0.000 1.717) 7.246 9.800 ( -1.493 0.000 -2.765) 3.142 ======================= Grid point 178 (68/199) ======================= q-point: ( 0.25 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.754 ( 13.374 -5.431 8.507) 16.755 0.865 ( 7.338 -6.255 2.411) 9.939 1.026 ( 6.366 -4.113 1.333) 7.696 1.267 ( 1.253 -3.826 3.710) 5.475 1.520 ( 13.771 -12.626 -1.404) 18.736 1.619 ( 1.857 -3.444 0.193) 3.917 1.680 ( 7.924 -6.309 8.117) 12.980 1.721 ( -3.911 -1.934 -3.779) 5.773 1.823 ( -2.824 -2.315 0.359) 3.670 1.968 ( -3.504 -0.744 1.599) 3.922 2.178 ( -2.386 -0.865 -1.773) 3.096 2.253 ( 1.756 -0.624 -0.999) 2.115 2.328 ( -1.509 -0.517 -3.690) 4.020 2.350 ( 0.224 -0.981 0.773) 1.269 2.465 ( -4.329 -1.460 1.566) 4.830 2.599 ( -4.215 -7.791 0.009) 8.858 2.665 ( 1.027 -3.326 -5.375) 6.404 2.712 ( -1.373 0.291 -1.407) 1.987 2.772 ( -0.869 -2.923 -6.547) 7.222 2.886 ( 0.204 0.241 4.478) 4.489 3.239 ( -0.482 2.643 -1.008) 2.870 3.414 ( -2.607 3.997 -4.740) 6.727 3.600 ( 2.279 1.052 1.847) 3.116 3.706 ( 3.813 2.149 2.822) 5.208 4.938 ( -2.476 -2.567 0.343) 3.583 5.480 ( -0.898 -11.326 -3.307) 11.833 5.568 ( -0.391 0.089 3.570) 3.592 5.720 ( -4.925 0.116 -0.713) 4.978 5.833 ( -2.186 -3.900 0.572) 4.508 5.948 ( -4.816 -7.195 1.867) 8.857 6.070 ( -3.432 -9.632 1.690) 10.363 6.097 ( -2.078 -8.685 1.833) 9.116 6.533 ( 7.077 3.008 -2.688) 8.145 6.740 ( 0.249 -2.319 -1.074) 2.567 6.785 ( 2.671 0.882 -1.573) 3.223 6.978 ( 1.233 -9.843 -0.462) 9.930 7.367 ( -6.140 0.300 2.197) 6.528 7.751 ( 2.785 0.068 0.447) 2.821 8.011 ( -8.732 3.993 -1.340) 9.695 8.457 ( -3.401 4.390 2.314) 6.016 8.766 ( 8.352 1.652 1.265) 8.607 9.737 ( -1.471 3.975 -0.797) 4.313 ======================= Grid point 179 (69/199) ======================= q-point: ( 0.33 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.938 ( 1.860 -2.323 3.761) 4.796 1.016 ( 8.498 -8.086 0.420) 11.738 1.188 ( 7.200 -8.020 4.308) 11.607 1.390 ( 2.032 -7.109 6.446) 9.809 1.676 ( -2.662 -3.098 -2.365) 4.720 1.726 ( -2.149 -2.355 -5.310) 6.194 1.753 ( -1.465 -5.016 -1.315) 5.388 1.819 ( -2.591 -5.155 -4.680) 7.429 1.886 ( 0.434 -3.834 1.956) 4.326 2.009 ( 0.749 -2.764 3.027) 4.167 2.232 ( -2.733 -1.125 -0.583) 3.013 2.303 ( 4.081 -5.291 2.831) 7.257 2.317 ( -0.122 -0.667 -5.125) 5.169 2.398 ( -0.461 -1.850 0.625) 2.007 2.540 ( 0.323 -7.625 1.665) 7.811 2.657 ( 0.593 -0.908 -1.019) 1.488 2.752 ( 2.380 -2.467 1.773) 3.859 2.764 ( -1.963 -5.131 2.080) 5.874 2.857 ( -0.716 -4.476 -4.862) 6.647 2.927 ( 0.709 -7.661 0.269) 7.698 3.190 ( -1.097 0.273 -1.974) 2.275 3.333 ( -1.180 2.733 -1.548) 3.356 3.593 ( 1.795 0.900 1.044) 2.264 3.680 ( 2.805 2.615 1.740) 4.211 5.005 ( -1.346 -5.207 -0.770) 5.434 5.577 ( -0.443 -1.245 1.584) 2.063 5.624 ( -2.579 -1.860 -3.535) 4.754 5.711 ( -3.083 -3.100 1.588) 4.652 5.860 ( -3.514 -0.757 0.892) 3.704 6.019 ( -2.763 -5.514 6.509) 8.967 6.325 ( 0.469 -13.344 -0.841) 13.378 6.362 ( -4.790 -18.163 -3.694) 19.143 6.525 ( 2.330 -0.441 -0.531) 2.430 6.715 ( 3.736 4.016 -3.707) 6.621 6.870 ( 1.027 -6.140 2.570) 6.735 7.197 ( -0.582 -11.680 0.881) 11.728 7.328 ( -6.858 -0.587 0.641) 6.913 7.761 ( 0.373 -0.201 -1.354) 1.418 7.895 ( -3.708 3.712 -0.938) 5.330 8.344 ( -3.086 4.595 0.904) 5.609 8.777 ( 8.190 2.375 1.178) 8.609 9.654 ( -1.288 3.334 -0.145) 3.577 ======================= Grid point 180 (70/199) ======================= q-point: ( 0.42 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.919 ( 0.870 3.445 -0.101) 3.554 1.221 ( 5.530 -6.832 2.280) 9.080 1.397 ( 3.560 -8.377 3.268) 9.671 1.556 ( -1.189 -8.698 4.698) 9.957 1.694 ( -2.487 -2.015 -5.593) 6.444 1.765 ( -3.357 -4.061 -1.999) 5.636 1.819 ( -4.033 -3.671 -0.929) 5.532 1.888 ( -3.443 -3.620 -3.892) 6.333 1.950 ( 0.912 -2.258 -0.182) 2.442 2.073 ( 0.867 -2.818 4.060) 5.017 2.221 ( -4.262 -1.066 -2.279) 4.950 2.303 ( -0.325 0.130 -1.775) 1.809 2.415 ( 1.329 -1.122 2.371) 2.941 2.438 ( 0.507 -3.383 -0.729) 3.498 2.590 ( 1.602 1.362 -1.131) 2.388 2.719 ( -1.300 -1.407 -0.876) 2.106 2.787 ( -0.288 1.093 2.822) 3.040 2.825 ( 0.864 -2.531 0.764) 2.781 2.979 ( 0.975 -8.091 -3.594) 8.907 3.078 ( 1.789 -2.361 2.884) 4.135 3.272 ( 1.824 -3.682 0.518) 4.142 3.371 ( 2.554 -12.281 -1.690) 12.657 3.592 ( -0.064 -0.626 0.447) 0.772 3.646 ( 1.668 1.720 0.741) 2.508 5.119 ( -1.085 -6.775 -0.662) 6.893 5.584 ( -4.958 2.264 1.011) 5.543 5.610 ( -0.080 -2.171 -0.168) 2.179 5.732 ( -0.350 0.354 1.352) 1.441 5.859 ( -2.831 -1.739 -0.381) 3.344 6.116 ( 1.127 -2.776 2.680) 4.019 6.496 ( 0.048 -4.149 -0.831) 4.231 6.587 ( 0.845 0.930 -7.344) 7.451 6.693 ( -2.358 -16.649 0.350) 16.818 6.734 ( 1.145 -9.961 3.925) 10.768 7.013 ( 1.608 -7.530 1.968) 7.947 7.310 ( -6.960 -1.692 -0.841) 7.212 7.422 ( -0.649 -11.218 1.477) 11.334 7.772 ( -2.546 -1.963 -3.648) 4.863 7.813 ( -0.447 3.327 0.351) 3.375 8.253 ( -2.609 2.724 0.405) 3.793 8.772 ( 6.508 2.746 1.127) 7.153 9.592 ( -1.041 2.243 -0.182) 2.479 ======================= Grid point 181 (71/199) ======================= q-point: ( 0.50 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.839 ( -0.059 4.316 -0.276) 4.325 1.345 ( 1.727 -3.483 0.505) 3.921 1.530 ( 1.250 -3.783 1.753) 4.352 1.697 ( -1.749 -5.959 -2.103) 6.556 1.764 ( -1.674 -5.201 -3.292) 6.379 1.809 ( -4.734 -2.931 2.024) 5.925 1.863 ( -2.252 -3.408 -2.850) 4.981 1.942 ( -1.900 -4.378 -1.419) 4.978 2.007 ( 1.194 -3.124 -0.196) 3.351 2.113 ( 0.626 -0.957 4.697) 4.834 2.239 ( -3.094 -2.707 -1.304) 4.313 2.306 ( 0.454 -0.578 -0.557) 0.922 2.426 ( 0.150 0.373 2.316) 2.351 2.488 ( -0.439 -1.574 -0.395) 1.681 2.569 ( 2.310 1.604 -0.998) 2.984 2.706 ( -0.945 1.088 -0.259) 1.464 2.750 ( -0.533 2.304 -1.341) 2.719 2.835 ( -0.123 0.701 0.231) 0.748 3.021 ( 0.540 4.508 -0.426) 4.560 3.164 ( 3.277 -5.586 2.483) 6.936 3.362 ( 0.925 -3.568 -1.538) 3.994 3.527 ( 0.630 0.290 -0.056) 0.696 3.639 ( 1.908 -1.655 1.350) 2.864 3.780 ( 0.498 -15.852 0.007) 15.860 5.248 ( -1.217 -6.855 0.011) 6.963 5.495 ( -5.193 3.006 2.986) 6.702 5.650 ( 1.479 -0.840 -1.390) 2.197 5.725 ( -0.085 -0.444 -0.754) 0.879 5.898 ( -1.423 -3.491 -0.008) 3.770 6.134 ( 2.277 1.240 1.173) 2.846 6.483 ( 1.453 5.920 -2.367) 6.539 6.607 ( -1.342 -5.094 -1.476) 5.471 6.941 ( 1.454 -8.221 1.400) 8.465 6.993 ( -1.240 -12.853 2.427) 13.139 7.187 ( -0.820 -8.932 0.979) 9.022 7.311 ( -4.525 -2.881 -2.052) 5.743 7.619 ( 0.848 -8.126 2.573) 8.566 7.739 ( -2.598 2.213 -1.841) 3.878 7.830 ( -0.233 -3.748 -2.259) 4.382 8.208 ( -1.919 0.487 0.385) 2.017 8.748 ( 3.850 2.878 0.834) 4.879 9.553 ( -0.481 1.244 -0.215) 1.351 ======================= Grid point 182 (72/199) ======================= q-point: ( 0.58 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.770 ( -0.059 2.193 -0.183) 2.201 1.385 ( -0.296 -0.383 -1.701) 1.769 1.586 ( 0.153 -1.540 0.926) 1.803 1.777 ( -0.337 -3.440 -5.549) 6.537 1.812 ( -1.477 -2.928 1.593) 3.646 1.860 ( -2.400 -2.877 1.050) 3.891 1.931 ( -1.130 -3.797 -3.209) 5.098 2.017 ( 0.110 -2.889 -0.267) 2.903 2.095 ( 0.371 -5.038 1.390) 5.240 2.147 ( 0.853 -2.359 1.458) 2.901 2.249 ( -0.359 1.144 -0.064) 1.200 2.341 ( 0.035 -2.821 1.549) 3.219 2.405 ( -1.751 1.228 2.858) 3.570 2.501 ( -0.142 -0.209 -0.954) 0.987 2.567 ( 2.055 -0.432 -0.116) 2.103 2.681 ( -1.111 0.854 -1.456) 2.021 2.687 ( -0.143 3.708 -1.845) 4.144 2.812 ( 0.098 1.895 -1.048) 2.167 2.925 ( 0.788 4.357 2.188) 4.939 3.247 ( 4.917 0.554 2.327) 5.468 3.383 ( -5.764 -1.051 -2.689) 6.447 3.521 ( 0.997 0.274 0.097) 1.038 3.705 ( 2.693 -2.884 1.038) 4.080 4.048 ( -0.142 -9.763 0.200) 9.766 5.370 ( -1.283 -6.221 1.015) 6.433 5.428 ( -3.315 0.949 2.290) 4.140 5.643 ( 2.363 2.441 -1.390) 3.670 5.753 ( -0.309 -1.853 -1.829) 2.622 5.969 ( -1.299 -3.943 1.106) 4.296 6.125 ( 2.766 0.626 -0.985) 3.002 6.363 ( -0.098 6.078 -0.493) 6.099 6.688 ( -0.551 -3.342 -0.493) 3.423 7.061 ( 0.115 -2.748 0.201) 2.757 7.149 ( -0.312 -4.484 3.014) 5.412 7.316 ( -2.535 -6.088 -0.807) 6.644 7.411 ( -0.072 -6.680 -1.272) 6.801 7.673 ( 0.991 2.407 2.093) 3.340 7.763 ( -0.823 -4.903 -0.070) 4.972 7.904 ( 0.261 -3.308 -2.585) 4.206 8.204 ( -1.209 -0.872 0.423) 1.550 8.705 ( 0.937 2.938 0.253) 3.094 9.535 ( 0.108 0.438 -0.101) 0.462 ======================= Grid point 183 (73/199) ======================= q-point: (-0.33 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.760 ( 0.478 -1.016 -0.110) 1.128 1.365 ( -0.682 1.874 -1.287) 2.374 1.590 ( -0.038 1.083 -0.047) 1.085 1.832 ( 0.525 -1.168 -4.509) 4.688 1.860 ( -1.681 -2.496 0.801) 3.115 1.912 ( 2.522 -1.658 0.966) 3.169 1.976 ( -0.731 -3.032 -0.131) 3.121 2.055 ( 0.853 -0.524 -0.070) 1.004 2.158 ( 0.494 -0.140 -2.736) 2.784 2.220 ( 1.115 0.665 3.177) 3.432 2.232 ( -1.150 -5.665 -2.320) 6.228 2.360 ( -2.619 1.789 1.026) 3.334 2.400 ( 0.813 -2.046 3.424) 4.071 2.503 ( 0.226 -0.122 -0.976) 1.009 2.591 ( -0.782 5.312 -1.655) 5.618 2.617 ( 1.809 -3.208 -0.102) 3.684 2.666 ( -1.139 -0.102 0.183) 1.158 2.766 ( 0.972 1.757 -0.572) 2.088 2.884 ( -0.450 0.509 1.834) 1.956 3.212 ( 2.570 4.158 0.955) 4.980 3.358 ( -5.241 0.575 -1.260) 5.421 3.524 ( 1.006 0.158 1.087) 1.489 3.756 ( 2.090 -0.368 -0.404) 2.160 4.143 ( -0.655 0.247 0.274) 0.752 5.423 ( -0.570 -1.406 0.352) 1.557 5.480 ( -0.898 -5.490 1.945) 5.893 5.589 ( 1.304 3.965 -0.695) 4.231 5.767 ( -0.149 0.510 -1.044) 1.171 6.017 ( -0.956 -1.479 1.331) 2.208 6.147 ( 1.698 -0.384 -2.856) 3.345 6.265 ( -0.366 2.356 0.784) 2.510 6.730 ( 0.045 -1.219 -0.444) 1.298 7.047 ( -2.199 2.257 -0.115) 3.153 7.242 ( 2.171 -3.751 2.277) 4.895 7.375 ( -1.416 -0.200 -0.358) 1.475 7.506 ( 0.517 -2.598 -1.449) 3.019 7.643 ( 0.645 1.071 1.661) 2.078 7.822 ( 0.767 -0.984 1.412) 1.884 7.944 ( 0.774 -0.176 -2.428) 2.555 8.223 ( -0.284 -1.381 0.369) 1.458 8.645 ( -1.598 2.877 -0.526) 3.333 9.535 ( 0.450 -0.196 0.103) 0.502 ======================= Grid point 184 (74/199) ======================= q-point: (-0.25 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.804 ( 0.498 -2.749 -0.022) 2.794 1.303 ( -0.672 4.033 -0.268) 4.097 1.539 ( 1.145 4.802 1.020) 5.041 1.837 ( 2.252 0.359 -3.839) 4.466 1.876 ( -2.461 -0.113 -1.003) 2.660 1.930 ( 1.423 -0.034 2.524) 2.897 2.024 ( 0.473 2.664 -0.537) 2.759 2.047 ( 0.087 0.442 0.290) 0.536 2.151 ( 3.131 0.751 -1.260) 3.457 2.213 ( -2.790 -0.198 -1.286) 3.078 2.302 ( -2.659 2.333 -2.288) 4.212 2.334 ( -0.212 -4.372 0.220) 4.382 2.414 ( 0.309 2.131 -1.723) 2.758 2.487 ( -0.315 2.374 1.234) 2.694 2.517 ( -0.217 -0.797 0.074) 0.830 2.673 ( 1.030 -0.653 3.024) 3.260 2.704 ( 3.101 -3.416 1.181) 4.763 2.796 ( -0.174 -4.308 -0.424) 4.332 2.884 ( -1.938 -1.636 -0.550) 2.595 3.147 ( 0.936 3.141 2.141) 3.915 3.278 ( -2.347 5.429 -0.617) 5.946 3.524 ( 0.711 0.516 1.269) 1.543 3.740 ( 0.391 2.533 -1.575) 3.009 4.026 ( -0.761 10.992 0.460) 11.028 5.461 ( 0.290 -0.484 -1.347) 1.460 5.494 ( 1.910 3.768 -0.071) 4.226 5.591 ( -1.327 -5.244 2.246) 5.857 5.731 ( 0.140 2.795 0.240) 2.809 6.021 ( 0.452 1.038 -0.705) 1.334 6.122 ( -2.690 0.670 2.208) 3.544 6.303 ( 1.833 -4.101 -3.041) 5.425 6.734 ( 0.306 1.215 -0.720) 1.445 6.975 ( -1.674 3.407 -0.015) 3.796 7.282 ( -0.809 2.439 1.665) 3.062 7.294 ( 1.371 7.308 1.001) 7.502 7.534 ( 0.671 -0.727 -2.572) 2.755 7.642 ( 0.285 -0.641 2.281) 2.386 7.815 ( 1.548 2.375 1.676) 3.293 7.913 ( 0.711 3.704 -1.901) 4.224 8.259 ( 1.391 -2.135 0.296) 2.566 8.576 ( -3.352 2.409 -1.341) 4.340 9.547 ( 0.489 -0.753 0.313) 0.951 ======================= Grid point 185 (75/199) ======================= q-point: (-0.17 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.861 ( 0.241 -2.553 -0.195) 2.572 1.200 ( 0.073 6.110 0.545) 6.135 1.408 ( 2.140 9.356 4.078) 10.428 1.841 ( 2.122 4.861 -2.619) 5.915 1.852 ( -1.856 0.389 -4.305) 4.705 1.884 ( 2.396 4.946 2.416) 6.004 1.948 ( -1.273 1.909 1.060) 2.528 2.006 ( -1.022 3.373 0.772) 3.608 2.110 ( -1.388 3.514 -0.089) 3.779 2.199 ( -3.859 1.821 -5.900) 7.281 2.264 ( 0.306 -0.374 -0.019) 0.483 2.301 ( 0.729 4.412 -1.549) 4.732 2.430 ( 0.571 -0.310 -1.646) 1.770 2.487 ( -1.408 -3.120 -0.796) 3.514 2.536 ( -0.448 -1.435 0.201) 1.516 2.700 ( 2.685 -0.082 4.007) 4.824 2.754 ( 0.677 -0.160 1.893) 2.016 2.888 ( 1.761 -3.847 -0.952) 4.336 2.960 ( -1.383 -5.944 1.090) 6.199 3.091 ( -4.532 8.194 -0.662) 9.388 3.128 ( 5.199 3.332 2.995) 6.863 3.506 ( -0.049 2.298 -0.209) 2.308 3.672 ( -1.626 3.589 -1.938) 4.391 3.734 ( 0.510 16.204 1.040) 16.245 5.349 ( -1.290 7.134 1.596) 7.423 5.532 ( 2.550 -1.715 -4.015) 5.056 5.679 ( 1.375 0.807 1.978) 2.541 5.689 ( -1.141 -3.633 1.354) 4.041 5.990 ( -0.447 1.563 -0.431) 1.681 6.118 ( -2.877 -1.341 2.840) 4.259 6.406 ( 2.127 -4.985 -4.289) 6.911 6.665 ( -0.046 6.359 -0.691) 6.396 6.899 ( -1.146 3.568 0.442) 3.774 7.062 ( -1.283 14.096 -0.158) 14.155 7.185 ( 0.875 8.009 1.540) 8.202 7.552 ( -0.598 -0.650 -2.043) 2.226 7.637 ( -2.046 2.733 2.010) 3.962 7.777 ( 2.497 1.177 1.657) 3.219 7.816 ( 1.794 6.008 -0.460) 6.287 8.327 ( 3.174 -3.266 0.239) 4.561 8.515 ( -3.904 1.284 -1.932) 4.541 9.571 ( 0.355 -1.312 0.499) 1.448 ======================= Grid point 186 (76/199) ======================= q-point: (-0.08 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.902 ( 1.151 -0.922 -1.405) 2.037 1.062 ( 0.622 8.154 2.610) 8.584 1.217 ( 3.621 11.596 8.602) 14.886 1.621 ( -0.821 13.082 -0.235) 13.110 1.818 ( 0.694 5.612 -1.497) 5.850 1.830 ( -0.852 3.431 -4.100) 5.413 1.908 ( 0.812 2.663 1.793) 3.312 1.915 ( -1.211 4.132 0.142) 4.308 2.009 ( -1.552 5.969 0.723) 6.209 2.129 ( -4.952 1.311 -5.931) 7.837 2.234 ( 1.355 2.950 -1.917) 3.770 2.280 ( 1.745 -0.163 1.066) 2.051 2.386 ( -0.602 3.712 -2.995) 4.807 2.544 ( -3.940 -1.630 -1.868) 4.655 2.571 ( -0.463 -2.266 0.196) 2.321 2.691 ( 4.332 2.078 2.114) 5.249 2.747 ( 1.188 5.779 5.073) 7.781 2.815 ( -0.445 9.017 0.986) 9.082 2.942 ( 0.611 0.687 -0.726) 1.171 3.036 ( -0.026 -2.251 1.371) 2.636 3.206 ( 0.466 -5.113 -0.803) 5.197 3.323 ( -0.170 13.051 -3.649) 13.552 3.554 ( 1.666 2.624 2.779) 4.170 3.618 ( -0.697 1.301 -0.319) 1.510 5.198 ( -2.378 6.732 2.356) 7.518 5.550 ( 2.185 0.982 -2.011) 3.128 5.682 ( 1.706 -0.663 -1.074) 2.122 5.767 ( -1.577 -3.719 1.885) 4.458 5.959 ( -1.235 1.202 -0.369) 1.762 6.134 ( -2.679 -1.939 2.996) 4.462 6.475 ( 1.275 12.356 0.204) 12.423 6.515 ( 2.437 -4.107 -4.812) 6.780 6.742 ( -1.329 16.134 0.914) 16.215 6.806 ( -2.536 5.763 -1.476) 6.467 7.021 ( -1.294 7.881 -1.136) 8.067 7.479 ( -2.889 10.048 -0.665) 10.476 7.537 ( -3.678 1.709 0.320) 4.068 7.726 ( 1.949 3.142 -0.779) 3.778 7.830 ( 4.405 -3.210 4.985) 7.386 8.415 ( 0.725 -3.625 -0.979) 3.824 8.489 ( 0.086 -0.596 -1.015) 1.180 9.604 ( 0.350 -1.878 0.687) 2.030 ======================= Grid point 190 (77/199) ======================= q-point: ( 0.25 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.813 ( 5.896 -0.000 3.638) 6.928 0.867 ( 16.428 -0.000 6.969) 17.845 1.022 ( 12.398 -0.000 -1.835) 12.533 1.228 ( 0.910 -0.000 0.881) 1.266 1.472 ( 15.411 -0.000 2.729) 15.651 1.597 ( 3.063 -0.000 -0.881) 3.187 1.671 ( 4.638 -0.000 3.417) 5.761 1.700 ( -0.350 0.000 0.628) 0.719 1.767 ( -3.676 0.000 -1.416) 3.939 1.948 ( -0.430 0.000 4.922) 4.940 2.186 ( -1.931 0.000 1.205) 2.276 2.220 ( -2.240 0.000 0.552) 2.307 2.304 ( -4.026 0.000 -0.300) 4.037 2.335 ( -0.549 0.000 -3.771) 3.811 2.425 ( -5.668 0.000 -0.099) 5.669 2.489 ( -1.560 0.000 2.501) 2.948 2.624 ( 1.902 -0.000 -12.529) 12.672 2.724 ( -0.900 0.000 -0.285) 0.944 2.731 ( -0.041 0.000 -3.065) 3.066 2.895 ( 0.427 -0.000 5.138) 5.156 3.257 ( -3.321 0.000 -2.531) 4.175 3.429 ( -6.328 0.000 -6.760) 9.260 3.626 ( 2.110 -0.000 1.656) 2.683 3.759 ( 3.810 -0.000 2.614) 4.621 4.902 ( -1.079 0.000 -1.511) 1.857 5.339 ( 2.803 -0.000 -0.541) 2.855 5.587 ( 0.205 -0.000 2.838) 2.846 5.688 ( -0.626 0.000 0.253) 0.676 5.725 ( -7.260 0.000 -2.866) 7.805 5.855 ( -0.487 0.000 0.542) 0.729 5.986 ( -1.256 0.000 -0.421) 1.324 6.004 ( -4.559 0.000 11.086) 11.987 6.616 ( 5.177 -0.000 -1.758) 5.468 6.694 ( -0.626 0.000 1.133) 1.294 6.849 ( 0.905 -0.000 -0.995) 1.345 6.861 ( 5.387 -0.000 -3.397) 6.369 7.337 ( -5.847 0.000 2.353) 6.302 7.768 ( 1.809 -0.000 0.380) 1.848 7.992 ( -8.567 0.000 -3.858) 9.396 8.486 ( -3.449 0.000 4.478) 5.652 8.832 ( 7.982 -0.000 0.655) 8.009 9.764 ( -3.866 0.000 -1.454) 4.130 ======================= Grid point 191 (78/199) ======================= q-point: ( 0.33 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.891 ( 4.422 -3.815 3.802) 6.969 0.965 ( 13.223 -2.508 1.411) 13.532 1.137 ( 9.835 -3.020 0.741) 10.315 1.296 ( 3.313 -4.621 8.010) 9.823 1.627 ( 1.726 -3.143 -3.958) 5.340 1.648 ( 4.338 -3.271 -5.299) 7.590 1.666 ( -3.025 -2.742 -4.846) 6.337 1.726 ( -1.930 -1.640 1.420) 2.904 1.806 ( 0.450 -4.493 2.006) 4.941 1.978 ( 1.934 -1.012 4.605) 5.096 2.151 ( -0.262 -3.108 6.608) 7.307 2.274 ( 1.690 -0.817 -1.807) 2.606 2.308 ( -0.915 -1.386 -1.773) 2.430 2.354 ( 0.609 -3.673 -0.549) 3.763 2.406 ( -5.313 -2.816 1.051) 6.105 2.551 ( -3.513 -6.729 1.636) 7.765 2.689 ( 3.016 -4.379 -7.430) 9.136 2.708 ( 1.402 -0.037 0.487) 1.484 2.762 ( -0.065 -2.507 -4.088) 4.796 2.895 ( 0.635 0.272 4.506) 4.559 3.198 ( -6.736 1.932 -4.113) 8.126 3.368 ( -3.198 2.028 -2.783) 4.700 3.627 ( 1.776 1.078 0.808) 2.230 3.754 ( 3.441 2.497 2.465) 4.915 4.922 ( -0.313 -2.562 -2.247) 3.423 5.476 ( 0.423 -9.707 -1.673) 9.859 5.563 ( -0.726 0.349 0.354) 0.880 5.658 ( -4.997 0.426 0.083) 5.016 5.806 ( -2.324 -4.528 1.034) 5.194 5.905 ( -3.018 -5.088 3.378) 6.812 6.029 ( -2.979 -8.832 4.081) 10.175 6.083 ( -0.673 -9.343 0.448) 9.378 6.594 ( 3.448 3.432 -0.594) 4.901 6.743 ( 0.246 -3.985 0.655) 4.046 6.825 ( 3.930 1.817 -2.934) 5.230 6.991 ( 0.971 -8.433 0.357) 8.496 7.294 ( -6.106 0.708 1.379) 6.299 7.765 ( -0.879 0.614 -1.687) 1.999 7.928 ( -4.078 1.990 -3.533) 5.751 8.424 ( -2.207 4.182 4.545) 6.559 8.865 ( 7.594 1.506 0.308) 7.748 9.706 ( -3.165 2.837 -0.759) 4.317 ======================= Grid point 192 (79/199) ======================= q-point: ( 0.42 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.964 ( 1.982 -0.403 1.314) 2.412 1.131 ( 9.777 -6.105 1.935) 11.688 1.272 ( 6.366 -6.093 0.757) 8.844 1.424 ( 1.712 -5.696 7.537) 9.601 1.630 ( -3.400 -1.468 -2.784) 4.633 1.690 ( -2.770 -2.382 -3.268) 4.901 1.722 ( -4.220 -2.856 -1.197) 5.235 1.789 ( -0.667 -4.746 -3.868) 6.159 1.904 ( 1.530 -3.298 0.166) 3.639 2.003 ( -1.671 -3.406 1.485) 4.074 2.195 ( -3.079 0.441 0.544) 3.158 2.309 ( 0.366 0.033 -3.006) 3.028 2.361 ( 3.092 -4.603 2.631) 6.138 2.399 ( 0.593 -1.411 0.191) 1.543 2.550 ( 1.099 -8.184 0.744) 8.291 2.659 ( -0.387 -3.853 -0.439) 3.897 2.742 ( -1.273 -5.297 1.055) 5.549 2.786 ( 2.629 -2.041 1.398) 3.610 2.848 ( -0.404 -4.060 -3.915) 5.654 2.957 ( 3.947 -8.096 2.714) 9.407 3.155 ( -4.146 -3.261 -3.802) 6.502 3.317 ( -1.093 1.610 -0.481) 2.005 3.611 ( 0.959 1.334 -0.070) 1.645 3.713 ( 2.283 3.292 1.834) 4.406 4.997 ( 0.060 -5.049 -1.945) 5.411 5.547 ( -3.879 -1.239 -0.176) 4.076 5.608 ( -0.266 0.193 -0.480) 0.581 5.685 ( -1.341 -5.528 0.436) 5.705 5.817 ( -3.346 -0.398 1.106) 3.546 6.002 ( -1.278 -6.986 6.879) 9.887 6.308 ( -3.295 -18.146 -1.285) 18.488 6.330 ( 0.364 -14.121 -2.084) 14.279 6.548 ( 1.448 1.851 0.921) 2.524 6.760 ( 4.013 3.724 -3.286) 6.385 6.889 ( 1.570 -6.460 2.651) 7.157 7.189 ( -0.828 -11.263 0.946) 11.333 7.248 ( -6.202 -0.168 -0.198) 6.207 7.737 ( -3.651 0.327 -4.815) 6.052 7.868 ( -0.671 2.534 -1.619) 3.081 8.322 ( -0.792 4.860 4.464) 6.646 8.864 ( 5.893 2.691 0.046) 6.479 9.633 ( -1.948 2.717 -0.405) 3.367 ======================= Grid point 193 (80/199) ======================= q-point: ( 0.50 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.930 ( 0.874 4.136 -0.145) 4.230 1.279 ( 3.272 -4.289 1.856) 5.705 1.441 ( 3.610 -6.584 1.057) 7.583 1.541 ( -1.752 -6.864 2.221) 7.424 1.675 ( -0.772 -4.303 -1.600) 4.655 1.717 ( -3.669 -2.640 -2.559) 5.195 1.771 ( -3.220 -4.182 -3.299) 6.224 1.861 ( -1.002 -3.143 0.651) 3.362 1.959 ( 0.854 -2.673 -0.631) 2.876 2.080 ( -0.184 -3.195 4.346) 5.397 2.167 ( -3.655 -1.193 -2.194) 4.427 2.310 ( 1.321 0.234 -1.043) 1.700 2.425 ( -0.065 -1.372 -0.289) 1.404 2.444 ( 0.557 -2.188 1.717) 2.837 2.610 ( 1.534 0.756 -0.566) 1.801 2.707 ( -0.425 -0.718 -1.262) 1.513 2.779 ( -1.201 0.632 1.318) 1.892 2.834 ( 0.555 -0.982 0.759) 1.359 2.983 ( 0.343 -8.728 -4.733) 9.934 3.098 ( 0.900 -2.407 2.681) 3.714 3.291 ( 1.200 -3.830 0.828) 4.098 3.403 ( 2.793 -15.550 -0.640) 15.812 3.589 ( -0.496 0.653 0.063) 0.822 3.665 ( 1.296 2.199 1.101) 2.780 5.113 ( 0.249 -6.405 -1.353) 6.551 5.518 ( -5.443 1.847 2.739) 6.367 5.614 ( 0.359 -1.698 -1.658) 2.400 5.726 ( -0.664 -0.322 1.371) 1.557 5.833 ( -1.257 -2.374 -0.382) 2.713 6.133 ( 1.185 -4.033 3.597) 5.533 6.498 ( 0.420 -3.484 -0.976) 3.642 6.586 ( 0.027 -1.215 -6.242) 6.359 6.671 ( -1.226 -17.391 0.494) 17.441 6.755 ( 1.596 -6.912 3.911) 8.101 7.037 ( 1.786 -6.970 2.261) 7.542 7.232 ( -5.521 -1.868 -1.346) 5.982 7.414 ( -0.868 -11.615 0.588) 11.662 7.719 ( -4.501 -1.265 -6.719) 8.186 7.820 ( 0.650 1.869 0.398) 2.018 8.242 ( 0.507 3.202 4.566) 5.600 8.831 ( 3.163 3.351 -0.460) 4.631 9.579 ( -0.872 1.828 -0.268) 2.043 ======================= Grid point 194 (81/199) ======================= q-point: ( 0.58 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.839 ( 0.048 4.643 -0.210) 4.648 1.351 ( -0.600 -2.607 -0.735) 2.774 1.545 ( 1.062 -2.952 0.908) 3.266 1.684 ( -0.392 -7.022 0.658) 7.063 1.734 ( -2.319 -2.016 -5.797) 6.561 1.765 ( -3.051 -4.802 1.581) 5.905 1.845 ( -0.104 -4.268 -3.507) 5.525 1.924 ( -0.925 -4.620 -0.189) 4.716 2.026 ( 1.660 -3.027 1.623) 3.815 2.119 ( -0.022 -1.651 4.333) 4.637 2.213 ( -1.049 -3.733 -0.297) 3.889 2.317 ( 1.210 -0.247 -0.038) 1.235 2.424 ( -0.733 1.230 2.474) 2.858 2.480 ( -0.642 -1.613 -0.402) 1.782 2.591 ( 1.318 1.459 -0.685) 2.082 2.696 ( -0.407 1.079 -1.714) 2.066 2.746 ( 0.017 2.142 -0.989) 2.359 2.835 ( 0.003 0.746 0.394) 0.844 3.021 ( -0.307 3.823 -1.456) 4.103 3.196 ( 1.386 -6.691 1.747) 7.053 3.360 ( -0.591 -0.879 -1.669) 1.977 3.540 ( 1.336 0.902 0.511) 1.691 3.660 ( 1.299 -1.980 1.614) 2.866 3.786 ( 0.410 -16.065 0.137) 16.071 5.241 ( 0.058 -6.356 -0.277) 6.362 5.438 ( -4.450 2.367 3.465) 6.116 5.665 ( 1.184 -2.255 -2.876) 3.841 5.722 ( -0.322 0.185 -0.291) 0.472 5.887 ( -0.513 -3.539 0.570) 3.621 6.162 ( 2.146 1.048 2.004) 3.118 6.493 ( 0.297 6.722 -3.744) 7.701 6.596 ( -0.062 -5.516 0.162) 5.519 6.957 ( 0.856 -8.562 1.580) 8.749 6.984 ( -0.358 -13.026 2.302) 13.233 7.173 ( -1.872 -6.058 0.821) 6.394 7.271 ( -1.653 -5.628 -2.121) 6.238 7.618 ( -1.515 -8.908 -0.678) 9.061 7.702 ( -2.434 0.488 -3.347) 4.167 7.836 ( 1.148 -3.014 -0.258) 3.236 8.208 ( 1.638 1.140 4.359) 4.794 8.773 ( 0.272 3.532 -1.256) 3.759 9.549 ( -0.058 0.961 -0.077) 0.966 ======================= Grid point 195 (82/199) ======================= q-point: ( 0.67 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.770 ( 0.051 2.021 -0.152) 2.027 1.378 ( -0.484 -0.441 -2.059) 2.160 1.586 ( -0.208 -1.082 0.326) 1.149 1.770 ( 0.031 -3.521 -5.139) 6.230 1.806 ( -0.034 -4.206 1.794) 4.573 1.830 ( -2.751 -4.439 0.770) 5.279 1.926 ( 0.808 -3.139 -3.678) 4.903 2.015 ( -0.193 -3.953 -0.408) 3.978 2.100 ( 0.193 -4.251 2.373) 4.872 2.159 ( 1.134 -1.575 0.545) 2.016 2.256 ( 1.186 0.335 1.667) 2.073 2.345 ( 0.448 -2.642 1.807) 3.232 2.385 ( -1.803 1.577 3.286) 4.066 2.501 ( 0.123 -0.592 -0.934) 1.113 2.582 ( 0.312 -0.438 -0.432) 0.690 2.665 ( -0.558 1.851 -3.454) 3.959 2.692 ( 0.570 3.386 -0.044) 3.434 2.812 ( 0.015 1.570 -0.932) 1.826 2.932 ( 0.147 4.164 1.773) 4.528 3.301 ( -6.591 -1.050 -2.043) 6.980 3.310 ( 4.949 1.663 0.731) 5.272 3.537 ( 1.312 0.376 0.977) 1.678 3.728 ( 0.759 -3.149 0.746) 3.324 4.047 ( -0.049 -9.383 0.120) 9.384 5.361 ( -0.325 -5.883 1.086) 5.991 5.396 ( -2.050 -0.245 2.116) 2.956 5.666 ( 1.535 2.667 -1.604) 3.471 5.747 ( -0.352 -2.273 -2.198) 3.181 5.957 ( -0.892 -3.509 1.606) 3.961 6.158 ( 2.708 0.355 -0.543) 2.784 6.355 ( -1.219 6.426 -0.951) 6.609 6.689 ( 0.753 -3.332 0.506) 3.453 7.054 ( -0.841 -1.049 -0.150) 1.352 7.155 ( 0.514 -5.806 2.756) 6.448 7.293 ( -1.189 -6.829 -0.496) 6.950 7.407 ( -0.322 -6.905 -1.732) 7.126 7.649 ( -3.814 0.363 -2.880) 4.793 7.774 ( 1.462 -4.664 2.235) 5.374 7.914 ( 1.424 -3.219 -1.228) 3.728 8.215 ( 2.707 -0.173 3.798) 4.668 8.697 ( -2.089 3.487 -2.168) 4.607 9.538 ( 0.320 0.288 0.144) 0.454 ======================= Grid point 196 (83/199) ======================= q-point: (-0.25 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.763 ( 0.010 -1.172 -0.089) 1.175 1.362 ( 0.311 1.950 -1.075) 2.248 1.591 ( 0.183 0.517 -0.029) 0.549 1.836 ( 0.738 -1.985 -4.985) 5.416 1.842 ( -1.162 -1.753 1.178) 2.411 1.934 ( 0.734 -2.363 1.337) 2.812 1.962 ( -1.311 -3.464 -1.272) 3.917 2.063 ( 0.334 -0.743 0.075) 0.818 2.171 ( 2.103 -0.160 -3.507) 4.092 2.210 ( -1.746 -5.176 0.893) 5.536 2.231 ( -0.332 1.591 1.296) 2.078 2.341 ( -0.681 2.232 1.386) 2.714 2.418 ( 1.644 -2.882 3.693) 4.965 2.505 ( 0.257 0.253 -1.321) 1.370 2.569 ( -2.050 4.093 -2.675) 5.302 2.645 ( 2.019 -2.234 1.082) 3.200 2.655 ( -0.461 -0.678 0.086) 0.824 2.779 ( 1.131 1.394 -0.523) 1.870 2.877 ( -0.936 1.506 1.868) 2.576 3.211 ( -3.113 3.340 -1.345) 4.760 3.334 ( 1.902 1.228 0.287) 2.282 3.542 ( 1.632 0.283 2.036) 2.625 3.764 ( -0.841 -0.220 -0.952) 1.289 4.138 ( -0.070 0.433 0.212) 0.488 5.421 ( 0.258 -2.407 0.019) 2.421 5.472 ( -0.733 -5.560 2.247) 6.042 5.600 ( 0.389 4.468 -0.805) 4.557 5.766 ( 0.157 0.425 -1.151) 1.237 6.006 ( -0.903 -2.032 1.466) 2.664 6.164 ( 1.207 2.485 -3.006) 4.082 6.260 ( -0.473 0.326 0.962) 1.120 6.737 ( 0.953 -1.042 0.160) 1.421 7.027 ( -0.886 2.425 -0.624) 2.656 7.257 ( -0.243 -3.861 2.077) 4.391 7.368 ( 0.409 -0.472 0.186) 0.651 7.504 ( -0.554 -3.010 -1.979) 3.644 7.625 ( -3.036 -0.100 -0.465) 3.073 7.839 ( 1.133 -0.943 1.992) 2.478 7.957 ( 1.391 -0.003 -1.258) 1.875 8.247 ( 3.995 -0.901 3.049) 5.106 8.611 ( -3.479 3.234 -2.919) 5.575 9.540 ( 0.310 -0.248 0.312) 0.505 ======================= Grid point 197 (84/199) ======================= q-point: (-0.17 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.805 ( -0.455 -2.797 -0.004) 2.834 1.306 ( 1.341 4.080 -0.181) 4.298 1.555 ( 1.077 4.030 1.671) 4.494 1.845 ( -2.160 0.808 -2.896) 3.702 1.866 ( 2.849 -0.911 -2.592) 3.958 1.940 ( -0.210 -0.172 2.749) 2.763 2.009 ( -2.701 0.654 -2.093) 3.479 2.050 ( 0.622 2.283 1.740) 2.938 2.151 ( -4.263 3.484 0.457) 5.525 2.191 ( 0.312 -0.754 -4.063) 4.144 2.287 ( 0.779 2.307 -1.132) 2.685 2.327 ( -0.940 -5.616 0.790) 5.749 2.416 ( 0.346 4.847 -2.912) 5.664 2.487 ( 0.157 0.616 1.220) 1.376 2.514 ( -0.154 -0.347 -0.163) 0.413 2.672 ( -0.629 -2.224 2.478) 3.389 2.764 ( 5.159 -3.479 3.709) 7.244 2.796 ( 0.178 -4.068 -0.433) 4.095 2.855 ( -2.737 -1.017 -1.610) 3.335 3.139 ( -1.656 2.620 0.999) 3.256 3.288 ( 3.301 4.971 0.266) 5.973 3.541 ( 1.773 1.067 1.993) 2.873 3.726 ( -2.505 2.734 -2.279) 4.352 4.024 ( 0.313 11.015 0.414) 11.027 5.457 ( -0.763 2.197 -0.990) 2.528 5.517 ( 1.809 1.160 -0.880) 2.322 5.575 ( -1.633 -5.423 2.786) 6.312 5.736 ( 0.660 2.419 0.296) 2.525 6.022 ( -0.156 0.856 -0.575) 1.043 6.095 ( -2.056 1.537 1.055) 2.776 6.322 ( 1.636 -4.393 -2.163) 5.163 6.737 ( 0.115 1.649 -0.677) 1.786 6.965 ( 0.073 3.333 -0.227) 3.341 7.252 ( -2.688 5.269 0.771) 5.965 7.331 ( 2.924 4.657 2.328) 5.971 7.521 ( -2.492 -0.554 -2.976) 3.921 7.625 ( -2.443 -1.510 1.908) 3.448 7.829 ( 0.315 2.255 0.932) 2.460 7.927 ( 1.397 3.672 -0.700) 3.991 8.302 ( 4.620 -1.800 1.845) 5.290 8.531 ( -3.071 2.466 -2.933) 4.911 9.552 ( 0.099 -0.768 0.401) 0.872 ======================= Grid point 198 (85/199) ======================= q-point: (-0.08 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.859 ( -0.586 -2.856 -0.166) 2.920 1.218 ( 2.683 6.139 0.636) 6.730 1.443 ( 2.807 8.357 4.802) 10.039 1.812 ( -3.269 0.586 -4.065) 5.249 1.852 ( -0.900 8.586 -1.900) 8.840 1.909 ( 0.734 2.729 0.940) 2.978 1.935 ( -0.402 0.731 1.411) 1.639 1.997 ( -0.337 3.304 1.036) 3.479 2.070 ( -4.332 2.414 -0.977) 5.055 2.143 ( -4.296 3.092 -5.718) 7.792 2.276 ( 1.138 0.848 -0.017) 1.419 2.324 ( 2.845 3.138 -1.171) 4.395 2.426 ( -1.576 -2.710 -0.905) 3.263 2.469 ( -0.519 0.113 -1.612) 1.697 2.531 ( -0.315 -1.396 -0.082) 1.433 2.723 ( 0.494 -2.407 4.164) 4.834 2.767 ( 1.114 1.902 1.082) 2.455 2.893 ( -1.831 -2.966 -0.864) 3.591 2.956 ( 1.364 -7.317 1.520) 7.596 3.058 ( -0.440 6.329 0.660) 6.378 3.201 ( 6.150 4.921 1.696) 8.057 3.512 ( 0.913 3.886 0.132) 3.994 3.643 ( -2.503 3.257 -2.126) 4.625 3.748 ( 1.257 14.960 0.723) 15.030 5.328 ( -2.221 7.335 0.947) 7.722 5.558 ( 2.147 -1.429 -3.390) 4.260 5.668 ( -2.226 -4.942 3.078) 6.233 5.699 ( 1.428 1.489 0.721) 2.185 5.977 ( -1.690 1.961 -0.354) 2.613 6.093 ( -1.269 -1.211 1.396) 2.242 6.429 ( 2.029 -5.204 -3.266) 6.470 6.660 ( -0.744 6.079 -1.071) 6.218 6.893 ( 0.162 4.483 0.501) 4.514 7.043 ( -1.725 13.395 0.236) 13.508 7.197 ( 0.625 9.624 1.130) 9.711 7.518 ( -4.402 -0.818 -1.589) 4.751 7.609 ( -2.302 3.526 3.056) 5.203 7.777 ( -0.631 1.932 -0.397) 2.070 7.855 ( 2.386 3.517 0.625) 4.296 8.359 ( -0.442 -1.905 -1.688) 2.583 8.496 ( 3.043 0.202 -0.202) 3.056 9.573 ( -0.099 -1.374 0.444) 1.448 ======================= Grid point 203 (86/199) ======================= q-point: ( 0.33 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.850 ( 1.451 -0.000 0.018) 1.452 1.052 ( 12.508 -0.000 3.903) 13.103 1.203 ( 15.613 -0.000 2.184) 15.765 1.255 ( 3.555 -0.000 6.021) 6.992 1.592 ( -2.866 0.000 -4.780) 5.574 1.594 ( 2.536 -0.000 -8.077) 8.465 1.687 ( 2.715 -0.000 -3.535) 4.458 1.722 ( 2.871 -0.000 3.260) 4.344 1.732 ( -2.460 0.000 0.047) 2.460 1.993 ( 1.353 -0.000 4.504) 4.703 2.159 ( -2.712 0.000 1.581) 3.140 2.172 ( -1.746 0.000 11.820) 11.948 2.297 ( 1.771 -0.000 -0.805) 1.945 2.327 ( -0.171 0.000 -4.025) 4.029 2.356 ( -4.642 0.000 -0.358) 4.656 2.473 ( -1.451 0.000 2.437) 2.837 2.665 ( 5.653 -0.000 -11.435) 12.756 2.714 ( -0.744 0.000 -0.263) 0.790 2.741 ( 2.087 -0.000 0.148) 2.092 2.905 ( 0.640 -0.000 4.741) 4.784 3.156 ( -12.597 0.000 -6.301) 14.085 3.369 ( -2.425 0.000 -2.200) 3.275 3.648 ( 1.179 -0.000 0.266) 1.209 3.803 ( 2.990 -0.000 2.370) 3.815 4.897 ( 0.335 -0.000 -3.423) 3.439 5.373 ( 2.780 -0.000 -0.507) 2.826 5.584 ( -0.789 0.000 -0.643) 1.018 5.642 ( -5.671 0.000 -1.214) 5.800 5.680 ( -0.689 0.000 0.894) 1.128 5.849 ( -0.480 0.000 -0.195) 0.518 5.970 ( -2.733 0.000 12.470) 12.766 5.970 ( -1.244 0.000 -0.458) 1.326 6.658 ( 2.566 -0.000 -0.186) 2.573 6.688 ( -0.397 0.000 1.218) 1.281 6.858 ( 0.665 -0.000 -0.967) 1.173 6.923 ( 4.749 -0.000 -1.867) 5.103 7.268 ( -5.568 0.000 1.230) 5.702 7.761 ( -3.010 0.000 -3.775) 4.828 7.926 ( -1.895 0.000 -3.584) 4.054 8.459 ( -1.672 0.000 6.053) 6.279 8.925 ( 6.972 -0.000 -0.217) 6.976 9.712 ( -4.301 0.000 -1.027) 4.421 ======================= Grid point 204 (87/199) ======================= q-point: ( 0.42 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.919 ( 1.273 -4.697 0.088) 4.868 1.129 ( 11.017 -1.301 2.844) 11.452 1.247 ( 9.164 -0.619 0.244) 9.188 1.357 ( 3.981 -2.976 8.784) 10.093 1.596 ( -5.425 -1.970 -3.586) 6.795 1.618 ( -0.865 -1.300 -4.016) 4.309 1.686 ( -2.442 0.344 0.051) 2.467 1.708 ( 2.930 -2.225 -4.850) 6.087 1.837 ( 3.361 -4.941 -0.847) 6.036 1.945 ( -5.752 0.196 -0.159) 5.758 2.186 ( 1.825 -1.329 8.079) 8.389 2.276 ( -1.069 -3.008 -1.296) 3.445 2.318 ( -0.934 -5.026 -0.710) 5.161 2.350 ( 0.300 -3.916 3.736) 5.421 2.376 ( 2.389 -3.481 -1.521) 4.487 2.521 ( -1.558 -5.555 2.554) 6.309 2.704 ( 0.956 -0.720 -1.941) 2.281 2.752 ( 3.313 -4.374 -6.908) 8.822 2.772 ( 3.350 -1.204 1.543) 3.879 2.914 ( 2.403 -0.551 4.571) 5.194 3.071 ( -12.671 -0.612 -5.971) 14.020 3.343 ( -0.981 1.388 -0.874) 1.911 3.641 ( 0.474 1.102 -0.648) 1.363 3.791 ( 2.235 2.706 2.272) 4.181 4.923 ( 0.632 -2.515 -3.025) 3.985 5.482 ( 0.539 -6.704 -0.645) 6.756 5.550 ( -1.288 -1.147 -2.968) 3.432 5.611 ( -2.258 0.084 1.190) 2.553 5.779 ( -2.160 -4.069 1.480) 4.839 5.875 ( -2.482 -4.133 3.990) 6.258 6.008 ( -1.165 -8.383 4.503) 9.587 6.079 ( -0.064 -9.853 0.950) 9.899 6.625 ( 2.043 3.461 0.681) 4.076 6.748 ( 0.492 -4.913 1.630) 5.200 6.868 ( 3.201 1.187 -3.294) 4.744 7.000 ( 0.196 -6.583 0.868) 6.643 7.226 ( -4.861 0.926 0.331) 4.960 7.725 ( -4.587 0.878 -6.735) 8.196 7.905 ( -0.080 1.465 -2.173) 2.622 8.414 ( -0.191 3.809 6.650) 7.666 8.945 ( 5.313 1.846 -0.573) 5.653 9.665 ( -3.170 1.897 -0.788) 3.778 ======================= Grid point 205 (88/199) ======================= q-point: ( 0.50 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.984 ( 0.963 -0.143 -0.101) 0.979 1.234 ( 5.652 -3.019 2.528) 6.888 1.357 ( 8.324 -4.603 0.238) 9.515 1.417 ( -3.552 -4.040 2.402) 5.891 1.594 ( -4.181 -2.270 0.023) 4.758 1.663 ( -3.257 -1.139 -1.948) 3.963 1.673 ( 0.835 -3.361 -1.736) 3.874 1.793 ( 0.834 -3.721 1.540) 4.113 1.903 ( -0.740 -3.117 -4.110) 5.212 1.998 ( 0.588 -4.619 2.902) 5.486 2.162 ( -2.248 1.961 -1.006) 3.148 2.313 ( 0.317 -1.329 -1.771) 2.237 2.369 ( -0.900 -2.381 -0.064) 2.546 2.421 ( 2.092 -2.034 2.838) 4.070 2.566 ( 1.277 -7.776 0.056) 7.881 2.646 ( -1.296 -6.248 0.743) 6.424 2.737 ( -0.011 -2.599 0.022) 2.599 2.816 ( 1.891 -1.208 1.145) 2.519 2.837 ( -0.335 -4.122 -4.670) 6.238 3.008 ( 1.274 -5.185 3.262) 6.256 3.105 ( -0.856 -11.046 -2.620) 11.385 3.307 ( -0.531 1.423 0.202) 1.532 3.615 ( -0.206 1.519 -1.062) 1.865 3.737 ( 1.316 3.635 1.907) 4.311 5.002 ( 1.060 -5.001 -2.464) 5.675 5.502 ( -2.943 -0.092 -0.521) 2.990 5.604 ( -0.636 0.023 0.735) 0.972 5.676 ( -0.284 -5.341 -0.156) 5.350 5.787 ( -1.568 -1.040 0.665) 1.996 5.994 ( -1.155 -8.294 7.047) 10.945 6.279 ( -1.367 -17.377 -1.023) 17.461 6.337 ( 0.993 -14.747 -0.783) 14.801 6.565 ( 1.213 3.019 1.669) 3.657 6.802 ( 3.079 3.717 -2.756) 5.558 6.905 ( 0.491 -6.863 2.360) 7.274 7.173 ( -2.506 -8.245 -1.178) 8.697 7.191 ( -2.122 -2.677 1.183) 3.615 7.678 ( -4.770 0.286 -8.489) 9.742 7.865 ( -0.003 2.333 -1.011) 2.543 8.333 ( 1.644 4.641 7.261) 8.773 8.916 ( 2.515 3.364 -1.161) 4.358 9.611 ( -1.476 1.985 -0.511) 2.526 ======================= Grid point 206 (89/199) ======================= q-point: ( 0.58 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.937 ( 0.104 4.505 -0.281) 4.514 1.294 ( -1.074 -2.198 0.624) 2.524 1.477 ( 0.707 -4.515 -0.412) 4.589 1.536 ( 2.429 -7.495 1.379) 7.999 1.639 ( -5.722 -4.984 2.068) 7.865 1.690 ( 0.257 -2.096 -5.705) 6.083 1.756 ( 1.166 -4.527 -1.415) 4.884 1.853 ( -0.528 -2.634 0.145) 2.690 1.977 ( 2.246 -3.292 1.910) 4.419 2.079 ( -0.563 -2.921 4.042) 5.019 2.137 ( -0.765 -1.858 -2.446) 3.166 2.327 ( 1.454 0.142 0.041) 1.462 2.418 ( -0.737 -2.645 -1.895) 3.337 2.451 ( 0.159 -0.167 2.729) 2.739 2.624 ( 0.819 0.653 -0.059) 1.049 2.705 ( 0.063 -0.545 -1.548) 1.642 2.762 ( -1.650 -0.243 0.175) 1.677 2.839 ( 0.237 -0.539 0.667) 0.890 2.980 ( -0.100 -7.948 -4.903) 9.339 3.103 ( -0.348 -3.382 1.903) 3.896 3.301 ( 0.336 -3.060 0.869) 3.199 3.434 ( 2.144 -17.407 0.352) 17.542 3.581 ( -0.812 1.389 -0.319) 1.640 3.679 ( 0.926 2.437 1.527) 3.021 5.121 ( 1.300 -6.138 -1.801) 6.527 5.463 ( -3.710 2.238 3.205) 5.389 5.614 ( -0.188 -1.906 -2.343) 3.027 5.720 ( -0.412 -0.930 1.380) 1.714 5.828 ( 0.355 -2.486 -0.056) 2.511 6.149 ( 0.872 -5.067 4.352) 6.736 6.502 ( 0.385 -3.452 -1.460) 3.768 6.582 ( 0.203 -1.588 -4.595) 4.866 6.664 ( 0.137 -17.513 0.940) 17.539 6.776 ( 1.281 -5.428 3.148) 6.404 7.050 ( -0.560 -6.482 1.904) 6.779 7.186 ( -1.319 -2.016 -1.154) 2.672 7.402 ( -1.179 -11.642 -0.245) 11.704 7.662 ( -3.759 -1.558 -8.426) 9.357 7.825 ( 0.124 1.115 0.344) 1.174 8.271 ( 3.325 3.257 7.501) 8.828 8.847 ( -0.432 4.036 -2.086) 4.564 9.572 ( -0.295 1.404 -0.218) 1.451 ======================= Grid point 207 (90/199) ======================= q-point: (-0.33 -0.67 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.839 ( -0.082 4.684 -0.175) 4.688 1.334 ( -1.860 -2.869 -1.802) 3.865 1.552 ( -0.279 -2.760 0.118) 2.777 1.688 ( 1.096 -6.486 2.544) 7.053 1.712 ( -1.161 -3.461 -2.036) 4.180 1.730 ( -1.879 -3.618 -3.785) 5.563 1.857 ( 2.188 -4.383 -2.660) 5.574 1.918 ( 0.024 -4.459 -0.436) 4.480 2.047 ( 1.387 -2.442 2.729) 3.915 2.126 ( 0.840 -2.555 4.053) 4.864 2.214 ( 1.164 -4.265 0.334) 4.434 2.333 ( 1.241 0.038 0.422) 1.311 2.414 ( -1.130 2.076 2.480) 3.426 2.473 ( -0.525 -2.021 -0.662) 2.191 2.598 ( -0.079 1.612 -0.675) 1.749 2.692 ( -0.266 1.327 -2.001) 2.416 2.747 ( 0.175 1.362 -1.063) 1.736 2.836 ( 0.142 0.976 0.651) 1.181 3.012 ( -0.846 3.006 -2.413) 3.947 3.195 ( -1.737 -5.624 1.351) 6.039 3.356 ( 0.248 -0.752 -1.363) 1.576 3.554 ( 0.648 0.610 0.531) 1.036 3.672 ( 0.297 -1.701 1.820) 2.509 3.791 ( 0.340 -16.019 0.291) 16.025 5.248 ( 1.094 -5.867 -0.528) 5.991 5.399 ( -2.371 1.774 3.389) 4.500 5.672 ( 0.469 -3.594 -3.482) 5.026 5.718 ( -0.165 1.053 0.064) 1.068 5.886 ( 0.318 -3.209 0.982) 3.371 6.188 ( 1.658 0.721 2.876) 3.397 6.480 ( -1.770 6.500 -4.852) 8.302 6.609 ( 1.878 -5.069 1.251) 5.548 6.959 ( -0.397 -9.615 1.439) 9.730 6.995 ( 1.703 -11.695 2.611) 12.103 7.146 ( -2.324 -5.440 -0.104) 5.917 7.266 ( 0.743 -6.147 -1.630) 6.403 7.582 ( -3.774 -5.893 -3.187) 7.689 7.682 ( -0.465 -3.628 -2.867) 4.647 7.851 ( 1.063 -3.246 0.388) 3.438 8.253 ( 4.667 1.436 6.955) 8.498 8.755 ( -2.678 4.032 -3.095) 5.745 9.550 ( 0.170 0.775 0.051) 0.795 ======================= Grid point 208 (91/199) ======================= q-point: (-0.25 -0.67 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.770 ( -0.014 2.004 -0.142) 2.009 1.371 ( -0.468 -1.285 -2.408) 2.770 1.585 ( 0.065 -0.890 0.402) 0.979 1.771 ( 0.664 -3.499 -5.379) 6.451 1.792 ( -2.166 -3.280 -0.049) 3.931 1.819 ( 1.158 -6.066 2.260) 6.576 1.938 ( 1.359 -2.159 -2.852) 3.827 2.013 ( -0.141 -4.457 -0.581) 4.497 2.102 ( -0.219 -3.300 2.895) 4.395 2.180 ( 2.396 -1.066 0.053) 2.623 2.274 ( 1.272 0.557 2.113) 2.528 2.355 ( 0.949 -2.441 1.330) 2.937 2.371 ( -0.832 0.792 3.949) 4.113 2.502 ( 0.237 -0.940 -0.879) 1.309 2.573 ( -1.632 0.191 -1.142) 2.001 2.658 ( -0.390 1.484 -2.658) 3.069 2.702 ( 1.185 3.505 -0.512) 3.735 2.810 ( -0.229 1.425 -0.589) 1.559 2.932 ( -0.212 3.912 1.446) 4.176 3.219 ( -6.296 0.394 -1.632) 6.516 3.371 ( 4.680 0.138 -0.016) 4.682 3.553 ( 1.107 -0.013 1.212) 1.641 3.722 ( -1.855 -2.767 0.643) 3.393 4.049 ( 0.352 -9.246 0.166) 9.254 5.363 ( 0.509 -5.220 1.040) 5.347 5.385 ( -0.099 -1.152 1.831) 2.166 5.674 ( -0.020 3.016 -1.004) 3.179 5.743 ( 0.173 -2.739 -2.706) 3.854 5.951 ( -0.269 -3.001 1.663) 3.441 6.188 ( 2.130 -0.016 0.145) 2.135 6.333 ( -2.259 6.504 -1.506) 7.048 6.705 ( 1.732 -3.108 0.921) 3.675 7.048 ( 0.204 -0.558 -0.398) 0.715 7.158 ( -0.648 -5.646 2.835) 6.350 7.289 ( 0.674 -7.431 -0.397) 7.472 7.402 ( -0.299 -6.533 -2.020) 6.845 7.596 ( -4.177 -0.708 -2.642) 4.993 7.790 ( 0.851 -4.666 0.927) 4.832 7.930 ( 1.028 -3.211 -0.504) 3.409 8.272 ( 5.519 0.185 5.622) 7.881 8.657 ( -3.778 3.711 -3.756) 6.492 9.542 ( 0.130 0.242 0.212) 0.347 ======================= Grid point 209 (92/199) ======================= q-point: (-0.17 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.760 ( -0.460 -0.994 -0.097) 1.100 1.370 ( 1.181 1.405 -1.279) 2.237 1.593 ( 0.090 0.241 0.450) 0.519 1.833 ( -0.327 -1.551 -0.556) 1.680 1.841 ( 0.316 -2.984 -4.200) 5.162 1.929 ( -1.000 -3.658 1.054) 3.936 1.952 ( -0.337 -0.159 -0.513) 0.634 2.063 ( -0.311 -0.851 -0.129) 0.916 2.186 ( -0.979 -2.759 -1.991) 3.540 2.202 ( 1.938 -2.332 0.434) 3.063 2.220 ( -1.343 3.746 1.312) 4.191 2.343 ( 0.757 1.853 1.011) 2.243 2.445 ( 2.115 -3.387 3.924) 5.598 2.507 ( 0.420 0.951 -1.937) 2.198 2.539 ( -2.433 2.953 -2.159) 4.393 2.647 ( -0.493 0.137 0.530) 0.737 2.672 ( 1.708 -2.923 0.112) 3.387 2.789 ( 0.335 0.186 -1.116) 1.180 2.867 ( -0.700 2.617 2.556) 3.724 3.164 ( -3.393 1.277 -0.775) 3.707 3.376 ( 4.085 2.197 -0.200) 4.643 3.567 ( 2.246 0.029 2.163) 3.118 3.734 ( -3.812 -0.019 -1.217) 4.002 4.142 ( 0.560 0.480 0.245) 0.777 5.430 ( 1.162 -2.737 -0.058) 2.974 5.466 ( -0.459 -4.879 2.158) 5.354 5.597 ( -0.777 4.456 -0.377) 4.539 5.769 ( 0.421 0.276 -1.341) 1.432 6.000 ( -0.176 -2.126 1.149) 2.423 6.167 ( -0.293 5.163 -2.889) 5.924 6.258 ( -0.024 -2.224 1.127) 2.493 6.750 ( 0.941 -0.503 -0.025) 1.067 7.028 ( 1.242 2.481 -0.582) 2.835 7.241 ( -2.394 -3.290 2.166) 4.609 7.384 ( 1.971 -1.199 0.415) 2.344 7.490 ( -1.416 -2.463 -2.224) 3.608 7.585 ( -3.020 -0.628 0.473) 3.120 7.848 ( 0.246 -0.783 0.943) 1.250 7.968 ( 0.422 -0.029 -0.907) 1.000 8.310 ( 4.863 -0.480 3.144) 5.811 8.567 ( -2.643 2.935 -3.140) 5.046 9.542 ( -0.131 -0.241 0.248) 0.369 ======================= Grid point 210 (93/199) ======================= q-point: (-0.08 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.795 ( -1.040 -2.736 -0.062) 2.928 1.332 ( 2.728 3.593 -0.265) 4.519 1.566 ( 0.521 2.991 1.903) 3.583 1.819 ( -1.612 1.973 -3.683) 4.478 1.899 ( 2.391 -2.166 -2.733) 4.228 1.931 ( -1.431 0.210 2.681) 3.046 1.966 ( -3.497 0.676 -1.761) 3.973 2.060 ( 0.221 0.895 1.790) 2.013 2.094 ( -4.130 6.019 1.774) 7.512 2.177 ( -1.981 2.112 -4.900) 5.692 2.310 ( 1.996 0.106 -0.261) 2.016 2.312 ( -1.297 -4.023 0.288) 4.237 2.419 ( 0.494 5.131 -2.166) 5.591 2.494 ( 0.942 -0.215 1.333) 1.646 2.513 ( -0.084 -0.042 -0.611) 0.618 2.668 ( -0.352 -2.378 2.234) 3.282 2.792 ( -1.223 -6.098 -1.108) 6.317 2.816 ( -0.657 2.225 1.187) 2.606 2.831 ( 3.046 -4.784 0.902) 5.743 3.129 ( 0.115 1.732 1.788) 2.492 3.339 ( 4.625 4.182 -0.265) 6.241 3.568 ( 2.361 1.489 2.012) 3.441 3.680 ( -4.418 2.453 -2.413) 5.600 4.032 ( 0.865 10.818 0.342) 10.858 5.441 ( -1.711 4.405 -0.481) 4.750 5.531 ( -0.095 -1.758 -0.834) 1.948 5.562 ( -0.127 -4.000 2.825) 4.899 5.746 ( 0.790 2.026 -0.170) 2.181 6.017 ( -0.633 1.749 -0.349) 1.892 6.076 ( -0.928 1.185 -0.052) 1.506 6.339 ( 1.281 -4.734 -1.302) 5.074 6.733 ( -0.734 2.375 -1.222) 2.770 6.978 ( 2.075 3.498 0.138) 4.069 7.221 ( -2.647 4.926 1.732) 5.854 7.365 ( 2.388 5.142 1.667) 5.909 7.473 ( -4.539 0.359 -2.653) 5.270 7.602 ( -1.362 -1.897 3.172) 3.939 7.826 ( -0.700 2.627 -0.079) 2.719 7.936 ( 0.056 3.130 -1.037) 3.298 8.335 ( -0.685 -0.174 -1.832) 1.963 8.527 ( 3.626 0.757 0.535) 3.743 9.550 ( -0.399 -0.774 0.207) 0.895 ======================= Grid point 216 (94/199) ======================= q-point: ( 0.42 0.42 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.863 ( 0.779 -0.000 -0.160) 0.796 1.164 ( 5.910 -0.000 1.288) 6.049 1.316 ( 2.803 -0.000 9.623) 10.023 1.383 ( 13.261 -0.000 2.645) 13.522 1.537 ( -5.157 0.000 -3.574) 6.274 1.563 ( -1.046 0.000 -6.585) 6.668 1.703 ( -0.674 0.000 -1.347) 1.506 1.749 ( 0.682 -0.000 1.118) 1.310 1.764 ( 6.776 -0.000 -7.061) 9.787 1.922 ( -9.655 0.000 0.053) 9.655 2.129 ( -2.048 0.000 1.984) 2.852 2.206 ( 0.862 -0.000 12.019) 12.050 2.296 ( -0.917 0.000 -3.301) 3.426 2.324 ( 0.205 -0.000 -4.117) 4.122 2.366 ( 4.816 -0.000 5.340) 7.191 2.460 ( -0.942 0.000 2.495) 2.667 2.706 ( -0.443 0.000 -0.296) 0.533 2.723 ( 4.794 -0.000 -9.265) 10.432 2.787 ( 4.618 -0.000 2.433) 5.220 2.925 ( 1.551 -0.000 3.331) 3.674 2.975 ( -13.559 0.000 -5.251) 14.540 3.352 ( -0.553 0.000 -0.932) 1.084 3.653 ( -0.434 0.000 -1.412) 1.477 3.832 ( 1.452 -0.000 2.240) 2.669 4.901 ( 0.884 -0.000 -3.333) 3.448 5.402 ( 1.930 -0.000 -0.477) 1.989 5.560 ( -2.489 0.000 -4.505) 5.147 5.603 ( -0.738 0.000 1.045) 1.280 5.674 ( -0.543 0.000 1.463) 1.560 5.843 ( -0.363 0.000 -0.891) 0.963 5.956 ( -0.837 0.000 -0.239) 0.871 5.956 ( -1.338 0.000 13.444) 13.511 6.686 ( -0.177 0.000 1.268) 1.281 6.689 ( 2.611 -0.000 1.646) 3.086 6.863 ( 0.365 -0.000 -0.934) 1.003 6.964 ( 1.816 -0.000 -1.478) 2.341 7.211 ( -3.523 0.000 0.254) 3.532 7.702 ( -5.173 0.000 -8.929) 10.320 7.920 ( 0.419 -0.000 -1.634) 1.686 8.457 ( 0.370 -0.000 7.352) 7.362 8.993 ( 3.968 -0.000 -0.851) 4.058 9.664 ( -3.114 0.000 -0.981) 3.265 ======================= Grid point 217 (95/199) ======================= q-point: ( 0.50 0.42 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.928 ( 0.063 -4.737 -0.456) 4.760 1.216 ( 3.767 -2.020 2.209) 4.811 1.330 ( -3.472 -1.687 5.125) 6.415 1.402 ( 9.289 2.261 0.016) 9.560 1.517 ( -6.906 -1.494 -1.999) 7.344 1.630 ( 1.592 -1.330 -0.072) 2.075 1.686 ( 2.713 2.023 0.006) 3.384 1.735 ( 3.034 -3.066 -0.381) 4.330 1.827 ( -4.262 -1.945 -6.995) 8.419 1.916 ( 0.999 -4.674 1.149) 4.916 2.183 ( -2.728 -0.393 3.172) 4.203 2.258 ( -1.718 -2.160 -2.458) 3.696 2.285 ( -0.947 -6.489 0.666) 6.591 2.384 ( 2.503 -3.231 3.232) 5.210 2.411 ( 1.929 -3.436 0.693) 4.000 2.517 ( 0.192 -5.585 3.567) 6.630 2.711 ( 0.223 -0.866 -0.626) 1.092 2.771 ( 0.730 -2.382 -6.900) 7.336 2.816 ( 2.302 -0.328 1.694) 2.877 2.908 ( -11.721 -3.394 -5.489) 13.380 2.985 ( 8.982 -2.370 5.521) 10.806 3.336 ( -0.239 1.320 -0.724) 1.524 3.637 ( -1.105 0.980 -1.972) 2.464 3.810 ( 0.596 2.744 2.196) 3.565 4.932 ( 1.334 -2.598 -2.893) 4.111 5.485 ( 0.173 -3.199 -1.139) 3.400 5.533 ( -0.978 -3.288 -2.363) 4.165 5.606 ( 0.975 -0.573 0.012) 1.131 5.759 ( -1.203 -3.560 1.735) 4.139 5.849 ( -2.555 -3.463 4.364) 6.129 6.007 ( 0.287 -8.394 3.933) 9.274 6.084 ( 0.682 -10.325 2.354) 10.612 6.650 ( 2.105 3.540 1.781) 4.487 6.757 ( 0.603 -5.362 2.746) 6.054 6.894 ( 1.500 0.607 -3.927) 4.247 6.992 ( -1.664 -5.291 0.234) 5.551 7.186 ( -1.318 0.775 0.408) 1.582 7.657 ( -5.165 0.764 -10.509) 11.735 7.905 ( 0.093 1.594 -1.066) 1.920 8.430 ( 1.692 3.325 7.905) 8.741 8.986 ( 1.402 2.333 -1.273) 3.005 9.634 ( -1.574 1.286 -0.868) 2.210 ======================= Grid point 218 (96/199) ======================= q-point: (-0.42 -0.58 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.982 ( -1.426 -0.309 -0.723) 1.628 1.254 ( -2.615 -1.062 2.413) 3.713 1.369 ( -3.551 -4.924 -0.244) 6.076 1.469 ( 8.023 -2.935 0.616) 8.565 1.515 ( -6.669 -2.937 0.714) 7.323 1.647 ( 0.906 -1.908 -2.585) 3.338 1.697 ( 1.271 -2.048 0.244) 2.422 1.806 ( 1.500 -2.147 0.058) 2.620 1.914 ( 3.317 -5.368 0.301) 6.317 2.004 ( -0.394 -3.753 1.537) 4.075 2.140 ( -1.028 1.728 -1.760) 2.673 2.306 ( -1.173 -3.477 -2.475) 4.426 2.361 ( 0.002 -1.627 0.527) 1.710 2.445 ( 1.372 -1.435 3.255) 3.813 2.579 ( 0.806 -8.059 -0.013) 8.099 2.637 ( -0.242 -5.084 1.051) 5.197 2.733 ( -0.580 -1.019 -0.871) 1.460 2.802 ( -2.693 -2.708 -3.846) 5.419 2.860 ( 2.563 -3.173 0.167) 4.082 2.963 ( -5.292 -7.970 -0.659) 9.590 3.160 ( 6.651 -9.844 2.619) 12.165 3.303 ( -0.096 1.531 -0.055) 1.535 3.604 ( -1.405 1.362 -1.701) 2.592 3.747 ( 0.183 3.521 1.941) 4.024 5.017 ( 1.714 -5.041 -2.469) 5.869 5.480 ( -0.495 0.967 -0.511) 1.201 5.591 ( -1.671 -0.596 0.685) 1.902 5.677 ( 0.499 -3.631 0.113) 3.666 5.784 ( 0.907 -2.202 0.093) 2.383 5.985 ( -1.379 -9.740 6.891) 12.011 6.272 ( 0.228 -16.385 -0.575) 16.397 6.353 ( 1.772 -15.135 0.104) 15.239 6.584 ( 1.824 3.790 2.508) 4.897 6.825 ( 0.781 4.599 -3.130) 5.617 6.901 ( -1.321 -7.594 2.419) 8.078 7.148 ( -0.883 -6.912 -2.442) 7.384 7.187 ( 0.742 -4.070 2.455) 4.810 7.615 ( -4.089 -0.256 -10.771) 11.524 7.862 ( -0.459 2.394 -0.447) 2.479 8.371 ( 3.349 4.091 8.463) 9.979 8.921 ( -1.465 3.961 -2.123) 4.727 9.600 ( -0.203 1.563 -0.561) 1.673 ======================= Grid point 219 (97/199) ======================= q-point: (-0.33 -0.58 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.930 ( -1.315 3.978 -0.416) 4.210 1.264 ( -3.291 -2.283 -0.012) 4.006 1.454 ( -3.440 -5.487 -1.165) 6.581 1.560 ( -6.744 -6.581 1.328) 9.516 1.599 ( 6.326 -4.748 1.173) 7.996 1.706 ( 2.765 -1.759 -4.459) 5.533 1.776 ( 1.558 -4.814 0.012) 5.060 1.858 ( 1.816 -2.397 -1.814) 3.512 2.012 ( 2.644 -2.480 4.196) 5.545 2.076 ( -0.315 -3.428 3.726) 5.073 2.146 ( 2.498 -2.631 -2.315) 4.304 2.341 ( 0.660 -0.249 0.524) 0.878 2.408 ( -0.563 -3.173 -2.282) 3.949 2.452 ( -0.289 1.064 2.644) 2.864 2.629 ( -0.043 1.075 0.071) 1.078 2.704 ( -0.042 -0.645 -1.807) 1.920 2.741 ( -1.783 -1.187 -0.301) 2.163 2.839 ( -0.311 -1.257 -0.065) 1.297 2.974 ( -0.200 -5.793 -3.759) 6.909 3.094 ( -1.117 -5.019 1.347) 5.315 3.301 ( -0.376 -2.143 0.867) 2.342 3.451 ( 0.539 -16.873 0.780) 16.899 3.570 ( -0.946 1.041 -0.671) 1.559 3.689 ( 0.404 2.316 1.734) 2.922 5.139 ( 1.804 -6.022 -1.720) 6.517 5.437 ( -1.064 2.783 2.910) 4.165 5.607 ( -0.632 -2.406 -2.358) 3.428 5.720 ( 0.252 -1.058 1.132) 1.570 5.840 ( 1.572 -2.207 0.308) 2.727 6.161 ( 0.541 -5.872 4.847) 7.633 6.503 ( -0.013 -3.016 -2.340) 3.817 6.580 ( -0.234 -1.823 -3.663) 4.099 6.677 ( 1.590 -15.936 1.741) 16.109 6.795 ( 1.733 -6.386 2.745) 7.163 7.026 ( -2.993 -5.754 1.339) 6.623 7.198 ( 2.878 -2.152 -0.667) 3.655 7.387 ( -1.109 -11.045 -0.537) 11.114 7.618 ( -2.090 -2.268 -8.940) 9.457 7.825 ( -0.122 0.452 0.575) 0.741 8.328 ( 4.750 2.873 8.346) 10.023 8.820 ( -3.566 4.430 -3.147) 6.499 9.572 ( 0.257 1.275 -0.222) 1.319 ======================= Grid point 220 (98/199) ======================= q-point: (-0.25 -0.58 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.837 ( -0.245 4.349 -0.242) 4.363 1.308 ( -1.920 -3.557 -1.942) 4.484 1.535 ( -2.615 -4.348 -0.561) 5.105 1.682 ( -2.020 -7.540 0.096) 7.807 1.720 ( 2.698 -4.349 0.649) 5.159 1.737 ( 3.130 -0.636 -3.295) 4.589 1.883 ( 2.139 -4.546 -1.814) 5.342 1.927 ( 1.479 -3.401 -0.973) 3.834 2.062 ( 0.708 -1.680 2.767) 3.313 2.149 ( 2.477 -3.464 4.201) 5.982 2.239 ( 2.762 -3.944 0.327) 4.826 2.345 ( 0.663 -0.030 0.552) 0.863 2.404 ( -0.804 2.617 2.249) 3.543 2.466 ( -0.492 -2.471 -1.009) 2.714 2.590 ( -1.143 2.025 -0.750) 2.443 2.683 ( -1.032 1.460 -2.056) 2.725 2.748 ( 0.222 0.491 -1.043) 1.173 2.840 ( 0.369 1.197 0.916) 1.552 2.998 ( -1.017 2.111 -3.081) 3.871 3.162 ( -3.572 -2.580 1.865) 4.785 3.359 ( 0.168 -3.354 -1.371) 3.628 3.557 ( -0.155 -0.005 0.490) 0.514 3.670 ( -0.703 -0.751 1.722) 2.005 3.794 ( 0.086 -16.038 0.440) 16.044 5.265 ( 1.674 -5.549 -0.273) 5.802 5.389 ( 0.328 1.394 2.556) 2.930 5.670 ( -0.503 -3.885 -2.464) 4.628 5.719 ( 0.189 1.271 -0.431) 1.356 5.896 ( 1.198 -2.618 1.003) 3.049 6.206 ( 0.897 0.428 3.686) 3.818 6.448 ( -2.576 6.099 -5.184) 8.409 6.636 ( 2.106 -4.774 0.908) 5.296 6.958 ( 0.148 -10.106 0.982) 10.155 7.021 ( 1.678 -9.395 4.410) 10.513 7.124 ( -0.694 -7.626 -1.236) 7.757 7.281 ( 1.897 -4.713 -1.756) 5.376 7.533 ( -3.441 -3.952 -2.989) 6.033 7.683 ( 0.735 -5.664 -2.586) 6.269 7.862 ( 0.676 -3.538 0.320) 3.616 8.323 ( 5.408 1.285 7.078) 9.000 8.708 ( -4.456 4.108 -3.755) 7.129 9.552 ( 0.137 0.799 -0.011) 0.811 ======================= Grid point 221 (99/199) ======================= q-point: (-0.17 -0.58 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.770 ( 0.087 2.142 -0.161) 2.150 1.362 ( -0.607 -2.346 -2.553) 3.520 1.584 ( -0.614 -1.601 0.736) 1.866 1.768 ( 0.246 -2.930 -3.954) 4.928 1.787 ( 1.056 -3.032 -1.403) 3.504 1.845 ( 2.704 -5.342 1.949) 6.297 1.950 ( 0.836 -0.934 -2.040) 2.394 2.011 ( 0.001 -4.237 -0.607) 4.280 2.101 ( -0.255 -2.516 3.020) 3.939 2.216 ( 3.472 -0.644 -0.231) 3.539 2.284 ( 0.010 1.933 1.257) 2.305 2.362 ( 0.182 -0.350 0.747) 0.845 2.383 ( 1.966 -2.889 4.643) 5.811 2.504 ( 0.013 -1.451 -1.002) 1.764 2.546 ( -2.439 1.054 -1.272) 2.945 2.647 ( -1.008 1.108 -2.369) 2.803 2.717 ( 1.044 2.998 -1.020) 3.334 2.806 ( -0.288 1.864 -0.007) 1.886 2.930 ( -0.402 3.615 1.133) 3.809 3.150 ( -4.753 -0.029 -0.312) 4.763 3.419 ( 2.985 -0.872 -0.734) 3.195 3.566 ( 0.739 -0.978 0.460) 1.309 3.689 ( -3.199 -1.617 0.918) 3.700 4.054 ( 0.410 -9.397 0.339) 9.412 5.376 ( 1.564 -4.733 0.998) 5.084 5.395 ( 1.345 -1.267 1.373) 2.302 5.664 ( -1.437 2.989 -0.102) 3.319 5.745 ( 0.431 -2.680 -2.741) 3.858 5.954 ( 0.655 -2.533 1.171) 2.867 6.209 ( 1.146 -0.549 1.295) 1.815 6.301 ( -2.550 6.570 -2.404) 7.446 6.727 ( 1.424 -2.726 0.358) 3.097 7.059 ( 1.362 -1.055 -0.108) 1.726 7.147 ( -1.251 -4.639 3.109) 5.723 7.309 ( 2.746 -7.490 -0.216) 7.980 7.396 ( -0.441 -5.786 -2.229) 6.216 7.551 ( -2.584 -1.192 -0.909) 2.987 7.799 ( 0.650 -4.432 0.171) 4.483 7.937 ( 0.204 -3.026 -0.725) 3.118 8.340 ( 4.199 0.487 3.989) 5.812 8.609 ( -3.113 3.118 -2.769) 5.204 9.541 ( -0.171 0.315 0.035) 0.361 ======================= Grid point 222 (100/199) ======================= q-point: (-0.08 0.42 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.754 ( -0.444 -0.550 -0.128) 0.718 1.383 ( 0.879 0.227 -1.779) 1.997 1.595 ( 0.098 0.309 1.082) 1.130 1.830 ( -0.272 -1.342 0.999) 1.695 1.836 ( -0.016 -3.073 -6.848) 7.506 1.927 ( -0.098 -0.882 2.501) 2.654 1.949 ( 0.419 -0.204 -0.771) 0.901 2.055 ( -0.853 -0.676 -0.315) 1.133 2.170 ( -1.143 -3.309 0.377) 3.521 2.204 ( -1.248 5.162 2.795) 6.001 2.230 ( 1.988 -0.382 -2.992) 3.612 2.357 ( 1.273 1.330 0.807) 2.010 2.465 ( 0.045 -2.106 2.784) 3.491 2.510 ( -1.584 1.799 -1.237) 2.697 2.516 ( 1.315 0.564 -1.356) 1.971 2.641 ( -0.479 -0.831 -0.176) 0.975 2.688 ( 0.824 -1.992 -0.235) 2.168 2.782 ( -1.236 -0.395 -1.856) 2.264 2.868 ( 0.414 2.494 3.192) 4.072 3.137 ( -0.980 -0.508 0.732) 1.325 3.423 ( 3.351 1.948 -0.440) 3.901 3.594 ( 1.336 -0.560 0.318) 1.483 3.679 ( -4.112 0.434 -0.313) 4.146 4.149 ( 0.555 0.411 0.340) 0.770 5.443 ( 0.537 -2.476 0.642) 2.614 5.468 ( 0.752 -3.296 1.181) 3.581 5.582 ( -1.381 3.778 0.281) 4.033 5.773 ( 0.325 0.083 -1.388) 1.428 6.004 ( 0.681 -1.988 0.602) 2.186 6.155 ( -1.219 6.113 -2.485) 6.710 6.260 ( 0.272 -3.483 1.055) 3.650 6.755 ( -0.068 0.231 -0.903) 0.934 7.055 ( 3.041 2.376 -0.032) 3.859 7.209 ( -2.964 -2.722 2.579) 4.780 7.413 ( 2.698 -1.306 0.246) 3.007 7.466 ( -2.122 -1.221 -1.858) 3.073 7.561 ( -0.798 -1.171 2.187) 2.606 7.848 ( -0.325 -0.364 0.222) 0.537 7.966 ( -0.541 0.064 -1.514) 1.609 8.339 ( -0.919 1.045 -1.635) 2.147 8.563 ( 2.495 0.872 1.195) 2.900 9.538 ( -0.447 -0.174 -0.024) 0.480 ======================= Grid point 229 (101/199) ======================= q-point: (-0.50 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.868 ( -0.003 0.000 -0.009) 0.009 1.213 ( 2.184 -0.000 2.475) 3.301 1.274 ( -9.376 0.000 4.139) 10.249 1.444 ( -6.247 0.000 -1.621) 6.453 1.545 ( 9.352 -0.000 2.519) 9.686 1.610 ( 6.585 -0.000 -0.608) 6.613 1.714 ( 2.352 -0.000 -4.577) 5.146 1.731 ( -3.691 0.000 -1.293) 3.911 1.800 ( -3.171 0.000 -1.463) 3.492 1.843 ( 2.001 -0.000 -3.639) 4.153 2.119 ( 0.155 -0.000 2.279) 2.284 2.197 ( -2.284 0.000 7.657) 7.991 2.288 ( -1.791 0.000 -1.848) 2.574 2.326 ( 0.669 -0.000 -4.146) 4.199 2.408 ( 0.436 -0.000 6.174) 6.189 2.454 ( -0.370 0.000 2.591) 2.618 2.703 ( -0.024 0.000 -0.330) 0.331 2.740 ( -3.970 0.000 -7.943) 8.880 2.816 ( -3.285 0.000 -1.789) 3.741 2.829 ( 1.393 -0.000 -1.101) 1.775 3.030 ( 11.300 -0.000 5.793) 12.698 3.348 ( 0.031 -0.000 -1.421) 1.421 3.636 ( -2.026 0.000 -2.636) 3.324 3.841 ( -0.455 0.000 2.203) 2.250 4.915 ( 1.948 -0.000 -2.900) 3.494 5.416 ( 0.298 -0.000 -0.433) 0.526 5.539 ( -0.112 0.000 -4.136) 4.138 5.610 ( 1.588 -0.000 -0.218) 1.603 5.671 ( 0.047 -0.000 1.767) 1.768 5.838 ( -0.381 0.000 -1.295) 1.350 5.951 ( -0.013 0.000 -0.411) 0.411 5.957 ( -0.488 0.000 14.807) 14.815 6.686 ( 0.042 -0.000 1.309) 1.309 6.728 ( 3.514 -0.000 4.082) 5.386 6.865 ( 0.028 -0.000 -0.930) 0.930 6.959 ( -2.152 0.000 -3.250) 3.898 7.192 ( 0.357 -0.000 0.743) 0.824 7.629 ( -5.323 0.000 -12.049) 13.173 7.922 ( -0.242 0.000 -0.824) 0.859 8.478 ( 1.936 -0.000 7.828) 8.064 9.013 ( -0.719 0.000 -1.272) 1.461 9.640 ( -0.482 0.000 -1.091) 1.193 ======================= Grid point 230 (102/199) ======================= q-point: (-0.42 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.916 ( -2.097 -3.911 -0.617) 4.480 1.209 ( -8.419 -0.722 4.188) 9.431 1.264 ( -2.241 -3.218 0.447) 3.947 1.405 ( -8.583 -0.989 0.304) 8.645 1.546 ( 9.423 2.314 0.535) 9.718 1.641 ( 0.476 0.587 -1.176) 1.398 1.688 ( -1.158 0.658 -0.663) 1.487 1.777 ( -2.721 -3.067 -4.508) 6.094 1.828 ( 10.067 -3.900 3.107) 11.234 1.915 ( -1.560 -4.997 -3.163) 6.117 2.148 ( -2.538 -0.432 3.607) 4.432 2.234 ( -1.564 -1.024 -5.262) 5.584 2.294 ( 1.181 -6.673 3.458) 7.608 2.411 ( 0.028 -6.550 -2.030) 6.857 2.421 ( 1.554 -1.642 5.508) 5.954 2.514 ( -1.682 -6.278 3.914) 7.587 2.702 ( -2.750 -0.884 -3.584) 4.604 2.728 ( -3.355 -1.440 -4.416) 5.730 2.816 ( -2.832 -1.263 0.294) 3.114 2.861 ( 4.263 -1.635 -1.243) 4.732 3.117 ( 10.692 -1.624 4.591) 11.749 3.335 ( 0.470 1.320 -1.765) 2.253 3.613 ( -2.380 0.747 -2.522) 3.548 3.808 ( -1.183 2.547 2.180) 3.555 4.952 ( 2.442 -2.489 -2.592) 4.344 5.487 ( 0.099 -3.726 -1.236) 3.927 5.525 ( 0.340 -1.427 -2.023) 2.498 5.629 ( 2.805 -1.177 -0.836) 3.155 5.755 ( 0.298 -3.812 1.852) 4.249 5.820 ( -2.721 -2.616 4.768) 6.082 6.020 ( 1.326 -8.646 2.560) 9.113 6.101 ( 1.608 -10.930 4.486) 11.924 6.679 ( 2.369 3.220 2.343) 4.633 6.766 ( 0.299 -4.528 4.172) 6.164 6.896 ( -0.430 1.905 -4.812) 5.193 6.967 ( -1.817 -6.653 -0.648) 6.927 7.194 ( 2.000 0.460 1.404) 2.487 7.587 ( -4.729 0.344 -12.786) 13.637 7.901 ( -0.853 1.680 -0.536) 1.959 8.465 ( 2.840 2.812 7.994) 8.938 8.974 ( -3.237 2.598 -1.693) 4.482 9.629 ( 0.746 1.178 -1.004) 1.719 ======================= Grid point 231 (103/199) ======================= q-point: (-0.33 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.944 ( -4.766 -0.863 -0.756) 4.902 1.194 ( -6.588 -2.488 2.690) 7.538 1.323 ( -5.016 -4.673 -0.968) 6.923 1.405 ( -7.484 -4.153 1.272) 8.653 1.588 ( 8.050 -1.127 0.551) 8.147 1.675 ( 3.599 -2.658 -2.099) 4.942 1.700 ( -0.085 -2.738 -0.711) 2.830 1.827 ( 1.603 -2.477 -2.273) 3.725 1.976 ( 4.151 -5.565 4.430) 8.236 1.987 ( -0.714 -2.939 0.566) 3.077 2.139 ( 1.294 -0.215 -1.764) 2.198 2.287 ( -1.198 -4.487 -3.449) 5.785 2.367 ( 0.424 -1.009 1.902) 2.195 2.461 ( 0.884 -0.769 3.106) 3.320 2.581 ( -0.788 -8.351 0.021) 8.388 2.640 ( 0.439 -2.516 0.710) 2.651 2.720 ( -1.556 -0.869 -1.961) 2.649 2.767 ( -1.583 -5.591 -4.327) 7.245 2.855 ( -3.683 -6.589 2.352) 7.906 2.944 ( 2.445 -5.213 -0.030) 5.758 3.227 ( 3.184 -5.515 1.621) 6.571 3.310 ( 1.717 1.413 -0.598) 2.302 3.580 ( -2.313 0.957 -1.692) 3.021 3.744 ( -0.980 2.964 1.934) 3.672 5.039 ( 2.302 -4.871 -2.019) 5.753 5.490 ( 1.978 2.067 -0.493) 2.904 5.566 ( -2.419 -1.321 0.195) 2.763 5.691 ( 1.862 -2.256 0.363) 2.948 5.805 ( 2.391 -2.724 -0.006) 3.624 5.974 ( -1.282 -11.296 6.478) 13.085 6.281 ( 1.211 -15.450 -0.450) 15.504 6.378 ( 2.129 -14.468 0.711) 14.641 6.615 ( 3.015 3.862 3.169) 5.835 6.808 ( -2.775 3.127 -4.119) 5.869 6.891 ( -0.469 -5.745 3.617) 6.805 7.142 ( 0.163 -9.366 -2.368) 9.663 7.215 ( 3.460 -1.993 2.763) 4.856 7.564 ( -2.627 -1.248 -11.965) 12.313 7.853 ( -1.071 2.208 0.042) 2.454 8.423 ( 3.933 3.458 8.064) 9.615 8.879 ( -5.043 4.102 -2.501) 6.965 9.604 ( 0.935 1.694 -0.661) 2.045 ======================= Grid point 232 (104/199) ======================= q-point: (-0.25 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.905 ( -2.449 2.309 -0.658) 3.430 1.224 ( -3.262 -3.374 0.942) 4.787 1.396 ( -6.123 -6.277 -1.035) 8.830 1.495 ( -3.380 -8.610 0.545) 9.265 1.673 ( 5.314 -2.789 -0.137) 6.003 1.743 ( 3.582 -1.855 -2.502) 4.747 1.796 ( 2.114 -5.223 -0.907) 5.707 1.887 ( 2.687 -2.413 -1.322) 3.845 2.032 ( -0.172 -2.113 1.726) 2.734 2.091 ( 2.749 -3.952 5.372) 7.214 2.190 ( 4.953 -2.893 -1.672) 5.975 2.343 ( -0.274 -0.932 0.361) 1.036 2.401 ( -0.295 -3.112 -1.828) 3.621 2.449 ( -0.400 1.847 2.126) 2.844 2.623 ( -0.809 1.737 -0.007) 1.916 2.699 ( -0.749 0.105 -2.335) 2.455 2.720 ( -1.481 -2.970 -0.033) 3.319 2.833 ( -0.639 -2.385 -0.549) 2.529 2.967 ( -0.689 -3.856 -2.533) 4.665 3.082 ( -1.035 -5.422 1.531) 5.728 3.294 ( -0.810 -0.991 0.811) 1.515 3.449 ( -0.944 -15.368 0.611) 15.409 3.556 ( -1.293 -0.209 -0.917) 1.599 3.691 ( -0.423 1.948 1.673) 2.602 5.161 ( 2.019 -5.926 -0.861) 6.320 5.441 ( 1.402 3.105 1.657) 3.788 5.596 ( -0.773 -2.914 -1.819) 3.521 5.728 ( 0.813 -0.512 0.857) 1.287 5.865 ( 2.484 -1.881 0.521) 3.159 6.170 ( 0.308 -6.256 5.138) 8.101 6.498 ( -0.366 -1.291 -3.468) 3.719 6.568 ( -1.315 -3.518 -3.039) 4.831 6.699 ( 1.581 -12.914 1.206) 13.066 6.833 ( 4.355 -9.013 4.154) 10.838 6.989 ( -3.156 -5.275 1.183) 6.259 7.241 ( 4.033 -2.086 -1.285) 4.719 7.379 ( 0.110 -9.549 0.315) 9.555 7.598 ( -0.138 -3.284 -8.612) 9.218 7.823 ( -0.300 -0.273 0.724) 0.830 8.392 ( 4.432 2.437 7.131) 8.743 8.759 ( -5.693 4.286 -3.038) 7.746 9.576 ( 0.516 1.485 -0.333) 1.607 ======================= Grid point 233 (105/199) ======================= q-point: (-0.17 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.834 ( -0.151 3.668 -0.397) 3.693 1.286 ( -1.437 -4.134 -1.129) 4.520 1.489 ( -4.653 -6.140 -0.600) 7.727 1.677 ( 1.491 -8.901 -0.777) 9.059 1.743 ( 1.638 -2.133 -2.642) 3.770 1.797 ( 5.886 -1.222 1.002) 6.094 1.904 ( 1.667 -4.396 -1.367) 4.896 1.948 ( 1.920 -2.181 -0.912) 3.046 2.069 ( 0.131 -1.507 2.151) 2.629 2.191 ( 3.692 -4.007 4.122) 6.833 2.276 ( 3.072 -2.327 -0.601) 3.900 2.349 ( -0.127 -0.364 0.414) 0.566 2.401 ( 0.239 2.374 2.477) 3.439 2.458 ( -0.756 -2.593 -1.570) 3.124 2.572 ( -1.505 2.394 -0.494) 2.871 2.663 ( -1.778 1.393 -2.434) 3.321 2.749 ( -0.048 0.136 -0.626) 0.643 2.847 ( 0.798 1.061 0.943) 1.628 2.984 ( -0.881 1.303 -3.178) 3.546 3.118 ( -3.803 -0.237 2.805) 4.731 3.350 ( -1.674 -5.444 -1.395) 5.864 3.552 ( -0.580 -0.535 0.438) 0.902 3.660 ( -0.976 -0.174 1.288) 1.625 3.792 ( -0.466 -16.192 0.521) 16.207 5.288 ( 2.121 -5.520 0.568) 5.941 5.407 ( 2.316 1.335 0.890) 2.818 5.659 ( -0.955 -3.307 -0.986) 3.581 5.720 ( 0.046 1.073 -0.753) 1.312 5.917 ( 2.062 -1.966 0.715) 2.937 6.215 ( -0.129 0.307 4.425) 4.438 6.413 ( -2.273 6.023 -5.626) 8.550 6.657 ( 1.157 -5.119 -0.028) 5.248 6.963 ( 0.447 -9.656 0.733) 9.694 7.033 ( -0.390 -6.848 5.453) 8.762 7.139 ( 3.231 -11.096 -0.921) 11.593 7.308 ( 2.857 -2.685 -2.424) 4.610 7.502 ( -1.121 -3.132 -1.251) 3.554 7.694 ( 1.366 -6.094 -2.323) 6.663 7.867 ( 0.162 -3.582 -0.116) 3.587 8.383 ( 3.174 1.426 4.150) 5.415 8.649 ( -4.425 3.332 -2.003) 5.891 9.553 ( 0.075 0.988 -0.195) 1.010 ======================= Grid point 234 (106/199) ======================= q-point: (-0.08 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.773 ( 0.475 2.325 -0.183) 2.380 1.352 ( -0.781 -2.920 -2.147) 3.708 1.567 ( -2.180 -3.514 0.399) 4.154 1.785 ( 2.564 -2.080 -4.027) 5.207 1.804 ( 2.048 -2.138 -0.225) 2.969 1.887 ( 3.860 -3.846 1.355) 5.615 1.954 ( 0.121 -0.132 -1.391) 1.403 2.012 ( 0.319 -3.305 -0.401) 3.344 2.102 ( 0.009 -2.143 2.713) 3.458 2.260 ( 3.655 0.352 -0.785) 3.755 2.278 ( -1.007 2.565 0.226) 2.765 2.366 ( 0.353 -0.930 0.243) 1.025 2.415 ( 2.438 -2.950 4.833) 6.164 2.493 ( -1.951 -2.083 -1.703) 3.324 2.521 ( -0.884 1.496 -0.257) 1.756 2.632 ( -1.091 0.668 -2.562) 2.864 2.721 ( -0.190 2.277 -1.111) 2.541 2.804 ( 0.001 3.157 0.322) 3.174 2.925 ( -0.583 3.226 0.798) 3.374 3.107 ( -2.277 -1.310 1.350) 2.954 3.436 ( -0.326 -2.756 -0.658) 2.852 3.561 ( -1.771 -1.308 -1.522) 2.677 3.666 ( 0.004 -0.505 1.718) 1.791 4.057 ( -0.099 -9.749 0.489) 9.762 5.402 ( 2.335 -4.068 0.351) 4.703 5.417 ( 2.009 -1.107 1.269) 2.622 5.643 ( -1.894 3.105 0.661) 3.696 5.746 ( -0.092 -2.604 -2.071) 3.329 5.969 ( 1.585 -2.116 0.384) 2.671 6.214 ( -0.882 -0.951 3.529) 3.760 6.273 ( -1.124 6.468 -4.409) 7.908 6.737 ( 0.368 -2.220 -0.684) 2.352 7.064 ( -1.260 -3.033 0.519) 3.325 7.151 ( 2.164 -2.795 3.349) 4.870 7.354 ( 4.057 -7.306 0.455) 8.369 7.386 ( -0.366 -4.202 -2.525) 4.915 7.537 ( 0.211 -1.421 0.937) 1.715 7.806 ( 0.424 -3.889 -0.087) 3.913 7.934 ( -0.447 -2.726 -1.462) 3.125 8.360 ( -1.317 1.827 -1.425) 2.665 8.591 ( 0.306 0.959 1.757) 2.025 9.539 ( -0.210 0.467 -0.204) 0.551 ======================= Grid point 242 (107/199) ======================= q-point: (-0.42 -0.42 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.858 ( -1.905 0.000 -0.262) 1.923 1.125 ( -14.003 0.000 3.986) 14.559 1.231 ( -0.706 0.000 1.754) 1.891 1.352 ( -8.093 0.000 1.152) 8.174 1.625 ( -1.053 0.000 -2.700) 2.898 1.649 ( -2.445 0.000 -5.333) 5.867 1.685 ( 0.878 -0.000 1.593) 1.819 1.689 ( -1.248 0.000 -1.775) 2.170 1.838 ( 2.612 -0.000 -1.584) 3.055 1.889 ( 8.006 -0.000 0.177) 8.008 2.133 ( 1.697 -0.000 2.008) 2.629 2.176 ( -3.916 0.000 10.746) 11.437 2.225 ( -4.933 0.000 -5.863) 7.662 2.333 ( 1.170 -0.000 -4.172) 4.333 2.412 ( 0.659 -0.000 5.526) 5.565 2.455 ( 0.095 -0.000 2.701) 2.703 2.680 ( -2.285 0.000 -5.913) 6.339 2.705 ( 0.458 -0.000 -0.318) 0.557 2.795 ( -1.707 0.000 -0.402) 1.754 2.876 ( 5.195 -0.000 -0.047) 5.195 3.176 ( 10.102 -0.000 3.399) 10.658 3.355 ( 2.000 -0.000 -3.085) 3.677 3.603 ( -2.736 0.000 -2.431) 3.660 3.825 ( -2.428 0.000 2.203) 3.278 4.947 ( 3.869 -0.000 -2.685) 4.710 5.408 ( -1.493 0.000 -0.366) 1.537 5.550 ( 2.314 -0.000 -3.841) 4.484 5.640 ( 3.517 -0.000 -0.524) 3.556 5.678 ( 0.839 -0.000 1.734) 1.926 5.832 ( -0.481 0.000 -1.295) 1.382 5.955 ( 0.854 -0.000 -0.445) 0.963 5.970 ( 0.517 -0.000 16.142) 16.150 6.689 ( 0.269 -0.000 1.360) 1.386 6.780 ( 4.107 -0.000 6.796) 7.940 6.862 ( -0.330 0.000 -0.978) 1.032 6.918 ( -3.189 0.000 -5.113) 6.026 7.212 ( 2.338 -0.000 1.261) 2.656 7.554 ( -5.119 0.000 -13.952) 14.862 7.911 ( -1.469 0.000 -0.478) 1.545 8.513 ( 2.706 -0.000 7.354) 7.836 8.973 ( -5.398 0.000 -1.452) 5.590 9.650 ( 2.058 -0.000 -1.314) 2.442 ======================= Grid point 243 (108/199) ======================= q-point: (-0.33 -0.42 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.868 ( -6.040 -2.214 -0.600) 6.461 1.074 ( -12.782 -3.364 3.851) 13.767 1.233 ( -4.741 -1.052 0.834) 4.928 1.306 ( -6.688 -1.634 2.213) 7.232 1.608 ( -0.794 -1.205 -2.421) 2.819 1.642 ( -0.031 -1.730 -3.801) 4.176 1.694 ( 1.910 0.335 -0.564) 2.020 1.752 ( 0.159 -4.373 -0.018) 4.376 1.864 ( -5.358 -3.705 -2.921) 7.139 1.959 ( 9.060 -2.559 3.461) 10.030 2.133 ( -0.315 -0.201 3.469) 3.489 2.214 ( -0.596 -1.845 -4.759) 5.139 2.305 ( 0.031 -8.207 3.379) 8.875 2.397 ( -0.782 -4.524 -0.598) 4.630 2.456 ( 2.684 -3.483 3.068) 5.362 2.497 ( -0.396 -6.378 2.990) 7.055 2.664 ( -1.240 0.022 -5.066) 5.215 2.716 ( -0.041 -0.536 -0.828) 0.987 2.790 ( -1.711 -0.521 0.830) 1.972 2.920 ( 5.096 -1.203 0.309) 5.245 3.216 ( 3.710 0.380 0.380) 3.749 3.358 ( 4.294 1.558 -2.604) 5.258 3.579 ( -2.647 0.670 -1.497) 3.114 3.786 ( -2.818 2.070 2.203) 4.133 4.988 ( 3.923 -1.852 -2.174) 4.852 5.476 ( -1.675 -5.714 -0.558) 5.981 5.547 ( 3.420 1.169 -2.963) 4.674 5.672 ( 4.288 -1.073 -0.861) 4.504 5.766 ( 0.399 -6.114 3.072) 6.854 5.794 ( -1.668 -0.390 4.008) 4.358 6.041 ( 1.848 -8.847 0.942) 9.087 6.133 ( 2.943 -11.630 6.812) 13.796 6.709 ( 1.991 1.312 1.567) 2.853 6.767 ( -0.839 -0.698 3.624) 3.784 6.880 ( -1.342 1.671 -2.477) 3.276 6.962 ( 1.350 -7.809 -0.115) 7.926 7.227 ( 3.023 -0.089 1.339) 3.308 7.522 ( -3.963 -0.567 -14.022) 14.582 7.883 ( -1.924 1.574 -0.211) 2.495 8.508 ( 3.088 2.373 7.019) 8.027 8.909 ( -6.929 2.503 -1.715) 7.565 9.647 ( 2.190 1.577 -1.211) 2.958 ======================= Grid point 244 (109/199) ======================= q-point: (-0.25 -0.42 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.870 ( -6.903 -2.636 -0.381) 7.399 1.109 ( -7.781 -6.051 3.551) 10.477 1.236 ( -8.267 -4.101 0.977) 9.280 1.346 ( -2.658 -4.603 0.084) 5.316 1.663 ( 3.737 -2.318 -1.760) 4.737 1.701 ( 0.738 -3.684 -1.307) 3.978 1.721 ( 3.994 -2.759 -1.488) 5.078 1.840 ( 1.018 -3.847 -0.145) 3.982 1.940 ( -3.998 -6.013 -2.066) 7.511 2.054 ( 4.445 -2.524 5.407) 7.440 2.173 ( 4.713 -2.305 -1.740) 5.527 2.278 ( 0.171 -4.272 -2.839) 5.132 2.370 ( -0.286 -0.582 2.147) 2.242 2.472 ( 0.677 0.052 3.189) 3.261 2.556 ( -3.086 -9.765 -0.372) 10.248 2.645 ( 0.160 0.152 0.240) 0.326 2.691 ( -2.533 -2.164 -3.729) 5.000 2.773 ( 2.440 -4.864 -1.396) 5.618 2.813 ( -2.841 -7.779 2.923) 8.782 2.985 ( 3.617 -2.915 0.942) 4.740 3.232 ( -1.682 -2.837 -2.102) 3.911 3.343 ( 2.976 2.006 -0.349) 3.606 3.548 ( -2.564 0.541 -0.725) 2.719 3.727 ( -2.108 2.166 1.872) 3.555 5.069 ( 2.788 -4.328 -0.967) 5.239 5.519 ( 1.411 3.158 0.301) 3.471 5.541 ( -0.173 -2.204 -1.449) 2.643 5.722 ( 3.013 -1.012 0.601) 3.235 5.838 ( 2.951 -2.816 0.201) 4.084 5.967 ( -0.608 -12.839 5.760) 14.085 6.298 ( 1.660 -14.760 -0.387) 14.858 6.401 ( 1.307 -11.672 0.757) 11.770 6.658 ( 2.967 3.607 1.174) 4.816 6.771 ( -1.615 -0.892 -2.428) 3.049 6.889 ( -0.690 -2.913 4.700) 5.572 7.152 ( 2.077 -9.366 -1.050) 9.651 7.269 ( 4.782 -2.148 2.474) 5.797 7.532 ( -1.075 -2.641 -12.446) 12.769 7.836 ( -1.687 1.686 0.432) 2.424 8.474 ( 3.326 3.011 6.239) 7.685 8.800 ( -7.345 3.752 -2.021) 8.492 9.618 ( 1.269 2.191 -0.751) 2.641 ======================= Grid point 245 (110/199) ======================= q-point: (-0.17 -0.42 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.875 ( -2.071 0.153 -1.021) 2.314 1.188 ( -2.861 -4.682 2.888) 6.200 1.309 ( -7.629 -7.899 -0.109) 10.982 1.483 ( 1.079 -10.123 -0.423) 10.189 1.719 ( 2.608 -1.571 -2.744) 4.098 1.791 ( 4.388 -3.535 0.151) 5.637 1.828 ( 3.083 -4.574 -1.588) 5.740 1.913 ( 1.454 -2.791 -0.190) 3.152 2.022 ( -1.102 -3.657 -0.160) 3.823 2.136 ( 3.168 -3.533 4.089) 6.264 2.256 ( 5.506 -2.383 -1.371) 6.154 2.338 ( -0.438 -1.059 0.402) 1.215 2.393 ( -1.042 -2.691 -0.833) 3.003 2.451 ( 0.722 1.838 1.444) 2.446 2.610 ( -1.241 2.228 -0.058) 2.551 2.678 ( -2.017 1.071 -2.917) 3.705 2.711 ( -0.150 -5.077 0.815) 5.145 2.824 ( -0.767 -3.275 0.049) 3.364 2.952 ( -1.409 -3.338 -2.319) 4.301 3.073 ( -0.643 -3.318 2.164) 4.013 3.283 ( -1.173 0.615 0.603) 1.456 3.431 ( -1.953 -15.130 -0.423) 15.261 3.538 ( -1.498 -0.883 -0.448) 1.796 3.682 ( -1.238 1.252 1.419) 2.261 5.186 ( 2.085 -5.811 0.557) 6.199 5.467 ( 2.473 2.847 -0.523) 3.807 5.588 ( -0.232 -2.917 -0.906) 3.064 5.741 ( 1.151 0.548 0.781) 1.496 5.899 ( 2.892 -1.668 0.570) 3.387 6.177 ( 0.095 -5.901 5.281) 7.919 6.489 ( -0.518 1.128 -4.958) 5.111 6.544 ( -2.181 -5.565 -2.108) 6.338 6.716 ( 1.191 -12.730 0.296) 12.789 6.903 ( 5.607 -8.222 6.891) 12.104 6.955 ( -2.150 -6.236 -0.500) 6.615 7.290 ( 4.415 -2.823 -1.973) 5.599 7.398 ( 2.984 -7.002 2.307) 7.954 7.598 ( 1.138 -4.291 -8.048) 9.191 7.817 ( -0.748 -0.988 0.654) 1.401 8.439 ( 2.196 2.505 3.679) 4.963 8.683 ( -6.167 3.424 -1.086) 7.137 9.583 ( 0.521 1.812 -0.391) 1.926 ======================= Grid point 246 (111/199) ======================= q-point: (-0.08 -0.42 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.834 ( 0.335 2.928 -0.524) 2.993 1.269 ( -1.513 -4.584 0.134) 4.829 1.430 ( -4.394 -7.689 -0.322) 8.862 1.712 ( 4.072 -9.541 -0.875) 10.410 1.760 ( 1.806 -1.727 -2.820) 3.768 1.866 ( 4.668 -1.409 0.911) 4.960 1.924 ( 2.017 -3.124 -0.861) 3.817 1.969 ( 1.603 -2.033 -0.335) 2.611 2.071 ( 0.041 -1.766 1.399) 2.253 2.237 ( 2.835 -4.281 3.067) 5.981 2.304 ( 1.338 0.073 -3.089) 3.367 2.344 ( -0.522 -0.385 0.485) 0.810 2.415 ( 1.038 -0.061 3.123) 3.292 2.447 ( -0.223 -0.861 -1.488) 1.734 2.557 ( -0.922 2.327 0.107) 2.505 2.640 ( -1.482 1.116 -2.737) 3.307 2.746 ( -0.289 0.516 0.261) 0.647 2.860 ( 1.043 0.847 0.281) 1.373 2.974 ( -0.308 0.633 -2.473) 2.571 3.078 ( -3.152 0.572 3.692) 4.888 3.313 ( -4.239 -5.951 -1.250) 7.413 3.543 ( -1.031 -0.409 0.150) 1.119 3.654 ( -0.035 -1.354 0.885) 1.618 3.783 ( -1.186 -16.245 0.417) 16.293 5.316 ( 2.269 -5.796 1.456) 6.393 5.441 ( 2.975 1.560 -1.159) 3.554 5.648 ( -0.578 -2.753 0.273) 2.826 5.717 ( -0.407 1.390 -0.500) 1.532 5.945 ( 2.392 -1.480 0.372) 2.837 6.209 ( -1.441 0.471 4.964) 5.190 6.387 ( -1.111 5.870 -6.118) 8.551 6.664 ( 0.277 -5.620 -0.833) 5.688 6.962 ( -1.031 -6.609 0.969) 6.759 7.035 ( 0.561 -9.614 3.991) 10.425 7.179 ( 2.358 -11.074 0.396) 11.329 7.356 ( 6.131 -1.235 -2.121) 6.604 7.508 ( 2.139 -2.560 0.885) 3.451 7.709 ( 1.297 -5.895 -2.015) 6.363 7.864 ( -0.612 -3.548 -0.777) 3.683 8.394 ( -1.632 2.608 -1.347) 3.359 8.607 ( -2.250 1.312 2.159) 3.383 9.555 ( 0.188 1.200 -0.270) 1.245 ======================= Grid point 255 (112/199) ======================= q-point: (-0.33 -0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.812 ( -6.045 0.000 -0.656) 6.080 0.946 ( -15.758 0.000 5.128) 16.572 1.207 ( -3.204 0.000 0.780) 3.298 1.261 ( -6.931 0.000 4.098) 8.051 1.540 ( -14.326 0.000 -5.624) 15.390 1.541 ( -8.449 0.000 -5.609) 10.141 1.701 ( 1.595 -0.000 -1.095) 1.935 1.737 ( 3.992 -0.000 2.473) 4.696 1.810 ( -4.246 0.000 1.346) 4.454 1.992 ( 4.891 -0.000 0.555) 4.923 2.138 ( 1.759 -0.000 5.197) 5.486 2.158 ( 1.898 -0.000 1.432) 2.377 2.236 ( 5.003 -0.000 -3.102) 5.886 2.346 ( 1.504 -0.000 -4.121) 4.387 2.435 ( 2.352 -0.000 5.089) 5.606 2.460 ( 0.451 -0.000 2.833) 2.869 2.666 ( 0.076 -0.000 -4.666) 4.666 2.714 ( 0.881 -0.000 -0.271) 0.922 2.776 ( -1.177 0.000 1.775) 2.130 2.941 ( 5.179 -0.000 0.742) 5.231 3.235 ( -0.342 0.000 -3.394) 3.411 3.412 ( 6.960 -0.000 -3.906) 7.981 3.575 ( -1.164 0.000 0.140) 1.172 3.786 ( -4.097 0.000 2.264) 4.681 5.008 ( 6.526 -0.000 -2.481) 6.982 5.382 ( -2.616 0.000 -0.332) 2.637 5.581 ( 2.899 -0.000 -3.078) 4.229 5.693 ( 1.188 -0.000 1.406) 1.841 5.694 ( 5.484 -0.000 -0.338) 5.495 5.826 ( -0.312 0.000 -0.951) 1.001 5.969 ( 1.318 -0.000 -0.456) 1.395 6.000 ( 2.381 -0.000 17.371) 17.533 6.695 ( 0.486 -0.000 1.415) 1.496 6.818 ( -0.172 0.000 1.891) 1.899 6.855 ( -0.673 0.000 -1.076) 1.269 6.904 ( 3.123 -0.000 2.562) 4.040 7.240 ( 1.599 -0.000 -0.744) 1.763 7.482 ( -4.686 0.000 -14.109) 14.867 7.886 ( -2.554 0.000 -0.298) 2.571 8.552 ( 2.660 -0.000 6.104) 6.659 8.887 ( -8.390 0.000 -1.316) 8.493 9.681 ( 2.979 -0.000 -1.689) 3.425 ======================= Grid point 256 (113/199) ======================= q-point: (-0.25 -0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.766 ( -10.570 -1.142 0.522) 10.644 0.914 ( -14.086 -5.796 4.823) 15.978 1.157 ( -6.920 0.504 3.835) 7.928 1.254 ( -2.764 -3.256 -0.091) 4.272 1.552 ( -8.179 -7.335 -4.228) 11.772 1.595 ( -6.225 -8.260 -3.056) 10.785 1.722 ( 2.660 -0.626 -1.481) 3.108 1.768 ( -1.403 -3.052 1.133) 3.546 1.802 ( -1.204 -2.051 1.656) 2.898 2.031 ( 2.455 -1.917 0.793) 3.214 2.164 ( 5.040 -1.098 1.535) 5.382 2.222 ( 2.032 -2.436 -1.604) 3.554 2.309 ( 0.630 -5.453 0.861) 5.557 2.395 ( 0.139 -2.400 -0.719) 2.509 2.477 ( 0.777 -0.928 3.171) 3.394 2.530 ( 5.121 -8.403 1.588) 9.968 2.655 ( -0.032 0.525 -3.543) 3.582 2.717 ( 0.294 0.034 -0.147) 0.331 2.778 ( -0.268 -0.412 2.051) 2.109 2.979 ( 4.227 -0.804 0.475) 4.329 3.211 ( -2.925 0.838 -5.347) 6.152 3.420 ( 4.930 2.675 -3.254) 6.485 3.552 ( -1.670 1.524 1.150) 2.537 3.746 ( -3.888 1.372 2.293) 4.718 5.042 ( 5.051 -0.376 -1.065) 5.175 5.454 ( -1.590 -5.672 -0.897) 5.959 5.595 ( 4.673 0.999 -3.185) 5.743 5.731 ( 5.349 -0.698 -1.160) 5.518 5.750 ( -2.636 -5.658 6.395) 8.936 5.805 ( 2.296 -1.311 1.346) 2.966 6.064 ( 1.819 -8.998 -0.099) 9.181 6.184 ( 4.421 -11.695 8.110) 14.902 6.722 ( -0.528 -1.903 -0.277) 1.994 6.756 ( -0.460 3.955 -1.170) 4.150 6.865 ( -1.123 -0.541 2.072) 2.418 7.010 ( 6.734 -6.627 5.573) 10.969 7.259 ( 1.719 -1.514 -1.935) 2.998 7.469 ( -2.882 -1.849 -12.937) 13.383 7.855 ( -2.747 1.322 0.046) 3.049 8.548 ( 2.445 2.130 5.169) 6.102 8.810 ( -8.766 2.186 -1.192) 9.113 9.673 ( 2.061 2.202 -1.445) 3.345 ======================= Grid point 257 (114/199) ======================= q-point: (-0.17 -0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.790 ( -5.721 -5.977 0.198) 8.277 1.014 ( -8.074 -10.585 4.872) 14.176 1.145 ( -6.683 -2.863 3.342) 8.002 1.328 ( -0.398 -5.764 -1.215) 5.904 1.668 ( -1.593 -5.791 -4.226) 7.344 1.715 ( 0.641 -6.234 0.248) 6.272 1.766 ( 3.643 -2.870 -1.544) 4.888 1.855 ( 1.323 -2.957 0.542) 3.284 1.889 ( -3.945 -8.690 -0.357) 9.550 2.088 ( 1.342 -2.883 0.695) 3.255 2.243 ( 5.833 -2.346 -0.991) 6.365 2.285 ( 1.114 -3.462 -1.307) 3.865 2.362 ( -1.122 -0.508 1.668) 2.074 2.485 ( 1.122 0.839 3.235) 3.525 2.518 ( -2.625 -10.795 0.109) 11.110 2.645 ( -0.182 1.393 0.304) 1.437 2.659 ( -1.944 -1.275 -4.122) 4.732 2.780 ( -1.137 -0.731 2.507) 2.848 2.825 ( 3.933 -9.189 0.700) 10.020 3.027 ( 2.945 -2.015 0.945) 3.692 3.195 ( -3.769 -3.177 -5.436) 7.338 3.368 ( 1.171 4.154 -0.689) 4.370 3.520 ( -2.011 0.117 1.008) 2.252 3.697 ( -2.977 1.385 1.764) 3.727 5.103 ( 2.598 -3.553 0.871) 4.487 5.503 ( -1.883 -0.905 -0.617) 2.179 5.578 ( 4.335 1.930 -1.751) 5.058 5.763 ( 3.473 0.355 0.954) 3.620 5.874 ( 2.948 -2.799 0.373) 4.083 5.971 ( 0.815 -14.030 4.551) 14.772 6.318 ( 1.631 -14.207 -0.101) 14.301 6.407 ( -0.514 -7.746 0.611) 7.787 6.661 ( -1.936 4.021 -4.698) 6.480 6.789 ( 3.500 -5.705 -0.526) 6.713 6.884 ( -0.423 -1.361 6.477) 6.631 7.203 ( 6.729 -7.565 3.084) 10.584 7.330 ( 4.794 -3.526 1.449) 6.125 7.515 ( -0.112 -4.137 -12.106) 12.794 7.813 ( -2.164 0.996 0.779) 2.506 8.508 ( 1.398 3.079 2.941) 4.482 8.705 ( -7.666 2.968 -0.306) 8.226 9.631 ( 0.810 2.611 -0.654) 2.811 ======================= Grid point 258 (115/199) ======================= q-point: (-0.08 -0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.859 ( -0.412 -1.416 -1.360) 2.006 1.158 ( -2.889 -5.306 4.830) 7.735 1.222 ( -6.222 -9.927 0.816) 11.744 1.513 ( 3.697 -11.666 -0.736) 12.260 1.743 ( 2.089 -1.970 -3.520) 4.543 1.835 ( 2.316 -4.397 0.302) 4.979 1.866 ( 3.344 -4.344 -1.163) 5.604 1.923 ( 0.391 -3.260 0.341) 3.301 2.012 ( -0.416 -4.717 -0.186) 4.739 2.168 ( 1.804 -4.109 0.709) 4.543 2.289 ( -0.889 -1.008 -2.325) 2.685 2.351 ( 2.053 0.007 1.182) 2.369 2.373 ( -1.218 -2.708 -0.793) 3.073 2.476 ( 3.339 1.158 1.925) 4.025 2.594 ( -1.355 2.201 -0.545) 2.641 2.653 ( -1.521 0.631 -2.543) 3.029 2.714 ( 0.342 -6.014 2.043) 6.361 2.814 ( -0.847 -5.146 0.888) 5.290 2.934 ( -0.965 -1.871 -2.283) 3.105 3.067 ( -0.881 -0.556 2.450) 2.662 3.266 ( -1.823 3.051 0.311) 3.567 3.401 ( -2.637 -16.283 -2.496) 16.682 3.523 ( -0.814 -0.945 1.171) 1.711 3.665 ( -1.616 0.161 0.992) 1.903 5.210 ( 1.558 -5.769 2.082) 6.328 5.493 ( 1.818 1.358 -3.043) 3.796 5.594 ( 1.498 -1.612 0.171) 2.207 5.756 ( 1.216 1.859 0.871) 2.386 5.933 ( 2.508 -1.527 0.436) 2.969 6.181 ( -0.259 -4.462 5.249) 6.894 6.480 ( -0.176 3.193 -6.516) 7.258 6.514 ( -2.464 -8.100 -0.737) 8.498 6.731 ( 1.250 -14.281 0.240) 14.337 6.911 ( -2.910 -3.104 3.090) 5.258 6.987 ( 4.677 -9.504 1.260) 10.666 7.359 ( 7.563 -3.602 -0.180) 8.379 7.451 ( 5.102 -4.968 3.855) 8.097 7.606 ( 1.158 -5.028 -7.577) 9.167 7.805 ( -1.448 -1.472 0.495) 2.124 8.444 ( -1.725 3.503 -1.338) 4.128 8.618 ( -4.365 1.750 2.329) 5.247 9.588 ( 0.437 1.984 -0.216) 2.043 ======================= Grid point 268 (116/199) ======================= q-point: (-0.25 -0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.704 ( -11.768 0.000 0.445) 11.776 0.758 ( -15.906 0.000 8.047) 17.826 1.157 ( -5.817 0.000 1.205) 5.941 1.196 ( -4.444 0.000 4.385) 6.244 1.304 ( -21.484 0.000 -0.362) 21.487 1.436 ( -7.450 0.000 -4.975) 8.959 1.725 ( 2.049 -0.000 -2.267) 3.056 1.766 ( -2.868 0.000 2.818) 4.021 1.773 ( 1.727 -0.000 1.238) 2.125 2.025 ( 2.677 -0.000 -2.011) 3.348 2.179 ( 1.443 -0.000 0.855) 1.677 2.194 ( 4.526 -0.000 1.514) 4.773 2.303 ( 4.156 -0.000 -1.286) 4.350 2.361 ( 1.437 -0.000 -3.944) 4.198 2.470 ( 0.739 -0.000 3.027) 3.116 2.494 ( 7.819 -0.000 3.502) 8.568 2.667 ( 0.701 -0.000 -3.542) 3.611 2.725 ( 1.078 -0.000 -0.249) 1.106 2.772 ( 0.047 -0.000 4.010) 4.010 2.993 ( 2.691 -0.000 -0.795) 2.806 3.198 ( -3.832 0.000 -7.488) 8.411 3.467 ( 2.143 -0.000 -4.211) 4.725 3.586 ( 2.268 -0.000 0.718) 2.379 3.734 ( -4.489 0.000 2.614) 5.194 5.104 ( 9.835 -0.000 -1.932) 10.023 5.348 ( -2.837 0.000 -0.362) 2.860 5.610 ( 2.267 -0.000 -1.008) 2.481 5.707 ( 0.856 -0.000 0.774) 1.154 5.769 ( 6.559 -0.000 -0.589) 6.585 5.824 ( 0.232 -0.000 -0.264) 0.352 5.985 ( 1.319 -0.000 -0.399) 1.378 6.058 ( 4.734 -0.000 17.707) 18.329 6.703 ( 0.635 -0.000 1.440) 1.574 6.792 ( -2.494 0.000 -5.175) 5.744 6.845 ( -0.913 0.000 -1.194) 1.503 6.995 ( 9.595 -0.000 13.901) 16.891 7.228 ( -4.020 0.000 -9.754) 10.550 7.429 ( -1.736 0.000 -7.246) 7.451 7.850 ( -3.237 0.000 -0.172) 3.242 8.585 ( 1.846 -0.000 4.261) 4.644 8.777 ( -9.219 0.000 -0.664) 9.242 9.712 ( 2.097 -0.000 -2.297) 3.110 ======================= Grid point 269 (117/199) ======================= q-point: (-0.17 -0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.625 ( -12.165 -3.422 2.924) 12.971 0.753 ( -12.491 -8.335 8.729) 17.370 1.084 ( -5.717 -0.204 5.330) 7.819 1.227 ( -1.735 -4.052 -2.417) 5.028 1.401 ( -14.874 -15.435 -1.690) 21.501 1.521 ( -4.937 -11.037 -0.111) 12.091 1.727 ( -3.685 -2.023 2.357) 4.819 1.761 ( 3.904 -0.413 -2.747) 4.791 1.818 ( 1.221 -2.470 1.151) 2.986 2.054 ( 2.402 -1.232 -2.607) 3.753 2.219 ( 2.856 -2.629 0.541) 3.919 2.247 ( 1.885 -2.375 -0.504) 3.074 2.315 ( -0.335 -1.376 -0.171) 1.426 2.397 ( 0.583 -2.011 -2.189) 3.029 2.492 ( 1.310 -1.034 3.863) 4.208 2.613 ( 8.065 -5.104 -0.281) 9.549 2.656 ( 0.493 0.654 -0.905) 1.221 2.724 ( 0.789 -0.256 0.536) 0.987 2.784 ( 0.648 -0.447 2.505) 2.626 3.012 ( 0.718 -1.112 -2.963) 3.246 3.161 ( -3.602 0.942 -6.328) 7.342 3.458 ( 1.982 2.423 -3.345) 4.581 3.535 ( -2.013 3.586 2.515) 4.820 3.700 ( -3.775 0.941 2.490) 4.619 5.102 ( 4.330 2.043 1.470) 5.008 5.442 ( -0.004 -4.901 -1.593) 5.153 5.653 ( 5.321 1.053 -3.440) 6.423 5.722 ( -2.172 -7.252 5.816) 9.547 5.797 ( 5.000 -0.076 -0.796) 5.063 5.840 ( 3.417 -1.964 1.019) 4.071 6.084 ( 1.501 -9.204 -0.396) 9.334 6.247 ( 4.456 -9.850 7.480) 13.146 6.697 ( -2.579 0.917 -3.063) 4.108 6.755 ( 0.071 1.069 -4.057) 4.196 6.853 ( -1.204 -1.689 2.654) 3.368 7.151 ( 15.813 -5.441 15.196) 22.596 7.243 ( -4.365 -5.695 -12.340) 14.274 7.442 ( 0.310 -2.007 -5.082) 5.473 7.819 ( -3.081 0.969 0.410) 3.255 8.572 ( 0.802 2.276 2.438) 3.430 8.704 ( -8.243 1.709 0.219) 8.421 9.689 ( 0.549 2.672 -1.536) 3.130 ======================= Grid point 270 (118/199) ======================= q-point: (-0.08 -0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.742 ( -2.077 -9.444 0.916) 9.713 0.935 ( -5.273 -13.884 6.924) 16.387 1.080 ( -4.692 -1.759 4.711) 6.877 1.332 ( 1.242 -7.840 -1.937) 8.171 1.630 ( -4.010 -11.488 -3.005) 12.533 1.710 ( -1.128 -8.754 0.033) 8.827 1.804 ( 1.770 -3.931 -0.540) 4.344 1.842 ( -1.774 -8.346 0.483) 8.546 1.879 ( 1.347 -3.283 0.784) 3.634 2.104 ( 1.802 -2.811 -3.012) 4.497 2.269 ( -1.560 -0.106 -1.674) 2.291 2.305 ( 1.413 -3.873 -1.096) 4.266 2.351 ( -0.735 -1.476 1.819) 2.455 2.490 ( -0.859 -8.209 -0.862) 8.299 2.517 ( 2.678 -0.944 4.616) 5.419 2.640 ( -0.677 0.037 -3.511) 3.575 2.642 ( -0.276 2.363 0.231) 2.390 2.776 ( 0.081 0.034 3.099) 3.101 2.875 ( 3.780 -6.542 0.353) 7.564 3.057 ( 2.040 -2.613 0.093) 3.316 3.137 ( -4.615 -3.771 -7.351) 9.463 3.370 ( -0.787 5.741 -0.514) 5.817 3.504 ( -0.789 -0.499 2.524) 2.691 3.661 ( -3.125 0.731 1.674) 3.619 5.128 ( 1.103 -2.925 3.169) 4.451 5.486 ( -0.608 -1.399 -1.342) 2.032 5.629 ( 4.018 2.298 -2.133) 5.097 5.802 ( 2.698 1.344 1.456) 3.348 5.908 ( 2.373 -2.609 0.193) 3.533 5.998 ( 3.291 -13.958 2.759) 14.604 6.334 ( 0.417 -12.350 1.138) 12.409 6.391 ( -1.803 -6.177 0.007) 6.435 6.629 ( -2.166 2.961 -5.353) 6.490 6.807 ( -0.692 -5.396 -3.888) 6.686 6.898 ( 1.524 -3.134 4.749) 5.891 7.313 ( 7.742 -4.987 3.896) 9.999 7.394 ( 7.822 -5.418 3.395) 10.103 7.510 ( 1.083 -4.640 -9.330) 10.476 7.788 ( -1.927 0.420 1.350) 2.390 8.507 ( -1.737 3.878 -1.178) 4.410 8.625 ( -5.354 1.769 2.247) 6.070 9.636 ( 0.075 2.551 -0.220) 2.562 ======================= Grid point 281 (119/199) ======================= q-point: (-0.17 -0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.536 ( -15.404 0.000 4.027) 15.922 0.581 ( -14.338 0.000 12.448) 18.987 0.971 ( -23.169 0.000 17.016) 28.746 1.148 ( -4.344 0.000 -0.308) 4.355 1.163 ( -2.378 0.000 -7.468) 7.837 1.366 ( -3.304 0.000 -0.768) 3.392 1.700 ( -4.802 0.000 3.809) 6.130 1.784 ( 4.072 -0.000 -3.278) 5.228 1.784 ( 0.101 -0.000 -0.079) 0.128 2.064 ( 3.916 -0.000 -3.301) 5.122 2.194 ( 0.897 -0.000 0.400) 0.982 2.236 ( 2.335 -0.000 -0.706) 2.440 2.312 ( -1.682 0.000 -1.001) 1.957 2.373 ( 0.893 -0.000 -3.716) 3.822 2.483 ( 0.937 -0.000 3.258) 3.390 2.625 ( 11.963 -0.000 1.478) 12.054 2.677 ( 1.210 -0.000 -2.190) 2.502 2.738 ( 0.940 -0.000 -0.289) 0.983 2.779 ( 0.243 -0.000 5.464) 5.469 2.986 ( -3.395 0.000 -8.784) 9.417 3.156 ( -1.655 0.000 -3.891) 4.228 3.478 ( 0.839 -0.000 -0.416) 0.936 3.585 ( -3.522 0.000 -3.162) 4.733 3.698 ( -1.476 0.000 2.360) 2.784 5.244 ( 13.342 -0.000 -1.395) 13.415 5.315 ( -2.330 0.000 -0.430) 2.369 5.640 ( 3.170 -0.000 1.669) 3.583 5.713 ( 0.210 -0.000 -0.016) 0.211 5.831 ( 0.789 -0.000 0.609) 0.996 5.843 ( 5.310 -0.000 -1.867) 5.629 5.999 ( 1.020 -0.000 -0.302) 1.064 6.136 ( 5.190 -0.000 16.106) 16.921 6.712 ( 0.591 -0.000 1.402) 1.521 6.762 ( -1.545 0.000 -6.195) 6.385 6.832 ( -0.898 0.000 -1.281) 1.564 7.016 ( -17.000 0.000 -23.680) 29.150 7.254 ( 19.381 -0.000 23.808) 30.699 7.436 ( 2.964 -0.000 1.997) 3.574 7.809 ( -3.247 0.000 0.449) 3.278 8.600 ( 0.064 -0.000 1.704) 1.706 8.673 ( -7.389 0.000 0.893) 7.443 9.722 ( -0.440 0.000 -2.932) 2.965 ======================= Grid point 282 (120/199) ======================= q-point: (-0.08 -0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.504 ( -6.985 -10.371 6.234) 13.972 0.643 ( -6.712 -11.006 14.350) 19.291 1.022 ( -5.739 -5.172 8.925) 11.804 1.190 ( -6.778 -8.880 -1.412) 11.260 1.243 ( -6.759 -13.305 -3.148) 15.252 1.481 ( -1.688 -11.091 1.874) 11.374 1.682 ( -3.957 -2.391 3.085) 5.558 1.809 ( 4.128 -0.661 -3.491) 5.446 1.825 ( -0.032 -3.207 0.014) 3.207 2.089 ( 3.521 -0.411 -3.899) 5.269 2.236 ( 0.497 -3.437 -0.353) 3.491 2.255 ( -1.490 -0.451 -1.769) 2.357 2.300 ( -1.133 -0.997 0.025) 1.509 2.403 ( 0.411 -2.264 -2.913) 3.712 2.512 ( 1.274 -1.404 4.119) 4.535 2.660 ( 0.805 1.580 -1.234) 2.161 2.701 ( 3.466 2.270 0.870) 4.234 2.752 ( 5.307 -4.665 0.502) 7.084 2.794 ( 0.513 -0.675 1.792) 1.982 2.980 ( -4.408 -2.436 -10.910) 12.016 3.133 ( -0.445 1.439 -0.695) 1.659 3.471 ( -0.157 3.850 -2.973) 4.867 3.499 ( -3.162 1.513 4.198) 5.469 3.662 ( -2.850 1.471 2.756) 4.229 5.137 ( 0.606 4.177 4.956) 6.510 5.454 ( 2.051 -2.477 -1.177) 3.424 5.680 ( -1.685 -0.575 1.316) 2.214 5.749 ( 6.743 -6.872 -0.291) 9.632 5.845 ( 3.239 -1.779 -0.400) 3.717 5.890 ( 4.549 -1.024 -1.194) 4.813 6.099 ( 1.102 -9.465 -0.297) 9.533 6.293 ( 1.898 -5.839 5.668) 8.356 6.655 ( -4.527 1.611 -5.914) 7.620 6.742 ( -1.454 -0.010 -6.761) 6.916 6.839 ( -1.754 -2.759 1.540) 3.614 7.128 ( -11.118 -14.397 -19.841) 26.917 7.426 ( 23.103 -1.952 15.040) 27.636 7.469 ( 6.294 -0.038 7.051) 9.452 7.789 ( -0.769 0.474 2.554) 2.709 8.565 ( -1.998 2.884 -0.697) 3.577 8.623 ( -4.868 1.090 2.064) 5.399 9.682 ( -1.359 2.357 -0.859) 2.853 ======================= Grid point 294 (121/199) ======================= q-point: (-0.08 -0.08 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.362 ( -12.708 0.000 10.522) 16.499 0.427 ( -13.334 0.000 14.601) 19.773 0.762 ( -11.339 0.000 34.050) 35.888 1.085 ( -5.378 0.000 -5.883) 7.971 1.153 ( 1.321 -0.000 -9.204) 9.298 1.358 ( 1.495 -0.000 4.007) 4.276 1.641 ( -5.147 0.000 4.494) 6.833 1.778 ( -0.848 0.000 -1.312) 1.562 1.829 ( 3.506 -0.000 -3.735) 5.122 2.110 ( 3.946 -0.000 -3.520) 5.288 2.202 ( 0.507 -0.000 0.148) 0.528 2.239 ( -2.683 0.000 -2.981) 4.011 2.290 ( -0.231 0.000 -0.598) 0.641 2.376 ( 0.140 -0.000 -3.485) 3.487 2.497 ( 0.856 -0.000 3.380) 3.487 2.688 ( 0.583 -0.000 -0.290) 0.651 2.746 ( 5.041 -0.000 -4.333) 6.647 2.747 ( 0.506 -0.000 -0.370) 0.627 2.779 ( -0.260 0.000 4.726) 4.733 2.925 ( -3.084 0.000 -12.074) 12.461 3.149 ( 0.839 -0.000 1.218) 1.479 3.495 ( 0.372 -0.000 4.339) 4.355 3.508 ( -6.371 0.000 -4.993) 8.094 3.683 ( -1.830 0.000 1.325) 2.259 5.292 ( -1.345 0.000 -0.503) 1.436 5.406 ( 11.803 -0.000 -0.886) 11.837 5.713 ( -0.235 0.000 -0.577) 0.623 5.715 ( 10.099 -0.000 0.819) 10.132 5.842 ( 0.899 -0.000 1.266) 1.553 5.874 ( -1.527 0.000 -4.971) 5.201 6.008 ( 0.565 -0.000 -0.215) 0.605 6.189 ( 0.058 -0.000 11.216) 11.216 6.621 ( -40.316 0.000 -27.251) 48.662 6.718 ( 0.202 -0.000 1.275) 1.291 6.752 ( -0.709 0.000 -5.453) 5.499 6.822 ( -0.454 0.000 -1.277) 1.356 7.458 ( 4.015 -0.000 2.067) 4.516 7.646 ( 20.094 -0.000 15.270) 25.238 7.841 ( 24.430 -0.000 16.762) 29.627 8.583 ( -2.466 0.000 -0.103) 2.468 8.611 ( -3.265 0.000 1.499) 3.593 9.695 ( -3.043 0.000 -1.426) 3.361 ======================= Grid point 295 (122/199) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.578 ( 3.806 -0.000 12.835) 13.387 0.621 ( -1.568 0.000 13.701) 13.791 0.844 ( -4.368 0.000 -10.069) 10.976 0.964 ( 1.856 -0.000 -11.253) 11.405 1.492 ( 2.652 -0.000 3.685) 4.540 1.507 ( 8.149 -0.000 36.126) 37.033 1.671 ( -4.824 0.000 5.064) 6.994 1.713 ( -1.464 0.000 -2.427) 2.835 1.780 ( 1.837 -0.000 -4.578) 4.933 2.048 ( 2.468 -0.000 -14.396) 14.606 2.125 ( -4.401 0.000 -2.158) 4.902 2.209 ( 0.168 -0.000 0.099) 0.195 2.212 ( -0.615 0.000 -9.195) 9.215 2.327 ( -0.240 0.000 -1.297) 1.319 2.442 ( -3.572 0.000 -6.904) 7.773 2.552 ( 0.155 -0.000 1.353) 1.362 2.690 ( 0.215 -0.000 0.056) 0.222 2.741 ( -0.046 0.000 -0.327) 0.330 2.828 ( -5.246 0.000 3.190) 6.140 2.885 ( 4.896 -0.000 -1.062) 5.010 3.223 ( 2.187 -0.000 0.643) 2.280 3.433 ( -1.593 0.000 0.165) 1.601 3.550 ( 1.202 -0.000 0.390) 1.263 3.713 ( -0.022 0.000 1.808) 1.808 5.274 ( -0.070 0.000 -0.331) 0.339 5.563 ( 11.649 -0.000 3.048) 12.041 5.600 ( -23.344 0.000 -0.725) 23.355 5.696 ( -0.201 0.000 -0.375) 0.426 5.781 ( 5.057 -0.000 -3.464) 6.130 5.878 ( 0.317 -0.000 0.889) 0.944 6.008 ( 0.015 -0.000 -0.163) 0.163 6.123 ( -2.437 0.000 0.621) 2.515 6.383 ( -1.701 0.000 4.048) 4.390 6.663 ( 1.532 -0.000 -4.293) 4.558 6.743 ( -0.487 0.000 1.379) 1.462 6.794 ( 0.413 -0.000 -1.425) 1.484 7.523 ( 0.233 -0.000 1.296) 1.317 7.695 ( -0.575 0.000 0.612) 0.840 8.296 ( 5.306 -0.000 -1.813) 5.608 8.577 ( 0.162 -0.000 0.368) 0.403 8.588 ( 1.096 -0.000 -0.030) 1.096 9.714 ( 1.475 -0.000 0.596) 1.591 ======================= Grid point 296 (123/199) ======================= q-point: ( 0.08 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.715 ( 2.752 -6.459 6.151) 9.334 0.833 ( 0.714 -12.941 11.224) 17.145 0.930 ( -0.586 -9.509 -4.759) 10.650 1.071 ( 5.822 -13.637 -9.688) 17.712 1.461 ( 2.275 1.192 7.788) 8.201 1.658 ( 1.214 -1.611 3.841) 4.338 1.698 ( -0.179 -7.241 12.350) 14.317 1.768 ( -0.190 -6.415 5.018) 8.147 1.814 ( 1.902 -2.526 -3.062) 4.402 2.050 ( 0.813 -1.323 -12.687) 12.782 2.094 ( -3.933 -0.125 -0.191) 3.940 2.183 ( 1.441 0.174 -2.842) 3.191 2.325 ( 0.596 -6.386 1.663) 6.626 2.360 ( 0.075 -1.187 -0.190) 1.204 2.445 ( -2.787 -5.841 -10.061) 11.963 2.588 ( -0.876 -2.307 0.706) 2.566 2.677 ( -0.588 1.179 -0.060) 1.319 2.732 ( -0.048 0.346 -0.988) 1.048 2.810 ( -4.097 -2.037 2.432) 5.182 2.902 ( 2.644 0.488 -0.413) 2.720 3.213 ( 1.070 1.830 -0.009) 2.120 3.404 ( -0.945 2.251 0.416) 2.477 3.558 ( 1.752 0.193 0.134) 1.768 3.691 ( 0.736 2.152 1.757) 2.874 5.172 ( -4.960 3.683 3.929) 7.321 5.513 ( -4.085 -0.590 -0.062) 4.128 5.647 ( -0.374 -2.647 2.647) 3.761 5.787 ( -1.771 -3.603 -0.373) 4.032 5.875 ( -1.996 -4.295 -1.484) 4.963 5.930 ( 3.616 -8.971 -5.276) 11.017 6.149 ( -6.310 -12.432 -1.802) 14.058 6.211 ( 7.589 -7.594 3.817) 11.394 6.364 ( -1.845 0.450 4.305) 4.705 6.617 ( 1.981 3.243 -5.147) 6.397 6.813 ( -1.055 -3.954 1.426) 4.334 6.923 ( 1.146 -12.707 -1.203) 12.815 7.522 ( -2.549 -0.396 1.095) 2.802 7.688 ( 1.724 0.816 0.624) 2.007 8.186 ( -5.003 8.742 -2.664) 10.419 8.531 ( -1.539 3.867 0.372) 4.178 8.581 ( 6.730 2.537 0.044) 7.192 9.703 ( 1.366 2.011 -0.060) 2.432 ======================= Grid point 297 (124/199) ======================= q-point: ( 0.17 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.848 ( 2.475 -4.174 -1.993) 5.246 0.991 ( 1.593 -5.534 3.445) 6.710 1.172 ( -0.630 -14.232 4.109) 14.827 1.437 ( 4.934 -10.689 7.047) 13.720 1.524 ( 1.863 -9.275 -9.644) 13.510 1.708 ( -1.800 -3.704 -0.530) 4.152 1.787 ( -3.650 -4.923 -1.140) 6.233 1.880 ( 0.864 -3.025 -1.341) 3.420 1.910 ( -1.201 -5.247 3.926) 6.662 2.049 ( -1.478 -0.043 -0.068) 1.481 2.192 ( 2.155 -0.345 -0.852) 2.343 2.202 ( 2.254 -8.387 -0.505) 8.699 2.342 ( 1.037 0.962 2.562) 2.926 2.470 ( -2.539 -6.613 3.592) 7.942 2.599 ( -1.156 -2.149 -1.200) 2.719 2.610 ( 0.052 -3.269 -2.295) 3.995 2.687 ( 1.403 -7.903 -1.816) 8.229 2.742 ( 0.058 -2.094 -3.494) 4.074 2.864 ( -0.615 -1.273 2.256) 2.663 2.934 ( -0.267 -6.220 -0.814) 6.279 3.178 ( 0.257 1.360 -0.149) 1.392 3.329 ( -0.144 4.946 -0.057) 4.948 3.566 ( 1.058 -0.276 0.156) 1.104 3.652 ( 1.418 2.290 1.285) 2.985 5.140 ( -5.009 -2.935 4.021) 7.062 5.517 ( 2.223 0.157 -2.796) 3.576 5.669 ( -1.723 -0.942 0.217) 1.976 5.807 ( -2.245 0.193 0.384) 2.286 5.917 ( -1.017 -2.065 0.167) 2.308 6.193 ( 1.666 -13.983 -5.282) 15.040 6.246 ( -4.050 0.649 5.470) 6.837 6.451 ( 4.615 -8.755 4.825) 11.010 6.471 ( -4.442 -14.221 -2.266) 15.070 6.579 ( 2.132 -0.647 -4.246) 4.795 6.897 ( -0.218 -4.781 1.280) 4.954 7.211 ( 0.087 -14.523 0.261) 14.526 7.505 ( -5.346 -0.384 0.934) 5.440 7.696 ( 2.797 -0.409 -0.508) 2.872 7.986 ( -5.388 6.904 -3.043) 9.271 8.429 ( -3.412 4.535 0.166) 5.678 8.580 ( 8.730 2.332 0.714) 9.064 9.660 ( 0.209 2.603 -0.095) 2.613 ======================= Grid point 298 (125/199) ======================= q-point: ( 0.25 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.884 ( 0.300 0.767 -1.586) 1.787 1.134 ( 4.093 -6.492 1.723) 7.865 1.412 ( 1.891 -8.831 4.241) 9.977 1.610 ( -2.593 -7.673 -4.802) 9.416 1.671 ( -0.918 -4.428 -0.418) 4.542 1.806 ( -2.687 -7.154 -2.101) 7.925 1.877 ( -2.621 -5.927 -0.685) 6.517 1.941 ( -0.327 -2.832 0.019) 2.851 1.968 ( -4.084 -2.646 1.056) 4.979 2.074 ( 3.150 -1.526 2.585) 4.351 2.212 ( 0.017 -1.826 -1.943) 2.667 2.319 ( 0.946 -1.644 0.870) 2.087 2.383 ( 3.758 -3.619 1.524) 5.435 2.469 ( -3.072 2.087 -0.408) 3.736 2.562 ( -1.490 2.156 -0.169) 2.626 2.722 ( 0.279 -2.212 -1.796) 2.863 2.832 ( -0.676 -2.895 1.109) 3.173 2.845 ( 0.369 -2.972 2.551) 3.934 2.900 ( -0.743 -7.236 -3.719) 8.170 3.074 ( 1.901 -3.747 1.881) 4.604 3.217 ( 2.832 3.983 0.331) 4.898 3.287 ( 1.603 -13.062 -1.267) 13.221 3.592 ( -0.115 -2.609 -0.547) 2.668 3.624 ( 1.500 1.292 1.324) 2.382 5.210 ( -3.988 -6.249 2.912) 7.965 5.522 ( 2.688 0.740 -3.700) 4.633 5.677 ( -2.001 -1.150 -0.834) 2.454 5.769 ( -0.747 2.523 0.481) 2.675 5.942 ( -1.608 -1.134 0.551) 2.043 6.190 ( -2.033 2.459 6.385) 7.137 6.414 ( 1.859 -2.862 -6.981) 7.771 6.503 ( 0.341 -4.053 -0.104) 4.069 6.750 ( -1.258 -14.836 0.522) 14.898 6.779 ( 0.358 -12.278 2.754) 12.588 7.009 ( 0.258 -7.395 0.447) 7.413 7.461 ( -3.210 -6.921 0.076) 7.629 7.488 ( -4.271 -5.299 1.178) 6.907 7.737 ( 1.488 -2.356 -1.051) 2.978 7.852 ( -4.181 3.839 -3.379) 6.606 8.327 ( -3.497 3.331 -0.158) 4.832 8.595 ( 9.042 1.687 1.277) 9.286 9.610 ( -0.617 2.225 -0.185) 2.316 ======================= Grid point 299 (126/199) ======================= q-point: ( 0.33 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.843 ( -0.921 2.795 -0.467) 2.980 1.272 ( 4.142 -4.428 0.249) 6.069 1.559 ( 1.596 -5.322 1.337) 5.715 1.629 ( -4.487 -0.945 -5.600) 7.238 1.832 ( -1.689 -8.753 -0.081) 8.915 1.899 ( -3.409 -3.840 -0.922) 5.217 1.960 ( -2.582 -1.020 0.382) 2.802 1.972 ( 0.259 -2.456 0.098) 2.472 2.006 ( -4.568 -4.888 1.853) 6.942 2.121 ( 3.184 -0.955 2.827) 4.363 2.266 ( 0.310 -3.230 -0.841) 3.352 2.339 ( -1.571 0.013 0.983) 1.853 2.408 ( 2.142 1.962 -1.063) 3.094 2.471 ( 2.485 -2.447 1.323) 3.730 2.519 ( -1.011 1.245 -0.410) 1.655 2.737 ( -3.372 -0.477 -3.174) 4.656 2.773 ( -0.787 3.602 1.289) 3.906 2.847 ( -1.232 2.634 -0.357) 2.930 2.991 ( 0.561 2.778 -0.862) 2.962 3.129 ( 3.736 -3.470 3.400) 6.129 3.253 ( 3.939 -4.851 -2.820) 6.856 3.519 ( 0.071 -4.001 -0.478) 4.030 3.626 ( 1.238 -1.111 2.069) 2.655 3.765 ( 0.763 -15.619 -0.027) 15.638 5.320 ( -3.099 -6.552 1.700) 7.445 5.519 ( 1.697 0.751 -3.362) 3.840 5.685 ( -2.135 0.958 0.609) 2.418 5.710 ( 0.105 1.251 -0.145) 1.264 5.955 ( -2.061 -1.785 0.659) 2.805 6.139 ( -0.226 2.293 4.737) 5.267 6.379 ( 2.557 3.786 -4.836) 6.653 6.626 ( -1.532 -5.678 -0.128) 5.882 6.930 ( 1.812 -5.045 1.552) 5.581 7.056 ( 0.030 -13.578 2.076) 13.736 7.205 ( -0.768 -11.173 -0.126) 11.200 7.426 ( -6.250 1.286 -1.234) 6.499 7.669 ( -0.881 -8.133 2.793) 8.645 7.759 ( -0.509 2.949 -0.817) 3.102 7.810 ( -2.919 -3.976 -4.076) 6.399 8.262 ( -2.676 1.270 -0.530) 3.010 8.621 ( 7.865 1.004 1.563) 8.081 9.568 ( -0.955 1.515 -0.283) 1.813 ======================= Grid point 300 (127/199) ======================= q-point: ( 0.42 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.779 ( -1.039 2.519 -0.132) 2.728 1.346 ( 1.449 -1.292 -1.301) 2.337 1.622 ( -0.334 -1.188 3.257) 3.483 1.666 ( -0.542 -3.690 -6.967) 7.902 1.901 ( -2.950 0.984 1.571) 3.485 1.949 ( -1.770 -3.446 0.498) 3.906 1.952 ( -0.687 -0.687 0.864) 1.300 2.009 ( -1.916 -1.650 -1.321) 2.853 2.085 ( -0.779 -4.034 -1.400) 4.341 2.164 ( 0.231 -1.958 2.439) 3.136 2.288 ( -0.939 1.657 1.754) 2.589 2.337 ( 1.196 -1.815 -0.172) 2.181 2.424 ( 2.598 -1.038 0.106) 2.800 2.504 ( -0.763 -0.183 0.228) 0.817 2.522 ( 1.609 -1.586 0.530) 2.321 2.686 ( -3.906 2.771 -3.494) 5.928 2.702 ( -0.855 2.340 0.612) 2.566 2.798 ( 0.388 2.879 -0.224) 2.913 2.916 ( 1.663 2.829 0.614) 3.338 3.191 ( 2.423 -0.064 1.510) 2.856 3.375 ( 3.619 -4.495 -1.034) 5.863 3.541 ( -3.277 -0.660 -1.926) 3.858 3.668 ( 1.185 -1.753 1.775) 2.762 4.051 ( 0.701 -10.533 0.520) 10.569 5.420 ( -1.400 -4.657 0.155) 4.865 5.508 ( -0.727 0.657 -1.286) 1.617 5.611 ( 0.033 3.587 2.244) 4.231 5.732 ( -0.526 -1.700 -1.216) 2.155 5.998 ( -0.946 -3.343 -0.530) 3.515 6.096 ( 0.094 2.110 2.912) 3.598 6.321 ( 1.698 3.119 -2.493) 4.338 6.699 ( -0.983 -2.676 -0.279) 2.864 7.027 ( 3.095 -3.518 1.021) 4.796 7.252 ( -1.396 -4.380 3.811) 5.971 7.354 ( -3.827 -2.545 -4.063) 6.134 7.403 ( -0.599 -5.204 0.592) 5.272 7.688 ( 0.927 3.125 2.302) 3.991 7.795 ( -1.854 -4.540 0.345) 4.916 7.869 ( -1.868 -3.118 -3.622) 5.131 8.240 ( -1.983 -0.312 -1.040) 2.261 8.647 ( 5.278 0.590 1.634) 5.557 9.539 ( -0.784 0.760 -0.284) 1.128 ======================= Grid point 301 (128/199) ======================= q-point: (-0.50 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.748 ( 0.000 -0.016 -0.116) 0.117 1.352 ( -0.049 0.607 -1.207) 1.352 1.630 ( -1.095 0.941 2.660) 3.026 1.708 ( 1.264 -0.852 -5.616) 5.819 1.874 ( 0.734 0.426 2.258) 2.412 1.951 ( -1.460 -0.429 1.047) 1.847 1.979 ( 2.428 1.006 1.123) 2.858 2.022 ( -1.222 -0.722 -1.701) 2.215 2.141 ( -1.419 0.498 -2.900) 3.267 2.168 ( 0.883 -1.032 -0.363) 1.406 2.289 ( -0.165 -1.742 3.403) 3.826 2.362 ( 0.891 0.180 -1.531) 1.780 2.449 ( -0.967 -0.322 0.017) 1.020 2.504 ( -0.266 -0.499 0.076) 0.570 2.565 ( 2.749 -1.151 2.215) 3.713 2.605 ( -2.392 3.344 -1.949) 4.551 2.680 ( -0.026 -0.441 -0.387) 0.587 2.753 ( -0.238 0.033 -0.115) 0.266 2.904 ( 0.081 -0.132 0.437) 0.463 3.186 ( 1.228 1.178 1.991) 2.620 3.449 ( 0.829 -0.621 -0.341) 1.091 3.519 ( -2.851 0.254 -1.539) 3.250 3.697 ( 1.065 -0.255 0.619) 1.258 4.160 ( 0.022 -0.156 0.245) 0.292 5.461 ( -0.307 1.178 0.674) 1.391 5.492 ( 0.495 -0.003 0.421) 0.650 5.581 ( -0.379 -1.058 0.546) 1.249 5.748 ( 0.202 0.180 -1.085) 1.118 6.029 ( 0.416 1.581 0.960) 1.896 6.095 ( -0.384 -3.355 -1.984) 3.917 6.278 ( 0.025 1.540 0.466) 1.609 6.724 ( -0.446 -0.457 -0.801) 1.024 7.090 ( 0.545 -0.414 0.164) 0.704 7.243 ( -0.169 0.245 2.465) 2.483 7.389 ( -0.693 -0.012 -1.881) 2.005 7.465 ( 1.030 0.218 0.119) 1.059 7.647 ( 2.180 2.002 3.621) 4.677 7.840 ( -1.135 -1.032 0.631) 1.659 7.893 ( -1.092 -0.086 -3.697) 3.856 8.243 ( -1.817 -1.016 -1.752) 2.721 8.659 ( 1.773 0.479 1.540) 2.396 9.528 ( -0.208 0.034 -0.156) 0.262 ======================= Grid point 302 (129/199) ======================= q-point: (-0.42 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.779 ( 1.018 -2.430 -0.107) 2.637 1.328 ( -0.634 1.709 0.331) 1.853 1.565 ( -1.101 4.672 3.031) 5.677 1.710 ( 1.225 1.115 -5.306) 5.559 1.886 ( 4.447 1.400 2.874) 5.477 1.935 ( 0.439 2.910 0.747) 3.036 1.964 ( 3.323 1.079 -0.155) 3.498 2.020 ( 0.945 0.776 -0.469) 1.310 2.090 ( -1.548 1.630 -2.319) 3.230 2.205 ( 0.542 -0.524 -2.768) 2.869 2.319 ( 0.685 -0.828 0.892) 1.397 2.338 ( -1.207 1.740 -1.840) 2.805 2.429 ( -3.204 0.806 -0.713) 3.380 2.507 ( 0.596 1.750 0.172) 1.856 2.534 ( -1.313 0.262 0.074) 1.341 2.612 ( 4.178 -1.089 2.918) 5.211 2.714 ( 0.046 -2.716 -0.066) 2.718 2.801 ( -0.580 -3.606 -0.306) 3.665 2.915 ( -0.892 -1.902 0.085) 2.102 3.171 ( 0.197 0.993 3.696) 3.832 3.377 ( -4.743 5.422 -1.456) 7.350 3.524 ( 0.516 -0.508 0.066) 0.727 3.690 ( 0.662 1.369 -0.563) 1.622 4.057 ( -0.798 10.307 -0.038) 10.338 5.421 ( 1.298 2.783 -0.110) 3.073 5.477 ( 1.245 1.801 1.950) 2.932 5.636 ( -0.823 -4.026 -0.144) 4.112 5.722 ( 0.900 2.605 -0.398) 2.785 5.990 ( 1.028 2.083 0.234) 2.334 6.172 ( 0.151 -4.089 -5.005) 6.465 6.266 ( -1.876 -0.789 3.427) 3.986 6.710 ( 0.139 1.935 -1.335) 2.355 7.041 ( -2.971 3.333 -0.331) 4.477 7.272 ( 3.579 2.252 4.744) 6.355 7.316 ( -0.965 4.939 -2.908) 5.812 7.419 ( 4.169 4.775 -1.150) 6.443 7.637 ( 4.155 1.161 5.443) 6.945 7.819 ( 0.510 3.542 1.490) 3.876 7.861 ( -1.407 1.808 -4.492) 5.042 8.256 ( -1.869 -1.658 -2.549) 3.569 8.651 ( -1.891 0.325 1.289) 2.311 9.536 ( 0.468 -0.689 0.073) 0.836 ======================= Grid point 303 (130/199) ======================= q-point: (-0.33 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.837 ( 1.018 -2.247 0.063) 2.468 1.266 ( -3.458 3.569 0.963) 5.062 1.451 ( 0.853 6.538 5.990) 8.908 1.688 ( 2.251 2.335 -5.435) 6.329 1.803 ( 4.966 8.685 2.352) 10.278 1.886 ( 0.236 2.654 -0.113) 2.667 1.960 ( 2.283 2.080 0.125) 3.091 1.996 ( 1.535 2.632 -0.316) 3.063 2.051 ( 1.794 2.882 -3.017) 4.542 2.191 ( -3.329 0.297 -5.054) 6.059 2.263 ( -0.501 4.384 -0.233) 4.418 2.360 ( 2.257 -1.612 0.494) 2.817 2.383 ( -4.167 1.014 -0.465) 4.313 2.502 ( -0.783 -0.881 -0.303) 1.218 2.526 ( -0.121 0.092 -2.040) 2.046 2.663 ( 4.718 -0.549 4.386) 6.465 2.773 ( 0.727 -2.617 1.178) 2.960 2.850 ( 0.046 -2.356 -0.712) 2.461 2.971 ( 0.816 -0.858 0.759) 1.407 3.141 ( -0.716 2.269 3.852) 4.528 3.220 ( -6.047 4.854 -1.144) 7.838 3.520 ( -1.152 1.638 -0.485) 2.061 3.660 ( -0.311 1.397 -1.025) 1.760 3.764 ( -1.448 17.010 -0.051) 17.071 5.352 ( 3.222 5.663 -1.298) 6.643 5.464 ( -0.804 -0.349 2.088) 2.265 5.672 ( 1.649 2.782 1.309) 3.489 5.711 ( -0.088 -3.624 0.018) 3.626 5.967 ( 1.541 1.162 -0.562) 2.010 6.250 ( -0.209 -3.779 -6.324) 7.370 6.286 ( -1.919 -2.227 4.610) 5.468 6.640 ( 0.640 5.655 -1.390) 5.859 6.949 ( -2.076 4.519 -0.407) 4.989 7.080 ( -0.493 13.421 0.010) 13.430 7.195 ( 0.309 9.596 0.726) 9.628 7.424 ( 7.580 -0.503 -1.161) 7.685 7.646 ( 5.654 2.468 5.752) 8.435 7.712 ( 2.672 7.001 1.088) 7.573 7.813 ( -2.170 1.627 -2.524) 3.705 8.289 ( -1.454 -2.933 -2.995) 4.437 8.628 ( -4.933 -0.186 0.904) 5.019 9.561 ( 0.882 -1.427 0.342) 1.712 ======================= Grid point 304 (131/199) ======================= q-point: (-0.25 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.859 ( 0.621 0.999 0.880) 1.469 1.147 ( -4.834 5.610 0.323) 7.412 1.334 ( 0.581 6.156 10.473) 12.162 1.552 ( 4.047 12.518 -0.512) 13.165 1.726 ( 3.394 2.405 -1.809) 4.536 1.799 ( -1.648 6.684 -3.018) 7.517 1.887 ( 2.470 5.696 -0.932) 6.278 1.935 ( 0.770 4.141 0.386) 4.230 2.002 ( 2.344 3.256 -1.928) 4.451 2.135 ( -2.597 3.963 -3.359) 5.808 2.197 ( -1.917 0.790 -1.119) 2.357 2.342 ( -2.016 1.570 -0.760) 2.666 2.382 ( -1.040 0.606 0.921) 1.516 2.510 ( -0.647 -2.020 -4.309) 4.802 2.557 ( 3.156 -1.479 0.523) 3.524 2.675 ( 0.800 1.312 3.155) 3.509 2.799 ( 1.248 7.644 4.680) 9.050 2.834 ( -0.073 5.564 1.144) 5.681 2.898 ( 1.349 -0.393 -1.536) 2.082 3.088 ( -2.061 1.588 0.723) 2.700 3.230 ( -3.060 -6.241 -1.067) 7.032 3.297 ( -2.292 17.752 -2.383) 18.057 3.567 ( 0.544 2.244 1.988) 3.047 3.645 ( -1.840 -0.506 -0.646) 2.014 5.252 ( 2.906 5.726 -0.792) 6.470 5.472 ( -1.197 -0.767 0.795) 1.629 5.647 ( 2.689 1.025 2.070) 3.545 5.776 ( 0.765 -2.752 -0.230) 2.866 5.952 ( 1.050 1.349 -0.562) 1.799 6.275 ( -1.486 1.440 4.103) 4.596 6.341 ( 1.326 -2.108 -5.746) 6.262 6.497 ( -0.771 7.081 0.476) 7.138 6.752 ( 1.248 15.886 0.221) 15.937 6.847 ( -3.077 8.557 -3.711) 9.821 7.017 ( -0.236 6.813 -0.448) 6.832 7.459 ( 5.316 3.916 0.093) 6.604 7.521 ( 1.926 7.324 -2.775) 8.066 7.670 ( 6.658 2.929 6.861) 9.999 7.798 ( 0.613 -1.454 1.335) 2.067 8.354 ( -0.369 -4.348 -2.658) 5.110 8.603 ( -6.817 -0.954 0.450) 6.898 9.602 ( 0.837 -2.072 0.609) 2.316 ======================= Grid point 305 (132/199) ======================= q-point: (-0.17 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.795 ( 0.976 5.853 3.394) 6.836 1.001 ( -2.810 6.624 2.379) 7.578 1.193 ( -0.719 9.459 5.051) 10.747 1.337 ( 1.301 10.597 5.015) 11.796 1.568 ( -3.772 13.233 -3.427) 14.181 1.677 ( 2.281 4.231 0.132) 4.808 1.808 ( 3.949 4.012 -2.747) 6.263 1.855 ( -1.527 4.400 2.168) 5.137 1.918 ( 0.189 6.502 2.675) 7.033 2.050 ( 2.801 3.369 -2.385) 4.988 2.180 ( -4.405 -0.574 -1.733) 4.769 2.267 ( -2.394 4.428 -3.425) 6.088 2.359 ( -2.240 -0.066 0.655) 2.334 2.499 ( -1.061 9.965 3.696) 10.681 2.579 ( 2.416 -1.655 -5.411) 6.152 2.626 ( 2.298 -1.298 0.316) 2.658 2.640 ( -0.090 4.479 2.247) 5.012 2.785 ( -2.209 4.543 -5.274) 7.303 2.882 ( -0.938 0.468 -0.832) 1.339 2.929 ( 0.337 10.346 -1.152) 10.416 3.147 ( 1.824 -1.273 2.887) 3.644 3.343 ( -0.749 -5.426 -1.140) 5.595 3.550 ( -0.037 0.351 1.742) 1.777 3.657 ( -1.864 -1.772 0.892) 2.722 5.182 ( 2.176 2.379 0.147) 3.227 5.479 ( 0.065 -0.458 0.697) 0.837 5.659 ( 2.301 -0.283 0.905) 2.488 5.827 ( 1.242 -1.530 -1.271) 2.345 5.922 ( 0.820 2.194 -0.347) 2.368 6.103 ( 2.817 14.866 3.965) 15.642 6.333 ( 1.066 5.581 -3.919) 6.902 6.396 ( -2.261 5.611 4.956) 7.820 6.538 ( -0.179 0.775 -1.944) 2.101 6.622 ( -4.830 10.817 -9.677) 15.296 6.914 ( -0.967 4.329 -0.419) 4.456 7.234 ( -1.757 14.761 -2.656) 15.101 7.512 ( 5.129 0.737 -0.114) 5.183 7.667 ( 1.056 -0.415 3.311) 3.501 7.889 ( 9.786 -4.821 6.538) 12.718 8.448 ( 0.566 -4.853 -1.577) 5.134 8.585 ( -7.356 -1.590 0.105) 7.526 9.650 ( 0.414 -2.269 0.906) 2.478 ======================= Grid point 306 (133/199) ======================= q-point: (-0.08 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.663 ( 3.302 8.185 9.261) 12.793 0.843 ( -2.726 10.367 10.758) 15.187 0.984 ( -7.094 10.973 -5.660) 14.239 1.042 ( -0.004 11.613 -9.433) 14.962 1.421 ( 2.468 1.146 13.879) 14.143 1.599 ( 3.882 6.254 10.369) 12.716 1.724 ( -3.798 5.138 9.489) 11.439 1.772 ( 2.505 2.635 -3.548) 5.080 1.797 ( -0.878 3.889 -1.669) 4.322 2.032 ( 3.487 0.620 -7.460) 8.258 2.153 ( -5.028 0.086 -3.502) 6.128 2.193 ( -2.117 0.627 -3.898) 4.480 2.318 ( 0.343 5.643 1.698) 5.903 2.362 ( -0.142 2.388 -0.945) 2.572 2.499 ( -4.549 4.616 -14.096) 15.514 2.587 ( 0.750 2.541 0.512) 2.699 2.673 ( 1.105 -1.322 0.240) 1.740 2.731 ( 0.333 -0.485 -0.912) 1.085 2.839 ( 1.139 0.729 0.320) 1.390 2.871 ( 0.267 0.642 1.740) 1.873 3.192 ( 2.080 -1.465 2.114) 3.308 3.418 ( -1.094 -2.573 -0.954) 2.954 3.546 ( -0.186 0.014 1.362) 1.375 3.690 ( -0.768 -2.095 1.856) 2.902 5.198 ( 0.306 -3.358 1.151) 3.563 5.505 ( 4.832 -0.876 0.999) 5.011 5.665 ( -1.904 0.824 0.345) 2.103 5.805 ( -0.769 5.377 0.026) 5.431 5.859 ( 6.629 7.933 -3.817) 11.020 5.895 ( -0.589 2.299 0.666) 2.465 6.124 ( 3.467 10.355 0.984) 10.964 6.308 ( -15.465 11.011 -7.605) 20.451 6.384 ( -1.346 0.021 3.522) 3.771 6.601 ( 1.129 -3.370 -4.505) 5.738 6.826 ( -1.171 3.583 0.168) 3.773 6.920 ( -0.675 13.921 -1.221) 13.991 7.521 ( 2.446 0.651 1.143) 2.777 7.689 ( -1.533 -1.336 0.686) 2.146 8.116 ( 15.462 -8.718 5.297) 18.524 8.537 ( 0.506 -3.484 -0.231) 3.528 8.579 ( -5.886 -1.893 0.194) 6.186 9.692 ( 0.313 -1.593 1.170) 2.001 ======================= Grid point 308 (134/199) ======================= q-point: ( 0.08 0.08 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.680 ( 8.793 -0.000 12.751) 15.488 0.687 ( 11.969 -0.000 10.299) 15.790 0.803 ( -1.340 0.000 -7.642) 7.759 0.986 ( 3.587 -0.000 -11.919) 12.447 1.522 ( 1.795 -0.000 -0.146) 1.801 1.590 ( -3.065 0.000 16.369) 16.653 1.679 ( 8.005 -0.000 18.004) 19.704 1.702 ( 0.064 -0.000 -0.242) 0.251 1.780 ( -0.798 0.000 -4.067) 4.144 2.058 ( 2.245 -0.000 -21.296) 21.414 2.073 ( -3.538 0.000 1.805) 3.971 2.212 ( 0.229 -0.000 0.018) 0.230 2.227 ( 3.714 -0.000 -5.906) 6.976 2.319 ( -1.022 0.000 -1.008) 1.435 2.405 ( -2.150 0.000 -0.323) 2.174 2.549 ( -0.728 0.000 1.017) 1.251 2.683 ( -2.150 0.000 0.019) 2.150 2.737 ( -0.458 0.000 -0.233) 0.513 2.754 ( -6.454 0.000 2.040) 6.768 2.929 ( 2.446 -0.000 0.070) 2.447 3.239 ( 0.332 -0.000 -2.278) 2.302 3.420 ( -0.731 0.000 0.472) 0.870 3.576 ( 2.875 -0.000 -0.430) 2.907 3.723 ( 1.406 -0.000 1.556) 2.096 5.280 ( 1.206 -0.000 -0.216) 1.225 5.296 ( -23.856 0.000 5.907) 24.576 5.650 ( 2.922 -0.000 5.799) 6.493 5.695 ( -0.023 0.000 -0.050) 0.055 5.797 ( -1.717 0.000 -4.479) 4.797 5.878 ( -0.415 0.000 0.388) 0.568 6.004 ( -0.618 0.000 -0.191) 0.647 6.204 ( 8.985 -0.000 5.047) 10.306 6.384 ( 3.945 -0.000 3.095) 5.014 6.682 ( 2.211 -0.000 -5.057) 5.519 6.736 ( -0.802 0.000 1.500) 1.701 6.802 ( 0.996 -0.000 -1.438) 1.749 7.500 ( -3.751 0.000 1.101) 3.910 7.711 ( 2.644 -0.000 0.995) 2.825 8.206 ( -14.742 0.000 -6.628) 16.164 8.581 ( 0.231 -0.000 0.474) 0.527 8.658 ( 7.210 -0.000 -1.273) 7.322 9.739 ( 2.006 -0.000 -1.724) 2.645 ======================= Grid point 309 (135/199) ======================= q-point: ( 0.17 0.08 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.749 ( 3.720 -5.676 0.813) 6.835 0.876 ( 3.784 -7.697 8.150) 11.832 0.954 ( 4.580 -7.414 -1.394) 8.825 1.165 ( 10.558 -16.606 -5.991) 20.570 1.488 ( 1.548 1.282 3.164) 3.748 1.636 ( -2.637 -3.204 1.710) 4.488 1.687 ( -3.099 -1.629 -2.694) 4.417 1.809 ( 2.684 -5.197 10.927) 12.394 1.826 ( 0.319 -3.246 -0.085) 3.262 2.029 ( -2.306 0.345 -7.856) 8.195 2.093 ( 4.733 -3.377 1.224) 5.941 2.215 ( 3.329 0.507 -0.347) 3.385 2.328 ( -0.610 -5.685 2.047) 6.074 2.371 ( 1.483 0.287 2.601) 3.008 2.415 ( -0.495 -8.983 -8.542) 12.406 2.565 ( -2.964 -1.188 0.655) 3.260 2.656 ( -2.944 0.120 -0.976) 3.104 2.727 ( -0.844 -0.643 -0.500) 1.173 2.764 ( -2.957 -3.336 1.709) 4.774 2.926 ( 1.490 1.204 0.378) 1.952 3.215 ( -0.820 1.866 -2.435) 3.176 3.393 ( -1.141 2.156 0.351) 2.465 3.584 ( 2.376 0.831 -0.339) 2.540 3.711 ( 2.248 2.105 1.423) 3.392 5.089 ( -8.761 1.898 5.432) 10.482 5.457 ( -3.263 -8.001 -1.507) 8.771 5.642 ( -1.432 0.041 2.493) 2.875 5.762 ( -2.582 -1.734 0.994) 3.265 5.850 ( -1.558 -5.589 -1.734) 6.056 5.935 ( -1.075 -9.452 -4.384) 10.475 6.098 ( -2.300 -9.198 -0.151) 9.482 6.274 ( -1.757 -3.771 9.329) 10.214 6.413 ( 10.896 0.668 2.466) 11.191 6.638 ( 2.169 2.984 -5.407) 6.546 6.805 ( -0.452 -4.254 2.151) 4.789 6.943 ( 2.089 -12.187 -0.910) 12.398 7.471 ( -5.471 0.260 1.095) 5.585 7.720 ( 2.718 0.727 0.090) 2.815 8.051 ( -13.575 4.981 -7.595) 16.333 8.523 ( -0.438 5.208 1.569) 5.457 8.676 ( 7.901 1.952 -0.442) 8.151 9.717 ( 0.595 2.649 -1.357) 3.035 ======================= Grid point 310 (136/199) ======================= q-point: ( 0.25 0.08 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.877 ( 2.814 -3.043 -4.127) 5.849 1.028 ( 3.884 -6.466 4.983) 9.040 1.180 ( 1.762 -13.231 1.766) 13.464 1.497 ( 3.680 -4.805 7.718) 9.808 1.555 ( 4.101 -9.344 -9.724) 14.095 1.671 ( -3.756 -3.302 -2.838) 5.750 1.740 ( -3.269 -5.623 -1.287) 6.630 1.854 ( -4.561 -2.461 0.204) 5.187 1.908 ( 0.119 -3.430 1.200) 3.636 2.039 ( -0.510 -2.663 -0.206) 2.719 2.211 ( 2.825 0.272 -0.327) 2.857 2.251 ( 2.625 -5.052 1.032) 5.786 2.369 ( 2.843 -0.473 4.261) 5.144 2.434 ( -3.276 -3.930 3.790) 6.367 2.582 ( -1.361 -2.277 1.405) 3.002 2.612 ( 0.705 -4.968 -4.159) 6.517 2.700 ( 0.904 -10.262 -5.436) 11.648 2.752 ( 2.013 -1.941 1.308) 3.087 2.854 ( -1.671 -3.627 2.019) 4.475 2.934 ( 0.659 -5.177 -0.028) 5.219 3.171 ( -1.400 0.825 -2.140) 2.687 3.328 ( -0.097 3.804 0.475) 3.834 3.579 ( 1.059 0.481 -0.639) 1.327 3.679 ( 2.606 2.557 1.420) 3.917 5.078 ( -5.316 -4.103 3.608) 7.623 5.540 ( 1.976 -1.186 -3.132) 3.888 5.637 ( -3.461 -1.013 -0.392) 3.628 5.775 ( -3.097 -1.137 1.220) 3.517 5.901 ( -1.778 -2.014 0.268) 2.699 6.165 ( -3.447 -8.911 0.116) 9.555 6.244 ( 1.073 -5.968 -0.005) 6.064 6.417 ( -4.016 -15.146 1.051) 15.705 6.514 ( 4.420 -3.072 3.745) 6.558 6.609 ( 3.416 -1.198 -2.609) 4.462 6.901 ( 0.677 -5.154 2.010) 5.573 7.215 ( 0.284 -13.380 1.100) 13.429 7.426 ( -7.455 0.039 0.408) 7.466 7.719 ( 0.264 0.081 -2.743) 2.757 7.894 ( -7.209 3.685 -5.813) 9.967 8.406 ( -0.704 5.721 2.617) 6.330 8.686 ( 8.333 1.978 -0.022) 8.565 9.658 ( -0.622 2.963 -0.663) 3.100 ======================= Grid point 311 (137/199) ======================= q-point: ( 0.33 0.08 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.889 ( 0.874 1.897 -1.788) 2.750 1.195 ( 5.428 -6.461 2.024) 8.678 1.432 ( 0.977 -9.955 2.108) 10.223 1.571 ( -2.764 -2.157 -9.571) 10.193 1.653 ( -2.217 -5.334 3.143) 6.576 1.771 ( -2.620 -6.350 -0.643) 6.900 1.862 ( 0.175 -6.370 -0.499) 6.392 1.888 ( -5.884 -4.053 0.787) 7.188 1.954 ( -0.310 -1.555 0.814) 1.783 2.115 ( 2.666 -3.123 3.273) 5.251 2.215 ( 0.519 -0.681 -0.972) 1.295 2.309 ( -2.737 -1.618 0.293) 3.193 2.424 ( 1.210 -1.731 -0.247) 2.126 2.451 ( 1.338 -0.898 3.637) 3.978 2.551 ( 0.019 2.314 -1.455) 2.734 2.710 ( -1.606 -1.201 -2.355) 3.093 2.826 ( -0.591 1.018 0.573) 1.309 2.849 ( -0.037 -2.146 2.140) 3.031 2.890 ( -0.220 -8.923 -4.979) 10.221 3.103 ( 2.227 -3.653 2.151) 4.789 3.253 ( 2.780 0.792 0.595) 2.951 3.314 ( 2.971 -14.578 -0.521) 14.887 3.589 ( -0.175 -1.847 -0.978) 2.097 3.647 ( 1.952 1.804 1.618) 3.111 5.165 ( -3.667 -6.788 2.342) 8.063 5.547 ( 1.903 1.034 -3.353) 3.992 5.642 ( -3.409 -1.697 -1.465) 4.080 5.760 ( -0.691 1.596 0.659) 1.859 5.913 ( -3.086 -0.954 1.298) 3.481 6.185 ( 0.335 1.407 6.656) 6.811 6.423 ( 0.683 -5.461 -7.127) 9.005 6.509 ( 0.853 -0.396 -0.189) 0.959 6.730 ( -2.044 -16.506 0.443) 16.638 6.793 ( 1.236 -11.591 4.613) 12.537 7.020 ( 1.393 -6.680 0.843) 6.875 7.384 ( -7.801 -0.841 -0.993) 7.909 7.462 ( -1.460 -11.394 1.672) 11.609 7.723 ( -4.519 -1.939 -6.561) 8.199 7.811 ( -0.745 2.308 -1.084) 2.657 8.306 ( -0.285 4.048 2.998) 5.045 8.697 ( 7.283 1.817 -0.026) 7.506 9.599 ( -1.061 2.311 -0.446) 2.581 ======================= Grid point 312 (138/199) ======================= q-point: ( 0.42 0.08 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.834 ( -0.386 3.387 -0.507) 3.446 1.318 ( 3.063 -2.878 -0.230) 4.209 1.573 ( 0.538 -4.768 -5.743) 7.484 1.582 ( -2.052 -2.363 1.013) 3.289 1.793 ( -4.048 -8.781 -1.807) 9.836 1.858 ( -3.198 -3.734 -0.186) 4.920 1.907 ( -5.424 -1.968 0.902) 5.840 1.971 ( -1.786 -3.401 1.002) 3.970 1.995 ( 2.620 -3.248 2.262) 4.747 2.156 ( 1.672 -0.021 2.768) 3.234 2.266 ( -0.465 -3.753 0.393) 3.802 2.310 ( -1.926 -0.374 0.645) 2.065 2.440 ( 2.122 0.045 0.387) 2.158 2.495 ( 0.373 -1.118 1.336) 1.782 2.518 ( 2.094 0.912 -0.911) 2.460 2.689 ( -3.528 1.030 -4.170) 5.558 2.763 ( -0.920 3.388 0.925) 3.631 2.841 ( -0.007 1.473 0.336) 1.511 2.992 ( -0.178 1.430 -2.086) 2.536 3.173 ( 3.128 -3.647 2.409) 5.374 3.296 ( 3.167 -3.838 -2.763) 5.692 3.523 ( 0.592 -1.057 0.334) 1.256 3.647 ( 1.797 -0.996 1.966) 2.844 3.775 ( 0.828 -16.459 0.228) 16.482 5.286 ( -2.672 -7.021 1.415) 7.645 5.528 ( 0.076 1.424 -2.964) 3.289 5.655 ( -2.614 -0.631 0.441) 2.725 5.712 ( 0.252 1.900 -0.264) 1.935 5.928 ( -2.245 -2.534 0.998) 3.529 6.154 ( 1.863 2.637 4.443) 5.493 6.401 ( 1.628 3.710 -4.770) 6.258 6.611 ( -0.863 -5.684 0.524) 5.773 6.952 ( 1.591 -6.423 1.620) 6.813 7.057 ( -0.410 -13.539 2.951) 13.863 7.199 ( -0.188 -10.094 -0.130) 10.096 7.342 ( -7.070 0.120 -2.105) 7.377 7.655 ( -1.941 -8.423 0.175) 8.646 7.717 ( -4.560 -0.606 -5.066) 6.843 7.805 ( 1.617 -1.459 0.763) 2.307 8.249 ( 0.213 1.893 2.696) 3.302 8.700 ( 4.780 1.594 -0.286) 5.047 9.556 ( -0.802 1.423 -0.302) 1.661 ======================= Grid point 313 (139/199) ======================= q-point: ( 0.50 0.08 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.770 ( -0.477 2.320 -0.132) 2.372 1.352 ( -0.025 -0.385 -1.975) 2.012 1.621 ( -0.349 -1.300 2.920) 3.215 1.660 ( 0.528 -4.019 -5.913) 7.169 1.871 ( -2.045 -0.532 1.420) 2.546 1.905 ( -3.887 -3.817 -1.220) 5.583 1.928 ( -3.128 -3.787 0.113) 4.913 2.011 ( 0.708 -1.251 0.212) 1.453 2.090 ( 1.631 -4.494 0.455) 4.802 2.161 ( -0.814 0.164 0.775) 1.136 2.286 ( 0.218 0.655 3.177) 3.251 2.349 ( 0.855 -2.514 -0.198) 2.663 2.449 ( 1.240 0.220 1.236) 1.765 2.495 ( -0.713 -0.071 -0.138) 0.730 2.544 ( 1.955 -1.388 0.669) 2.489 2.636 ( -3.367 1.815 -4.581) 5.968 2.700 ( -0.070 2.385 1.121) 2.636 2.802 ( 0.247 2.938 0.012) 2.948 2.930 ( 0.823 2.729 -0.166) 2.855 3.222 ( 2.564 0.811 -0.249) 2.701 3.395 ( -0.998 -4.300 -0.782) 4.483 3.516 ( 0.097 0.559 0.289) 0.637 3.690 ( 2.158 -1.532 0.763) 2.755 4.056 ( 0.081 -10.147 0.499) 10.159 5.403 ( -1.381 -5.933 0.515) 6.113 5.490 ( -2.175 1.548 -0.558) 2.727 5.616 ( 0.425 2.579 1.372) 2.952 5.726 ( -0.324 -1.937 -1.625) 2.549 5.986 ( -0.829 -3.956 -0.240) 4.049 6.110 ( 1.561 2.870 2.473) 4.098 6.335 ( 0.912 3.461 -2.225) 4.214 6.691 ( -0.256 -2.804 0.421) 2.847 7.059 ( 1.751 -3.342 0.784) 3.853 7.231 ( -2.406 -2.102 3.984) 5.107 7.314 ( -2.212 -5.369 -3.022) 6.546 7.393 ( -1.016 -6.868 -1.066) 7.024 7.677 ( -2.797 0.388 -3.344) 4.377 7.793 ( 0.987 -4.097 3.673) 5.590 7.856 ( 0.377 -2.479 -2.087) 3.262 8.231 ( 0.360 0.390 1.847) 1.921 8.689 ( 1.344 1.485 -0.651) 2.106 9.533 ( -0.127 0.579 -0.093) 0.600 ======================= Grid point 314 (140/199) ======================= q-point: (-0.42 0.08 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.752 ( 0.502 -0.615 -0.097) 0.800 1.348 ( -0.363 0.604 -0.983) 1.209 1.616 ( -1.155 1.211 2.417) 2.940 1.720 ( 1.204 -1.147 -5.319) 5.573 1.892 ( 1.326 -1.697 1.478) 2.612 1.931 ( -1.191 -1.543 1.159) 2.268 1.986 ( -1.373 -2.635 -0.655) 3.043 2.029 ( 2.304 0.312 0.097) 2.327 2.116 ( -1.764 2.373 -1.869) 3.498 2.188 ( 1.967 -2.971 -0.798) 3.651 2.288 ( -0.510 -0.915 2.925) 3.107 2.368 ( 0.226 1.172 -1.809) 2.167 2.437 ( -0.900 1.300 0.959) 1.849 2.503 ( -0.144 -1.176 0.503) 1.287 2.575 ( -2.178 2.780 -2.191) 4.156 2.601 ( 2.750 -2.689 1.816) 4.253 2.679 ( -0.150 -0.435 0.010) 0.461 2.753 ( 0.289 0.686 0.027) 0.745 2.905 ( -0.051 0.756 0.321) 0.823 3.201 ( 1.014 1.727 0.115) 2.006 3.408 ( -5.377 0.937 -0.646) 5.496 3.527 ( 2.436 -0.430 1.509) 2.898 3.717 ( 2.129 0.317 -0.691) 2.261 4.156 ( -0.665 0.025 0.180) 0.690 5.450 ( -1.338 0.955 0.768) 1.814 5.501 ( 0.666 -3.378 0.188) 3.449 5.578 ( -0.177 0.934 0.500) 1.074 5.750 ( 0.231 -0.269 -0.938) 1.003 6.034 ( 0.193 0.827 0.383) 0.931 6.095 ( 0.691 -2.530 -1.321) 2.937 6.277 ( -0.276 2.369 0.318) 2.406 6.723 ( 0.241 -0.506 -0.106) 0.570 7.074 ( -2.665 1.649 -0.416) 3.161 7.260 ( 2.213 -2.828 2.322) 4.276 7.378 ( -0.750 -0.175 -0.744) 1.071 7.472 ( 0.239 -1.239 -1.290) 1.804 7.662 ( -0.459 -0.060 0.187) 0.499 7.846 ( 1.984 -0.424 3.178) 3.771 7.886 ( 0.387 0.066 -2.863) 2.889 8.233 ( 0.428 -0.259 0.883) 1.014 8.656 ( -2.223 1.444 -1.008) 2.836 9.531 ( 0.541 -0.146 0.141) 0.578 ======================= Grid point 315 (141/199) ======================= q-point: (-0.33 0.08 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.793 ( 1.181 -2.624 -0.038) 2.878 1.314 ( -1.485 2.584 0.160) 2.984 1.568 ( 1.023 3.878 4.230) 5.829 1.719 ( 1.029 0.873 -5.911) 6.063 1.913 ( -1.235 0.472 1.214) 1.794 1.950 ( 2.688 1.185 1.989) 3.548 2.000 ( 1.648 2.017 -0.676) 2.691 2.028 ( 0.930 0.477 -1.394) 1.743 2.090 ( 2.002 -0.435 -0.773) 2.190 2.204 ( -0.189 1.820 -1.978) 2.695 2.313 ( -2.513 2.301 -0.923) 3.530 2.332 ( 0.968 -2.764 -0.526) 2.976 2.392 ( -2.527 2.557 -1.004) 3.733 2.506 ( -0.872 2.188 0.238) 2.367 2.521 ( -0.337 -0.420 -0.540) 0.763 2.677 ( 5.731 -2.220 3.840) 7.247 2.714 ( -0.081 -3.078 0.434) 3.109 2.793 ( -0.556 -3.305 -0.305) 3.365 2.900 ( -1.661 -1.892 -0.188) 2.525 3.176 ( -0.133 1.362 1.461) 2.002 3.315 ( -4.544 5.238 -0.155) 6.936 3.538 ( 1.388 0.708 1.628) 2.253 3.699 ( 0.828 2.229 -1.883) 3.033 4.044 ( -1.146 10.666 0.033) 10.727 5.435 ( 0.953 0.598 -0.351) 1.178 5.490 ( 0.702 3.563 1.136) 3.805 5.626 ( -0.754 -4.603 0.276) 4.673 5.733 ( 0.771 2.169 0.266) 2.318 6.002 ( 0.767 1.762 -0.200) 1.932 6.171 ( -0.067 -4.000 -3.131) 5.080 6.249 ( -1.003 -0.136 1.834) 2.095 6.714 ( 0.709 1.778 -0.721) 2.046 7.002 ( -3.078 3.130 -0.478) 4.416 7.296 ( -1.062 7.655 -1.109) 7.807 7.322 ( 2.977 1.098 4.257) 5.310 7.459 ( 2.466 1.551 -3.169) 4.305 7.679 ( 1.371 -1.322 2.862) 3.438 7.832 ( 1.117 3.553 1.808) 4.140 7.856 ( 1.672 2.817 -2.304) 4.005 8.248 ( 0.978 -0.998 0.119) 1.402 8.607 ( -5.155 1.136 -1.285) 5.433 9.545 ( 0.872 -0.797 0.334) 1.228 ======================= Grid point 316 (142/199) ======================= q-point: (-0.25 0.08 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.851 ( 1.091 -2.069 0.072) 2.340 1.226 ( -2.752 4.823 0.431) 5.569 1.475 ( 1.952 6.486 6.573) 9.439 1.714 ( 2.565 1.112 -5.680) 6.331 1.841 ( -0.157 6.995 -0.605) 7.023 1.896 ( 2.649 4.215 2.772) 5.699 1.974 ( 0.339 1.976 0.698) 2.123 2.003 ( 0.202 2.416 -1.683) 2.952 2.091 ( 3.691 3.264 -0.784) 4.989 2.141 ( -3.927 2.191 -5.241) 6.906 2.257 ( -0.069 2.886 -0.441) 2.920 2.323 ( -4.514 0.649 0.694) 4.613 2.394 ( 2.171 -1.182 -0.295) 2.489 2.478 ( -2.135 0.071 -2.389) 3.205 2.535 ( 0.779 -1.564 -0.290) 1.771 2.722 ( 3.847 1.645 3.502) 5.456 2.782 ( 0.445 -2.982 1.293) 3.281 2.860 ( 1.941 -4.168 0.275) 4.606 2.976 ( -0.099 -3.169 0.329) 3.188 3.133 ( -3.943 1.790 -2.046) 4.789 3.157 ( -1.080 7.324 4.051) 8.439 3.510 ( -0.392 3.691 0.217) 3.718 3.651 ( -1.078 2.113 -2.246) 3.267 3.751 ( -0.607 16.111 0.590) 16.133 5.384 ( 1.742 5.896 -0.039) 6.148 5.455 ( -0.291 -0.517 -0.099) 0.602 5.692 ( 1.348 2.032 1.510) 2.868 5.710 ( -0.056 -3.886 0.252) 3.894 5.979 ( 0.492 1.078 -0.607) 1.332 6.230 ( -2.967 -2.681 1.838) 4.401 6.285 ( 1.733 -3.279 -3.192) 4.893 6.648 ( 0.804 5.739 -0.742) 5.842 6.923 ( -1.958 3.493 -0.288) 4.015 7.071 ( -0.923 13.878 -0.545) 13.920 7.204 ( 0.840 10.116 1.355) 10.241 7.494 ( 3.984 -1.661 -1.599) 4.603 7.686 ( 0.640 5.705 2.111) 6.116 7.764 ( 2.985 -0.144 1.136) 3.197 7.793 ( 1.221 4.528 0.304) 4.700 8.292 ( 2.324 -2.479 -0.343) 3.415 8.554 ( -6.910 0.310 -1.412) 7.060 9.572 ( 0.800 -1.434 0.460) 1.705 ======================= Grid point 317 (143/199) ======================= q-point: (-0.17 0.08 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.871 ( 1.097 1.021 0.132) 1.505 1.104 ( -2.212 5.751 0.710) 6.202 1.354 ( 1.371 7.095 9.295) 11.773 1.598 ( 3.330 12.364 0.069) 12.804 1.732 ( -2.285 3.782 -6.969) 8.252 1.803 ( 2.755 7.336 1.347) 7.951 1.913 ( 1.547 3.954 0.113) 4.247 1.933 ( -0.863 4.443 0.012) 4.526 2.025 ( 1.081 4.384 -0.462) 4.539 2.085 ( -4.245 0.574 -4.644) 6.318 2.197 ( 1.388 3.092 0.337) 3.406 2.311 ( -2.060 -0.262 0.556) 2.150 2.360 ( -1.951 3.464 -1.075) 4.119 2.509 ( 0.221 -3.143 -2.743) 4.178 2.588 ( 1.234 -2.653 0.095) 2.927 2.686 ( 1.078 3.339 1.996) 4.037 2.817 ( 1.135 9.694 4.370) 10.694 2.837 ( 0.329 3.317 1.209) 3.546 2.912 ( 0.904 2.367 -1.661) 3.030 3.066 ( -1.431 2.136 0.437) 2.608 3.197 ( -1.860 -6.849 -0.956) 7.161 3.278 ( -0.658 14.338 -1.783) 14.463 3.577 ( 0.849 2.551 1.718) 3.191 3.625 ( -1.300 -0.169 -0.599) 1.441 5.270 ( -0.157 5.540 1.462) 5.732 5.469 ( 0.995 -0.590 -1.677) 2.037 5.676 ( 1.740 0.654 1.813) 2.596 5.781 ( 0.054 -3.196 -0.454) 3.228 5.957 ( -0.012 1.323 -0.523) 1.423 6.253 ( -2.782 -1.215 5.079) 5.918 6.361 ( 2.650 -1.435 -6.188) 6.883 6.494 ( 0.180 8.668 0.821) 8.708 6.762 ( 0.309 15.805 0.386) 15.813 6.808 ( -2.676 8.748 -2.464) 9.474 7.014 ( -0.250 7.516 -0.585) 7.543 7.486 ( 0.120 10.415 -0.492) 10.428 7.548 ( 1.750 1.071 -0.729) 2.177 7.708 ( 0.284 3.825 0.848) 3.929 7.844 ( 5.005 -4.140 3.861) 7.556 8.373 ( 3.525 -3.859 -0.425) 5.244 8.515 ( -7.038 -0.801 -1.280) 7.198 9.610 ( 0.498 -1.983 0.542) 2.115 ======================= Grid point 318 (144/199) ======================= q-point: (-0.08 0.08 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.819 ( 2.301 5.118 1.076) 5.714 0.983 ( -0.598 5.567 2.316) 6.059 1.183 ( -1.566 11.864 5.696) 13.253 1.375 ( 4.179 13.257 3.943) 14.448 1.530 ( -1.599 10.971 -6.130) 12.669 1.707 ( 1.811 4.167 1.539) 4.797 1.824 ( -2.391 5.040 0.597) 5.610 1.854 ( 2.768 3.486 -1.095) 4.584 1.918 ( -0.563 6.899 3.751) 7.873 2.070 ( -0.474 -0.201 -2.599) 2.649 2.151 ( 1.090 3.078 1.299) 3.514 2.226 ( -3.182 4.864 -5.149) 7.765 2.339 ( -0.846 -1.211 1.402) 2.037 2.489 ( -1.228 8.856 3.857) 9.738 2.599 ( 1.465 0.887 -5.544) 5.803 2.621 ( -1.445 2.342 1.193) 2.999 2.666 ( 2.335 2.751 0.747) 3.685 2.755 ( -1.520 4.893 -6.051) 7.929 2.870 ( -0.772 0.495 1.342) 1.625 2.935 ( 0.348 7.448 -0.868) 7.506 3.168 ( 1.281 -1.439 1.741) 2.596 3.334 ( -0.610 -5.475 -0.615) 5.543 3.554 ( 0.620 0.655 1.016) 1.359 3.644 ( -0.261 -2.024 1.085) 2.312 5.183 ( -2.236 2.250 2.869) 4.276 5.492 ( 1.972 -0.980 -1.388) 2.603 5.677 ( 0.417 0.407 0.759) 0.957 5.827 ( -0.940 -1.139 -0.772) 1.666 5.925 ( -0.255 1.769 -0.028) 1.788 6.150 ( 4.379 13.744 0.282) 14.428 6.308 ( -4.928 -0.380 0.948) 5.033 6.400 ( 2.679 11.027 3.514) 11.880 6.526 ( -3.040 8.801 -1.955) 9.514 6.570 ( -0.891 5.451 -7.693) 9.471 6.903 ( -0.763 4.532 0.327) 4.608 7.216 ( -0.870 15.178 -0.976) 15.234 7.544 ( -0.528 0.709 0.727) 1.144 7.670 ( 0.874 0.340 0.328) 0.993 7.995 ( 4.538 -8.164 2.970) 9.801 8.475 ( 1.371 -4.349 -0.420) 4.579 8.504 ( -2.469 -1.619 -0.431) 2.983 9.655 ( 0.424 -2.228 0.563) 2.337 ======================= Grid point 321 (145/199) ======================= q-point: ( 0.17 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.795 ( 1.021 -0.000 -6.390) 6.471 0.825 ( 12.230 -0.000 9.887) 15.727 0.869 ( 15.764 -0.000 9.118) 18.211 1.041 ( 7.663 -0.000 -11.605) 13.906 1.532 ( 0.148 -0.000 -4.206) 4.208 1.553 ( -3.142 0.000 7.247) 7.898 1.715 ( 1.834 -0.000 2.306) 2.947 1.723 ( -2.592 0.000 -2.401) 3.533 1.801 ( 2.006 -0.000 9.836) 10.038 2.036 ( -1.079 0.000 -5.206) 5.317 2.112 ( 8.169 -0.000 -4.099) 9.139 2.214 ( 0.090 -0.000 0.263) 0.278 2.276 ( 4.230 -0.000 -3.578) 5.540 2.301 ( -1.689 0.000 -1.082) 2.006 2.391 ( -0.099 0.000 3.512) 3.513 2.537 ( -1.386 0.000 0.748) 1.575 2.604 ( -9.814 0.000 1.609) 9.945 2.716 ( -0.412 0.000 0.004) 0.412 2.730 ( -0.750 0.000 -0.153) 0.766 2.950 ( 1.089 -0.000 0.949) 1.444 3.224 ( -2.438 0.000 -4.672) 5.270 3.405 ( -2.090 0.000 -0.283) 2.109 3.611 ( 2.575 -0.000 -0.321) 2.595 3.750 ( 2.924 -0.000 1.017) 3.095 5.065 ( -14.843 0.000 6.689) 16.281 5.302 ( 2.260 -0.000 -0.102) 2.262 5.660 ( -1.572 0.000 3.312) 3.666 5.696 ( 0.117 -0.000 0.335) 0.355 5.754 ( -4.250 0.000 -1.734) 4.590 5.869 ( -1.023 0.000 -0.165) 1.037 5.994 ( -1.117 0.000 -0.237) 1.142 6.236 ( -2.471 0.000 9.368) 9.689 6.515 ( 12.731 -0.000 2.586) 12.991 6.716 ( 4.902 -0.000 -4.849) 6.895 6.727 ( -0.763 0.000 1.507) 1.689 6.814 ( 1.143 -0.000 -1.327) 1.751 7.443 ( -5.670 0.000 1.087) 5.773 7.744 ( 1.746 -0.000 -0.286) 1.769 8.005 ( -15.169 0.000 -9.519) 17.908 8.579 ( -0.677 0.000 1.889) 2.007 8.740 ( 6.767 -0.000 -1.229) 6.878 9.748 ( -0.392 0.000 -2.582) 2.612 ======================= Grid point 322 (146/199) ======================= q-point: ( 0.25 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.812 ( 6.004 -3.272 -4.346) 8.102 0.940 ( 6.482 -5.047 8.757) 12.007 1.028 ( 7.500 -5.098 -1.596) 9.208 1.303 ( 11.998 -15.604 -1.340) 19.729 1.506 ( 1.275 0.031 -0.081) 1.278 1.609 ( -1.782 -3.974 -0.664) 4.406 1.640 ( -3.825 1.033 -3.340) 5.182 1.809 ( -3.571 -0.240 3.999) 5.367 1.824 ( 0.121 -5.025 0.245) 5.032 2.000 ( -1.441 0.577 -5.610) 5.820 2.187 ( 7.856 -2.737 4.146) 9.295 2.252 ( 2.551 0.256 0.959) 2.738 2.319 ( -0.605 -4.966 3.212) 5.945 2.379 ( -0.222 -1.127 3.762) 3.933 2.437 ( 4.118 -9.698 -5.324) 11.805 2.516 ( -4.739 -0.727 0.367) 4.808 2.611 ( -3.569 -3.801 -0.661) 5.256 2.716 ( -0.450 -1.301 0.617) 1.509 2.748 ( -0.120 -1.998 0.714) 2.125 2.941 ( 0.822 1.266 0.758) 1.689 3.184 ( -4.091 1.516 -4.531) 6.290 3.374 ( -2.017 1.615 0.420) 2.618 3.609 ( 1.600 1.350 -0.692) 2.205 3.747 ( 3.382 2.147 1.139) 4.165 4.991 ( -7.229 -1.073 4.405) 8.533 5.439 ( 0.206 -8.889 -1.303) 8.987 5.613 ( -3.515 0.819 0.827) 3.702 5.723 ( -3.906 -0.468 1.430) 4.186 5.836 ( -0.872 -5.979 -0.325) 6.051 5.913 ( -1.766 -8.884 -3.098) 9.573 6.077 ( -1.370 -8.658 -0.169) 8.768 6.241 ( -3.651 -2.349 9.945) 10.852 6.546 ( 8.566 2.161 3.519) 9.510 6.666 ( 3.425 2.875 -5.008) 6.714 6.807 ( 0.549 -4.331 2.549) 5.055 6.971 ( 2.586 -11.466 0.066) 11.754 7.395 ( -7.206 0.995 0.520) 7.293 7.729 ( -2.638 1.270 -4.442) 5.320 7.901 ( -7.723 1.929 -6.887) 10.526 8.520 ( -0.253 5.022 3.436) 6.090 8.767 ( 7.359 1.306 -1.065) 7.549 9.711 ( -1.384 2.663 -1.724) 3.461 ======================= Grid point 323 (147/199) ======================= q-point: ( 0.33 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.910 ( 3.200 -1.602 -4.172) 5.497 1.094 ( 6.373 -6.754 5.176) 10.631 1.219 ( 4.387 -10.240 0.296) 11.144 1.534 ( 1.751 -1.426 -3.735) 4.365 1.577 ( -1.888 -2.843 1.435) 3.702 1.636 ( 0.113 -6.261 -2.214) 6.642 1.722 ( 1.059 -7.699 -1.159) 7.858 1.788 ( -5.816 -1.681 0.703) 6.095 1.903 ( -1.210 -3.120 -0.273) 3.358 2.036 ( 0.102 -4.460 0.388) 4.478 2.231 ( -2.762 0.446 -0.426) 2.830 2.264 ( 2.611 -0.849 0.723) 2.839 2.388 ( -0.985 -1.883 -1.182) 2.432 2.435 ( 2.887 -2.000 9.170) 9.819 2.570 ( -0.716 -3.687 1.066) 3.904 2.625 ( 2.056 -5.112 -2.650) 6.115 2.696 ( -0.450 -7.544 -6.600) 10.034 2.791 ( 3.289 -3.524 2.760) 5.555 2.826 ( -2.873 -5.389 0.832) 6.164 2.959 ( 3.577 -6.508 2.051) 7.704 3.139 ( -3.422 -0.868 -3.388) 4.893 3.326 ( -0.344 2.277 0.845) 2.453 3.589 ( 0.683 1.029 -1.263) 1.767 3.714 ( 2.854 3.016 1.442) 4.395 5.024 ( -3.904 -5.010 2.450) 6.808 5.560 ( 1.503 -2.133 -2.850) 3.864 5.589 ( -3.947 -0.679 -0.619) 4.053 5.737 ( -3.215 -2.797 1.407) 4.487 5.873 ( -2.794 -1.334 0.435) 3.126 6.134 ( -1.772 -8.555 2.453) 9.074 6.252 ( 0.355 -8.473 -1.193) 8.563 6.376 ( -2.859 -15.072 2.435) 15.533 6.557 ( 2.386 1.293 2.010) 3.377 6.658 ( 4.668 -1.604 -0.799) 5.000 6.917 ( 1.596 -5.680 2.527) 6.418 7.217 ( -0.194 -12.144 1.674) 12.260 7.328 ( -8.545 0.398 -0.988) 8.611 7.674 ( -6.547 0.479 -9.056) 11.185 7.843 ( -0.627 1.617 -1.888) 2.563 8.412 ( 0.977 5.800 4.961) 7.695 8.777 ( 6.656 1.998 -1.201) 7.052 9.643 ( -1.571 2.872 -0.882) 3.390 ======================= Grid point 324 (148/199) ======================= q-point: ( 0.42 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.902 ( 1.437 2.977 -1.491) 3.626 1.262 ( 5.008 -5.412 1.973) 7.633 1.447 ( 1.667 -9.682 1.273) 9.906 1.527 ( -2.755 -0.364 -9.397) 9.799 1.625 ( -2.618 -4.920 0.593) 5.605 1.746 ( -1.449 -5.306 1.075) 5.605 1.810 ( -6.124 -3.717 -0.052) 7.164 1.886 ( 2.025 -5.389 2.565) 6.302 1.948 ( -0.328 -2.931 0.251) 2.960 2.137 ( 0.582 -4.136 2.265) 4.752 2.202 ( -3.691 -0.413 0.498) 3.747 2.288 ( 0.812 -0.705 0.780) 1.329 2.421 ( -0.909 -2.113 -0.827) 2.444 2.479 ( 1.410 -1.092 3.521) 3.947 2.567 ( 2.731 1.908 -1.105) 3.510 2.687 ( -1.700 -0.023 -2.552) 3.066 2.813 ( -1.623 2.092 -0.351) 2.671 2.850 ( -0.175 -0.754 1.304) 1.516 2.888 ( 0.699 -10.224 -4.374) 11.143 3.125 ( 1.075 -3.119 1.351) 3.565 3.283 ( 2.092 -1.563 0.566) 2.672 3.357 ( 4.018 -15.992 0.578) 16.500 3.585 ( -0.313 -1.133 -1.123) 1.626 3.672 ( 1.874 2.292 1.698) 3.413 5.128 ( -2.563 -7.074 1.545) 7.681 5.561 ( 0.762 1.685 -2.663) 3.242 5.596 ( -3.767 -2.309 -1.244) 4.590 5.753 ( -0.480 0.664 0.480) 0.950 5.874 ( -3.328 -1.230 1.633) 3.906 6.204 ( 1.707 -0.060 6.812) 7.023 6.423 ( 0.261 -5.808 -6.930) 9.046 6.522 ( 1.244 0.904 0.019) 1.538 6.706 ( -1.787 -17.562 0.835) 17.672 6.811 ( 0.834 -10.503 4.530) 11.469 7.043 ( 2.295 -6.039 1.009) 6.539 7.286 ( -7.885 -1.021 -1.710) 8.133 7.445 ( -1.615 -11.326 1.291) 11.513 7.642 ( -6.564 -1.785 -9.333) 11.549 7.818 ( 0.982 0.921 0.436) 1.415 8.321 ( 2.052 4.372 5.713) 7.481 8.767 ( 4.285 2.381 -1.730) 5.199 9.585 ( -1.091 2.077 -0.443) 2.388 ======================= Grid point 325 (149/199) ======================= q-point: ( 0.50 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.832 ( 0.138 4.024 -0.381) 4.044 1.337 ( 0.120 -1.093 -1.442) 1.813 1.567 ( 0.932 -4.206 -4.639) 6.331 1.583 ( 0.124 -3.700 0.894) 3.808 1.743 ( -3.526 -8.190 -2.210) 9.187 1.821 ( -3.084 -2.994 0.098) 4.299 1.848 ( -3.770 -3.426 1.586) 5.335 1.950 ( -1.927 -3.251 0.377) 3.798 2.034 ( 3.331 -3.370 2.911) 5.561 2.157 ( -1.533 -0.162 1.117) 1.904 2.258 ( -0.733 -4.519 2.276) 5.112 2.308 ( 1.182 -0.729 0.808) 1.607 2.451 ( -0.370 -1.007 0.509) 1.187 2.495 ( 0.000 -0.038 0.261) 0.264 2.554 ( 3.148 0.974 0.302) 3.309 2.651 ( -2.086 1.792 -4.380) 5.172 2.753 ( -0.779 2.822 0.594) 2.988 2.843 ( 0.195 1.195 0.615) 1.358 2.983 ( -0.764 0.749 -2.919) 3.109 3.209 ( 2.524 -4.561 1.527) 5.432 3.320 ( 1.143 -1.714 -2.098) 2.940 3.534 ( 1.172 0.332 0.779) 1.446 3.671 ( 1.857 -1.116 1.455) 2.609 3.785 ( 0.678 -16.571 0.514) 16.593 5.259 ( -1.812 -7.279 1.037) 7.573 5.515 ( -1.836 2.388 -1.400) 3.322 5.627 ( -1.912 -2.070 -0.540) 2.869 5.716 ( 0.364 1.955 -0.229) 2.002 5.906 ( -1.329 -3.346 0.885) 3.707 6.187 ( 2.745 3.070 4.397) 6.024 6.410 ( 0.492 3.468 -5.036) 6.134 6.607 ( 0.138 -5.530 1.302) 5.683 6.970 ( 1.160 -7.785 1.216) 7.964 7.050 ( -1.239 -13.321 3.479) 13.824 7.200 ( 0.251 -8.240 0.346) 8.251 7.260 ( -5.734 -1.381 -3.240) 6.729 7.615 ( -4.086 -4.747 -4.454) 7.685 7.672 ( -2.253 -6.492 -2.199) 7.215 7.829 ( 1.879 -1.294 1.562) 2.765 8.270 ( 2.684 2.552 5.466) 6.603 8.734 ( 0.971 2.465 -2.396) 3.572 9.549 ( -0.243 1.132 -0.104) 1.162 ======================= Grid point 326 (150/199) ======================= q-point: ( 0.58 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.767 ( -0.011 2.129 -0.104) 2.132 1.346 ( -0.619 -0.443 -2.146) 2.277 1.613 ( -1.212 -0.675 2.190) 2.592 1.667 ( 1.089 -4.277 -4.820) 6.535 1.852 ( -1.813 -2.271 1.742) 3.388 1.865 ( -1.851 -5.191 -3.884) 6.743 1.895 ( -1.939 -3.737 2.533) 4.913 2.013 ( -0.279 -3.045 -0.369) 3.079 2.116 ( 2.068 -3.434 1.624) 4.325 2.149 ( -0.901 0.702 -0.365) 1.200 2.297 ( 0.987 0.495 3.469) 3.641 2.357 ( 0.511 -2.779 -0.047) 2.826 2.455 ( -0.419 0.293 2.339) 2.395 2.488 ( -0.331 0.268 -0.472) 0.636 2.569 ( 1.854 -1.063 0.604) 2.221 2.599 ( -2.020 1.792 -4.626) 5.356 2.701 ( 0.112 2.189 0.852) 2.351 2.805 ( 0.164 2.847 0.115) 2.854 2.936 ( 0.261 2.230 -0.590) 2.321 3.252 ( 2.331 2.111 -2.382) 3.945 3.359 ( -3.844 -2.713 1.001) 4.810 3.535 ( 1.966 -0.079 1.144) 2.276 3.718 ( 2.313 -1.625 0.254) 2.838 4.054 ( -0.407 -9.690 0.345) 9.705 5.389 ( -0.983 -6.576 0.725) 6.689 5.459 ( -2.577 1.440 0.429) 2.984 5.623 ( 0.656 1.883 -0.065) 1.995 5.721 ( -0.212 -2.002 -1.462) 2.489 5.978 ( -0.417 -4.099 0.077) 4.121 6.135 ( 2.165 3.456 1.859) 4.481 6.339 ( -0.025 3.554 -1.955) 4.056 6.693 ( 0.532 -2.848 1.021) 3.072 7.065 ( -0.778 -1.655 0.098) 1.831 7.211 ( -1.031 -3.021 3.028) 4.400 7.294 ( -1.003 -7.054 -1.212) 7.227 7.379 ( -1.004 -7.280 -2.026) 7.623 7.632 ( -3.399 -1.475 -4.269) 5.653 7.801 ( -0.154 -5.332 1.405) 5.516 7.878 ( 2.830 -1.600 0.774) 3.342 8.253 ( 2.948 1.236 4.444) 5.474 8.680 ( -2.327 2.429 -2.921) 4.455 9.536 ( 0.459 0.345 0.161) 0.596 ======================= Grid point 327 (151/199) ======================= q-point: (-0.33 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.758 ( 0.524 -1.072 -0.069) 1.195 1.343 ( -0.358 0.757 -0.820) 1.172 1.610 ( -0.168 0.346 2.524) 2.553 1.726 ( 0.536 -0.954 -5.394) 5.503 1.887 ( -1.603 -2.161 1.554) 3.107 1.937 ( 0.842 -2.717 -2.002) 3.478 1.972 ( -0.235 -3.742 1.779) 4.150 2.052 ( 1.143 -0.823 0.623) 1.540 2.101 ( -0.307 2.139 -2.118) 3.026 2.209 ( 1.372 -3.371 -0.439) 3.666 2.284 ( -0.505 0.557 2.575) 2.682 2.362 ( -0.910 2.382 -1.113) 2.782 2.434 ( 0.358 1.921 0.477) 2.011 2.500 ( -0.304 -1.437 0.740) 1.645 2.551 ( -1.506 2.114 -1.894) 3.213 2.632 ( 2.109 -4.113 1.181) 4.771 2.677 ( -0.267 -0.171 0.646) 0.720 2.760 ( 0.749 0.906 -0.144) 1.185 2.903 ( -0.231 1.645 0.382) 1.704 3.205 ( -0.499 2.160 -1.713) 2.802 3.353 ( -3.013 1.230 0.745) 3.338 3.556 ( 1.953 -0.274 2.109) 2.887 3.740 ( 1.485 0.849 -1.189) 2.083 4.147 ( -0.755 0.185 0.122) 0.787 5.435 ( -1.036 -0.037 0.614) 1.205 5.506 ( 0.091 -5.389 0.653) 5.429 5.578 ( 0.203 2.709 -0.217) 2.725 5.752 ( 0.094 -0.635 -0.598) 0.877 6.033 ( -0.288 -0.249 0.302) 0.486 6.107 ( 1.240 -0.989 -1.111) 1.936 6.273 ( -0.376 2.641 0.177) 2.673 6.730 ( 0.807 -0.498 0.373) 1.019 7.038 ( -2.723 2.223 -0.738) 3.592 7.288 ( 1.640 -3.959 1.909) 4.691 7.372 ( -0.138 -0.460 0.386) 0.616 7.469 ( -0.460 -2.196 -2.211) 3.150 7.643 ( -2.008 -1.522 -1.317) 2.843 7.864 ( 0.154 -0.878 1.392) 1.653 7.910 ( 3.456 0.579 0.119) 3.506 8.257 ( 3.295 0.443 3.215) 4.625 8.610 ( -4.793 2.280 -3.118) 6.156 9.539 ( 0.714 -0.271 0.306) 0.822 ======================= Grid point 328 (152/199) ======================= q-point: (-0.25 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.804 ( 0.562 -2.799 0.004) 2.855 1.299 ( -0.703 3.368 -0.056) 3.442 1.590 ( 1.704 3.040 4.853) 5.975 1.724 ( 0.575 0.214 -6.805) 6.833 1.890 ( -1.825 1.029 1.052) 2.344 1.972 ( 0.523 -0.240 -0.788) 0.976 1.998 ( -0.748 0.402 0.098) 0.855 2.053 ( 2.425 2.175 1.050) 3.423 2.120 ( 2.039 -1.693 -0.996) 2.831 2.199 ( -0.627 3.199 -0.778) 3.351 2.278 ( -2.397 2.663 -0.491) 3.616 2.339 ( 0.014 -3.997 -0.927) 4.103 2.372 ( -0.657 4.197 -1.066) 4.380 2.495 ( -0.641 2.006 0.049) 2.106 2.520 ( -0.085 -0.195 -0.052) 0.219 2.712 ( -0.253 -3.199 0.929) 3.341 2.751 ( 5.413 -4.941 3.068) 7.945 2.789 ( 0.111 -2.357 -0.066) 2.360 2.872 ( -2.805 -1.022 -0.790) 3.088 3.165 ( -1.544 1.829 -0.423) 2.431 3.283 ( -0.606 4.609 1.044) 4.764 3.558 ( 1.525 1.363 2.200) 3.003 3.701 ( -0.415 3.110 -2.361) 3.927 4.033 ( -0.630 10.829 0.178) 10.848 5.443 ( 0.356 -0.729 -0.486) 0.946 5.498 ( 0.578 4.724 0.309) 4.769 5.619 ( -0.582 -5.056 0.653) 5.131 5.741 ( 0.426 1.712 0.579) 1.857 6.008 ( 0.293 1.697 -0.534) 1.803 6.158 ( -1.869 -2.862 0.750) 3.500 6.251 ( 1.302 -0.748 -1.522) 2.138 6.723 ( 0.635 1.802 -0.354) 1.943 6.971 ( -1.739 2.847 -0.386) 3.358 7.280 ( -1.160 7.117 -0.485) 7.227 7.360 ( 2.460 2.956 4.478) 5.902 7.471 ( 0.013 -0.574 -4.024) 4.065 7.678 ( -1.038 -2.904 1.187) 3.305 7.836 ( -0.198 3.729 -0.541) 3.773 7.894 ( 3.196 3.137 0.928) 4.573 8.281 ( 3.975 -0.671 2.028) 4.512 8.535 ( -5.693 1.761 -2.804) 6.586 9.554 ( 0.558 -0.829 0.338) 1.055 ======================= Grid point 329 (153/199) ======================= q-point: (-0.17 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.859 ( 0.174 -2.173 -0.043) 2.180 1.208 ( 0.011 5.313 0.283) 5.321 1.505 ( 2.132 6.440 5.520) 8.746 1.728 ( -0.318 -0.004 -6.220) 6.228 1.825 ( -0.771 6.015 -0.817) 6.119 1.934 ( 2.005 4.282 2.379) 5.292 1.972 ( -0.695 2.117 0.928) 2.414 2.007 ( 0.724 3.326 0.255) 3.413 2.085 ( -3.718 2.900 -3.439) 5.836 2.118 ( -0.539 4.274 -0.887) 4.398 2.271 ( 2.344 2.627 -0.552) 3.564 2.280 ( -1.998 -0.311 0.003) 2.023 2.415 ( 1.410 -0.739 0.618) 1.708 2.451 ( -1.901 0.158 -2.445) 3.101 2.539 ( -0.180 -2.019 0.060) 2.028 2.755 ( 1.485 2.684 1.214) 3.299 2.785 ( -0.144 -3.037 1.300) 3.307 2.890 ( 1.786 -4.516 0.695) 4.906 2.970 ( -0.490 -6.681 0.263) 6.704 3.079 ( -2.543 5.309 -0.444) 5.904 3.176 ( 2.363 6.140 1.619) 6.775 3.511 ( 0.429 5.623 0.590) 5.670 3.632 ( -1.489 2.444 -1.874) 3.421 3.751 ( 0.276 14.877 0.547) 14.890 5.384 ( -1.705 5.967 1.935) 6.500 5.467 ( 2.247 -0.517 -2.780) 3.611 5.704 ( 0.319 -1.302 0.907) 1.619 5.711 ( 0.065 -1.203 0.604) 1.348 5.979 ( -0.223 1.197 -0.493) 1.313 6.190 ( -3.718 -2.391 4.503) 6.310 6.313 ( 3.169 -3.535 -5.181) 7.027 6.653 ( -0.061 5.727 -0.428) 5.743 6.906 ( -0.626 3.400 0.221) 3.464 7.060 ( -0.708 13.769 -0.074) 13.787 7.213 ( 0.404 10.860 1.099) 10.923 7.516 ( -0.153 -2.407 -1.353) 2.766 7.684 ( -0.809 6.100 2.692) 6.716 7.760 ( -0.720 0.467 -2.279) 2.435 7.839 ( 2.737 2.788 1.513) 4.189 8.333 ( 2.726 -2.238 0.321) 3.542 8.479 ( -3.176 0.622 -1.426) 3.536 9.579 ( 0.213 -1.423 0.301) 1.470 ======================= Grid point 330 (154/199) ======================= q-point: (-0.08 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.881 ( 0.518 0.295 -0.856) 1.043 1.099 ( 1.282 6.108 1.244) 6.364 1.382 ( 2.115 7.886 7.016) 10.765 1.626 ( 0.738 12.012 1.272) 12.102 1.691 ( -2.484 3.627 -7.796) 8.950 1.827 ( 0.067 7.466 -0.162) 7.468 1.912 ( -2.247 5.017 -0.123) 5.499 1.930 ( 1.016 2.699 0.571) 2.939 2.015 ( -2.852 3.883 0.095) 4.819 2.051 ( -0.033 0.516 -1.352) 1.447 2.212 ( 0.583 2.382 -0.862) 2.599 2.303 ( 0.741 0.326 0.818) 1.151 2.351 ( 0.981 4.469 0.044) 4.576 2.501 ( -1.498 -3.134 -1.832) 3.927 2.583 ( -1.625 -2.416 0.589) 2.971 2.707 ( 1.926 3.083 -0.279) 3.646 2.833 ( 0.860 11.017 3.051) 11.464 2.839 ( -0.168 -0.494 1.672) 1.751 2.912 ( -0.622 5.569 -2.489) 6.132 3.059 ( 0.302 2.780 0.954) 2.955 3.191 ( 1.074 -6.301 -0.253) 6.397 3.276 ( 0.485 12.586 -1.554) 12.691 3.589 ( 0.718 2.908 0.920) 3.133 3.614 ( -0.180 -0.693 0.014) 0.716 5.251 ( -2.992 5.726 2.889) 7.078 5.491 ( 2.682 -0.614 -3.390) 4.366 5.689 ( 0.062 0.734 0.691) 1.010 5.777 ( -0.600 -3.092 -0.193) 3.155 5.954 ( -0.553 1.278 -0.139) 1.400 6.219 ( -3.347 -2.555 5.849) 7.207 6.391 ( 2.841 0.062 -6.530) 7.122 6.499 ( 0.360 7.687 0.417) 7.706 6.760 ( -0.583 14.762 0.807) 14.796 6.783 ( -1.148 10.810 -0.397) 10.878 7.010 ( -0.313 7.796 -0.124) 7.803 7.479 ( -0.954 11.359 0.329) 11.404 7.541 ( -3.062 0.542 0.229) 3.118 7.716 ( 1.473 3.019 -0.329) 3.375 7.882 ( 0.225 -4.622 0.329) 4.639 8.384 ( -4.333 -3.150 -1.612) 5.594 8.492 ( 5.988 -1.298 1.004) 6.209 9.614 ( -0.023 -2.036 0.219) 2.048 ======================= Grid point 334 (155/199) ======================= q-point: ( 0.25 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.811 ( 2.080 -0.000 -3.255) 3.863 0.970 ( 10.441 -0.000 3.958) 11.166 1.074 ( 16.512 -0.000 6.494) 17.743 1.158 ( 12.430 -0.000 -6.475) 14.016 1.522 ( -0.991 0.000 -5.745) 5.830 1.535 ( -0.546 0.000 3.463) 3.506 1.677 ( -4.212 0.000 -2.900) 5.114 1.744 ( 2.147 -0.000 2.671) 3.427 1.790 ( -3.604 0.000 3.641) 5.123 2.024 ( -0.616 0.000 -5.747) 5.780 2.213 ( -0.542 0.000 1.218) 1.333 2.229 ( 8.104 -0.000 1.028) 8.169 2.278 ( -1.863 0.000 -1.906) 2.665 2.317 ( 3.832 -0.000 0.913) 3.939 2.398 ( -1.379 0.000 0.179) 1.390 2.504 ( -3.879 0.000 6.407) 7.490 2.519 ( -1.550 0.000 0.673) 1.690 2.720 ( -0.881 0.000 -0.146) 0.893 2.726 ( 2.110 -0.000 0.601) 2.194 2.958 ( 0.199 -0.000 0.841) 0.864 3.163 ( -7.223 0.000 -6.106) 9.458 3.375 ( -2.463 0.000 0.244) 2.475 3.633 ( 0.914 -0.000 -0.724) 1.166 3.793 ( 3.702 -0.000 0.764) 3.780 4.939 ( -7.225 0.000 4.259) 8.387 5.333 ( 2.852 -0.000 -0.015) 2.852 5.622 ( -4.600 0.000 -0.346) 4.613 5.698 ( 0.183 -0.000 0.744) 0.767 5.702 ( -4.145 0.000 1.370) 4.365 5.854 ( -1.384 0.000 -0.692) 1.547 5.978 ( -1.354 0.000 -0.280) 1.383 6.207 ( -3.007 0.000 9.971) 10.414 6.622 ( 5.037 -0.000 1.443) 5.239 6.720 ( -0.629 0.000 1.421) 1.554 6.808 ( 9.764 -0.000 -0.505) 9.777 6.827 ( 1.058 -0.000 -1.156) 1.567 7.364 ( -7.455 0.000 0.132) 7.456 7.711 ( -7.721 0.000 -8.857) 11.749 7.883 ( -2.393 0.000 -3.875) 4.554 8.572 ( -0.762 0.000 3.802) 3.877 8.824 ( 7.177 -0.000 -1.453) 7.323 9.726 ( -2.725 0.000 -2.201) 3.503 ======================= Grid point 335 (156/199) ======================= q-point: ( 0.33 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.868 ( 3.779 -3.762 -3.825) 6.562 1.052 ( 10.257 -2.315 5.304) 11.777 1.132 ( 9.952 -2.408 -0.168) 10.241 1.443 ( 10.566 -12.251 0.922) 16.204 1.520 ( 1.113 -0.895 -2.221) 2.641 1.587 ( -3.410 -1.532 -1.106) 3.898 1.597 ( -1.167 -0.793 -2.444) 2.822 1.757 ( -4.896 0.900 2.149) 5.422 1.823 ( -0.651 -4.143 -0.420) 4.214 1.982 ( -1.100 0.160 -2.022) 2.307 2.209 ( -3.222 0.910 -3.130) 4.583 2.298 ( 3.681 0.045 2.130) 4.253 2.329 ( 0.940 -5.140 0.159) 5.228 2.384 ( -1.621 -4.865 5.775) 7.723 2.447 ( 0.310 -5.075 3.098) 5.954 2.510 ( 3.804 -5.077 -4.615) 7.845 2.583 ( -0.861 -4.800 1.823) 5.206 2.716 ( -0.040 -1.020 0.122) 1.028 2.765 ( 3.177 -1.818 2.350) 4.349 2.949 ( 0.674 0.614 0.655) 1.122 3.104 ( -8.157 0.302 -4.579) 9.359 3.351 ( -1.715 1.008 0.485) 2.048 3.619 ( 0.240 1.388 -1.393) 1.981 3.790 ( 3.354 2.377 1.065) 4.247 4.927 ( -3.809 -2.407 2.358) 5.086 5.451 ( 1.675 -8.146 -0.816) 8.356 5.563 ( -4.447 0.698 -0.529) 4.533 5.676 ( -3.789 -0.257 1.753) 4.182 5.824 ( -1.269 -4.533 0.720) 4.762 5.891 ( -1.450 -9.349 -2.555) 9.800 6.061 ( -1.241 -8.720 -0.270) 8.812 6.212 ( -2.359 -2.304 9.861) 10.397 6.617 ( 3.609 2.475 2.267) 4.928 6.712 ( 4.107 1.796 -2.918) 5.348 6.824 ( 1.782 -3.528 2.612) 4.737 7.003 ( 2.269 -9.549 1.482) 9.926 7.300 ( -8.144 1.466 -1.239) 8.367 7.641 ( -8.521 0.960 -11.441) 14.298 7.870 ( 0.957 1.032 -1.165) 1.827 8.524 ( 0.342 4.263 5.031) 6.603 8.852 ( 6.614 1.428 -1.641) 6.963 9.683 ( -2.821 2.177 -1.505) 3.868 ======================= Grid point 336 (157/199) ======================= q-point: ( 0.42 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.944 ( 2.663 -0.691 -2.756) 3.894 1.188 ( 8.079 -5.136 3.610) 10.232 1.286 ( 6.593 -7.524 0.538) 10.018 1.511 ( -4.282 0.723 -6.463) 7.786 1.553 ( -1.219 -1.581 0.806) 2.153 1.645 ( 0.532 -4.954 0.380) 4.997 1.716 ( -5.167 -1.415 0.131) 5.359 1.774 ( 6.124 -8.636 2.509) 10.881 1.873 ( -3.677 -3.105 -2.052) 5.232 2.042 ( 0.568 -4.986 2.098) 5.439 2.170 ( -5.471 0.182 -2.086) 5.858 2.307 ( 3.262 0.696 2.767) 4.334 2.368 ( -1.871 -1.993 -2.394) 3.633 2.470 ( 1.417 -0.852 5.836) 6.066 2.570 ( 0.463 -6.056 1.259) 6.203 2.652 ( 1.550 -2.802 -0.179) 3.207 2.688 ( 0.721 -7.569 -6.476) 9.987 2.789 ( -3.069 -4.836 -0.814) 5.786 2.823 ( 1.690 -1.442 1.707) 2.801 3.028 ( 7.039 -8.974 4.454) 12.244 3.085 ( -4.939 -4.268 -3.453) 7.385 3.321 ( -0.741 1.014 0.668) 1.422 3.592 ( 0.076 1.146 -1.615) 1.982 3.747 ( 2.270 3.514 1.373) 4.403 4.989 ( -1.963 -5.367 1.110) 5.822 5.531 ( -4.082 -1.564 -1.081) 4.503 5.585 ( 1.680 -0.848 -1.691) 2.530 5.703 ( -2.495 -4.621 1.149) 5.375 5.837 ( -3.087 -0.614 0.681) 3.220 6.121 ( -0.988 -9.380 3.165) 9.949 6.253 ( 0.009 -10.102 -0.938) 10.146 6.353 ( -1.247 -14.406 2.787) 14.726 6.582 ( 1.786 2.779 1.718) 3.723 6.712 ( 4.059 -0.278 -0.900) 4.167 6.942 ( 2.006 -6.284 3.042) 7.264 7.199 ( -4.970 -8.143 -0.561) 9.556 7.238 ( -3.561 -2.532 -0.029) 4.369 7.578 ( -7.197 -0.101 -10.828) 13.002 7.848 ( 0.960 1.604 -0.321) 1.897 8.436 ( 2.046 5.209 6.377) 8.485 8.843 ( 4.397 2.732 -2.236) 5.638 9.621 ( -1.905 2.317 -0.786) 3.101 ======================= Grid point 337 (158/199) ======================= q-point: ( 0.50 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.919 ( 1.335 3.810 -0.918) 4.141 1.307 ( 1.805 -2.431 1.029) 3.197 1.479 ( 3.180 -7.548 2.117) 8.460 1.502 ( 0.332 -2.618 -6.997) 7.478 1.590 ( -2.857 -4.254 -1.669) 5.389 1.731 ( -4.157 -3.925 -0.531) 5.742 1.747 ( -1.228 -4.370 2.120) 5.010 1.883 ( -2.813 -2.472 0.264) 3.755 1.975 ( 4.421 -5.479 2.739) 7.554 2.130 ( -2.531 -1.388 0.143) 2.890 2.153 ( -2.642 -4.231 1.680) 5.263 2.317 ( 2.804 0.258 1.980) 3.443 2.403 ( -1.688 -2.655 -1.629) 3.543 2.491 ( 0.376 -0.508 1.974) 2.073 2.604 ( 2.837 1.442 0.471) 3.217 2.669 ( -0.743 0.641 -2.663) 2.838 2.788 ( -2.137 1.186 -0.549) 2.505 2.841 ( -1.126 -2.708 -1.848) 3.466 2.902 ( 1.911 -7.108 -1.007) 7.429 3.130 ( -0.341 -3.843 0.343) 3.873 3.304 ( 1.260 -2.236 0.476) 2.610 3.407 ( 3.777 -16.598 1.091) 17.057 3.579 ( -0.499 -0.451 -0.957) 1.170 3.694 ( 1.439 2.457 1.590) 3.261 5.106 ( -1.167 -7.077 0.616) 7.199 5.548 ( -3.271 -0.943 0.877) 3.516 5.567 ( -0.166 0.725 -3.310) 3.393 5.749 ( -0.293 0.053 0.520) 0.599 5.841 ( -2.052 -2.094 1.236) 3.181 6.232 ( 1.729 -1.757 6.892) 7.320 6.419 ( 0.116 -4.623 -6.797) 8.221 6.539 ( 1.444 0.611 0.349) 1.607 6.692 ( -0.595 -17.868 1.324) 17.926 6.817 ( -0.288 -9.245 3.049) 9.739 7.074 ( 2.414 -5.499 1.129) 6.111 7.199 ( -5.889 -1.543 -1.807) 6.350 7.425 ( -1.692 -10.981 1.058) 11.161 7.561 ( -5.223 -2.692 -9.031) 10.775 7.828 ( 0.576 0.546 0.434) 0.905 8.361 ( 3.382 4.177 7.010) 8.833 8.797 ( 1.132 3.435 -3.106) 4.767 9.574 ( -0.703 1.572 -0.270) 1.743 ======================= Grid point 338 (159/199) ======================= q-point: ( 0.58 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.835 ( 0.246 4.498 -0.203) 4.509 1.325 ( -1.485 -0.743 -1.888) 2.514 1.577 ( -0.833 -2.661 2.458) 3.717 1.588 ( 2.165 -3.936 -5.745) 7.293 1.712 ( -1.098 -7.898 -0.994) 8.035 1.780 ( -3.411 -3.965 0.627) 5.268 1.826 ( -0.375 -3.143 1.176) 3.377 1.926 ( -1.849 -4.072 -0.361) 4.487 2.076 ( 2.881 -2.649 2.953) 4.903 2.136 ( -1.558 -1.350 -0.149) 2.067 2.253 ( -0.356 -5.389 2.472) 5.939 2.329 ( 1.777 0.061 1.181) 2.135 2.440 ( -1.101 -1.626 -0.252) 1.979 2.494 ( -0.346 0.225 0.797) 0.897 2.585 ( 1.503 1.450 0.678) 2.196 2.633 ( -0.203 2.250 -4.047) 4.635 2.746 ( -0.457 2.102 0.303) 2.172 2.846 ( 0.205 1.125 0.646) 1.314 2.970 ( -1.014 0.473 -3.037) 3.236 3.235 ( 1.247 -5.991 1.512) 6.304 3.324 ( 0.010 1.119 -1.588) 1.943 3.548 ( 0.879 0.343 0.372) 1.014 3.693 ( 1.509 -1.449 1.366) 2.498 3.791 ( 0.358 -16.111 0.443) 16.121 5.245 ( -0.715 -7.300 0.517) 7.353 5.486 ( -2.545 2.876 0.928) 3.950 5.610 ( -0.576 -3.079 -2.037) 3.737 5.720 ( 0.215 1.930 -0.067) 1.943 5.897 ( -0.351 -3.818 0.583) 3.878 6.224 ( 2.676 3.390 4.407) 6.171 6.404 ( -0.779 3.117 -5.271) 6.174 6.616 ( 0.988 -5.196 1.578) 5.519 6.983 ( 0.880 -7.802 0.617) 7.875 7.033 ( -1.730 -13.670 2.938) 14.089 7.192 ( -2.564 -2.934 1.345) 4.122 7.216 ( -0.127 -6.508 -3.643) 7.459 7.563 ( -3.572 -3.439 -4.460) 6.669 7.651 ( -1.111 -8.822 -1.307) 8.987 7.849 ( 1.203 -2.182 1.077) 2.714 8.319 ( 4.229 2.748 6.610) 8.314 8.724 ( -1.943 3.505 -3.797) 5.521 9.549 ( 0.151 0.784 0.063) 0.801 ======================= Grid point 339 (160/199) ======================= q-point: ( 0.67 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.768 ( 0.078 1.996 -0.085) 1.999 1.337 ( -0.519 -0.957 -1.847) 2.144 1.603 ( -0.538 -0.758 1.818) 2.041 1.672 ( 0.274 -3.978 -4.545) 6.047 1.832 ( -1.828 -2.586 1.135) 3.364 1.844 ( -0.955 -5.798 -1.425) 6.046 1.895 ( 1.215 -4.238 1.308) 4.599 2.006 ( -0.550 -3.938 -0.530) 4.012 2.133 ( 0.331 -0.923 0.965) 1.376 2.148 ( 0.833 -1.108 -0.285) 1.415 2.312 ( 0.990 0.687 2.857) 3.101 2.361 ( 0.185 -2.596 -0.126) 2.606 2.448 ( -0.809 -0.202 3.014) 3.127 2.486 ( 0.077 0.243 -0.638) 0.687 2.569 ( -1.509 0.928 -1.680) 2.441 2.596 ( 1.409 0.347 -2.052) 2.513 2.703 ( 0.160 2.148 0.659) 2.252 2.806 ( 0.133 2.723 0.078) 2.728 2.937 ( -0.115 1.594 -0.704) 1.746 3.260 ( -1.619 3.762 -2.104) 4.604 3.332 ( 0.287 -2.545 1.354) 2.897 3.555 ( 1.169 -0.568 0.807) 1.530 3.740 ( 0.887 -1.591 0.356) 1.857 4.050 ( -0.232 -9.350 0.147) 9.354 5.381 ( -0.371 -6.719 0.751) 6.771 5.434 ( -1.598 0.939 1.311) 2.270 5.632 ( 0.849 1.593 -1.346) 2.251 5.717 ( -0.330 -2.040 -0.970) 2.283 5.975 ( -0.223 -3.920 0.392) 3.946 6.162 ( 1.933 3.899 0.824) 4.429 6.332 ( -0.881 3.315 -1.331) 3.679 6.704 ( 0.969 -2.816 0.949) 3.125 7.049 ( -1.287 -0.170 -0.370) 1.350 7.210 ( 0.153 -4.619 2.471) 5.240 7.285 ( -0.331 -7.605 -0.139) 7.614 7.367 ( -0.659 -7.078 -2.218) 7.447 7.593 ( -2.497 -2.198 -2.572) 4.205 7.798 ( -0.308 -5.758 0.237) 5.771 7.909 ( 1.834 -2.255 0.604) 2.969 8.305 ( 4.506 1.670 5.193) 7.075 8.636 ( -3.817 3.264 -3.858) 6.333 9.542 ( 0.397 0.177 0.201) 0.479 ======================= Grid point 340 (161/199) ======================= q-point: (-0.25 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.762 ( 0.012 -1.245 -0.061) 1.246 1.340 ( 0.164 0.806 -0.854) 1.186 1.615 ( 0.494 -0.493 2.671) 2.761 1.724 ( -0.146 -0.968 -5.723) 5.806 1.874 ( -0.578 -2.095 1.858) 2.859 1.929 ( -1.192 -3.596 -2.028) 4.297 1.982 ( 0.787 -2.594 2.357) 3.592 2.057 ( -0.226 -1.678 0.301) 1.719 2.106 ( 1.272 1.062 -2.773) 3.230 2.217 ( 0.041 -3.482 -0.096) 3.484 2.281 ( -0.327 2.117 2.641) 3.400 2.350 ( -0.698 2.945 -0.410) 3.054 2.444 ( 1.103 2.399 -0.832) 2.768 2.498 ( -0.109 -1.418 0.941) 1.705 2.535 ( -0.959 1.255 -0.894) 1.815 2.651 ( 0.737 -4.831 0.020) 4.887 2.675 ( -0.015 0.031 1.153) 1.154 2.768 ( 0.489 0.527 -0.575) 0.920 2.901 ( -0.237 2.364 0.631) 2.458 3.187 ( -1.827 1.927 -0.804) 2.774 3.342 ( 0.985 1.570 0.334) 1.884 3.577 ( 1.199 -0.431 1.354) 1.859 3.745 ( -0.732 1.289 -0.813) 1.691 4.142 ( -0.045 0.287 0.127) 0.317 5.428 ( -0.022 -0.685 0.514) 0.857 5.505 ( -0.329 -5.980 1.112) 6.092 5.582 ( 0.372 3.468 -0.815) 3.582 5.751 ( -0.097 -0.867 -0.384) 0.953 6.029 ( -0.443 -0.870 0.743) 1.227 6.118 ( 0.559 0.549 -1.539) 1.727 6.270 ( -0.099 2.091 0.217) 2.104 6.740 ( 0.614 -0.357 0.098) 0.717 7.015 ( -0.605 2.306 -0.428) 2.422 7.297 ( -0.358 -3.632 1.668) 4.013 7.377 ( 0.874 -1.426 0.825) 1.865 7.460 ( -0.730 -2.312 -2.265) 3.318 7.620 ( -1.522 -1.973 -0.069) 2.493 7.863 ( -0.262 -0.902 0.470) 1.051 7.943 ( 1.430 0.184 -0.216) 1.458 8.308 ( 3.654 0.771 2.749) 4.637 8.552 ( -3.286 2.771 -2.707) 5.080 9.545 ( 0.186 -0.320 0.188) 0.416 ======================= Grid point 341 (162/199) ======================= q-point: (-0.17 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.804 ( -0.519 -2.834 -0.019) 2.882 1.301 ( 1.128 3.406 -0.274) 3.598 1.612 ( 1.039 2.300 4.735) 5.366 1.714 ( -1.321 0.526 -7.899) 8.026 1.885 ( 1.109 0.970 1.641) 2.205 1.963 ( -1.501 -0.610 -1.728) 2.369 1.991 ( -0.709 0.421 2.040) 2.201 2.073 ( 0.182 1.006 0.178) 1.038 2.127 ( -0.539 -0.092 -2.094) 2.164 2.176 ( -2.924 4.527 1.558) 5.610 2.276 ( 1.863 1.694 -0.342) 2.541 2.332 ( -0.873 -3.550 -0.506) 3.691 2.373 ( 0.916 4.115 -0.942) 4.320 2.494 ( 0.349 1.906 0.177) 1.945 2.518 ( -0.303 -0.014 0.167) 0.346 2.709 ( -0.438 -3.376 1.255) 3.629 2.782 ( -0.068 -6.066 -0.609) 6.097 2.806 ( -0.669 -3.592 -1.002) 3.788 2.848 ( 1.448 1.070 1.677) 2.460 3.152 ( -0.192 1.908 0.633) 2.019 3.295 ( 2.068 4.055 0.051) 4.552 3.576 ( 1.028 1.441 1.065) 2.066 3.685 ( -1.915 3.487 -1.340) 4.198 4.031 ( 0.366 10.832 0.312) 10.842 5.443 ( -0.305 0.209 -0.442) 0.576 5.505 ( 0.609 3.774 -0.485) 3.853 5.614 ( -0.386 -5.099 1.233) 5.261 5.743 ( -0.093 1.412 0.306) 1.448 6.009 ( 0.016 1.855 -0.632) 1.960 6.131 ( -2.639 -1.634 2.583) 4.037 6.273 ( 2.348 -1.829 -2.824) 4.103 6.724 ( -0.422 2.078 -0.511) 2.181 6.965 ( 0.816 2.769 0.221) 2.895 7.268 ( -0.808 6.885 0.823) 6.981 7.387 ( 1.431 4.360 3.451) 5.741 7.453 ( -2.349 -1.652 -4.016) 4.937 7.668 ( -0.573 -3.329 2.162) 4.010 7.830 ( -0.665 3.862 -0.422) 3.941 7.916 ( 0.196 2.924 -0.766) 3.029 8.316 ( -0.325 -0.239 -0.885) 0.972 8.499 ( 1.770 1.587 0.254) 2.391 9.557 ( -0.201 -0.838 0.096) 0.867 ======================= Grid point 342 (163/199) ======================= q-point: (-0.08 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.854 ( -0.819 -2.398 -0.270) 2.548 1.227 ( 2.873 5.174 0.285) 5.925 1.535 ( 2.025 5.969 3.590) 7.254 1.690 ( -4.298 0.190 -6.247) 7.585 1.832 ( 1.170 7.113 -0.042) 7.208 1.934 ( -1.961 3.101 0.241) 3.677 1.966 ( -0.276 1.207 1.681) 2.088 2.000 ( -2.576 5.044 -2.334) 6.125 2.055 ( -2.008 3.801 2.382) 4.915 2.095 ( -0.851 2.276 -0.138) 2.434 2.264 ( -0.162 2.490 -1.165) 2.754 2.317 ( 3.954 0.617 0.601) 4.046 2.415 ( -1.923 -4.106 -1.214) 4.694 2.444 ( 1.596 3.461 0.236) 3.818 2.531 ( -0.939 -1.667 0.103) 1.916 2.763 ( -0.397 2.341 -1.036) 2.591 2.781 ( -0.701 -3.467 1.495) 3.840 2.876 ( -3.079 -4.097 -1.157) 5.254 2.979 ( 1.318 -5.518 0.459) 5.692 3.084 ( 2.730 4.666 2.523) 5.966 3.211 ( 3.269 5.621 -1.238) 6.619 3.517 ( 0.439 6.187 -0.072) 6.203 3.619 ( -0.353 1.562 0.310) 1.631 3.757 ( 0.625 14.801 0.122) 14.815 5.356 ( -2.943 6.054 1.970) 7.014 5.495 ( 2.557 -0.424 -3.326) 4.217 5.702 ( -0.769 -3.852 0.748) 3.999 5.710 ( -0.140 1.228 0.165) 1.247 5.973 ( -0.943 1.383 -0.011) 1.674 6.153 ( -2.675 -2.233 4.964) 6.065 6.348 ( 3.183 -3.701 -5.121) 7.075 6.644 ( -1.290 5.669 -0.399) 5.827 6.910 ( 1.101 4.000 1.021) 4.272 7.055 ( -0.173 13.634 0.963) 13.669 7.214 ( -0.478 11.338 0.392) 11.355 7.490 ( -3.854 -2.190 -1.064) 4.559 7.676 ( -0.842 6.731 3.465) 7.617 7.756 ( 0.278 -0.389 -1.172) 1.265 7.846 ( -1.510 2.538 -2.093) 3.620 8.311 ( -4.560 -1.227 -2.458) 5.323 8.519 ( 7.764 -0.404 2.093) 8.052 9.577 ( -0.521 -1.469 -0.020) 1.559 ======================= Grid point 347 (164/199) ======================= q-point: ( 0.33 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.836 ( 2.207 -0.000 -1.293) 2.558 1.090 ( 9.141 -0.000 0.845) 9.180 1.271 ( 14.952 -0.000 4.677) 15.666 1.314 ( 13.261 -0.000 -2.376) 13.472 1.502 ( -1.437 0.000 -4.832) 5.041 1.541 ( 0.385 -0.000 2.129) 2.164 1.620 ( -4.192 0.000 -2.162) 4.716 1.744 ( -3.737 0.000 1.637) 4.080 1.764 ( 0.542 -0.000 1.260) 1.371 2.001 ( -3.455 0.000 -2.273) 4.136 2.201 ( -1.711 0.000 2.866) 3.338 2.242 ( -3.617 0.000 -5.523) 6.602 2.258 ( -0.929 0.000 -3.374) 3.500 2.343 ( -1.349 0.000 3.918) 4.144 2.424 ( 8.783 -0.000 -1.024) 8.842 2.503 ( -1.227 0.000 0.766) 1.446 2.529 ( 3.395 -0.000 6.917) 7.705 2.709 ( -0.807 0.000 -0.195) 0.830 2.773 ( 5.259 -0.000 3.070) 6.090 2.954 ( -1.727 0.000 -1.199) 2.103 3.048 ( -9.280 0.000 -2.599) 9.637 3.350 ( -1.768 0.000 -0.143) 1.773 3.632 ( -0.786 0.000 -1.733) 1.903 3.836 ( 3.163 -0.000 0.886) 3.285 4.884 ( -2.717 0.000 1.649) 3.179 5.368 ( 2.754 -0.000 0.008) 2.754 5.560 ( -5.045 0.000 -1.540) 5.275 5.657 ( -3.386 0.000 1.865) 3.866 5.701 ( 0.170 -0.000 1.147) 1.159 5.836 ( -1.392 0.000 -1.126) 1.790 5.962 ( -1.246 0.000 -0.302) 1.282 6.186 ( -1.812 0.000 9.691) 9.859 6.673 ( 3.988 -0.000 1.127) 4.144 6.715 ( -0.459 0.000 1.275) 1.355 6.837 ( 0.816 -0.000 -0.977) 1.273 6.915 ( 6.589 -0.000 2.399) 7.012 7.268 ( -7.564 0.000 -1.841) 7.785 7.594 ( -8.471 0.000 -12.423) 15.036 7.890 ( 1.830 -0.000 -0.410) 1.875 8.570 ( -0.041 0.000 4.897) 4.897 8.907 ( 6.422 -0.000 -1.605) 6.620 9.684 ( -3.648 0.000 -1.612) 3.988 ======================= Grid point 348 (165/199) ======================= q-point: ( 0.42 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.901 ( 2.128 -4.197 -1.694) 5.001 1.172 ( 8.420 -2.651 1.721) 8.994 1.271 ( 12.383 1.198 1.768) 12.565 1.501 ( -0.760 -2.103 -6.135) 6.530 1.522 ( -5.759 1.191 5.374) 7.966 1.576 ( 5.021 -2.883 0.152) 5.792 1.615 ( 5.611 -8.558 -2.584) 10.554 1.707 ( -2.957 1.100 1.898) 3.682 1.798 ( -3.403 -1.997 -2.218) 4.527 1.965 ( -2.168 -2.081 1.392) 3.312 2.162 ( -2.886 1.999 -4.418) 5.643 2.309 ( -4.280 -3.536 -2.126) 5.945 2.325 ( 0.243 -2.946 2.032) 3.587 2.367 ( 1.399 -7.331 3.566) 8.271 2.479 ( 1.407 -0.315 5.071) 5.272 2.559 ( 5.189 -6.765 -4.919) 9.843 2.588 ( 1.013 -3.568 0.916) 3.821 2.712 ( -0.398 -0.930 -0.559) 1.156 2.815 ( 2.975 -0.740 2.275) 3.817 2.944 ( -5.071 -2.554 -3.195) 6.515 3.019 ( -0.460 -0.746 3.723) 3.825 3.330 ( -1.819 0.750 -0.690) 2.085 3.613 ( -0.904 1.016 -2.004) 2.422 3.826 ( 2.310 2.655 1.117) 3.692 4.899 ( -1.218 -2.738 0.532) 3.044 5.470 ( 0.995 -6.059 -0.484) 6.159 5.514 ( -2.833 -1.315 -1.087) 3.307 5.638 ( -2.655 -0.121 1.465) 3.035 5.807 ( -1.485 -2.604 1.252) 3.249 5.874 ( -1.015 -10.164 -1.911) 10.392 6.047 ( -1.008 -8.807 -0.177) 8.866 6.201 ( -0.782 -2.634 8.775) 9.196 6.656 ( 2.830 2.826 2.179) 4.555 6.753 ( 3.182 -0.767 -1.682) 3.680 6.848 ( 1.487 -2.594 2.202) 3.713 7.016 ( -1.029 -6.570 1.165) 6.751 7.214 ( -4.562 0.970 -1.694) 4.963 7.534 ( -7.310 0.463 -11.711) 13.813 7.887 ( 1.455 1.316 -0.146) 1.967 8.537 ( 1.001 3.440 5.527) 6.587 8.920 ( 4.682 2.105 -1.871) 5.464 9.645 ( -2.871 1.523 -1.126) 3.439 ======================= Grid point 349 (166/199) ======================= q-point: ( 0.50 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.967 ( 1.313 -0.471 -1.383) 1.965 1.279 ( 5.638 -2.748 2.205) 6.648 1.379 ( 8.484 -4.960 1.144) 9.894 1.451 ( -4.888 -0.270 0.407) 4.912 1.534 ( -1.567 -1.403 -4.466) 4.936 1.630 ( -4.002 -2.539 -0.464) 4.762 1.682 ( 0.869 -2.228 0.854) 2.540 1.810 ( -4.908 -2.615 -1.832) 5.855 1.869 ( 7.462 -8.664 3.086) 11.844 2.042 ( -1.275 -5.008 1.668) 5.430 2.115 ( -2.988 0.886 -2.771) 4.171 2.323 ( -2.057 -1.666 0.722) 2.744 2.359 ( 2.008 -0.367 0.307) 2.064 2.484 ( 0.472 -0.676 2.729) 2.851 2.581 ( 1.084 -8.345 1.795) 8.604 2.651 ( -0.690 -2.404 -0.473) 2.546 2.701 ( 0.918 -4.166 -4.485) 6.190 2.752 ( -2.818 -3.456 -2.707) 5.217 2.848 ( 2.691 -2.115 2.203) 4.070 3.018 ( -5.363 -7.119 -1.909) 9.115 3.124 ( 7.655 -9.015 4.156) 12.535 3.308 ( -1.500 0.020 -0.340) 1.538 3.588 ( -0.492 0.905 -1.483) 1.806 3.770 ( 1.238 3.838 1.234) 4.217 4.976 ( -0.323 -5.399 -0.137) 5.410 5.488 ( -2.687 -1.543 -0.763) 3.191 5.601 ( 0.932 0.655 -0.836) 1.413 5.680 ( -1.219 -6.581 0.542) 6.715 5.805 ( -2.037 -0.334 0.784) 2.208 6.112 ( -1.088 -10.380 3.664) 11.061 6.252 ( 0.120 -11.425 -0.790) 11.453 6.351 ( 0.387 -13.352 2.153) 13.530 6.606 ( 1.930 3.441 2.258) 4.545 6.750 ( 2.229 1.299 -2.043) 3.291 6.965 ( 1.050 -6.918 3.866) 7.994 7.122 ( -5.218 -4.384 -4.048) 7.926 7.229 ( 0.295 -5.843 2.849) 6.507 7.489 ( -5.824 -0.814 -10.161) 11.740 7.858 ( 0.580 1.958 -0.017) 2.042 8.469 ( 2.423 4.381 6.279) 8.031 8.878 ( 1.615 3.879 -2.606) 4.945 9.600 ( -1.318 1.612 -0.552) 2.154 ======================= Grid point 350 (167/199) ======================= q-point: ( 0.58 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.930 ( 0.399 4.190 -0.396) 4.227 1.307 ( -1.331 0.160 0.599) 1.469 1.497 ( -1.621 -4.656 2.644) 5.594 1.533 ( 4.248 -4.566 -4.635) 7.770 1.573 ( 1.543 -4.684 -2.402) 5.486 1.663 ( -5.320 -4.599 0.637) 7.061 1.764 ( 2.187 -3.715 1.163) 4.465 1.842 ( -3.011 -3.161 -0.956) 4.469 2.036 ( 4.637 -4.083 3.176) 6.947 2.096 ( -1.778 -0.954 -1.025) 2.264 2.136 ( -1.198 -5.695 1.605) 6.037 2.347 ( 1.450 -0.110 1.828) 2.336 2.383 ( -1.049 -2.417 -1.844) 3.216 2.494 ( -0.031 -0.090 1.440) 1.443 2.627 ( 0.853 1.461 0.701) 1.831 2.666 ( 0.369 0.859 -2.174) 2.366 2.764 ( -1.748 -0.217 -0.065) 1.763 2.824 ( -1.225 -4.676 -2.847) 5.610 2.926 ( 1.803 -3.586 0.271) 4.023 3.121 ( -0.957 -5.432 -0.053) 5.516 3.314 ( 0.388 -2.184 0.460) 2.265 3.444 ( 2.069 -16.428 0.673) 16.572 3.572 ( -0.561 0.039 -0.463) 0.729 3.709 ( 0.780 2.359 1.225) 2.770 5.100 ( 0.161 -6.951 -0.359) 6.962 5.513 ( -2.327 -1.014 2.104) 3.297 5.563 ( -0.060 1.210 -2.840) 3.087 5.746 ( -0.365 -0.309 0.918) 1.035 5.829 ( -0.096 -2.760 0.270) 2.774 6.255 ( 1.116 -3.560 6.778) 7.737 6.414 ( -0.186 -2.685 -6.753) 7.270 6.555 ( 0.937 -0.764 0.304) 1.247 6.695 ( 0.851 -17.110 1.716) 17.217 6.811 ( -0.695 -8.314 0.934) 8.395 7.094 ( -0.191 -5.220 2.421) 5.757 7.151 ( -0.968 -1.793 -2.321) 3.088 7.408 ( -1.184 -10.304 1.440) 10.472 7.503 ( -3.053 -4.029 -7.636) 9.157 7.832 ( 0.196 0.361 0.350) 0.540 8.409 ( 3.415 3.594 6.245) 7.974 8.792 ( -1.253 4.546 -3.266) 5.736 9.568 ( -0.203 1.121 -0.141) 1.148 ======================= Grid point 351 (168/199) ======================= q-point: (-0.33 -0.67 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.836 ( -0.037 4.635 -0.096) 4.636 1.306 ( -1.290 -1.147 -0.884) 1.939 1.558 ( -2.051 -3.349 0.727) 3.994 1.614 ( 2.645 -2.276 -4.323) 5.556 1.705 ( -0.967 -6.681 -0.339) 6.759 1.752 ( -0.522 -5.563 2.222) 6.013 1.834 ( 1.403 -2.665 -0.208) 3.019 1.911 ( -0.367 -4.786 -0.569) 4.833 2.102 ( 0.685 -1.753 2.348) 3.009 2.130 ( 1.014 -2.055 -1.126) 2.553 2.255 ( 0.492 -5.887 1.892) 6.203 2.346 ( 0.877 0.593 0.682) 1.260 2.428 ( -0.733 -1.960 -0.175) 2.100 2.489 ( -0.647 0.245 1.330) 1.499 2.591 ( -0.307 2.103 0.417) 2.165 2.634 ( 0.339 2.083 -3.288) 3.907 2.743 ( -0.044 1.537 0.209) 1.552 2.849 ( 0.211 0.977 0.468) 1.104 2.956 ( -0.809 0.452 -2.359) 2.534 3.238 ( -1.101 -5.435 2.287) 5.998 3.325 ( 0.455 1.220 -1.621) 2.079 3.555 ( 0.314 0.098 -0.124) 0.351 3.705 ( 0.111 -1.496 1.273) 1.967 3.795 ( 0.271 -15.754 0.138) 15.757 5.243 ( 0.449 -7.140 -0.069) 7.155 5.461 ( -1.618 2.681 2.729) 4.154 5.609 ( 0.619 -3.507 -2.756) 4.503 5.720 ( -0.125 2.024 0.106) 2.031 5.897 ( 0.329 -3.793 0.234) 3.814 6.256 ( 1.915 3.669 4.023) 5.772 6.383 ( -1.832 2.693 -4.914) 5.896 6.630 ( 1.065 -4.947 0.795) 5.122 6.986 ( -0.759 -7.075 0.946) 7.178 7.030 ( 1.694 -14.290 1.009) 14.426 7.162 ( -2.302 -3.483 1.873) 4.576 7.223 ( 1.129 -5.810 -2.679) 6.497 7.525 ( -2.184 -3.333 -2.164) 4.535 7.643 ( -0.032 -9.365 -1.163) 9.437 7.860 ( 0.511 -2.754 0.400) 2.829 8.374 ( 3.516 2.449 4.835) 6.460 8.690 ( -2.591 4.277 -3.077) 5.872 9.551 ( 0.102 0.602 0.030) 0.612 ======================= Grid point 352 (169/199) ======================= q-point: (-0.25 -0.67 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.768 ( -0.044 1.988 -0.096) 1.991 1.331 ( -0.279 -1.489 -1.302) 1.998 1.605 ( 0.496 -1.296 1.951) 2.395 1.670 ( 0.177 -3.198 -4.670) 5.662 1.809 ( -1.600 -4.518 1.634) 5.064 1.847 ( 1.136 -3.734 -0.020) 3.904 1.915 ( 1.671 -4.318 -0.254) 4.637 2.001 ( -0.196 -3.976 -0.275) 3.990 2.137 ( 0.310 -0.903 0.543) 1.098 2.158 ( 0.911 -0.667 -1.125) 1.594 2.322 ( 0.228 0.932 1.968) 2.189 2.362 ( -0.120 -1.941 -0.462) 1.999 2.447 ( 0.431 -1.360 3.435) 3.720 2.488 ( 0.194 0.080 -0.732) 0.762 2.549 ( -1.453 1.419 -0.849) 2.202 2.605 ( 0.273 0.142 -2.161) 2.183 2.706 ( 0.278 2.193 0.341) 2.237 2.808 ( 0.083 2.787 0.017) 2.788 2.933 ( -0.320 1.153 -0.546) 1.315 3.223 ( -3.485 2.802 1.669) 4.773 3.358 ( 3.072 -1.410 -1.281) 3.615 3.564 ( 0.139 -0.923 -0.036) 0.934 3.737 ( -1.490 -1.280 0.692) 2.083 4.051 ( 0.423 -9.259 0.031) 9.269 5.381 ( 0.367 -6.467 0.681) 6.513 5.425 ( 0.004 0.459 2.011) 2.063 5.641 ( 0.899 1.919 -2.110) 2.990 5.712 ( -0.417 -2.327 -0.505) 2.417 5.973 ( -0.132 -3.576 0.632) 3.634 6.180 ( 0.969 4.229 -0.924) 4.435 6.317 ( -1.305 2.767 0.025) 3.059 6.715 ( 0.610 -2.678 -0.061) 2.747 7.044 ( 0.707 0.058 0.029) 0.710 7.211 ( -0.368 -4.345 2.284) 4.922 7.287 ( 0.755 -8.195 0.053) 8.230 7.360 ( -0.233 -6.750 -1.848) 7.003 7.569 ( -1.203 -2.523 -0.090) 2.797 7.797 ( 0.186 -5.712 0.123) 5.716 7.921 ( 0.143 -2.512 -0.509) 2.567 8.352 ( 1.707 1.761 1.503) 2.876 8.599 ( -1.068 3.403 -1.096) 3.732 9.544 ( -0.123 0.150 0.015) 0.195 ======================= Grid point 353 (170/199) ======================= q-point: (-0.17 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.759 ( -0.506 -1.059 -0.080) 1.177 1.345 ( 0.619 0.347 -1.060) 1.275 1.624 ( 0.610 -0.385 2.660) 2.756 1.715 ( -0.520 -0.921 -5.835) 5.930 1.876 ( 0.156 -2.562 3.048) 3.985 1.917 ( -0.145 -2.888 -1.362) 3.196 1.986 ( -0.413 -1.524 1.683) 2.308 2.051 ( -0.731 -1.528 -0.238) 1.711 2.122 ( 1.592 1.088 -3.344) 3.860 2.208 ( -1.531 -2.934 -0.242) 3.319 2.281 ( 0.048 2.560 3.241) 4.130 2.347 ( 0.176 2.236 -0.298) 2.263 2.455 ( 0.739 2.960 -2.168) 3.743 2.503 ( 0.891 -1.393 1.342) 2.129 2.525 ( -0.593 0.523 0.464) 0.917 2.650 ( -0.779 -4.236 -0.465) 4.332 2.678 ( 0.269 -0.413 0.440) 0.661 2.767 ( -0.454 0.436 -1.021) 1.199 2.900 ( 0.052 2.164 0.855) 2.327 3.170 ( -0.771 0.870 1.492) 1.892 3.369 ( 3.153 1.910 -0.715) 3.755 3.585 ( -0.073 -0.762 -0.528) 0.930 3.723 ( -2.589 1.447 0.330) 2.984 4.146 ( 0.695 0.329 0.191) 0.792 5.436 ( 1.076 -0.747 0.452) 1.386 5.501 ( -0.598 -5.365 1.258) 5.543 5.585 ( 0.205 3.313 -0.747) 3.402 5.749 ( -0.147 -0.879 -0.495) 1.019 6.025 ( -0.290 -1.261 1.179) 1.750 6.117 ( -0.511 2.019 -2.082) 2.945 6.272 ( 0.284 0.888 0.388) 1.010 6.741 ( -0.298 -0.021 -0.752) 0.809 7.026 ( 2.237 2.293 0.399) 3.228 7.284 ( -1.882 -3.271 1.984) 4.263 7.390 ( 0.972 -1.739 -0.398) 2.031 7.450 ( -0.431 -1.811 -1.070) 2.147 7.610 ( -0.199 -2.231 1.975) 2.986 7.860 ( -0.338 -0.591 0.568) 0.887 7.943 ( -1.076 0.158 -1.900) 2.189 8.319 ( -2.087 1.364 -2.502) 3.532 8.553 ( 3.643 1.943 2.064) 4.616 9.543 ( -0.511 -0.298 -0.085) 0.598 ======================= Grid point 354 (171/199) ======================= q-point: (-0.08 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.793 ( -1.172 -2.709 -0.084) 2.953 1.323 ( 2.183 2.615 -0.644) 3.466 1.622 ( -0.014 1.320 4.350) 4.545 1.686 ( -1.749 2.409 -8.256) 8.776 1.915 ( 2.676 -0.178 2.655) 3.774 1.939 ( -2.064 -0.017 -0.807) 2.216 1.979 ( -1.729 0.865 1.993) 2.777 2.050 ( -3.321 1.557 -2.244) 4.299 2.107 ( -2.178 1.208 -2.353) 3.426 2.157 ( -0.110 5.041 3.452) 6.111 2.296 ( 0.404 -0.898 -0.029) 0.985 2.324 ( 0.245 -0.899 0.385) 1.008 2.392 ( 2.380 3.010 -0.692) 3.899 2.503 ( 1.119 1.613 0.427) 2.009 2.513 ( -0.507 0.235 0.183) 0.588 2.704 ( -0.550 -3.357 1.422) 3.687 2.749 ( -4.507 -3.728 -3.460) 6.796 2.794 ( 0.230 -2.345 -0.563) 2.423 2.887 ( 2.954 -2.206 1.787) 4.097 3.163 ( 1.755 1.061 1.916) 2.806 3.329 ( 3.616 4.125 -0.952) 5.568 3.576 ( -1.436 1.441 -1.809) 2.722 3.663 ( -0.958 2.737 1.370) 3.207 4.040 ( 0.907 10.749 0.430) 10.795 5.435 ( -0.972 2.581 -0.209) 2.766 5.511 ( 0.358 1.396 -1.156) 1.848 5.611 ( -0.239 -4.578 1.972) 4.991 5.739 ( -0.491 1.435 -0.415) 1.572 6.007 ( -0.372 2.412 -0.650) 2.525 6.105 ( -1.813 -1.427 3.032) 3.810 6.299 ( 2.252 -2.585 -2.799) 4.426 6.713 ( -1.202 2.429 -0.646) 2.786 6.989 ( 2.814 3.063 0.843) 4.244 7.261 ( -0.713 6.158 2.332) 6.623 7.397 ( -0.775 6.643 -0.348) 6.697 7.414 ( -2.762 -2.276 -1.497) 3.879 7.672 ( 0.781 -3.478 3.435) 4.950 7.818 ( -1.405 4.160 -0.262) 4.399 7.900 ( -2.205 2.963 -2.986) 4.750 8.279 ( -3.808 0.530 -3.074) 4.923 8.566 ( 7.138 0.326 2.816) 7.680 9.550 ( -0.816 -0.832 -0.192) 1.181 ======================= Grid point 360 (172/199) ======================= q-point: ( 0.42 0.42 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.858 ( 1.473 -0.000 -0.260) 1.495 1.191 ( 7.019 -0.000 1.543) 7.187 1.422 ( 6.539 -0.000 0.023) 6.539 1.452 ( 5.615 -0.000 -5.832) 8.096 1.496 ( 3.623 -0.000 0.577) 3.669 1.514 ( -1.756 0.000 10.986) 11.125 1.614 ( 3.513 -0.000 -6.789) 7.644 1.712 ( -1.037 0.000 0.533) 1.166 1.752 ( -2.641 0.000 -0.752) 2.746 1.921 ( -9.026 0.000 -0.274) 9.030 2.182 ( -1.539 0.000 3.633) 3.946 2.203 ( -1.322 0.000 -5.084) 5.253 2.249 ( -0.030 0.000 -3.976) 3.977 2.352 ( 1.862 -0.000 5.750) 6.044 2.492 ( -0.674 0.000 0.898) 1.123 2.522 ( 6.273 -0.000 1.168) 6.380 2.561 ( 1.591 -0.000 -1.998) 2.554 2.701 ( -0.502 0.000 -0.237) 0.555 2.820 ( -2.485 0.000 -1.217) 2.767 2.866 ( -6.256 0.000 -0.937) 6.325 3.034 ( 5.781 -0.000 6.436) 8.651 3.325 ( -2.487 0.000 -2.232) 3.342 3.614 ( -1.622 0.000 -2.228) 2.756 3.867 ( 1.689 -0.000 1.096) 2.013 4.868 ( -0.382 0.000 -0.162) 0.415 5.396 ( 1.817 -0.000 -0.070) 1.818 5.507 ( -3.169 0.000 -1.577) 3.540 5.626 ( -1.780 0.000 1.203) 2.148 5.704 ( 0.112 -0.000 1.485) 1.490 5.820 ( -0.990 0.000 -1.392) 1.708 5.949 ( -0.772 0.000 -0.287) 0.823 6.179 ( -0.622 0.000 8.911) 8.933 6.711 ( -0.242 0.000 1.123) 1.148 6.731 ( 5.570 -0.000 2.570) 6.135 6.844 ( 0.455 -0.000 -0.841) 0.957 6.951 ( -1.501 0.000 0.476) 1.575 7.203 ( -1.855 0.000 -0.908) 2.065 7.492 ( -6.766 0.000 -11.500) 13.343 7.910 ( 1.274 -0.000 0.004) 1.274 8.578 ( 0.662 -0.000 4.801) 4.847 8.969 ( 3.765 -0.000 -1.459) 4.037 9.642 ( -2.767 0.000 -1.107) 2.980 ======================= Grid point 361 (173/199) ======================= q-point: ( 0.50 0.42 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.917 ( 0.542 -4.098 -0.594) 4.176 1.254 ( 4.624 -2.538 1.617) 5.517 1.408 ( 5.583 1.221 0.683) 5.756 1.443 ( -4.584 1.517 6.040) 7.732 1.479 ( -1.193 -1.071 -2.839) 3.261 1.611 ( 1.700 0.990 -2.581) 3.246 1.668 ( 2.121 -2.015 -2.188) 3.654 1.707 ( -2.762 -3.277 -1.223) 4.457 1.774 ( 5.554 -4.428 2.175) 7.429 1.922 ( -5.065 -5.267 -0.655) 7.336 2.138 ( -0.893 2.679 -3.695) 4.651 2.258 ( -3.112 -3.444 0.778) 4.706 2.328 ( 0.374 -6.563 0.870) 6.630 2.399 ( 2.593 -3.809 3.504) 5.789 2.488 ( 0.202 -0.394 2.658) 2.695 2.592 ( -0.078 -3.622 3.199) 4.833 2.613 ( 2.056 -4.365 -7.741) 9.121 2.707 ( -0.318 -0.729 -0.691) 1.054 2.805 ( -3.985 -3.138 -2.193) 5.526 2.871 ( -2.310 -1.938 0.852) 3.133 3.094 ( 8.451 -1.473 6.593) 10.819 3.301 ( -2.905 0.454 -3.218) 4.359 3.598 ( -1.242 0.565 -1.725) 2.200 3.845 ( 0.720 2.807 1.203) 3.137 4.895 ( 0.362 -2.782 -0.801) 2.917 5.464 ( -1.001 -0.293 -0.866) 1.356 5.505 ( 0.427 -7.293 -0.640) 7.333 5.618 ( -0.650 0.133 0.722) 0.980 5.793 ( -0.830 -1.329 1.541) 2.198 5.862 ( -0.778 -10.417 -1.024) 10.496 6.038 ( -0.497 -8.807 0.026) 8.821 6.207 ( 0.602 -3.231 7.113) 7.836 6.689 ( 2.057 2.649 1.972) 3.890 6.795 ( 4.070 -0.646 -1.147) 4.277 6.856 ( -0.558 -2.557 2.854) 3.872 6.974 ( -4.674 -4.969 -2.575) 7.292 7.200 ( 1.561 -0.056 1.545) 2.197 7.445 ( -5.858 0.188 -10.340) 11.885 7.899 ( 0.554 1.554 0.030) 1.650 8.556 ( 1.299 2.788 4.748) 5.658 8.956 ( 1.291 2.830 -1.590) 3.493 9.618 ( -1.371 1.001 -0.748) 1.855 ======================= Grid point 362 (174/199) ======================= q-point: (-0.42 -0.58 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.970 ( -0.795 -0.528 -0.382) 1.028 1.314 ( -0.008 -0.037 2.631) 2.631 1.391 ( -5.564 -2.950 3.624) 7.266 1.476 ( 4.030 -3.037 0.021) 5.046 1.506 ( -0.883 -2.869 -3.318) 4.474 1.596 ( 0.764 0.091 -1.331) 1.538 1.703 ( 0.431 -3.054 0.288) 3.098 1.761 ( -0.740 -3.739 -2.498) 4.558 1.965 ( 7.452 -6.889 3.337) 10.683 2.009 ( -4.165 -5.679 -1.182) 7.141 2.093 ( -0.444 1.073 -2.114) 2.412 2.295 ( -1.878 -2.950 0.504) 3.533 2.385 ( 1.469 0.355 1.402) 2.061 2.491 ( 0.520 -0.707 1.342) 1.604 2.595 ( 0.772 -9.866 1.757) 10.051 2.644 ( -0.476 -1.041 -0.086) 1.148 2.692 ( -1.635 -2.866 -4.146) 5.299 2.723 ( -1.018 -2.789 -1.861) 3.504 2.888 ( 2.645 -2.082 1.774) 3.804 2.959 ( -3.261 -10.252 -0.158) 10.759 3.208 ( 4.838 -6.560 2.345) 8.482 3.285 ( -1.638 -0.886 -1.757) 2.560 3.579 ( -0.786 0.616 -0.724) 1.233 3.778 ( 0.070 3.842 1.057) 3.985 4.980 ( 0.895 -5.358 -1.209) 5.565 5.469 ( -0.218 -1.422 -0.462) 1.511 5.601 ( -0.922 1.473 0.336) 1.770 5.676 ( 0.456 -6.852 -0.115) 6.868 5.794 ( 0.180 -0.726 0.550) 0.928 6.100 ( -1.297 -11.209 4.321) 12.083 6.256 ( 0.569 -12.321 -0.921) 12.369 6.364 ( 1.483 -12.071 0.830) 12.190 6.630 ( 1.511 3.775 1.824) 4.456 6.760 ( -0.315 2.202 -2.763) 3.547 6.973 ( -0.089 -6.614 4.928) 8.249 7.082 ( -0.917 -6.318 -4.568) 7.850 7.244 ( 1.724 -4.259 3.500) 5.775 7.423 ( -3.699 -1.771 -8.239) 9.204 7.862 ( -0.062 2.118 0.114) 2.122 8.501 ( 1.980 3.667 4.523) 6.150 8.878 ( -1.247 4.710 -1.885) 5.224 9.590 ( -0.127 1.227 -0.347) 1.282 ======================= Grid point 363 (175/199) ======================= q-point: (-0.33 -0.58 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.926 ( -1.109 3.879 0.014) 4.035 1.291 ( -1.245 0.491 2.334) 2.691 1.454 ( -4.809 -5.003 1.651) 7.133 1.563 ( -4.683 -6.447 -0.372) 7.977 1.580 ( 4.002 -3.085 -5.052) 7.145 1.658 ( 4.976 -4.073 1.187) 6.539 1.777 ( -0.597 -3.973 -0.295) 4.028 1.836 ( 2.672 -3.267 -0.480) 4.248 2.064 ( -1.287 -2.537 0.564) 2.900 2.099 ( 2.251 -1.585 -1.170) 2.991 2.137 ( 2.146 -6.449 1.559) 6.974 2.354 ( -0.010 -2.446 1.046) 2.661 2.377 ( -0.183 -0.295 -1.264) 1.311 2.492 ( -0.376 0.428 1.460) 1.567 2.631 ( -0.054 1.577 0.465) 1.645 2.665 ( -0.625 1.129 -2.100) 2.464 2.748 ( -0.869 -1.688 1.157) 2.223 2.813 ( -0.104 -5.079 -1.936) 5.437 2.940 ( 0.247 -1.738 -0.523) 1.832 3.112 ( -0.394 -6.332 0.636) 6.376 3.314 ( -0.409 -1.740 0.448) 1.843 3.455 ( -0.374 -16.237 -0.361) 16.245 3.565 ( -0.546 0.025 0.224) 0.591 3.714 ( -0.019 2.206 0.674) 2.307 5.109 ( 1.347 -6.851 -1.239) 7.091 5.497 ( -0.725 0.216 3.274) 3.361 5.562 ( 0.255 0.050 -2.252) 2.267 5.743 ( -0.218 -0.488 1.068) 1.194 5.838 ( 1.537 -2.605 -0.504) 3.066 6.271 ( 0.553 -5.139 6.516) 8.317 6.402 ( -0.793 -0.391 -6.880) 6.937 6.559 ( -0.243 -2.434 -0.085) 2.448 6.706 ( 0.384 -15.391 0.776) 15.416 6.817 ( 2.214 -9.069 0.204) 9.338 7.073 ( -2.693 -4.161 3.295) 5.952 7.166 ( 2.731 -2.472 -2.659) 4.543 7.404 ( 0.374 -8.869 2.834) 9.319 7.475 ( -0.723 -5.658 -5.844) 8.166 7.834 ( -0.053 0.160 0.261) 0.311 8.446 ( 1.791 3.123 3.031) 4.706 8.768 ( -2.214 4.970 -1.396) 5.618 9.568 ( 0.180 1.041 -0.131) 1.065 ======================= Grid point 364 (176/199) ======================= q-point: (-0.25 -0.58 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.834 ( -0.365 4.321 -0.073) 4.337 1.296 ( -0.371 -1.318 0.789) 1.580 1.531 ( -2.683 -5.091 0.747) 5.802 1.640 ( 1.892 -1.782 -4.378) 5.092 1.688 ( -0.870 -6.711 0.819) 6.817 1.774 ( 3.330 -4.504 2.047) 5.963 1.853 ( 1.645 -3.519 -1.577) 4.192 1.920 ( 1.790 -3.864 -0.018) 4.259 2.100 ( -1.007 -1.964 0.559) 2.277 2.154 ( 2.837 -1.723 -1.527) 3.654 2.267 ( 1.027 -5.421 0.864) 5.585 2.349 ( -0.478 0.629 -0.545) 0.960 2.427 ( 0.645 -2.061 1.017) 2.387 2.481 ( -0.864 -0.002 1.772) 1.972 2.584 ( -0.747 2.634 0.823) 2.859 2.627 ( -1.117 1.677 -3.359) 3.917 2.746 ( 0.440 1.325 0.296) 1.428 2.852 ( 0.216 0.784 0.150) 0.827 2.948 ( -0.244 0.489 -1.134) 1.259 3.216 ( -2.602 -2.828 3.035) 4.897 3.329 ( 0.172 -1.616 -1.643) 2.311 3.556 ( -0.177 0.067 -0.407) 0.449 3.697 ( -1.415 -1.296 0.874) 2.109 3.798 ( 0.094 -15.737 -0.106) 15.737 5.255 ( 1.573 -6.870 -0.603) 7.073 5.453 ( -0.219 2.164 3.699) 4.291 5.619 ( 1.352 -3.651 -2.432) 4.590 5.717 ( -0.325 2.315 0.145) 2.342 5.905 ( 0.950 -3.299 -0.109) 3.435 6.275 ( 0.645 4.262 2.223) 4.850 6.354 ( -2.205 1.968 -3.161) 4.328 6.639 ( 0.364 -5.008 -0.677) 5.067 6.978 ( -0.410 -8.904 0.944) 8.963 7.071 ( 4.540 -12.589 -0.404) 13.388 7.138 ( -1.917 -4.522 3.626) 6.105 7.236 ( 1.341 -4.071 -2.791) 5.115 7.509 ( -0.259 -3.234 0.807) 3.343 7.648 ( 1.084 -9.309 -0.935) 9.419 7.863 ( -0.112 -2.786 -0.299) 2.804 8.398 ( -0.170 2.515 -0.408) 2.553 8.668 ( -0.607 3.923 0.774) 4.045 9.551 ( -0.098 0.686 -0.115) 0.703 ======================= Grid point 365 (177/199) ======================= q-point: (-0.17 -0.58 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.767 ( 0.030 2.101 -0.129) 2.105 1.328 ( 0.026 -1.710 -0.593) 1.809 1.607 ( -0.910 -2.993 2.019) 3.723 1.675 ( 1.542 -1.454 -4.607) 5.071 1.804 ( 0.768 -4.634 2.392) 5.271 1.868 ( 2.417 -3.167 0.055) 3.985 1.932 ( 1.210 -3.353 -0.901) 3.677 2.002 ( 0.352 -3.363 0.176) 3.386 2.135 ( -0.958 -2.366 0.484) 2.599 2.173 ( 1.824 1.358 -3.051) 3.805 2.321 ( -0.535 0.643 1.564) 1.773 2.358 ( -0.413 -1.205 -0.890) 1.554 2.465 ( 1.936 -2.412 2.921) 4.254 2.486 ( -0.646 0.029 -0.861) 1.077 2.535 ( -0.668 1.421 1.114) 1.925 2.599 ( -0.944 -0.046 -2.425) 2.603 2.710 ( 0.317 2.292 -0.165) 2.319 2.808 ( -0.024 3.146 -0.054) 3.147 2.928 ( -0.406 1.137 -0.226) 1.228 3.188 ( -2.441 1.567 3.680) 4.686 3.393 ( 2.723 -1.958 -1.964) 3.887 3.557 ( -1.293 -0.891 -1.110) 1.923 3.711 ( -2.418 -0.846 1.051) 2.768 4.058 ( 0.578 -9.445 -0.002) 9.463 5.390 ( 1.001 -5.861 0.484) 5.966 5.436 ( 1.295 0.093 2.469) 2.789 5.648 ( 0.355 2.848 -1.938) 3.463 5.708 ( 0.026 -2.888 -0.482) 2.928 5.974 ( 0.147 -3.138 0.707) 3.220 6.183 ( -0.045 4.337 -3.088) 5.324 6.301 ( -1.416 2.123 1.843) 3.148 6.717 ( -0.123 -2.432 -1.244) 2.734 7.062 ( 1.636 -0.875 0.337) 1.886 7.208 ( -0.028 -2.849 2.992) 4.132 7.305 ( 2.123 -7.954 -1.217) 8.322 7.357 ( 0.101 -6.785 -0.677) 6.820 7.566 ( 0.566 -2.551 2.471) 3.597 7.802 ( 0.624 -5.313 0.322) 5.359 7.913 ( -1.318 -2.124 -1.896) 3.137 8.339 ( -2.990 2.312 -3.847) 5.393 8.615 ( 2.804 2.147 3.258) 4.805 9.540 ( -0.488 0.270 -0.194) 0.591 ======================= Grid point 366 (178/199) ======================= q-point: (-0.08 0.42 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.752 ( -0.496 -0.589 -0.107) 0.778 1.351 ( 0.410 -0.332 -1.251) 1.358 1.633 ( 0.240 -0.029 2.780) 2.790 1.705 ( -0.031 -0.423 -5.826) 5.841 1.873 ( -0.723 -2.461 3.022) 3.964 1.934 ( 2.736 -1.648 -0.500) 3.232 1.977 ( -1.254 -0.788 1.599) 2.179 2.039 ( -1.177 -0.564 -0.876) 1.572 2.137 ( 1.493 2.268 -3.545) 4.466 2.183 ( -2.315 -2.445 -0.271) 3.378 2.286 ( 0.203 2.225 3.588) 4.227 2.352 ( 0.723 0.937 -0.790) 1.423 2.457 ( -0.121 2.186 -1.571) 2.695 2.509 ( -0.341 -0.359 -0.228) 0.545 2.533 ( 1.971 0.162 2.550) 3.227 2.633 ( -1.843 -3.919 -1.136) 4.477 2.680 ( 0.080 -0.006 -0.315) 0.325 2.759 ( -0.663 0.504 -0.682) 1.076 2.902 ( 0.159 1.149 0.699) 1.354 3.172 ( 0.605 -0.331 2.620) 2.709 3.412 ( 3.874 1.745 -0.695) 4.305 3.566 ( -3.057 -0.820 -2.515) 4.043 3.696 ( -1.338 1.023 1.490) 2.248 4.155 ( 0.672 0.289 0.252) 0.774 5.452 ( 1.372 -0.443 0.378) 1.490 5.494 ( -0.627 -3.726 1.105) 3.937 5.585 ( -0.167 2.498 -0.095) 2.506 5.748 ( 0.015 -0.619 -0.855) 1.055 6.024 ( 0.080 -1.571 1.291) 2.035 6.106 ( -0.888 3.057 -2.292) 3.922 6.276 ( 0.300 -0.410 0.495) 0.709 6.733 ( -0.758 0.301 -1.150) 1.410 7.063 ( 3.234 2.049 0.690) 3.891 7.259 ( -2.309 -2.707 2.277) 4.224 7.396 ( 0.008 -0.723 -2.202) 2.317 7.452 ( 0.767 -1.356 0.698) 1.707 7.620 ( 1.447 -2.431 3.672) 4.635 7.854 ( -0.859 0.169 0.730) 1.140 7.918 ( -2.275 0.326 -3.737) 4.387 8.278 ( -3.406 1.562 -3.722) 5.281 8.615 ( 4.894 0.612 3.260) 5.912 9.535 ( -0.731 -0.200 -0.264) 0.802 ======================= Grid point 373 (179/199) ======================= q-point: (-0.50 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.868 ( -0.002 0.000 -0.005) 0.006 1.251 ( 1.774 -0.000 1.212) 2.148 1.386 ( -8.727 0.000 6.617) 10.952 1.423 ( -2.424 0.000 -0.626) 2.503 1.576 ( 3.549 -0.000 -3.357) 4.885 1.585 ( 5.450 -0.000 1.510) 5.655 1.648 ( 1.602 -0.000 -1.940) 2.516 1.706 ( -3.361 0.000 -1.105) 3.538 1.750 ( 6.205 -0.000 -2.327) 6.627 1.820 ( -3.956 0.000 -0.320) 3.968 2.174 ( -0.131 0.000 3.630) 3.633 2.186 ( -1.724 0.000 -2.422) 2.973 2.249 ( 0.508 -0.000 -4.174) 4.204 2.385 ( 1.671 -0.000 8.005) 8.177 2.488 ( -0.123 0.000 0.992) 0.999 2.521 ( -6.687 0.000 1.037) 6.767 2.588 ( 2.724 -0.000 -5.229) 5.896 2.697 ( -0.015 0.000 -0.227) 0.228 2.751 ( -0.635 0.000 -2.135) 2.228 2.859 ( 0.520 -0.000 1.221) 1.327 3.139 ( 8.667 -0.000 6.100) 10.598 3.283 ( -3.522 0.000 -5.426) 6.469 3.594 ( -1.182 0.000 -1.304) 1.760 3.877 ( -0.233 0.000 1.286) 1.307 4.871 ( 1.067 -0.000 -1.416) 1.773 5.409 ( 0.172 -0.000 -0.236) 0.293 5.485 ( -0.055 0.000 -1.465) 1.466 5.619 ( 0.503 -0.000 0.469) 0.688 5.706 ( 0.129 -0.000 1.562) 1.567 5.811 ( -0.321 0.000 -1.300) 1.339 5.944 ( -0.009 0.000 -0.249) 0.249 6.185 ( 0.444 -0.000 8.014) 8.026 6.711 ( 0.024 -0.000 1.003) 1.003 6.813 ( 7.363 -0.000 4.074) 8.415 6.847 ( 0.018 -0.000 -0.775) 0.775 6.892 ( -6.598 0.000 -3.200) 7.333 7.213 ( 1.987 -0.000 1.545) 2.517 7.411 ( -4.967 0.000 -9.100) 10.367 7.918 ( 0.011 -0.000 0.057) 0.058 8.592 ( 0.974 -0.000 3.705) 3.831 8.989 ( -0.536 0.000 -0.986) 1.122 9.622 ( -0.310 0.000 -0.679) 0.747 ======================= Grid point 374 (180/199) ======================= q-point: (-0.42 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.910 ( -1.663 -3.656 0.020) 4.016 1.270 ( -3.581 -2.524 -0.113) 4.382 1.338 ( -7.218 0.334 8.783) 11.373 1.418 ( -4.633 -0.902 1.130) 4.854 1.536 ( 5.715 1.974 -2.713) 6.627 1.609 ( -2.529 -0.574 -2.057) 3.310 1.660 ( -0.465 -0.667 -1.459) 1.670 1.712 ( 4.975 -1.222 -1.611) 5.371 1.839 ( -4.981 -6.828 -3.979) 9.342 1.893 ( 8.155 -5.100 2.251) 9.878 2.123 ( -1.262 2.334 -2.324) 3.528 2.237 ( -0.657 -2.425 2.717) 3.701 2.339 ( 1.479 -7.567 -0.497) 7.726 2.425 ( 0.758 -2.797 4.221) 5.120 2.493 ( 0.302 -1.345 1.779) 2.251 2.547 ( -6.950 -6.641 -3.163) 10.120 2.618 ( 0.767 -1.577 0.056) 1.755 2.704 ( -0.019 -0.430 -0.447) 0.620 2.792 ( 1.702 -3.802 -0.886) 4.259 2.874 ( 2.193 -0.936 0.857) 2.534 3.183 ( 2.652 -0.344 0.843) 2.804 3.268 ( 0.407 -0.259 -3.317) 3.352 3.584 ( -0.672 0.416 -0.354) 0.866 3.844 ( -1.043 2.721 1.294) 3.188 4.906 ( 1.675 -2.712 -1.895) 3.709 5.463 ( 1.026 -0.213 -0.875) 1.365 5.504 ( -0.533 -6.923 -0.448) 6.958 5.625 ( 1.835 -0.047 -0.120) 1.839 5.792 ( 0.478 -0.859 1.723) 1.984 5.852 ( -0.841 -10.277 0.045) 10.312 6.036 ( 0.265 -8.758 0.114) 8.762 6.227 ( 1.813 -3.910 5.357) 6.875 6.707 ( 0.781 1.824 0.416) 2.028 6.802 ( -4.039 2.363 -3.367) 5.765 6.879 ( 4.479 -3.120 5.801) 7.965 6.934 ( -0.298 -6.065 -2.599) 6.605 7.226 ( 1.250 -0.433 1.045) 1.685 7.382 ( -2.696 -0.120 -6.241) 6.800 7.899 ( -0.606 1.586 0.087) 1.700 8.574 ( 1.108 2.435 2.987) 4.010 8.946 ( -2.701 3.074 -0.764) 4.163 9.614 ( 0.845 0.931 -0.409) 1.322 ======================= Grid point 375 (181/199) ======================= q-point: (-0.33 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.945 ( -3.425 -0.813 0.807) 3.612 1.296 ( -3.120 0.397 4.906) 5.827 1.316 ( -7.298 -5.242 2.408) 9.302 1.420 ( -6.160 -3.456 0.639) 7.092 1.563 ( 4.889 -1.011 -3.893) 6.331 1.640 ( 4.877 -1.604 -1.031) 5.237 1.687 ( -1.000 -3.612 -0.283) 3.758 1.796 ( 4.673 -3.280 -0.669) 5.748 1.943 ( -5.988 -7.102 -3.820) 10.044 2.048 ( 5.364 -5.438 1.453) 7.775 2.098 ( 1.840 -0.002 -1.346) 2.280 2.285 ( 0.226 -3.102 2.669) 4.098 2.391 ( -0.643 0.791 -0.518) 1.144 2.499 ( 0.773 -0.264 0.811) 1.151 2.597 ( -0.836 -9.933 2.034) 10.173 2.634 ( -1.085 -2.070 -1.396) 2.722 2.668 ( -1.521 -1.433 -1.598) 2.631 2.731 ( 2.301 -3.677 -0.083) 4.338 2.878 ( -3.121 -4.373 -0.393) 5.387 2.972 ( 3.684 -7.487 2.719) 8.776 3.208 ( -4.048 -4.736 -3.967) 7.385 3.298 ( 3.276 -1.195 0.208) 3.493 3.569 ( -0.757 0.613 0.470) 1.082 3.773 ( -1.114 3.487 0.871) 3.762 4.996 ( 2.100 -5.277 -2.113) 6.060 5.482 ( 2.257 -1.069 -0.154) 2.502 5.581 ( -2.320 0.413 1.192) 2.640 5.690 ( 1.924 -4.772 -0.417) 5.162 5.809 ( 2.118 -1.422 0.247) 2.563 6.088 ( -1.327 -11.925 4.996) 12.997 6.265 ( 1.159 -12.665 -1.224) 12.777 6.385 ( 1.842 -10.334 -0.580) 10.513 6.637 ( -0.748 3.982 -1.059) 4.187 6.747 ( -0.937 0.268 -1.648) 1.914 6.978 ( -0.077 -4.397 4.573) 6.344 7.088 ( 2.794 -7.372 -2.572) 8.293 7.271 ( 1.965 -4.295 1.299) 4.899 7.392 ( -0.166 -2.222 -3.415) 4.077 7.857 ( -0.735 1.942 0.213) 2.087 8.521 ( 0.719 3.445 1.464) 3.812 8.848 ( -3.487 4.575 -0.083) 5.753 9.596 ( 0.979 1.427 -0.169) 1.739 ======================= Grid point 376 (182/199) ======================= q-point: (-0.25 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.904 ( -2.290 2.775 0.517) 3.635 1.284 ( -0.493 -0.035 4.392) 4.420 1.392 ( -5.549 -6.209 1.569) 8.473 1.506 ( -3.664 -8.332 0.403) 9.111 1.621 ( 3.182 -2.302 -4.341) 5.854 1.729 ( 5.815 -3.546 0.440) 6.825 1.774 ( 0.810 -4.788 -1.332) 5.035 1.880 ( 3.748 -2.555 0.111) 4.537 2.029 ( -3.544 -4.484 -2.183) 6.118 2.132 ( 2.886 -2.367 -0.195) 3.738 2.179 ( 4.068 -4.288 -0.464) 5.929 2.352 ( -1.233 -0.847 0.290) 1.524 2.375 ( 0.734 -2.145 -0.498) 2.321 2.489 ( -0.233 1.007 1.795) 2.072 2.629 ( -0.846 2.038 0.937) 2.398 2.644 ( -1.835 0.865 -3.071) 3.681 2.747 ( 0.444 -2.865 2.849) 4.065 2.818 ( 0.933 -4.039 -0.395) 4.164 2.930 ( -1.560 -2.193 -2.018) 3.364 3.113 ( 0.284 -5.129 1.714) 5.416 3.306 ( -1.084 -0.954 0.311) 1.477 3.435 ( -2.646 -16.488 -1.687) 16.784 3.560 ( -0.409 -0.442 1.043) 1.204 3.709 ( -0.925 2.041 0.109) 2.244 5.131 ( 2.485 -6.769 -1.892) 7.455 5.499 ( 0.246 1.842 3.892) 4.313 5.566 ( 0.703 -1.827 -1.292) 2.345 5.744 ( 0.326 -0.136 0.808) 0.881 5.863 ( 2.624 -2.051 -0.787) 3.422 6.280 ( 0.190 -6.169 6.172) 8.729 6.382 ( -1.463 1.794 -7.157) 7.522 6.550 ( -1.239 -3.217 -0.474) 3.480 6.707 ( 0.194 -14.863 -0.291) 14.867 6.860 ( 4.080 -10.629 -1.022) 11.431 7.044 ( -2.327 -3.479 3.879) 5.706 7.203 ( 3.846 -2.537 -2.207) 5.109 7.426 ( 2.913 -6.762 4.928) 8.860 7.474 ( 1.012 -7.141 -4.383) 8.439 7.831 ( -0.395 -0.087 0.125) 0.423 8.452 ( -1.029 3.410 -1.620) 3.913 8.741 ( -2.160 4.105 1.818) 4.982 9.572 ( 0.482 1.357 -0.101) 1.444 ======================= Grid point 377 (183/199) ======================= q-point: (-0.17 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.829 ( -0.304 3.609 -0.059) 3.622 1.297 ( 0.208 -1.267 2.189) 2.538 1.492 ( -3.757 -6.423 1.496) 7.590 1.654 ( 1.329 -3.931 -3.826) 5.644 1.699 ( 2.320 -6.218 0.994) 6.711 1.826 ( 4.571 -2.777 1.014) 5.444 1.874 ( 2.318 -4.085 -1.686) 4.990 1.947 ( 2.345 -2.570 0.340) 3.496 2.081 ( -1.881 -2.635 -1.296) 3.487 2.193 ( 3.522 -0.905 -2.334) 4.321 2.274 ( -0.096 -4.070 -0.044) 4.072 2.338 ( -0.868 -0.112 -1.637) 1.856 2.445 ( 1.689 -2.279 1.417) 3.171 2.469 ( -1.102 0.291 2.381) 2.640 2.575 ( -1.135 2.372 0.881) 2.773 2.607 ( -1.163 1.481 -2.459) 3.097 2.754 ( 0.724 1.552 0.523) 1.791 2.854 ( 0.067 0.841 -0.351) 0.914 2.949 ( 0.443 0.264 0.168) 0.543 3.184 ( -2.854 -1.260 3.597) 4.762 3.320 ( -1.585 -3.887 -1.576) 4.484 3.550 ( -0.804 0.176 -0.690) 1.074 3.678 ( -1.545 -1.093 0.533) 1.967 3.795 ( -0.613 -16.182 -0.336) 16.197 5.280 ( 2.531 -6.505 -1.048) 7.058 5.459 ( 0.486 1.543 3.835) 4.162 5.635 ( 1.457 -3.664 -1.209) 4.125 5.714 ( -0.214 2.766 -0.005) 2.775 5.921 ( 1.694 -2.482 -0.403) 3.031 6.274 ( -0.712 4.972 -2.412) 5.572 6.328 ( -1.879 1.167 1.231) 2.531 6.639 ( -0.124 -5.250 -1.738) 5.532 6.976 ( -0.147 -8.878 0.428) 8.889 7.097 ( -0.909 -9.736 -0.768) 9.808 7.156 ( 4.507 -9.488 4.228) 11.323 7.255 ( 2.881 -1.263 -2.631) 4.101 7.523 ( 2.336 -2.854 3.688) 5.216 7.665 ( 1.735 -8.944 -0.691) 9.137 7.856 ( -0.881 -2.388 -1.101) 2.773 8.372 ( -3.295 3.153 -4.604) 6.480 8.672 ( 0.306 2.407 3.694) 4.420 9.550 ( -0.008 0.972 -0.151) 0.983 ======================= Grid point 378 (184/199) ======================= q-point: (-0.08 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.770 ( 0.466 2.261 -0.144) 2.312 1.330 ( 0.133 -1.566 0.080) 1.573 1.586 ( -2.369 -4.477 2.096) 5.482 1.695 ( 1.993 -0.839 -4.761) 5.229 1.833 ( 3.467 -3.230 2.983) 5.599 1.905 ( 3.515 -3.237 0.004) 4.778 1.943 ( 0.780 -1.783 -0.488) 2.006 2.009 ( 0.741 -2.252 0.238) 2.383 2.116 ( -1.973 -2.331 -1.258) 3.303 2.193 ( 1.725 1.822 -3.355) 4.189 2.316 ( -0.308 0.113 1.460) 1.496 2.350 ( -0.667 -1.167 -1.423) 1.958 2.465 ( -2.368 -0.032 -0.785) 2.495 2.493 ( 1.761 -2.359 1.000) 3.109 2.538 ( 0.543 0.635 2.961) 3.076 2.586 ( -0.202 0.156 -1.455) 1.478 2.713 ( 0.194 2.459 -0.354) 2.492 2.806 ( -0.293 3.536 -0.201) 3.554 2.923 ( -0.530 1.513 0.043) 1.604 3.171 ( -0.904 0.085 4.407) 4.500 3.411 ( -0.158 -4.130 -1.803) 4.509 3.533 ( -1.869 0.299 -1.379) 2.342 3.690 ( -0.893 -0.816 0.748) 1.422 4.062 ( -0.007 -9.847 -0.029) 9.847 5.405 ( 1.309 -4.636 0.179) 4.820 5.457 ( 1.698 -0.567 2.487) 3.064 5.645 ( -0.515 3.558 -0.930) 3.713 5.713 ( 0.726 -2.975 -0.749) 3.153 5.979 ( 0.681 -2.608 0.564) 2.754 6.177 ( -0.277 4.198 -4.667) 6.284 6.285 ( -1.674 1.512 3.157) 3.880 6.712 ( -0.306 -2.166 -1.664) 2.748 7.068 ( -1.081 -2.742 -0.121) 2.949 7.227 ( 2.692 -1.268 4.245) 5.185 7.324 ( 0.644 -5.673 -3.925) 6.928 7.371 ( 2.828 -7.488 1.219) 8.097 7.589 ( 2.725 -2.193 4.616) 5.792 7.811 ( 0.686 -4.593 0.720) 4.699 7.888 ( -2.209 -1.520 -3.534) 4.436 8.293 ( -3.497 2.289 -4.495) 6.138 8.649 ( 1.666 0.749 3.392) 3.852 9.534 ( -0.232 0.485 -0.189) 0.570 ======================= Grid point 386 (185/199) ======================= q-point: (-0.42 -0.42 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.855 ( -2.146 0.000 0.012) 2.146 1.201 ( -9.684 0.000 1.271) 9.767 1.312 ( -4.803 0.000 8.521) 9.781 1.387 ( -3.680 0.000 2.475) 4.435 1.553 ( -7.915 0.000 -4.271) 8.993 1.562 ( -4.593 0.000 -2.020) 5.017 1.660 ( 1.386 -0.000 -3.390) 3.662 1.725 ( 4.347 -0.000 2.067) 4.813 1.766 ( 2.294 -0.000 -5.523) 5.981 1.909 ( 10.439 -0.000 1.140) 10.501 2.151 ( -3.139 0.000 -0.477) 3.175 2.182 ( 0.802 -0.000 3.269) 3.366 2.255 ( 1.202 -0.000 -4.290) 4.455 2.362 ( -6.703 0.000 9.341) 11.497 2.455 ( -1.697 0.000 -2.883) 3.346 2.490 ( 0.372 -0.000 1.077) 1.140 2.610 ( 1.753 -0.000 -0.857) 1.951 2.700 ( 0.515 -0.000 -0.185) 0.547 2.786 ( 4.072 -0.000 0.367) 4.088 2.880 ( 3.216 -0.000 -0.118) 3.218 3.175 ( -4.392 0.000 -6.439) 7.794 3.287 ( 6.086 -0.000 0.019) 6.086 3.587 ( 0.166 -0.000 0.538) 0.563 3.863 ( -2.186 0.000 1.473) 2.636 4.892 ( 2.821 -0.000 -2.638) 3.862 5.400 ( -1.559 0.000 -0.401) 1.609 5.502 ( 2.840 -0.000 -1.152) 3.064 5.639 ( 2.876 -0.000 -0.214) 2.884 5.710 ( 0.186 -0.000 1.109) 1.124 5.810 ( 0.357 -0.000 -0.628) 0.722 5.948 ( 0.796 -0.000 -0.243) 0.832 6.203 ( 1.590 -0.000 7.092) 7.268 6.714 ( 0.303 -0.000 0.921) 0.970 6.803 ( -6.542 0.000 -5.677) 8.662 6.843 ( -0.440 0.000 -0.771) 0.887 6.919 ( 8.672 -0.000 5.804) 10.435 7.218 ( -2.086 0.000 -2.137) 2.986 7.374 ( 0.457 -0.000 -1.441) 1.512 7.910 ( -1.320 0.000 0.069) 1.322 8.606 ( 0.869 -0.000 2.047) 2.224 8.955 ( -4.773 0.000 -0.207) 4.777 9.633 ( 2.104 -0.000 -0.276) 2.122 ======================= Grid point 387 (186/199) ======================= q-point: (-0.33 -0.42 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.873 ( -4.658 -2.887 1.055) 5.581 1.171 ( -10.682 -3.522 3.208) 11.696 1.268 ( -6.687 0.369 2.830) 7.270 1.360 ( -4.778 -0.138 5.322) 7.154 1.563 ( -1.401 -2.071 -2.407) 3.471 1.576 ( -1.535 -5.093 -1.595) 5.553 1.671 ( 0.615 -0.712 -2.401) 2.579 1.768 ( 3.563 -1.894 1.205) 4.211 1.786 ( -0.709 -2.273 -5.950) 6.408 1.982 ( 3.732 -3.477 -0.472) 5.123 2.117 ( 2.010 1.074 -0.089) 2.280 2.244 ( 1.162 -2.280 4.065) 4.803 2.358 ( 1.287 -6.331 -1.739) 6.691 2.411 ( -3.993 -6.302 6.422) 9.844 2.470 ( -2.217 -6.314 -5.092) 8.409 2.507 ( 0.702 -1.000 1.169) 1.691 2.631 ( 1.366 -1.268 0.205) 1.875 2.706 ( 0.393 -0.269 -0.146) 0.498 2.814 ( 1.366 -0.724 1.804) 2.375 2.920 ( 4.529 -1.869 -0.235) 4.906 3.141 ( -5.570 -0.330 -8.011) 9.763 3.320 ( 5.302 0.399 -0.129) 5.319 3.582 ( 0.187 0.806 1.243) 1.493 3.823 ( -2.637 2.376 1.397) 3.814 4.934 ( 3.512 -2.412 -2.980) 5.199 5.468 ( -1.174 -5.234 -0.232) 5.369 5.512 ( 2.859 -1.189 -0.838) 3.208 5.659 ( 3.623 -0.284 -0.832) 3.728 5.807 ( 1.625 -0.691 1.631) 2.404 5.841 ( -1.050 -10.265 1.409) 10.414 6.044 ( 1.015 -8.756 0.012) 8.815 6.259 ( 2.913 -4.395 3.656) 6.416 6.705 ( -1.370 2.598 -2.874) 4.109 6.741 ( -4.228 0.620 -1.565) 4.551 6.892 ( -1.215 -4.358 -0.954) 4.623 7.003 ( 8.968 -3.533 4.360) 10.579 7.213 ( -2.539 -1.634 -3.395) 4.544 7.384 ( 2.990 -0.000 2.373) 3.817 7.885 ( -1.676 1.401 0.154) 2.190 8.586 ( 0.452 2.493 0.779) 2.651 8.894 ( -5.718 2.661 0.462) 6.324 9.634 ( 2.271 1.322 -0.047) 2.628 ======================= Grid point 388 (187/199) ======================= q-point: (-0.25 -0.42 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.892 ( -5.245 -1.846 2.446) 6.075 1.220 ( -8.458 -6.986 3.555) 11.531 1.255 ( -3.982 -2.291 2.721) 5.340 1.364 ( -3.221 -2.963 3.819) 5.808 1.601 ( 1.924 -1.661 -3.563) 4.377 1.679 ( 2.532 -4.599 -2.199) 5.692 1.708 ( 3.183 -2.508 0.566) 4.092 1.842 ( 1.011 -3.575 -0.354) 3.732 1.875 ( -2.362 -7.242 -4.727) 8.965 2.071 ( -0.812 -4.305 -1.466) 4.620 2.155 ( 6.649 -1.987 -0.126) 6.941 2.300 ( 1.078 -2.734 3.890) 4.875 2.372 ( -1.830 0.873 -2.574) 3.277 2.513 ( 1.394 0.692 1.028) 1.866 2.581 ( -2.015 -10.705 3.695) 11.503 2.615 ( -1.955 -3.704 -3.143) 5.237 2.653 ( -0.883 0.458 -0.174) 1.010 2.772 ( 3.957 -4.162 0.831) 5.803 2.845 ( -1.806 -3.890 0.042) 4.289 3.019 ( 3.194 -6.195 2.788) 7.507 3.139 ( -5.756 -4.920 -6.688) 10.103 3.332 ( 2.115 0.789 -0.599) 2.335 3.562 ( -0.621 0.844 1.570) 1.888 3.753 ( -2.224 2.911 0.708) 3.731 5.028 ( 3.571 -4.987 -2.779) 6.734 5.519 ( 3.573 -1.023 0.070) 3.717 5.552 ( -2.523 0.068 1.841) 3.124 5.720 ( 3.006 -2.816 -0.656) 4.171 5.841 ( 2.941 -1.996 0.119) 3.556 6.077 ( -1.106 -12.695 5.497) 13.878 6.281 ( 1.574 -12.367 -1.684) 12.580 6.405 ( 1.507 -8.004 -1.338) 8.253 6.611 ( -2.789 3.574 -3.055) 5.466 6.738 ( -0.522 -2.978 -2.334) 3.820 6.969 ( -1.636 -3.708 1.631) 4.369 7.156 ( 8.385 -4.772 2.344) 9.928 7.284 ( 0.241 -7.378 -3.646) 8.233 7.418 ( 4.127 -1.242 4.041) 5.908 7.844 ( -1.348 1.491 0.327) 2.036 8.519 ( -1.061 3.942 -1.798) 4.460 8.798 ( -4.749 3.457 1.970) 6.196 9.611 ( 1.487 1.991 0.104) 2.487 ======================= Grid point 389 (188/199) ======================= q-point: (-0.17 -0.42 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.876 ( -2.145 1.215 1.026) 2.670 1.274 ( -2.739 -1.662 2.644) 4.154 1.331 ( -3.742 -6.796 5.731) 9.645 1.485 ( 0.244 -10.258 0.353) 10.267 1.652 ( 2.698 -2.000 -3.418) 4.792 1.784 ( 2.861 -4.302 -2.066) 5.564 1.806 ( 4.680 -4.471 0.228) 6.476 1.914 ( 1.559 -2.812 -0.065) 3.215 1.988 ( -2.161 -5.319 -3.492) 6.720 2.155 ( 0.728 -4.409 -0.260) 4.476 2.232 ( 4.137 -1.282 -2.098) 4.812 2.325 ( -2.046 -0.404 -2.165) 3.007 2.393 ( 1.297 -2.994 1.720) 3.688 2.494 ( 0.947 1.590 2.130) 2.822 2.591 ( -4.035 1.402 -3.247) 5.366 2.643 ( 0.875 1.232 1.254) 1.964 2.760 ( 1.155 -3.646 3.980) 5.520 2.830 ( 0.850 -3.454 0.791) 3.644 2.905 ( -1.828 -2.765 -2.726) 4.291 3.116 ( -0.200 -2.978 1.978) 3.581 3.289 ( -1.678 0.424 -0.010) 1.731 3.391 ( -4.062 -17.265 -2.793) 17.955 3.558 ( -0.098 -1.056 1.753) 2.049 3.693 ( -1.698 1.700 -0.318) 2.423 5.166 ( 3.491 -6.565 -2.210) 7.757 5.501 ( -0.556 2.439 3.409) 4.228 5.581 ( 1.884 -2.709 0.261) 3.311 5.752 ( 0.872 0.731 0.440) 1.220 5.898 ( 3.035 -1.600 -0.737) 3.509 6.285 ( -0.162 -6.228 5.554) 8.347 6.358 ( -1.464 3.126 -7.144) 7.934 6.531 ( -1.653 -3.795 -0.536) 4.174 6.715 ( 1.179 -15.452 -0.229) 15.499 6.893 ( 1.149 -10.667 -4.016) 11.456 7.027 ( -1.030 -4.119 3.544) 5.530 7.266 ( 6.910 -1.852 -0.129) 7.156 7.480 ( 4.473 -8.127 3.664) 9.974 7.490 ( 2.672 -5.035 -0.423) 5.716 7.823 ( -0.953 -0.267 -0.050) 0.991 8.423 ( -3.069 4.161 -4.533) 6.876 8.715 ( -2.809 2.529 3.449) 5.117 9.579 ( 0.766 1.809 0.094) 1.966 ======================= Grid point 390 (189/199) ======================= q-point: (-0.08 -0.42 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.828 ( 0.301 2.806 -0.003) 2.822 1.295 ( -1.255 -1.835 2.136) 3.083 1.454 ( -2.211 -6.960 3.543) 8.117 1.669 ( 1.696 -3.620 -4.770) 6.224 1.741 ( 4.414 -7.572 2.133) 9.021 1.871 ( 2.377 -2.782 -0.512) 3.695 1.914 ( 4.439 -2.899 -0.243) 5.307 1.973 ( 1.941 -2.245 0.425) 2.998 2.057 ( -1.541 -3.012 -2.973) 4.504 2.219 ( 0.273 0.332 -4.413) 4.434 2.267 ( -0.524 -4.131 0.460) 4.189 2.336 ( 1.089 -0.030 -1.529) 1.877 2.432 ( -3.356 -1.151 0.802) 3.637 2.485 ( 2.347 0.214 1.898) 3.026 2.551 ( -2.459 0.488 -2.268) 3.381 2.614 ( 2.416 1.849 2.511) 3.945 2.763 ( 0.776 2.055 0.876) 2.365 2.852 ( -0.226 1.343 -0.815) 1.587 2.958 ( 0.996 0.034 0.926) 1.361 3.156 ( -2.212 -1.183 4.016) 4.735 3.285 ( -4.114 -4.743 -1.486) 6.452 3.536 ( -1.315 -0.207 -0.848) 1.578 3.665 ( -0.648 -1.154 0.087) 1.326 3.782 ( -1.336 -16.791 -0.424) 16.850 5.314 ( 3.161 -6.046 -1.353) 6.955 5.466 ( 0.057 0.882 3.237) 3.355 5.652 ( 1.464 -3.378 0.304) 3.694 5.712 ( -0.072 3.200 -0.110) 3.203 5.944 ( 2.102 -1.651 -0.547) 2.728 6.260 ( -0.711 4.622 -6.371) 7.903 6.308 ( -2.062 1.446 4.823) 5.441 6.637 ( 0.089 -5.487 -1.889) 5.803 6.969 ( -1.144 -6.706 -0.202) 6.806 7.085 ( -0.657 -11.420 0.624) 11.456 7.192 ( 0.759 -10.311 0.680) 10.361 7.324 ( 8.212 0.035 -0.679) 8.240 7.571 ( 4.959 -2.290 5.845) 8.000 7.687 ( 1.841 -8.424 -0.377) 8.631 7.839 ( -1.731 -1.812 -1.955) 3.178 8.324 ( -3.482 3.304 -4.917) 6.871 8.668 ( -1.817 1.035 3.135) 3.769 9.552 ( 0.461 1.275 0.048) 1.356 ======================= Grid point 399 (190/199) ======================= q-point: (-0.33 -0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.814 ( -4.745 0.000 0.825) 4.816 1.065 ( -11.997 0.000 4.731) 12.896 1.242 ( -8.215 0.000 3.667) 8.996 1.323 ( -8.074 0.000 1.070) 8.144 1.457 ( -5.712 0.000 -1.897) 6.019 1.501 ( -4.828 0.000 1.785) 5.147 1.672 ( 0.693 -0.000 -2.715) 2.802 1.768 ( 2.046 -0.000 0.791) 2.193 1.804 ( 3.774 -0.000 -3.302) 5.015 1.961 ( -2.803 0.000 -0.307) 2.820 2.168 ( 6.793 -0.000 1.777) 7.022 2.195 ( 0.739 -0.000 2.563) 2.668 2.272 ( 1.999 -0.000 -3.913) 4.394 2.308 ( -2.307 0.000 6.689) 7.076 2.438 ( -0.859 0.000 -4.356) 4.440 2.498 ( 0.832 -0.000 1.226) 1.481 2.634 ( 2.205 -0.000 -0.463) 2.253 2.709 ( 0.900 -0.000 -0.172) 0.916 2.821 ( 1.074 -0.000 1.793) 2.090 2.925 ( 2.625 -0.000 -1.988) 3.293 3.105 ( -3.665 0.000 -7.858) 8.671 3.359 ( 4.901 -0.000 -1.355) 5.084 3.598 ( 1.229 -0.000 1.760) 2.147 3.828 ( -3.705 0.000 1.708) 4.080 4.940 ( 5.668 -0.000 -4.007) 6.941 5.373 ( -2.653 0.000 -0.494) 2.699 5.547 ( 4.395 -0.000 -0.432) 4.416 5.686 ( 4.644 -0.000 -1.028) 4.756 5.712 ( 0.026 -0.000 0.264) 0.266 5.818 ( 0.993 -0.000 0.405) 1.072 5.961 ( 1.315 -0.000 -0.265) 1.341 6.236 ( 2.853 -0.000 5.958) 6.606 6.720 ( 0.540 -0.000 0.860) 1.016 6.726 ( -5.076 0.000 -5.794) 7.702 6.835 ( -0.846 0.000 -0.801) 1.165 7.003 ( 1.186 -0.000 -2.756) 3.000 7.195 ( 2.528 -0.000 2.984) 3.911 7.410 ( 4.348 -0.000 5.363) 6.905 7.887 ( -2.353 0.000 0.138) 2.357 8.615 ( 0.392 -0.000 0.363) 0.535 8.880 ( -7.221 0.000 0.809) 7.266 9.666 ( 2.905 -0.000 0.155) 2.909 ======================= Grid point 400 (191/199) ======================= q-point: (-0.25 -0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.800 ( -7.454 -2.271 3.102) 8.387 1.043 ( -10.550 -4.647 5.915) 12.957 1.180 ( -7.145 -1.271 -3.232) 7.945 1.311 ( -4.662 -1.460 8.670) 9.951 1.503 ( -7.285 -7.998 -0.771) 10.846 1.566 ( -0.279 -6.587 0.166) 6.595 1.674 ( 0.820 -0.375 -4.494) 4.584 1.796 ( 0.475 -2.131 1.799) 2.829 1.803 ( 3.037 0.423 -1.866) 3.590 1.975 ( -2.390 -3.561 -2.818) 5.132 2.178 ( 5.868 0.616 0.790) 5.953 2.264 ( 1.085 -2.625 3.776) 4.725 2.356 ( -1.138 -4.906 -1.380) 5.222 2.364 ( -3.633 -5.213 3.374) 7.195 2.478 ( 3.808 -6.486 -4.904) 8.979 2.522 ( 1.527 -1.238 1.266) 2.338 2.650 ( 1.603 -0.383 -1.040) 1.949 2.713 ( 0.601 -0.667 0.041) 0.899 2.822 ( -0.467 -0.064 0.128) 0.489 2.947 ( -1.279 -1.972 -2.753) 3.620 3.091 ( 0.098 0.127 -3.949) 3.953 3.372 ( 3.426 1.148 -1.806) 4.039 3.587 ( 0.111 1.601 2.021) 2.580 3.785 ( -3.642 1.889 1.515) 4.373 4.989 ( 5.981 -1.571 -3.859) 7.289 5.445 ( -1.960 -6.631 -0.100) 6.916 5.560 ( 4.717 0.450 -0.618) 4.778 5.708 ( 4.307 -0.276 -1.491) 4.566 5.825 ( -0.288 -4.259 0.988) 4.382 5.837 ( 1.390 -6.623 3.112) 7.449 6.060 ( 1.441 -8.863 -0.153) 8.980 6.302 ( 3.615 -4.371 2.059) 6.035 6.664 ( -3.767 3.057 -4.598) 6.684 6.708 ( -2.508 0.748 -1.535) 3.034 6.873 ( -1.608 -4.104 -1.776) 4.752 7.076 ( -0.779 -8.286 -5.959) 10.236 7.226 ( 8.373 0.748 6.388) 10.558 7.442 ( 5.701 -0.024 7.515) 9.433 7.861 ( -2.321 1.071 0.345) 2.579 8.585 ( -0.600 3.027 -1.148) 3.293 8.816 ( -6.919 1.855 1.734) 7.370 9.663 ( 2.232 1.823 0.388) 2.908 ======================= Grid point 401 (192/199) ======================= q-point: (-0.17 -0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.832 ( -4.571 -3.800 3.864) 7.090 1.124 ( -7.539 -7.963 3.275) 11.444 1.215 ( -2.611 -5.451 2.295) 6.466 1.341 ( -1.660 -3.664 6.611) 7.738 1.612 ( 0.522 -4.267 -1.512) 4.557 1.714 ( -1.342 -8.187 -0.292) 8.301 1.716 ( 2.306 -3.523 -4.460) 6.134 1.830 ( 1.360 -2.900 -3.321) 4.614 1.892 ( 1.913 -4.916 0.656) 5.316 2.049 ( -1.996 -5.317 -1.921) 5.995 2.232 ( 5.136 -1.799 -0.654) 5.481 2.294 ( -2.496 -0.859 -0.111) 2.642 2.364 ( 1.036 -0.925 0.002) 1.389 2.528 ( -0.222 -1.931 2.753) 3.370 2.562 ( -0.615 -9.006 1.918) 9.229 2.586 ( -1.720 -0.817 -2.982) 3.539 2.646 ( -0.308 -0.655 -0.069) 0.727 2.813 ( 1.449 -1.159 1.129) 2.172 2.840 ( 1.770 -5.305 -0.341) 5.603 3.022 ( -4.288 -10.691 -4.155) 12.245 3.094 ( 0.718 -0.181 -0.446) 0.864 3.349 ( 0.772 2.765 -1.302) 3.152 3.556 ( -0.578 0.845 2.164) 2.394 3.722 ( -2.966 2.315 0.635) 3.815 5.078 ( 4.897 -4.294 -2.937) 7.145 5.517 ( -2.607 -1.301 1.811) 3.430 5.573 ( 4.158 0.664 0.768) 4.280 5.760 ( 3.538 -1.126 -0.945) 3.832 5.877 ( 2.801 -2.423 -0.006) 3.703 6.072 ( -0.493 -13.585 5.717) 14.747 6.299 ( 1.650 -11.302 -2.413) 11.674 6.417 ( 0.557 -5.594 -0.726) 5.669 6.575 ( -2.576 2.385 -2.740) 4.453 6.722 ( -1.790 -5.623 -5.522) 8.081 6.947 ( -1.850 -3.971 -0.008) 4.381 7.275 ( 0.581 -7.253 -2.456) 7.679 7.287 ( 10.572 -4.885 0.998) 11.689 7.490 ( 6.766 -0.754 8.620) 10.984 7.826 ( -1.562 0.999 0.609) 1.951 8.494 ( -2.430 4.799 -3.541) 6.440 8.738 ( -5.443 2.135 2.811) 6.487 9.629 ( 1.307 2.453 0.481) 2.821 ======================= Grid point 402 (193/199) ======================= q-point: (-0.08 -0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.859 ( -0.813 -0.191 1.193) 1.456 1.215 ( -5.973 -4.978 0.073) 7.776 1.322 ( -0.079 -5.417 10.174) 11.526 1.507 ( 3.093 -11.818 -0.144) 12.217 1.685 ( 3.223 -2.186 -2.162) 4.454 1.809 ( 1.138 -4.437 -2.854) 5.397 1.857 ( 3.062 -5.776 0.023) 6.537 1.920 ( 0.691 -4.602 -1.133) 4.789 1.982 ( 1.097 -3.379 -2.594) 4.399 2.153 ( -0.690 -5.623 -1.014) 5.756 2.236 ( -2.935 1.050 -3.129) 4.417 2.333 ( 3.050 -2.216 -1.940) 4.240 2.395 ( -1.245 -0.802 2.339) 2.769 2.519 ( 2.765 1.235 1.453) 3.359 2.540 ( -3.409 1.130 -4.348) 5.640 2.659 ( 1.327 0.571 2.760) 3.115 2.779 ( 1.295 -5.113 4.471) 6.915 2.836 ( -0.148 -5.234 1.350) 5.407 2.890 ( -0.083 -0.630 -2.378) 2.461 3.109 ( -1.338 -1.573 1.482) 2.542 3.264 ( -2.363 3.330 -0.499) 4.114 3.338 ( -3.994 -18.452 -3.072) 19.128 3.560 ( 0.239 -1.691 2.060) 2.675 3.669 ( -2.024 1.124 -0.558) 2.381 5.210 ( 3.919 -6.163 -1.989) 7.569 5.490 ( -1.622 1.471 2.329) 3.197 5.611 ( 2.827 -1.843 1.596) 3.733 5.765 ( 1.064 1.820 0.100) 2.111 5.932 ( 2.410 -1.407 -0.585) 2.852 6.285 ( -0.688 -4.478 4.366) 6.292 6.340 ( -0.325 2.922 -6.238) 6.896 6.511 ( -1.510 -5.013 -0.140) 5.238 6.733 ( 1.629 -15.832 0.048) 15.916 6.882 ( -1.965 -9.234 -4.472) 10.446 7.021 ( -0.420 -5.804 1.017) 5.908 7.366 ( 8.869 -1.356 0.825) 9.010 7.504 ( 1.587 -9.784 -3.549) 10.528 7.569 ( 7.526 -2.793 8.604) 11.767 7.808 ( -1.403 -0.112 -0.083) 1.410 8.380 ( -2.938 4.538 -4.501) 7.034 8.673 ( -4.716 1.397 2.545) 5.538 9.590 ( 0.927 2.078 0.403) 2.310 ======================= Grid point 412 (194/199) ======================= q-point: (-0.25 -0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.743 ( -7.188 0.000 3.456) 7.976 0.933 ( -10.501 0.000 8.454) 13.481 1.124 ( -10.637 0.000 -3.207) 11.110 1.194 ( -11.833 0.000 -5.149) 12.905 1.422 ( -0.875 0.000 3.993) 4.088 1.445 ( -5.400 0.000 12.263) 13.400 1.676 ( 0.882 -0.000 -2.576) 2.723 1.777 ( -0.330 0.000 -0.841) 0.904 1.830 ( -0.754 0.000 3.727) 3.803 1.927 ( 0.331 -0.000 -4.931) 4.942 2.203 ( 0.321 -0.000 1.600) 1.631 2.232 ( 1.663 -0.000 1.235) 2.071 2.295 ( 2.144 -0.000 -3.075) 3.749 2.309 ( -0.155 0.000 1.445) 1.453 2.454 ( 5.613 -0.000 -4.927) 7.469 2.512 ( 1.205 -0.000 1.441) 1.878 2.664 ( 3.037 -0.000 -1.240) 3.281 2.721 ( 1.005 -0.000 -0.223) 1.029 2.800 ( -4.861 0.000 -8.106) 9.452 2.919 ( -1.819 0.000 1.278) 2.223 3.108 ( 3.493 -0.000 -0.563) 3.538 3.404 ( 3.132 -0.000 -2.673) 4.118 3.610 ( -0.023 0.000 1.521) 1.522 3.781 ( -4.017 0.000 1.957) 4.468 5.029 ( 9.833 -0.000 -5.152) 11.101 5.338 ( -2.870 0.000 -0.518) 2.917 5.603 ( 4.621 -0.000 0.644) 4.666 5.710 ( -0.256 0.000 -0.409) 0.483 5.744 ( 4.878 -0.000 -2.203) 5.353 5.834 ( 1.423 -0.000 1.176) 1.846 5.978 ( 1.406 -0.000 -0.262) 1.430 6.280 ( 3.588 -0.000 4.451) 5.717 6.671 ( -3.405 0.000 -5.587) 6.543 6.728 ( 0.682 -0.000 0.815) 1.063 6.822 ( -1.109 0.000 -0.845) 1.394 6.908 ( -13.401 0.000 -11.376) 17.579 7.314 ( 12.587 -0.000 7.621) 14.714 7.489 ( 8.739 -0.000 11.369) 14.340 7.856 ( -2.533 0.000 0.542) 2.591 8.615 ( -0.484 0.000 -0.763) 0.904 8.790 ( -7.490 0.000 1.834) 7.711 9.697 ( 1.994 -0.000 0.643) 2.095 ======================= Grid point 413 (195/199) ======================= q-point: (-0.17 -0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.709 ( -7.424 -3.369 5.871) 10.046 0.936 ( -7.570 -5.697 7.976) 12.385 1.100 ( -5.182 -3.803 -6.742) 9.315 1.245 ( -7.998 -6.798 5.467) 11.835 1.419 ( -5.452 -7.493 5.156) 10.604 1.563 ( -0.581 -7.160 3.634) 8.051 1.690 ( 2.655 -0.844 -4.889) 5.627 1.788 ( -1.955 -3.016 4.652) 5.878 1.830 ( 0.723 -0.929 0.412) 1.247 1.959 ( 1.017 -2.448 -4.981) 5.642 2.224 ( 1.156 -1.025 -0.376) 1.590 2.266 ( -1.619 -1.490 0.797) 2.341 2.326 ( -2.391 -4.720 1.690) 5.555 2.352 ( 0.658 -3.440 -1.590) 3.847 2.536 ( 4.379 -3.537 -2.937) 6.349 2.549 ( 3.611 -2.546 -0.328) 4.431 2.661 ( 0.082 2.348 -5.181) 5.689 2.720 ( 0.467 -2.614 0.041) 2.655 2.797 ( -2.323 -1.982 -5.502) 6.292 2.913 ( -2.527 -0.593 1.083) 2.813 3.122 ( 3.443 0.840 1.489) 3.844 3.404 ( 2.282 1.713 -2.474) 3.776 3.582 ( -1.349 1.890 2.146) 3.162 3.742 ( -3.525 1.604 1.613) 4.195 5.072 ( 7.933 0.292 -3.825) 8.812 5.428 ( -0.507 -6.740 -0.053) 6.759 5.618 ( 4.639 0.818 -0.571) 4.745 5.754 ( 3.333 -1.744 -1.254) 3.966 5.817 ( -0.489 -6.814 1.918) 7.096 5.865 ( 2.242 -3.002 1.937) 4.218 6.077 ( 1.503 -9.097 -0.229) 9.223 6.346 ( 3.265 -3.724 1.003) 5.053 6.622 ( -2.441 3.191 -3.483) 5.317 6.652 ( -7.065 1.300 -5.900) 9.295 6.853 ( -1.260 -3.828 -1.872) 4.443 7.015 ( -5.969 -13.223 -6.552) 15.919 7.372 ( 11.097 1.275 4.046) 11.880 7.549 ( 11.530 1.087 13.051) 17.449 7.836 ( -1.188 0.747 1.398) 1.981 8.569 ( -1.656 3.802 -1.860) 4.545 8.734 ( -6.672 1.175 2.279) 7.148 9.684 ( 1.085 2.069 0.878) 2.496 ======================= Grid point 414 (196/199) ======================= q-point: (-0.08 -0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.796 ( -1.780 -5.523 4.309) 7.228 1.048 ( -5.294 -7.734 2.955) 9.827 1.197 ( -0.850 -8.026 3.247) 8.699 1.331 ( -0.831 -6.134 6.981) 9.331 1.609 ( -1.638 -10.305 0.426) 10.443 1.672 ( -2.003 -5.956 -4.706) 7.851 1.761 ( 4.078 -4.359 -2.918) 6.645 1.855 ( 1.578 -2.666 0.082) 3.099 1.909 ( 0.896 -5.667 1.864) 6.032 2.032 ( -0.037 -5.115 -2.158) 5.551 2.236 ( -4.027 1.137 -2.156) 4.707 2.281 ( 0.550 -3.629 -1.769) 4.075 2.376 ( -0.080 -1.263 1.112) 1.685 2.511 ( -1.727 -9.700 3.761) 10.546 2.562 ( 0.618 1.744 -5.672) 5.966 2.592 ( 2.361 -0.594 2.337) 3.375 2.643 ( -0.262 -2.314 0.572) 2.398 2.809 ( -1.223 -1.601 -1.463) 2.489 2.874 ( 2.505 -3.806 -0.746) 4.617 2.955 ( -4.393 -11.291 -5.065) 13.132 3.119 ( 2.213 0.804 2.876) 3.716 3.351 ( -0.191 4.457 -1.440) 4.687 3.552 ( -0.470 0.336 2.183) 2.258 3.686 ( -2.896 1.870 0.711) 3.520 5.137 ( 4.912 -3.246 -2.113) 6.255 5.490 ( -1.889 -0.571 1.860) 2.712 5.622 ( 3.651 0.628 0.861) 3.803 5.800 ( 3.091 0.507 -1.203) 3.356 5.906 ( 1.929 -2.589 -0.266) 3.240 6.078 ( 0.770 -14.517 5.465) 15.530 6.317 ( 1.685 -9.452 -3.370) 10.175 6.415 ( -1.022 -4.022 1.690) 4.481 6.548 ( -1.387 0.922 -2.278) 2.822 6.683 ( -3.711 -8.213 -8.377) 12.304 6.928 ( -1.310 -4.164 -0.539) 4.399 7.258 ( -1.574 -12.880 -4.161) 13.627 7.424 ( 9.565 -0.519 0.357) 9.585 7.597 ( 8.804 0.390 10.339) 13.585 7.817 ( 0.947 1.169 2.245) 2.702 8.461 ( -2.106 5.254 -3.113) 6.461 8.669 ( -6.370 1.506 1.863) 6.805 9.642 ( 0.764 2.507 0.821) 2.747 ======================= Grid point 425 (197/199) ======================= q-point: (-0.17 -0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.652 ( -8.092 0.000 7.803) 11.241 0.817 ( -10.866 0.000 12.725) 16.733 1.004 ( -6.678 0.000 -9.581) 11.679 1.048 ( -10.764 0.000 -8.889) 13.960 1.400 ( -3.779 0.000 24.841) 25.127 1.430 ( 1.188 -0.000 5.919) 6.037 1.698 ( 3.041 -0.000 -3.600) 4.712 1.763 ( -1.657 0.000 -2.176) 2.735 1.795 ( -4.531 0.000 6.084) 7.586 1.961 ( 4.706 -0.000 -6.815) 8.282 2.206 ( 0.097 -0.000 0.849) 0.855 2.227 ( -2.075 0.000 -2.321) 3.113 2.284 ( -2.982 0.000 -1.852) 3.510 2.315 ( 1.508 -0.000 -2.334) 2.779 2.527 ( 3.784 -0.000 -8.715) 9.501 2.529 ( 1.290 -0.000 1.606) 2.060 2.710 ( 1.039 -0.000 1.043) 1.473 2.721 ( -0.302 0.000 -12.722) 12.726 2.732 ( 0.813 -0.000 -0.308) 0.870 2.904 ( -1.524 0.000 5.320) 5.533 3.153 ( 3.282 -0.000 2.311) 4.013 3.435 ( 2.254 -0.000 -2.786) 3.584 3.592 ( -2.995 0.000 1.547) 3.371 3.741 ( -2.632 0.000 1.862) 3.224 5.174 ( 14.801 -0.000 -5.225) 15.696 5.306 ( -2.350 0.000 -0.493) 2.401 5.658 ( 4.434 -0.000 1.468) 4.671 5.705 ( -0.399 0.000 -0.657) 0.768 5.790 ( 2.517 -0.000 -3.688) 4.465 5.853 ( 1.422 -0.000 1.416) 2.006 5.994 ( 1.140 -0.000 -0.220) 1.161 6.322 ( 2.175 -0.000 2.915) 3.637 6.613 ( -9.642 0.000 -8.758) 13.026 6.707 ( -13.326 0.000 -6.569) 14.857 6.737 ( 0.650 -0.000 0.840) 1.062 6.808 ( -1.091 0.000 -0.933) 1.436 7.436 ( 6.411 -0.000 1.942) 6.698 7.663 ( 14.256 -0.000 11.508) 18.321 7.852 ( 5.370 -0.000 5.144) 7.437 8.602 ( -1.459 0.000 -0.743) 1.637 8.707 ( -6.414 0.000 2.134) 6.760 9.711 ( 0.216 -0.000 1.219) 1.238 ======================= Grid point 426 (198/199) ======================= q-point: (-0.08 -0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.649 ( -2.701 -6.607 8.503) 11.101 0.874 ( -4.074 -6.977 9.078) 12.153 1.045 ( -2.910 -5.711 -8.367) 10.540 1.126 ( -10.850 -13.504 -1.600) 17.397 1.393 ( -0.367 -4.084 13.762) 14.360 1.566 ( 0.720 -6.958 6.947) 9.858 1.729 ( 4.152 -1.380 -4.968) 6.620 1.761 ( -3.286 -3.982 7.399) 9.022 1.820 ( -1.841 -3.332 -0.040) 3.807 1.989 ( 4.018 -0.718 -5.845) 7.129 2.211 ( -3.068 -1.695 -3.700) 5.096 2.228 ( -3.420 0.013 -1.258) 3.644 2.315 ( -0.179 -5.099 2.077) 5.508 2.361 ( 0.604 -3.213 -1.310) 3.522 2.560 ( -0.899 -3.344 -5.453) 6.459 2.576 ( 0.169 -2.814 -7.405) 7.923 2.654 ( 1.401 3.057 -2.440) 4.155 2.726 ( 0.590 -1.254 -0.456) 1.459 2.798 ( 3.116 -2.845 -2.346) 4.827 2.889 ( -2.079 0.282 3.674) 4.230 3.161 ( 2.683 1.136 2.786) 4.031 3.422 ( 0.808 2.411 -2.341) 3.456 3.560 ( -2.095 0.913 2.257) 3.212 3.707 ( -2.303 1.820 1.713) 3.399 5.160 ( 6.040 2.724 -1.910) 6.896 5.444 ( 3.508 -5.027 0.016) 6.130 5.664 ( 2.465 1.472 -0.935) 3.019 5.787 ( 2.567 -8.445 2.156) 9.086 5.820 ( 0.804 -2.543 -1.855) 3.248 5.889 ( 1.322 -2.679 1.270) 3.246 6.096 ( 1.673 -9.554 -0.041) 9.700 6.377 ( 1.461 -2.992 1.248) 3.556 6.512 ( -14.550 -2.258 -8.895) 17.203 6.601 ( -0.586 3.133 -3.921) 5.052 6.839 ( -0.902 -3.547 -1.198) 3.851 6.948 ( -3.829 -15.098 -2.658) 15.801 7.470 ( 5.579 -0.079 1.104) 5.687 7.688 ( 4.392 2.587 5.024) 7.157 7.895 ( 14.255 3.177 8.707) 17.003 8.547 ( -1.591 4.157 -1.131) 4.592 8.657 ( -6.546 1.201 1.470) 6.816 9.691 ( -0.040 1.873 1.306) 2.284 ======================= Grid point 438 (199/199) ======================= q-point: (-0.08 -0.08 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 4.65e-08 8.58e-05 8.58e-05 8.58e-05 8.58e-05 8.58e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.576 ( -4.747 0.000 11.899) 12.811 0.690 ( -10.565 0.000 13.317) 16.999 0.926 ( -7.765 0.000 -10.605) 13.144 0.960 ( -0.064 0.000 -10.888) 10.888 1.412 ( 2.165 -0.000 33.344) 33.414 1.457 ( 2.326 -0.000 5.651) 6.111 1.722 ( -2.120 0.000 3.338) 3.955 1.737 ( -2.010 0.000 -2.872) 3.505 1.755 ( 0.528 -0.000 -1.673) 1.754 2.013 ( 4.525 -0.000 -7.876) 9.083 2.182 ( -4.287 0.000 -5.039) 6.616 2.208 ( 0.080 -0.000 0.374) 0.383 2.245 ( -2.943 0.000 -5.211) 5.985 2.326 ( 0.616 -0.000 -1.758) 1.863 2.502 ( -4.325 0.000 -13.730) 14.395 2.544 ( 0.918 -0.000 1.585) 1.831 2.686 ( -0.013 0.000 -0.435) 0.436 2.739 ( 0.417 -0.000 -0.358) 0.550 2.802 ( 7.815 -0.000 -3.140) 8.422 2.881 ( -3.147 0.000 4.978) 5.889 3.191 ( 2.697 -0.000 2.705) 3.820 3.448 ( -0.053 0.000 -2.284) 2.284 3.555 ( -2.434 0.000 2.024) 3.166 3.720 ( -1.259 0.000 1.716) 2.129 5.283 ( -1.334 0.000 -0.428) 1.401 5.373 ( 17.761 -0.000 -2.866) 17.991 5.700 ( -0.355 0.000 -0.601) 0.698 5.715 ( 4.969 -0.000 0.385) 4.984 5.778 ( -5.349 0.000 -4.525) 7.006 5.869 ( 0.997 -0.000 1.265) 1.611 6.004 ( 0.640 -0.000 -0.174) 0.664 6.279 ( -15.117 0.000 -2.264) 15.286 6.417 ( -8.281 0.000 -0.667) 8.308 6.655 ( -0.057 0.000 -3.397) 3.397 6.743 ( 0.245 -0.000 1.064) 1.091 6.796 ( -0.560 0.000 -1.167) 1.295 7.495 ( 3.605 -0.000 1.543) 3.922 7.716 ( -1.845 0.000 0.625) 1.948 8.081 ( 24.314 -0.000 8.072) 25.619 8.584 ( -1.213 0.000 0.068) 1.214 8.634 ( -5.980 0.000 1.232) 6.106 9.709 ( -0.452 0.000 1.637) 1.698 =================== 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 3/30240 10.0 156.988 94.859 88.293 -0.000 40.582 -0.000 3/30240 20.0 22.756 19.142 15.927 -0.000 4.572 -0.000 3/30240 30.0 10.229 9.805 7.372 -0.000 1.870 -0.000 3/30240 40.0 6.462 6.720 4.754 -0.000 1.153 -0.000 3/30240 50.0 4.698 5.148 3.508 -0.000 0.835 -0.000 3/30240 60.0 3.675 4.167 2.773 -0.000 0.654 -0.000 3/30240 70.0 3.010 3.494 2.288 -0.000 0.538 -0.000 3/30240 80.0 2.546 3.005 1.945 -0.000 0.456 -0.000 3/30240 90.0 2.205 2.635 1.691 -0.000 0.397 -0.000 3/30240 100.0 1.945 2.346 1.496 -0.000 0.351 -0.000 3/30240 110.0 1.740 2.115 1.342 -0.000 0.315 -0.000 3/30240 120.0 1.575 1.925 1.217 -0.000 0.286 -0.000 3/30240 130.0 1.439 1.768 1.114 -0.000 0.262 -0.000 3/30240 140.0 1.326 1.634 1.027 -0.000 0.242 -0.000 3/30240 150.0 1.229 1.520 0.954 -0.000 0.225 -0.000 3/30240 160.0 1.146 1.421 0.890 -0.000 0.210 -0.000 3/30240 170.0 1.073 1.334 0.834 -0.000 0.197 -0.000 3/30240 180.0 1.010 1.257 0.785 -0.000 0.186 -0.000 3/30240 190.0 0.953 1.189 0.742 -0.000 0.176 -0.000 3/30240 200.0 0.903 1.128 0.703 -0.000 0.167 -0.000 3/30240 210.0 0.858 1.073 0.668 -0.000 0.159 -0.000 3/30240 220.0 0.817 1.023 0.637 -0.000 0.151 -0.000 3/30240 230.0 0.780 0.977 0.608 -0.000 0.144 -0.000 3/30240 240.0 0.746 0.936 0.582 -0.000 0.138 -0.000 3/30240 250.0 0.715 0.898 0.558 -0.000 0.133 -0.000 3/30240 260.0 0.687 0.863 0.536 -0.000 0.127 -0.000 3/30240 270.0 0.661 0.830 0.516 -0.000 0.123 -0.000 3/30240 280.0 0.637 0.800 0.497 -0.000 0.118 -0.000 3/30240 290.0 0.614 0.772 0.479 -0.000 0.114 -0.000 3/30240 300.0 0.593 0.746 0.463 -0.000 0.110 -0.000 3/30240 310.0 0.573 0.722 0.448 -0.000 0.107 -0.000 3/30240 320.0 0.555 0.699 0.434 -0.000 0.103 -0.000 3/30240 330.0 0.538 0.678 0.420 -0.000 0.100 -0.000 3/30240 340.0 0.522 0.658 0.408 -0.000 0.097 -0.000 3/30240 350.0 0.507 0.639 0.396 -0.000 0.094 -0.000 3/30240 360.0 0.492 0.621 0.385 -0.000 0.092 -0.000 3/30240 370.0 0.479 0.604 0.374 -0.000 0.089 -0.000 3/30240 380.0 0.466 0.588 0.364 -0.000 0.087 -0.000 3/30240 390.0 0.454 0.573 0.355 -0.000 0.085 -0.000 3/30240 400.0 0.442 0.558 0.346 -0.000 0.083 -0.000 3/30240 410.0 0.432 0.545 0.337 -0.000 0.080 -0.000 3/30240 420.0 0.421 0.532 0.329 -0.000 0.079 -0.000 3/30240 430.0 0.411 0.519 0.322 -0.000 0.077 -0.000 3/30240 440.0 0.402 0.507 0.314 -0.000 0.075 -0.000 3/30240 450.0 0.393 0.496 0.307 -0.000 0.073 -0.000 3/30240 460.0 0.384 0.485 0.300 -0.000 0.072 -0.000 3/30240 470.0 0.376 0.475 0.294 -0.000 0.070 -0.000 3/30240 480.0 0.368 0.465 0.288 -0.000 0.069 -0.000 3/30240 490.0 0.360 0.456 0.282 -0.000 0.067 -0.000 3/30240 500.0 0.353 0.446 0.276 -0.000 0.066 -0.000 3/30240 510.0 0.346 0.438 0.271 -0.000 0.065 -0.000 3/30240 520.0 0.339 0.429 0.266 -0.000 0.063 -0.000 3/30240 530.0 0.333 0.421 0.261 -0.000 0.062 -0.000 3/30240 540.0 0.327 0.413 0.256 -0.000 0.061 -0.000 3/30240 550.0 0.321 0.406 0.251 -0.000 0.060 -0.000 3/30240 560.0 0.315 0.398 0.246 -0.000 0.059 -0.000 3/30240 570.0 0.310 0.391 0.242 -0.000 0.058 -0.000 3/30240 580.0 0.304 0.385 0.238 -0.000 0.057 -0.000 3/30240 590.0 0.299 0.378 0.234 -0.000 0.056 -0.000 3/30240 600.0 0.294 0.372 0.230 -0.000 0.055 -0.000 3/30240 610.0 0.289 0.366 0.226 -0.000 0.054 -0.000 3/30240 620.0 0.284 0.360 0.223 -0.000 0.053 -0.000 3/30240 630.0 0.280 0.354 0.219 -0.000 0.052 -0.000 3/30240 640.0 0.276 0.349 0.216 -0.000 0.052 -0.000 3/30240 650.0 0.271 0.343 0.212 -0.000 0.051 -0.000 3/30240 660.0 0.267 0.338 0.209 -0.000 0.050 -0.000 3/30240 670.0 0.263 0.333 0.206 -0.000 0.049 -0.000 3/30240 680.0 0.259 0.328 0.203 -0.000 0.048 -0.000 3/30240 690.0 0.255 0.323 0.200 -0.000 0.048 -0.000 3/30240 700.0 0.252 0.319 0.197 -0.000 0.047 -0.000 3/30240 710.0 0.248 0.314 0.194 -0.000 0.046 -0.000 3/30240 720.0 0.245 0.310 0.192 -0.000 0.046 -0.000 3/30240 730.0 0.241 0.306 0.189 -0.000 0.045 -0.000 3/30240 740.0 0.238 0.301 0.186 -0.000 0.045 -0.000 3/30240 750.0 0.235 0.297 0.184 -0.000 0.044 -0.000 3/30240 760.0 0.232 0.293 0.181 -0.000 0.043 -0.000 3/30240 770.0 0.229 0.290 0.179 -0.000 0.043 -0.000 3/30240 780.0 0.226 0.286 0.177 -0.000 0.042 -0.000 3/30240 790.0 0.223 0.282 0.175 -0.000 0.042 -0.000 3/30240 800.0 0.220 0.279 0.172 -0.000 0.041 -0.000 3/30240 810.0 0.217 0.275 0.170 -0.000 0.041 -0.000 3/30240 820.0 0.215 0.272 0.168 -0.000 0.040 -0.000 3/30240 830.0 0.212 0.269 0.166 -0.000 0.040 -0.000 3/30240 840.0 0.210 0.265 0.164 -0.000 0.039 -0.000 3/30240 850.0 0.207 0.262 0.162 -0.000 0.039 -0.000 3/30240 860.0 0.205 0.259 0.160 -0.000 0.038 -0.000 3/30240 870.0 0.202 0.256 0.158 -0.000 0.038 -0.000 3/30240 880.0 0.200 0.253 0.157 -0.000 0.037 -0.000 3/30240 890.0 0.198 0.251 0.155 -0.000 0.037 -0.000 3/30240 900.0 0.196 0.248 0.153 -0.000 0.037 -0.000 3/30240 910.0 0.194 0.245 0.151 -0.000 0.036 -0.000 3/30240 920.0 0.191 0.242 0.150 -0.000 0.036 -0.000 3/30240 930.0 0.189 0.240 0.148 -0.000 0.035 -0.000 3/30240 940.0 0.187 0.237 0.147 -0.000 0.035 -0.000 3/30240 950.0 0.185 0.235 0.145 -0.000 0.035 -0.000 3/30240 960.0 0.183 0.232 0.144 -0.000 0.034 -0.000 3/30240 970.0 0.182 0.230 0.142 -0.000 0.034 -0.000 3/30240 980.0 0.180 0.228 0.141 -0.000 0.034 -0.000 3/30240 990.0 0.178 0.225 0.139 -0.000 0.033 -0.000 3/30240 1000.0 0.176 0.223 0.138 -0.000 0.033 -0.000 3/30240 Thermal conductivity related properties were written into "kappa-m12125.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 10:57:11]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|