----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 19:39:18]------------------------- 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: [3 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 24 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.422093011785647 0.000000000000000 0.000000000000000 b 0.000000000000000 5.583332350000001 0.000000000000000 c -0.883094011516970 0.000000000000000 10.006532543389003 Atomic positions (fractional): *1 F 0.21226313605816 0.32248265576195 0.66063519038110 18.998 2 F 0.78773686394184 0.82248265576195 0.83936480961890 18.998 3 F 0.78773686394184 0.67751734423805 0.33936480961890 18.998 4 F 0.21226313605816 0.17751734423805 0.16063519038110 18.998 *5 F 0.79219255078199 0.19448465088349 0.42546272240181 18.998 6 F 0.20780744921801 0.69448465088349 0.07453727759819 18.998 7 F 0.79219255078199 0.30551534911651 0.92546272240181 18.998 8 F 0.20780744921801 0.80551534911651 0.57453727759819 18.998 *9 Na 0.28239631246542 0.95527934673727 0.34871516746985 22.990 10 Na 0.71760368753458 0.45527934673727 0.15128483253015 22.990 11 Na 0.71760368753458 0.04472065326273 0.65128483253015 22.990 12 Na 0.28239631246542 0.54472065326273 0.84871516746985 22.990 *13 Pd 0.00000000000000 0.50000000000000 0.50000000000000 106.420 14 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 -------------------------------- unit cell --------------------------------- Lattice vectors: a 3.422093011785647 0.000000000000000 0.000000000000000 b 0.000000000000000 5.583332350000001 0.000000000000000 c -0.883094011516970 0.000000000000000 10.006532543389003 Atomic positions (fractional): *1 F 0.21226313605816 0.32248265576195 0.66063519038110 18.998 > 1 2 F 0.78773686394184 0.82248265576195 0.83936480961890 18.998 > 2 3 F 0.78773686394184 0.67751734423805 0.33936480961890 18.998 > 3 4 F 0.21226313605816 0.17751734423805 0.16063519038110 18.998 > 4 *5 F 0.79219255078199 0.19448465088349 0.42546272240181 18.998 > 5 6 F 0.20780744921801 0.69448465088349 0.07453727759819 18.998 > 6 7 F 0.79219255078199 0.30551534911651 0.92546272240181 18.998 > 7 8 F 0.20780744921801 0.80551534911651 0.57453727759819 18.998 > 8 *9 Na 0.28239631246542 0.95527934673727 0.34871516746985 22.990 > 9 10 Na 0.71760368753458 0.45527934673727 0.15128483253015 22.990 > 10 11 Na 0.71760368753458 0.04472065326273 0.65128483253015 22.990 > 11 12 Na 0.28239631246542 0.54472065326273 0.84871516746985 22.990 > 12 *13 Pd 0.00000000000000 0.50000000000000 0.50000000000000 106.420 > 13 14 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 > 14 -------------------------------- super cell -------------------------------- Lattice vectors: a 10.266279035356941 0.000000000000000 0.000000000000000 b 0.000000000000000 11.166664700000002 0.000000000000000 c -0.883094011516970 0.000000000000000 10.006532543389003 Atomic positions (fractional): *1 F 0.07075437868605 0.16124132788098 0.66063519038110 18.998 > 1 2 F 0.40408771201939 0.16124132788098 0.66063519038110 18.998 > 1 3 F 0.73742104535272 0.16124132788098 0.66063519038110 18.998 > 1 4 F 0.07075437868605 0.66124132788098 0.66063519038110 18.998 > 1 5 F 0.40408771201939 0.66124132788098 0.66063519038110 18.998 > 1 6 F 0.73742104535272 0.66124132788098 0.66063519038110 18.998 > 1 7 F 0.26257895464728 0.41124132788098 0.83936480961890 18.998 > 2 8 F 0.59591228798061 0.41124132788098 0.83936480961890 18.998 > 2 9 F 0.92924562131395 0.41124132788098 0.83936480961890 18.998 > 2 10 F 0.26257895464728 0.91124132788098 0.83936480961890 18.998 > 2 11 F 0.59591228798061 0.91124132788098 0.83936480961890 18.998 > 2 12 F 0.92924562131395 0.91124132788098 0.83936480961890 18.998 > 2 13 F 0.26257895464728 0.33875867211902 0.33936480961890 18.998 > 3 14 F 0.59591228798061 0.33875867211902 0.33936480961890 18.998 > 3 15 F 0.92924562131395 0.33875867211902 0.33936480961890 18.998 > 3 16 F 0.26257895464728 0.83875867211902 0.33936480961890 18.998 > 3 17 F 0.59591228798061 0.83875867211902 0.33936480961890 18.998 > 3 18 F 0.92924562131395 0.83875867211902 0.33936480961890 18.998 > 3 19 F 0.07075437868605 0.08875867211902 0.16063519038110 18.998 > 4 20 F 0.40408771201939 0.08875867211902 0.16063519038110 18.998 > 4 21 F 0.73742104535272 0.08875867211902 0.16063519038110 18.998 > 4 22 F 0.07075437868605 0.58875867211902 0.16063519038110 18.998 > 4 23 F 0.40408771201939 0.58875867211902 0.16063519038110 18.998 > 4 24 F 0.73742104535272 0.58875867211902 0.16063519038110 18.998 > 4 *25 F 0.26406418359400 0.09724232544174 0.42546272240181 18.998 > 5 26 F 0.59739751692733 0.09724232544174 0.42546272240181 18.998 > 5 27 F 0.93073085026066 0.09724232544174 0.42546272240181 18.998 > 5 28 F 0.26406418359400 0.59724232544174 0.42546272240181 18.998 > 5 29 F 0.59739751692733 0.59724232544174 0.42546272240181 18.998 > 5 30 F 0.93073085026066 0.59724232544174 0.42546272240181 18.998 > 5 31 F 0.06926914973934 0.34724232544174 0.07453727759819 18.998 > 6 32 F 0.40260248307267 0.34724232544174 0.07453727759819 18.998 > 6 33 F 0.73593581640600 0.34724232544174 0.07453727759819 18.998 > 6 34 F 0.06926914973934 0.84724232544174 0.07453727759819 18.998 > 6 35 F 0.40260248307267 0.84724232544174 0.07453727759819 18.998 > 6 36 F 0.73593581640600 0.84724232544174 0.07453727759819 18.998 > 6 37 F 0.26406418359400 0.15275767455826 0.92546272240181 18.998 > 7 38 F 0.59739751692733 0.15275767455826 0.92546272240181 18.998 > 7 39 F 0.93073085026066 0.15275767455826 0.92546272240181 18.998 > 7 40 F 0.26406418359400 0.65275767455826 0.92546272240181 18.998 > 7 41 F 0.59739751692733 0.65275767455826 0.92546272240181 18.998 > 7 42 F 0.93073085026066 0.65275767455826 0.92546272240181 18.998 > 7 43 F 0.06926914973934 0.40275767455826 0.57453727759819 18.998 > 8 44 F 0.40260248307267 0.40275767455826 0.57453727759819 18.998 > 8 45 F 0.73593581640600 0.40275767455826 0.57453727759819 18.998 > 8 46 F 0.06926914973934 0.90275767455826 0.57453727759819 18.998 > 8 47 F 0.40260248307267 0.90275767455826 0.57453727759819 18.998 > 8 48 F 0.73593581640600 0.90275767455826 0.57453727759819 18.998 > 8 *49 Na 0.09413210415514 0.47763967336863 0.34871516746985 22.990 > 9 50 Na 0.42746543748847 0.47763967336863 0.34871516746985 22.990 > 9 51 Na 0.76079877082181 0.47763967336863 0.34871516746985 22.990 > 9 52 Na 0.09413210415514 0.97763967336863 0.34871516746985 22.990 > 9 53 Na 0.42746543748847 0.97763967336863 0.34871516746985 22.990 > 9 54 Na 0.76079877082181 0.97763967336863 0.34871516746985 22.990 > 9 55 Na 0.23920122917819 0.22763967336863 0.15128483253015 22.990 > 10 56 Na 0.57253456251153 0.22763967336863 0.15128483253015 22.990 > 10 57 Na 0.90586789584486 0.22763967336863 0.15128483253015 22.990 > 10 58 Na 0.23920122917819 0.72763967336863 0.15128483253015 22.990 > 10 59 Na 0.57253456251153 0.72763967336863 0.15128483253015 22.990 > 10 60 Na 0.90586789584486 0.72763967336863 0.15128483253015 22.990 > 10 61 Na 0.23920122917819 0.02236032663137 0.65128483253015 22.990 > 11 62 Na 0.57253456251153 0.02236032663137 0.65128483253015 22.990 > 11 63 Na 0.90586789584486 0.02236032663137 0.65128483253015 22.990 > 11 64 Na 0.23920122917819 0.52236032663137 0.65128483253015 22.990 > 11 65 Na 0.57253456251153 0.52236032663137 0.65128483253015 22.990 > 11 66 Na 0.90586789584486 0.52236032663137 0.65128483253015 22.990 > 11 67 Na 0.09413210415514 0.27236032663137 0.84871516746985 22.990 > 12 68 Na 0.42746543748847 0.27236032663137 0.84871516746985 22.990 > 12 69 Na 0.76079877082181 0.27236032663137 0.84871516746985 22.990 > 12 70 Na 0.09413210415514 0.77236032663137 0.84871516746985 22.990 > 12 71 Na 0.42746543748847 0.77236032663137 0.84871516746985 22.990 > 12 72 Na 0.76079877082181 0.77236032663137 0.84871516746985 22.990 > 12 *73 Pd 0.00000000000000 0.25000000000000 0.50000000000000 106.420 > 13 74 Pd 0.33333333333333 0.25000000000000 0.50000000000000 106.420 > 13 75 Pd 0.66666666666667 0.25000000000000 0.50000000000000 106.420 > 13 76 Pd 0.00000000000000 0.75000000000000 0.50000000000000 106.420 > 13 77 Pd 0.33333333333333 0.75000000000000 0.50000000000000 106.420 > 13 78 Pd 0.66666666666667 0.75000000000000 0.50000000000000 106.420 > 13 79 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 > 14 80 Pd 0.33333333333333 0.00000000000000 0.00000000000000 106.420 > 14 81 Pd 0.66666666666667 0.00000000000000 0.00000000000000 106.420 > 14 82 Pd 0.00000000000000 0.50000000000000 0.00000000000000 106.420 > 14 83 Pd 0.33333333333333 0.50000000000000 0.00000000000000 106.420 > 14 84 Pd 0.66666666666667 0.50000000000000 0.00000000000000 106.420 > 14 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.3977982 0.0000000 0.1194129 0.0000000 2.5743331 0.0000000 0.1194143 0.0000000 2.4226235 -------------------------- Born effective charges -------------------------- 1 F -0.7069869 0.1063072 -0.2022195 0.1414915 -0.8426466 0.4202254 -0.2001596 0.3707075 -1.2010548 2 F -0.7069869 -0.1063072 -0.2022195 -0.1414915 -0.8426466 -0.4202254 -0.2001596 -0.3707075 -1.2010548 3 F -0.7069869 0.1063072 -0.2022195 0.1414915 -0.8426466 0.4202254 -0.2001596 0.3707075 -1.2010548 4 F -0.7069869 -0.1063072 -0.2022195 -0.1414915 -0.8426466 -0.4202254 -0.2001596 -0.3707075 -1.2010548 5 F -0.7559081 -0.2545165 -0.1063366 -0.2712361 -1.3716407 -0.3435547 -0.0969474 -0.3182809 -0.6872099 6 F -0.7559081 0.2545165 -0.1063366 0.2712361 -1.3716407 0.3435547 -0.0969474 0.3182809 -0.6872099 7 F -0.7559081 0.2545165 -0.1063366 0.2712361 -1.3716407 0.3435547 -0.0969474 0.3182809 -0.6872099 8 F -0.7559081 -0.2545165 -0.1063366 -0.2712361 -1.3716407 -0.3435547 -0.0969474 -0.3182809 -0.6872099 9 Na 1.0453988 -0.0079153 -0.0162598 0.0134973 1.2034685 -0.0086381 0.0012239 -0.1181877 1.1272263 10 Na 1.0453988 0.0079153 -0.0162598 -0.0134973 1.2034685 0.0086381 0.0012239 0.1181877 1.1272263 11 Na 1.0453988 -0.0079153 -0.0162598 0.0134973 1.2034685 -0.0086381 0.0012239 -0.1181877 1.1272263 12 Na 1.0453988 0.0079153 -0.0162598 -0.0134973 1.2034685 0.0086381 0.0012239 0.1181877 1.1272263 13 Pd 0.8349924 0.2423865 0.6496319 0.2181555 2.0216376 -0.1487713 0.5917661 -0.1135790 1.5220767 14 Pd 0.8349924 -0.2423865 0.6496319 -0.2181555 2.0216376 0.1487713 0.5917661 0.1135790 1.5220767 ---------------------------------------------------------------------------- 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: 5586/5586 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1380 Number of blocks in projector: 1380 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: 295 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 295 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 295 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 165 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 165 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 165 Use standard eigh solver. Tree of FC basis block matrices: - (1380, 1345), data: False |-- (165, 161), data: True |-- (165, 161), data: True |-- (165, 161), data: True |-- (295, 288), data: True |-- (295, 287), data: True |-- (295, 287), data: True ----- Solver_atoms: 1 -- 84 / 84 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 480 - Time: 1.354 Solver_block: 200 / 480 - Time: 1.368 Solver_block: 300 / 480 - Time: 1.369 Solver_block: 400 / 480 - Time: 1.369 Solver_block: 480 / 480 - Time: 1.126 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 6.619 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (yy) 0.00000000 (yy) Permutation basis: 252/252 Permutation basis: 5586/5586 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1380 Number of blocks in projector: 1380 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: 295 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 295 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 295 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 165 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 165 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 165 Use standard eigh solver. Tree of FC basis block matrices: - (1380, 1345), data: False |-- (165, 161), data: True |-- (165, 161), data: True |-- (165, 161), data: True |-- (295, 288), data: True |-- (295, 287), data: True |-- (295, 287), 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 2026-01-07 19:39:40]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 19:39:41]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [3 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.422093011785647 0.000000000000000 0.000000000000000 b 0.000000000000000 5.583332350000001 0.000000000000000 c -0.883094011516970 0.000000000000000 10.006532543389003 Atomic positions (fractional): 1 F 0.21226313605816 0.32248265576195 0.66063519038110 18.998 2 F 0.78773686394184 0.82248265576195 0.83936480961890 18.998 3 F 0.78773686394184 0.67751734423805 0.33936480961890 18.998 4 F 0.21226313605816 0.17751734423805 0.16063519038110 18.998 5 F 0.79219255078199 0.19448465088349 0.42546272240181 18.998 6 F 0.20780744921801 0.69448465088349 0.07453727759819 18.998 7 F 0.79219255078199 0.30551534911651 0.92546272240181 18.998 8 F 0.20780744921801 0.80551534911651 0.57453727759819 18.998 9 Na 0.28239631246542 0.95527934673727 0.34871516746985 22.990 10 Na 0.71760368753458 0.45527934673727 0.15128483253015 22.990 11 Na 0.71760368753458 0.04472065326273 0.65128483253015 22.990 12 Na 0.28239631246542 0.54472065326273 0.84871516746985 22.990 13 Pd 0.00000000000000 0.50000000000000 0.50000000000000 106.420 14 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.266279035356941 0.000000000000000 0.000000000000000 b 0.000000000000000 11.166664700000002 0.000000000000000 c -0.883094011516970 0.000000000000000 10.006532543389003 Atomic positions (fractional): 1 F 0.07075437868605 0.16124132788098 0.66063519038110 18.998 > 1 2 F 0.40408771201939 0.16124132788098 0.66063519038110 18.998 > 1 3 F 0.73742104535272 0.16124132788098 0.66063519038110 18.998 > 1 4 F 0.07075437868605 0.66124132788098 0.66063519038110 18.998 > 1 5 F 0.40408771201939 0.66124132788098 0.66063519038110 18.998 > 1 6 F 0.73742104535272 0.66124132788098 0.66063519038110 18.998 > 1 7 F 0.26257895464728 0.41124132788098 0.83936480961890 18.998 > 7 8 F 0.59591228798061 0.41124132788098 0.83936480961890 18.998 > 7 9 F 0.92924562131395 0.41124132788098 0.83936480961890 18.998 > 7 10 F 0.26257895464728 0.91124132788098 0.83936480961890 18.998 > 7 11 F 0.59591228798061 0.91124132788098 0.83936480961890 18.998 > 7 12 F 0.92924562131395 0.91124132788098 0.83936480961890 18.998 > 7 13 F 0.26257895464728 0.33875867211902 0.33936480961890 18.998 > 13 14 F 0.59591228798061 0.33875867211902 0.33936480961890 18.998 > 13 15 F 0.92924562131395 0.33875867211902 0.33936480961890 18.998 > 13 16 F 0.26257895464728 0.83875867211902 0.33936480961890 18.998 > 13 17 F 0.59591228798061 0.83875867211902 0.33936480961890 18.998 > 13 18 F 0.92924562131395 0.83875867211902 0.33936480961890 18.998 > 13 19 F 0.07075437868605 0.08875867211902 0.16063519038110 18.998 > 19 20 F 0.40408771201939 0.08875867211902 0.16063519038110 18.998 > 19 21 F 0.73742104535272 0.08875867211902 0.16063519038110 18.998 > 19 22 F 0.07075437868605 0.58875867211902 0.16063519038110 18.998 > 19 23 F 0.40408771201939 0.58875867211902 0.16063519038110 18.998 > 19 24 F 0.73742104535272 0.58875867211902 0.16063519038110 18.998 > 19 25 F 0.26406418359400 0.09724232544174 0.42546272240181 18.998 > 25 26 F 0.59739751692733 0.09724232544174 0.42546272240181 18.998 > 25 27 F 0.93073085026066 0.09724232544174 0.42546272240181 18.998 > 25 28 F 0.26406418359400 0.59724232544174 0.42546272240181 18.998 > 25 29 F 0.59739751692733 0.59724232544174 0.42546272240181 18.998 > 25 30 F 0.93073085026066 0.59724232544174 0.42546272240181 18.998 > 25 31 F 0.06926914973934 0.34724232544174 0.07453727759819 18.998 > 31 32 F 0.40260248307267 0.34724232544174 0.07453727759819 18.998 > 31 33 F 0.73593581640600 0.34724232544174 0.07453727759819 18.998 > 31 34 F 0.06926914973934 0.84724232544174 0.07453727759819 18.998 > 31 35 F 0.40260248307267 0.84724232544174 0.07453727759819 18.998 > 31 36 F 0.73593581640600 0.84724232544174 0.07453727759819 18.998 > 31 37 F 0.26406418359400 0.15275767455826 0.92546272240181 18.998 > 37 38 F 0.59739751692733 0.15275767455826 0.92546272240181 18.998 > 37 39 F 0.93073085026066 0.15275767455826 0.92546272240181 18.998 > 37 40 F 0.26406418359400 0.65275767455826 0.92546272240181 18.998 > 37 41 F 0.59739751692733 0.65275767455826 0.92546272240181 18.998 > 37 42 F 0.93073085026066 0.65275767455826 0.92546272240181 18.998 > 37 43 F 0.06926914973934 0.40275767455826 0.57453727759819 18.998 > 43 44 F 0.40260248307267 0.40275767455826 0.57453727759819 18.998 > 43 45 F 0.73593581640600 0.40275767455826 0.57453727759819 18.998 > 43 46 F 0.06926914973934 0.90275767455826 0.57453727759819 18.998 > 43 47 F 0.40260248307267 0.90275767455826 0.57453727759819 18.998 > 43 48 F 0.73593581640600 0.90275767455826 0.57453727759819 18.998 > 43 49 Na 0.09413210415514 0.47763967336863 0.34871516746985 22.990 > 49 50 Na 0.42746543748847 0.47763967336863 0.34871516746985 22.990 > 49 51 Na 0.76079877082181 0.47763967336863 0.34871516746985 22.990 > 49 52 Na 0.09413210415514 0.97763967336863 0.34871516746985 22.990 > 49 53 Na 0.42746543748847 0.97763967336863 0.34871516746985 22.990 > 49 54 Na 0.76079877082181 0.97763967336863 0.34871516746985 22.990 > 49 55 Na 0.23920122917819 0.22763967336863 0.15128483253015 22.990 > 55 56 Na 0.57253456251153 0.22763967336863 0.15128483253015 22.990 > 55 57 Na 0.90586789584486 0.22763967336863 0.15128483253015 22.990 > 55 58 Na 0.23920122917819 0.72763967336863 0.15128483253015 22.990 > 55 59 Na 0.57253456251153 0.72763967336863 0.15128483253015 22.990 > 55 60 Na 0.90586789584486 0.72763967336863 0.15128483253015 22.990 > 55 61 Na 0.23920122917819 0.02236032663137 0.65128483253015 22.990 > 61 62 Na 0.57253456251153 0.02236032663137 0.65128483253015 22.990 > 61 63 Na 0.90586789584486 0.02236032663137 0.65128483253015 22.990 > 61 64 Na 0.23920122917819 0.52236032663137 0.65128483253015 22.990 > 61 65 Na 0.57253456251153 0.52236032663137 0.65128483253015 22.990 > 61 66 Na 0.90586789584486 0.52236032663137 0.65128483253015 22.990 > 61 67 Na 0.09413210415514 0.27236032663137 0.84871516746985 22.990 > 67 68 Na 0.42746543748847 0.27236032663137 0.84871516746985 22.990 > 67 69 Na 0.76079877082181 0.27236032663137 0.84871516746985 22.990 > 67 70 Na 0.09413210415514 0.77236032663137 0.84871516746985 22.990 > 67 71 Na 0.42746543748847 0.77236032663137 0.84871516746985 22.990 > 67 72 Na 0.76079877082181 0.77236032663137 0.84871516746985 22.990 > 67 73 Pd 0.00000000000000 0.25000000000000 0.50000000000000 106.420 > 73 74 Pd 0.33333333333333 0.25000000000000 0.50000000000000 106.420 > 73 75 Pd 0.66666666666667 0.25000000000000 0.50000000000000 106.420 > 73 76 Pd 0.00000000000000 0.75000000000000 0.50000000000000 106.420 > 73 77 Pd 0.33333333333333 0.75000000000000 0.50000000000000 106.420 > 73 78 Pd 0.66666666666667 0.75000000000000 0.50000000000000 106.420 > 73 79 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 > 79 80 Pd 0.33333333333333 0.00000000000000 0.00000000000000 106.420 > 79 81 Pd 0.66666666666667 0.00000000000000 0.00000000000000 106.420 > 79 82 Pd 0.00000000000000 0.50000000000000 0.00000000000000 106.420 > 79 83 Pd 0.33333333333333 0.50000000000000 0.00000000000000 106.420 > 79 84 Pd 0.66666666666667 0.50000000000000 0.00000000000000 106.420 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.3977982 0.0000000 0.1194129 0.0000000 2.5743331 0.0000000 0.1194143 0.0000000 2.4226235 -------------------------- Born effective charges -------------------------- 1 F -0.7069869 0.1063072 -0.2022195 0.1414915 -0.8426466 0.4202254 -0.2001596 0.3707075 -1.2010548 2 F -0.7069869 -0.1063072 -0.2022195 -0.1414915 -0.8426466 -0.4202254 -0.2001596 -0.3707075 -1.2010548 3 F -0.7069869 0.1063072 -0.2022195 0.1414915 -0.8426466 0.4202254 -0.2001596 0.3707075 -1.2010548 4 F -0.7069869 -0.1063072 -0.2022195 -0.1414915 -0.8426466 -0.4202254 -0.2001596 -0.3707075 -1.2010548 5 F -0.7559081 -0.2545165 -0.1063366 -0.2712361 -1.3716407 -0.3435547 -0.0969474 -0.3182809 -0.6872099 6 F -0.7559081 0.2545165 -0.1063366 0.2712361 -1.3716407 0.3435547 -0.0969474 0.3182809 -0.6872099 7 F -0.7559081 0.2545165 -0.1063366 0.2712361 -1.3716407 0.3435547 -0.0969474 0.3182809 -0.6872099 8 F -0.7559081 -0.2545165 -0.1063366 -0.2712361 -1.3716407 -0.3435547 -0.0969474 -0.3182809 -0.6872099 9 Na 1.0453988 -0.0079153 -0.0162598 0.0134973 1.2034685 -0.0086381 0.0012239 -0.1181877 1.1272263 10 Na 1.0453988 0.0079153 -0.0162598 -0.0134973 1.2034685 0.0086381 0.0012239 0.1181877 1.1272263 11 Na 1.0453988 -0.0079153 -0.0162598 0.0134973 1.2034685 -0.0086381 0.0012239 -0.1181877 1.1272263 12 Na 1.0453988 0.0079153 -0.0162598 -0.0134973 1.2034685 0.0086381 0.0012239 0.1181877 1.1272263 13 Pd 0.8349924 0.2423865 0.6496319 0.2181555 2.0216376 -0.1487713 0.5917661 -0.1135790 1.5220767 14 Pd 0.8349924 -0.2423865 0.6496319 -0.2181555 2.0216376 0.1487713 0.5917661 0.1135790 1.5220767 ---------------------------------------------------------------------------- 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] [-0.0009 0.0000 0.0100] [ 0.0009 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] [-0.0009 0.0000 0.0100] [ 0.0009 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] [-0.0009 0.0000 0.0100] [ 0.0009 0.0000 -0.0100] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0009 0.0000 0.0100] [ 0.0009 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 (yyy) -0.00000000 (yyy) -0.00000000 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (yz) 0.00000000 (yz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 19:39:52]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 19:39:52]------------------------- 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): [3 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.422093011785647 0.000000000000000 0.000000000000000 b 0.000000000000000 5.583332350000001 0.000000000000000 c -0.883094011516970 0.000000000000000 10.006532543389003 Atomic positions (fractional): 1 F 0.21226313605816 0.32248265576195 0.66063519038110 18.998 2 F 0.78773686394184 0.82248265576195 0.83936480961890 18.998 3 F 0.78773686394184 0.67751734423805 0.33936480961890 18.998 4 F 0.21226313605816 0.17751734423805 0.16063519038110 18.998 5 F 0.79219255078199 0.19448465088349 0.42546272240181 18.998 6 F 0.20780744921801 0.69448465088349 0.07453727759819 18.998 7 F 0.79219255078199 0.30551534911651 0.92546272240181 18.998 8 F 0.20780744921801 0.80551534911651 0.57453727759819 18.998 9 Na 0.28239631246542 0.95527934673727 0.34871516746985 22.990 10 Na 0.71760368753458 0.45527934673727 0.15128483253015 22.990 11 Na 0.71760368753458 0.04472065326273 0.65128483253015 22.990 12 Na 0.28239631246542 0.54472065326273 0.84871516746985 22.990 13 Pd 0.00000000000000 0.50000000000000 0.50000000000000 106.420 14 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.266279035356941 0.000000000000000 0.000000000000000 b 0.000000000000000 11.166664700000002 0.000000000000000 c -0.883094011516970 0.000000000000000 10.006532543389003 Atomic positions (fractional): 1 F 0.07075437868605 0.16124132788098 0.66063519038110 18.998 > 1 2 F 0.40408771201939 0.16124132788098 0.66063519038110 18.998 > 1 3 F 0.73742104535272 0.16124132788098 0.66063519038110 18.998 > 1 4 F 0.07075437868605 0.66124132788098 0.66063519038110 18.998 > 1 5 F 0.40408771201939 0.66124132788098 0.66063519038110 18.998 > 1 6 F 0.73742104535272 0.66124132788098 0.66063519038110 18.998 > 1 7 F 0.26257895464728 0.41124132788098 0.83936480961890 18.998 > 7 8 F 0.59591228798061 0.41124132788098 0.83936480961890 18.998 > 7 9 F 0.92924562131395 0.41124132788098 0.83936480961890 18.998 > 7 10 F 0.26257895464728 0.91124132788098 0.83936480961890 18.998 > 7 11 F 0.59591228798061 0.91124132788098 0.83936480961890 18.998 > 7 12 F 0.92924562131395 0.91124132788098 0.83936480961890 18.998 > 7 13 F 0.26257895464728 0.33875867211902 0.33936480961890 18.998 > 13 14 F 0.59591228798061 0.33875867211902 0.33936480961890 18.998 > 13 15 F 0.92924562131395 0.33875867211902 0.33936480961890 18.998 > 13 16 F 0.26257895464728 0.83875867211902 0.33936480961890 18.998 > 13 17 F 0.59591228798061 0.83875867211902 0.33936480961890 18.998 > 13 18 F 0.92924562131395 0.83875867211902 0.33936480961890 18.998 > 13 19 F 0.07075437868605 0.08875867211902 0.16063519038110 18.998 > 19 20 F 0.40408771201939 0.08875867211902 0.16063519038110 18.998 > 19 21 F 0.73742104535272 0.08875867211902 0.16063519038110 18.998 > 19 22 F 0.07075437868605 0.58875867211902 0.16063519038110 18.998 > 19 23 F 0.40408771201939 0.58875867211902 0.16063519038110 18.998 > 19 24 F 0.73742104535272 0.58875867211902 0.16063519038110 18.998 > 19 25 F 0.26406418359400 0.09724232544174 0.42546272240181 18.998 > 25 26 F 0.59739751692733 0.09724232544174 0.42546272240181 18.998 > 25 27 F 0.93073085026066 0.09724232544174 0.42546272240181 18.998 > 25 28 F 0.26406418359400 0.59724232544174 0.42546272240181 18.998 > 25 29 F 0.59739751692733 0.59724232544174 0.42546272240181 18.998 > 25 30 F 0.93073085026066 0.59724232544174 0.42546272240181 18.998 > 25 31 F 0.06926914973934 0.34724232544174 0.07453727759819 18.998 > 31 32 F 0.40260248307267 0.34724232544174 0.07453727759819 18.998 > 31 33 F 0.73593581640600 0.34724232544174 0.07453727759819 18.998 > 31 34 F 0.06926914973934 0.84724232544174 0.07453727759819 18.998 > 31 35 F 0.40260248307267 0.84724232544174 0.07453727759819 18.998 > 31 36 F 0.73593581640600 0.84724232544174 0.07453727759819 18.998 > 31 37 F 0.26406418359400 0.15275767455826 0.92546272240181 18.998 > 37 38 F 0.59739751692733 0.15275767455826 0.92546272240181 18.998 > 37 39 F 0.93073085026066 0.15275767455826 0.92546272240181 18.998 > 37 40 F 0.26406418359400 0.65275767455826 0.92546272240181 18.998 > 37 41 F 0.59739751692733 0.65275767455826 0.92546272240181 18.998 > 37 42 F 0.93073085026066 0.65275767455826 0.92546272240181 18.998 > 37 43 F 0.06926914973934 0.40275767455826 0.57453727759819 18.998 > 43 44 F 0.40260248307267 0.40275767455826 0.57453727759819 18.998 > 43 45 F 0.73593581640600 0.40275767455826 0.57453727759819 18.998 > 43 46 F 0.06926914973934 0.90275767455826 0.57453727759819 18.998 > 43 47 F 0.40260248307267 0.90275767455826 0.57453727759819 18.998 > 43 48 F 0.73593581640600 0.90275767455826 0.57453727759819 18.998 > 43 49 Na 0.09413210415514 0.47763967336863 0.34871516746985 22.990 > 49 50 Na 0.42746543748847 0.47763967336863 0.34871516746985 22.990 > 49 51 Na 0.76079877082181 0.47763967336863 0.34871516746985 22.990 > 49 52 Na 0.09413210415514 0.97763967336863 0.34871516746985 22.990 > 49 53 Na 0.42746543748847 0.97763967336863 0.34871516746985 22.990 > 49 54 Na 0.76079877082181 0.97763967336863 0.34871516746985 22.990 > 49 55 Na 0.23920122917819 0.22763967336863 0.15128483253015 22.990 > 55 56 Na 0.57253456251153 0.22763967336863 0.15128483253015 22.990 > 55 57 Na 0.90586789584486 0.22763967336863 0.15128483253015 22.990 > 55 58 Na 0.23920122917819 0.72763967336863 0.15128483253015 22.990 > 55 59 Na 0.57253456251153 0.72763967336863 0.15128483253015 22.990 > 55 60 Na 0.90586789584486 0.72763967336863 0.15128483253015 22.990 > 55 61 Na 0.23920122917819 0.02236032663137 0.65128483253015 22.990 > 61 62 Na 0.57253456251153 0.02236032663137 0.65128483253015 22.990 > 61 63 Na 0.90586789584486 0.02236032663137 0.65128483253015 22.990 > 61 64 Na 0.23920122917819 0.52236032663137 0.65128483253015 22.990 > 61 65 Na 0.57253456251153 0.52236032663137 0.65128483253015 22.990 > 61 66 Na 0.90586789584486 0.52236032663137 0.65128483253015 22.990 > 61 67 Na 0.09413210415514 0.27236032663137 0.84871516746985 22.990 > 67 68 Na 0.42746543748847 0.27236032663137 0.84871516746985 22.990 > 67 69 Na 0.76079877082181 0.27236032663137 0.84871516746985 22.990 > 67 70 Na 0.09413210415514 0.77236032663137 0.84871516746985 22.990 > 67 71 Na 0.42746543748847 0.77236032663137 0.84871516746985 22.990 > 67 72 Na 0.76079877082181 0.77236032663137 0.84871516746985 22.990 > 67 73 Pd 0.00000000000000 0.25000000000000 0.50000000000000 106.420 > 73 74 Pd 0.33333333333333 0.25000000000000 0.50000000000000 106.420 > 73 75 Pd 0.66666666666667 0.25000000000000 0.50000000000000 106.420 > 73 76 Pd 0.00000000000000 0.75000000000000 0.50000000000000 106.420 > 73 77 Pd 0.33333333333333 0.75000000000000 0.50000000000000 106.420 > 73 78 Pd 0.66666666666667 0.75000000000000 0.50000000000000 106.420 > 73 79 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 > 79 80 Pd 0.33333333333333 0.00000000000000 0.00000000000000 106.420 > 79 81 Pd 0.66666666666667 0.00000000000000 0.00000000000000 106.420 > 79 82 Pd 0.00000000000000 0.50000000000000 0.00000000000000 106.420 > 79 83 Pd 0.33333333333333 0.50000000000000 0.00000000000000 106.420 > 79 84 Pd 0.66666666666667 0.50000000000000 0.00000000000000 106.420 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.3977982 0.0000000 0.1194129 0.0000000 2.5743331 0.0000000 0.1194143 0.0000000 2.4226235 -------------------------- Born effective charges -------------------------- 1 F -0.7069869 0.1063072 -0.2022195 0.1414915 -0.8426466 0.4202254 -0.2001596 0.3707075 -1.2010548 2 F -0.7069869 -0.1063072 -0.2022195 -0.1414915 -0.8426466 -0.4202254 -0.2001596 -0.3707075 -1.2010548 3 F -0.7069869 0.1063072 -0.2022195 0.1414915 -0.8426466 0.4202254 -0.2001596 0.3707075 -1.2010548 4 F -0.7069869 -0.1063072 -0.2022195 -0.1414915 -0.8426466 -0.4202254 -0.2001596 -0.3707075 -1.2010548 5 F -0.7559081 -0.2545165 -0.1063366 -0.2712361 -1.3716407 -0.3435547 -0.0969474 -0.3182809 -0.6872099 6 F -0.7559081 0.2545165 -0.1063366 0.2712361 -1.3716407 0.3435547 -0.0969474 0.3182809 -0.6872099 7 F -0.7559081 0.2545165 -0.1063366 0.2712361 -1.3716407 0.3435547 -0.0969474 0.3182809 -0.6872099 8 F -0.7559081 -0.2545165 -0.1063366 -0.2712361 -1.3716407 -0.3435547 -0.0969474 -0.3182809 -0.6872099 9 Na 1.0453988 -0.0079153 -0.0162598 0.0134973 1.2034685 -0.0086381 0.0012239 -0.1181877 1.1272263 10 Na 1.0453988 0.0079153 -0.0162598 -0.0134973 1.2034685 0.0086381 0.0012239 0.1181877 1.1272263 11 Na 1.0453988 -0.0079153 -0.0162598 0.0134973 1.2034685 -0.0086381 0.0012239 -0.1181877 1.1272263 12 Na 1.0453988 0.0079153 -0.0162598 -0.0134973 1.2034685 0.0086381 0.0012239 0.1181877 1.1272263 13 Pd 0.8349924 0.2423865 0.6496319 0.2181555 2.0216376 -0.1487713 0.5917661 -0.1135790 1.5220767 14 Pd 0.8349924 -0.2423865 0.6496319 -0.2181555 2.0216376 0.1487713 0.5917661 0.1135790 1.5220767 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (yyy) -0.00000000 (yyy) -0.00000000 (yyy) 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 ... [ 15 9 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: 0.72, Number of G-points: 305, Lambda: 0.12 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/190) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 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 1.269 ( 0.000 0.000 0.000) 0.000 1.307 ( 0.000 0.000 0.000) 0.000 2.315 ( 0.000 0.000 0.000) 0.000 2.922 ( 0.000 0.000 0.000) 0.000 2.940 ( 0.000 0.000 0.000) 0.000 3.262 ( 0.000 0.000 0.000) 0.000 4.137 ( 0.000 0.000 0.000) 0.000 4.275 ( 0.000 0.000 0.000) 0.000 4.277 ( 0.000 0.000 0.000) 0.000 4.584 ( 0.000 0.000 0.000) 0.000 4.764 ( 0.000 0.000 0.000) 0.000 4.911 ( 0.000 0.000 0.000) 0.000 5.214 ( 0.000 0.000 0.000) 0.000 5.271 ( 0.000 0.000 0.000) 0.000 5.727 ( 0.000 0.000 0.000) 0.000 6.097 ( 0.000 0.000 0.000) 0.000 6.144 ( 0.000 0.000 0.000) 0.000 6.273 ( 0.000 0.000 0.000) 0.000 6.506 ( 0.000 0.000 0.000) 0.000 6.568 ( 0.000 0.000 0.000) 0.000 6.857 ( 0.000 0.000 0.000) 0.000 6.857 ( 0.000 0.000 0.000) 0.000 6.924 ( 0.000 0.000 0.000) 0.000 7.034 ( 0.000 0.000 0.000) 0.000 7.285 ( 0.000 0.000 0.000) 0.000 7.848 ( 0.000 0.000 0.000) 0.000 7.937 ( 0.000 0.000 0.000) 0.000 8.544 ( 0.000 0.000 0.000) 0.000 8.843 ( 0.000 0.000 0.000) 0.000 9.160 ( 0.000 0.000 0.000) 0.000 9.161 ( 0.000 0.000 0.000) 0.000 13.053 ( 0.000 0.000 0.000) 0.000 13.604 ( 0.000 0.000 0.000) 0.000 15.036 ( 0.000 0.000 0.000) 0.000 15.123 ( 0.000 0.000 0.000) 0.000 15.211 ( 0.000 0.000 0.000) 0.000 15.254 ( 0.000 0.000 0.000) 0.000 15.529 ( 0.000 0.000 0.000) 0.000 16.477 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/190) ======================= q-point: ( 0.07 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.362 ( 18.056 0.000 8.864) 20.115 0.393 ( 20.043 0.000 4.496) 20.541 0.694 ( 34.508 0.000 3.966) 34.735 1.318 ( 4.433 0.000 2.446) 5.064 1.456 ( 13.943 0.000 0.777) 13.965 2.373 ( 4.584 0.000 5.003) 6.785 2.971 ( 4.428 0.000 -8.073) 9.208 3.019 ( 8.684 0.000 -0.338) 8.691 3.291 ( 3.858 0.000 -1.416) 4.109 4.141 ( 0.543 0.000 -1.104) 1.230 4.152 ( -8.843 0.000 -18.258) 20.287 4.258 ( -4.557 0.000 15.720) 16.367 4.675 ( 2.769 0.000 -11.659) 11.984 4.786 ( 1.890 0.000 0.028) 1.890 4.976 ( 6.016 0.000 1.759) 6.268 5.249 ( -1.915 0.000 4.702) 5.077 5.442 ( 1.898 0.000 24.314) 24.388 5.713 ( -0.631 0.000 -2.678) 2.752 6.075 ( -2.370 0.000 1.986) 3.092 6.151 ( 0.109 0.000 3.808) 3.810 6.231 ( -3.714 0.000 -0.718) 3.782 6.540 ( 2.739 0.000 0.817) 2.858 6.585 ( 0.596 0.000 -1.873) 1.966 6.843 ( -2.045 0.000 -3.066) 3.685 6.878 ( 2.377 0.000 -1.157) 2.644 6.942 ( 1.146 0.000 -0.036) 1.147 7.066 ( -0.215 0.000 4.445) 4.450 7.298 ( 1.054 0.000 0.313) 1.099 7.992 ( 5.025 0.000 4.323) 6.628 8.536 ( -0.747 0.000 -0.113) 0.755 8.826 ( -1.738 0.000 -0.037) 1.738 9.004 ( 2.686 0.000 -43.950) 44.032 9.162 ( 0.111 0.000 0.982) 0.988 9.412 ( 0.005 0.000 -23.603) 23.603 13.057 ( 0.211 0.000 1.191) 1.209 13.560 ( -4.035 0.000 -2.912) 4.975 15.053 ( 1.323 0.000 2.983) 3.263 15.188 ( -2.323 0.000 0.127) 2.326 15.218 ( -3.370 0.000 -0.585) 3.420 15.306 ( -2.740 0.000 16.673) 16.897 15.946 ( -5.869 0.000 61.330) 61.610 16.428 ( -4.463 0.000 -4.742) 6.512 ======================= Grid point 2 (3/190) ======================= q-point: ( 0.13 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.734 ( 18.484 0.000 8.918) 20.522 0.798 ( 20.757 0.000 4.186) 21.175 1.333 ( 27.991 0.000 3.572) 28.218 1.458 ( 11.767 0.000 0.159) 11.768 1.783 ( 17.784 0.000 -0.241) 17.786 2.459 ( 2.331 0.000 6.958) 7.338 3.106 ( 11.149 0.000 -11.924) 16.324 3.167 ( 5.369 0.000 -3.655) 6.495 3.454 ( 12.710 0.000 0.414) 12.717 3.895 ( -13.490 0.000 -19.384) 23.616 4.160 ( 2.003 0.000 -2.157) 2.944 4.175 ( -6.435 0.000 16.260) 17.487 4.715 ( 1.748 0.000 2.982) 3.456 4.817 ( 0.684 0.000 1.086) 1.283 5.131 ( 9.364 0.000 0.391) 9.372 5.235 ( 0.141 0.000 3.045) 3.048 5.544 ( 5.606 0.000 9.627) 11.140 5.720 ( 2.426 0.000 -4.690) 5.281 6.016 ( -3.964 0.000 3.225) 5.110 6.130 ( -4.604 0.000 6.672) 8.106 6.169 ( -0.716 0.000 -1.664) 1.812 6.578 ( -1.136 0.000 -5.005) 5.132 6.597 ( 2.734 0.000 2.400) 3.638 6.796 ( -2.181 0.000 -2.690) 3.464 6.947 ( 4.822 0.000 -2.124) 5.269 6.955 ( 0.087 0.000 0.153) 0.176 7.089 ( 2.308 0.000 2.995) 3.781 7.317 ( 0.942 0.000 -1.493) 1.766 8.126 ( 6.867 0.000 8.264) 10.745 8.515 ( -1.410 0.000 -0.154) 1.418 8.777 ( -3.312 0.000 0.558) 3.358 8.968 ( -0.326 0.000 -25.303) 25.305 9.168 ( 0.275 0.000 1.697) 1.719 9.354 ( -2.959 0.000 -8.445) 8.948 13.065 ( 0.365 0.000 2.159) 2.190 13.451 ( -6.101 0.000 -4.817) 7.773 15.078 ( -0.950 0.000 3.920) 4.033 15.125 ( -3.957 0.000 -0.174) 3.960 15.147 ( -2.176 0.000 0.022) 2.177 15.269 ( -2.943 0.000 5.551) 6.283 15.933 ( -3.470 0.000 28.960) 29.167 16.297 ( -7.507 0.000 -7.958) 10.940 ======================= Grid point 3 (4/190) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.107 ( 18.093 0.000 8.441) 19.965 1.213 ( 20.988 0.000 3.569) 21.290 1.618 ( 11.123 0.000 -0.976) 11.166 1.933 ( 26.000 0.000 3.839) 26.282 2.084 ( 11.867 0.000 -6.493) 13.527 2.504 ( 2.494 0.000 9.147) 9.481 3.241 ( 3.937 0.000 -7.081) 8.102 3.326 ( 11.746 0.000 -10.334) 15.644 3.583 ( -14.306 0.000 -19.621) 24.283 3.688 ( 8.454 0.000 2.836) 8.918 4.075 ( -6.376 0.000 16.548) 17.734 4.238 ( 7.062 0.000 -2.513) 7.496 4.748 ( 0.759 0.000 9.920) 9.949 4.804 ( -2.512 0.000 1.343) 2.848 5.264 ( 1.812 0.000 1.314) 2.238 5.331 ( 11.017 0.000 -1.629) 11.136 5.684 ( 6.509 0.000 3.857) 7.566 5.789 ( 4.742 0.000 -5.760) 7.461 5.958 ( -1.062 0.000 4.043) 4.180 6.053 ( -3.283 0.000 7.041) 7.768 6.165 ( 0.643 0.000 -1.405) 1.545 6.522 ( -3.148 0.000 -6.943) 7.623 6.659 ( 3.224 0.000 3.765) 4.957 6.750 ( -2.176 0.000 -2.247) 3.128 6.946 ( -1.016 0.000 0.483) 1.125 7.048 ( 5.791 0.000 -2.734) 6.404 7.169 ( 5.220 0.000 2.963) 6.002 7.333 ( 1.239 0.000 -2.704) 2.974 8.259 ( 4.617 0.000 9.058) 10.167 8.482 ( -1.956 0.000 -0.016) 1.956 8.700 ( -4.854 0.000 2.169) 5.316 8.900 ( -2.860 0.000 -20.560) 20.758 9.179 ( 0.525 0.000 2.079) 2.144 9.275 ( -4.001 0.000 -1.998) 4.472 13.077 ( 0.433 0.000 2.737) 2.771 13.322 ( -5.880 0.000 -5.327) 7.935 15.009 ( -4.520 0.000 0.672) 4.570 15.038 ( -4.714 0.000 -0.602) 4.752 15.160 ( 1.352 0.000 4.054) 4.273 15.213 ( -3.391 0.000 1.447) 3.687 15.911 ( -2.836 0.000 17.449) 17.678 16.123 ( -8.521 0.000 -9.175) 12.521 ======================= Grid point 4 (5/190) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.460 ( 16.423 0.000 7.252) 17.952 1.620 ( 20.009 0.000 2.519) 20.167 1.847 ( 12.469 0.000 -1.071) 12.515 2.177 ( 0.472 0.000 -13.422) 13.430 2.383 ( 19.122 0.000 3.730) 19.483 2.639 ( 8.685 0.000 12.295) 15.053 3.253 ( -14.023 0.000 -14.791) 20.382 3.304 ( 3.826 0.000 -9.981) 10.689 3.511 ( 5.930 0.000 -9.499) 11.198 3.773 ( 1.011 0.000 4.151) 4.272 4.000 ( -3.721 0.000 14.412) 14.884 4.387 ( 5.775 0.000 2.145) 6.161 4.715 ( -6.874 0.000 -0.365) 6.884 4.813 ( 5.431 0.000 10.008) 11.387 5.269 ( -2.455 0.000 0.012) 2.455 5.535 ( 9.142 0.000 -3.053) 9.639 5.742 ( -0.259 0.000 -0.913) 0.949 5.841 ( 1.683 0.000 1.426) 2.205 6.054 ( 2.154 0.000 -0.529) 2.218 6.071 ( 10.868 0.000 3.471) 11.409 6.220 ( 5.856 0.000 -0.687) 5.896 6.467 ( 0.308 0.000 -5.401) 5.410 6.699 ( -2.759 0.000 -2.084) 3.457 6.746 ( 5.417 0.000 4.222) 6.868 6.919 ( -1.903 0.000 1.107) 2.202 7.155 ( 5.462 0.000 -2.803) 6.139 7.291 ( 6.458 0.000 3.047) 7.141 7.359 ( 1.865 0.000 -3.012) 3.543 8.325 ( 0.809 0.000 6.535) 6.585 8.439 ( -2.462 0.000 0.448) 2.502 8.594 ( -6.715 0.000 4.758) 8.230 8.778 ( -6.386 0.000 -18.197) 19.285 9.195 ( 0.691 0.000 2.056) 2.169 9.202 ( -3.147 0.000 0.951) 3.288 13.091 ( 0.421 0.000 2.839) 2.870 13.212 ( -4.384 0.000 -4.656) 6.395 14.935 ( -3.060 0.000 0.916) 3.195 14.945 ( -4.629 0.000 -0.873) 4.710 15.146 ( -3.452 0.000 -0.473) 3.484 15.185 ( 0.222 0.000 3.946) 3.952 15.883 ( -2.464 0.000 11.175) 11.444 15.947 ( -7.618 0.000 -8.640) 11.519 ======================= Grid point 5 (6/190) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.760 ( 13.027 0.000 5.458) 14.124 1.981 ( 15.133 0.000 0.492) 15.141 2.098 ( 13.419 0.000 -0.543) 13.430 2.132 ( -0.473 0.000 -12.562) 12.571 2.684 ( 11.289 0.000 2.661) 11.598 2.823 ( 6.621 0.000 7.138) 9.736 2.977 ( -10.629 0.000 -7.914) 13.252 3.333 ( 0.252 0.000 -9.785) 9.788 3.556 ( 0.542 0.000 -2.801) 2.853 3.806 ( 3.112 0.000 2.737) 4.145 3.981 ( -0.724 0.000 8.632) 8.662 4.429 ( -1.804 0.000 9.622) 9.790 4.536 ( -10.829 0.000 -3.133) 11.273 4.999 ( 10.801 0.000 7.856) 13.355 5.159 ( -8.168 0.000 -1.485) 8.302 5.604 ( -1.493 0.000 -1.050) 1.825 5.725 ( -0.530 0.000 -7.553) 7.572 5.960 ( 10.062 0.000 4.410) 10.986 6.100 ( 3.144 0.000 -4.345) 5.363 6.237 ( 4.112 0.000 -0.595) 4.155 6.360 ( 7.035 0.000 -0.616) 7.062 6.615 ( 12.140 0.000 -0.399) 12.146 6.636 ( 0.280 0.000 0.854) 0.899 6.880 ( -2.082 0.000 1.411) 2.515 6.894 ( 8.969 0.000 3.145) 9.505 7.249 ( 4.722 0.000 -2.397) 5.295 7.396 ( 2.693 0.000 -3.784) 4.644 7.420 ( 5.980 0.000 2.997) 6.689 8.320 ( -1.855 0.000 2.934) 3.472 8.384 ( -3.747 0.000 1.221) 3.941 8.451 ( -9.162 0.000 7.401) 11.778 8.591 ( -9.302 0.000 -15.738) 18.282 9.158 ( -1.610 0.000 1.321) 2.082 9.211 ( 0.611 0.000 1.598) 1.710 13.103 ( 0.349 0.000 2.460) 2.485 13.137 ( -2.720 0.000 -3.368) 4.329 14.860 ( -3.830 0.000 -0.886) 3.931 14.896 ( -1.141 0.000 1.676) 2.028 15.081 ( -2.983 0.000 -1.177) 3.207 15.178 ( -1.463 0.000 2.369) 2.785 15.806 ( -5.352 0.000 -6.650) 8.537 15.855 ( -1.991 0.000 7.007) 7.284 ======================= Grid point 6 (7/190) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.976 ( 8.199 0.000 3.359) 8.860 2.036 ( -1.828 0.000 -7.982) 8.188 2.298 ( 11.759 0.000 -2.767) 12.080 2.360 ( 13.125 0.000 0.265) 13.128 2.727 ( -8.740 0.000 -6.680) 11.000 2.834 ( 3.895 0.000 -0.021) 3.895 3.005 ( 5.520 0.000 8.685) 10.291 3.279 ( -3.810 0.000 -4.220) 5.685 3.571 ( 2.245 0.000 1.580) 2.746 3.918 ( 7.917 0.000 -2.671) 8.355 3.974 ( -1.955 0.000 4.186) 4.620 4.304 ( -11.255 0.000 -5.100) 12.356 4.380 ( -4.723 0.000 12.443) 13.309 4.979 ( -8.981 0.000 -2.265) 9.262 5.213 ( 8.723 0.000 10.169) 13.398 5.545 ( -3.395 0.000 0.327) 3.410 5.698 ( -0.050 0.000 -15.188) 15.189 6.113 ( 3.152 0.000 -1.530) 3.504 6.225 ( 10.621 0.000 2.095) 10.826 6.292 ( 2.500 0.000 2.297) 3.395 6.460 ( 3.228 0.000 -0.350) 3.247 6.540 ( -4.999 0.000 -1.821) 5.320 6.847 ( -1.385 0.000 1.379) 1.954 7.013 ( 21.285 0.000 4.322) 21.719 7.065 ( 6.451 0.000 0.864) 6.509 7.327 ( 3.271 0.000 -0.927) 3.400 7.477 ( 7.775 0.000 -5.871) 9.742 7.525 ( 4.084 0.000 2.829) 4.968 8.244 ( -11.835 0.000 -3.805) 12.432 8.260 ( -11.395 0.000 6.607) 13.172 8.279 ( -2.679 0.000 2.592) 3.728 8.422 ( -4.140 0.000 -7.543) 8.604 9.140 ( -0.594 0.000 0.836) 1.025 9.223 ( 0.380 0.000 0.934) 1.008 13.093 ( -1.399 0.000 -1.962) 2.410 13.112 ( 0.231 0.000 1.667) 1.683 14.796 ( -2.506 0.000 -0.651) 2.589 14.893 ( 0.385 0.000 2.061) 2.096 15.029 ( -2.021 0.000 -1.054) 2.280 15.140 ( -2.487 0.000 0.351) 2.512 15.718 ( -2.792 0.000 -3.846) 4.753 15.832 ( -1.312 0.000 3.868) 4.085 ======================= Grid point 7 (8/190) ======================= q-point: ( 0.47 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.999 ( -0.721 0.000 -3.073) 3.157 2.088 ( 2.795 0.000 1.144) 3.020 2.467 ( 6.232 0.000 -2.981) 6.908 2.581 ( -5.569 0.000 -0.350) 5.580 2.586 ( 8.572 0.000 0.998) 8.630 2.839 ( -2.471 0.000 -1.929) 3.135 3.094 ( 2.175 0.000 3.253) 3.913 3.211 ( -1.990 0.000 -0.116) 1.994 3.673 ( 7.569 0.000 3.298) 8.257 3.877 ( -8.369 0.000 -0.896) 8.417 4.071 ( 7.007 0.000 -5.438) 8.870 4.143 ( -3.480 0.000 -2.318) 4.181 4.298 ( -5.034 0.000 9.301) 10.576 4.839 ( -4.100 0.000 -1.441) 4.346 5.346 ( 2.947 0.000 7.003) 7.597 5.496 ( -1.402 0.000 0.171) 1.412 5.680 ( 0.576 0.000 -10.098) 10.115 6.146 ( 0.838 0.000 -0.830) 1.179 6.354 ( 3.306 0.000 4.317) 5.438 6.409 ( 6.628 0.000 1.840) 6.879 6.439 ( -4.680 0.000 -3.060) 5.592 6.485 ( -0.698 0.000 -0.426) 0.818 6.830 ( -0.463 0.000 0.433) 0.634 7.127 ( 0.785 0.000 -0.387) 0.875 7.366 ( 0.938 0.000 0.005) 0.938 7.412 ( 17.081 0.000 3.074) 17.355 7.576 ( -0.100 0.000 2.745) 2.747 7.675 ( 11.217 0.000 -5.818) 12.636 7.969 ( -12.581 0.000 -5.551) 13.751 8.037 ( -11.191 0.000 6.595) 12.990 8.245 ( -1.018 0.000 0.181) 1.033 8.374 ( -0.863 0.000 -1.483) 1.715 9.134 ( -0.131 0.000 0.274) 0.304 9.229 ( 0.125 0.000 0.297) 0.322 13.073 ( -0.423 0.000 -0.637) 0.765 13.117 ( 0.081 0.000 0.590) 0.595 14.762 ( -0.870 0.000 -0.238) 0.902 14.909 ( 0.610 0.000 1.143) 1.295 15.001 ( -0.715 0.000 -0.411) 0.825 15.097 ( -1.442 0.000 -0.394) 1.495 15.680 ( -0.812 0.000 -1.196) 1.446 15.819 ( -0.460 0.000 1.237) 1.320 ======================= Grid point 15 (9/190) ======================= q-point: ( 0.00 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.402 ( 0.000 20.302 0.000) 20.302 0.477 ( 0.000 22.592 0.000) 22.592 0.986 ( 0.000 47.638 0.000) 47.638 1.368 ( 0.000 6.890 0.000) 6.890 1.504 ( 0.000 21.494 0.000) 21.494 2.442 ( 0.000 12.248 0.000) 12.248 2.797 ( 0.000 -10.817 0.000) 10.817 3.075 ( 0.000 7.151 0.000) 7.151 3.193 ( 0.000 -8.792 0.000) 8.792 3.989 ( 0.000 -14.039 0.000) 14.039 4.097 ( 0.000 -19.489 0.000) 19.489 4.211 ( 0.000 -18.632 0.000) 18.632 4.445 ( 0.000 4.904 0.000) 4.904 4.908 ( 0.000 -3.492 0.000) 3.492 4.920 ( 0.000 -2.782 0.000) 2.782 5.361 ( 0.000 17.104 0.000) 17.104 5.430 ( 0.000 12.752 0.000) 12.752 5.689 ( 0.000 -4.590 0.000) 4.590 5.939 ( 0.000 -13.275 0.000) 13.275 6.158 ( 0.000 -9.235 0.000) 9.235 6.360 ( 0.000 -14.790 0.000) 14.790 6.499 ( 0.000 -6.081 0.000) 6.081 6.756 ( 0.000 5.729 0.000) 5.729 6.895 ( 0.000 2.085 0.000) 2.085 6.998 ( 0.000 4.973 0.000) 4.973 7.177 ( 0.000 13.217 0.000) 13.217 7.243 ( 0.000 10.897 0.000) 10.897 7.357 ( 0.000 6.279 0.000) 6.279 7.811 ( 0.000 -3.748 0.000) 3.748 7.905 ( 0.000 -4.921 0.000) 4.921 8.580 ( 0.000 3.275 0.000) 3.275 8.775 ( 0.000 -6.391 0.000) 6.391 9.155 ( 0.000 -0.647 0.000) 0.647 9.620 ( 0.000 -3.439 0.000) 3.439 13.112 ( 0.000 5.515 0.000) 5.515 13.552 ( 0.000 -4.263 0.000) 4.263 15.076 ( 0.000 -3.006 0.000) 3.006 15.220 ( 0.000 0.903 0.000) 0.903 15.311 ( 0.000 3.917 0.000) 3.917 15.660 ( 0.000 12.242 0.000) 12.242 16.248 ( 0.000 -5.678 0.000) 5.678 17.138 ( 0.000 -3.985 0.000) 3.985 ======================= Grid point 16 (10/190) ======================= q-point: ( 0.07 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.558 ( 10.200 17.899 -0.308) 20.604 0.570 ( 13.005 15.476 0.988) 20.239 1.202 ( 18.749 37.234 4.350) 41.914 1.445 ( 6.374 7.941 1.120) 10.244 1.615 ( 11.732 19.522 0.475) 22.781 2.499 ( 3.533 11.161 5.904) 13.111 2.800 ( 2.533 -10.553 -8.239) 13.626 3.154 ( 6.044 3.644 -2.170) 7.384 3.228 ( 6.278 -3.792 -0.221) 7.338 3.949 ( -4.456 -15.215 -5.231) 16.695 4.102 ( 0.337 -9.275 -7.387) 11.862 4.256 ( 5.220 -24.605 -3.828) 25.442 4.375 ( -6.591 6.577 11.236) 14.592 4.885 ( -2.077 -3.701 7.532) 8.645 4.977 ( 3.594 -1.995 3.194) 5.206 5.322 ( -0.838 6.199 0.179) 6.258 5.485 ( 3.410 14.947 0.664) 15.345 5.706 ( 1.445 -1.971 0.250) 2.457 5.924 ( -1.137 -10.856 3.606) 11.495 6.103 ( -4.385 -10.113 -4.108) 11.763 6.364 ( -0.569 -8.249 2.281) 8.577 6.523 ( 2.518 -4.928 -3.237) 6.411 6.605 ( -7.411 10.699 0.285) 13.018 6.852 ( -2.375 9.097 3.878) 10.170 6.909 ( -1.209 3.499 -2.456) 4.443 7.183 ( -0.972 13.143 -2.874) 13.489 7.203 ( -0.385 13.156 3.574) 13.638 7.366 ( 0.826 5.957 1.000) 6.096 7.940 ( 4.933 -4.954 4.014) 8.062 8.324 ( 24.217 -30.579 -14.336) 41.558 8.582 ( 0.995 1.926 -3.787) 4.363 8.763 ( -1.257 -6.032 -0.346) 6.171 9.144 ( -0.997 -0.852 -0.408) 1.374 9.542 ( -5.336 0.276 -8.555) 10.086 13.110 ( -0.101 5.253 0.512) 5.279 13.554 ( -1.348 -2.742 1.692) 3.493 15.046 ( -2.461 -1.803 -1.560) 3.426 15.170 ( -4.488 -0.331 1.616) 4.782 15.288 ( -1.945 4.499 -0.490) 4.926 15.582 ( -6.426 15.585 -3.455) 17.208 16.167 ( -8.216 1.490 13.026) 15.472 16.635 ( -26.117 17.358 12.929) 33.920 ======================= Grid point 17 (11/190) ======================= q-point: ( 0.13 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.815 ( 15.624 9.685 6.354) 19.450 0.880 ( 17.091 9.179 0.541) 19.407 1.532 ( 9.864 13.583 -0.097) 16.787 1.691 ( 21.519 19.493 3.342) 29.227 1.918 ( 17.449 16.729 -0.087) 24.173 2.540 ( -0.383 6.069 5.864) 8.448 2.903 ( 8.768 -9.338 -9.369) 15.869 3.220 ( 3.135 -6.036 -2.722) 7.326 3.487 ( 16.532 5.988 -0.294) 17.585 3.779 ( -10.071 -11.605 -15.417) 21.766 4.124 ( 3.063 -3.996 -3.147) 5.937 4.250 ( -7.554 4.672 15.179) 17.587 4.386 ( 7.575 -22.123 -2.693) 23.538 4.844 ( -3.548 -3.359 10.807) 11.860 5.063 ( 4.757 -1.357 1.534) 5.179 5.350 ( 3.155 -3.648 1.202) 4.970 5.550 ( 3.076 10.534 -1.597) 11.089 5.741 ( 2.230 1.279 1.200) 2.837 5.928 ( 0.969 -4.495 3.725) 5.918 6.007 ( -4.461 -9.968 -0.748) 10.946 6.341 ( -1.162 5.829 -1.906) 6.242 6.542 ( -0.515 -1.366 1.929) 2.419 6.590 ( 3.565 -3.803 -5.005) 7.227 6.824 ( -1.259 5.566 0.945) 5.784 6.895 ( -0.035 3.814 0.726) 3.882 7.171 ( -2.648 10.554 3.448) 11.414 7.174 ( 0.333 9.509 -4.501) 10.526 7.403 ( 2.564 7.392 0.122) 7.825 8.067 ( 6.564 -5.494 7.333) 11.271 8.505 ( -0.078 -6.387 0.739) 6.430 8.661 ( 5.921 -15.910 -13.652) 21.784 8.731 ( -1.074 -6.419 -4.030) 7.655 9.120 ( -1.227 -1.852 0.249) 2.236 9.428 ( -4.895 1.560 -5.584) 7.588 13.111 ( -0.025 4.547 1.590) 4.817 13.486 ( -5.174 1.579 -1.871) 5.725 14.997 ( -2.430 -2.858 1.475) 4.031 15.080 ( -4.734 -2.247 1.032) 5.341 15.248 ( -1.879 4.469 0.969) 4.944 15.451 ( -6.150 14.147 -1.080) 15.464 16.039 ( -6.846 4.870 15.156) 17.329 16.325 ( -11.047 5.079 0.172) 12.160 ======================= Grid point 18 (12/190) ======================= q-point: ( 0.20 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.160 ( 17.696 4.921 8.776) 20.356 1.221 ( 17.721 4.014 0.841) 18.189 1.708 ( 9.443 8.103 -1.680) 12.555 2.099 ( 16.078 9.935 -1.393) 18.951 2.245 ( 16.238 18.845 -2.385) 24.990 2.551 ( 2.189 3.802 8.060) 9.177 3.052 ( 7.094 -10.938 -8.324) 15.468 3.284 ( 3.455 -7.140 -2.067) 8.197 3.502 ( -11.554 -7.313 -15.914) 20.982 3.828 ( 13.640 9.375 -1.483) 16.617 4.125 ( -5.885 1.400 12.311) 13.717 4.208 ( 4.334 -1.148 1.303) 4.669 4.533 ( 6.938 -17.232 -1.629) 18.648 4.801 ( -1.937 0.156 11.058) 11.228 5.166 ( 5.684 -2.528 0.747) 6.265 5.427 ( 3.787 -8.330 1.528) 9.277 5.583 ( 0.756 -0.370 -3.730) 3.824 5.810 ( 3.439 -2.866 4.061) 6.044 5.925 ( 0.586 5.161 -3.501) 6.264 5.994 ( 2.253 -3.817 6.379) 7.767 6.337 ( 1.781 11.505 -3.151) 12.061 6.514 ( -2.583 -1.074 -2.971) 4.081 6.649 ( 2.914 -4.733 -2.170) 5.966 6.809 ( -0.181 3.184 -0.521) 3.231 6.908 ( 0.829 3.970 2.314) 4.669 7.138 ( -0.266 2.883 2.404) 3.763 7.186 ( 1.448 7.462 -3.583) 8.403 7.455 ( 2.708 8.878 -0.277) 9.286 8.197 ( 4.914 -5.787 8.345) 11.282 8.473 ( -2.730 -2.796 1.028) 4.040 8.648 ( -3.685 -5.396 1.108) 6.628 8.732 ( 0.763 -12.758 -16.995) 21.265 9.102 ( -0.756 -3.636 1.332) 3.945 9.334 ( -4.057 1.623 -1.538) 4.632 13.114 ( 0.004 3.711 2.175) 4.301 13.370 ( -5.761 3.761 -3.654) 7.790 14.946 ( -3.276 -3.422 1.358) 4.928 14.996 ( -3.919 -2.815 0.521) 4.853 15.226 ( -0.597 3.484 2.768) 4.489 15.337 ( -5.388 10.531 -1.009) 11.872 15.943 ( -5.495 1.355 8.577) 10.276 16.134 ( -8.649 2.458 -2.223) 9.262 ======================= Grid point 19 (13/190) ======================= q-point: ( 0.27 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.506 ( 15.787 4.520 7.221) 17.939 1.577 ( 18.621 -1.857 2.129) 18.834 1.894 ( 9.639 4.129 -2.905) 10.881 2.230 ( 1.394 5.343 -10.610) 11.961 2.551 ( 13.704 13.167 0.535) 19.012 2.689 ( 8.602 4.968 11.149) 14.932 3.101 ( -3.921 -12.210 -11.043) 16.924 3.283 ( -0.380 -3.061 -12.131) 12.517 3.358 ( 0.751 -7.759 -0.666) 7.824 3.918 ( -4.678 6.329 9.200) 12.107 4.141 ( 5.424 11.843 1.538) 13.117 4.295 ( 3.612 -7.793 3.169) 9.155 4.583 ( -2.483 -10.466 0.182) 10.758 4.860 ( 6.622 4.845 8.152) 11.566 5.272 ( 3.527 -0.902 -0.408) 3.663 5.480 ( 1.889 -8.577 -0.663) 8.808 5.579 ( -0.413 -9.604 0.884) 9.654 5.849 ( 2.996 -4.621 0.384) 5.520 6.014 ( 2.093 -2.164 1.217) 3.247 6.092 ( 11.516 9.383 -1.133) 14.898 6.360 ( -2.279 8.280 -0.914) 8.637 6.496 ( 5.123 2.707 -5.081) 7.706 6.693 ( 1.641 -4.794 -1.006) 5.166 6.816 ( 1.359 5.230 -0.215) 5.408 6.927 ( 0.638 3.514 3.126) 4.746 7.176 ( 3.177 0.790 3.400) 4.719 7.222 ( 3.158 1.156 -4.858) 5.908 7.506 ( 2.493 8.719 0.067) 9.069 8.278 ( 1.873 -4.984 7.395) 9.113 8.407 ( -4.213 -4.019 0.341) 5.833 8.562 ( -5.352 -2.965 2.850) 6.749 8.671 ( -3.988 -8.797 -15.527) 18.286 9.094 ( -0.413 -4.881 1.507) 5.125 9.267 ( -2.758 1.308 0.915) 3.187 13.118 ( 0.016 2.890 2.059) 3.549 13.263 ( -4.463 4.361 -3.381) 7.097 14.883 ( -3.036 -2.832 0.521) 4.185 14.925 ( -3.549 -2.332 0.165) 4.250 15.223 ( -1.288 3.974 1.105) 4.321 15.241 ( -3.516 6.569 1.186) 7.544 15.846 ( -5.394 -2.674 0.919) 6.090 15.985 ( -6.428 2.958 0.867) 7.129 ======================= Grid point 20 (14/190) ======================= q-point: ( 0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.791 ( 12.346 2.961 4.462) 13.458 1.940 ( 17.606 -3.771 2.459) 18.173 2.029 ( 3.318 -1.669 -7.916) 8.744 2.255 ( 5.369 7.591 -4.744) 10.438 2.743 ( 5.863 4.095 -1.355) 7.278 2.831 ( -0.179 -1.461 -0.186) 1.483 2.944 ( -2.716 -1.178 0.385) 2.986 3.327 ( 1.885 -0.257 -8.595) 8.803 3.394 ( 3.890 -10.750 -0.661) 11.451 3.835 ( -4.030 3.545 11.657) 12.833 4.192 ( -0.884 11.529 -1.846) 11.709 4.350 ( 1.023 -7.000 4.138) 8.196 4.489 ( -5.590 -0.215 1.236) 5.729 5.037 ( 8.981 3.545 7.725) 12.365 5.229 ( -6.639 5.538 -3.128) 9.194 5.506 ( -0.383 -8.769 -2.483) 9.122 5.620 ( 4.550 -11.514 5.024) 13.361 5.954 ( 6.507 1.128 -4.932) 8.242 6.042 ( 3.102 -2.948 -2.569) 4.991 6.252 ( -1.645 -4.348 -2.214) 5.149 6.385 ( 10.665 9.283 0.919) 14.169 6.637 ( 5.341 2.084 -3.067) 6.502 6.714 ( 4.008 -0.751 2.042) 4.561 6.884 ( 4.785 5.780 -0.335) 7.511 6.954 ( 2.654 2.473 4.375) 5.684 7.249 ( 3.618 1.785 0.894) 4.133 7.303 ( 6.046 -3.554 -3.862) 8.006 7.551 ( 2.063 7.081 0.568) 7.398 8.296 ( -1.374 -3.370 5.703) 6.766 8.303 ( -6.660 -6.910 0.595) 9.615 8.455 ( -6.070 -0.332 3.574) 7.052 8.534 ( -6.909 -4.559 -13.334) 15.694 9.090 ( -0.210 -4.869 1.119) 5.000 9.228 ( -1.485 -0.028 1.472) 2.091 13.121 ( -0.059 2.275 1.057) 2.509 13.188 ( -2.734 4.328 -1.768) 5.416 14.833 ( -2.286 -2.059 0.069) 3.078 14.863 ( -2.474 -2.256 0.295) 3.362 15.155 ( -3.280 5.936 -1.503) 6.946 15.223 ( -1.325 3.440 3.042) 4.779 15.746 ( -4.201 -3.973 -3.192) 6.605 15.885 ( -4.338 1.536 3.200) 5.605 ======================= Grid point 21 (15/190) ======================= q-point: ( 0.40 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.996 ( 7.773 1.818 2.075) 8.248 2.016 ( -1.199 -1.639 -7.540) 7.808 2.250 ( 13.510 -3.736 -0.191) 14.018 2.419 ( 10.045 4.459 0.051) 10.991 2.681 ( -7.352 -4.533 -6.913) 11.063 2.801 ( 0.021 -1.974 -1.270) 2.347 3.025 ( 4.389 1.582 9.143) 10.264 3.298 ( -3.059 1.711 -2.973) 4.596 3.486 ( 5.239 -8.166 -3.322) 10.254 3.817 ( -0.805 -3.334 8.533) 9.196 4.122 ( -4.124 5.472 -3.160) 7.545 4.323 ( -4.023 -0.459 1.582) 4.347 4.431 ( -0.634 9.783 3.719) 10.486 5.051 ( -8.392 5.770 -2.093) 10.397 5.223 ( 6.482 1.045 9.038) 11.171 5.463 ( -2.910 -5.703 -2.677) 6.940 5.726 ( 5.639 -2.872 -1.904) 6.609 5.999 ( 0.668 -2.927 -8.225) 8.756 6.189 ( 9.460 -2.783 2.092) 10.080 6.217 ( -0.778 -8.742 -0.867) 8.819 6.529 ( 2.745 9.247 1.417) 9.750 6.623 ( -1.896 1.907 -2.351) 3.572 6.885 ( 3.889 2.722 1.945) 5.130 6.993 ( 10.060 -0.371 2.986) 10.500 7.074 ( 8.007 -0.444 1.776) 8.213 7.329 ( 4.903 0.892 -0.599) 5.019 7.443 ( 9.153 -1.395 -4.013) 10.091 7.589 ( 1.774 4.405 1.122) 4.879 8.131 ( -10.679 -7.333 -2.060) 13.117 8.231 ( -8.097 -4.083 7.491) 11.762 8.335 ( -5.172 2.925 -1.791) 6.206 8.412 ( -3.036 -1.003 -5.580) 6.431 9.090 ( 0.115 -4.272 0.670) 4.326 9.209 ( -0.827 -1.722 1.015) 2.163 13.116 ( -0.464 2.505 -0.884) 2.696 13.151 ( -0.973 3.525 0.654) 3.715 14.789 ( -1.996 -0.536 -0.441) 2.114 14.836 ( -0.647 -3.665 0.749) 3.796 15.106 ( -1.408 5.292 -0.461) 5.496 15.187 ( -2.548 4.265 0.844) 5.040 15.682 ( -1.843 -3.192 -2.728) 4.586 15.821 ( -2.854 -1.103 2.636) 4.039 ======================= Grid point 22 (16/190) ======================= q-point: ( 0.47 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.983 ( -0.671 -1.563 -3.173) 3.600 2.105 ( 2.743 1.625 1.046) 3.356 2.448 ( 6.996 -2.645 -2.941) 8.037 2.548 ( -3.707 -1.418 1.143) 4.130 2.612 ( 6.555 0.156 0.481) 6.575 2.761 ( -3.491 -5.037 -2.484) 6.613 3.113 ( 3.168 -1.622 7.163) 7.999 3.220 ( -3.608 4.445 -3.735) 6.836 3.596 ( 6.563 -7.210 -0.758) 9.779 3.752 ( -6.756 -10.043 1.743) 12.228 4.109 ( 3.102 4.467 -1.499) 5.641 4.236 ( -4.573 6.754 1.467) 8.288 4.438 ( 0.274 11.507 1.709) 11.636 4.915 ( -4.105 6.981 -1.236) 8.192 5.333 ( 3.213 -2.879 9.392) 10.336 5.400 ( -2.636 -3.769 -6.116) 7.652 5.827 ( 4.379 8.149 -2.693) 9.636 5.980 ( -1.341 -8.929 -2.791) 9.450 6.211 ( 0.045 -11.277 -0.127) 11.278 6.338 ( 4.229 -6.133 1.716) 7.645 6.531 ( -0.862 8.113 0.787) 8.196 6.605 ( -0.143 5.911 -1.287) 6.051 6.915 ( 0.524 6.624 0.959) 6.714 7.090 ( 1.073 -3.799 -0.189) 3.952 7.266 ( 5.646 -5.782 1.880) 8.297 7.471 ( 10.166 1.781 0.139) 10.322 7.577 ( 1.946 0.225 0.551) 2.035 7.669 ( 6.676 -0.294 -2.147) 7.019 7.907 ( -9.102 -4.705 -3.970) 10.989 8.032 ( -10.722 -1.080 4.818) 11.804 8.278 ( -1.235 2.624 -0.400) 2.928 8.374 ( -0.713 -0.176 -1.222) 1.426 9.094 ( 0.138 -3.693 0.223) 3.702 9.199 ( -0.319 -2.914 0.341) 2.952 13.106 ( -0.293 3.154 -0.618) 3.227 13.144 ( -0.139 2.565 0.584) 2.634 14.761 ( -0.747 -0.032 -0.199) 0.774 14.831 ( -0.074 -4.414 0.316) 4.426 15.100 ( 0.800 5.450 0.599) 5.541 15.136 ( -2.413 4.453 -0.638) 5.105 15.659 ( -0.339 -1.845 -0.973) 2.113 15.785 ( -1.085 -3.221 1.010) 3.545 ======================= Grid point 30 (17/190) ======================= q-point: ( 0.00 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.810 ( 0.000 20.652 0.000) 20.652 0.905 ( 0.000 20.811 0.000) 20.811 1.499 ( 0.000 11.255 0.000) 11.255 1.949 ( 0.000 42.852 0.000) 42.852 2.008 ( 0.000 26.362 0.000) 26.362 2.607 ( 0.000 -5.991 0.000) 5.991 2.770 ( 0.000 19.722 0.000) 19.722 2.898 ( 0.000 -18.655 0.000) 18.655 3.280 ( 0.000 10.072 0.000) 10.072 3.619 ( 0.000 -20.244 0.000) 20.244 3.621 ( 0.000 -24.817 0.000) 24.817 3.889 ( 0.000 -14.814 0.000) 14.814 4.477 ( 0.000 -3.062 0.000) 3.062 4.743 ( 0.000 -11.883 0.000) 11.883 4.954 ( 0.000 8.113 0.000) 8.113 5.507 ( 0.000 -14.106 0.000) 14.106 5.526 ( 0.000 -11.694 0.000) 11.694 5.668 ( 0.000 5.494 0.000) 5.494 5.769 ( 0.000 -1.302 0.000) 1.302 6.047 ( 0.000 -7.928 0.000) 7.928 6.047 ( 0.000 4.188 0.000) 4.188 6.362 ( 0.000 -7.021 0.000) 7.021 6.897 ( 0.000 6.180 0.000) 6.180 6.923 ( 0.000 0.669 0.000) 0.669 7.110 ( 0.000 6.583 0.000) 6.583 7.420 ( 0.000 7.246 0.000) 7.246 7.468 ( 0.000 11.059 0.000) 11.059 7.534 ( 0.000 11.153 0.000) 11.153 7.710 ( 0.000 -4.644 0.000) 4.644 7.768 ( 0.000 -8.599 0.000) 8.599 8.620 ( 0.000 -8.157 0.000) 8.157 8.651 ( 0.000 3.266 0.000) 3.266 9.139 ( 0.000 -0.723 0.000) 0.723 9.523 ( 0.000 -6.117 0.000) 6.117 13.249 ( 0.000 7.525 0.000) 7.525 13.478 ( 0.000 -2.500 0.000) 2.500 15.039 ( 0.000 -0.189 0.000) 0.189 15.246 ( 0.000 1.705 0.000) 1.705 15.377 ( 0.000 2.472 0.000) 2.472 15.959 ( 0.000 16.437 0.000) 16.437 16.076 ( 0.000 -11.453 0.000) 11.453 17.036 ( 0.000 -5.923 0.000) 5.923 ======================= Grid point 31 (18/190) ======================= q-point: ( 0.07 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.910 ( 9.272 18.694 -0.256) 20.869 0.954 ( 5.174 20.231 -0.695) 20.893 1.612 ( 9.749 10.469 1.138) 14.351 1.941 ( 2.971 32.872 -1.784) 33.054 2.158 ( 11.709 31.807 2.372) 33.977 2.592 ( -1.147 -4.722 -3.005) 5.714 2.813 ( 3.416 12.367 -1.782) 12.953 2.928 ( 3.249 -13.092 3.162) 13.855 3.374 ( 9.297 6.650 -1.130) 11.486 3.584 ( -3.289 -18.959 -4.272) 19.711 3.706 ( 8.015 -23.522 -0.417) 24.854 3.911 ( 2.786 -12.713 -1.402) 13.090 4.417 ( -5.660 -3.566 1.993) 6.980 4.760 ( 0.784 -10.731 7.474) 13.101 4.960 ( 0.651 7.473 2.838) 8.021 5.411 ( -7.685 -7.243 3.158) 11.023 5.547 ( 3.155 -10.656 -0.997) 11.158 5.707 ( -0.040 -4.944 -9.712) 10.898 5.778 ( 2.466 -1.907 5.040) 5.926 6.031 ( 1.728 8.838 -2.508) 9.348 6.106 ( 3.040 -6.606 1.271) 7.382 6.398 ( 3.386 -6.743 0.181) 7.547 6.805 ( -5.561 7.708 -1.159) 9.575 6.950 ( 0.060 1.369 -0.765) 1.569 7.062 ( -3.329 9.338 2.414) 10.203 7.392 ( -2.232 7.170 -4.282) 8.644 7.501 ( 3.774 11.712 -0.597) 12.319 7.520 ( -3.541 12.250 3.245) 13.158 7.809 ( 5.163 -7.846 3.097) 9.890 7.879 ( 13.054 -16.401 -3.825) 21.308 8.608 ( -0.724 -6.152 -4.425) 7.613 8.645 ( -1.062 0.951 3.131) 3.441 9.125 ( -1.326 -0.831 -0.782) 1.749 9.483 ( -3.425 -5.081 -2.589) 6.652 13.243 ( -0.543 7.402 0.385) 7.432 13.493 ( 0.715 -2.331 3.603) 4.350 15.021 ( -1.775 -0.037 -1.032) 2.054 15.187 ( -5.522 1.631 0.175) 5.760 15.355 ( -2.137 2.261 0.376) 3.134 15.876 ( -6.480 10.675 -9.197) 15.509 16.079 ( -1.253 -4.494 6.838) 8.278 16.821 ( -18.396 2.428 5.092) 19.241 ======================= Grid point 32 (19/190) ======================= q-point: ( 0.13 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.095 ( 9.698 16.337 2.387) 19.148 1.137 ( 12.629 16.317 -0.388) 20.637 1.785 ( 6.762 11.749 -0.500) 13.565 2.102 ( 12.858 22.474 -1.975) 25.968 2.425 ( 14.186 26.839 1.925) 30.418 2.565 ( -0.381 -1.704 -3.979) 4.345 2.863 ( 2.251 -2.086 -3.427) 4.600 3.033 ( 5.734 -2.963 5.695) 8.607 3.474 ( -5.916 -16.544 -10.315) 20.374 3.605 ( 12.920 -0.857 -1.842) 13.079 3.901 ( 11.244 -19.936 -1.071) 22.913 4.013 ( 7.606 -5.869 3.283) 10.152 4.298 ( -5.766 -2.561 3.653) 7.290 4.793 ( 1.373 -5.384 9.307) 10.839 4.998 ( 2.582 3.442 4.413) 6.164 5.290 ( -4.983 -8.408 2.839) 10.178 5.582 ( -0.014 -2.362 -7.631) 7.988 5.675 ( -0.058 -13.442 -2.167) 13.616 5.844 ( 2.578 -1.832 4.598) 5.581 6.104 ( 5.534 16.391 -1.474) 17.362 6.179 ( 4.866 -9.828 -0.290) 10.971 6.478 ( 4.473 -5.573 -1.321) 7.268 6.715 ( -3.179 10.579 -2.333) 11.290 6.915 ( -2.892 1.090 -2.853) 4.206 7.022 ( -1.569 8.781 6.278) 10.908 7.321 ( -4.419 6.127 -5.817) 9.535 7.450 ( -3.060 13.808 1.797) 14.257 7.576 ( 3.455 9.892 0.115) 10.479 7.923 ( 5.742 -8.825 5.638) 11.943 8.116 ( 10.084 -21.459 -4.214) 24.082 8.582 ( -0.832 -4.136 -6.595) 7.829 8.618 ( -2.275 -2.175 3.284) 4.549 9.089 ( -2.074 -1.184 -0.850) 2.535 9.400 ( -4.266 -3.559 -2.008) 5.908 13.231 ( -0.815 6.943 1.300) 7.110 13.493 ( -1.674 -0.292 2.336) 2.888 14.970 ( -3.122 0.058 -0.709) 3.202 15.065 ( -6.228 0.705 0.792) 6.318 15.305 ( -2.834 1.414 1.278) 3.415 15.710 ( -8.412 7.927 -8.577) 14.393 16.037 ( -4.086 -0.231 4.996) 6.458 16.482 ( -15.730 7.283 5.541) 18.198 ======================= Grid point 33 (20/190) ======================= q-point: ( 0.20 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.325 ( 13.054 11.867 5.156) 18.380 1.390 ( 13.029 11.977 0.819) 17.716 1.898 ( 5.589 10.109 -2.647) 11.851 2.311 ( 6.473 10.006 -7.917) 14.308 2.610 ( 6.497 5.750 1.945) 8.891 2.671 ( 9.735 15.175 -0.264) 18.031 2.896 ( 1.827 -5.191 -3.960) 6.779 3.140 ( 3.934 -3.302 6.969) 8.657 3.334 ( -5.200 -7.929 -13.435) 16.444 3.842 ( 11.284 -11.809 -0.940) 16.361 4.055 ( -3.302 -2.520 11.459) 12.189 4.140 ( 9.290 -17.428 -6.348) 20.744 4.341 ( 10.772 9.314 5.404) 15.231 4.862 ( 4.460 2.610 8.344) 9.815 5.066 ( 3.481 -5.029 3.635) 7.115 5.229 ( -1.519 -8.204 1.645) 8.504 5.543 ( -1.635 -5.371 -9.294) 10.858 5.695 ( 1.967 -4.773 1.826) 5.476 5.889 ( 1.305 -4.674 4.144) 6.382 6.218 ( 6.176 13.787 -0.550) 15.117 6.307 ( 8.208 -7.157 -1.404) 10.980 6.546 ( 2.191 -3.488 -2.643) 4.894 6.663 ( -2.071 12.395 -4.162) 13.238 6.855 ( -2.065 -0.065 -1.876) 2.791 7.014 ( -0.374 6.082 6.928) 9.226 7.221 ( -3.835 4.797 -4.538) 7.636 7.410 ( -1.551 13.180 0.054) 13.271 7.631 ( 2.280 8.566 0.086) 8.864 8.041 ( 4.921 -9.728 6.687) 12.789 8.235 ( 2.845 -18.274 -2.811) 18.706 8.552 ( -1.436 -3.117 -7.330) 8.093 8.572 ( -2.517 -5.152 1.563) 5.944 9.047 ( -1.998 -1.852 -0.155) 2.729 9.319 ( -3.824 -2.700 -0.129) 4.683 13.217 ( -0.914 6.173 1.730) 6.476 13.438 ( -3.849 2.753 -0.246) 4.738 14.905 ( -3.355 -0.555 0.387) 3.422 14.961 ( -4.559 -0.516 0.656) 4.634 15.262 ( -1.680 0.148 2.588) 3.089 15.534 ( -8.016 6.028 -6.860) 12.151 15.942 ( -6.059 1.154 2.000) 6.484 16.234 ( -11.009 5.990 4.155) 13.204 ======================= Grid point 34 (21/190) ======================= q-point: ( 0.27 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.606 ( 14.238 5.808 5.224) 16.240 1.642 ( 12.541 8.323 2.700) 15.292 1.993 ( 4.477 5.649 -5.045) 8.798 2.349 ( 1.244 4.742 -8.831) 10.101 2.760 ( 4.183 1.833 -1.885) 4.940 2.776 ( 2.397 1.348 -1.909) 3.347 2.916 ( 1.603 0.109 0.030) 1.607 3.205 ( 1.619 -2.590 4.908) 5.781 3.279 ( 2.100 -0.561 -8.624) 8.894 3.942 ( -7.618 -6.060 8.692) 13.051 4.034 ( 7.818 -14.470 2.548) 16.643 4.310 ( 7.397 0.347 -5.696) 9.342 4.556 ( 7.816 11.907 6.529) 15.669 4.985 ( 6.257 5.016 6.668) 10.429 5.158 ( 5.695 -12.824 5.247) 14.981 5.242 ( 2.582 -5.808 -1.591) 6.551 5.480 ( -3.591 -2.690 -6.720) 8.080 5.790 ( 7.872 -0.715 1.901) 8.130 5.917 ( 1.403 -6.823 1.001) 7.037 6.324 ( 2.145 4.234 -1.184) 4.891 6.444 ( 4.536 4.676 -3.395) 7.346 6.549 ( 1.368 -3.244 -0.101) 3.522 6.650 ( 3.044 8.566 -4.919) 10.336 6.844 ( 0.870 -0.523 -0.437) 1.105 7.031 ( 0.517 4.483 6.574) 7.974 7.187 ( 1.445 1.689 -4.502) 5.021 7.385 ( -0.865 12.334 0.222) 12.367 7.666 ( 1.227 7.179 0.228) 7.287 8.126 ( 2.387 -9.888 6.844) 12.260 8.230 ( -2.477 -13.237 -2.212) 13.647 8.493 ( -3.440 -3.537 -1.711) 5.222 8.529 ( -2.169 -5.186 -5.030) 7.543 9.015 ( -1.300 -2.792 0.495) 3.120 9.252 ( -3.213 -2.517 1.170) 4.246 13.203 ( -0.774 5.306 1.444) 5.553 13.357 ( -3.995 4.578 -1.222) 6.197 14.844 ( -2.912 -0.938 0.161) 3.064 14.888 ( -3.245 -1.007 0.507) 3.436 15.251 ( -0.123 -0.649 3.718) 3.776 15.380 ( -6.634 4.203 -5.082) 9.354 15.817 ( -6.542 1.257 -0.540) 6.684 16.054 ( -8.349 3.761 3.061) 9.655 ======================= Grid point 35 (22/190) ======================= q-point: ( 0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.855 ( 10.684 1.435 0.270) 10.784 1.900 ( 11.941 2.633 4.581) 13.058 2.043 ( 2.403 2.885 -5.554) 6.704 2.386 ( 4.147 4.124 -4.234) 7.221 2.689 ( -5.759 -9.318 -7.676) 13.376 2.814 ( 0.212 2.432 -3.039) 3.898 2.989 ( 3.621 2.983 5.893) 7.533 3.252 ( 2.913 -2.524 4.965) 6.285 3.327 ( 2.790 -0.027 -7.208) 7.729 3.807 ( -7.458 -8.000 6.702) 12.827 4.142 ( 2.341 -10.834 5.899) 12.556 4.401 ( 3.325 12.389 -5.476) 13.948 4.649 ( 1.613 11.593 3.050) 12.096 5.112 ( 4.710 0.175 7.115) 8.534 5.260 ( -0.663 -6.786 -0.549) 6.840 5.302 ( 5.061 -8.258 2.092) 9.909 5.442 ( 3.569 1.106 -1.945) 4.212 5.948 ( 2.680 -6.871 -1.366) 7.500 5.988 ( 10.337 1.874 -1.473) 10.608 6.216 ( -8.268 -0.579 -4.373) 9.371 6.567 ( 5.704 3.672 -3.932) 7.841 6.619 ( 5.890 0.110 2.171) 6.279 6.748 ( 5.953 6.217 -1.796) 8.793 6.891 ( 4.571 -3.376 1.223) 5.813 7.040 ( -0.720 4.396 5.923) 7.412 7.248 ( 4.780 -2.197 -6.271) 8.185 7.394 ( 2.374 11.593 1.583) 11.939 7.680 ( 0.183 5.744 0.509) 5.769 8.121 ( -5.373 -10.440 1.000) 11.784 8.173 ( -1.753 -8.980 3.131) 9.670 8.423 ( -3.221 -2.973 -0.589) 4.423 8.461 ( -3.759 -2.732 -5.558) 7.245 8.999 ( -0.396 -3.608 0.641) 3.686 9.197 ( -2.660 -2.952 1.479) 4.240 13.192 ( -0.446 4.634 0.682) 4.705 13.286 ( -3.038 5.048 -0.750) 5.939 14.797 ( -1.792 -1.214 -0.143) 2.169 14.832 ( -2.552 -0.715 0.182) 2.657 15.249 ( -2.581 1.814 -1.364) 3.437 15.275 ( -1.726 1.141 1.945) 2.840 15.698 ( -5.111 0.466 -1.808) 5.442 15.912 ( -6.750 1.379 2.025) 7.181 ======================= Grid point 36 (23/190) ======================= q-point: ( 0.40 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.970 ( -0.490 -2.952 -6.605) 7.251 2.041 ( 7.134 2.186 0.023) 7.461 2.192 ( 10.228 -0.766 3.464) 10.826 2.477 ( 4.474 -1.695 -2.281) 5.301 2.576 ( -3.569 -3.160 -2.672) 5.465 2.788 ( -2.186 0.926 -2.869) 3.724 3.050 ( 1.855 0.541 6.055) 6.355 3.330 ( 2.011 -0.578 9.203) 9.438 3.349 ( 2.710 -3.044 -12.825) 13.457 3.675 ( -7.038 -10.073 3.584) 12.800 4.159 ( -0.968 -2.998 6.132) 6.894 4.439 ( 1.686 14.571 -2.910) 14.954 4.659 ( -0.402 9.576 -0.076) 9.585 5.125 ( -4.130 -0.683 -2.050) 4.661 5.241 ( 1.013 -1.154 7.727) 7.878 5.375 ( 1.191 -1.247 -0.221) 1.738 5.591 ( 9.408 -4.757 1.736) 10.684 5.974 ( 0.109 -7.240 -5.887) 9.332 6.096 ( -1.559 -0.210 -2.211) 2.713 6.170 ( 6.710 2.466 -1.027) 7.222 6.610 ( 1.563 -2.332 -3.057) 4.150 6.716 ( 1.298 8.657 0.638) 8.777 6.899 ( 9.088 0.175 0.007) 9.090 7.010 ( 5.765 -4.710 2.922) 7.997 7.032 ( -0.021 2.123 4.957) 5.393 7.337 ( 6.043 -1.878 -5.590) 8.443 7.489 ( 6.224 7.030 -0.028) 9.389 7.678 ( -0.245 4.373 1.485) 4.625 7.974 ( -8.771 -8.067 -2.216) 12.121 8.117 ( -5.315 -6.902 5.088) 10.088 8.369 ( -2.984 -0.199 -0.105) 2.992 8.381 ( -2.285 -1.868 -4.384) 5.285 9.001 ( 0.351 -4.014 0.458) 4.055 9.153 ( -2.077 -3.703 1.099) 4.386 13.188 ( -0.085 4.400 -0.227) 4.407 13.237 ( -1.887 4.757 0.209) 5.122 14.772 ( -0.804 -1.576 -0.421) 1.818 14.790 ( -1.751 -0.223 0.146) 1.771 15.186 ( -2.168 2.024 -1.684) 3.411 15.271 ( -0.744 2.631 2.626) 3.791 15.626 ( -1.756 -1.113 -1.435) 2.526 15.796 ( -5.396 -0.979 1.033) 5.581 ======================= Grid point 37 (24/190) ======================= q-point: ( 0.47 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.943 ( -0.712 -2.305 -2.843) 3.729 2.142 ( 2.734 1.503 0.383) 3.144 2.345 ( 4.420 -6.815 -0.668) 8.151 2.474 ( -1.661 -6.468 -0.867) 6.734 2.619 ( 5.023 1.752 3.316) 6.269 2.721 ( -4.126 1.235 -3.310) 5.432 3.091 ( 1.178 -0.145 3.914) 4.090 3.318 ( -0.916 3.438 -2.704) 4.468 3.435 ( 4.974 -8.470 -0.774) 9.853 3.550 ( -5.912 -9.084 1.433) 10.932 4.147 ( -0.650 0.866 2.624) 2.838 4.460 ( 0.694 14.190 -0.686) 14.223 4.648 ( -0.368 7.936 -0.490) 7.960 5.046 ( -2.402 2.993 -1.489) 4.117 5.273 ( 0.535 0.499 5.665) 5.712 5.366 ( -0.777 -1.969 -2.381) 3.186 5.745 ( 4.723 -5.909 1.362) 7.686 5.954 ( -0.493 -10.459 -2.050) 10.669 6.113 ( 2.086 8.291 -2.636) 8.947 6.231 ( 0.084 -2.603 0.477) 2.647 6.644 ( 2.137 2.780 -1.491) 3.811 6.712 ( -1.072 4.971 0.645) 5.126 6.990 ( 1.020 -4.783 -1.211) 5.038 7.028 ( 0.230 3.643 2.541) 4.447 7.159 ( 5.344 -5.162 2.517) 7.844 7.472 ( 7.210 -2.018 -2.534) 7.904 7.579 ( 3.149 1.064 -2.341) 4.065 7.682 ( -2.634 1.249 3.812) 4.799 7.817 ( -3.249 -3.905 -3.149) 5.977 7.999 ( -6.111 -1.825 2.882) 6.999 8.317 ( -1.420 0.769 -0.653) 1.742 8.358 ( -0.369 -1.703 -0.850) 1.939 9.010 ( 0.391 -4.075 0.152) 4.097 9.123 ( -0.944 -4.324 0.405) 4.444 13.188 ( 0.105 4.710 -0.525) 4.741 13.212 ( -0.727 4.100 0.536) 4.198 14.762 ( -0.151 -1.799 -0.625) 1.910 14.766 ( -0.702 0.010 0.449) 0.834 15.162 ( -0.372 1.324 -0.321) 1.413 15.254 ( -0.872 5.051 0.622) 5.163 15.623 ( 1.047 -1.300 -0.379) 1.712 15.710 ( -3.212 -3.453 0.299) 4.725 ======================= Grid point 45 (25/190) ======================= q-point: ( 0.00 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.214 ( 0.000 19.642 0.000) 19.642 1.327 ( 0.000 22.279 0.000) 22.279 1.749 ( 0.000 13.328 0.000) 13.328 2.461 ( 0.000 16.880 0.000) 16.880 2.467 ( 0.000 4.743 0.000) 4.743 2.487 ( 0.000 -19.531 0.000) 19.531 2.842 ( 0.000 28.442 0.000) 28.442 3.042 ( 0.000 -23.385 0.000) 23.385 3.085 ( 0.000 -9.792 0.000) 9.792 3.251 ( 0.000 8.574 0.000) 8.574 3.637 ( 0.000 13.635 0.000) 13.635 3.658 ( 0.000 -6.992 0.000) 6.992 4.384 ( 0.000 -4.216 0.000) 4.216 4.520 ( 0.000 -8.887 0.000) 8.887 5.000 ( 0.000 -10.605 0.000) 10.605 5.153 ( 0.000 -20.266 0.000) 20.266 5.338 ( 0.000 -4.458 0.000) 4.458 5.533 ( 0.000 -7.421 0.000) 7.421 5.541 ( 0.000 -12.654 0.000) 12.654 6.149 ( 0.000 -6.777 0.000) 6.777 6.233 ( 0.000 15.726 0.000) 15.726 6.384 ( 0.000 15.326 0.000) 15.326 6.917 ( 0.000 -1.126 0.000) 1.126 6.978 ( 0.000 2.553 0.000) 2.553 7.250 ( 0.000 6.444 0.000) 6.444 7.478 ( 0.000 -7.744 0.000) 7.744 7.504 ( 0.000 -0.579 0.000) 0.579 7.571 ( 0.000 -10.180 0.000) 10.180 7.673 ( 0.000 9.038 0.000) 9.038 7.840 ( 0.000 9.359 0.000) 9.359 8.501 ( 0.000 -2.437 0.000) 2.437 8.691 ( 0.000 0.356 0.000) 0.356 9.134 ( 0.000 0.412 0.000) 0.412 9.386 ( 0.000 -7.284 0.000) 7.284 13.386 ( 0.000 5.762 0.000) 5.762 13.461 ( 0.000 0.517 0.000) 0.517 15.080 ( 0.000 4.521 0.000) 4.521 15.285 ( 0.000 2.105 0.000) 2.105 15.406 ( 0.000 0.488 0.000) 0.488 15.807 ( 0.000 -14.912 0.000) 14.912 16.278 ( 0.000 15.062 0.000) 15.062 16.908 ( 0.000 -6.963 0.000) 6.963 ======================= Grid point 46 (26/190) ======================= q-point: ( 0.07 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.282 ( 6.034 18.395 0.268) 19.361 1.378 ( 5.428 22.758 -0.971) 23.417 1.857 ( 9.607 13.650 0.840) 16.713 2.415 ( -0.474 6.409 -7.830) 10.130 2.477 ( 0.425 -3.713 -4.034) 5.499 2.551 ( 3.623 -2.236 8.049) 9.106 2.882 ( 3.752 23.639 -2.731) 24.090 3.044 ( 0.510 -18.882 0.274) 18.891 3.160 ( 6.709 -8.659 -0.377) 10.960 3.275 ( 2.496 4.397 0.957) 5.146 3.582 ( -0.683 -0.672 -2.782) 2.943 3.820 ( 11.251 6.203 2.868) 13.163 4.303 ( -5.616 -5.222 -3.529) 8.442 4.567 ( 2.957 -6.605 9.357) 11.829 5.017 ( 1.409 -10.729 1.775) 10.966 5.223 ( 3.846 -15.298 4.550) 16.417 5.279 ( -2.435 -4.187 -2.320) 5.371 5.488 ( -1.293 -11.164 -10.316) 15.255 5.606 ( 3.122 -9.210 5.214) 11.034 6.158 ( 0.587 -5.240 2.311) 5.757 6.252 ( 2.299 13.192 -1.830) 13.516 6.432 ( 4.276 14.959 0.036) 15.558 6.894 ( -1.810 1.001 0.275) 2.086 6.974 ( -0.585 2.222 -2.731) 3.569 7.222 ( -2.565 6.204 2.236) 7.076 7.467 ( -2.552 0.399 -2.281) 3.446 7.557 ( 6.418 -12.424 0.519) 13.993 7.616 ( 3.746 -8.043 -1.684) 9.031 7.688 ( 1.646 8.272 0.585) 8.455 7.828 ( -1.090 8.963 0.624) 9.051 8.495 ( -0.630 -2.829 0.351) 2.920 8.667 ( -2.416 -0.233 -0.377) 2.457 9.119 ( -1.404 0.459 -0.673) 1.623 9.363 ( -2.202 -6.630 -0.561) 7.008 13.380 ( -0.619 5.889 0.823) 5.978 13.475 ( 0.864 0.247 3.630) 3.739 15.061 ( -1.871 4.310 -1.033) 4.811 15.227 ( -5.475 2.294 -0.162) 5.938 15.378 ( -2.757 0.135 0.126) 2.763 15.762 ( -3.854 -13.468 -6.246) 15.338 16.255 ( -2.735 13.901 3.496) 14.593 16.799 ( -10.342 -3.705 1.609) 11.103 ======================= Grid point 47 (27/190) ======================= q-point: ( 0.13 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.420 ( 7.863 16.461 0.941) 18.267 1.525 ( 8.852 22.002 -0.184) 23.716 2.034 ( 6.474 13.715 -0.469) 15.173 2.420 ( 0.817 4.208 -8.128) 9.189 2.496 ( 3.671 -12.233 -5.508) 13.909 2.656 ( 6.520 6.331 6.907) 11.414 2.937 ( 1.578 3.674 -5.296) 6.636 3.075 ( 3.028 -3.764 1.857) 5.175 3.270 ( 3.047 6.985 -1.039) 7.691 3.377 ( 7.592 -13.879 -0.702) 15.835 3.637 ( 8.413 -4.558 -2.819) 9.975 3.994 ( 0.186 -4.608 9.128) 10.227 4.292 ( 10.537 7.755 -4.871) 13.960 4.663 ( 5.094 -3.628 11.981) 13.515 5.039 ( -0.948 -12.640 2.360) 12.894 5.176 ( -1.332 6.077 2.440) 6.683 5.377 ( 3.646 -15.100 -0.949) 15.563 5.467 ( 3.444 -9.411 -8.467) 13.119 5.675 ( 3.313 -9.436 2.737) 10.368 6.172 ( 0.094 -1.482 3.854) 4.130 6.314 ( 4.245 5.806 -3.476) 7.988 6.528 ( 5.119 13.835 -0.310) 14.755 6.867 ( -0.786 2.303 -0.267) 2.448 6.937 ( -2.441 4.701 -4.599) 7.015 7.173 ( -2.847 5.749 5.018) 8.145 7.392 ( -4.509 0.527 -4.355) 6.290 7.644 ( 1.382 0.241 -0.655) 1.548 7.720 ( 6.515 -9.802 -0.423) 11.777 7.753 ( 4.772 -0.928 -1.147) 4.995 7.815 ( 0.276 3.242 2.363) 4.021 8.480 ( -0.986 -3.681 0.254) 3.819 8.600 ( -4.209 -1.649 -0.662) 4.569 9.081 ( -2.256 0.568 -0.798) 2.460 9.307 ( -3.201 -5.401 -0.118) 6.279 13.365 ( -1.160 6.064 1.842) 6.443 13.493 ( -0.048 0.299 4.014) 4.026 15.005 ( -3.575 3.631 -1.457) 5.300 15.098 ( -7.088 2.267 0.180) 7.444 15.310 ( -3.905 -0.698 0.354) 3.983 15.647 ( -6.252 -10.429 -9.083) 15.177 16.182 ( -5.414 11.535 4.535) 13.525 16.564 ( -13.034 0.954 2.526) 13.311 ======================= Grid point 48 (28/190) ======================= q-point: ( 0.20 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.593 ( 9.502 14.165 2.853) 17.294 1.693 ( 8.033 18.407 0.959) 20.106 2.104 ( 1.940 10.691 -2.921) 11.251 2.401 ( -0.585 0.906 -9.303) 9.366 2.558 ( 2.026 -15.257 -3.926) 15.884 2.815 ( 6.516 7.530 4.526) 10.938 2.935 ( 0.380 -1.940 -6.268) 6.572 3.161 ( 4.664 4.657 4.603) 8.039 3.294 ( 0.324 4.821 -3.964) 6.250 3.526 ( 8.830 -15.664 0.124) 17.982 3.831 ( 1.528 -11.680 -6.553) 13.479 3.998 ( 10.512 -3.896 12.978) 17.150 4.601 ( 16.427 15.253 0.603) 22.425 4.805 ( 7.698 -2.628 11.855) 14.377 4.971 ( -5.042 -6.776 3.673) 9.210 5.240 ( 5.824 6.110 -2.832) 8.903 5.369 ( -0.206 -10.273 -6.485) 12.151 5.604 ( 8.347 -6.542 2.358) 10.864 5.741 ( 2.952 -8.947 -1.070) 9.482 6.178 ( 0.243 -1.995 3.987) 4.465 6.393 ( 4.250 -1.622 -4.880) 6.671 6.611 ( 2.705 9.631 -0.903) 10.044 6.835 ( -2.731 1.910 -2.681) 4.277 6.905 ( 0.893 10.616 -2.340) 10.907 7.130 ( -2.597 4.981 5.897) 8.144 7.293 ( -4.150 1.779 -4.638) 6.473 7.646 ( -0.609 8.431 -1.074) 8.521 7.785 ( 0.710 3.920 -1.670) 4.320 7.836 ( 4.280 -6.567 3.681) 8.659 7.890 ( 5.077 -14.982 -0.513) 15.827 8.459 ( -1.125 -4.420 -0.389) 4.577 8.509 ( -4.769 -3.067 -0.652) 5.707 9.034 ( -2.399 0.587 -0.394) 2.501 9.243 ( -3.339 -4.551 0.743) 5.693 13.342 ( -1.533 5.993 2.030) 6.511 13.479 ( -1.930 1.365 2.306) 3.303 14.925 ( -4.187 2.474 -0.804) 4.929 14.974 ( -5.468 1.563 0.400) 5.701 15.242 ( -2.822 -1.703 1.048) 3.459 15.501 ( -6.904 -7.546 -8.859) 13.531 16.063 ( -7.317 9.301 3.505) 12.342 16.325 ( -11.671 2.656 2.538) 12.235 ======================= Grid point 49 (29/190) ======================= q-point: ( 0.27 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.778 ( 7.713 10.352 4.111) 13.548 1.846 ( 8.122 12.235 1.577) 14.770 2.123 ( 0.811 7.396 -4.176) 8.532 2.380 ( 0.104 -0.934 -7.871) 7.927 2.559 ( -0.594 -11.717 -4.580) 12.594 2.874 ( 0.377 0.757 0.058) 0.848 2.957 ( 1.905 -0.037 -3.142) 3.674 3.246 ( 1.941 5.187 11.280) 12.566 3.287 ( 0.775 0.599 -9.581) 9.631 3.710 ( -0.655 -13.959 2.719) 14.236 3.765 ( 6.330 -8.458 0.080) 10.565 4.362 ( 19.922 -0.228 3.913) 20.304 4.803 ( 2.994 9.416 7.642) 12.491 4.894 ( -2.624 -3.271 8.388) 9.377 5.016 ( 9.882 -2.882 3.189) 10.776 5.294 ( 2.057 5.827 -8.931) 10.860 5.446 ( 7.676 -0.613 -3.873) 8.619 5.753 ( 1.928 -5.015 2.318) 5.851 5.807 ( 9.259 -2.050 -0.965) 9.532 6.211 ( 2.202 -7.337 1.165) 7.748 6.441 ( 0.825 -4.917 -5.079) 7.117 6.599 ( -1.995 -1.218 -1.008) 2.546 6.830 ( 3.172 11.211 -0.625) 11.668 6.924 ( 0.538 8.759 -1.855) 8.969 7.105 ( -0.526 3.488 5.368) 6.423 7.233 ( -1.278 2.581 -4.308) 5.182 7.628 ( -0.731 10.556 -0.681) 10.603 7.788 ( -0.042 4.799 -0.716) 4.853 7.912 ( 2.456 -10.188 4.431) 11.378 7.955 ( 1.655 -13.126 -1.622) 13.329 8.419 ( -4.164 -3.881 -0.629) 5.726 8.433 ( -1.416 -4.616 -1.299) 5.000 8.990 ( -1.931 0.357 0.097) 1.966 9.181 ( -3.197 -4.190 1.317) 5.433 13.315 ( -1.486 5.586 1.473) 5.965 13.431 ( -3.012 2.629 0.714) 4.061 14.849 ( -3.383 1.468 -0.485) 3.720 14.887 ( -3.510 0.872 0.436) 3.643 15.210 ( -0.717 -2.854 2.358) 3.771 15.358 ( -6.140 -5.362 -7.048) 10.776 15.918 ( -7.817 7.519 1.738) 10.984 16.119 ( -9.995 2.285 1.950) 10.437 ======================= Grid point 50 (30/190) ======================= q-point: ( 0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.885 ( 3.207 2.784 1.036) 4.372 2.007 ( 6.531 6.608 -0.660) 9.314 2.137 ( 2.099 5.372 0.724) 5.812 2.373 ( 0.090 -4.169 -5.755) 7.108 2.548 ( 0.770 -3.796 -2.547) 4.636 2.867 ( -0.505 3.170 -4.342) 5.400 2.985 ( 1.471 -4.053 1.397) 4.532 3.264 ( -0.420 1.826 3.552) 4.015 3.308 ( 1.571 -3.154 -2.631) 4.397 3.595 ( -6.457 -10.854 0.815) 12.655 3.982 ( 10.044 -1.988 3.854) 10.940 4.700 ( 11.794 10.618 -0.080) 15.869 4.786 ( -2.661 -0.584 2.278) 3.551 4.934 ( 3.730 -4.439 15.081) 16.157 5.096 ( -0.482 -6.241 -2.675) 6.807 5.383 ( 7.056 9.178 -1.936) 11.737 5.548 ( 3.191 6.519 -6.307) 9.616 5.776 ( 1.514 -9.774 -1.676) 10.031 6.039 ( 12.425 3.522 2.419) 13.139 6.190 ( -4.239 -1.997 -5.488) 7.216 6.454 ( 3.147 -7.640 -1.545) 8.406 6.636 ( 5.640 -6.671 2.761) 9.162 6.919 ( 5.021 9.782 0.038) 10.995 6.919 ( -0.178 6.796 -2.594) 7.277 7.110 ( -1.039 3.104 6.478) 7.258 7.221 ( 1.151 0.044 -6.214) 6.320 7.628 ( 0.935 10.546 0.030) 10.588 7.779 ( -0.965 4.139 0.205) 4.255 7.918 ( -2.756 -9.180 -0.197) 9.587 7.972 ( 0.498 -10.507 2.647) 10.846 8.350 ( -2.652 -3.976 -1.166) 4.920 8.396 ( -2.162 -3.990 -1.627) 4.820 8.962 ( -1.029 -0.141 0.382) 1.107 9.124 ( -2.899 -4.027 1.401) 5.156 13.292 ( -1.010 4.997 0.721) 5.148 13.373 ( -2.854 3.369 0.128) 4.417 14.793 ( -2.244 0.856 -0.776) 2.524 14.834 ( -2.204 0.721 0.296) 2.337 15.220 ( 1.073 -3.684 3.347) 5.092 15.245 ( -4.301 -3.759 -4.513) 7.280 15.775 ( -6.801 6.001 0.198) 9.072 15.941 ( -8.531 1.231 1.065) 8.685 ======================= Grid point 51 (31/190) ======================= q-point: ( 0.40 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.913 ( -0.002 -1.955 -2.812) 3.425 2.072 ( 1.985 0.257 -2.401) 3.126 2.217 ( 3.681 1.647 4.857) 6.313 2.361 ( -0.301 -4.957 -3.160) 5.886 2.591 ( 3.577 2.410 1.057) 4.441 2.841 ( -1.353 4.445 -5.143) 6.931 3.023 ( 1.979 -4.429 2.738) 5.570 3.266 ( 0.622 -2.108 -2.139) 3.067 3.322 ( 0.010 -4.418 1.588) 4.694 3.482 ( -4.955 -8.036 -0.065) 9.441 4.141 ( 5.454 3.533 4.627) 7.977 4.743 ( -1.792 0.214 1.654) 2.448 4.778 ( -1.009 14.849 -1.199) 14.932 5.056 ( -1.321 -3.069 -1.981) 3.885 5.092 ( 6.741 -10.008 10.261) 15.839 5.474 ( 0.388 8.286 -3.175) 8.882 5.613 ( 5.946 4.305 -1.721) 7.540 5.766 ( -1.604 -11.962 -4.020) 12.721 6.127 ( 0.542 3.046 -1.658) 3.510 6.260 ( 7.861 5.303 0.336) 9.488 6.531 ( 5.146 -5.680 -2.501) 8.062 6.774 ( 4.664 -6.292 3.591) 8.616 6.933 ( 3.286 3.964 -1.443) 5.347 6.986 ( 1.163 5.411 -0.590) 5.566 7.085 ( -1.498 3.250 5.505) 6.566 7.272 ( 5.295 -3.951 -5.256) 8.442 7.654 ( 0.887 7.956 -0.705) 8.037 7.754 ( -1.591 2.893 2.515) 4.150 7.826 ( -5.741 -6.445 -2.012) 8.863 7.976 ( -0.516 -6.668 2.901) 7.290 8.313 ( -0.999 -3.756 -1.175) 4.060 8.345 ( -2.631 -2.872 -1.486) 4.169 8.952 ( -0.108 -0.764 0.366) 0.854 9.075 ( -2.303 -3.810 1.048) 4.574 13.279 ( -0.342 4.464 0.095) 4.478 13.325 ( -2.052 3.663 0.201) 4.204 14.758 ( -1.283 0.339 -0.796) 1.547 14.800 ( -1.335 0.849 -0.049) 1.583 15.178 ( -2.010 -2.380 -2.003) 3.704 15.255 ( 1.611 -3.634 3.052) 5.011 15.665 ( -4.062 4.270 -0.539) 5.918 15.791 ( -6.877 0.321 0.202) 6.888 ======================= Grid point 52 (32/190) ======================= q-point: ( 0.47 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.898 ( -0.497 -1.869 -1.760) 2.615 2.099 ( 0.845 -6.657 -0.458) 6.726 2.265 ( 0.929 -0.018 1.292) 1.592 2.354 ( -0.193 -4.334 -0.664) 4.388 2.673 ( 3.603 3.401 2.942) 5.762 2.796 ( -2.176 6.278 -3.816) 7.663 3.061 ( 1.087 -4.674 1.437) 5.010 3.281 ( 1.263 -4.801 -3.646) 6.159 3.316 ( -0.946 -4.434 3.003) 5.438 3.412 ( -1.972 -5.228 -0.253) 5.594 4.214 ( 1.564 6.602 2.255) 7.150 4.715 ( -0.991 -0.975 -0.902) 1.658 4.753 ( -0.746 14.150 0.729) 14.188 5.023 ( -0.886 -2.258 -1.660) 2.939 5.220 ( 4.189 -7.782 7.830) 11.807 5.404 ( -4.344 4.107 -5.565) 8.168 5.725 ( 3.920 1.279 -1.927) 4.552 5.749 ( -0.042 -6.518 0.725) 6.559 6.166 ( 2.296 1.258 -0.265) 2.631 6.334 ( 0.614 6.721 -0.226) 6.753 6.651 ( 6.713 -1.672 -1.174) 7.017 6.764 ( -4.124 -0.183 -0.107) 4.129 6.959 ( -0.727 2.265 0.106) 2.381 7.058 ( 3.143 -1.368 2.500) 4.242 7.082 ( 1.316 -0.249 0.898) 1.613 7.386 ( 5.477 -5.706 -2.829) 8.400 7.639 ( -1.258 3.228 -1.142) 3.647 7.686 ( -5.376 -1.237 1.693) 5.770 7.767 ( 0.206 -0.293 -0.060) 0.363 7.970 ( -0.260 -1.207 1.017) 1.599 8.299 ( -1.115 -2.570 0.244) 2.812 8.303 ( -0.419 -3.279 -1.350) 3.571 8.955 ( 0.218 -1.271 0.131) 1.296 9.042 ( -1.024 -3.528 0.399) 3.695 13.279 ( 0.329 4.153 -0.278) 4.175 13.294 ( -1.117 3.761 0.355) 3.940 14.740 ( -0.428 0.022 -0.326) 0.538 14.782 ( -0.481 0.882 -0.121) 1.012 15.154 ( -0.400 -1.611 -0.419) 1.712 15.282 ( 0.644 -2.478 1.226) 2.838 15.628 ( 0.451 1.939 -0.168) 1.998 15.679 ( -4.465 0.277 -0.230) 4.479 ======================= Grid point 60 (33/190) ======================= q-point: ( 0.00 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.591 ( 0.000 18.434 0.000) 18.434 1.796 ( 0.000 24.155 0.000) 24.155 1.900 ( 0.000 -6.464 0.000) 6.464 2.161 ( 0.000 -9.662 0.000) 9.662 2.528 ( 0.000 -11.658 0.000) 11.658 2.582 ( 0.000 -6.493 0.000) 6.493 2.600 ( 0.000 3.737 0.000) 3.737 2.760 ( 0.000 -11.384 0.000) 11.384 3.383 ( 0.000 16.689 0.000) 16.689 3.499 ( 0.000 3.408 0.000) 3.408 3.696 ( 0.000 11.037 0.000) 11.037 3.824 ( 0.000 1.779 0.000) 1.779 4.394 ( 0.000 6.956 0.000) 6.956 4.447 ( 0.000 2.124 0.000) 2.124 4.706 ( 0.000 -13.950 0.000) 13.950 4.750 ( 0.000 -18.302 0.000) 18.302 5.163 ( 0.000 -4.049 0.000) 4.049 5.270 ( 0.000 -12.448 0.000) 12.448 5.692 ( 0.000 13.464 0.000) 13.464 5.950 ( 0.000 -11.892 0.000) 11.892 6.520 ( 0.000 11.920 0.000) 11.920 6.634 ( 0.000 3.893 0.000) 3.893 6.925 ( 0.000 4.759 0.000) 4.759 7.014 ( 0.000 0.151 0.000) 0.151 7.273 ( 0.000 -5.202 0.000) 5.202 7.291 ( 0.000 -7.611 0.000) 7.611 7.452 ( 0.000 1.179 0.000) 1.179 7.498 ( 0.000 -1.672 0.000) 1.672 7.831 ( 0.000 6.521 0.000) 6.521 7.917 ( 0.000 -1.319 0.000) 1.319 8.544 ( 0.000 5.636 0.000) 5.636 8.654 ( 0.000 -4.145 0.000) 4.145 9.164 ( 0.000 2.779 0.000) 2.779 9.250 ( 0.000 -5.881 0.000) 5.881 13.466 ( 0.000 2.193 0.000) 2.193 13.478 ( 0.000 0.640 0.000) 0.640 15.219 ( 0.000 8.790 0.000) 8.790 15.319 ( 0.000 0.443 0.000) 0.443 15.405 ( 0.000 0.097 0.000) 0.097 15.518 ( 0.000 -12.687 0.000) 12.687 16.547 ( 0.000 11.893 0.000) 11.893 16.753 ( 0.000 -8.894 0.000) 8.894 ======================= Grid point 61 (34/190) ======================= q-point: ( 0.07 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.646 ( 4.854 18.439 0.387) 19.071 1.857 ( 6.040 24.793 -0.833) 25.531 1.995 ( 7.802 -11.828 1.473) 14.246 2.204 ( 5.153 -1.775 -2.490) 5.992 2.509 ( -1.513 -15.147 0.017) 15.222 2.529 ( -2.890 -2.387 -1.027) 3.886 2.667 ( 4.823 1.297 -3.088) 5.872 2.817 ( 5.797 -13.335 -0.826) 14.564 3.382 ( 0.274 15.627 -3.213) 15.957 3.512 ( 1.636 2.912 -3.294) 4.691 3.656 ( -3.170 11.759 2.845) 12.507 3.865 ( 0.636 -5.958 5.043) 7.832 4.360 ( 2.647 12.054 -3.379) 12.795 4.528 ( 5.499 0.790 5.620) 7.902 4.757 ( 4.419 -10.525 4.261) 12.184 4.851 ( 8.432 -17.181 1.964) 19.239 5.152 ( -0.765 -3.080 -2.116) 3.815 5.267 ( 0.158 -11.981 -4.321) 12.737 5.698 ( 0.480 12.948 2.504) 13.197 5.958 ( 0.705 -12.260 1.470) 12.368 6.530 ( 0.686 11.956 -1.236) 12.039 6.659 ( 2.001 1.989 -0.830) 2.941 6.932 ( 0.881 6.773 0.451) 6.845 7.031 ( 1.755 1.631 -0.474) 2.442 7.247 ( -1.896 -3.757 0.011) 4.209 7.310 ( 0.886 -9.900 -0.951) 9.985 7.461 ( 1.075 1.021 0.541) 1.578 7.510 ( 1.460 -2.848 -0.614) 3.259 7.839 ( 0.664 6.260 -0.201) 6.298 7.916 ( -0.049 -0.634 -1.122) 1.290 8.522 ( -2.233 4.770 0.657) 5.308 8.623 ( -3.041 -4.154 -0.492) 5.171 9.151 ( -1.265 2.881 -0.138) 3.150 9.237 ( -1.391 -5.611 0.159) 5.783 13.465 ( -0.267 2.530 1.747) 3.086 13.485 ( 0.339 0.229 2.861) 2.891 15.190 ( -2.905 7.810 -0.819) 8.373 15.266 ( -5.074 0.866 0.137) 5.149 15.373 ( -2.977 0.272 -1.156) 3.205 15.492 ( -2.270 -12.120 -4.019) 12.969 16.506 ( -4.245 10.984 1.530) 11.875 16.688 ( -6.359 -7.348 0.940) 9.763 ======================= Grid point 62 (35/190) ======================= q-point: ( 0.13 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.756 ( 6.128 17.517 0.373) 18.561 1.992 ( 6.413 22.998 -0.424) 23.879 2.131 ( 5.964 -16.793 0.732) 17.836 2.319 ( 3.046 13.264 -1.774) 13.725 2.471 ( -2.493 -0.848 -4.258) 5.007 2.520 ( 4.733 -25.800 -0.800) 26.243 2.782 ( 7.882 3.719 -3.673) 9.458 2.965 ( 8.792 -14.970 -3.539) 17.718 3.396 ( 2.500 14.611 -4.247) 15.419 3.536 ( -0.924 8.304 -0.012) 8.356 3.619 ( 1.430 0.922 -0.214) 1.715 3.816 ( -5.280 -11.185 10.068) 15.948 4.548 ( 15.451 14.531 -1.935) 21.299 4.693 ( 10.044 4.197 6.697) 12.781 4.860 ( 4.575 -4.287 7.752) 9.970 5.033 ( 8.655 -16.824 1.557) 18.984 5.141 ( 1.005 -2.510 -2.810) 3.899 5.270 ( 1.671 -11.249 -6.077) 12.894 5.726 ( 1.929 11.919 3.000) 12.441 5.986 ( 1.881 -12.750 2.194) 13.073 6.523 ( -1.413 10.750 -2.716) 11.178 6.674 ( -0.913 -2.834 -2.128) 3.660 6.972 ( 3.127 11.620 0.809) 12.060 7.075 ( 2.510 6.945 -2.053) 7.665 7.206 ( -2.258 -3.399 2.979) 5.052 7.300 ( -1.498 -9.769 -3.959) 10.646 7.507 ( 3.449 -1.835 1.172) 4.079 7.559 ( 3.754 -5.969 -0.204) 7.054 7.850 ( 0.477 5.835 -0.619) 5.887 7.911 ( -0.207 0.770 -2.147) 2.290 8.467 ( -3.313 2.459 1.324) 4.332 8.542 ( -4.922 -3.952 -0.394) 6.325 9.117 ( -2.137 3.056 -0.066) 3.729 9.200 ( -2.356 -5.069 0.449) 5.608 13.459 ( -0.819 3.227 2.908) 4.421 13.494 ( -0.155 -0.505 3.866) 3.902 15.105 ( -5.442 5.227 -1.102) 7.626 15.141 ( -7.159 1.422 0.065) 7.299 15.299 ( -3.920 1.016 -2.125) 4.573 15.421 ( -3.946 -10.565 -6.003) 12.776 16.394 ( -7.397 8.986 2.424) 11.888 16.528 ( -9.780 -4.376 1.649) 10.841 ======================= Grid point 63 (36/190) ======================= q-point: ( 0.20 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.882 ( 6.410 14.855 0.599) 16.190 2.068 ( 1.667 12.914 -0.633) 13.037 2.250 ( 4.649 -9.648 2.837) 11.079 2.296 ( -1.984 5.897 -2.899) 6.864 2.423 ( -1.000 2.171 -6.078) 6.531 2.642 ( 5.568 -17.995 0.192) 18.838 2.931 ( 6.429 3.470 -7.448) 10.433 3.099 ( 5.074 -12.346 -6.318) 14.768 3.460 ( -3.242 7.142 1.449) 7.976 3.519 ( 8.443 15.655 2.313) 17.937 3.636 ( -2.773 -7.106 -0.992) 7.692 3.860 ( 11.150 -12.295 9.331) 19.041 4.841 ( 9.659 6.976 9.814) 15.436 4.904 ( 10.279 12.277 -1.763) 16.109 4.944 ( 2.211 1.939 9.993) 10.417 5.157 ( 7.934 -8.402 -2.214) 11.766 5.217 ( 5.773 -5.566 -6.916) 10.590 5.383 ( 12.165 -13.606 -1.037) 18.280 5.778 ( 2.742 11.320 1.943) 11.808 6.031 ( 2.017 -12.043 2.072) 12.385 6.466 ( -3.439 7.483 -4.313) 9.297 6.610 ( -4.905 -6.005 -3.539) 8.523 7.034 ( 1.985 12.858 0.665) 13.027 7.088 ( -1.028 7.262 -0.957) 7.397 7.188 ( -0.314 0.141 3.547) 3.564 7.266 ( -0.064 -5.379 -4.526) 7.030 7.589 ( 4.563 -4.441 0.757) 6.412 7.645 ( 4.581 -8.807 0.101) 9.928 7.852 ( -0.150 5.625 -0.985) 5.712 7.899 ( -0.644 1.545 -2.218) 2.778 8.406 ( -3.078 -0.369 1.458) 3.426 8.442 ( -5.078 -3.271 0.131) 6.041 9.071 ( -2.480 3.084 0.180) 3.962 9.150 ( -2.804 -4.583 0.780) 5.429 13.441 ( -1.543 3.741 2.753) 4.895 13.486 ( -1.365 -0.812 3.134) 3.513 14.989 ( -5.747 3.084 -0.640) 6.553 15.009 ( -6.126 1.233 -0.004) 6.249 15.224 ( -3.292 1.140 -2.055) 4.045 15.326 ( -4.567 -8.399 -6.024) 11.300 16.235 ( -9.063 7.085 2.374) 11.746 16.330 ( -10.580 -2.272 1.817) 10.973 ======================= Grid point 64 (37/190) ======================= q-point: ( 0.27 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.980 ( 2.255 9.714 -0.048) 9.973 2.085 ( 1.272 6.861 -1.235) 7.086 2.213 ( -3.162 0.464 1.232) 3.425 2.335 ( 0.619 -6.766 0.599) 6.820 2.450 ( 5.325 9.022 -4.922) 11.575 2.729 ( 3.659 -14.241 0.586) 14.715 2.983 ( 1.151 4.711 -8.527) 9.810 3.146 ( 1.394 -10.549 -6.078) 12.254 3.383 ( -3.971 5.876 3.326) 7.833 3.519 ( -4.996 -7.722 0.508) 9.211 3.821 ( 15.883 14.488 4.168) 21.898 4.163 ( 16.213 -16.865 5.843) 24.113 4.913 ( -0.984 4.848 8.585) 9.909 4.981 ( -0.802 0.134 10.847) 10.877 5.054 ( 6.492 10.459 -1.689) 12.425 5.299 ( 6.848 -9.647 -4.324) 12.596 5.450 ( 16.047 7.019 -4.597) 18.108 5.649 ( 10.605 -9.427 -5.787) 15.323 5.852 ( 7.140 9.779 3.428) 12.584 6.065 ( 1.512 -9.294 1.565) 9.545 6.395 ( -2.676 1.951 -4.712) 5.759 6.494 ( -5.271 -6.551 -2.966) 8.916 7.033 ( -1.089 5.872 1.418) 6.138 7.055 ( -2.199 2.965 1.165) 3.870 7.203 ( 1.356 6.708 0.611) 6.871 7.277 ( 0.684 0.836 -3.226) 3.402 7.678 ( 4.224 -4.057 0.186) 5.860 7.723 ( 3.406 -8.322 0.268) 8.996 7.844 ( -0.487 4.141 -0.823) 4.250 7.876 ( -1.522 1.500 -1.059) 2.385 8.352 ( -3.932 -2.202 0.288) 4.516 8.355 ( -2.420 -2.577 0.629) 3.590 9.024 ( -2.293 2.859 0.446) 3.692 9.096 ( -2.798 -4.146 1.018) 5.104 13.410 ( -1.923 3.711 1.781) 4.543 13.454 ( -2.303 -0.502 1.723) 2.920 14.892 ( -4.097 2.225 -0.444) 4.683 14.909 ( -4.055 0.668 0.047) 4.110 15.170 ( -1.879 -0.158 -0.732) 2.022 15.231 ( -3.955 -5.909 -4.604) 8.471 16.058 ( -9.275 5.703 1.597) 11.005 16.130 ( -10.110 -1.421 1.399) 10.304 ======================= Grid point 65 (38/190) ======================= q-point: ( 0.33 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.966 ( -2.303 5.237 -0.744) 5.770 2.075 ( -2.747 -3.797 -2.924) 5.524 2.213 ( 2.349 6.296 3.991) 7.815 2.330 ( -0.505 -2.983 -0.216) 3.033 2.566 ( 6.347 7.866 -1.340) 10.196 2.797 ( 3.387 -12.096 0.270) 12.564 2.977 ( 0.143 6.520 -7.580) 9.999 3.153 ( 0.639 -10.344 -4.647) 11.358 3.322 ( -2.892 4.260 2.715) 5.821 3.429 ( -4.172 -6.417 0.653) 7.682 4.115 ( 12.607 13.699 4.368) 19.123 4.447 ( 10.846 -18.187 4.178) 21.584 4.910 ( 0.092 3.278 8.586) 9.192 4.961 ( -2.300 -1.822 8.541) 9.031 5.168 ( 4.787 14.548 -2.741) 15.558 5.439 ( 7.638 -9.130 -2.029) 12.075 5.638 ( 2.228 3.735 -8.536) 9.580 5.675 ( -2.102 1.188 -6.677) 7.101 6.112 ( 11.835 2.736 4.435) 12.931 6.156 ( 11.005 -1.567 -1.793) 11.259 6.343 ( -1.453 -0.585 -1.375) 2.084 6.458 ( 2.539 -9.355 0.244) 9.697 7.017 ( -0.637 2.913 0.912) 3.118 7.041 ( 1.018 0.876 1.936) 2.356 7.213 ( -0.950 6.507 0.517) 6.597 7.256 ( -2.212 2.071 -3.926) 4.959 7.741 ( 2.139 -1.390 -0.434) 2.588 7.783 ( 1.571 -6.809 0.908) 7.047 7.821 ( -1.739 2.395 -0.533) 3.007 7.843 ( -0.856 1.217 0.365) 1.532 8.290 ( -2.420 -1.303 -0.416) 2.780 8.315 ( -1.882 -3.469 -0.169) 3.950 8.986 ( -1.656 2.346 0.587) 2.931 9.047 ( -2.399 -3.584 1.042) 4.437 13.377 ( -1.656 3.203 0.834) 3.700 13.409 ( -2.312 0.107 0.704) 2.419 14.826 ( -2.665 1.990 -0.940) 3.456 14.847 ( -2.422 0.128 -0.204) 2.434 15.151 ( -0.269 -2.100 0.552) 2.188 15.165 ( -1.986 -3.252 -1.851) 4.237 15.888 ( -8.185 4.617 0.594) 9.417 15.945 ( -8.881 -1.140 0.649) 8.977 ======================= Grid point 66 (39/190) ======================= q-point: ( 0.40 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.917 ( -2.173 2.636 -0.948) 3.545 2.008 ( -3.251 -5.622 -0.730) 6.535 2.261 ( 1.616 3.488 1.613) 4.169 2.320 ( -0.596 -1.693 0.288) 1.818 2.680 ( 5.190 7.120 0.840) 8.851 2.862 ( 3.038 -10.007 0.321) 10.463 2.970 ( 0.228 8.130 -6.167) 10.206 3.159 ( 0.723 -10.125 -4.115) 10.953 3.281 ( -1.725 2.899 2.721) 4.334 3.361 ( -2.855 -4.867 0.753) 5.693 4.311 ( 6.800 12.425 3.450) 14.578 4.581 ( 2.996 -13.156 1.311) 13.556 4.941 ( -0.505 0.585 8.698) 8.733 4.965 ( 3.385 -2.771 10.523) 11.396 5.183 ( -2.614 15.135 -8.313) 17.464 5.483 ( -6.069 -13.541 -7.500) 16.627 5.639 ( 5.027 4.474 -2.757) 7.272 5.680 ( 4.051 0.983 -3.508) 5.448 6.223 ( 2.189 6.469 -1.542) 7.001 6.347 ( 1.154 -1.740 0.557) 2.161 6.430 ( 13.039 1.652 0.817) 13.169 6.589 ( 8.900 -10.085 4.139) 14.073 7.026 ( 1.247 4.250 -1.271) 4.608 7.073 ( 0.594 0.983 2.309) 2.579 7.168 ( -3.527 3.793 -0.337) 5.190 7.208 ( -0.043 -1.692 -3.080) 3.515 7.732 ( -3.800 -2.362 -1.043) 4.594 7.737 ( -4.203 -1.175 0.721) 4.424 7.810 ( 0.972 4.401 0.904) 4.597 7.883 ( 3.009 -2.934 0.540) 4.237 8.255 ( -1.067 -1.149 -0.700) 1.717 8.279 ( -1.688 -3.029 -0.626) 3.523 8.963 ( -0.821 1.621 0.496) 1.883 9.008 ( -1.667 -2.831 0.789) 3.379 13.352 ( -0.952 2.523 0.260) 2.709 13.371 ( -1.639 0.737 0.282) 1.819 14.782 ( -1.626 1.822 -1.052) 2.659 14.809 ( -1.511 -0.374 -0.637) 1.682 15.135 ( -0.364 -0.686 -0.318) 0.839 15.170 ( 1.258 -3.842 1.761) 4.410 15.750 ( -5.748 3.486 -0.137) 6.724 15.792 ( -6.755 -0.745 -0.029) 6.796 ======================= Grid point 67 (40/190) ======================= q-point: ( 0.47 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.887 ( -0.752 1.234 -0.555) 1.548 1.959 ( -1.440 -5.954 0.135) 6.127 2.285 ( 0.795 1.258 0.183) 1.499 2.307 ( -0.692 -1.106 0.283) 1.335 2.759 ( 2.338 5.683 1.104) 6.243 2.906 ( 1.248 -8.558 0.238) 8.652 2.962 ( -0.111 9.627 -2.867) 10.045 3.164 ( 0.290 -9.719 -2.180) 9.965 3.264 ( -0.440 1.768 1.518) 2.371 3.323 ( -1.047 -3.834 0.448) 3.999 4.398 ( 1.936 10.925 1.330) 11.175 4.606 ( 0.262 -8.942 0.106) 8.947 4.974 ( 2.366 4.167 9.648) 10.773 5.043 ( 0.107 0.518 -0.655) 0.842 5.100 ( -1.074 4.518 -1.975) 5.047 5.326 ( -5.966 -10.822 -6.539) 13.981 5.721 ( 2.586 3.738 -1.122) 4.682 5.772 ( 3.480 -0.092 -0.405) 3.505 6.242 ( 0.449 6.089 -0.663) 6.142 6.362 ( 0.350 -4.080 -0.046) 4.095 6.642 ( 8.097 2.200 1.874) 8.597 6.718 ( 1.723 -4.131 1.358) 4.677 7.007 ( -1.468 2.914 -0.528) 3.306 7.070 ( -2.888 -2.235 -0.928) 3.768 7.122 ( 1.509 7.151 0.312) 7.315 7.264 ( 3.548 -6.549 -0.814) 7.492 7.649 ( -3.034 -0.938 -0.661) 3.244 7.655 ( -3.388 -1.197 0.776) 3.676 7.831 ( 0.640 5.390 0.335) 5.439 7.929 ( 1.335 -3.605 0.243) 3.852 8.243 ( -0.221 -1.502 -0.220) 1.534 8.252 ( -0.886 -2.025 -0.458) 2.257 8.955 ( -0.176 0.979 0.187) 1.012 8.986 ( -0.638 -2.146 0.300) 2.258 13.342 ( -0.115 1.884 -0.025) 1.888 13.348 ( -0.757 1.313 0.153) 1.523 14.759 ( -0.566 1.660 -0.448) 1.810 14.787 ( -0.561 -0.646 -0.362) 0.929 15.136 ( 0.224 0.803 0.191) 0.856 15.197 ( 0.832 -4.708 0.890) 4.863 15.675 ( -1.655 1.994 -0.177) 2.597 15.692 ( -3.202 0.287 -0.188) 3.221 ======================= Grid point 135 (41/190) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.315 ( -10.075 0.000 15.797) 18.737 0.384 ( 3.075 0.000 19.108) 19.354 0.758 ( 7.588 0.000 37.195) 37.961 1.199 ( 2.179 0.000 -9.903) 10.140 1.449 ( -1.521 0.000 -11.514) 11.614 2.345 ( 5.421 0.000 0.106) 5.422 2.811 ( -7.991 0.000 -10.332) 13.062 2.923 ( -0.338 0.000 -1.152) 1.201 3.325 ( 1.056 0.000 6.538) 6.623 3.965 ( -1.271 0.000 -13.708) 13.767 4.186 ( -1.440 0.000 4.816) 5.027 4.543 ( 0.098 0.000 5.813) 5.814 4.742 ( -2.024 0.000 0.085) 2.026 4.748 ( -8.676 0.000 0.671) 8.702 4.977 ( 2.517 0.000 7.205) 7.632 5.292 ( 3.141 0.000 1.848) 3.645 5.722 ( -3.260 0.000 -0.990) 3.406 5.935 ( 8.927 0.000 -9.965) 13.379 6.082 ( 4.022 0.000 -2.013) 4.498 6.258 ( 11.619 0.000 4.959) 12.633 6.360 ( -0.704 0.000 5.170) 5.218 6.520 ( -0.972 0.000 -5.212) 5.302 6.544 ( 0.431 0.000 3.562) 3.588 6.834 ( -4.440 0.000 -4.207) 6.116 6.867 ( -1.356 0.000 0.948) 1.654 6.931 ( 2.534 0.000 -0.173) 2.540 7.186 ( 14.494 0.000 1.315) 14.554 7.269 ( 1.186 0.000 -1.398) 1.833 7.947 ( 4.424 0.000 0.976) 4.531 8.078 ( -59.111 0.000 -2.375) 59.158 8.578 ( -2.387 0.000 3.095) 3.908 8.811 ( 0.323 0.000 -2.965) 2.982 9.187 ( 0.698 0.000 2.350) 2.452 9.334 ( -3.928 0.000 -1.426) 4.179 13.101 ( 1.745 0.000 4.651) 4.968 13.543 ( -2.290 0.000 -5.786) 6.223 15.088 ( 2.402 0.000 4.696) 5.274 15.213 ( 0.278 0.000 0.205) 0.345 15.255 ( -0.511 0.000 0.228) 0.559 15.452 ( -3.706 0.000 -2.986) 4.759 16.493 ( -5.573 0.000 1.521) 5.777 16.642 ( 57.300 0.000 -1.882) 57.331 ======================= Grid point 136 (42/190) ======================= q-point: ( 0.07 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.505 ( 19.044 0.000 7.841) 20.595 0.611 ( 14.783 0.000 14.946) 21.022 1.104 ( 20.184 0.000 28.667) 35.060 1.368 ( 15.050 0.000 -8.557) 17.313 1.382 ( -0.506 0.000 -4.799) 4.826 2.531 ( 11.375 0.000 8.153) 13.995 2.662 ( -3.445 0.000 -20.699) 20.984 3.002 ( 7.045 0.000 0.653) 7.075 3.293 ( -0.371 0.000 3.447) 3.467 3.830 ( -9.775 0.000 -13.501) 16.668 4.171 ( -0.885 0.000 4.073) 4.168 4.528 ( -2.782 0.000 9.564) 9.961 4.736 ( 1.704 0.000 -4.197) 4.530 4.738 ( 5.031 0.000 6.554) 8.262 5.064 ( 4.895 0.000 6.708) 8.304 5.340 ( 1.165 0.000 4.820) 4.959 5.646 ( -3.345 0.000 -3.788) 5.053 5.817 ( -12.705 0.000 0.507) 12.716 6.146 ( 1.977 0.000 0.079) 1.978 6.161 ( -6.951 0.000 9.547) 11.809 6.324 ( -3.327 0.000 5.549) 6.470 6.502 ( -1.245 0.000 -6.946) 7.057 6.588 ( 3.060 0.000 3.762) 4.849 6.764 ( -1.948 0.000 -4.326) 4.744 6.865 ( 1.180 0.000 -0.161) 1.191 6.959 ( 1.211 0.000 1.520) 1.943 7.155 ( -5.020 0.000 2.960) 5.827 7.277 ( -0.273 0.000 -2.280) 2.296 8.080 ( 22.895 0.000 -23.336) 32.691 8.103 ( 9.995 0.000 6.860) 12.122 8.579 ( 0.663 0.000 2.135) 2.236 8.805 ( -0.329 0.000 -1.650) 1.682 9.204 ( 0.615 0.000 2.943) 3.007 9.300 ( -0.736 0.000 -1.623) 1.782 13.131 ( 0.607 0.000 6.031) 6.061 13.453 ( -5.420 0.000 -7.260) 9.060 15.151 ( 2.953 0.000 5.866) 6.567 15.192 ( -2.346 0.000 0.229) 2.357 15.209 ( -4.042 0.000 0.134) 4.045 15.370 ( -4.228 0.000 -2.453) 4.888 16.333 ( -9.826 0.000 -5.047) 11.046 16.787 ( -18.694 0.000 11.421) 21.907 ======================= Grid point 137 (43/190) ======================= q-point: ( 0.13 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.899 ( 19.174 0.000 7.697) 20.661 0.959 ( 18.007 0.000 11.092) 21.149 1.423 ( 7.050 0.000 -3.045) 7.679 1.607 ( 23.909 0.000 17.961) 29.903 1.668 ( 15.079 0.000 -9.986) 18.085 2.543 ( -1.502 0.000 -9.403) 9.522 2.862 ( 17.313 0.000 -1.922) 17.420 3.086 ( 1.108 0.000 -0.034) 1.109 3.448 ( 14.831 0.000 -1.217) 14.881 3.572 ( -13.487 0.000 -12.954) 18.701 4.167 ( 0.013 0.000 2.984) 2.984 4.470 ( -4.953 0.000 12.628) 13.564 4.773 ( 2.139 0.000 -5.698) 6.086 4.881 ( 7.088 0.000 9.144) 11.569 5.188 ( 6.810 0.000 5.168) 8.549 5.350 ( -1.111 0.000 7.715) 7.794 5.606 ( 0.615 0.000 -5.729) 5.762 5.661 ( -3.069 0.000 -1.797) 3.557 6.071 ( -4.371 0.000 4.134) 6.017 6.139 ( -2.759 0.000 -2.005) 3.410 6.273 ( -2.661 0.000 7.154) 7.632 6.455 ( -2.385 0.000 -6.677) 7.090 6.662 ( 3.630 0.000 3.905) 5.331 6.723 ( -1.609 0.000 -4.615) 4.888 6.912 ( 3.722 0.000 -1.298) 3.941 6.988 ( 1.078 0.000 3.243) 3.417 7.137 ( 1.855 0.000 1.569) 2.430 7.264 ( -0.067 0.000 -3.422) 3.422 8.301 ( 7.466 0.000 8.543) 11.346 8.323 ( 7.422 0.000 -21.707) 22.941 8.601 ( 1.035 0.000 -1.048) 1.473 8.799 ( -0.206 0.000 2.436) 2.445 9.221 ( 0.545 0.000 3.484) 3.527 9.280 ( -1.194 0.000 -2.093) 2.409 13.150 ( 0.256 0.000 6.184) 6.189 13.323 ( -6.212 0.000 -7.446) 9.697 15.113 ( -5.348 0.000 -0.303) 5.357 15.127 ( -4.207 0.000 0.093) 4.208 15.216 ( 2.373 0.000 6.279) 6.712 15.281 ( -4.363 0.000 -2.598) 5.078 16.119 ( -10.241 0.000 -10.188) 14.445 16.459 ( -15.485 0.000 17.626) 23.462 ======================= Grid point 138 (44/190) ======================= q-point: ( 0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.270 ( 17.413 0.000 8.118) 19.212 1.336 ( 18.704 0.000 8.267) 20.449 1.594 ( 10.980 0.000 -2.781) 11.327 1.851 ( 5.352 0.000 -15.674) 16.562 2.090 ( 22.023 0.000 10.771) 24.516 2.578 ( 6.660 0.000 -6.550) 9.341 3.095 ( 0.833 0.000 -3.969) 4.055 3.182 ( 14.316 0.000 1.025) 14.353 3.292 ( -12.381 0.000 -9.886) 15.844 3.741 ( 12.446 0.000 1.636) 12.553 4.202 ( 4.343 0.000 -0.400) 4.362 4.387 ( -5.633 0.000 14.086) 15.170 4.770 ( -2.069 0.000 -5.356) 5.742 5.012 ( 3.891 0.000 12.971) 13.542 5.342 ( -1.007 0.000 6.406) 6.485 5.347 ( 8.523 0.000 3.737) 9.306 5.641 ( 0.475 0.000 -8.945) 8.957 5.662 ( 6.149 0.000 -6.258) 8.773 6.022 ( -0.195 0.000 2.414) 2.422 6.047 ( -5.130 0.000 -6.575) 8.340 6.256 ( -0.260 0.000 8.485) 8.489 6.398 ( -1.729 0.000 -4.306) 4.640 6.682 ( -1.809 0.000 -4.713) 5.049 6.739 ( 3.718 0.000 4.175) 5.591 6.998 ( 5.141 0.000 -2.315) 5.638 7.007 ( 0.071 0.000 5.547) 5.548 7.215 ( 5.415 0.000 1.532) 5.627 7.270 ( 1.237 0.000 -3.367) 3.588 8.365 ( 1.389 0.000 -15.413) 15.476 8.394 ( 1.134 0.000 3.973) 4.132 8.595 ( -1.590 0.000 -3.350) 3.709 8.801 ( -1.033 0.000 8.186) 8.251 9.236 ( 0.299 0.000 3.606) 3.618 9.246 ( -1.865 0.000 -1.467) 2.373 13.162 ( -0.086 0.000 5.554) 5.555 13.201 ( -4.812 0.000 -6.287) 7.917 15.017 ( -4.193 0.000 0.244) 4.200 15.035 ( -5.071 0.000 -0.103) 5.072 15.194 ( -4.089 0.000 -2.618) 4.855 15.258 ( 0.742 0.000 5.102) 5.155 15.916 ( -8.366 0.000 -11.477) 14.202 16.240 ( -10.235 0.000 13.089) 16.616 ======================= Grid point 139 (45/190) ======================= q-point: ( 0.27 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.600 ( 14.876 0.000 7.232) 16.541 1.704 ( 17.457 0.000 5.364) 18.263 1.831 ( 13.394 0.000 -1.119) 13.440 1.862 ( 0.391 0.000 -17.561) 17.566 2.478 ( 16.026 0.000 5.033) 16.798 2.729 ( 7.786 0.000 -4.421) 8.954 3.064 ( -8.443 0.000 -3.964) 9.327 3.111 ( 1.695 0.000 -6.967) 7.170 3.413 ( 8.471 0.000 2.583) 8.856 3.879 ( 1.726 0.000 6.054) 6.295 4.308 ( -4.931 0.000 14.995) 15.784 4.350 ( 9.762 0.000 -5.134) 11.030 4.662 ( -8.090 0.000 -5.118) 9.572 5.094 ( 3.289 0.000 14.604) 14.970 5.292 ( -5.725 0.000 2.027) 6.073 5.508 ( 6.107 0.000 0.155) 6.109 5.610 ( -2.544 0.000 -10.510) 10.814 5.810 ( 9.542 0.000 -3.521) 10.170 5.961 ( -0.859 0.000 -7.702) 7.750 6.094 ( 6.613 0.000 -1.581) 6.799 6.297 ( 3.109 0.000 6.799) 7.476 6.426 ( 6.498 0.000 1.537) 6.677 6.639 ( -1.816 0.000 -4.132) 4.513 6.829 ( 4.996 0.000 3.813) 6.284 7.006 ( -1.363 0.000 7.280) 7.407 7.093 ( 4.858 0.000 -3.410) 5.935 7.296 ( 1.819 0.000 -3.167) 3.652 7.338 ( 6.582 0.000 1.607) 6.775 8.346 ( -0.691 0.000 -13.640) 13.657 8.380 ( -2.436 0.000 0.417) 2.471 8.524 ( -5.052 0.000 -2.075) 5.462 8.767 ( -4.515 0.000 10.680) 11.595 9.207 ( -1.872 0.000 -0.452) 1.926 9.242 ( -0.196 0.000 2.559) 2.566 13.118 ( -2.765 0.000 -4.372) 5.173 13.165 ( -0.455 0.000 4.418) 4.441 14.936 ( -4.863 0.000 -0.280) 4.871 14.956 ( -2.189 0.000 1.258) 2.525 15.116 ( -3.445 0.000 -2.100) 4.034 15.255 ( -1.783 0.000 2.510) 3.079 15.764 ( -5.242 0.000 -9.225) 10.610 16.090 ( -7.306 0.000 8.461) 11.179 ======================= Grid point 140 (46/190) ======================= q-point: ( 0.33 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.838 ( 1.197 0.000 -13.777) 13.829 1.865 ( 11.035 0.000 5.489) 12.325 2.033 ( 14.617 0.000 2.370) 14.808 2.104 ( 14.526 0.000 0.880) 14.553 2.724 ( 8.618 0.000 1.221) 8.704 2.783 ( -2.066 0.000 -2.333) 3.116 2.999 ( 2.040 0.000 0.223) 2.052 3.135 ( 2.044 0.000 -8.840) 9.073 3.537 ( 4.446 0.000 4.669) 6.447 3.884 ( -1.181 0.000 4.513) 4.665 4.248 ( -4.044 0.000 15.104) 15.636 4.447 ( -12.454 0.000 -5.660) 13.679 4.489 ( 4.510 0.000 -4.654) 6.481 5.136 ( -9.798 0.000 1.162) 9.866 5.236 ( 9.273 0.000 12.968) 15.942 5.500 ( -6.187 0.000 -12.660) 14.091 5.532 ( -2.309 0.000 -6.612) 7.003 5.999 ( 7.119 0.000 -2.329) 7.491 6.039 ( 11.166 0.000 0.776) 11.193 6.218 ( 5.975 0.000 -1.447) 6.148 6.387 ( 4.608 0.000 3.279) 5.656 6.576 ( -1.149 0.000 -2.321) 2.590 6.697 ( 16.572 0.000 3.468) 16.931 6.955 ( 7.383 0.000 2.577) 7.820 6.981 ( -2.414 0.000 8.127) 8.478 7.168 ( 3.599 0.000 -5.618) 6.672 7.329 ( 2.222 0.000 -2.837) 3.604 7.465 ( 5.986 0.000 1.536) 6.180 8.275 ( -5.152 0.000 -14.657) 15.537 8.319 ( -3.452 0.000 -0.554) 3.496 8.414 ( -4.958 0.000 1.501) 5.180 8.655 ( -8.757 0.000 10.347) 13.555 9.175 ( -1.317 0.000 0.311) 1.353 9.239 ( -0.406 0.000 0.954) 1.036 13.075 ( -1.150 0.000 -2.533) 2.782 13.159 ( -0.782 0.000 3.002) 3.102 14.850 ( -3.810 0.000 -0.278) 3.820 14.932 ( -0.649 0.000 1.934) 2.040 15.055 ( -2.463 0.000 -1.117) 2.705 15.200 ( -3.776 0.000 -0.675) 3.836 15.682 ( -2.027 0.000 -5.184) 5.566 15.978 ( -5.438 0.000 4.825) 7.270 ======================= Grid point 141 (47/190) ======================= q-point: ( 0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.866 ( 3.628 0.000 -7.595) 8.417 2.040 ( 5.998 0.000 3.326) 6.858 2.281 ( 10.540 0.000 0.818) 10.572 2.388 ( 13.868 0.000 2.313) 14.059 2.726 ( -2.890 0.000 5.452) 6.171 2.828 ( 2.508 0.000 0.432) 2.545 3.047 ( 1.682 0.000 -3.446) 3.835 3.148 ( 0.529 0.000 -8.877) 8.893 3.635 ( 4.999 0.000 6.551) 8.241 3.870 ( -0.032 0.000 -2.830) 2.830 4.138 ( -12.594 0.000 3.231) 13.002 4.241 ( -4.241 0.000 5.261) 6.757 4.519 ( -0.321 0.000 -1.270) 1.310 4.937 ( -10.261 0.000 1.696) 10.400 5.353 ( -5.844 0.000 -15.439) 16.508 5.456 ( -3.080 0.000 -8.673) 9.204 5.485 ( 13.104 0.000 12.867) 18.365 6.107 ( 4.544 0.000 0.818) 4.617 6.280 ( 11.031 0.000 2.907) 11.407 6.321 ( 4.616 0.000 0.036) 4.616 6.466 ( 2.682 0.000 1.166) 2.925 6.519 ( -3.708 0.000 -0.460) 3.736 6.923 ( -1.940 0.000 6.255) 6.549 7.089 ( 4.229 0.000 1.255) 4.411 7.101 ( 19.203 0.000 3.973) 19.610 7.240 ( 6.131 0.000 -8.115) 10.171 7.382 ( 4.461 0.000 -2.894) 5.318 7.570 ( 4.411 0.000 1.694) 4.725 8.081 ( -11.568 0.000 -10.306) 15.493 8.250 ( -3.653 0.000 -0.262) 3.663 8.360 ( -1.152 0.000 -0.127) 1.159 8.469 ( -11.626 0.000 8.735) 14.542 9.156 ( -0.774 0.000 0.671) 1.025 9.232 ( -0.354 0.000 -0.186) 0.400 13.061 ( -0.063 0.000 -1.089) 1.091 13.146 ( -1.012 0.000 1.542) 1.845 14.790 ( -2.225 0.000 0.001) 2.225 14.928 ( -0.386 0.000 1.216) 1.276 15.017 ( -1.252 0.000 0.013) 1.252 15.124 ( -3.236 0.000 -1.824) 3.715 15.658 ( -0.006 0.000 -1.942) 1.942 15.893 ( -3.992 0.000 1.997) 4.463 ======================= Grid point 142 (48/190) ======================= q-point: ( 0.47 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.948 ( 5.353 0.000 -1.334) 5.517 2.107 ( 0.377 0.000 0.801) 0.885 2.457 ( 7.546 0.000 1.987) 7.803 2.611 ( 6.452 0.000 1.216) 6.566 2.696 ( -1.612 0.000 10.473) 10.597 2.855 ( 1.163 0.000 4.088) 4.250 3.036 ( -1.995 0.000 -6.304) 6.612 3.126 ( -0.455 0.000 -7.985) 7.998 3.694 ( -3.993 0.000 -4.563) 6.063 3.879 ( 2.312 0.000 -12.545) 12.757 3.950 ( -1.374 0.000 9.992) 10.086 4.210 ( -1.194 0.000 8.226) 8.312 4.470 ( -5.898 0.000 4.552) 7.450 4.788 ( -3.294 0.000 -1.011) 3.446 5.230 ( -4.172 0.000 -14.213) 14.813 5.401 ( -0.777 0.000 -8.755) 8.790 5.760 ( 12.083 0.000 13.369) 18.020 6.177 ( 2.243 0.000 3.133) 3.853 6.372 ( -1.309 0.000 -2.096) 2.471 6.434 ( 3.500 0.000 0.205) 3.506 6.457 ( -0.709 0.000 3.702) 3.769 6.483 ( -0.795 0.000 0.584) 0.987 6.888 ( -2.095 0.000 5.526) 5.910 7.133 ( 1.503 0.000 0.855) 1.729 7.323 ( 2.277 0.000 -4.804) 5.316 7.421 ( 9.862 0.000 -2.074) 10.078 7.537 ( 11.637 0.000 -6.537) 13.347 7.619 ( -3.450 0.000 0.620) 3.505 7.877 ( -1.681 0.000 -2.379) 2.913 8.131 ( -10.618 0.000 2.451) 10.897 8.294 ( -4.943 0.000 4.400) 6.618 8.358 ( 1.082 0.000 -0.308) 1.125 9.145 ( -0.510 0.000 0.758) 0.913 9.224 ( -0.357 0.000 -0.786) 0.863 13.067 ( 0.761 0.000 0.059) 0.763 13.126 ( -1.118 0.000 0.251) 1.146 14.765 ( -0.410 0.000 0.540) 0.678 14.909 ( -1.614 0.000 -1.192) 2.007 15.006 ( 0.014 0.000 0.932) 0.932 15.085 ( -0.420 0.000 -0.662) 0.784 15.671 ( 1.412 0.000 0.297) 1.443 15.828 ( -2.771 0.000 -0.299) 2.787 ======================= Grid point 143 (49/190) ======================= q-point: (-0.47 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.058 ( 5.471 0.000 2.862) 6.174 2.058 ( -5.225 0.000 -1.893) 5.558 2.532 ( -2.647 0.000 4.054) 4.842 2.581 ( -8.041 0.000 0.501) 8.057 2.750 ( 6.915 0.000 14.075) 15.682 2.882 ( -1.221 0.000 0.357) 1.272 2.946 ( -5.804 0.000 -7.842) 9.756 3.177 ( 7.479 0.000 -0.701) 7.512 3.518 ( -7.874 0.000 -11.563) 13.989 3.907 ( 2.481 0.000 -17.402) 17.578 4.062 ( 4.431 0.000 15.981) 16.584 4.237 ( 4.288 0.000 5.540) 7.006 4.311 ( -9.522 0.000 5.580) 11.036 4.825 ( 6.168 0.000 -1.871) 6.445 5.134 ( -3.690 0.000 -11.758) 12.323 5.400 ( 2.210 0.000 -8.422) 8.708 5.964 ( 4.794 0.000 15.168) 15.908 6.203 ( -0.332 0.000 3.970) 3.984 6.291 ( -3.670 0.000 -1.697) 4.044 6.363 ( -7.957 0.000 -3.108) 8.543 6.493 ( 0.074 0.000 0.387) 0.394 6.501 ( 3.082 0.000 2.499) 3.968 6.866 ( -0.976 0.000 4.105) 4.220 7.154 ( -0.727 0.000 2.459) 2.564 7.317 ( -17.345 0.000 -5.568) 18.217 7.332 ( -0.138 0.000 -3.440) 3.443 7.523 ( -1.617 0.000 -2.677) 3.128 7.709 ( 1.226 0.000 -3.238) 3.462 7.935 ( -2.799 0.000 -2.030) 3.457 8.067 ( 13.471 0.000 4.048) 14.066 8.270 ( 0.724 0.000 2.242) 2.356 8.412 ( 4.938 0.000 1.798) 5.255 9.138 ( -0.398 0.000 0.691) 0.797 9.214 ( -0.510 0.000 -1.083) 1.197 13.091 ( 1.580 0.000 1.061) 1.903 13.104 ( -1.090 0.000 -0.720) 1.306 14.776 ( 1.374 0.000 1.239) 1.850 14.872 ( -1.539 0.000 -2.333) 2.794 15.020 ( 1.125 0.000 1.343) 1.752 15.095 ( 1.119 0.000 -0.698) 1.319 15.716 ( 3.055 0.000 2.266) 3.804 15.782 ( -1.786 0.000 -2.289) 2.903 ======================= Grid point 144 (50/190) ======================= q-point: (-0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.899 ( -10.460 0.000 -4.396) 11.346 2.148 ( 1.624 0.000 3.221) 3.607 2.370 ( -12.631 0.000 0.725) 12.652 2.397 ( -9.804 0.000 6.826) 11.946 2.786 ( -7.789 0.000 -10.649) 13.194 2.804 ( -6.045 0.000 -2.727) 6.632 2.988 ( 12.567 0.000 18.056) 21.999 3.353 ( 8.518 0.000 3.783) 9.320 3.412 ( -0.705 0.000 -12.772) 12.791 3.867 ( -4.790 0.000 -11.845) 12.777 4.093 ( -2.518 0.000 12.121) 12.380 4.204 ( -0.463 0.000 -0.802) 0.926 4.408 ( 10.047 0.000 6.213) 11.813 4.978 ( 8.267 0.000 -0.832) 8.309 5.035 ( -4.061 0.000 -9.331) 10.176 5.458 ( 5.129 0.000 -7.465) 9.057 5.949 ( -7.086 0.000 9.260) 11.660 6.119 ( -10.715 0.000 -2.262) 10.951 6.223 ( -3.453 0.000 1.848) 3.916 6.283 ( 1.235 0.000 2.199) 2.522 6.471 ( -2.464 0.000 0.621) 2.541 6.573 ( 3.783 0.000 0.788) 3.864 6.848 ( -4.196 0.000 0.680) 4.250 6.962 ( -14.060 0.000 0.413) 14.066 7.064 ( -9.284 0.000 0.912) 9.329 7.316 ( -1.102 0.000 -1.717) 2.040 7.458 ( -4.328 0.000 -3.718) 5.706 7.572 ( -8.227 0.000 3.096) 8.790 8.047 ( 8.524 0.000 -10.102) 13.218 8.271 ( 6.567 0.000 0.259) 6.572 8.318 ( 3.833 0.000 2.314) 4.477 8.589 ( 12.242 0.000 6.907) 14.056 9.133 ( -0.185 0.000 0.459) 0.495 9.200 ( -0.737 0.000 -1.204) 1.412 13.082 ( -0.938 0.000 -1.299) 1.602 13.133 ( 2.566 0.000 1.946) 3.221 14.821 ( 2.922 0.000 1.981) 3.530 14.851 ( -0.039 0.000 -2.014) 2.014 15.052 ( 1.870 0.000 1.034) 2.137 15.114 ( 0.966 0.000 -1.971) 2.195 15.749 ( -1.129 0.000 -4.123) 4.275 15.800 ( 5.145 0.000 4.094) 6.575 ======================= Grid point 145 (51/190) ======================= q-point: (-0.33 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.642 ( -14.717 0.000 -6.058) 15.915 1.988 ( -17.017 0.000 1.350) 17.071 2.119 ( -12.910 0.000 1.053) 12.953 2.343 ( 2.222 0.000 6.638) 7.000 2.592 ( -10.422 0.000 -10.216) 14.594 2.636 ( -11.135 0.000 -1.391) 11.222 3.291 ( 14.728 0.000 19.444) 24.393 3.432 ( 4.351 0.000 -12.821) 13.540 3.462 ( 0.481 0.000 0.628) 0.791 3.745 ( -3.572 0.000 -3.984) 5.351 4.030 ( -5.678 0.000 9.427) 11.004 4.258 ( 4.922 0.000 -3.602) 6.099 4.597 ( 7.858 0.000 4.369) 8.991 4.889 ( -7.982 0.000 -3.874) 8.872 5.166 ( 8.888 0.000 -1.353) 8.990 5.571 ( 7.218 0.000 -4.757) 8.644 5.801 ( -7.834 0.000 1.979) 8.080 5.873 ( -12.585 0.000 -3.806) 13.147 6.158 ( -4.516 0.000 1.205) 4.674 6.234 ( -8.854 0.000 -1.671) 9.010 6.396 ( -5.464 0.000 2.590) 6.047 6.589 ( -4.084 0.000 -1.033) 4.212 6.696 ( 0.042 0.000 4.921) 4.922 6.840 ( -11.449 0.000 -2.059) 11.632 6.914 ( 1.188 0.000 4.171) 4.337 7.279 ( -2.729 0.000 0.802) 2.844 7.350 ( -5.939 0.000 -3.808) 7.055 7.462 ( -4.074 0.000 2.438) 4.748 8.145 ( 3.123 0.000 -10.466) 10.922 8.362 ( 3.621 0.000 -1.006) 3.759 8.428 ( 6.799 0.000 1.457) 6.954 8.861 ( 13.205 0.000 9.819) 16.456 9.134 ( 0.401 0.000 -0.335) 0.523 9.182 ( -0.850 0.000 -1.121) 1.407 13.064 ( -0.693 0.000 -1.484) 1.638 13.199 ( 3.760 0.000 2.560) 4.549 14.866 ( 1.882 0.000 -1.244) 2.256 14.894 ( 4.060 0.000 2.698) 4.874 15.092 ( 2.042 0.000 -0.137) 2.047 15.122 ( 0.210 0.000 -2.944) 2.952 15.721 ( -0.895 0.000 -5.826) 5.895 15.930 ( 7.290 0.000 5.480) 9.120 ======================= Grid point 146 (52/190) ======================= q-point: (-0.27 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.320 ( -16.871 0.000 -5.585) 17.771 1.611 ( -20.786 0.000 1.601) 20.848 1.877 ( -12.089 0.000 1.555) 12.188 2.335 ( -12.990 0.000 -14.209) 19.252 2.354 ( -17.941 0.000 1.197) 17.981 2.405 ( 1.275 0.000 7.244) 7.355 3.377 ( -6.437 0.000 -4.832) 8.049 3.510 ( 4.595 0.000 -9.769) 10.796 3.603 ( 12.623 0.000 15.665) 20.118 3.724 ( -0.791 0.000 -0.905) 1.202 3.919 ( -5.538 0.000 7.831) 9.592 4.336 ( 2.094 0.000 0.295) 2.114 4.720 ( 4.341 0.000 1.995) 4.777 4.730 ( -6.439 0.000 0.050) 6.439 5.295 ( 3.341 0.000 2.377) 4.100 5.599 ( -10.907 0.000 1.964) 11.082 5.681 ( -3.930 0.000 -4.561) 6.020 5.746 ( 7.051 0.000 -6.682) 9.714 5.980 ( -12.900 0.000 -5.268) 13.935 6.033 ( -8.128 0.000 -1.873) 8.341 6.287 ( -5.359 0.000 4.890) 7.254 6.573 ( 1.567 0.000 2.782) 3.193 6.667 ( -5.665 0.000 -3.732) 6.783 6.745 ( 2.494 0.000 3.597) 4.377 6.949 ( 1.261 0.000 3.287) 3.521 7.208 ( -4.805 0.000 2.527) 5.429 7.223 ( -6.134 0.000 -3.355) 6.992 7.405 ( -2.369 0.000 1.246) 2.677 8.143 ( -1.153 0.000 -9.517) 9.586 8.422 ( 2.859 0.000 -0.998) 3.028 8.564 ( 6.592 0.000 0.105) 6.592 9.101 ( 6.018 0.000 12.141) 13.551 9.165 ( -0.656 0.000 -0.758) 1.002 9.170 ( 6.758 0.000 -1.770) 6.986 13.051 ( -0.395 0.000 -1.342) 1.399 13.288 ( 4.936 0.000 2.575) 5.568 14.919 ( 3.530 0.000 -0.610) 3.583 14.985 ( 4.633 0.000 3.403) 5.749 15.115 ( -0.321 0.000 -2.805) 2.823 15.126 ( 1.448 0.000 -2.223) 2.653 15.691 ( -1.131 0.000 -7.208) 7.296 16.099 ( 8.756 0.000 6.334) 10.807 ======================= Grid point 147 (53/190) ======================= q-point: (-0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.983 ( -16.613 0.000 -1.514) 16.682 1.204 ( -21.088 0.000 2.668) 21.256 1.657 ( -10.723 0.000 2.177) 10.942 1.943 ( -24.455 0.000 4.363) 24.841 2.018 ( -16.742 0.000 -12.134) 20.677 2.424 ( -0.658 0.000 1.217) 1.384 3.247 ( -5.620 0.000 -5.994) 8.217 3.484 ( -9.047 0.000 3.709) 9.778 3.635 ( -8.696 0.000 -3.309) 9.304 3.736 ( 4.796 0.000 -12.748) 13.620 4.020 ( 11.959 0.000 18.522) 22.047 4.310 ( -4.124 0.000 5.118) 6.573 4.704 ( 3.311 0.000 4.043) 5.226 4.779 ( 1.633 0.000 0.927) 1.877 5.293 ( -3.260 0.000 4.247) 5.354 5.366 ( -12.273 0.000 0.919) 12.308 5.582 ( -7.319 0.000 -4.019) 8.350 5.841 ( 1.257 0.000 -7.389) 7.496 5.850 ( -2.733 0.000 -0.618) 2.802 5.915 ( 3.184 0.000 -5.332) 6.211 6.228 ( -1.398 0.000 5.330) 5.511 6.590 ( -2.065 0.000 -3.271) 3.868 6.615 ( 1.701 0.000 0.934) 1.941 6.797 ( 2.261 0.000 3.222) 3.936 6.962 ( -0.468 0.000 0.738) 0.873 7.105 ( -6.006 0.000 2.829) 6.639 7.113 ( -4.304 0.000 -1.670) 4.617 7.364 ( -2.234 0.000 -0.052) 2.235 8.078 ( -3.665 0.000 -7.833) 8.648 8.471 ( 2.303 0.000 -0.726) 2.415 8.677 ( 5.000 0.000 -0.891) 5.079 9.145 ( 0.762 0.000 2.497) 2.610 9.156 ( -0.187 0.000 -0.117) 0.221 9.382 ( 10.896 0.000 7.498) 13.227 13.044 ( -0.094 0.000 -1.003) 1.008 13.395 ( 5.478 0.000 1.606) 5.709 14.991 ( 3.433 0.000 -0.776) 3.520 15.082 ( 4.560 0.000 4.276) 6.251 15.110 ( 0.739 0.000 -1.043) 1.278 15.135 ( -0.004 0.000 -4.651) 4.651 15.650 ( -1.774 0.000 -7.711) 7.912 16.283 ( 8.705 0.000 6.842) 11.072 ======================= Grid point 148 (54/190) ======================= q-point: (-0.13 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.691 ( -13.201 0.000 8.612) 15.761 0.811 ( -19.598 0.000 5.371) 20.320 1.403 ( -25.839 0.000 8.806) 27.298 1.508 ( -10.139 0.000 2.679) 10.487 1.656 ( -17.681 0.000 -11.685) 21.193 2.383 ( -3.187 0.000 -2.116) 3.826 3.135 ( -5.486 0.000 -3.466) 6.489 3.246 ( -13.623 0.000 2.967) 13.943 3.406 ( -11.820 0.000 -4.881) 12.788 3.837 ( 7.361 0.000 -16.433) 18.006 4.248 ( -2.929 0.000 6.355) 6.997 4.287 ( 11.093 0.000 15.859) 19.354 4.796 ( 0.039 0.000 1.952) 1.953 4.830 ( 7.841 0.000 8.023) 11.218 5.139 ( -10.683 0.000 0.391) 10.690 5.221 ( -4.173 0.000 0.644) 4.223 5.439 ( -5.231 0.000 2.883) 5.973 5.781 ( -2.168 0.000 1.898) 2.882 5.920 ( 6.138 0.000 -5.404) 8.177 5.987 ( 2.896 0.000 -6.924) 7.505 6.256 ( 2.868 0.000 6.621) 7.216 6.562 ( -0.673 0.000 -1.474) 1.620 6.624 ( -1.011 0.000 -0.932) 1.374 6.842 ( 1.821 0.000 2.166) 2.830 6.937 ( -1.400 0.000 -3.169) 3.465 6.996 ( -5.425 0.000 2.733) 6.075 7.059 ( -1.428 0.000 1.321) 1.945 7.311 ( -2.834 0.000 -2.195) 3.585 7.989 ( -3.892 0.000 -5.087) 6.405 8.509 ( 1.642 0.000 -0.455) 1.704 8.755 ( 3.239 0.000 -1.908) 3.759 9.156 ( -0.002 0.000 -0.703) 0.703 9.158 ( 0.315 0.000 0.723) 0.788 9.587 ( 8.276 0.000 3.732) 9.079 13.043 ( 0.196 0.000 -0.488) 0.526 13.497 ( 4.522 0.000 -0.498) 4.549 15.029 ( 0.846 0.000 -0.371) 0.923 15.115 ( -0.569 0.000 -3.517) 3.563 15.158 ( 3.791 0.000 0.738) 3.863 15.177 ( 4.332 0.000 7.133) 8.345 15.595 ( -2.558 0.000 -6.549) 7.031 16.445 ( 6.251 0.000 6.944) 9.343 ======================= Grid point 149 (55/190) ======================= q-point: (-0.07 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.484 ( -14.260 0.000 11.808) 18.515 0.526 ( -7.034 0.000 20.836) 21.992 0.875 ( -25.919 0.000 18.939) 32.101 1.329 ( -12.444 0.000 -11.076) 16.660 1.434 ( 0.571 0.000 -0.009) 0.572 2.319 ( -1.839 0.000 -2.520) 3.120 3.005 ( -6.958 0.000 0.590) 6.983 3.005 ( -10.861 0.000 -2.988) 11.265 3.263 ( -0.617 0.000 -0.485) 0.785 3.941 ( 5.418 0.000 -15.015) 15.963 4.211 ( -2.057 0.000 5.680) 6.041 4.478 ( 5.790 0.000 9.132) 10.812 4.787 ( -1.823 0.000 4.057) 4.448 4.940 ( -3.665 0.000 -4.837) 6.069 4.980 ( -4.771 0.000 1.989) 5.169 5.197 ( 5.278 0.000 2.498) 5.839 5.489 ( 13.799 0.000 20.262) 24.514 5.761 ( -1.027 0.000 2.014) 2.261 6.022 ( 2.598 0.000 -5.664) 6.231 6.034 ( 6.212 0.000 0.046) 6.213 6.329 ( 2.637 0.000 6.134) 6.676 6.549 ( -0.782 0.000 1.385) 1.591 6.579 ( -2.914 0.000 -2.632) 3.927 6.878 ( 1.858 0.000 0.191) 1.868 6.902 ( -1.797 0.000 -4.315) 4.674 6.912 ( -3.529 0.000 2.205) 4.162 7.056 ( 0.945 0.000 3.446) 3.573 7.264 ( -0.946 0.000 -2.857) 3.010 7.926 ( -1.491 0.000 -2.464) 2.880 8.531 ( 0.490 0.000 -0.889) 1.015 8.798 ( 1.609 0.000 -2.787) 3.218 9.092 ( -10.696 0.000 -11.772) 15.905 9.170 ( 0.636 0.000 1.607) 1.729 9.592 ( -12.553 0.000 -18.201) 22.110 13.056 ( 1.390 0.000 1.808) 2.280 13.557 ( 1.647 0.000 -3.289) 3.678 15.046 ( 1.178 0.000 2.255) 2.544 15.167 ( 4.960 0.000 1.646) 5.226 15.230 ( 2.862 0.000 0.565) 2.918 15.389 ( 26.180 0.000 31.073) 40.632 15.534 ( -1.874 0.000 -1.946) 2.702 16.531 ( 0.982 0.000 5.697) 5.781 ======================= Grid point 150 (56/190) ======================= q-point: ( 0.00 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.522 ( -4.939 16.211 10.279) 19.820 0.641 ( -0.255 16.829 14.195) 22.018 1.200 ( 3.724 34.381 18.398) 39.172 1.271 ( 2.329 9.614 -8.564) 13.085 1.568 ( -0.496 15.520 -2.777) 15.774 2.414 ( 5.641 3.686 -5.654) 8.796 2.708 ( -6.120 -2.501 0.090) 6.612 3.024 ( -1.052 8.233 -4.032) 9.227 3.190 ( -0.101 -10.031 1.853) 10.202 3.843 ( -2.618 -12.429 -16.656) 20.947 4.010 ( -0.490 -15.100 2.401) 15.298 4.210 ( -2.578 -25.766 -0.234) 25.896 4.721 ( 0.625 7.323 13.657) 15.509 4.927 ( 3.213 -1.767 2.029) 4.191 5.097 ( 2.728 1.738 9.055) 9.615 5.393 ( -0.107 13.076 2.628) 13.338 5.564 ( 0.291 -8.431 9.248) 12.517 5.706 ( -0.108 -1.208 1.115) 1.647 5.910 ( 3.315 -16.933 -2.590) 17.448 6.127 ( -1.015 -6.295 0.112) 6.377 6.339 ( -0.744 -6.143 -9.944) 11.712 6.402 ( 0.176 -13.632 -0.241) 13.635 6.787 ( 3.763 10.067 -5.899) 12.259 6.815 ( -3.217 5.827 3.036) 7.316 6.932 ( -0.625 5.198 -1.542) 5.458 7.090 ( 1.145 12.600 -4.695) 13.495 7.344 ( 3.891 11.882 2.975) 12.852 7.391 ( 4.328 6.007 1.430) 7.541 7.850 ( -8.324 -8.673 2.161) 12.214 7.941 ( -11.960 -6.967 1.950) 13.978 8.564 ( 0.285 1.254 0.829) 1.530 8.798 ( -1.699 -3.436 -0.222) 3.840 9.175 ( -0.411 -0.895 2.074) 2.297 9.459 ( -4.399 3.621 -9.620) 11.181 13.131 ( 1.394 4.269 3.511) 5.700 13.556 ( 0.382 -0.798 -2.950) 3.080 15.082 ( -0.314 -1.778 2.113) 2.779 15.231 ( -0.090 -0.702 0.038) 0.709 15.293 ( 0.850 5.382 0.267) 5.456 15.594 ( -3.418 11.242 -5.166) 12.835 16.341 ( 2.218 -6.647 6.895) 9.831 16.876 ( 19.418 7.467 -15.168) 25.747 ======================= Grid point 151 (57/190) ======================= q-point: ( 0.07 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.619 ( 12.373 13.432 7.299) 19.667 0.768 ( 9.847 12.339 15.094) 21.842 1.386 ( 7.540 11.467 -3.059) 14.061 1.421 ( 14.977 17.613 7.873) 24.424 1.630 ( 9.250 23.464 0.372) 25.224 2.525 ( 2.450 -9.235 -15.573) 18.271 2.658 ( 4.777 10.512 9.517) 14.964 3.077 ( 4.141 3.947 -3.430) 6.670 3.216 ( 5.973 -3.743 -0.129) 7.050 3.693 ( -9.319 -12.480 -15.316) 21.844 4.037 ( 2.787 -12.817 1.761) 13.234 4.244 ( 5.082 -23.663 0.092) 24.203 4.677 ( -6.197 5.892 11.544) 14.366 5.010 ( 3.516 -1.474 6.132) 7.220 5.148 ( 1.705 9.586 6.488) 11.700 5.367 ( -3.310 5.849 4.995) 8.373 5.540 ( -1.749 -13.417 2.658) 13.789 5.724 ( 1.304 6.372 0.890) 6.565 5.929 ( -0.504 -15.397 -1.045) 15.441 6.115 ( -0.490 -10.889 5.581) 12.246 6.270 ( -3.287 -0.056 -11.833) 12.282 6.443 ( 3.681 -13.642 -0.558) 14.140 6.684 ( -7.007 7.610 3.121) 10.805 6.808 ( -0.410 6.217 -4.675) 7.790 6.929 ( 0.135 7.884 1.786) 8.085 7.093 ( 0.286 9.370 -3.823) 10.123 7.286 ( -5.579 11.481 1.480) 12.850 7.400 ( -0.762 8.194 2.761) 8.680 7.982 ( 18.528 -8.480 -13.602) 24.499 8.037 ( 9.240 -6.211 5.643) 12.482 8.565 ( -0.485 0.088 2.402) 2.453 8.769 ( -1.224 -3.455 -0.807) 3.753 9.168 ( -0.644 -1.911 2.729) 3.393 9.383 ( -2.228 3.607 -5.832) 7.210 13.160 ( 0.753 3.852 4.924) 6.297 13.509 ( -4.172 2.849 -6.246) 8.033 15.079 ( -0.788 -3.343 3.904) 5.200 15.179 ( -4.325 -1.052 -0.747) 4.513 15.303 ( -0.230 5.568 2.740) 6.210 15.505 ( -4.732 10.673 -4.786) 12.618 16.263 ( -7.896 -4.849 0.068) 9.266 16.829 ( -16.195 1.933 1.373) 16.367 ======================= Grid point 152 (58/190) ======================= q-point: ( 0.13 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.934 ( 17.192 6.638 5.998) 19.381 1.041 ( 14.859 7.641 13.705) 21.611 1.511 ( 7.059 8.276 -4.109) 11.628 1.742 ( 15.240 9.367 -4.639) 18.480 1.919 ( 17.684 24.319 6.084) 30.678 2.502 ( 1.455 -4.381 -11.546) 12.435 2.854 ( 9.211 2.057 7.834) 12.266 3.128 ( 4.223 1.471 -3.866) 5.911 3.449 ( -3.338 -6.266 -10.241) 12.461 3.472 ( 8.639 -1.052 -5.791) 10.453 4.109 ( 3.866 -6.963 1.729) 8.150 4.372 ( 7.530 -22.070 -0.648) 23.328 4.553 ( -7.919 3.920 12.246) 15.100 5.076 ( 1.706 -6.374 8.376) 10.663 5.170 ( -0.712 8.727 8.995) 12.553 5.339 ( 1.202 0.035 -1.002) 1.566 5.531 ( 0.276 -8.771 -0.944) 8.826 5.763 ( 3.179 12.592 -0.742) 13.008 5.898 ( -2.434 -12.566 -0.396) 12.806 6.121 ( -1.235 -6.163 4.609) 7.794 6.210 ( 0.393 0.236 -6.744) 6.759 6.528 ( 4.924 -11.995 -1.783) 13.088 6.580 ( -4.991 5.921 1.229) 7.841 6.785 ( -0.708 4.667 -3.051) 5.621 6.939 ( 0.665 7.543 1.799) 7.783 7.090 ( -0.150 4.989 -3.348) 6.010 7.217 ( -1.779 10.264 1.356) 10.505 7.411 ( 1.493 10.058 0.768) 10.197 8.198 ( 7.338 -7.757 -3.093) 11.117 8.267 ( 10.601 -9.167 -8.125) 16.200 8.549 ( -1.834 -2.087 2.412) 3.679 8.752 ( -0.521 -4.084 2.258) 4.696 9.159 ( -0.828 -3.244 3.133) 4.586 9.341 ( -1.517 2.405 -3.078) 4.191 13.175 ( -0.155 3.251 4.534) 5.582 13.395 ( -5.795 5.243 -6.361) 10.077 15.045 ( -3.724 -3.724 1.910) 5.602 15.088 ( -4.181 -2.159 0.341) 4.718 15.300 ( -0.697 5.348 3.715) 6.549 15.403 ( -4.671 8.741 -3.032) 10.364 16.083 ( -9.448 -2.212 -5.870) 11.341 16.506 ( -15.644 3.528 9.944) 18.869 ======================= Grid point 153 (59/190) ======================= q-point: ( 0.20 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.279 ( 16.942 2.552 4.941) 17.831 1.370 ( 16.273 4.586 11.677) 20.548 1.662 ( 8.853 5.712 -3.674) 11.158 1.924 ( 5.462 6.511 -14.895) 17.149 2.280 ( 17.195 15.762 4.497) 23.756 2.595 ( 8.995 2.065 -3.835) 9.994 2.976 ( 3.269 -5.834 1.004) 6.763 3.211 ( -10.192 -7.226 -10.198) 16.128 3.264 ( 8.172 3.574 1.348) 9.021 3.794 ( 15.450 3.922 -1.738) 16.034 4.176 ( 2.263 -2.652 -0.074) 3.487 4.432 ( -5.274 0.408 12.437) 13.516 4.517 ( 6.074 -15.185 -1.009) 16.385 5.083 ( -2.016 -2.924 14.822) 15.242 5.209 ( 3.468 -0.770 1.640) 3.912 5.381 ( 2.601 -1.420 -2.576) 3.927 5.543 ( 1.553 -9.776 -2.600) 10.235 5.809 ( -1.062 0.422 -6.837) 6.932 5.902 ( 6.639 5.196 4.069) 9.361 6.054 ( -4.423 -0.492 -3.460) 5.637 6.290 ( 6.877 1.528 2.341) 7.424 6.464 ( -6.831 5.569 -1.997) 9.037 6.620 ( 4.428 -10.576 -0.770) 11.491 6.779 ( 0.540 4.361 -1.807) 4.751 6.962 ( 1.349 5.814 1.710) 6.209 7.089 ( 1.253 -1.211 -3.742) 4.128 7.215 ( 0.740 8.831 3.817) 9.649 7.453 ( 2.510 10.466 -0.116) 10.764 8.282 ( 2.627 -6.712 -8.732) 11.323 8.394 ( 3.707 -4.995 -3.346) 7.063 8.498 ( -3.549 -5.223 0.637) 6.347 8.748 ( -1.236 -4.958 6.814) 8.517 9.146 ( -1.091 -4.443 2.649) 5.287 9.309 ( -1.510 1.659 -0.922) 2.425 13.167 ( -1.240 2.266 1.753) 3.121 13.285 ( -4.147 6.094 -2.973) 7.948 14.959 ( -4.396 -3.007 -0.178) 5.329 15.013 ( -4.082 -2.584 1.014) 4.936 15.263 ( -3.617 6.121 -2.118) 7.418 15.342 ( -1.353 5.311 4.386) 7.020 15.893 ( -8.371 -1.080 -8.480) 11.965 16.266 ( -10.990 2.224 8.773) 14.237 ======================= Grid point 154 (60/190) ======================= q-point: ( 0.27 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.600 ( 14.894 0.415 4.071) 15.445 1.700 ( 15.235 1.469 7.232) 16.928 1.803 ( 5.292 1.085 -7.709) 9.413 1.998 ( 7.377 8.093 -9.680) 14.615 2.560 ( 10.371 6.129 -0.981) 12.086 2.770 ( 7.145 2.858 -0.290) 7.701 3.001 ( -2.246 -4.222 -0.544) 4.813 3.071 ( 0.892 -2.436 -7.443) 7.882 3.407 ( 5.273 -0.115 5.974) 7.969 3.992 ( 3.259 9.454 1.612) 10.129 4.205 ( 2.204 -9.867 -1.587) 10.234 4.392 ( -1.320 1.759 9.929) 10.170 4.576 ( -0.403 -5.909 -1.715) 6.166 5.109 ( 3.090 0.736 14.551) 14.894 5.237 ( -1.981 -2.303 -5.458) 6.246 5.433 ( 3.045 -6.629 0.227) 7.298 5.599 ( 4.193 -6.487 -1.630) 7.894 5.773 ( 0.004 -3.608 -7.454) 8.282 5.975 ( -1.707 1.880 -3.552) 4.366 6.115 ( 13.179 7.590 2.187) 15.365 6.326 ( -6.052 1.991 -1.995) 6.676 6.456 ( 9.048 2.684 1.538) 9.562 6.692 ( 3.053 -5.806 0.778) 6.606 6.805 ( 2.706 4.948 -0.288) 5.646 6.999 ( 2.061 3.121 2.458) 4.476 7.124 ( 2.567 -2.963 -4.401) 5.894 7.250 ( 2.151 5.524 4.553) 7.474 7.503 ( 2.634 9.144 -0.566) 9.533 8.284 ( -0.559 -5.764 -11.665) 13.024 8.399 ( -3.137 1.044 -1.525) 3.641 8.431 ( -2.348 -8.267 0.576) 8.613 8.710 ( -4.376 -5.384 9.002) 11.365 9.127 ( -1.105 -4.975 1.639) 5.353 9.278 ( -1.642 0.765 0.168) 1.820 13.135 ( -1.769 2.365 -1.870) 3.495 13.227 ( -2.001 5.107 1.539) 5.696 14.885 ( -3.154 -2.999 -0.303) 4.363 14.935 ( -3.817 -2.166 0.748) 4.452 15.184 ( -3.480 5.519 -2.465) 6.975 15.325 ( -1.999 4.948 4.386) 6.908 15.740 ( -5.619 -1.441 -7.638) 9.591 16.096 ( -8.092 0.512 5.971) 10.069 ======================= Grid point 155 (61/190) ======================= q-point: ( 0.33 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.817 ( 1.982 -0.863 -10.925) 11.137 1.867 ( 11.362 -0.275 2.913) 11.733 2.017 ( 13.916 0.436 4.104) 14.515 2.189 ( 11.794 5.846 -1.603) 13.261 2.665 ( 1.202 -2.962 -3.224) 4.540 2.818 ( -0.680 -0.204 2.524) 2.622 3.021 ( 4.183 1.383 -0.761) 4.470 3.131 ( 4.085 0.740 -6.347) 7.585 3.492 ( 2.594 -2.969 7.202) 8.211 3.978 ( -2.533 8.494 2.814) 9.299 4.203 ( -4.604 -9.173 1.293) 10.344 4.385 ( -1.348 0.106 2.778) 3.089 4.537 ( -1.605 2.725 0.374) 3.185 5.131 ( -6.679 -0.052 -5.849) 8.878 5.247 ( 7.415 1.128 11.042) 13.348 5.442 ( -2.567 -3.305 -2.306) 4.778 5.638 ( -0.228 5.340 -6.277) 8.244 5.819 ( 5.751 -11.711 -3.598) 13.534 6.031 ( 8.036 -0.554 0.043) 8.055 6.237 ( -2.178 -5.635 0.770) 6.090 6.380 ( 11.540 8.112 -0.751) 14.126 6.602 ( 3.915 0.050 -0.567) 3.956 6.782 ( 7.991 -2.120 4.002) 9.185 6.896 ( 6.289 5.715 1.659) 8.658 7.046 ( 2.334 2.322 3.613) 4.888 7.162 ( 2.506 -1.682 -6.117) 6.821 7.316 ( 3.784 2.111 2.734) 5.123 7.553 ( 2.526 6.372 -0.617) 6.882 8.205 ( -6.056 -6.258 -10.451) 13.604 8.326 ( -3.040 -1.072 -2.987) 4.395 8.387 ( -2.542 -1.659 1.762) 3.510 8.603 ( -8.081 -4.869 8.945) 13.001 9.112 ( -0.655 -4.859 0.934) 4.991 9.246 ( -1.598 -0.436 0.133) 1.661 13.104 ( -0.946 2.870 -1.993) 3.620 13.199 ( -1.408 3.692 2.196) 4.520 14.829 ( -2.702 -1.880 -0.464) 3.324 14.877 ( -2.126 -3.155 0.927) 3.916 15.127 ( -1.990 4.886 -0.951) 5.361 15.269 ( -4.044 5.809 1.035) 7.153 15.656 ( -2.041 -2.152 -4.287) 5.213 15.965 ( -6.186 -1.130 3.457) 7.176 ======================= Grid point 156 (62/190) ======================= q-point: ( 0.40 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.851 ( 3.533 -1.036 -6.840) 7.768 2.051 ( 6.656 0.855 2.784) 7.265 2.262 ( 10.519 -1.705 1.250) 10.729 2.424 ( 12.039 2.248 0.411) 12.254 2.653 ( -1.148 -4.647 2.650) 5.471 2.798 ( -2.025 -2.268 2.125) 3.710 3.091 ( 2.819 2.069 -5.690) 6.679 3.168 ( 0.144 1.227 -3.038) 3.279 3.550 ( 2.567 -5.573 5.310) 8.115 3.942 ( -2.066 2.164 0.415) 3.021 4.057 ( -7.997 -1.898 0.786) 8.256 4.334 ( -3.758 3.845 1.420) 5.561 4.534 ( 0.379 3.862 2.397) 4.561 4.988 ( -6.838 4.168 -1.546) 8.156 5.281 ( -4.405 -4.285 -11.500) 13.039 5.438 ( 0.807 1.372 6.545) 6.736 5.661 ( 6.767 10.980 -3.075) 13.260 5.935 ( 5.295 -12.631 1.502) 13.779 6.191 ( 2.953 -9.580 -0.754) 10.053 6.255 ( 6.716 -3.414 3.345) 8.243 6.534 ( 4.760 7.828 -0.689) 9.187 6.608 ( -2.040 1.768 0.737) 2.798 6.937 ( 2.914 -0.484 3.313) 4.439 7.063 ( 7.692 2.063 3.881) 8.859 7.121 ( 7.502 -0.522 2.005) 7.783 7.234 ( 7.005 -0.776 -7.947) 10.622 7.407 ( 5.713 2.507 0.065) 6.239 7.603 ( 2.899 3.241 0.257) 4.356 8.023 ( -10.468 -5.042 -7.427) 13.790 8.259 ( -4.032 -0.510 -2.459) 4.750 8.350 ( -1.671 -0.758 1.700) 2.501 8.439 ( -9.114 -2.517 6.667) 11.569 9.105 ( -0.171 -4.381 0.704) 4.441 9.217 ( -1.357 -1.788 -0.335) 2.270 13.092 ( -0.015 3.018 -1.042) 3.193 13.176 ( -1.307 2.907 1.328) 3.453 14.782 ( -1.817 -0.733 -0.276) 1.979 14.851 ( -0.980 -4.188 0.713) 4.359 15.105 ( -0.302 4.578 0.288) 4.597 15.185 ( -4.165 5.997 -1.077) 7.380 15.636 ( 0.237 -1.988 -1.463) 2.480 15.865 ( -4.596 -2.570 1.439) 5.459 ======================= Grid point 157 (63/190) ======================= q-point: ( 0.47 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.932 ( 5.272 -1.355 -1.019) 5.538 2.127 ( 0.733 1.873 0.999) 2.246 2.442 ( 8.205 -2.148 1.753) 8.660 2.627 ( 2.799 -5.800 3.776) 7.465 2.639 ( 2.072 1.595 3.058) 4.024 2.754 ( -1.337 -6.556 2.702) 7.216 3.062 ( -4.905 1.720 -8.079) 9.607 3.168 ( 1.429 2.254 -1.532) 3.078 3.595 ( 0.096 -5.814 -2.474) 6.319 3.860 ( -3.233 -5.696 5.502) 8.554 3.993 ( -0.361 4.305 -4.978) 6.591 4.267 ( -2.663 6.022 2.788) 7.151 4.538 ( -1.077 6.442 4.403) 7.877 4.885 ( -2.568 8.577 0.156) 8.954 5.176 ( -3.176 -4.201 -14.101) 15.053 5.415 ( -1.768 1.237 -3.072) 3.755 5.857 ( 9.968 8.409 6.994) 14.798 6.014 ( 2.429 -11.337 4.564) 12.460 6.203 ( 0.151 -11.350 -0.764) 11.377 6.372 ( 1.528 -5.407 1.154) 5.736 6.556 ( -2.475 5.267 1.718) 6.068 6.597 ( 2.317 6.834 0.294) 7.222 6.947 ( -1.333 3.937 2.408) 4.803 7.116 ( 1.059 -1.283 2.802) 3.258 7.254 ( 1.631 -4.857 -3.236) 6.060 7.426 ( 11.277 -0.609 -5.226) 12.444 7.534 ( 5.964 -0.116 -2.590) 6.503 7.656 ( -1.526 3.266 -0.516) 3.642 7.841 ( -0.834 -3.081 -1.380) 3.477 8.111 ( -11.253 -2.284 2.128) 11.678 8.302 ( -2.227 0.864 2.873) 3.737 8.365 ( 0.415 0.307 0.125) 0.531 9.104 ( -0.160 -3.776 0.722) 3.847 9.194 ( -0.860 -2.934 -0.847) 3.173 13.099 ( 0.791 3.056 -0.054) 3.157 13.153 ( -1.230 2.553 0.251) 2.845 14.761 ( -0.314 -0.327 0.245) 0.515 14.835 ( -0.765 -4.119 -0.015) 4.189 15.113 ( 0.953 4.045 0.391) 4.174 15.117 ( -2.331 5.982 -0.877) 6.479 15.652 ( 1.428 -1.633 0.282) 2.188 15.792 ( -2.919 -3.456 -0.293) 4.533 ======================= Grid point 158 (64/190) ======================= q-point: (-0.47 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.035 ( 3.274 -1.166 1.744) 3.888 2.093 ( -2.492 2.309 0.076) 3.398 2.507 ( -7.767 -3.600 2.267) 8.856 2.579 ( -5.397 -0.043 1.475) 5.595 2.664 ( 5.716 -7.991 5.777) 11.398 2.826 ( 3.774 -5.392 2.005) 6.880 2.944 ( -4.361 3.016 -4.413) 6.898 3.213 ( 3.578 2.005 -1.572) 4.392 3.528 ( -3.664 -0.137 -7.723) 8.550 3.907 ( 1.742 -9.600 14.328) 17.334 3.935 ( -2.073 1.376 -14.836) 15.043 4.277 ( 3.458 5.911 4.279) 8.075 4.497 ( -3.590 11.786 4.606) 13.154 4.916 ( 5.571 8.656 -0.731) 10.319 5.109 ( -1.908 -2.563 -11.474) 11.911 5.389 ( 0.123 -0.667 -5.917) 5.955 5.939 ( -3.925 -6.690 7.235) 10.607 6.107 ( 5.776 0.605 8.323) 10.149 6.210 ( 0.987 -9.922 -0.134) 9.972 6.307 ( -6.678 -4.564 -1.828) 8.292 6.526 ( -1.191 7.195 0.412) 7.305 6.639 ( 1.631 5.465 1.385) 5.869 6.917 ( -1.810 3.996 1.694) 4.702 7.119 ( -2.632 -3.389 2.493) 4.962 7.198 ( -6.589 -5.898 -4.255) 9.814 7.439 ( -9.560 4.837 -3.134) 11.163 7.534 ( 1.384 1.429 -2.682) 3.339 7.678 ( 0.486 -2.935 -2.286) 3.751 7.923 ( -2.763 -1.292 -1.459) 3.381 8.022 ( 11.727 -3.631 3.402) 12.739 8.302 ( 1.520 2.257 1.682) 3.199 8.407 ( 4.063 -0.536 1.602) 4.400 9.098 ( -0.573 -3.639 0.711) 3.752 9.182 ( -0.123 -3.055 -1.197) 3.284 13.121 ( 0.950 2.895 0.759) 3.140 13.131 ( -0.406 2.670 -0.541) 2.754 14.771 ( 1.135 -0.398 0.841) 1.468 14.821 ( -0.515 -3.327 -0.819) 3.465 15.095 ( 0.129 5.300 0.156) 5.304 15.137 ( 1.385 4.053 -0.487) 4.310 15.688 ( 1.770 -2.536 1.739) 3.548 15.755 ( -0.323 -2.519 -1.767) 3.094 ======================= Grid point 159 (65/190) ======================= q-point: (-0.40 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.924 ( -9.889 2.545 -4.417) 11.125 2.157 ( 2.530 0.578 5.076) 5.701 2.266 ( -14.481 -8.881 1.386) 17.043 2.423 ( -8.900 2.564 0.229) 9.265 2.785 ( 0.981 -2.148 -1.256) 2.675 2.817 ( -3.755 1.747 -5.876) 7.189 2.964 ( 7.609 -1.636 14.033) 16.046 3.284 ( 2.783 -5.211 -1.003) 5.993 3.496 ( 2.560 5.495 -6.930) 9.207 3.755 ( -10.049 -6.588 -1.086) 12.065 4.045 ( 6.795 -1.951 -2.136) 7.385 4.394 ( 6.746 0.060 5.483) 8.693 4.427 ( -4.216 14.412 3.049) 15.322 5.046 ( -2.956 2.131 -5.017) 6.201 5.066 ( 8.728 6.357 -3.770) 11.437 5.404 ( 2.576 -4.781 -6.561) 8.517 5.802 ( -10.131 -10.604 5.088) 15.523 6.143 ( -9.036 -1.389 -2.699) 9.532 6.166 ( -1.099 -1.908 5.290) 5.730 6.255 ( 2.717 -5.751 3.821) 7.420 6.491 ( -3.542 8.068 -1.910) 9.016 6.674 ( 2.118 3.479 1.696) 4.412 6.865 ( -6.571 1.607 0.280) 6.771 6.961 ( -7.496 -0.198 0.521) 7.517 7.064 ( -7.824 -1.638 0.522) 8.010 7.298 ( -5.367 2.038 -2.870) 6.418 7.510 ( -5.789 2.057 1.464) 6.316 7.567 ( -3.600 0.878 -0.522) 3.742 8.016 ( 7.627 -2.984 -8.682) 11.935 8.207 ( 6.644 -4.941 1.524) 8.418 8.356 ( 3.472 2.001 0.949) 4.118 8.551 ( 9.862 -3.436 5.911) 12.000 9.087 ( -0.609 -3.998 0.590) 4.087 9.183 ( 0.390 -1.935 -1.358) 2.396 13.108 ( -0.829 2.552 -1.049) 2.881 13.167 ( 2.605 3.160 1.480) 4.355 14.800 ( 1.271 -1.566 0.282) 2.037 14.824 ( 1.440 -2.033 -0.040) 2.491 15.118 ( 1.986 5.595 0.499) 5.958 15.160 ( 1.096 3.691 -1.446) 4.113 15.707 ( 0.410 -3.469 -1.362) 3.749 15.795 ( 4.287 -0.738 1.320) 4.545 ======================= Grid point 160 (66/190) ======================= q-point: (-0.33 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.676 ( -14.281 3.396 -6.319) 15.982 1.927 ( -17.358 -4.814 0.953) 18.039 2.141 ( -9.032 1.667 3.459) 9.814 2.339 ( 1.558 1.630 1.484) 2.700 2.650 ( -9.517 5.725 -9.166) 14.400 2.758 ( -5.404 7.890 1.802) 9.732 3.188 ( 10.089 -9.473 13.987) 19.676 3.308 ( 0.914 -8.938 -4.959) 10.262 3.549 ( -5.193 -0.920 5.130) 7.357 3.607 ( 4.029 1.017 -7.683) 8.735 4.163 ( 5.238 -1.141 -0.180) 5.364 4.332 ( -6.037 12.427 -0.272) 13.819 4.528 ( 5.220 -4.791 5.510) 8.976 4.949 ( -6.047 5.560 -1.572) 8.364 5.224 ( 6.909 2.575 -3.671) 8.237 5.467 ( 3.877 -7.907 -4.957) 10.106 5.600 ( -9.443 -11.047 3.131) 14.867 5.964 ( -8.624 0.867 -2.017) 8.899 6.097 ( -6.527 -4.965 0.274) 8.206 6.311 ( 0.028 -2.660 3.152) 4.125 6.341 ( -8.298 9.564 -2.825) 12.973 6.691 ( -5.108 2.936 0.219) 5.895 6.728 ( -0.406 2.027 3.938) 4.448 6.888 ( -8.085 2.633 -0.639) 8.527 6.923 ( -0.287 1.651 2.640) 3.126 7.191 ( -5.119 -0.808 -3.939) 6.510 7.392 ( -5.279 0.046 4.112) 6.692 7.535 ( -1.257 6.496 -1.051) 6.699 8.105 ( 2.825 -3.903 -9.648) 10.784 8.317 ( 4.865 -4.350 0.237) 6.531 8.435 ( 4.613 0.177 0.263) 4.624 8.770 ( 10.212 -8.009 8.554) 15.543 9.080 ( -0.101 -3.950 0.808) 4.033 9.195 ( 1.250 -0.249 -1.677) 2.106 13.093 ( -0.482 2.866 -1.297) 3.182 13.232 ( 3.699 3.034 1.942) 5.163 14.825 ( 1.764 -2.442 -0.627) 3.078 14.872 ( 2.909 -2.137 1.123) 3.780 15.158 ( 1.411 4.288 -1.902) 4.899 15.186 ( 2.474 6.321 0.443) 6.802 15.715 ( 0.948 -0.615 -4.396) 4.539 15.909 ( 6.726 -1.762 3.899) 7.971 ======================= Grid point 161 (67/190) ======================= q-point: (-0.27 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.365 ( -16.004 4.526 -5.222) 17.432 1.586 ( -17.770 -0.349 2.249) 17.915 1.938 ( -11.004 5.142 1.096) 12.195 2.373 ( -1.201 2.347 1.006) 2.821 2.412 ( -12.504 7.715 -11.715) 18.791 2.595 ( -11.029 15.241 5.118) 19.496 3.245 ( -4.064 -10.177 -1.942) 11.129 3.335 ( -0.091 -14.696 -2.344) 14.882 3.548 ( 6.529 -5.174 7.966) 11.526 3.736 ( 7.424 5.051 -0.262) 8.983 4.162 ( -9.120 14.941 0.744) 17.521 4.253 ( 1.276 -7.991 1.652) 8.259 4.603 ( 1.985 -8.257 2.336) 8.807 4.812 ( -7.813 5.380 2.747) 9.875 5.292 ( -1.140 -2.836 0.099) 3.058 5.385 ( -4.626 -13.820 -4.469) 15.243 5.629 ( 6.062 -1.778 2.071) 6.648 5.811 ( -6.350 -2.768 -2.468) 7.354 5.936 ( -7.729 -2.498 -5.154) 9.620 6.114 ( -10.105 10.886 -0.021) 14.853 6.367 ( 1.031 6.276 0.106) 6.361 6.607 ( -3.143 0.282 4.546) 5.534 6.693 ( -2.791 2.104 -1.764) 3.915 6.821 ( -0.055 2.744 1.126) 2.966 6.920 ( -0.816 -0.769 2.257) 2.520 7.094 ( -3.610 -0.292 -4.724) 5.952 7.317 ( -3.250 3.491 4.676) 6.679 7.504 ( -1.845 7.985 -0.265) 8.199 8.100 ( -1.395 -4.276 -8.810) 9.892 8.399 ( 3.671 -3.137 -0.378) 4.844 8.530 ( 4.805 -2.989 -0.800) 5.715 8.940 ( 4.776 -12.794 7.879) 15.766 9.092 ( 1.177 -2.718 3.062) 4.260 9.241 ( 4.410 0.776 -1.599) 4.755 13.085 ( -0.078 3.368 -1.225) 3.585 13.316 ( 4.565 2.442 1.647) 5.433 14.868 ( 2.668 -2.956 -0.738) 4.050 14.933 ( 3.088 -3.157 0.916) 4.511 15.173 ( 0.919 3.110 -1.613) 3.622 15.255 ( 4.162 10.796 0.734) 11.594 15.727 ( 1.206 3.205 -6.668) 7.496 16.065 ( 8.303 -2.912 5.226) 10.234 ======================= Grid point 162 (68/190) ======================= q-point: (-0.20 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.060 ( -14.321 7.910 0.014) 16.361 1.247 ( -17.317 5.258 3.467) 18.427 1.730 ( -10.258 6.614 -0.397) 12.211 2.089 ( -18.453 11.275 -2.874) 21.815 2.198 ( -16.309 17.287 -5.992) 24.510 2.474 ( -2.108 5.656 1.677) 6.264 3.138 ( -5.998 -8.015 -1.874) 10.185 3.295 ( -3.485 -13.568 -0.469) 14.017 3.683 ( 6.046 -7.207 -7.565) 12.072 3.770 ( -9.979 7.578 -1.229) 12.591 4.059 ( 3.717 2.391 9.419) 10.404 4.253 ( -1.560 -4.620 4.938) 6.940 4.612 ( -3.939 -15.245 5.089) 16.548 4.700 ( -0.772 1.341 1.592) 2.220 5.193 ( -6.445 -1.566 3.275) 7.397 5.357 ( -0.388 -14.227 -2.825) 14.510 5.662 ( -3.228 12.118 2.093) 12.714 5.729 ( -1.730 -4.155 -4.418) 6.307 5.859 ( -1.104 -5.649 -3.900) 6.953 5.979 ( -1.018 8.372 -0.110) 8.434 6.355 ( -1.523 10.407 0.519) 10.531 6.570 ( -2.471 -6.888 1.153) 7.408 6.662 ( 0.015 5.111 -1.713) 5.391 6.825 ( -0.424 -1.926 2.331) 3.053 6.898 ( -1.186 -1.069 0.672) 1.732 7.049 ( 0.058 5.860 -5.476) 8.020 7.279 ( -1.553 7.550 4.817) 9.089 7.460 ( -2.843 8.211 -0.214) 8.692 8.033 ( -3.735 -4.409 -7.131) 9.179 8.462 ( 2.799 -2.225 -0.110) 3.577 8.608 ( 3.197 -6.465 -2.358) 7.588 8.978 ( -1.071 -14.147 4.350) 14.840 9.129 ( 1.470 -1.682 4.748) 5.247 9.366 ( 7.744 -2.096 1.227) 8.115 13.085 ( 0.281 4.004 -1.008) 4.138 13.408 ( 4.480 0.919 0.324) 4.585 14.922 ( 3.120 -2.670 -0.698) 4.165 14.998 ( 3.441 -3.372 0.891) 4.899 15.196 ( 1.635 3.478 -0.966) 3.963 15.350 ( 5.456 15.514 1.586) 16.522 15.736 ( 0.991 7.541 -8.610) 11.488 16.242 ( 8.584 -3.618 5.917) 11.035 ======================= Grid point 163 (69/190) ======================= q-point: (-0.13 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.829 ( -9.755 12.879 8.419) 18.218 0.933 ( -15.358 10.646 5.819) 19.572 1.537 ( -9.497 7.710 -2.576) 12.501 1.682 ( -22.519 19.212 3.123) 29.765 1.858 ( -15.646 20.079 -5.126) 25.966 2.433 ( -2.304 4.198 -4.723) 6.726 3.001 ( -8.047 -6.127 1.255) 10.192 3.219 ( -3.338 -9.944 -1.063) 10.543 3.462 ( -17.095 7.562 -3.144) 18.955 3.776 ( 5.521 -8.023 -15.417) 18.235 4.120 ( -2.473 -11.380 4.424) 12.457 4.317 ( 6.796 -3.300 8.462) 11.344 4.511 ( -4.677 -13.889 10.725) 18.160 4.770 ( 5.450 -5.336 3.100) 8.233 5.079 ( -5.455 -1.922 3.422) 6.720 5.349 ( 0.010 -4.121 2.625) 4.886 5.582 ( -4.292 18.272 1.233) 18.810 5.723 ( 0.762 -3.784 -1.389) 4.102 5.808 ( -1.049 -5.672 -4.382) 7.244 6.055 ( 5.308 0.469 -0.438) 5.346 6.336 ( -0.336 4.967 0.961) 5.070 6.498 ( -4.273 -9.379 -2.932) 10.715 6.673 ( 0.834 6.085 0.618) 6.173 6.806 ( -1.236 -2.911 2.422) 3.983 6.901 ( 1.276 1.942 0.051) 2.325 7.062 ( 1.658 11.858 -6.458) 13.605 7.274 ( 0.246 10.907 4.747) 11.898 7.391 ( -3.839 7.525 -1.337) 8.553 7.944 ( -3.955 -4.362 -4.651) 7.503 8.507 ( 1.722 -2.772 0.874) 3.378 8.633 ( -0.657 -11.808 -4.717) 12.732 8.933 ( -4.208 -14.742 4.580) 16.000 9.159 ( 0.875 -0.901 3.338) 3.566 9.511 ( 6.022 -5.300 0.123) 8.023 13.092 ( 0.483 4.605 -0.749) 4.690 13.482 ( 2.992 -1.439 -1.196) 3.529 15.009 ( 6.370 0.308 1.128) 6.477 15.059 ( 2.270 -3.396 0.543) 4.121 15.232 ( 2.300 4.360 -1.455) 5.140 15.490 ( 9.120 20.576 5.496) 23.168 15.739 ( 1.526 13.785 -10.596) 17.454 16.408 ( 7.159 -2.971 5.753) 9.653 ======================= Grid point 164 (70/190) ======================= q-point: (-0.07 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.676 ( -10.626 13.700 10.215) 20.123 0.708 ( -7.155 15.053 13.181) 21.249 1.284 ( -15.421 34.996 12.270) 40.163 1.358 ( -8.403 5.349 -9.111) 13.499 1.629 ( -6.508 18.071 -1.627) 19.276 2.383 ( -0.881 4.947 -6.629) 8.318 2.844 ( -7.897 -4.880 1.854) 9.467 3.153 ( -9.403 6.377 -2.320) 11.596 3.191 ( -2.643 -7.136 -1.829) 7.827 3.847 ( 4.162 -10.379 -16.450) 19.891 4.053 ( -3.847 -14.502 1.818) 15.114 4.316 ( -5.941 -26.773 -1.285) 27.455 4.595 ( 7.628 7.295 18.569) 21.359 4.880 ( 3.715 -9.525 2.056) 10.428 5.025 ( 0.327 0.797 8.269) 8.313 5.373 ( 1.431 5.736 4.436) 7.391 5.530 ( -0.754 13.681 5.350) 14.709 5.720 ( -1.002 -3.014 1.733) 3.619 5.833 ( 3.884 -12.841 -4.638) 14.195 6.128 ( 1.952 0.362 -2.876) 3.494 6.344 ( 0.503 -10.512 1.199) 10.592 6.422 ( -1.899 -5.436 -6.514) 8.695 6.703 ( 2.873 9.197 1.511) 9.753 6.811 ( 1.054 2.821 3.212) 4.403 6.929 ( 1.255 3.224 -0.690) 3.527 7.076 ( 0.893 13.804 -6.099) 15.118 7.288 ( -0.578 14.835 4.215) 15.433 7.343 ( 0.821 6.064 -1.162) 6.228 7.877 ( -1.961 -4.722 -2.385) 5.642 8.451 ( -17.326 -30.112 -0.233) 34.742 8.558 ( -0.601 1.354 -3.014) 3.358 8.847 ( -4.112 -7.708 3.312) 9.343 9.174 ( 0.165 -0.588 2.211) 2.294 9.555 ( -1.674 -3.471 -8.111) 8.979 13.103 ( 0.890 4.836 0.623) 4.957 13.527 ( 2.120 -2.424 -0.920) 3.349 15.083 ( 0.294 -2.090 0.035) 2.111 15.159 ( 6.936 0.134 2.070) 7.239 15.272 ( 1.766 4.749 -1.705) 5.346 15.641 ( 0.520 10.195 -1.271) 10.287 15.945 ( 27.754 27.940 1.716) 39.420 16.544 ( 7.630 3.343 1.481) 8.460 ======================= Grid point 165 (71/190) ======================= q-point: ( 0.00 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.878 ( -1.643 19.014 6.528) 20.171 0.986 ( -0.980 17.838 7.988) 19.569 1.443 ( 1.895 11.512 -5.562) 12.925 1.934 ( -4.872 25.336 -6.378) 26.577 2.056 ( 5.621 35.432 5.823) 36.344 2.402 ( -1.088 0.084 -10.137) 10.195 2.870 ( -0.956 9.290 6.548) 11.405 2.929 ( 1.723 -9.207 3.124) 9.874 3.234 ( -0.755 10.138 -4.389) 11.073 3.532 ( -1.305 -17.047 -12.029) 20.904 3.622 ( -2.651 -21.832 0.507) 21.998 3.754 ( 1.139 -18.963 -6.072) 19.944 4.648 ( -0.006 -9.268 13.082) 16.033 4.955 ( 2.735 -11.239 12.294) 16.880 5.036 ( 3.490 8.971 10.569) 14.295 5.423 ( 2.236 -8.324 -9.740) 13.006 5.495 ( 0.754 -15.922 -1.268) 15.991 5.670 ( -5.354 -6.420 4.274) 9.389 5.824 ( 0.134 5.980 2.313) 6.413 5.990 ( -2.058 3.336 -2.424) 4.609 6.095 ( 0.696 -6.949 1.536) 7.150 6.321 ( 0.907 -0.234 -4.464) 4.561 6.869 ( 1.943 0.560 -4.413) 4.854 6.918 ( -4.357 2.146 0.336) 4.868 7.087 ( 2.383 9.069 -0.161) 9.378 7.345 ( -2.509 10.723 -7.006) 13.052 7.473 ( 3.943 5.763 3.759) 7.931 7.595 ( -0.563 9.914 1.867) 10.104 7.678 ( -3.107 -8.571 -1.304) 9.209 7.797 ( 0.607 -7.088 0.801) 7.159 8.571 ( -0.138 -1.794 0.075) 1.801 8.738 ( -1.039 -0.903 3.177) 3.462 9.153 ( -0.801 -1.126 1.590) 2.106 9.445 ( -1.608 -3.802 -6.523) 7.719 13.254 ( 1.303 7.301 2.308) 7.768 13.535 ( 1.591 -0.388 2.390) 2.897 15.050 ( -0.557 -0.549 1.677) 1.850 15.238 ( -0.308 1.185 -1.112) 1.655 15.373 ( 1.080 2.432 0.501) 2.708 15.791 ( -4.090 4.836 -10.451) 12.220 16.246 ( 0.968 -0.764 10.660) 10.731 16.914 ( 5.801 -1.758 -10.414) 12.050 ======================= Grid point 166 (72/190) ======================= q-point: ( 0.07 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.959 ( 8.346 19.217 5.237) 21.596 1.048 ( 5.762 15.443 9.855) 19.205 1.564 ( 9.615 10.823 -5.767) 15.583 1.892 ( 2.211 22.243 -6.909) 23.396 2.226 ( 9.957 32.503 3.226) 34.146 2.378 ( 0.882 -3.068 -7.503) 8.154 2.879 ( 0.010 -0.608 4.634) 4.673 3.011 ( 6.382 4.619 5.173) 9.425 3.305 ( 7.748 3.026 -5.930) 10.216 3.418 ( -6.687 -9.911 -12.045) 16.971 3.655 ( 6.618 -22.910 -2.154) 23.944 3.848 ( 8.113 -15.232 -1.895) 17.362 4.615 ( -5.442 -9.245 12.420) 16.412 5.007 ( 0.514 -7.942 11.314) 13.832 5.109 ( 1.869 2.561 12.423) 12.821 5.375 ( -3.575 -5.224 -10.675) 12.411 5.489 ( -3.237 -9.468 0.149) 10.007 5.626 ( 1.851 -11.821 2.505) 12.225 5.878 ( 3.910 -1.309 4.112) 5.823 5.990 ( 2.382 9.752 -1.445) 10.142 6.118 ( 1.763 -5.997 0.239) 6.255 6.345 ( 2.138 1.097 -5.643) 6.133 6.787 ( -6.943 3.276 -1.230) 7.775 6.876 ( -0.617 0.250 -4.648) 4.695 7.116 ( 0.259 9.514 2.364) 9.807 7.282 ( -2.505 8.458 -5.013) 10.146 7.517 ( -2.833 10.017 -1.429) 10.508 7.551 ( 0.512 7.092 2.920) 7.687 7.783 ( 11.427 -10.814 -3.551) 16.129 7.887 ( 6.559 -8.064 2.161) 10.617 8.562 ( -1.056 -1.195 1.520) 2.203 8.711 ( -2.018 -1.364 1.510) 2.866 9.134 ( -1.442 -1.500 1.903) 2.820 9.394 ( -2.219 -2.132 -5.227) 6.066 13.279 ( 0.427 7.309 3.852) 8.273 13.543 ( -1.234 1.184 -0.904) 1.935 15.033 ( -1.604 -0.964 2.692) 3.279 15.179 ( -4.894 0.923 -1.130) 5.107 15.380 ( -0.680 1.997 2.805) 3.509 15.671 ( -6.172 2.748 -10.557) 12.534 16.220 ( -4.743 2.459 6.459) 8.382 16.829 ( -11.197 -1.656 -4.257) 12.093 ======================= Grid point 167 (73/190) ======================= q-point: ( 0.13 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.178 ( 12.186 16.676 5.119) 21.279 1.235 ( 11.254 11.512 10.782) 19.376 1.716 ( 6.431 11.571 -6.104) 14.577 1.985 ( 6.850 12.134 -12.502) 18.720 2.375 ( 7.056 11.197 -5.936) 14.505 2.497 ( 10.412 13.433 4.142) 17.493 2.889 ( 0.730 -2.277 2.504) 3.463 3.157 ( 4.720 2.618 3.856) 6.633 3.237 ( -4.660 -7.372 -8.889) 12.453 3.533 ( 12.782 -0.735 -4.773) 13.664 3.830 ( 11.119 -19.274 -2.942) 22.445 4.054 ( 12.892 -6.462 0.665) 14.436 4.499 ( -7.734 -8.469 10.912) 15.830 5.027 ( 0.157 -2.411 10.780) 11.047 5.142 ( -0.241 -3.257 8.717) 9.309 5.303 ( -2.133 -6.064 -4.142) 7.647 5.421 ( -2.650 -5.932 -2.685) 7.030 5.680 ( 2.219 -8.807 1.179) 9.158 5.953 ( 2.103 -7.236 5.504) 9.331 6.072 ( 6.123 14.000 -1.469) 15.351 6.178 ( 4.616 -3.393 0.483) 5.749 6.382 ( 2.922 1.539 -7.615) 8.300 6.676 ( -4.252 3.698 -1.619) 5.863 6.840 ( -1.971 0.217 -3.845) 4.326 7.107 ( -1.453 8.324 0.964) 8.504 7.222 ( -3.098 6.912 -2.731) 8.052 7.448 ( -2.407 11.604 -1.143) 11.906 7.594 ( 2.311 7.684 1.450) 8.154 7.991 ( 9.252 -13.344 -7.637) 17.944 8.028 ( 7.111 -11.844 4.456) 14.516 8.532 ( -2.285 -0.517 1.653) 2.867 8.672 ( -2.226 -3.360 1.991) 4.496 9.105 ( -1.835 -2.130 2.366) 3.675 9.346 ( -1.971 -1.741 -2.988) 3.980 13.279 ( -1.010 6.745 3.258) 7.559 13.488 ( -3.682 3.965 -3.001) 6.188 14.992 ( -3.201 -1.322 2.376) 4.199 15.070 ( -5.514 0.230 -0.237) 5.524 15.364 ( -1.339 0.786 5.025) 5.260 15.527 ( -6.552 1.417 -9.263) 11.434 16.101 ( -7.758 5.328 1.452) 9.523 16.563 ( -14.094 1.835 1.424) 14.284 ======================= Grid point 168 (74/190) ======================= q-point: ( 0.20 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.429 ( 12.328 12.346 4.980) 18.144 1.501 ( 13.541 8.176 10.087) 18.760 1.812 ( 4.574 9.163 -5.798) 11.769 2.054 ( 3.770 5.118 -16.672) 17.843 2.549 ( 9.571 8.412 -3.733) 13.278 2.673 ( 6.034 4.622 1.164) 7.690 2.920 ( 1.616 -2.750 1.683) 3.606 3.090 ( -1.953 0.198 -7.829) 8.072 3.321 ( 5.207 2.989 9.272) 11.046 3.771 ( 11.992 -8.567 -5.151) 15.612 4.052 ( 11.219 -15.025 -2.345) 18.897 4.256 ( 0.164 -0.144 6.448) 6.452 4.444 ( 6.971 -1.520 4.279) 8.320 5.061 ( 1.478 2.898 7.611) 8.277 5.161 ( 1.923 -7.202 7.163) 10.338 5.268 ( -1.188 -9.192 1.037) 9.326 5.380 ( -1.126 -4.106 -6.021) 7.374 5.716 ( 1.973 -2.954 -0.201) 3.558 5.967 ( -1.210 -7.165 4.099) 8.343 6.208 ( 7.660 15.540 -0.814) 17.345 6.294 ( 5.930 -6.605 0.470) 8.889 6.438 ( 4.163 0.860 -6.426) 7.705 6.594 ( -3.897 6.429 -2.838) 8.035 6.809 ( -0.083 -1.114 -2.304) 2.561 7.070 ( -1.508 3.650 -2.882) 4.889 7.170 ( -1.652 8.105 1.197) 8.358 7.422 ( -0.713 11.100 1.467) 11.219 7.637 ( 1.868 7.566 0.250) 7.798 8.098 ( 3.799 -11.644 -8.531) 14.927 8.162 ( 5.039 -13.772 3.663) 15.116 8.480 ( -3.102 0.337 0.355) 3.141 8.632 ( -2.577 -5.950 4.057) 7.649 9.071 ( -1.982 -2.842 2.257) 4.135 9.304 ( -2.043 -1.966 -1.276) 3.109 13.252 ( -1.983 5.818 0.891) 6.211 13.407 ( -3.797 5.725 -1.750) 7.089 14.917 ( -4.349 -1.052 0.303) 4.485 14.976 ( -4.245 -0.805 0.823) 4.398 15.348 ( -1.807 0.926 4.064) 4.543 15.398 ( -4.634 -0.525 -4.349) 6.377 15.937 ( -8.631 6.330 -2.128) 10.913 16.314 ( -11.741 2.337 2.679) 12.267 ======================= Grid point 169 (75/190) ======================= q-point: ( 0.27 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.667 ( 11.192 7.037 3.342) 13.636 1.764 ( 9.829 4.349 4.572) 11.680 1.876 ( 4.991 6.330 -5.079) 9.528 2.131 ( 7.052 4.557 -10.609) 13.530 2.645 ( 0.512 -0.395 -4.054) 4.105 2.745 ( 2.120 -2.777 -0.793) 3.582 2.961 ( 3.590 0.142 -1.028) 3.737 3.116 ( 3.444 5.574 -1.469) 6.715 3.415 ( 2.792 1.221 9.473) 9.951 3.950 ( 4.911 -12.112 -3.727) 13.591 4.174 ( -1.107 -15.736 8.111) 17.738 4.241 ( 4.960 8.483 -2.202) 10.070 4.635 ( 6.630 8.545 1.028) 10.864 5.131 ( 5.737 -0.580 3.715) 6.859 5.212 ( -1.124 -2.297 -3.534) 4.362 5.279 ( 3.239 -6.325 8.489) 11.071 5.380 ( 3.611 -8.492 -0.339) 9.235 5.775 ( 4.108 1.044 -4.345) 6.070 5.946 ( -0.482 -3.918 2.869) 4.881 6.289 ( -6.495 -3.599 -3.381) 8.159 6.368 ( 8.241 8.663 -1.755) 12.084 6.520 ( 5.102 -0.330 -2.695) 5.779 6.602 ( 5.936 6.808 0.386) 9.040 6.831 ( 2.615 -2.574 -0.591) 3.716 7.065 ( 1.763 -0.355 -4.761) 5.090 7.159 ( -0.211 8.235 3.290) 8.870 7.417 ( -0.153 10.033 2.948) 10.458 7.665 ( 1.053 6.806 -0.462) 6.902 8.117 ( -0.416 -10.428 -8.612) 13.531 8.227 ( 1.126 -11.335 3.098) 11.805 8.422 ( -2.642 0.612 -0.748) 2.813 8.576 ( -4.106 -7.305 5.169) 9.846 9.039 ( -1.600 -3.454 1.667) 4.156 9.260 ( -2.374 -2.409 -0.451) 3.413 13.214 ( -1.785 5.231 -0.999) 5.617 13.340 ( -3.014 5.691 0.269) 6.446 14.841 ( -3.268 -1.266 -0.441) 3.532 14.901 ( -3.620 -0.946 0.660) 3.800 15.270 ( -4.255 1.807 -3.856) 6.020 15.369 ( -0.539 -1.584 6.156) 6.379 15.770 ( -7.602 5.563 -3.756) 10.141 16.112 ( -9.553 1.165 1.927) 9.814 ======================= Grid point 170 (76/190) ======================= q-point: ( 0.33 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.816 ( 1.662 0.677 -7.790) 7.994 1.887 ( 9.285 3.273 1.851) 10.018 2.065 ( 10.619 4.397 3.427) 11.993 2.275 ( 8.343 1.811 -4.566) 9.682 2.616 ( -1.558 -2.444 0.696) 2.981 2.766 ( 0.196 -3.836 -0.934) 3.953 3.040 ( 4.326 2.151 -3.658) 6.060 3.165 ( 1.290 0.080 -0.210) 1.310 3.465 ( 0.973 0.460 7.429) 7.507 3.906 ( -6.441 -12.426 4.116) 14.589 4.224 ( 1.023 -12.184 1.783) 12.357 4.307 ( 3.940 16.454 -3.283) 17.235 4.686 ( -0.147 8.063 0.077) 8.064 5.130 ( -4.236 -0.672 -7.913) 9.001 5.258 ( 4.258 -0.271 1.265) 4.450 5.382 ( 4.890 -3.940 9.219) 11.155 5.518 ( 8.490 -7.632 6.926) 13.353 5.811 ( 0.982 3.499 -9.235) 9.924 6.014 ( 6.588 -1.006 0.333) 6.673 6.134 ( -6.063 -4.240 -1.893) 7.637 6.507 ( 5.265 -1.759 -1.182) 5.675 6.631 ( 5.817 8.030 -1.561) 10.037 6.739 ( 7.720 1.728 0.946) 7.968 6.922 ( 6.541 -4.633 1.830) 8.222 7.111 ( 3.778 -1.217 -6.045) 7.232 7.163 ( -0.284 6.271 4.804) 7.905 7.435 ( 1.818 9.059 2.548) 9.585 7.677 ( 0.345 5.701 -0.978) 5.794 8.050 ( -5.073 -8.502 -5.866) 11.508 8.229 ( -0.869 -8.029 0.199) 8.079 8.377 ( -2.047 -0.445 -0.111) 2.097 8.486 ( -5.850 -6.174 4.636) 9.687 9.018 ( -0.762 -3.905 1.033) 4.110 9.210 ( -2.588 -2.998 -0.278) 3.970 13.184 ( -0.945 4.979 -1.329) 5.239 13.289 ( -2.326 4.890 1.003) 5.507 14.790 ( -1.940 -1.542 -0.563) 2.541 14.840 ( -2.702 -0.735 0.517) 2.847 15.198 ( -2.515 1.441 -1.977) 3.509 15.359 ( -1.828 1.132 4.421) 4.916 15.644 ( -4.283 2.728 -3.095) 5.946 15.945 ( -7.846 -0.587 0.875) 7.917 ======================= Grid point 171 (77/190) ======================= q-point: ( 0.40 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.838 ( 2.541 -0.197 -5.287) 5.869 2.061 ( 7.603 0.025 1.969) 7.854 2.240 ( 6.792 0.630 0.464) 6.837 2.411 ( 5.514 -4.010 -1.557) 6.993 2.623 ( 2.111 1.292 5.201) 5.759 2.742 ( -2.666 -3.048 -1.282) 4.248 3.113 ( 3.755 0.737 -7.503) 8.423 3.158 ( -1.719 -2.424 1.323) 3.253 3.490 ( 0.811 -1.108 4.830) 5.021 3.784 ( -6.523 -10.854 8.429) 15.212 4.168 ( -4.724 1.007 -5.538) 7.348 4.392 ( 3.857 10.138 -1.101) 10.903 4.673 ( -0.575 6.250 0.517) 6.297 5.054 ( -2.216 1.513 -3.758) 4.618 5.251 ( -3.798 2.239 -6.237) 7.638 5.457 ( 0.093 -1.346 8.509) 8.615 5.695 ( 7.490 -8.117 4.963) 12.109 5.856 ( 6.153 3.318 -3.407) 7.776 6.035 ( -0.977 -2.596 -3.181) 4.221 6.188 ( 6.651 -2.189 2.453) 7.419 6.574 ( 2.364 -3.255 -0.347) 4.038 6.698 ( 1.779 6.916 -2.135) 7.453 6.896 ( 5.974 -1.276 -0.214) 6.112 7.069 ( 7.691 -4.521 2.380) 9.233 7.153 ( -1.251 4.099 6.508) 7.793 7.208 ( 7.422 -1.713 -6.751) 10.178 7.496 ( 3.612 6.638 0.545) 7.576 7.687 ( 1.537 4.736 -0.489) 5.004 7.910 ( -8.152 -5.786 -3.531) 10.602 8.185 ( -4.511 -6.614 0.090) 8.007 8.337 ( -2.050 -1.174 1.038) 2.580 8.387 ( -3.905 -2.566 1.964) 5.069 9.013 ( 0.052 -4.167 0.663) 4.220 9.160 ( -2.452 -3.694 -0.472) 4.458 13.173 ( -0.057 4.803 -0.911) 4.889 13.251 ( -1.814 4.250 0.791) 4.688 14.761 ( -0.958 -1.332 -0.568) 1.736 14.800 ( -1.483 -0.769 0.770) 1.839 15.164 ( -0.821 1.219 -0.560) 1.573 15.310 ( -3.325 4.617 1.032) 5.782 15.601 ( -0.087 -0.537 -0.760) 0.935 15.809 ( -6.160 -2.393 0.114) 6.610 ======================= Grid point 172 (78/190) ======================= q-point: ( 0.47 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.904 ( 4.561 -1.401 -0.196) 4.775 2.166 ( 2.128 1.218 1.930) 3.121 2.351 ( 5.560 -5.819 -0.714) 8.080 2.471 ( 0.038 -8.584 1.449) 8.705 2.659 ( -4.937 -1.582 -2.434) 5.727 2.702 ( 4.341 3.055 4.269) 6.812 3.081 ( -3.747 -0.249 -3.456) 5.104 3.189 ( 3.229 -0.069 -4.234) 5.325 3.507 ( -0.206 -3.794 1.045) 3.941 3.710 ( -2.377 -8.194 14.690) 16.988 4.058 ( -4.505 2.939 -10.310) 11.629 4.440 ( 1.313 10.789 -1.745) 11.007 4.675 ( 0.556 5.303 1.929) 5.671 5.039 ( 1.000 2.340 0.175) 2.551 5.143 ( -4.514 5.029 -9.753) 11.865 5.434 ( -2.377 -0.061 2.459) 3.421 5.802 ( 2.548 -7.331 3.143) 8.373 5.964 ( 1.719 -9.896 2.271) 10.297 6.082 ( 7.319 9.821 0.482) 12.258 6.262 ( -0.072 -4.538 2.377) 5.124 6.619 ( 2.482 1.239 -0.742) 2.871 6.711 ( -0.053 3.815 -1.049) 3.957 6.951 ( 1.017 -2.701 -1.336) 3.181 7.124 ( -2.209 1.397 5.488) 6.079 7.169 ( 0.257 -3.692 -1.465) 3.980 7.390 ( 10.891 -2.830 -5.348) 12.459 7.554 ( 2.512 2.661 -0.282) 3.670 7.716 ( -6.369 1.459 -0.542) 6.556 7.786 ( 4.060 -1.258 0.613) 4.294 8.047 ( -8.706 -3.641 1.273) 9.522 8.312 ( -0.360 -0.437 0.699) 0.900 8.357 ( 0.150 -1.390 0.364) 1.444 9.018 ( 0.187 -4.193 0.619) 4.243 9.118 ( -1.556 -4.293 -0.911) 4.657 13.179 ( 0.786 4.660 -0.282) 4.734 13.220 ( -1.415 3.976 0.181) 4.224 14.751 ( 0.056 -0.874 -0.222) 0.904 14.782 ( -0.621 -0.838 0.801) 1.315 15.159 ( 0.197 1.202 0.017) 1.218 15.254 ( -2.017 5.437 -0.521) 5.823 15.621 ( 1.746 -1.008 0.243) 2.031 15.710 ( -3.680 -3.922 -0.280) 5.385 ======================= Grid point 173 (79/190) ======================= q-point: (-0.47 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.003 ( 4.627 -2.303 3.482) 6.232 2.150 ( -3.352 3.214 0.504) 4.671 2.357 ( -9.695 -10.478 -1.218) 14.327 2.479 ( 4.827 -8.949 -1.450) 10.271 2.593 ( -0.908 1.490 2.423) 2.986 2.783 ( 3.191 0.968 1.646) 3.719 3.014 ( -2.308 2.835 -0.754) 3.732 3.219 ( 0.191 -1.700 -5.435) 5.698 3.499 ( 0.775 -2.437 -0.154) 2.562 3.713 ( -2.031 -9.002 14.684) 17.343 3.988 ( 0.028 3.781 -10.442) 11.105 4.448 ( 0.458 10.013 -2.453) 10.319 4.690 ( -0.007 6.585 2.450) 7.026 5.040 ( -0.859 -3.415 -11.079) 11.625 5.123 ( 4.012 9.738 3.702) 11.164 5.389 ( -2.390 1.048 -1.853) 3.201 5.782 ( -5.303 -5.428 4.077) 8.614 5.997 ( 2.633 -10.577 0.912) 10.938 6.179 ( -2.545 1.141 3.580) 4.539 6.245 ( 1.429 1.583 1.907) 2.861 6.655 ( 1.043 4.722 -0.829) 4.906 6.701 ( -0.541 1.125 -0.431) 1.320 6.959 ( 0.269 -0.873 -0.703) 1.153 7.068 ( -6.016 0.154 2.486) 6.511 7.089 ( -5.489 -5.135 -2.907) 8.059 7.505 ( -3.618 -0.200 1.214) 3.821 7.571 ( 2.708 2.331 -6.573) 7.482 7.629 ( -1.498 0.151 1.817) 2.360 7.876 ( 0.102 -3.483 1.749) 3.899 7.962 ( 5.001 -1.694 -0.083) 5.281 8.329 ( 1.801 -0.072 0.641) 1.913 8.384 ( 2.618 -2.023 1.129) 3.496 9.015 ( -0.689 -4.105 0.689) 4.220 9.104 ( 0.429 -4.364 -1.334) 4.584 13.195 ( -0.770 4.199 -0.113) 4.271 13.204 ( 1.399 4.346 0.005) 4.566 14.763 ( 1.087 -0.903 0.371) 1.461 14.775 ( -0.194 -0.436 0.254) 0.541 15.174 ( 1.527 2.115 0.997) 2.793 15.230 ( -0.554 3.852 -1.630) 4.219 15.634 ( -0.607 -2.111 0.652) 2.291 15.700 ( 2.881 -2.395 -0.633) 3.800 ======================= Grid point 174 (80/190) ======================= q-point: (-0.40 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.998 ( -7.424 4.544 -3.319) 9.315 2.069 ( -8.753 -8.261 -0.689) 12.055 2.181 ( -1.778 0.382 5.199) 5.508 2.466 ( -4.028 0.088 -2.758) 4.882 2.680 ( 6.846 -6.483 4.963) 10.655 2.828 ( 1.257 -0.410 -0.973) 1.642 2.985 ( -1.269 2.997 1.350) 3.523 3.186 ( -1.790 -3.845 -3.487) 5.491 3.556 ( 3.665 0.008 4.053) 5.465 3.649 ( -4.723 -5.089 1.962) 7.215 4.017 ( 2.951 -0.649 -3.412) 4.557 4.466 ( 1.689 7.302 -0.795) 7.537 4.664 ( -2.969 8.383 -0.698) 8.921 5.018 ( -0.113 -4.923 -8.595) 9.906 5.240 ( 6.267 7.106 5.686) 11.050 5.325 ( -3.737 -0.381 -3.595) 5.199 5.638 ( -9.128 -3.264 4.027) 10.497 6.043 ( -1.992 -8.201 0.970) 8.495 6.105 ( -1.025 -1.622 -1.383) 2.365 6.229 ( -3.529 0.871 3.920) 5.346 6.657 ( -1.258 1.327 -0.985) 2.077 6.682 ( -1.787 3.097 -0.774) 3.659 6.899 ( -7.948 1.120 0.104) 8.028 6.962 ( -0.118 0.536 -0.721) 0.906 6.987 ( -6.376 -3.084 0.020) 7.083 7.417 ( -3.094 4.321 2.292) 5.787 7.500 ( -9.186 2.027 0.614) 9.427 7.635 ( 2.547 4.112 -2.138) 5.288 7.940 ( 5.038 -4.249 -4.875) 8.198 8.085 ( 5.707 -7.129 1.746) 9.297 8.372 ( 2.361 -0.732 0.278) 2.488 8.471 ( 5.736 -4.392 3.442) 8.002 9.001 ( -0.526 -3.895 0.716) 3.995 9.124 ( 1.637 -3.748 -1.516) 4.362 13.179 ( -0.556 4.339 -0.809) 4.449 13.245 ( 2.544 4.282 0.690) 5.028 14.775 ( 0.431 -0.757 -0.240) 0.903 14.795 ( 1.866 -0.604 0.650) 2.066 15.216 ( -0.468 1.773 -2.555) 3.145 15.229 ( 3.713 3.425 2.432) 5.607 15.644 ( 1.814 -1.811 0.067) 2.564 15.778 ( 4.925 -0.619 -0.480) 4.987 ======================= Grid point 175 (81/190) ======================= q-point: (-0.33 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.764 ( -13.563 4.419 -7.071) 15.921 1.866 ( -10.687 0.549 1.364) 10.788 2.175 ( -3.862 1.854 5.799) 7.210 2.405 ( -0.255 3.665 -3.140) 4.833 2.783 ( -1.060 2.687 -1.589) 3.297 2.816 ( -0.023 -1.552 -0.137) 1.559 2.981 ( 1.559 -6.915 3.033) 7.710 3.161 ( -0.984 -4.233 0.196) 4.350 3.514 ( -5.623 -0.571 3.822) 6.823 3.692 ( 6.490 1.890 -0.459) 6.775 4.053 ( 0.425 -7.520 0.079) 7.533 4.492 ( -0.214 3.631 0.643) 3.694 4.577 ( -5.352 9.257 -1.932) 10.866 4.968 ( -3.990 -10.829 -7.710) 13.880 5.207 ( -6.939 3.939 0.002) 7.979 5.381 ( 3.624 -5.690 6.345) 9.261 5.498 ( -2.735 6.001 2.197) 6.951 5.927 ( -7.673 -3.510 -1.686) 8.605 5.999 ( -9.332 -4.677 -2.264) 10.681 6.289 ( 7.559 -0.355 2.388) 7.935 6.547 ( -7.776 5.502 -2.773) 9.921 6.644 ( -3.132 -2.824 0.993) 4.332 6.792 ( -4.910 2.627 1.714) 5.827 6.873 ( -3.271 0.372 -0.222) 3.300 6.949 ( -1.341 0.852 -2.359) 2.844 7.330 ( -7.322 6.786 0.106) 9.984 7.399 ( 0.191 5.475 3.839) 6.690 7.665 ( 0.771 6.042 -0.855) 6.151 7.998 ( 1.588 -6.538 -7.057) 9.750 8.185 ( 4.359 -8.829 1.404) 9.946 8.421 ( 2.677 -1.812 -0.216) 3.240 8.596 ( 5.644 -8.561 5.489) 11.631 9.004 ( 0.695 -3.238 1.346) 3.575 9.160 ( 2.434 -2.965 -1.880) 4.272 13.172 ( 0.012 4.807 -1.060) 4.923 13.303 ( 3.240 3.768 0.726) 5.022 14.793 ( 1.564 -0.617 -0.538) 1.765 14.837 ( 2.307 -1.075 0.622) 2.620 15.202 ( -0.257 0.144 -2.126) 2.146 15.331 ( 6.067 5.926 3.449) 9.155 15.700 ( 3.846 -0.294 -1.746) 4.234 15.888 ( 6.404 0.248 0.052) 6.409 ======================= Grid point 176 (82/190) ======================= q-point: (-0.27 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.498 ( -12.277 8.770 -3.667) 15.527 1.649 ( -11.811 6.723 2.106) 13.753 2.055 ( -7.835 6.253 0.469) 10.035 2.424 ( 1.505 2.323 -3.887) 4.772 2.635 ( -10.281 13.674 -4.939) 17.806 2.828 ( -1.364 0.856 2.907) 3.323 3.033 ( 1.326 -10.540 3.498) 11.184 3.101 ( -5.040 -3.405 -3.505) 7.020 3.460 ( 0.098 -2.235 3.016) 3.755 3.818 ( 5.498 1.268 1.756) 5.909 4.022 ( -3.969 -13.432 2.961) 14.315 4.398 ( -8.708 0.804 -4.933) 10.041 4.476 ( -5.903 4.036 6.941) 9.965 4.874 ( -3.318 -5.163 -7.715) 9.858 5.047 ( -8.157 -7.448 -1.181) 11.109 5.347 ( -5.132 2.991 6.808) 9.035 5.591 ( 6.893 -1.627 3.906) 8.088 5.768 ( -6.501 -0.775 0.571) 6.572 5.847 ( -5.148 -5.418 -5.919) 9.533 6.356 ( -5.490 3.525 1.771) 6.760 6.465 ( 0.459 4.738 -1.423) 4.968 6.540 ( -4.376 -1.715 -0.834) 4.774 6.734 ( -0.974 2.704 1.513) 3.248 6.848 ( -0.150 2.126 0.315) 2.155 6.898 ( -2.713 -0.366 -5.355) 6.014 7.240 ( -1.685 8.808 0.353) 8.975 7.420 ( 0.829 8.369 3.689) 9.183 7.665 ( -0.650 7.725 0.225) 7.755 7.980 ( -1.897 -7.500 -6.910) 10.373 8.254 ( 2.278 -11.445 0.908) 11.705 8.473 ( 2.688 -2.650 -1.326) 4.000 8.690 ( 2.656 -11.242 6.430) 13.221 9.036 ( 2.201 -2.494 3.013) 4.488 9.216 ( 3.744 -2.837 -2.347) 5.251 13.176 ( 0.592 5.414 -1.121) 5.560 13.369 ( 3.275 2.589 0.110) 4.176 14.834 ( 2.810 -0.366 -0.669) 2.912 14.889 ( 3.045 -1.078 0.639) 3.293 15.205 ( 0.969 0.077 -0.985) 1.384 15.475 ( 7.921 9.041 4.159) 12.719 15.778 ( 4.389 1.175 -4.318) 6.268 16.028 ( 7.945 0.665 0.883) 8.021 ======================= Grid point 177 (83/190) ======================= q-point: (-0.20 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.284 ( -9.436 13.785 1.447) 16.768 1.419 ( -12.044 11.722 3.548) 17.177 1.895 ( -8.118 9.573 -3.438) 13.014 2.391 ( -13.025 17.436 -5.956) 22.564 2.420 ( -1.978 4.235 -5.856) 7.492 2.744 ( -8.656 16.578 5.663) 19.540 2.957 ( -4.416 -10.753 -3.644) 12.182 3.067 ( -1.022 -5.261 1.221) 5.496 3.497 ( 2.546 -8.900 -1.515) 9.380 3.830 ( -7.235 -6.180 0.410) 9.524 3.939 ( -3.879 -10.234 1.146) 11.004 4.185 ( -11.280 -7.158 -0.949) 13.393 4.394 ( -2.212 0.795 11.645) 11.879 4.802 ( -3.117 6.713 0.405) 7.413 4.941 ( -2.054 -16.158 -6.168) 17.417 5.254 ( -3.809 -2.104 3.157) 5.376 5.668 ( -1.790 -7.165 -0.992) 7.452 5.732 ( 1.872 -1.493 8.278) 8.617 5.791 ( 1.507 1.699 -4.289) 4.853 6.231 ( -6.241 9.571 0.483) 11.436 6.332 ( -8.881 -7.600 0.658) 11.708 6.535 ( -2.182 3.216 -2.972) 4.893 6.733 ( 0.393 4.282 1.103) 4.440 6.861 ( 0.862 0.291 -5.918) 5.987 6.876 ( 2.866 4.424 -0.517) 5.296 7.262 ( 3.588 10.411 -1.251) 11.082 7.435 ( 0.023 9.281 2.875) 9.716 7.641 ( -1.957 9.429 0.984) 9.680 7.911 ( -3.804 -7.660 -5.639) 10.244 8.264 ( -1.845 -16.794 0.844) 16.916 8.518 ( 2.221 -2.452 -2.333) 4.048 8.725 ( 0.175 -9.847 6.485) 11.792 9.090 ( 2.397 -1.981 4.174) 5.206 9.300 ( 5.262 -4.209 -2.251) 7.104 13.190 ( 0.997 6.043 -1.161) 6.233 13.424 ( 2.318 0.795 -0.645) 2.534 14.907 ( 4.928 0.814 0.112) 4.996 14.956 ( 3.613 -0.731 0.501) 3.720 15.236 ( 2.296 0.712 -0.470) 2.449 15.653 ( 9.590 12.822 5.191) 16.832 15.849 ( 3.846 1.601 -6.827) 7.997 16.200 ( 9.516 1.548 1.207) 9.716 ======================= Grid point 178 (84/190) ======================= q-point: (-0.13 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.128 ( -7.631 15.775 5.410) 18.340 1.201 ( -10.809 16.175 5.961) 20.347 1.722 ( -9.103 11.110 -6.790) 15.887 2.133 ( -11.230 23.862 -0.165) 26.373 2.309 ( -8.611 15.310 -9.637) 20.035 2.568 ( -7.752 15.740 0.452) 17.551 2.908 ( -0.871 -16.138 -1.602) 16.241 3.014 ( -4.769 3.965 4.424) 7.618 3.533 ( 1.052 -14.670 -6.510) 16.084 3.608 ( -12.339 3.134 -3.185) 13.123 3.811 ( -8.306 -19.339 -2.620) 21.210 3.992 ( -8.533 -13.569 0.878) 16.054 4.455 ( 4.811 -2.872 15.408) 16.395 4.791 ( 1.402 -0.964 8.367) 8.538 4.916 ( 0.310 -2.465 -3.702) 4.458 5.244 ( 2.471 -9.697 -1.272) 10.088 5.605 ( -3.470 -9.743 -3.314) 10.860 5.756 ( -0.054 5.221 2.315) 5.711 5.854 ( 2.205 -3.415 6.506) 7.672 6.128 ( -4.219 12.229 0.817) 12.962 6.175 ( -6.841 -10.906 -0.904) 12.905 6.440 ( -5.515 -1.044 -4.799) 7.385 6.758 ( 2.159 3.892 0.558) 4.486 6.889 ( 2.451 5.254 -3.689) 6.871 6.951 ( 4.289 5.031 -0.593) 6.638 7.345 ( 4.455 12.597 -5.597) 14.487 7.435 ( -0.153 7.244 2.480) 7.658 7.594 ( -2.763 11.583 1.868) 12.054 7.825 ( -3.908 -7.362 -3.710) 9.123 8.167 ( -8.558 -22.348 1.124) 23.956 8.550 ( 1.491 -2.010 -2.355) 3.437 8.734 ( -0.153 -5.762 6.203) 8.468 9.135 ( 1.421 -1.391 3.423) 3.959 9.400 ( 4.855 -5.954 -2.578) 8.103 13.208 ( 1.051 6.543 -1.240) 6.741 13.458 ( 1.424 -0.448 0.248) 1.514 15.010 ( 3.137 -0.304 2.450) 3.992 15.042 ( 6.961 1.745 -1.211) 7.278 15.289 ( 2.973 1.473 -0.773) 3.407 15.840 ( 5.834 15.437 0.593) 16.514 15.926 ( 7.742 -0.572 -1.814) 7.973 16.407 ( 12.002 4.496 -0.841) 12.844 ======================= Grid point 179 (85/190) ======================= q-point: (-0.07 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.979 ( -8.457 16.485 6.696) 19.701 1.046 ( -6.114 18.312 7.637) 20.761 1.526 ( -8.283 11.357 -7.134) 15.763 2.004 ( -1.946 29.147 2.059) 29.284 2.097 ( -10.034 28.047 -4.857) 30.181 2.458 ( -3.302 5.923 -7.990) 10.480 2.904 ( 0.223 -17.883 1.147) 17.921 2.921 ( -4.664 12.318 6.308) 14.604 3.350 ( -9.965 8.363 -3.452) 13.459 3.565 ( 1.020 -16.153 -11.831) 20.048 3.667 ( -4.813 -22.496 0.513) 23.011 3.842 ( -6.837 -18.497 -3.954) 20.113 4.578 ( 4.298 -7.397 14.300) 16.663 4.868 ( 3.632 -9.178 13.801) 16.967 4.950 ( 3.345 8.908 2.455) 9.827 5.330 ( 6.251 -11.650 -4.220) 13.878 5.532 ( -3.138 -11.554 -3.579) 12.496 5.738 ( -2.209 -1.071 2.757) 3.692 5.858 ( -2.587 4.172 4.613) 6.736 6.063 ( -4.264 -2.579 -2.724) 5.679 6.086 ( -0.718 -1.121 2.573) 2.897 6.344 ( -2.754 -2.136 -5.321) 6.361 6.816 ( 3.554 2.174 -2.069) 4.652 6.931 ( 1.752 4.717 1.028) 5.136 7.029 ( 3.745 7.285 -1.572) 8.340 7.376 ( 0.308 14.397 -6.904) 15.969 7.442 ( -0.077 4.093 -0.483) 4.122 7.572 ( 0.768 12.546 4.095) 13.220 7.751 ( -3.133 -7.287 -2.274) 8.251 7.946 ( -13.095 -19.467 1.859) 23.535 8.568 ( 0.638 -2.047 -1.437) 2.581 8.742 ( -0.164 -2.325 5.095) 5.602 9.156 ( 0.242 -1.082 2.199) 2.462 9.459 ( 1.540 -5.925 -4.947) 7.871 13.228 ( 1.165 6.961 -0.190) 7.060 13.492 ( 1.926 -0.542 2.620) 3.297 15.047 ( 0.773 -0.541 1.302) 1.608 15.181 ( 5.965 1.732 -0.297) 6.218 15.340 ( 2.290 2.065 -0.993) 3.239 15.859 ( -0.976 7.523 -8.937) 11.723 16.132 ( 8.851 0.341 10.172) 13.489 16.679 ( 16.230 6.178 -7.230) 18.811 ======================= Grid point 180 (86/190) ======================= q-point: ( 0.00 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.256 ( -0.089 18.371 4.250) 18.856 1.367 ( -1.382 21.012 4.037) 21.440 1.704 ( 1.307 13.936 -4.234) 14.623 2.229 ( -1.911 8.307 -18.014) 19.929 2.394 ( -2.428 -5.619 -2.428) 6.585 2.627 ( 3.640 -4.854 5.687) 8.316 2.813 ( -2.056 27.468 -0.214) 27.546 3.050 ( -1.280 -20.611 -0.500) 20.657 3.084 ( 0.719 -15.458 0.319) 15.478 3.291 ( -0.585 10.087 0.996) 10.153 3.510 ( -0.478 -0.593 -8.883) 8.916 3.617 ( 1.895 14.266 -2.539) 14.613 4.487 ( -2.077 -5.739 11.832) 13.313 4.734 ( 4.667 -9.519 12.324) 16.256 5.052 ( 2.718 -14.433 5.845) 15.807 5.119 ( 1.234 -15.094 -2.845) 15.409 5.268 ( -0.223 -10.745 -8.249) 13.549 5.431 ( -6.025 -9.643 -1.666) 11.492 5.701 ( 1.655 -4.832 9.309) 10.619 6.169 ( 1.115 2.564 0.516) 2.843 6.262 ( -1.251 10.079 3.401) 10.710 6.388 ( 0.133 14.130 0.299) 14.134 6.852 ( 1.191 -1.293 -6.231) 6.474 6.926 ( -2.895 -0.260 -5.201) 5.958 7.244 ( 2.324 5.387 0.003) 5.867 7.456 ( -1.653 -4.440 -5.069) 6.938 7.484 ( -0.647 -3.579 0.477) 3.668 7.550 ( 0.332 -6.245 -1.219) 6.371 7.667 ( 0.991 6.803 0.903) 6.934 7.829 ( -0.433 6.151 -1.981) 6.477 8.538 ( 0.584 0.245 4.058) 4.107 8.741 ( -1.191 -0.234 3.037) 3.270 9.138 ( -0.705 -0.164 0.642) 0.967 9.341 ( -0.076 -6.001 -3.947) 7.183 13.397 ( 1.652 6.565 2.884) 7.358 13.545 ( 1.499 0.987 5.205) 5.505 15.080 ( -0.740 3.806 0.376) 3.895 15.273 ( -0.423 2.259 -1.578) 2.787 15.392 ( 0.962 -0.414 -0.607) 1.210 15.705 ( -4.394 -10.929 -8.538) 14.548 16.366 ( 1.608 10.311 7.389) 12.787 16.847 ( 1.832 -4.563 -5.674) 7.508 ======================= Grid point 181 (87/190) ======================= q-point: ( 0.07 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.331 ( 6.295 17.215 4.844) 18.959 1.408 ( 5.022 21.539 4.162) 22.505 1.816 ( 9.462 14.095 -4.775) 17.635 2.173 ( -0.672 7.950 -18.298) 19.962 2.358 ( -0.203 -6.701 -1.450) 6.859 2.704 ( 3.110 -6.035 5.637) 8.824 2.805 ( 0.706 17.527 -3.998) 17.991 3.061 ( 1.686 -11.193 1.806) 11.462 3.142 ( 5.613 -17.696 -1.778) 18.650 3.302 ( 1.975 6.850 -1.111) 7.215 3.479 ( 1.361 6.057 -3.138) 6.956 3.805 ( 14.895 11.689 -3.057) 19.179 4.423 ( -6.267 -8.357 12.327) 16.158 4.816 ( 2.529 -8.227 10.638) 13.684 5.115 ( 1.546 -12.838 6.759) 14.591 5.184 ( 2.869 -6.876 -5.154) 9.059 5.255 ( 1.524 -12.814 -7.433) 14.892 5.329 ( -1.764 -13.477 1.466) 13.671 5.758 ( 2.024 -2.884 9.779) 10.394 6.194 ( 1.701 5.599 -2.332) 6.299 6.256 ( -0.276 5.552 4.956) 7.447 6.431 ( 3.732 13.742 -0.213) 14.241 6.844 ( -1.945 1.170 -9.380) 9.651 6.851 ( -2.091 0.300 -4.318) 4.807 7.270 ( 0.121 4.917 2.470) 5.504 7.387 ( -3.868 0.011 -5.585) 6.794 7.536 ( 5.157 -7.147 -1.558) 8.949 7.591 ( 2.867 -6.779 -0.790) 7.403 7.705 ( 2.917 6.137 1.908) 7.058 7.818 ( -0.001 2.994 -2.305) 3.778 8.544 ( -0.775 0.439 4.923) 5.003 8.698 ( -3.460 -0.911 1.655) 3.942 9.116 ( -1.556 0.022 0.683) 1.700 9.320 ( -1.305 -4.803 -3.183) 5.908 13.425 ( 0.393 6.864 4.123) 8.017 13.569 ( -0.015 1.312 3.288) 3.540 15.053 ( -2.106 3.192 0.884) 3.925 15.212 ( -5.043 2.321 -1.583) 5.773 15.385 ( -1.787 -1.273 1.297) 2.549 15.585 ( -5.940 -9.396 -10.009) 14.959 16.362 ( -3.180 9.767 6.112) 11.953 16.776 ( -7.618 -3.543 -3.914) 9.269 ======================= Grid point 182 (88/190) ======================= q-point: ( 0.13 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.488 ( 8.703 13.883 6.107) 17.486 1.565 ( 9.229 21.433 4.160) 23.704 1.970 ( 5.630 14.079 -5.232) 16.040 2.136 ( 0.060 4.750 -18.009) 18.625 2.414 ( 5.855 -6.785 -1.073) 9.026 2.754 ( 0.588 -10.442 -5.178) 11.670 2.816 ( 2.505 10.794 1.371) 11.165 3.103 ( 2.072 -3.672 1.416) 4.447 3.278 ( 7.296 -10.066 0.950) 12.468 3.384 ( 6.529 2.900 -0.315) 7.151 3.570 ( 8.313 -0.998 -0.698) 8.401 4.144 ( 18.600 10.854 -0.460) 21.541 4.315 ( -5.048 -7.160 9.770) 13.122 4.905 ( 5.267 -6.343 8.127) 11.577 5.086 ( -3.420 -10.056 -0.851) 10.656 5.186 ( -1.519 0.240 -4.050) 4.332 5.269 ( 2.696 -8.230 2.398) 8.986 5.446 ( 8.665 -16.231 2.304) 18.543 5.806 ( 1.147 -3.164 9.407) 9.991 6.216 ( 0.585 9.344 -5.829) 11.028 6.268 ( 0.948 -4.884 4.892) 6.977 6.513 ( 4.369 13.311 -1.291) 14.069 6.786 ( -1.348 6.334 -9.080) 11.153 6.814 ( -1.183 0.398 -4.462) 4.633 7.243 ( -3.794 4.436 -0.737) 5.883 7.312 ( -2.162 1.228 -0.675) 2.576 7.625 ( 0.663 1.728 -1.137) 2.172 7.644 ( 5.626 -4.259 -3.557) 7.902 7.793 ( 5.429 -4.616 2.398) 7.519 7.834 ( 2.026 -2.154 -0.559) 3.010 8.522 ( -2.308 -0.217 4.000) 4.623 8.621 ( -4.491 -2.137 1.665) 5.245 9.082 ( -2.064 0.062 0.967) 2.280 9.284 ( -1.867 -4.156 -1.952) 4.957 13.420 ( -1.582 6.810 3.139) 7.664 13.553 ( -1.975 2.469 0.882) 3.282 15.000 ( -3.486 2.295 1.304) 4.373 15.094 ( -6.298 2.056 -0.615) 6.654 15.337 ( -2.975 -3.064 2.809) 5.111 15.454 ( -5.629 -7.286 -9.059) 12.916 16.268 ( -7.138 9.647 3.441) 12.485 16.577 ( -11.379 -0.456 -1.456) 11.481 ======================= Grid point 183 (89/190) ======================= q-point: ( 0.20 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.687 ( 10.130 10.284 6.263) 15.735 1.744 ( 7.863 18.317 4.173) 20.366 2.016 ( 0.974 10.775 -5.851) 12.300 2.132 ( 2.772 4.184 -14.298) 15.153 2.509 ( 2.705 -8.968 -0.228) 9.369 2.728 ( -0.415 -5.279 -11.622) 12.772 2.913 ( 5.431 5.004 4.542) 8.670 3.131 ( 0.715 -3.172 -2.350) 4.012 3.422 ( 5.044 7.220 8.967) 12.569 3.531 ( 10.288 -11.693 -0.474) 15.582 3.753 ( 7.130 -9.758 -0.576) 12.099 4.245 ( 2.180 -3.496 9.493) 10.348 4.559 ( 19.178 11.808 -3.549) 22.799 4.969 ( -0.709 -8.091 -2.084) 8.385 5.114 ( 6.564 -0.183 11.111) 12.907 5.157 ( 0.158 -1.289 -2.922) 3.198 5.317 ( 1.151 -2.609 2.522) 3.807 5.606 ( 7.303 -11.343 -1.121) 13.537 5.837 ( 0.671 -2.782 8.873) 9.323 6.201 ( -0.618 1.025 -3.741) 3.928 6.303 ( 1.867 -6.742 -1.834) 7.232 6.572 ( 1.373 5.477 -2.792) 6.299 6.757 ( 0.697 8.457 -4.128) 9.436 6.821 ( 2.318 8.290 -4.966) 9.938 7.146 ( -4.561 3.041 -3.798) 6.670 7.291 ( -1.024 3.339 3.949) 5.272 7.623 ( -0.313 7.110 -0.897) 7.173 7.725 ( 3.159 0.080 -3.214) 4.508 7.884 ( 3.103 -9.339 -0.655) 9.863 7.906 ( 4.818 -8.442 2.862) 10.133 8.473 ( -2.985 -1.158 1.691) 3.621 8.533 ( -4.895 -3.727 2.574) 6.669 9.041 ( -2.224 0.029 1.039) 2.455 9.241 ( -2.281 -4.064 -0.934) 4.753 13.379 ( -2.699 6.418 0.843) 7.013 13.501 ( -3.177 3.471 0.031) 4.706 14.922 ( -4.512 1.659 0.392) 4.823 14.982 ( -4.985 1.216 0.388) 5.146 15.295 ( -1.758 -4.995 3.471) 6.332 15.338 ( -4.765 -4.882 -5.522) 8.776 16.108 ( -9.217 9.299 0.779) 13.116 16.351 ( -11.375 1.127 -0.248) 11.433 ======================= Grid point 184 (90/190) ======================= q-point: ( 0.27 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.844 ( 3.015 6.702 1.028) 7.421 1.889 ( 6.956 10.918 2.890) 13.264 2.050 ( 5.096 10.695 -3.509) 12.355 2.187 ( 4.382 1.994 -7.415) 8.840 2.534 ( 0.605 -7.208 2.028) 7.512 2.712 ( 0.647 -1.513 -10.215) 10.347 3.011 ( 3.656 -0.970 4.246) 5.686 3.123 ( -0.768 -4.194 -5.479) 6.943 3.479 ( 0.398 4.021 7.457) 8.482 3.762 ( -3.497 -10.153 3.542) 11.308 3.796 ( 13.355 -10.463 3.080) 17.243 4.436 ( 13.582 4.952 1.469) 14.531 4.776 ( 1.997 2.122 -5.885) 6.567 5.050 ( 10.133 2.343 2.722) 10.751 5.127 ( -1.097 -3.287 1.344) 3.717 5.274 ( 1.686 1.155 8.761) 8.996 5.363 ( 7.220 3.821 -0.878) 8.216 5.721 ( 4.326 -8.691 -2.279) 9.972 5.890 ( 4.655 0.595 6.099) 7.695 6.165 ( -3.517 -5.683 -5.022) 8.360 6.331 ( 2.385 -6.540 -5.356) 8.783 6.593 ( 3.018 -3.815 0.695) 4.914 6.811 ( 4.225 12.176 -2.226) 13.079 6.855 ( 1.583 9.787 -3.244) 10.431 7.085 ( -0.646 2.037 -4.058) 4.586 7.277 ( -1.353 3.385 5.219) 6.366 7.619 ( 0.124 8.857 -0.050) 8.858 7.760 ( 1.056 2.141 -2.026) 3.131 7.923 ( 0.794 -7.527 -1.465) 7.709 7.989 ( 3.037 -11.759 2.758) 12.454 8.415 ( -3.392 -1.363 0.566) 3.699 8.443 ( -4.365 -5.662 1.814) 7.376 9.002 ( -1.889 -0.097 0.911) 2.099 9.192 ( -2.661 -4.120 -0.371) 4.919 13.328 ( -2.356 5.857 -0.620) 6.344 13.436 ( -3.348 3.651 0.061) 4.954 14.839 ( -3.748 1.120 -0.421) 3.934 14.899 ( -3.655 0.630 0.564) 3.751 15.239 ( -3.504 -4.165 -4.249) 6.905 15.294 ( -0.314 -4.885 5.768) 7.565 15.926 ( -9.191 8.491 -0.977) 12.551 16.138 ( -10.428 1.121 -0.241) 10.490 ======================= Grid point 185 (91/190) ======================= q-point: ( 0.33 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.851 ( -0.486 2.967 -4.090) 5.076 1.998 ( 4.188 6.755 1.690) 8.126 2.182 ( 6.996 6.354 -2.266) 9.719 2.261 ( 3.483 -1.750 -0.006) 3.898 2.568 ( 2.825 -1.562 3.969) 5.116 2.715 ( 1.173 -0.369 -7.582) 7.681 3.063 ( -0.096 -8.914 3.114) 9.443 3.102 ( 1.239 0.556 -6.171) 6.319 3.481 ( -1.165 -0.117 4.514) 4.664 3.658 ( -6.138 -12.454 7.424) 15.745 4.048 ( 10.113 -1.168 1.847) 10.346 4.649 ( 6.382 11.178 -4.881) 13.766 4.752 ( -1.534 1.424 -4.953) 5.377 5.094 ( -2.098 -2.454 0.818) 3.330 5.217 ( 5.369 -3.419 11.219) 12.899 5.328 ( 4.362 4.432 -5.225) 8.122 5.530 ( 7.628 3.458 7.678) 11.362 5.750 ( -1.111 -9.306 -0.856) 9.411 6.027 ( 4.764 1.528 -5.132) 7.167 6.100 ( 3.310 2.252 -0.622) 4.051 6.391 ( 4.182 -7.582 -3.512) 9.344 6.705 ( 6.858 -7.924 2.059) 10.680 6.846 ( 1.393 7.799 -3.334) 8.595 6.922 ( 4.610 9.848 0.215) 10.876 7.095 ( 2.083 0.077 -4.993) 5.411 7.250 ( -2.466 2.391 6.068) 6.973 7.633 ( 1.142 9.526 0.441) 9.605 7.764 ( -0.128 2.354 -1.561) 2.828 7.901 ( -2.871 -5.289 -0.729) 6.062 8.032 ( 0.949 -11.047 2.032) 11.272 8.340 ( -3.809 -3.383 0.630) 5.133 8.380 ( -2.669 -4.192 -0.081) 4.971 8.974 ( -1.144 -0.417 0.666) 1.388 9.137 ( -2.860 -4.071 -0.227) 4.980 13.290 ( -1.390 5.262 -0.933) 5.522 13.376 ( -2.774 3.449 0.189) 4.430 14.779 ( -2.275 0.595 -0.483) 2.400 14.839 ( -2.542 0.468 0.279) 2.599 15.180 ( -1.981 -2.557 -1.882) 3.743 15.305 ( 0.300 -5.164 4.872) 7.106 15.759 ( -7.322 7.134 -1.595) 10.347 15.946 ( -9.080 0.447 -0.579) 9.110 ======================= Grid point 186 (92/190) ======================= q-point: ( 0.40 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.843 ( 0.769 0.957 -3.125) 3.358 2.068 ( 2.836 0.374 1.671) 3.312 2.282 ( 3.776 0.784 -3.449) 5.174 2.307 ( 0.809 -2.858 3.327) 4.460 2.647 ( 3.411 0.426 2.654) 4.343 2.728 ( 1.549 3.159 -3.787) 5.170 3.036 ( -1.134 -8.611 -3.762) 9.465 3.145 ( 2.489 0.036 -1.171) 2.751 3.456 ( -1.719 -2.439 2.040) 3.614 3.572 ( -4.124 -10.331 11.139) 15.742 4.172 ( 2.630 3.676 -2.566) 5.197 4.684 ( 0.451 8.898 -4.427) 9.949 4.712 ( -1.881 4.304 -5.811) 7.472 5.062 ( -1.153 0.208 1.864) 2.202 5.339 ( 1.725 -7.021 9.560) 11.986 5.348 ( 0.152 4.370 -4.796) 6.490 5.637 ( 2.328 -1.216 0.984) 2.805 5.758 ( 4.101 -6.355 4.865) 8.993 6.081 ( 4.476 2.600 -2.093) 5.584 6.246 ( 6.391 7.569 -1.922) 10.091 6.482 ( 6.084 -5.872 -1.958) 8.679 6.760 ( -0.608 -1.443 -4.418) 4.687 6.953 ( 5.547 1.793 2.481) 6.335 6.985 ( 3.820 2.596 0.743) 4.678 7.159 ( 4.761 -2.853 -4.333) 7.042 7.207 ( -1.730 1.350 4.951) 5.416 7.643 ( -0.714 6.935 -0.670) 7.003 7.763 ( 0.270 1.185 -0.517) 1.321 7.822 ( -4.500 -1.303 0.872) 4.765 8.029 ( -1.571 -8.127 1.683) 8.447 8.286 ( -1.514 -3.467 -0.621) 3.834 8.331 ( -2.154 -3.261 -0.130) 3.910 8.960 ( -0.328 -0.936 0.422) 1.078 9.082 ( -2.629 -3.818 -0.384) 4.652 13.271 ( -0.409 4.732 -0.751) 4.809 13.330 ( -1.999 3.343 0.182) 3.899 14.748 ( -0.937 0.303 -0.123) 0.992 14.802 ( -1.342 0.515 0.362) 1.482 15.154 ( -0.595 -1.671 -0.524) 1.850 15.312 ( -0.542 -4.024 2.324) 4.679 15.649 ( -3.461 4.734 -0.905) 5.934 15.786 ( -7.128 -0.065 -0.649) 7.158 ======================= Grid point 187 (93/190) ======================= q-point: ( 0.47 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.877 ( 2.935 -1.100 0.207) 3.141 2.111 ( 1.164 -6.703 1.562) 6.980 2.301 ( -1.721 0.040 1.307) 2.161 2.328 ( 1.513 -3.614 -1.665) 4.257 2.659 ( -1.042 1.459 -3.256) 3.717 2.788 ( 3.604 5.730 2.277) 7.142 3.020 ( -0.059 -6.438 -3.249) 7.211 3.175 ( 0.750 -1.265 -3.551) 3.844 3.429 ( -1.111 -3.674 2.169) 4.408 3.542 ( -1.245 -8.586 13.609) 16.139 4.162 ( -1.807 7.952 -6.742) 10.580 4.655 ( -2.196 6.561 -9.068) 11.406 4.708 ( 2.140 1.673 0.489) 2.760 5.050 ( -0.792 1.442 -0.318) 1.675 5.244 ( -5.384 -0.796 -0.784) 5.499 5.415 ( 2.724 -0.405 4.963) 5.676 5.710 ( 4.396 -3.458 1.741) 5.857 5.829 ( 0.599 -1.013 4.676) 4.822 6.175 ( 3.707 -0.308 1.434) 3.987 6.305 ( 1.088 6.928 -2.372) 7.403 6.616 ( 7.230 -0.816 -2.110) 7.576 6.720 ( -2.505 -2.247 -3.784) 5.064 6.957 ( -0.785 3.964 0.080) 4.042 7.088 ( 0.289 -2.961 -0.562) 3.028 7.138 ( -1.999 -1.143 4.781) 5.307 7.321 ( 8.343 -3.798 -3.366) 9.765 7.623 ( 0.364 2.976 -0.474) 3.035 7.700 ( -5.456 -1.278 0.675) 5.644 7.804 ( 0.615 1.697 2.571) 3.141 7.987 ( -2.458 -2.131 0.342) 3.271 8.275 ( 0.256 -3.040 -0.879) 3.175 8.306 ( -0.206 -3.503 0.107) 3.511 8.960 ( 0.039 -1.457 0.348) 1.498 9.038 ( -1.613 -3.433 -0.766) 3.869 13.271 ( 0.505 4.258 -0.430) 4.309 13.298 ( -1.326 3.492 -0.040) 3.736 14.741 ( 0.167 0.315 0.486) 0.603 14.787 ( -0.328 0.753 0.576) 1.004 15.151 ( 0.321 -1.539 0.087) 1.574 15.289 ( -1.834 -2.421 -0.653) 3.106 15.627 ( 1.108 1.774 0.113) 2.095 15.673 ( -4.123 0.307 -0.202) 4.139 ======================= Grid point 188 (94/190) ======================= q-point: (-0.47 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.942 ( 2.440 -3.410 2.870) 5.081 2.120 ( 0.077 -9.580 0.888) 9.622 2.238 ( -4.661 2.625 -1.978) 5.703 2.352 ( 1.542 -3.503 -0.978) 3.951 2.637 ( -0.727 3.012 0.933) 3.236 2.841 ( 1.463 4.634 -0.853) 4.934 3.014 ( -0.325 -3.928 -1.390) 4.179 3.159 ( -1.221 -3.204 -5.580) 6.549 3.441 ( 2.064 -3.236 4.742) 6.101 3.547 ( -1.053 -7.692 11.928) 14.232 4.111 ( -2.127 8.797 -5.839) 10.771 4.602 ( -0.968 2.939 -11.242) 11.660 4.759 ( 2.216 2.048 1.839) 3.534 5.002 ( -3.365 -0.940 -8.105) 8.826 5.187 ( -1.032 -1.470 8.198) 8.393 5.486 ( 3.552 7.157 2.277) 8.308 5.769 ( -1.943 1.503 3.735) 4.470 5.807 ( 0.210 -6.156 3.146) 6.917 6.176 ( -3.021 1.161 0.717) 3.315 6.319 ( -0.310 2.870 -1.322) 3.175 6.649 ( -4.333 -4.098 -1.697) 6.201 6.722 ( 2.920 -0.853 -3.899) 4.946 6.955 ( 0.654 1.828 0.585) 2.028 7.023 ( -4.090 0.366 -1.462) 4.359 7.098 ( -3.459 1.615 2.662) 4.654 7.413 ( -0.409 -6.760 -0.800) 6.819 7.632 ( 0.568 1.779 -1.985) 2.725 7.676 ( 3.087 2.962 1.887) 4.676 7.808 ( 0.169 -2.013 3.096) 3.697 7.951 ( -1.014 0.104 -0.870) 1.340 8.292 ( 1.533 -3.229 -0.222) 3.582 8.323 ( 1.832 -3.920 0.254) 4.334 8.957 ( -0.438 -1.503 0.415) 1.619 9.025 ( 0.510 -3.319 -1.166) 3.554 13.278 ( -0.713 3.858 -0.401) 3.943 13.289 ( 1.369 3.793 -0.116) 4.034 14.754 ( 0.935 0.498 1.083) 1.515 14.788 ( 0.228 1.095 0.214) 1.138 15.171 ( 1.822 -2.073 1.354) 3.074 15.245 ( -2.270 -2.494 -2.366) 4.119 15.632 ( -0.084 1.859 0.206) 1.872 15.680 ( 4.103 0.418 -0.060) 4.124 ======================= Grid point 189 (95/190) ======================= q-point: (-0.40 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.934 ( -3.550 -3.889 -0.676) 5.309 2.112 ( -5.521 4.858 -4.894) 8.834 2.164 ( 1.839 -2.624 6.073) 6.866 2.386 ( 1.913 -4.966 -0.835) 5.387 2.632 ( -0.298 0.807 4.546) 4.627 2.843 ( -0.572 2.760 -5.351) 6.048 3.002 ( -0.627 -2.533 -0.154) 2.614 3.129 ( -0.576 -2.625 -4.766) 5.472 3.512 ( 1.821 -3.882 9.356) 10.292 3.541 ( 0.706 -5.251 5.591) 7.703 4.050 ( -3.842 5.078 -2.249) 6.754 4.592 ( 2.069 1.558 -11.241) 11.535 4.768 ( -1.898 2.684 -4.031) 5.201 4.911 ( -5.242 -4.900 -2.520) 7.605 5.189 ( -1.187 -1.014 6.040) 6.239 5.524 ( -0.358 12.250 4.295) 12.986 5.688 ( -3.941 5.517 2.890) 7.370 5.858 ( 1.497 -10.359 4.553) 11.414 6.108 ( -3.617 1.784 -3.442) 5.302 6.255 ( -4.561 2.284 -0.183) 5.104 6.545 ( -6.507 -8.013 -1.964) 10.507 6.689 ( -3.827 -6.275 -3.460) 8.124 6.962 ( -1.299 5.506 0.831) 5.718 6.987 ( 1.238 2.623 -1.618) 3.321 7.025 ( -4.849 5.254 1.051) 7.227 7.362 ( -2.406 -4.965 3.256) 6.406 7.659 ( -1.275 8.029 -2.064) 8.387 7.706 ( 2.948 3.360 0.443) 4.492 7.859 ( 2.862 -3.958 0.091) 4.885 7.946 ( 0.902 -5.841 0.658) 5.946 8.324 ( 1.728 -3.683 0.161) 4.071 8.375 ( 3.136 -5.176 0.791) 6.103 8.951 ( 0.060 -1.001 0.471) 1.108 9.049 ( 1.920 -3.511 -1.310) 4.211 13.269 ( -0.087 4.390 -0.728) 4.451 13.323 ( 2.110 3.214 -0.028) 3.845 14.776 ( 0.997 0.907 0.693) 1.516 14.800 ( 1.189 0.976 0.087) 1.540 15.199 ( -1.767 -2.832 -2.386) 4.103 15.234 ( 4.247 -2.950 3.413) 6.196 15.666 ( 3.376 3.613 -0.461) 4.966 15.780 ( 6.086 0.636 -0.774) 6.168 ======================= Grid point 190 (96/190) ======================= q-point: (-0.33 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.834 ( -5.680 4.231 -3.668) 7.976 1.974 ( -7.236 8.385 -1.497) 11.176 2.209 ( 0.269 0.547 5.008) 5.045 2.416 ( 1.338 -3.313 -1.185) 3.765 2.645 ( 0.477 -6.616 4.995) 8.303 2.818 ( -0.173 0.221 -6.715) 6.721 2.981 ( -1.766 0.365 -2.224) 2.864 3.128 ( 0.916 -0.346 -1.679) 1.943 3.494 ( -2.271 -1.716 5.564) 6.250 3.637 ( 5.213 -6.021 6.991) 10.597 3.941 ( -7.271 -1.424 1.455) 7.550 4.639 ( 1.914 6.251 -7.672) 10.079 4.653 ( -7.946 -9.221 -10.739) 16.232 4.763 ( -8.572 2.880 2.657) 9.425 5.147 ( -3.788 -3.579 1.790) 5.510 5.521 ( -1.446 11.812 10.435) 15.827 5.643 ( -1.910 7.488 2.428) 8.101 5.808 ( -6.526 -7.625 1.344) 10.126 5.958 ( -9.803 0.667 -5.488) 11.255 6.266 ( 1.356 -2.966 2.129) 3.895 6.405 ( -2.598 -9.624 -5.583) 11.425 6.634 ( -1.762 -5.579 1.107) 5.955 6.916 ( -5.529 7.937 -0.198) 9.675 6.940 ( -1.222 3.554 -0.977) 3.883 6.992 ( -0.287 6.235 -3.801) 7.308 7.347 ( -0.723 -0.138 5.483) 5.533 7.628 ( -0.554 11.519 -0.117) 11.533 7.768 ( 2.679 3.905 -0.577) 4.770 7.864 ( -1.329 -5.999 -3.188) 6.922 7.989 ( 1.921 -9.990 2.345) 10.440 8.363 ( 2.303 -3.731 0.132) 4.386 8.437 ( 2.909 -7.426 1.743) 8.164 8.966 ( 1.331 -0.495 0.897) 1.680 9.091 ( 2.672 -3.628 -1.540) 4.762 13.272 ( 0.553 4.938 -0.992) 5.067 13.368 ( 2.426 2.438 -0.301) 3.452 14.800 ( 1.737 1.238 -0.316) 2.157 14.834 ( 2.222 0.745 0.507) 2.398 15.176 ( -0.152 -2.123 -1.170) 2.429 15.346 ( 6.439 -4.308 5.105) 9.278 15.752 ( 5.424 5.467 -1.906) 7.934 15.913 ( 7.752 1.556 -1.351) 8.021 ======================= Grid point 191 (97/190) ======================= q-point: (-0.27 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.710 ( -6.525 12.157 -2.276) 13.984 1.835 ( -6.822 11.462 0.704) 13.358 2.182 ( -3.164 6.224 0.775) 7.025 2.438 ( 1.052 -1.779 -2.154) 2.985 2.636 ( -2.163 -12.864 -0.175) 13.045 2.837 ( 1.821 -0.784 -0.295) 2.004 2.921 ( -2.917 4.088 -5.967) 7.799 3.142 ( 0.161 2.495 0.105) 2.503 3.460 ( -1.988 0.715 3.694) 4.255 3.703 ( -3.772 -8.981 3.004) 10.193 3.818 ( -1.860 -7.678 7.286) 10.747 4.326 ( -19.342 -5.884 -0.025) 20.217 4.639 ( -4.759 6.748 -3.208) 8.859 4.723 ( 4.895 -1.100 -9.213) 10.490 5.020 ( -9.935 1.564 1.703) 10.201 5.483 ( -9.591 6.009 5.148) 12.434 5.523 ( -4.298 -2.757 6.988) 8.655 5.696 ( -6.133 -5.190 -2.878) 8.534 5.839 ( -0.469 2.639 1.318) 2.987 6.161 ( -6.513 -12.168 -2.556) 14.036 6.499 ( 4.543 -3.202 -0.453) 5.577 6.606 ( -0.608 -1.674 -0.403) 1.827 6.841 ( -1.692 10.291 0.457) 10.439 6.900 ( -2.059 4.717 -5.252) 7.353 6.985 ( 0.669 7.161 -3.586) 8.037 7.344 ( 0.026 2.690 4.850) 5.546 7.638 ( 1.053 11.140 0.236) 11.192 7.802 ( 0.295 4.580 1.150) 4.732 7.817 ( -2.204 -7.414 -4.679) 9.040 7.997 ( -1.696 -12.358 2.254) 12.676 8.412 ( 2.479 -3.618 -0.525) 4.417 8.499 ( 3.259 -8.100 3.550) 9.425 9.006 ( 2.449 -0.409 1.671) 2.993 9.146 ( 3.236 -3.835 -1.978) 5.393 13.286 ( 1.096 5.358 -1.168) 5.592 13.412 ( 2.015 1.484 -0.766) 2.617 14.850 ( 3.563 1.687 -0.465) 3.969 14.891 ( 3.518 1.101 0.694) 3.751 15.190 ( 1.657 -1.007 -0.109) 1.942 15.494 ( 7.524 -6.660 5.658) 11.531 15.865 ( 6.498 8.111 -3.046) 10.830 16.077 ( 9.373 2.669 -1.617) 9.879 ======================= Grid point 192 (98/190) ======================= q-point: (-0.20 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.574 ( -7.157 14.778 0.913) 16.446 1.708 ( -6.777 17.188 2.464) 18.639 2.104 ( -4.632 11.078 -3.255) 12.441 2.440 ( -0.380 -0.014 -6.707) 6.718 2.578 ( -2.965 -16.809 -2.369) 17.232 2.751 ( -8.665 14.387 -1.414) 16.854 2.947 ( 3.870 -9.046 -1.443) 9.944 3.118 ( -2.830 8.556 0.246) 9.015 3.423 ( -2.914 2.099 4.065) 5.424 3.557 ( -7.650 -13.610 3.152) 15.927 3.773 ( -10.903 -6.888 -5.788) 14.136 4.040 ( -5.737 -7.176 11.668) 14.851 4.547 ( -5.119 9.680 0.144) 10.951 4.693 ( -9.753 -2.984 -3.978) 10.947 4.895 ( 2.430 0.242 -1.693) 2.971 5.264 ( -9.932 0.693 0.581) 9.973 5.464 ( -5.178 -7.961 0.847) 9.534 5.627 ( -0.168 -9.670 5.042) 10.907 5.812 ( -4.876 -5.240 5.627) 9.104 6.089 ( 0.072 -2.906 -4.607) 5.448 6.469 ( -4.889 -0.769 2.723) 5.648 6.608 ( -1.850 9.142 -1.336) 9.422 6.823 ( -0.795 1.939 -4.807) 5.244 6.894 ( 2.862 8.495 -3.224) 9.526 7.013 ( 3.082 6.231 -3.755) 7.901 7.380 ( 2.888 2.183 2.965) 4.679 7.652 ( 0.201 10.124 -0.714) 10.151 7.739 ( -3.982 -8.577 -3.840) 10.206 7.811 ( -0.604 4.696 0.392) 4.751 7.930 ( -5.274 -12.377 2.698) 13.722 8.451 ( 1.679 -4.140 -0.437) 4.489 8.582 ( 4.370 -5.193 4.966) 8.410 9.061 ( 2.704 -0.685 2.367) 3.658 9.210 ( 3.723 -4.615 -2.566) 6.461 13.309 ( 1.370 5.575 -1.315) 5.889 13.442 ( 1.262 0.801 -0.344) 1.534 14.942 ( 5.870 2.501 0.347) 6.390 14.971 ( 4.475 2.020 0.390) 4.925 15.236 ( 2.952 -0.297 -0.187) 2.973 15.645 ( 6.684 -10.279 3.947) 12.881 15.994 ( 7.240 11.648 -2.125) 13.879 16.273 ( 11.101 3.429 -1.904) 11.774 ======================= Grid point 193 (99/190) ======================= q-point: (-0.13 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.438 ( -7.022 15.533 2.695) 17.258 1.572 ( -7.715 20.846 4.445) 22.668 1.976 ( -8.114 14.004 -5.786) 17.187 2.390 ( -2.771 2.773 -14.239) 14.769 2.529 ( -2.027 -18.087 -1.347) 18.250 2.583 ( -6.574 14.677 1.986) 16.204 2.986 ( -1.745 -0.204 -0.231) 1.772 3.055 ( -1.742 3.281 1.088) 3.871 3.356 ( -4.807 5.832 6.418) 9.915 3.403 ( -11.355 -17.036 0.276) 20.476 3.530 ( -5.392 -3.636 -10.168) 12.069 3.978 ( -7.935 2.988 4.032) 9.389 4.438 ( -3.141 3.362 9.647) 10.688 4.569 ( -1.739 -8.842 2.669) 9.398 4.980 ( 4.261 -9.274 -3.817) 10.897 5.132 ( -2.966 4.350 0.181) 5.268 5.357 ( -5.179 -13.727 -2.272) 14.846 5.647 ( -0.543 -14.025 5.377) 15.030 5.694 ( -6.306 -7.349 6.203) 11.500 6.110 ( 1.897 0.486 -2.375) 3.078 6.374 ( -4.933 6.542 2.710) 8.630 6.528 ( -5.199 13.701 -0.249) 14.657 6.812 ( 0.799 1.290 -5.871) 6.064 6.943 ( 2.153 2.787 -3.853) 5.220 7.090 ( 4.958 6.228 -2.449) 8.329 7.445 ( 2.860 0.452 0.537) 2.945 7.637 ( -3.017 -2.995 -1.416) 4.481 7.654 ( -2.466 3.360 -4.553) 6.173 7.753 ( -6.050 -10.054 0.073) 11.734 7.850 ( -2.032 4.318 3.163) 5.725 8.481 ( 1.492 -3.138 0.742) 3.553 8.672 ( 3.614 -2.093 5.147) 6.628 9.111 ( 1.885 -0.732 2.210) 2.995 9.279 ( 3.609 -5.984 -3.079) 7.636 13.333 ( 1.349 5.720 -1.202) 5.998 13.466 ( 1.283 0.856 2.039) 2.557 15.037 ( 3.088 3.195 1.329) 4.637 15.089 ( 7.584 2.741 -0.621) 8.088 15.299 ( 3.485 -0.099 -1.114) 3.660 15.750 ( 3.441 -12.808 -0.705) 13.281 16.139 ( 7.553 13.383 1.992) 15.496 16.501 ( 12.485 2.729 -2.965) 13.119 ======================= Grid point 194 (100/190) ======================= q-point: (-0.07 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.315 ( -5.811 16.927 3.600) 18.255 1.438 ( -6.247 21.362 4.777) 22.764 1.790 ( -8.293 14.305 -5.402) 17.395 2.306 ( -2.704 6.162 -17.113) 18.389 2.456 ( -3.561 -2.721 -3.098) 5.448 2.561 ( 1.657 -3.708 5.289) 6.668 2.892 ( -5.588 23.866 0.562) 24.518 3.058 ( 0.260 -16.786 1.903) 16.895 3.168 ( -8.803 -16.826 -1.318) 19.036 3.314 ( -2.119 10.484 3.705) 11.319 3.485 ( 1.200 -2.661 -10.421) 10.822 3.760 ( -11.647 10.144 -1.679) 15.536 4.469 ( 1.542 -2.355 11.098) 11.449 4.609 ( 4.568 -12.205 10.389) 16.666 5.012 ( 0.832 -15.145 0.004) 15.168 5.133 ( 0.210 -3.358 -1.905) 3.866 5.278 ( -1.363 -11.805 -3.554) 12.404 5.550 ( -6.205 -10.403 -0.074) 12.114 5.675 ( -0.259 -9.534 8.507) 12.781 6.143 ( 1.551 0.303 0.240) 1.598 6.298 ( -3.126 10.586 2.771) 11.380 6.431 ( -4.204 14.998 -0.025) 15.576 6.830 ( 1.839 -0.006 -5.967) 6.244 6.961 ( 0.145 -0.337 -3.791) 3.809 7.180 ( 4.286 6.070 -1.638) 7.609 7.479 ( 0.573 -0.573 -1.785) 1.960 7.537 ( -5.087 -11.212 -0.562) 12.325 7.602 ( -3.934 -0.719 -4.395) 5.942 7.663 ( -1.338 1.953 1.289) 2.695 7.837 ( -0.283 7.733 0.321) 7.745 8.512 ( 1.336 -1.152 2.415) 2.991 8.731 ( 1.453 -0.452 4.424) 4.678 9.138 ( 0.551 -0.466 1.312) 1.497 9.330 ( 2.018 -6.710 -3.696) 7.922 13.360 ( 1.604 6.095 0.410) 6.316 13.503 ( 1.793 1.073 4.662) 5.109 15.078 ( 0.968 3.843 0.603) 4.008 15.223 ( 5.460 2.411 -0.655) 6.004 15.358 ( 2.612 -0.123 -1.800) 3.175 15.771 ( -0.801 -12.361 -5.454) 13.535 16.280 ( 5.707 11.901 6.082) 14.533 16.728 ( 10.483 -0.869 -4.860) 11.587 ======================= Grid point 195 (101/190) ======================= q-point: ( 0.00 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.610 ( 0.448 17.340 2.159) 17.479 1.808 ( -0.926 19.722 1.041) 19.771 1.894 ( 1.134 0.169 -0.276) 1.180 2.149 ( -2.150 -9.187 -0.490) 9.448 2.407 ( -0.249 8.334 -13.647) 15.992 2.533 ( 2.448 -10.325 -3.765) 11.259 2.570 ( -3.664 -12.486 -1.452) 13.093 2.722 ( -0.282 -15.801 -3.632) 16.215 3.326 ( -1.505 13.518 -2.315) 13.797 3.404 ( -0.574 2.826 -5.565) 6.267 3.769 ( 0.430 16.123 5.078) 16.910 3.874 ( 2.301 7.416 2.053) 8.031 4.464 ( -5.361 4.724 7.841) 10.609 4.612 ( 5.301 -2.585 10.232) 11.810 4.712 ( 4.543 -15.206 0.262) 15.872 4.777 ( 1.446 -15.978 4.283) 16.606 5.102 ( -1.741 -1.898 -5.597) 6.162 5.219 ( -3.480 -11.166 -4.467) 12.520 5.806 ( 1.535 10.908 10.522) 15.233 6.031 ( 0.838 -10.657 7.748) 13.203 6.515 ( -1.340 11.081 -0.958) 11.203 6.626 ( -0.830 3.177 -1.102) 3.463 6.865 ( 0.946 5.133 -5.825) 7.821 6.938 ( 0.072 0.827 -7.256) 7.304 7.228 ( 0.212 -5.372 -3.052) 6.182 7.262 ( 0.069 -8.602 -2.970) 9.100 7.473 ( 0.030 0.802 1.514) 1.714 7.497 ( -0.639 -0.404 0.111) 0.765 7.809 ( 0.312 5.868 -1.352) 6.030 7.881 ( -0.695 -0.979 -2.927) 3.164 8.601 ( 0.123 5.289 4.801) 7.144 8.701 ( -1.071 -3.884 3.518) 5.349 9.156 ( -0.110 2.147 -0.625) 2.239 9.227 ( 0.402 -4.972 -2.045) 5.391 13.504 ( 1.729 4.045 4.394) 6.217 13.552 ( 1.502 -0.784 5.506) 5.761 15.204 ( -0.784 8.404 -1.249) 8.533 15.320 ( 0.018 1.378 -0.057) 1.379 15.363 ( -0.039 -1.685 -3.650) 4.020 15.464 ( -3.337 -11.211 -4.625) 12.579 16.571 ( 1.038 9.530 2.258) 9.849 16.735 ( 0.857 -6.857 -1.733) 7.124 ======================= Grid point 196 (102/190) ======================= q-point: ( 0.07 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.672 ( 4.651 17.350 2.608) 18.151 1.862 ( 5.886 21.586 1.167) 22.404 2.005 ( 8.510 -7.345 -0.454) 11.250 2.144 ( 2.717 -0.177 -2.758) 3.875 2.364 ( -1.405 9.434 -12.602) 15.804 2.493 ( -2.465 -15.309 -3.971) 16.007 2.603 ( 3.905 -10.708 -1.632) 11.514 2.755 ( 4.209 -18.462 -4.560) 19.477 3.305 ( 0.143 13.628 -1.923) 13.764 3.412 ( 2.249 2.454 -3.470) 4.808 3.764 ( -0.986 16.927 5.363) 17.783 4.003 ( 7.364 -1.209 4.789) 8.867 4.378 ( -2.356 9.017 5.113) 10.630 4.658 ( 2.797 -10.765 4.896) 12.152 4.891 ( 6.762 -7.776 5.556) 11.708 4.907 ( 11.383 -11.151 5.787) 16.953 5.064 ( -0.580 -2.441 -5.770) 6.292 5.155 ( -1.742 -8.200 -5.378) 9.959 5.845 ( 0.504 9.285 11.411) 14.720 6.055 ( 0.297 -10.723 8.117) 13.452 6.488 ( -1.561 10.758 -3.670) 11.473 6.622 ( 0.044 -0.562 -3.425) 3.471 6.885 ( 2.334 8.259 -4.738) 9.803 6.941 ( 1.641 4.903 -7.512) 9.120 7.229 ( 0.443 -7.532 -2.000) 7.806 7.259 ( -0.251 -8.473 -2.645) 8.880 7.486 ( 1.195 0.101 1.377) 1.826 7.501 ( 1.350 -0.714 -0.015) 1.527 7.819 ( 0.775 4.547 -0.906) 4.700 7.866 ( -0.276 0.151 -3.085) 3.101 8.588 ( -2.247 3.495 5.068) 6.554 8.658 ( -3.700 -3.048 2.889) 5.597 9.143 ( -1.092 2.700 -0.539) 2.962 9.220 ( -0.787 -4.827 -1.594) 5.144 13.536 ( 0.437 4.005 4.913) 6.354 13.580 ( 0.303 -0.575 4.990) 5.032 15.164 ( -3.067 7.824 -1.335) 8.508 15.265 ( -5.046 2.426 -0.621) 5.633 15.339 ( -2.526 -3.114 -1.287) 4.211 15.373 ( -4.318 -10.094 -6.717) 12.871 16.548 ( -3.766 8.327 2.315) 9.428 16.686 ( -5.276 -5.585 -1.259) 7.786 ======================= Grid point 197 (103/190) ======================= q-point: ( 0.13 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.779 ( 5.802 15.160 2.408) 16.410 1.988 ( 4.715 13.177 -0.952) 14.027 2.124 ( 5.487 -2.709 -0.583) 6.147 2.251 ( 4.315 10.548 -7.173) 13.466 2.331 ( -0.337 4.570 -3.969) 6.062 2.499 ( 6.304 -15.206 -4.278) 17.008 2.677 ( 3.780 -10.023 -3.022) 11.130 2.852 ( 5.986 -19.361 -6.138) 21.174 3.345 ( 4.711 12.950 0.068) 13.781 3.481 ( 5.132 0.002 -1.824) 5.447 3.745 ( -2.029 14.626 7.522) 16.572 4.059 ( -2.525 -14.075 10.953) 18.013 4.506 ( 14.716 18.008 -1.417) 23.299 4.798 ( 10.472 -6.454 2.563) 12.565 4.977 ( 2.130 -2.841 -3.029) 4.667 5.057 ( 1.490 -8.002 -5.586) 9.872 5.129 ( 6.710 -6.400 11.341) 14.650 5.186 ( 7.307 -5.860 0.305) 9.372 5.867 ( -0.069 8.021 10.516) 13.226 6.072 ( 0.137 -11.423 6.627) 13.207 6.426 ( -3.838 9.769 -7.559) 12.935 6.585 ( -3.097 -5.510 -6.924) 9.375 6.941 ( 3.573 11.997 -3.895) 13.110 6.985 ( 4.173 10.314 -4.913) 12.163 7.209 ( -2.367 -7.051 -4.299) 8.591 7.261 ( 0.861 -7.056 2.249) 7.456 7.527 ( 2.816 -1.920 0.700) 3.480 7.554 ( 3.936 -4.297 -0.337) 5.837 7.828 ( 0.238 3.982 -1.299) 4.195 7.865 ( 0.664 0.628 -1.435) 1.701 8.534 ( -3.994 1.499 4.396) 6.126 8.576 ( -5.093 -2.395 2.927) 6.344 9.113 ( -1.795 3.028 -0.235) 3.527 9.193 ( -1.685 -4.654 -1.018) 5.053 13.532 ( -1.612 4.107 3.483) 5.621 13.576 ( -1.487 -0.364 3.084) 3.443 15.083 ( -4.953 5.552 -0.546) 7.460 15.141 ( -7.027 1.733 -0.092) 7.238 15.263 ( -3.807 -3.516 -1.841) 5.500 15.296 ( -3.189 -6.924 -4.394) 8.799 16.438 ( -7.662 7.003 1.601) 10.503 16.541 ( -9.067 -3.347 -0.605) 9.684 ======================= Grid point 198 (104/190) ======================= q-point: ( 0.20 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.898 ( 5.467 10.446 1.285) 11.860 2.025 ( 0.749 2.643 -3.891) 4.763 2.223 ( 2.786 9.047 -2.599) 9.817 2.269 ( 0.626 7.597 -7.285) 10.544 2.348 ( 3.612 0.732 6.451) 7.429 2.664 ( 8.127 -3.694 -5.626) 10.552 2.731 ( 2.271 -11.774 -2.687) 12.288 2.938 ( 3.659 -16.244 -7.770) 18.375 3.480 ( 6.382 5.759 1.549) 8.734 3.566 ( 2.569 -0.636 0.372) 2.673 3.744 ( 2.326 12.868 8.997) 15.873 4.074 ( 5.069 -14.954 9.445) 18.399 4.800 ( 10.628 12.770 -4.348) 17.173 4.983 ( 8.775 8.080 -0.842) 11.958 5.047 ( 3.153 -9.231 -6.151) 11.532 5.139 ( 13.223 -2.070 1.521) 13.471 5.252 ( 3.638 -1.864 15.065) 15.610 5.362 ( 9.016 -9.377 -0.696) 13.027 5.880 ( 0.009 6.714 7.669) 10.193 6.075 ( -1.018 -11.542 2.632) 11.881 6.331 ( -3.604 7.642 -8.868) 12.249 6.493 ( -4.370 -7.939 -7.390) 11.693 6.988 ( 1.929 10.690 -4.267) 11.670 7.073 ( 4.018 14.297 -0.549) 14.861 7.144 ( -2.627 -4.162 -4.378) 6.587 7.285 ( 0.851 -5.025 3.232) 6.035 7.595 ( 3.904 -3.114 -0.243) 5.000 7.641 ( 4.804 -7.711 -0.326) 9.090 7.829 ( 0.152 4.636 -1.059) 4.758 7.881 ( 0.785 -0.402 0.644) 1.092 8.453 ( -4.659 -0.121 2.323) 5.207 8.476 ( -5.537 -2.173 3.067) 6.692 9.074 ( -2.152 3.098 0.056) 3.772 9.153 ( -2.239 -4.516 -0.478) 5.063 13.489 ( -2.985 4.212 1.210) 5.303 13.535 ( -2.973 -0.279 1.163) 3.205 14.978 ( -5.458 3.406 -0.191) 6.436 15.011 ( -6.000 0.845 0.178) 6.062 15.203 ( -2.195 -2.860 -0.936) 3.725 15.230 ( -2.785 -4.874 -1.287) 5.759 16.267 ( -9.823 6.125 0.466) 11.586 16.346 ( -10.529 -1.924 -0.377) 10.710 ======================= Grid point 199 (105/190) ======================= q-point: ( 0.27 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.959 ( 0.340 5.639 -1.488) 5.842 2.036 ( 1.087 0.028 -2.781) 2.986 2.253 ( 1.723 4.850 2.056) 5.542 2.272 ( 0.965 6.696 -5.275) 8.579 2.470 ( 6.396 6.411 6.209) 10.980 2.745 ( 2.517 4.993 -11.796) 13.054 2.782 ( 2.737 -15.684 3.799) 16.368 2.975 ( 1.964 -12.847 -7.641) 15.076 3.504 ( -2.286 0.846 4.943) 5.511 3.560 ( -3.480 -4.988 2.760) 6.679 3.935 ( 13.634 15.738 5.825) 21.622 4.282 ( 12.523 -16.697 4.256) 21.301 4.886 ( 3.255 9.475 -5.051) 11.220 5.037 ( 0.696 -4.699 -0.379) 4.765 5.279 ( 13.531 10.587 -1.918) 17.288 5.307 ( -0.361 4.230 13.825) 14.462 5.395 ( 9.077 -2.046 3.156) 9.825 5.516 ( 6.717 -9.475 -5.606) 12.896 5.928 ( 5.582 3.264 3.327) 7.272 6.045 ( -0.772 -7.609 -2.512) 8.050 6.281 ( -0.145 3.834 -6.036) 7.152 6.430 ( -0.214 -9.477 -2.604) 9.830 7.005 ( 0.564 6.607 -3.804) 7.645 7.056 ( -2.665 3.199 -0.931) 4.266 7.167 ( 2.665 8.771 -2.136) 9.413 7.296 ( -0.541 -1.956 3.035) 3.651 7.670 ( 3.831 -1.694 -0.686) 4.245 7.733 ( 4.459 -8.406 0.512) 9.529 7.829 ( -0.149 4.399 -0.224) 4.407 7.889 ( -0.400 -1.278 1.777) 2.225 8.367 ( -4.559 -1.551 0.735) 4.872 8.377 ( -4.615 -1.954 1.553) 5.246 9.032 ( -2.097 2.891 0.225) 3.578 9.106 ( -2.484 -4.265 -0.130) 4.937 13.430 ( -2.951 3.959 -0.238) 4.943 13.473 ( -3.305 -0.172 0.026) 3.309 14.880 ( -4.377 2.545 -0.490) 5.087 14.911 ( -4.294 -0.104 0.086) 4.296 15.165 ( -1.595 -1.789 -0.906) 2.563 15.195 ( -0.842 -4.250 2.611) 5.058 16.070 ( -10.075 5.519 -0.518) 11.499 16.138 ( -10.490 -1.455 -0.613) 10.608 ======================= Grid point 200 (106/190) ======================= q-point: ( 0.33 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.933 ( -1.956 5.180 -1.789) 5.818 2.037 ( -0.814 -3.960 -0.496) 4.073 2.275 ( 0.613 5.083 -0.974) 5.212 2.306 ( 2.056 2.543 0.407) 3.295 2.597 ( 5.495 5.889 3.210) 8.671 2.780 ( 3.145 3.612 -6.515) 8.086 2.823 ( 1.453 -9.126 -0.776) 9.274 3.007 ( 2.697 -10.765 -4.606) 12.015 3.460 ( -2.782 -0.798 5.405) 6.131 3.484 ( -4.327 -3.812 4.638) 7.400 4.189 ( 10.427 12.979 1.838) 16.749 4.484 ( 6.701 -15.046 -1.148) 16.511 4.971 ( 5.754 8.640 -2.457) 10.668 5.059 ( 1.349 -1.746 3.693) 4.302 5.254 ( -5.558 7.987 6.069) 11.468 5.449 ( 0.128 1.487 -9.804) 9.917 5.506 ( 5.603 -5.987 7.917) 11.398 5.576 ( 2.360 -3.243 0.103) 4.012 6.067 ( 6.471 3.581 -5.184) 9.031 6.161 ( 12.726 -2.606 0.295) 12.993 6.297 ( 2.612 4.223 -2.406) 5.518 6.490 ( 6.349 -11.704 1.513) 13.401 6.989 ( -0.983 5.334 -3.369) 6.385 7.043 ( 1.507 -0.061 -1.714) 2.283 7.180 ( -1.091 7.948 -1.212) 8.114 7.269 ( -2.662 -0.782 2.931) 4.035 7.738 ( 2.742 -0.123 0.138) 2.748 7.786 ( -0.676 0.422 -0.099) 0.803 7.838 ( 2.328 -3.774 1.554) 4.699 7.867 ( -1.865 -0.837 1.718) 2.670 8.284 ( -3.581 -1.034 -0.056) 3.728 8.309 ( -2.764 -2.977 -0.429) 4.085 8.996 ( -1.663 2.359 0.218) 2.895 9.058 ( -2.396 -3.726 -0.053) 4.430 13.379 ( -2.068 3.383 -0.640) 4.016 13.413 ( -2.641 0.103 -0.306) 2.660 14.810 ( -2.728 2.112 -0.471) 3.482 14.842 ( -2.784 -0.687 -0.174) 2.873 15.143 ( -0.617 0.007 0.349) 0.709 15.196 ( 0.236 -4.903 2.999) 5.752 15.883 ( -8.661 4.797 -0.989) 9.950 15.943 ( -9.252 -1.276 -0.857) 9.379 ======================= Grid point 201 (107/190) ======================= q-point: ( 0.40 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.894 ( -1.566 4.348 -1.021) 4.733 2.007 ( -2.175 -6.144 0.798) 6.566 2.287 ( 0.739 3.179 0.030) 3.264 2.329 ( 0.202 -0.016 0.686) 0.715 2.683 ( 3.113 4.300 -2.001) 5.673 2.830 ( 1.744 -7.664 -2.706) 8.313 2.865 ( 4.081 6.936 -1.871) 8.262 3.063 ( 3.239 -8.811 -1.988) 9.595 3.413 ( -2.907 -1.388 3.409) 4.690 3.424 ( -2.636 -3.269 7.980) 9.017 4.328 ( 4.059 10.771 -2.356) 11.749 4.552 ( 1.640 -10.503 -3.667) 11.245 5.005 ( -3.467 12.784 -8.221) 15.590 5.089 ( 1.050 2.638 3.557) 4.551 5.207 ( 0.160 -3.836 12.257) 12.844 5.326 ( -6.653 -9.120 -6.316) 12.936 5.624 ( 6.035 3.497 2.153) 7.300 5.700 ( 7.624 -2.551 4.916) 9.423 6.166 ( 4.073 6.258 -3.162) 8.109 6.306 ( 2.503 -6.272 -3.462) 7.589 6.454 ( 11.905 7.820 0.358) 14.248 6.639 ( 6.515 -9.224 -0.299) 11.297 6.988 ( 1.675 4.422 -1.560) 4.979 7.084 ( 2.077 -4.497 -2.690) 5.637 7.134 ( -2.561 6.872 0.253) 7.338 7.216 ( -2.198 -1.158 2.182) 3.307 7.717 ( -4.003 1.183 -0.304) 4.185 7.759 ( -3.250 -1.106 1.361) 3.692 7.844 ( 0.754 2.124 2.017) 3.025 7.904 ( 2.829 -3.719 1.381) 4.872 8.234 ( -1.387 -0.809 -1.150) 1.975 8.263 ( -1.831 -3.108 -0.860) 3.708 8.970 ( -1.019 1.579 0.075) 1.880 9.015 ( -1.928 -2.889 -0.193) 3.478 13.348 ( -1.040 2.722 -0.574) 2.970 13.371 ( -1.686 0.525 -0.290) 1.790 14.772 ( -1.132 1.831 0.071) 2.154 14.803 ( -1.261 -0.819 0.167) 1.513 15.138 ( -0.079 1.075 0.405) 1.151 15.206 ( 0.160 -5.280 1.578) 5.513 15.740 ( -5.613 3.661 -0.740) 6.742 15.784 ( -6.736 -0.796 -0.685) 6.817 ======================= Grid point 202 (108/190) ======================= q-point: ( 0.47 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.879 ( 0.300 1.903 -0.054) 1.928 1.965 ( -1.860 -6.595 0.385) 6.863 2.302 ( 0.507 1.351 1.191) 1.871 2.323 ( -0.738 -0.183 1.002) 1.258 2.718 ( 1.216 4.751 -3.453) 5.998 2.853 ( 1.402 -8.036 -3.477) 8.867 2.940 ( 2.951 8.323 -0.421) 8.841 3.106 ( 1.150 -6.579 -3.397) 7.493 3.376 ( -1.328 -1.097 5.592) 5.851 3.404 ( -0.801 -4.185 9.134) 10.079 4.356 ( -0.029 10.701 -4.959) 11.794 4.558 ( -0.087 -8.891 -4.988) 10.195 4.895 ( -4.660 10.064 -7.390) 13.327 5.063 ( -5.644 -4.761 -6.791) 10.032 5.190 ( 0.546 2.792 10.787) 11.156 5.332 ( 4.765 -8.111 6.424) 11.391 5.739 ( 4.347 5.406 3.201) 7.640 5.826 ( 3.488 -2.029 4.644) 6.152 6.221 ( 2.102 5.103 -1.106) 5.629 6.332 ( 0.881 -4.168 -2.577) 4.979 6.635 ( 5.688 2.496 -2.944) 6.874 6.677 ( -1.996 -1.779 -4.799) 5.493 7.014 ( -0.332 1.574 1.031) 1.911 7.080 ( -0.232 -4.183 2.200) 4.732 7.125 ( 1.019 6.452 -0.153) 6.533 7.243 ( 3.554 -4.595 -1.195) 5.931 7.647 ( -2.075 0.613 0.271) 2.180 7.675 ( -4.199 -1.834 1.118) 4.716 7.863 ( 0.134 4.409 2.609) 5.125 7.945 ( 0.877 -3.001 1.183) 3.343 8.222 ( 0.193 -1.269 -1.489) 1.966 8.239 ( -0.311 -2.630 -0.880) 2.791 8.956 ( -0.438 0.813 -0.066) 0.926 8.985 ( -1.070 -2.034 -0.455) 2.343 13.336 ( -0.112 2.047 -0.434) 2.095 13.346 ( -0.823 1.081 -0.298) 1.391 14.764 ( 0.213 1.748 0.890) 1.973 14.793 ( 0.039 -0.628 0.810) 1.025 15.136 ( -0.239 0.980 -0.287) 1.049 15.200 ( -1.001 -4.944 -0.583) 5.078 15.672 ( -1.148 1.952 -0.050) 2.265 15.688 ( -2.771 0.349 -0.112) 2.795 ======================= Grid point 203 (109/190) ======================= q-point: (-0.47 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.898 ( 1.090 -0.134 0.650) 1.276 1.956 ( 1.540 -5.928 -0.399) 6.138 2.293 ( -1.872 2.135 0.701) 2.925 2.319 ( 0.206 -0.798 1.263) 1.508 2.723 ( -0.350 5.928 -0.672) 5.977 2.872 ( 0.867 -8.288 -1.793) 8.524 2.965 ( -0.034 6.916 -3.780) 7.882 3.091 ( -1.311 -4.781 -6.292) 8.011 3.389 ( 1.333 -1.133 8.492) 8.670 3.421 ( 0.540 -4.361 10.311) 11.208 4.322 ( -2.539 11.663 -4.969) 12.930 4.533 ( -1.256 -8.336 -7.730) 11.438 4.822 ( -1.749 3.948 -4.240) 6.052 4.922 ( -6.453 -5.999 -6.568) 10.989 5.267 ( 4.380 9.195 9.159) 13.698 5.468 ( 7.762 -8.972 5.973) 13.282 5.777 ( -1.399 4.631 4.584) 6.665 5.833 ( -3.201 0.321 4.147) 5.249 6.241 ( -0.154 5.024 -0.637) 5.067 6.330 ( -0.761 -2.290 -2.941) 3.804 6.579 ( -6.251 -0.830 -3.980) 7.457 6.640 ( -4.136 -5.532 -5.405) 8.771 7.032 ( 2.353 4.954 1.796) 5.771 7.099 ( -2.907 1.158 1.049) 3.300 7.117 ( 1.859 4.353 0.439) 4.753 7.266 ( -1.410 -7.847 -0.917) 8.025 7.648 ( 2.026 0.487 0.089) 2.085 7.671 ( 3.998 -1.976 1.310) 4.649 7.853 ( -1.494 4.957 2.462) 5.733 7.936 ( -1.915 -2.449 0.815) 3.214 8.233 ( 1.133 -1.568 -0.936) 2.150 8.249 ( 1.364 -2.826 -0.824) 3.245 8.950 ( -0.085 0.631 -0.126) 0.649 8.975 ( 0.241 -1.808 -0.702) 1.954 13.337 ( -0.060 1.785 -0.445) 1.841 13.342 ( 0.700 1.298 -0.362) 1.518 14.780 ( 1.069 1.748 1.433) 2.500 14.802 ( 0.680 -0.081 0.868) 1.106 15.133 ( 0.254 -0.558 0.015) 0.613 15.169 ( -1.656 -3.808 -1.655) 4.470 15.677 ( 1.655 1.928 0.058) 2.541 15.694 ( 3.099 0.276 0.003) 3.111 ======================= Grid point 204 (110/190) ======================= q-point: (-0.40 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.920 ( 1.501 2.542 -0.621) 3.017 2.024 ( 4.795 -7.216 0.631) 8.687 2.239 ( -3.620 5.286 -0.639) 6.438 2.323 ( 0.016 -3.022 0.713) 3.105 2.699 ( -2.528 6.493 2.869) 7.535 2.867 ( -1.862 -8.468 1.439) 8.789 2.947 ( 0.300 5.550 -8.200) 9.906 3.061 ( -0.023 -4.658 -6.934) 8.353 3.442 ( 1.376 -1.913 10.908) 11.160 3.456 ( 1.819 -2.990 8.780) 9.452 4.230 ( -6.475 12.188 -3.606) 14.265 4.481 ( -3.139 -11.216 -8.175) 14.230 4.789 ( -2.633 0.484 -5.851) 6.434 4.820 ( -1.150 -3.079 -2.488) 4.122 5.339 ( -0.443 13.056 6.415) 14.554 5.610 ( 2.264 -12.782 4.458) 13.725 5.725 ( -1.743 6.424 5.382) 8.559 5.779 ( -0.432 1.250 5.147) 5.314 6.182 ( -6.765 5.703 -5.213) 10.270 6.298 ( -1.277 -2.105 -3.893) 4.606 6.413 ( -10.829 -0.371 -1.205) 10.903 6.532 ( -4.299 -8.343 -1.076) 9.446 7.012 ( -3.217 2.128 -1.930) 4.314 7.043 ( -3.467 0.080 -0.770) 3.553 7.167 ( 2.882 7.170 0.012) 7.728 7.272 ( 2.977 -4.001 2.238) 5.466 7.718 ( 3.995 1.017 -0.661) 4.175 7.768 ( 4.355 -4.117 1.932) 6.297 7.820 ( -1.805 5.049 1.844) 5.670 7.883 ( -3.246 -1.620 0.513) 3.664 8.259 ( 1.536 -1.758 -0.360) 2.362 8.281 ( 1.798 -3.642 -0.627) 4.109 8.955 ( 0.702 1.136 -0.135) 1.342 8.990 ( 1.401 -2.331 -0.788) 2.832 13.341 ( 0.579 2.540 -0.684) 2.693 13.362 ( 1.376 0.498 -0.499) 1.546 14.805 ( 1.239 1.666 0.897) 2.262 14.820 ( 1.086 0.478 0.332) 1.232 15.142 ( -0.334 -1.725 -0.625) 1.865 15.159 ( 2.140 -3.246 1.718) 4.251 15.744 ( 5.037 3.373 -0.632) 6.095 15.784 ( 6.076 -0.644 -0.656) 6.146 ======================= Grid point 205 (111/190) ======================= q-point: (-0.33 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.956 ( 2.030 7.784 -1.376) 8.161 2.125 ( 4.988 -8.044 0.906) 9.509 2.154 ( -4.664 8.967 -1.333) 10.195 2.321 ( -0.335 -6.856 -0.638) 6.894 2.633 ( -4.656 6.584 3.902) 8.959 2.808 ( -3.699 -6.654 0.294) 7.619 2.962 ( 2.155 3.289 -6.684) 7.755 3.075 ( 2.331 -5.431 -5.575) 8.125 3.467 ( -0.050 0.248 8.399) 8.403 3.522 ( 2.783 -4.856 8.917) 10.528 4.053 ( -11.189 12.080 -1.057) 16.500 4.351 ( -9.568 -16.290 -4.460) 19.412 4.744 ( -0.171 4.368 -6.046) 7.461 4.819 ( 0.122 -1.874 -2.803) 3.374 5.251 ( -7.357 12.926 3.312) 15.237 5.522 ( -7.560 -11.779 3.843) 14.514 5.795 ( 1.861 6.567 5.036) 8.482 5.798 ( -2.966 5.583 7.648) 9.923 5.990 ( -8.544 2.120 -7.072) 11.291 6.109 ( -14.407 -10.012 -5.156) 18.286 6.350 ( 4.034 3.473 -0.690) 5.368 6.483 ( -1.173 -8.436 1.204) 8.602 6.974 ( -0.373 0.932 -3.540) 3.680 6.980 ( -1.183 0.663 -2.328) 2.694 7.206 ( 0.649 10.515 -0.158) 10.536 7.336 ( 2.107 -2.262 2.907) 4.243 7.747 ( -2.577 -2.018 -0.118) 3.275 7.773 ( -1.410 -1.350 0.557) 2.030 7.839 ( 0.100 1.671 0.899) 1.900 7.863 ( 3.208 0.395 1.988) 3.794 8.295 ( 2.392 -2.155 0.092) 3.221 8.314 ( 1.837 -4.192 -0.281) 4.585 8.979 ( 1.725 1.635 -0.002) 2.377 9.025 ( 2.265 -2.908 -0.859) 3.785 13.356 ( 1.063 3.191 -0.999) 3.508 13.391 ( 1.654 -0.277 -0.850) 1.880 14.834 ( 1.936 1.771 -0.277) 2.639 14.851 ( 2.205 0.331 0.207) 2.240 15.154 ( 1.576 0.898 0.935) 2.041 15.228 ( 4.172 -6.000 3.526) 8.114 15.864 ( 7.301 4.753 -1.500) 8.840 15.923 ( 8.168 -1.043 -1.342) 8.343 ======================= Grid point 206 (112/190) ======================= q-point: (-0.27 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.963 ( -2.393 12.879 -1.362) 13.170 2.081 ( -1.453 11.898 -0.789) 12.012 2.203 ( 2.425 -7.136 -0.910) 7.591 2.311 ( -0.083 -9.795 -1.361) 9.889 2.542 ( -4.866 6.551 2.571) 8.556 2.738 ( -3.526 -9.190 0.491) 9.856 2.987 ( 0.793 4.322 -6.101) 7.519 3.115 ( 1.961 -6.314 -4.629) 8.071 3.472 ( -0.602 2.864 5.698) 6.405 3.588 ( 2.625 -7.516 6.261) 10.128 3.806 ( -13.456 11.610 3.149) 18.050 4.103 ( -14.525 -15.136 0.723) 20.991 4.736 ( -0.897 5.391 -4.952) 7.375 4.807 ( -0.317 1.263 -4.471) 4.657 5.132 ( -5.122 10.557 3.007) 12.113 5.386 ( -8.086 -11.698 2.202) 14.390 5.525 ( -16.121 4.518 2.518) 16.930 5.695 ( -19.085 -7.324 -1.908) 20.531 5.855 ( -0.857 7.490 5.172) 9.143 6.011 ( 0.639 -5.247 -2.647) 5.911 6.446 ( 3.642 -0.163 -0.106) 3.648 6.509 ( 5.175 -5.389 -2.044) 7.746 6.981 ( 1.270 3.058 -4.876) 5.895 6.992 ( 2.576 2.704 -2.207) 4.338 7.188 ( -2.387 11.804 -0.688) 12.063 7.353 ( -0.578 -3.108 2.866) 4.268 7.667 ( -4.706 -3.165 -0.558) 5.699 7.724 ( -3.526 -7.034 0.341) 7.875 7.858 ( 0.672 6.039 0.501) 6.096 7.918 ( 1.921 0.750 2.280) 3.074 8.345 ( 2.564 -1.905 0.076) 3.195 8.372 ( 4.460 -4.333 1.777) 6.466 9.020 ( 2.435 1.817 0.155) 3.042 9.073 ( 2.746 -3.319 -1.055) 4.436 13.377 ( 1.297 3.511 -1.197) 3.930 13.420 ( 1.459 -0.787 -1.086) 1.982 14.891 ( 4.117 2.070 -0.382) 4.624 14.912 ( 4.155 0.289 0.214) 4.170 15.201 ( 2.828 3.114 1.665) 4.524 15.324 ( 4.849 -8.577 3.718) 10.531 16.019 ( 8.734 6.222 -1.819) 10.876 16.095 ( 9.692 -1.335 -1.629) 9.918 ======================= Grid point 207 (113/190) ======================= q-point: (-0.20 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.870 ( -5.812 15.170 -0.486) 16.252 2.073 ( -0.756 15.913 0.165) 15.932 2.191 ( -3.159 -10.309 -3.069) 11.211 2.326 ( 1.365 -1.072 -0.405) 1.783 2.466 ( -2.720 3.017 -1.955) 4.508 2.663 ( -4.832 -15.507 1.388) 16.302 2.929 ( -6.267 5.794 -6.476) 10.714 3.097 ( -3.881 -9.907 -5.006) 11.759 3.460 ( -1.898 6.513 1.788) 7.016 3.604 ( -4.182 11.720 6.890) 14.225 3.629 ( -2.355 -7.463 -0.961) 7.885 3.870 ( -6.839 -11.067 9.722) 16.241 4.673 ( -4.728 7.309 -3.033) 9.218 4.791 ( -1.341 0.909 -4.514) 4.796 4.982 ( -14.524 11.446 3.855) 18.890 5.169 ( -7.072 -3.260 -1.387) 7.910 5.327 ( -14.590 -10.449 2.344) 18.098 5.391 ( -4.008 -12.413 1.138) 13.094 5.808 ( -3.784 8.597 4.438) 10.389 6.006 ( -1.054 -8.421 0.124) 8.487 6.506 ( 3.025 5.247 -0.379) 6.068 6.619 ( 5.043 -4.912 -2.916) 7.620 6.974 ( -1.510 8.511 -4.895) 9.933 7.065 ( 4.651 1.489 -2.973) 5.717 7.120 ( -3.937 10.668 -2.287) 11.599 7.345 ( -0.327 -7.527 2.374) 7.899 7.574 ( -4.609 -3.055 -0.416) 5.545 7.642 ( -4.610 -8.355 -0.059) 9.543 7.858 ( -0.610 7.503 -0.509) 7.545 7.941 ( 0.068 0.292 1.287) 1.322 8.408 ( 3.781 1.122 1.606) 4.259 8.483 ( 6.029 -5.073 3.774) 8.737 9.070 ( 2.566 1.686 0.206) 3.078 9.126 ( 2.799 -3.691 -1.471) 4.861 13.401 ( 1.366 3.513 -0.944) 3.885 13.445 ( 1.236 -0.850 -0.337) 1.537 14.994 ( 6.419 2.331 -0.074) 6.830 15.012 ( 5.891 1.059 0.281) 5.992 15.262 ( 3.025 4.225 0.878) 5.270 15.420 ( 4.199 -10.822 2.335) 11.841 16.193 ( 9.230 7.730 -1.209) 12.099 16.291 ( 10.559 -2.000 -1.535) 10.856 ======================= Grid point 208 (114/190) ======================= q-point: (-0.13 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.755 ( -5.788 16.481 0.389) 17.472 2.021 ( -5.184 22.420 2.275) 23.124 2.088 ( -6.422 -12.117 -2.842) 14.005 2.332 ( -1.894 8.749 -0.991) 9.006 2.434 ( -0.007 -1.136 -7.533) 7.618 2.537 ( -6.977 -22.702 0.053) 23.751 2.777 ( -6.401 2.854 -3.753) 7.950 2.947 ( -9.327 -14.821 -4.749) 18.144 3.410 ( -2.523 9.788 -0.622) 10.127 3.532 ( -4.824 -0.705 -6.528) 8.147 3.625 ( 3.249 14.925 8.320) 17.393 3.891 ( 3.088 -10.549 11.499) 15.907 4.539 ( -8.034 7.853 -0.587) 11.250 4.669 ( -10.630 15.556 2.892) 19.061 4.764 ( -4.255 -11.784 -1.592) 12.629 5.018 ( -9.920 -16.383 0.011) 19.152 5.167 ( -1.812 0.748 -0.225) 1.973 5.349 ( -2.279 -14.342 2.025) 14.663 5.754 ( -1.945 10.992 5.487) 12.438 5.988 ( -0.574 -10.687 2.635) 11.022 6.550 ( 1.195 9.130 -0.131) 9.208 6.678 ( 1.284 -2.379 -1.983) 3.353 6.913 ( -3.136 10.581 -4.725) 12.005 7.031 ( -3.762 3.356 -5.488) 7.453 7.152 ( 4.114 1.929 -2.491) 5.182 7.336 ( -1.511 -12.398 -0.376) 12.496 7.499 ( -2.563 -0.026 0.695) 2.656 7.563 ( -3.213 -5.794 0.114) 6.626 7.837 ( -1.151 7.429 -1.609) 7.688 7.929 ( -1.134 -0.774 -0.450) 1.445 8.492 ( 4.087 4.406 3.311) 6.861 8.603 ( 5.061 -5.189 4.743) 8.662 9.117 ( 2.065 1.506 0.049) 2.556 9.174 ( 2.447 -4.223 -1.965) 5.261 13.428 ( 1.488 3.614 0.172) 3.912 13.472 ( 1.509 -0.759 1.802) 2.470 15.118 ( 5.384 3.624 0.220) 6.494 15.139 ( 7.077 1.611 -0.086) 7.258 15.317 ( 2.612 3.692 -1.009) 4.634 15.488 ( 2.384 -12.273 -0.082) 12.503 16.365 ( 8.280 9.056 0.112) 12.271 16.492 ( 10.054 -3.558 -1.450) 10.764 ======================= Grid point 209 (115/190) ======================= q-point: (-0.07 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.653 ( -4.495 17.079 1.262) 17.706 1.892 ( -7.107 22.206 2.403) 23.439 1.955 ( -6.047 -5.334 -1.905) 8.285 2.229 ( -6.099 -3.041 0.096) 6.816 2.423 ( 0.526 3.576 -11.291) 11.856 2.492 ( 1.497 -15.713 -2.283) 15.948 2.668 ( -5.083 -5.306 -2.876) 7.891 2.783 ( -5.603 -14.901 -3.607) 16.323 3.364 ( -2.027 12.193 -1.650) 12.470 3.448 ( -2.692 1.943 -6.802) 7.569 3.709 ( 3.576 17.267 6.120) 18.665 3.911 ( -3.244 -0.219 5.624) 6.496 4.472 ( 2.941 2.588 5.602) 6.836 4.537 ( -4.394 7.671 7.241) 11.427 4.700 ( -1.956 -13.898 -1.804) 14.150 4.850 ( -7.328 -17.912 2.212) 19.479 5.141 ( -1.338 -0.360 -2.930) 3.241 5.294 ( -3.417 -13.402 -1.325) 13.894 5.760 ( 1.052 11.967 8.198) 14.544 6.000 ( 0.885 -10.983 5.651) 12.384 6.546 ( -1.383 10.983 0.095) 11.070 6.663 ( -2.150 2.172 -0.705) 3.137 6.867 ( -0.440 6.704 -5.787) 8.868 6.965 ( -1.751 0.151 -6.531) 6.763 7.211 ( 2.283 -2.145 -3.221) 4.493 7.289 ( -2.309 -10.274 -2.299) 10.779 7.476 ( -0.567 0.822 1.474) 1.781 7.518 ( -1.577 -2.646 0.217) 3.088 7.815 ( -0.655 6.841 -1.832) 7.112 7.903 ( -1.126 -1.343 -1.981) 2.645 8.566 ( 2.582 5.851 4.284) 7.698 8.684 ( 2.221 -4.652 4.408) 6.782 9.148 ( 1.051 1.642 -0.335) 1.978 9.211 ( 1.615 -4.788 -2.203) 5.512 13.462 ( 1.830 3.932 2.350) 4.933 13.510 ( 1.824 -0.814 4.180) 4.633 15.193 ( 2.223 6.821 -0.388) 7.185 15.264 ( 5.155 0.643 -0.030) 5.195 15.356 ( 1.553 1.584 -3.044) 3.766 15.507 ( -0.315 -12.393 -2.585) 12.664 16.503 ( 5.446 9.809 1.450) 11.313 16.659 ( 6.851 -5.769 -1.646) 9.106 ======================= Grid point 270 (116/190) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.629 ( -8.131 0.000 15.400) 17.414 0.752 ( 3.890 0.000 16.060) 16.524 0.959 ( 3.691 0.000 -11.752) 12.318 1.134 ( -1.531 0.000 -15.397) 15.473 1.501 ( 4.649 0.000 33.065) 33.390 2.107 ( 1.441 0.000 -24.645) 24.687 2.737 ( -6.411 0.000 4.042) 7.578 2.852 ( 1.571 0.000 -5.571) 5.788 3.505 ( 0.733 0.000 10.553) 10.578 3.723 ( -0.739 0.000 -11.159) 11.183 4.320 ( -2.267 0.000 8.119) 8.430 4.485 ( 2.399 0.000 -7.548) 7.920 4.764 ( -0.651 0.000 0.812) 1.040 4.770 ( -3.212 0.000 0.635) 3.274 5.186 ( -0.297 0.000 11.105) 11.109 5.315 ( 4.487 0.000 -1.120) 4.624 5.686 ( -3.976 0.000 -1.385) 4.211 5.744 ( 3.072 0.000 -7.755) 8.341 6.129 ( 3.912 0.000 6.234) 7.360 6.271 ( 2.787 0.000 -5.364) 6.045 6.429 ( -0.542 0.000 1.495) 1.591 6.437 ( -2.095 0.000 -0.883) 2.273 6.635 ( 1.397 0.000 5.189) 5.374 6.740 ( -2.458 0.000 -5.100) 5.661 6.891 ( -2.499 0.000 1.380) 2.855 6.917 ( 2.854 0.000 -1.104) 3.060 7.211 ( 2.773 0.000 1.215) 3.027 7.238 ( 0.931 0.000 -1.521) 1.784 7.976 ( 10.996 0.000 1.982) 11.173 8.024 ( -23.561 0.000 -2.725) 23.718 8.653 ( -2.229 0.000 4.196) 4.752 8.738 ( 1.177 0.000 -4.105) 4.271 9.241 ( 1.184 0.000 2.853) 3.089 9.294 ( -1.897 0.000 -2.408) 3.065 13.229 ( 2.963 0.000 7.766) 8.312 13.395 ( -3.268 0.000 -8.388) 9.002 15.187 ( 2.299 0.000 3.759) 4.406 15.216 ( 0.087 0.000 -0.112) 0.142 15.276 ( 0.461 0.000 2.742) 2.781 15.368 ( -3.015 0.000 -5.145) 5.964 16.535 ( -12.844 0.000 2.654) 13.116 16.592 ( 25.104 0.000 -2.879) 25.268 ======================= Grid point 271 (117/190) ======================= q-point: ( 0.07 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.727 ( 13.562 0.000 13.106) 18.860 0.935 ( 10.831 0.000 16.653) 19.865 1.139 ( 4.772 0.000 -14.411) 15.181 1.153 ( 15.912 0.000 -12.297) 20.109 1.704 ( 10.682 0.000 27.387) 29.397 2.085 ( 1.231 0.000 -31.826) 31.850 2.766 ( 8.082 0.000 10.848) 13.528 2.989 ( 12.121 0.000 -2.302) 12.337 3.438 ( -7.130 0.000 10.238) 12.476 3.589 ( -10.038 0.000 -11.346) 15.148 4.295 ( -1.852 0.000 7.767) 7.985 4.532 ( 3.682 0.000 -7.611) 8.455 4.740 ( -1.316 0.000 4.335) 4.530 4.838 ( 7.162 0.000 3.658) 8.042 5.201 ( 1.290 0.000 5.186) 5.344 5.384 ( 2.725 0.000 -3.992) 4.833 5.594 ( -4.456 0.000 -0.266) 4.464 5.699 ( -5.368 0.000 -4.323) 6.892 6.169 ( -1.775 0.000 1.004) 2.039 6.229 ( -4.939 0.000 -8.044) 9.439 6.400 ( -1.550 0.000 1.702) 2.302 6.414 ( -0.807 0.000 3.663) 3.751 6.676 ( -2.982 0.000 -4.570) 5.457 6.679 ( 2.404 0.000 5.191) 5.720 6.869 ( 0.073 0.000 0.526) 0.531 6.980 ( 3.692 0.000 0.188) 3.697 7.174 ( -3.737 0.000 0.149) 3.740 7.216 ( -1.677 0.000 -3.538) 3.915 7.884 ( 5.450 0.000 -1.891) 5.769 8.268 ( 13.905 0.000 9.509) 16.845 8.643 ( -0.416 0.000 3.907) 3.929 8.778 ( 4.221 0.000 -0.489) 4.249 9.263 ( -1.176 0.000 -2.208) 2.502 9.272 ( 1.459 0.000 3.786) 4.058 13.279 ( 0.844 0.000 8.307) 8.349 13.293 ( -5.414 0.000 -8.260) 9.876 15.187 ( -2.664 0.000 -1.176) 2.912 15.188 ( -2.937 0.000 -0.380) 2.962 15.295 ( -3.681 0.000 -4.104) 5.513 15.302 ( 1.692 0.000 6.830) 7.036 16.208 ( -18.186 0.000 -8.228) 19.961 16.788 ( -2.180 0.000 -5.558) 5.970 ======================= Grid point 272 (118/190) ======================= q-point: ( 0.13 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.078 ( 18.462 0.000 9.081) 20.575 1.208 ( 14.148 0.000 12.853) 19.114 1.269 ( 10.521 0.000 -9.025) 13.861 1.409 ( 10.105 0.000 -15.814) 18.767 1.996 ( 14.580 0.000 18.442) 23.509 2.112 ( 8.643 0.000 -25.047) 26.496 3.031 ( 15.158 0.000 11.281) 18.895 3.186 ( 0.921 0.000 7.693) 7.748 3.349 ( -11.321 0.000 -9.652) 14.877 3.418 ( 10.602 0.000 -0.256) 10.605 4.271 ( -1.957 0.000 6.751) 7.029 4.588 ( 2.949 0.000 -7.556) 8.111 4.705 ( -3.512 0.000 6.749) 7.608 5.017 ( 9.446 0.000 4.392) 10.417 5.280 ( 6.370 0.000 1.857) 6.635 5.392 ( -0.663 0.000 -11.622) 11.641 5.539 ( -0.759 0.000 0.355) 0.838 5.593 ( -4.230 0.000 5.305) 6.785 6.051 ( -8.771 0.000 -7.151) 11.317 6.098 ( -6.234 0.000 -5.199) 8.117 6.382 ( -0.763 0.000 1.390) 1.585 6.418 ( -0.187 0.000 7.251) 7.253 6.615 ( -2.377 0.000 -5.942) 6.399 6.747 ( 3.526 0.000 4.594) 5.792 6.893 ( 2.303 0.000 -0.711) 2.410 7.059 ( 3.947 0.000 2.363) 4.600 7.160 ( 2.049 0.000 1.823) 2.742 7.192 ( 0.056 0.000 -3.668) 3.669 8.011 ( 6.343 0.000 -8.730) 10.791 8.438 ( 2.515 0.000 4.662) 5.297 8.637 ( -1.008 0.000 3.000) 3.165 8.902 ( 6.121 0.000 7.955) 10.037 9.237 ( -1.129 0.000 -2.298) 2.560 9.310 ( 1.403 0.000 5.806) 5.973 13.174 ( -4.909 0.000 -6.891) 8.461 13.294 ( -0.649 0.000 7.662) 7.690 15.103 ( -4.782 0.000 -0.466) 4.805 15.116 ( -4.191 0.000 -1.607) 4.489 15.213 ( -3.929 0.000 -3.233) 5.088 15.342 ( 0.837 0.000 5.787) 5.847 15.876 ( -12.724 0.000 -14.444) 19.249 16.625 ( -11.495 0.000 0.993) 11.537 ======================= Grid point 273 (119/190) ======================= q-point: ( 0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.435 ( 16.741 0.000 2.903) 16.991 1.476 ( 4.376 0.000 -16.665) 17.230 1.509 ( 14.474 0.000 0.702) 14.491 1.524 ( 13.498 0.000 5.446) 14.555 2.304 ( 13.960 0.000 9.364) 16.810 2.329 ( 14.975 0.000 -13.972) 20.481 3.134 ( -4.206 0.000 7.330) 8.451 3.146 ( -7.265 0.000 -4.431) 8.509 3.341 ( 12.976 0.000 10.518) 16.703 3.732 ( 17.210 0.000 -2.322) 17.366 4.237 ( -2.447 0.000 3.146) 3.986 4.608 ( 0.081 0.000 -5.104) 5.105 4.633 ( -4.827 0.000 5.661) 7.440 5.160 ( 2.573 0.000 -1.689) 3.078 5.366 ( 2.038 0.000 -8.023) 8.278 5.445 ( 9.111 0.000 3.011) 9.596 5.554 ( -1.860 0.000 8.814) 9.009 5.570 ( 3.772 0.000 -0.615) 3.822 5.856 ( -7.750 0.000 -11.976) 14.265 5.998 ( -2.339 0.000 -4.874) 5.406 6.389 ( 1.879 0.000 2.778) 3.354 6.424 ( -0.357 0.000 7.996) 8.004 6.566 ( -1.470 0.000 -6.403) 6.569 6.821 ( 3.138 0.000 3.879) 4.990 6.953 ( 3.971 0.000 -2.160) 4.520 7.132 ( 2.568 0.000 5.071) 5.684 7.203 ( 1.467 0.000 -3.405) 3.707 7.240 ( 5.323 0.000 1.938) 5.665 8.082 ( 2.743 0.000 -10.013) 10.382 8.438 ( -1.999 0.000 1.125) 2.294 8.606 ( -2.686 0.000 2.055) 3.382 8.986 ( 0.719 0.000 8.804) 8.833 9.211 ( -1.118 0.000 -1.985) 2.278 9.327 ( -1.141 0.000 5.527) 5.643 13.090 ( -2.692 0.000 -4.380) 5.141 13.283 ( -1.649 0.000 5.997) 6.220 15.024 ( -4.941 0.000 -1.191) 5.083 15.025 ( -2.997 0.000 0.714) 3.081 15.137 ( -3.268 0.000 -2.448) 4.083 15.335 ( -2.583 0.000 1.463) 2.969 15.679 ( -5.261 0.000 -11.069) 12.256 16.399 ( -11.412 0.000 3.109) 11.828 ======================= Grid point 274 (120/190) ======================= q-point: ( 0.27 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.510 ( 4.358 0.000 -15.596) 16.193 1.747 ( 14.714 0.000 2.292) 14.891 1.806 ( 15.147 0.000 4.182) 15.714 1.820 ( 14.267 0.000 5.043) 15.132 2.554 ( 10.518 0.000 1.909) 10.690 2.577 ( 11.470 0.000 -8.464) 14.255 3.050 ( -2.400 0.000 2.943) 3.797 3.074 ( -2.898 0.000 3.632) 4.647 3.557 ( 7.422 0.000 8.688) 11.427 3.987 ( 5.839 0.000 3.853) 6.995 4.206 ( 1.798 0.000 -9.124) 9.299 4.520 ( -7.112 0.000 -4.897) 8.635 4.586 ( -2.601 0.000 9.008) 9.376 5.126 ( -2.381 0.000 -11.841) 12.078 5.433 ( 3.555 0.000 8.641) 9.344 5.488 ( -5.763 0.000 -4.013) 7.022 5.497 ( -6.640 0.000 3.695) 7.599 5.725 ( 12.027 0.000 -4.904) 12.988 5.833 ( 8.264 0.000 -2.363) 8.595 6.032 ( 6.751 0.000 -3.401) 7.559 6.439 ( 0.629 0.000 6.773) 6.803 6.497 ( 9.154 0.000 4.114) 10.036 6.536 ( -0.549 0.000 -5.501) 5.529 6.885 ( 3.174 0.000 0.993) 3.326 7.027 ( 3.528 0.000 -2.489) 4.318 7.167 ( -0.039 0.000 7.350) 7.351 7.232 ( 2.115 0.000 -3.203) 3.838 7.360 ( 6.430 0.000 1.000) 6.507 8.090 ( -0.146 0.000 -9.265) 9.266 8.385 ( -3.238 0.000 0.508) 3.277 8.538 ( -4.613 0.000 1.476) 4.843 8.963 ( -4.601 0.000 8.311) 9.500 9.188 ( -0.877 0.000 -1.228) 1.510 9.288 ( -2.967 0.000 1.536) 3.341 13.051 ( -0.913 0.000 -2.143) 2.330 13.253 ( -2.226 0.000 3.913) 4.502 14.927 ( -4.679 0.000 -0.704) 4.732 14.988 ( -1.288 0.000 1.996) 2.375 15.080 ( -2.221 0.000 -1.102) 2.480 15.251 ( -5.220 0.000 -3.746) 6.426 15.616 ( -0.553 0.000 -4.310) 4.345 16.200 ( -9.523 0.000 2.401) 9.821 ======================= Grid point 275 (121/190) ======================= q-point: ( 0.33 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.609 ( 7.778 0.000 -7.738) 10.972 1.988 ( 8.982 0.000 6.093) 10.854 2.087 ( 12.473 0.000 2.550) 12.731 2.122 ( 16.628 0.000 1.501) 16.696 2.724 ( 7.284 0.000 -2.262) 7.627 2.735 ( 6.051 0.000 -4.135) 7.329 3.030 ( -2.093 0.000 0.110) 2.096 3.047 ( 0.420 0.000 7.984) 7.995 3.674 ( 3.814 0.000 6.042) 7.145 3.932 ( -8.316 0.000 -2.211) 8.605 4.302 ( 6.843 0.000 -10.861) 12.836 4.332 ( -10.782 0.000 -4.880) 11.835 4.545 ( -3.646 0.000 14.081) 14.545 5.067 ( -1.458 0.000 -12.503) 12.588 5.302 ( -12.691 0.000 2.637) 12.962 5.347 ( -5.878 0.000 -10.777) 12.275 5.560 ( 7.864 0.000 13.211) 15.375 5.938 ( 10.495 0.000 -3.584) 11.090 6.083 ( 14.564 0.000 3.498) 14.978 6.185 ( 7.764 0.000 -1.547) 7.917 6.472 ( 1.596 0.000 4.591) 4.860 6.520 ( -0.419 0.000 -3.251) 3.278 6.763 ( 16.750 0.000 2.925) 17.003 6.956 ( 4.542 0.000 -4.245) 6.217 7.070 ( 1.343 0.000 -2.625) 2.949 7.159 ( -2.016 0.000 8.356) 8.596 7.279 ( 3.235 0.000 -1.837) 3.720 7.484 ( 5.960 0.000 0.420) 5.974 8.040 ( -3.730 0.000 -7.858) 8.699 8.321 ( -3.372 0.000 0.706) 3.445 8.442 ( -5.015 0.000 1.089) 5.131 8.832 ( -10.140 0.000 7.089) 12.372 9.174 ( -0.498 0.000 -0.317) 0.590 9.238 ( -1.840 0.000 -1.314) 2.261 13.042 ( 0.126 0.000 -0.765) 0.776 13.212 ( -2.418 0.000 1.979) 3.125 14.846 ( -3.436 0.000 -0.145) 3.439 14.969 ( -1.327 0.000 1.428) 1.950 15.046 ( -1.236 0.000 0.378) 1.293 15.146 ( -4.313 0.000 -4.162) 5.993 15.618 ( 0.928 0.000 -1.032) 1.387 16.036 ( -7.556 0.000 0.888) 7.608 ======================= Grid point 276 (122/190) ======================= q-point: ( 0.40 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.775 ( 9.548 0.000 -1.103) 9.611 2.114 ( 2.991 0.000 3.858) 4.881 2.318 ( 11.028 0.000 2.589) 11.328 2.436 ( 14.349 0.000 2.297) 14.531 2.812 ( 2.493 0.000 -1.177) 2.757 2.851 ( 6.842 0.000 -2.583) 7.313 2.986 ( -2.561 0.000 -1.703) 3.075 3.065 ( -0.581 0.000 10.359) 10.375 3.711 ( -2.521 0.000 -1.343) 2.857 3.734 ( -9.528 0.000 -12.282) 15.545 4.144 ( -5.386 0.000 3.042) 6.186 4.395 ( 4.458 0.000 -7.059) 8.349 4.491 ( -4.413 0.000 14.747) 15.393 4.992 ( -7.412 0.000 -18.283) 19.728 5.072 ( -7.493 0.000 9.181) 11.851 5.241 ( -2.983 0.000 -11.686) 12.060 5.780 ( 11.761 0.000 14.177) 18.420 6.116 ( 7.831 0.000 -0.640) 7.857 6.302 ( 4.260 0.000 -1.582) 4.544 6.333 ( 8.939 0.000 2.172) 9.200 6.506 ( -0.599 0.000 -0.946) 1.120 6.507 ( 0.964 0.000 2.711) 2.878 7.050 ( 6.400 0.000 -9.792) 11.698 7.062 ( 5.196 0.000 5.773) 7.767 7.093 ( 2.330 0.000 -1.499) 2.770 7.166 ( 7.995 0.000 3.200) 8.611 7.351 ( 4.366 0.000 -0.030) 4.367 7.594 ( 5.303 0.000 0.685) 5.347 7.914 ( -7.477 0.000 -5.199) 9.107 8.257 ( -3.510 0.000 0.718) 3.583 8.365 ( -2.559 0.000 0.144) 2.563 8.607 ( -13.338 0.000 5.009) 14.248 9.167 ( -0.249 0.000 0.486) 0.546 9.212 ( -0.737 0.000 -1.850) 1.992 13.051 ( 0.845 0.000 0.057) 0.847 13.168 ( -2.314 0.000 0.527) 2.373 14.796 ( -1.631 0.000 0.600) 1.738 14.928 ( -2.843 0.000 -1.533) 3.230 15.032 ( -0.383 0.000 1.423) 1.474 15.085 ( -1.464 0.000 -1.532) 2.119 15.644 ( 1.772 0.000 0.552) 1.856 15.907 ( -5.780 0.000 -0.577) 5.809 ======================= Grid point 277 (123/190) ======================= q-point: ( 0.47 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.958 ( 8.725 0.000 2.088) 8.971 2.119 ( -2.800 0.000 0.240) 2.810 2.526 ( 9.221 0.000 4.339) 10.190 2.638 ( 4.615 0.000 1.796) 4.952 2.829 ( -0.571 0.000 -1.851) 1.937 2.900 ( -4.024 0.000 -8.627) 9.519 3.029 ( 10.071 0.000 7.993) 12.857 3.068 ( -0.470 0.000 14.234) 14.242 3.530 ( -12.895 0.000 -9.283) 15.888 3.564 ( -4.105 0.000 -18.722) 19.167 4.196 ( 7.510 0.000 11.298) 13.566 4.429 ( -4.279 0.000 13.640) 14.295 4.445 ( 0.522 0.000 -4.728) 4.756 4.768 ( -8.558 0.000 -10.334) 13.417 5.024 ( -1.259 0.000 1.810) 2.204 5.190 ( -0.142 0.000 -11.246) 11.247 6.040 ( 11.732 0.000 13.119) 17.600 6.234 ( 4.105 0.000 1.986) 4.560 6.332 ( -1.187 0.000 -2.002) 2.327 6.400 ( -2.390 0.000 -4.002) 4.661 6.502 ( 0.455 0.000 0.804) 0.924 6.507 ( -0.600 0.000 1.368) 1.494 7.042 ( -3.457 0.000 9.211) 9.838 7.154 ( 4.029 0.000 -0.680) 4.086 7.176 ( 6.502 0.000 -6.901) 9.481 7.340 ( 3.113 0.000 -5.521) 6.338 7.459 ( 7.328 0.000 -1.158) 7.419 7.603 ( -7.602 0.000 -0.921) 7.657 7.885 ( 9.636 0.000 2.026) 9.847 8.152 ( -9.115 0.000 -0.103) 9.116 8.349 ( 1.089 0.000 -0.908) 1.418 8.381 ( -8.316 0.000 3.622) 9.070 9.164 ( -0.199 0.000 1.126) 1.143 9.199 ( -0.367 0.000 -1.686) 1.726 13.074 ( 1.505 0.000 0.608) 1.623 13.125 ( -2.018 0.000 -0.368) 2.051 14.785 ( 0.330 0.000 1.491) 1.528 14.867 ( -2.674 0.000 -2.728) 3.820 15.035 ( 0.309 0.000 1.755) 1.782 15.071 ( -0.093 0.000 -0.855) 0.860 15.691 ( 2.873 0.000 1.669) 3.323 15.808 ( -4.260 0.000 -1.711) 4.591 ======================= Grid point 278 (124/190) ======================= q-point: (-0.47 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.011 ( -7.868 0.000 -2.744) 8.333 2.106 ( 5.811 0.000 1.641) 6.039 2.588 ( -9.014 0.000 -0.820) 9.051 2.640 ( -0.575 0.000 4.943) 4.977 2.778 ( -3.926 0.000 -2.110) 4.457 2.825 ( -1.968 0.000 -3.331) 3.869 3.142 ( 5.915 0.000 17.124) 18.116 3.244 ( 8.712 0.000 4.244) 9.691 3.275 ( -9.110 0.000 -9.559) 13.205 3.537 ( 4.740 0.000 -16.213) 16.892 4.342 ( -0.944 0.000 5.435) 5.516 4.344 ( -8.473 0.000 -3.143) 9.037 4.430 ( 7.146 0.000 19.020) 20.318 4.716 ( 4.074 0.000 -12.307) 12.964 5.011 ( -0.388 0.000 3.843) 3.862 5.198 ( 2.989 0.000 -10.950) 11.351 6.221 ( -2.031 0.000 7.561) 7.829 6.244 ( -8.839 0.000 -5.361) 10.338 6.286 ( 2.985 0.000 2.886) 4.152 6.292 ( -0.834 0.000 0.607) 1.031 6.502 ( -0.459 0.000 0.440) 0.636 6.525 ( 1.697 0.000 -0.109) 1.701 6.991 ( -3.460 0.000 8.026) 8.740 7.216 ( -12.512 0.000 -4.102) 13.167 7.218 ( 3.040 0.000 -4.990) 5.843 7.232 ( -1.637 0.000 2.208) 2.748 7.473 ( -4.198 0.000 -2.006) 4.653 7.622 ( 7.592 0.000 -3.266) 8.265 7.919 ( -10.950 0.000 -0.963) 10.993 8.129 ( 10.952 0.000 2.154) 11.162 8.318 ( -0.140 0.000 2.179) 2.184 8.426 ( 8.024 0.000 -0.728) 8.057 9.163 ( -0.182 0.000 1.709) 1.718 9.189 ( -0.367 0.000 -1.333) 1.383 13.089 ( -1.606 0.000 -0.781) 1.786 13.112 ( 2.203 0.000 0.943) 2.397 14.813 ( 2.151 0.000 2.412) 3.231 14.824 ( -1.176 0.000 -2.301) 2.584 15.048 ( 0.772 0.000 1.362) 1.565 15.070 ( 0.169 0.000 -1.641) 1.649 15.733 ( -3.056 0.000 -2.443) 3.912 15.764 ( 4.380 0.000 2.463) 5.025 ======================= Grid point 279 (125/190) ======================= q-point: (-0.40 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.810 ( -11.869 0.000 -3.902) 12.494 2.170 ( -0.257 0.000 -1.054) 1.085 2.365 ( -12.319 0.000 -1.530) 12.414 2.484 ( -13.114 0.000 -1.229) 13.171 2.701 ( -4.693 0.000 5.393) 7.149 2.771 ( -4.097 0.000 0.485) 4.126 3.142 ( -0.605 0.000 -12.209) 12.224 3.336 ( 1.619 0.000 -10.556) 10.679 3.392 ( 13.098 0.000 20.061) 23.958 3.657 ( 6.549 0.000 -1.345) 6.685 4.213 ( -2.536 0.000 -1.599) 2.998 4.282 ( -4.786 0.000 5.762) 7.491 4.630 ( 7.965 0.000 16.363) 18.198 4.788 ( 3.784 0.000 -14.280) 14.773 5.040 ( 3.175 0.000 7.073) 7.753 5.276 ( 7.013 0.000 -10.224) 12.398 6.013 ( -11.954 0.000 -8.561) 14.703 6.072 ( -10.378 0.000 3.781) 11.046 6.265 ( -3.226 0.000 2.073) 3.835 6.342 ( -2.380 0.000 1.861) 3.021 6.486 ( -1.314 0.000 0.932) 1.611 6.559 ( 1.134 0.000 -2.043) 2.337 6.892 ( -8.017 0.000 5.036) 9.468 7.026 ( -3.743 0.000 4.515) 5.865 7.094 ( -12.640 0.000 1.361) 12.713 7.256 ( 1.776 0.000 -4.439) 4.781 7.386 ( -4.645 0.000 -3.156) 5.616 7.600 ( -6.517 0.000 0.117) 6.518 7.899 ( 6.231 0.000 -3.764) 7.279 8.270 ( 4.476 0.000 -0.416) 4.496 8.355 ( 3.498 0.000 1.260) 3.718 8.660 ( 14.350 0.000 0.113) 14.351 9.164 ( 0.065 0.000 2.461) 2.462 9.179 ( -0.455 0.000 -0.826) 0.943 13.061 ( -1.132 0.000 -0.842) 1.411 13.164 ( 2.952 0.000 0.937) 3.097 14.816 ( 0.757 0.000 -1.427) 1.615 14.875 ( 3.615 0.000 3.156) 4.798 15.067 ( 0.947 0.000 0.549) 1.094 15.070 ( 0.182 0.000 -2.236) 2.243 15.678 ( -2.208 0.000 -2.753) 3.529 15.872 ( 6.188 0.000 2.833) 6.805 ======================= Grid point 280 (126/190) ======================= q-point: (-0.33 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.552 ( -13.592 0.000 -1.753) 13.705 2.025 ( -15.190 0.000 1.664) 15.281 2.123 ( -12.239 0.000 -0.860) 12.269 2.250 ( -8.919 0.000 -10.311) 13.633 2.615 ( -4.893 0.000 7.355) 8.833 2.651 ( -8.801 0.000 3.009) 9.301 3.162 ( 4.086 0.000 -11.612) 12.310 3.292 ( -3.347 0.000 -14.120) 14.511 3.701 ( 14.310 0.000 18.927) 23.728 3.723 ( 0.493 0.000 0.541) 0.731 4.171 ( -7.701 0.000 4.082) 8.717 4.266 ( 6.584 0.000 2.141) 6.923 4.775 ( 4.311 0.000 13.540) 14.210 4.784 ( -1.707 0.000 -8.665) 8.832 5.171 ( 8.679 0.000 4.699) 9.869 5.432 ( 10.163 0.000 -8.021) 12.947 5.774 ( -10.732 0.000 -7.461) 13.071 5.859 ( -11.725 0.000 3.865) 12.346 6.166 ( -7.232 0.000 0.319) 7.239 6.168 ( -13.886 0.000 -4.394) 14.564 6.454 ( -2.333 0.000 3.150) 3.920 6.551 ( -0.361 0.000 -3.048) 3.069 6.808 ( -14.487 0.000 -1.599) 14.575 6.824 ( -0.569 0.000 7.337) 7.359 7.011 ( -0.070 0.000 4.466) 4.466 7.271 ( 0.145 0.000 -2.423) 2.427 7.282 ( -5.294 0.000 -2.335) 5.786 7.487 ( -5.180 0.000 0.199) 5.184 7.993 ( 3.227 0.000 -3.331) 4.637 8.341 ( 3.354 0.000 -1.126) 3.538 8.450 ( 5.703 0.000 0.385) 5.716 8.930 ( 12.614 0.000 -2.189) 12.802 9.170 ( -0.378 0.000 -0.119) 0.396 9.180 ( 1.441 0.000 4.061) 4.309 13.042 ( -0.640 0.000 -0.663) 0.922 13.229 ( 3.659 0.000 0.362) 3.677 14.848 ( 2.669 0.000 -0.509) 2.717 14.959 ( 4.296 0.000 2.899) 5.182 15.071 ( 0.281 0.000 -2.008) 2.027 15.087 ( 1.136 0.000 0.591) 1.281 15.636 ( -1.715 0.000 -2.633) 3.142 16.015 ( 8.044 0.000 2.834) 8.528 ======================= Grid point 281 (127/190) ======================= q-point: (-0.27 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.298 ( -12.185 0.000 4.627) 13.034 1.676 ( -19.491 0.000 4.436) 19.990 1.885 ( -11.991 0.000 -1.257) 12.057 2.034 ( -11.967 0.000 -14.145) 18.528 2.429 ( -15.039 0.000 5.947) 16.172 2.534 ( -4.808 0.000 4.034) 6.276 3.190 ( -4.004 0.000 -10.343) 11.091 3.243 ( 6.122 0.000 -12.418) 13.845 3.688 ( -4.194 0.000 -3.822) 5.674 3.926 ( -5.411 0.000 13.255) 14.317 4.052 ( 5.536 0.000 3.891) 6.767 4.401 ( 4.933 0.000 5.059) 7.066 4.728 ( -1.692 0.000 -2.790) 3.263 4.857 ( 2.331 0.000 11.827) 12.054 5.367 ( 9.639 0.000 5.558) 11.126 5.550 ( -6.636 0.000 -5.866) 8.857 5.639 ( 6.514 0.000 -5.278) 8.384 5.646 ( -9.876 0.000 1.777) 10.035 5.874 ( -13.703 0.000 -4.755) 14.504 5.998 ( -8.776 0.000 -0.510) 8.791 6.404 ( -3.543 0.000 6.491) 7.395 6.551 ( 0.853 0.000 -4.042) 4.131 6.591 ( -6.544 0.000 -4.113) 7.729 6.840 ( 0.680 0.000 4.686) 4.736 7.005 ( -1.800 0.000 1.286) 2.212 7.185 ( -4.036 0.000 0.447) 4.061 7.242 ( -3.152 0.000 0.027) 3.152 7.396 ( -3.925 0.000 -2.056) 4.431 8.015 ( -0.212 0.000 -1.967) 1.978 8.402 ( 3.084 0.000 -1.029) 3.251 8.561 ( 5.398 0.000 -0.685) 5.441 9.092 ( 3.961 0.000 -4.747) 6.183 9.166 ( -0.017 0.000 0.755) 0.755 9.274 ( 7.759 0.000 3.847) 8.661 13.034 ( -0.134 0.000 -0.235) 0.271 13.305 ( 4.063 0.000 -0.999) 4.184 14.915 ( 3.982 0.000 0.279) 3.991 15.031 ( 2.209 0.000 -1.481) 2.660 15.078 ( 0.832 0.000 -0.862) 1.198 15.132 ( 3.653 0.000 5.649) 6.727 15.601 ( -1.510 0.000 -2.081) 2.571 16.192 ( 9.526 0.000 2.816) 9.934 ======================= Grid point 282 (128/190) ======================= q-point: (-0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.114 ( -8.022 0.000 14.281) 16.380 1.309 ( -18.749 0.000 7.345) 20.136 1.653 ( -11.288 0.000 -3.552) 11.833 1.735 ( -15.831 0.000 -14.371) 21.380 2.088 ( -20.975 0.000 9.845) 23.171 2.428 ( -6.378 0.000 -2.542) 6.866 3.129 ( -0.646 0.000 -3.248) 3.312 3.347 ( 6.106 0.000 -12.696) 14.088 3.528 ( -11.215 0.000 -7.547) 13.518 3.672 ( -15.762 0.000 2.968) 16.039 4.257 ( 9.198 0.000 3.645) 9.894 4.439 ( -1.583 0.000 7.765) 7.924 4.753 ( 4.366 0.000 -1.906) 4.764 4.923 ( 2.500 0.000 13.672) 13.898 5.353 ( -11.151 0.000 -1.965) 11.323 5.400 ( -8.320 0.000 4.782) 9.597 5.618 ( 0.901 0.000 8.793) 8.839 5.681 ( 1.884 0.000 -7.907) 8.128 5.743 ( 2.518 0.000 -8.512) 8.877 5.900 ( -0.116 0.000 3.194) 3.196 6.365 ( -0.942 0.000 6.852) 6.916 6.522 ( -0.678 0.000 -3.064) 3.138 6.562 ( 0.807 0.000 -5.362) 5.423 6.860 ( 0.680 0.000 1.630) 1.766 6.938 ( -4.435 0.000 -1.836) 4.800 7.135 ( -1.773 0.000 3.117) 3.586 7.154 ( -5.547 0.000 1.643) 5.785 7.320 ( -3.710 0.000 -4.269) 5.656 7.988 ( -2.178 0.000 -0.394) 2.214 8.456 ( 2.559 0.000 -0.815) 2.685 8.649 ( 3.771 0.000 -1.939) 4.240 9.116 ( 0.056 0.000 -4.115) 4.116 9.173 ( 0.495 0.000 1.609) 1.683 9.429 ( 6.502 0.000 -2.994) 7.158 13.038 ( 0.599 0.000 0.831) 1.024 13.379 ( 3.739 0.000 -3.140) 4.883 14.994 ( 3.776 0.000 1.203) 3.963 15.053 ( 1.227 0.000 -2.330) 2.634 15.107 ( 2.450 0.000 0.601) 2.523 15.246 ( 6.270 0.000 9.452) 11.342 15.570 ( -1.289 0.000 -0.632) 1.436 16.389 ( 9.841 0.000 3.428) 10.421 ======================= Grid point 283 (129/190) ======================= q-point: (-0.13 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.987 ( -15.519 0.000 11.090) 19.074 1.027 ( -5.129 0.000 20.828) 21.450 1.385 ( -16.978 0.000 -13.993) 22.001 1.440 ( -9.505 0.000 -8.254) 12.589 1.677 ( -21.850 0.000 17.270) 27.851 2.284 ( -6.878 0.000 -9.441) 11.681 3.146 ( -1.317 0.000 3.429) 3.673 3.267 ( -15.593 0.000 -0.352) 15.597 3.277 ( -8.155 0.000 -6.523) 10.442 3.541 ( 6.168 0.000 -12.347) 13.802 4.393 ( 4.908 0.000 -3.622) 6.100 4.404 ( -3.049 0.000 9.033) 9.534 4.841 ( 3.752 0.000 -5.163) 6.382 4.988 ( -0.308 0.000 12.284) 12.287 5.150 ( -7.275 0.000 3.370) 8.018 5.254 ( -5.662 0.000 2.664) 6.258 5.569 ( -0.158 0.000 2.124) 2.130 5.747 ( 0.407 0.000 -6.915) 6.927 5.889 ( 12.038 0.000 5.452) 13.215 5.952 ( 3.289 0.000 5.566) 6.465 6.387 ( 1.608 0.000 4.433) 4.715 6.537 ( 2.231 0.000 0.050) 2.231 6.551 ( -1.184 0.000 -5.680) 5.802 6.845 ( -3.000 0.000 -5.125) 5.938 6.877 ( -0.226 0.000 1.149) 1.171 7.049 ( -5.228 0.000 2.312) 5.717 7.118 ( -0.449 0.000 3.687) 3.714 7.237 ( -3.497 0.000 -4.737) 5.888 7.935 ( -3.010 0.000 -0.056) 3.010 8.493 ( 1.207 0.000 -1.378) 1.831 8.702 ( 2.134 0.000 -3.220) 3.863 9.072 ( -4.727 0.000 -7.277) 8.678 9.190 ( 0.907 0.000 2.214) 2.393 9.471 ( -1.845 0.000 -9.990) 10.159 13.067 ( 2.308 0.000 3.398) 4.108 13.432 ( 2.309 0.000 -5.594) 6.052 15.061 ( 2.857 0.000 3.076) 4.198 15.097 ( 3.793 0.000 0.108) 3.795 15.174 ( 3.867 0.000 1.017) 3.998 15.399 ( 6.571 0.000 4.793) 8.133 15.578 ( 4.580 0.000 9.740) 10.763 16.570 ( 7.324 0.000 5.206) 8.985 ======================= Grid point 284 (130/190) ======================= q-point: (-0.07 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 190 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.769 ( -8.149 0.000 14.295) 16.455 0.883 ( -14.862 0.000 14.783) 20.962 1.068 ( -11.549 0.000 -12.908) 17.320 1.247 ( -7.722 0.000 -11.908) 14.192 1.432 ( -5.153 0.000 30.378) 30.812 2.155 ( -3.385 0.000 -15.938) 16.293 2.951 ( -9.827 0.000 -6.854) 11.981 2.953 ( -14.735 0.000 -0.162) 14.736 3.369 ( 8.987 0.000 9.957) 13.413 3.668 ( 7.183 0.000 -12.490) 14.408 4.358 ( -3.077 0.000 8.649) 9.180 4.453 ( 2.620 0.000 -7.023) 7.496 4.831 ( -3.601 0.000 -4.823) 6.019 4.881 ( -7.742 0.000 0.167) 7.744 5.151 ( 1.556 0.000 14.983) 15.064 5.233 ( 2.871 0.000 1.130) 3.085 5.638 ( 6.442 0.000 -2.255) 6.825 5.736 ( -0.814 0.000 -4.513) 4.586 6.035 ( 4.019 0.000 7.566) 8.567 6.126 ( 10.649 0.000 5.787) 12.120 6.421 ( 1.029 0.000 1.902) 2.162 6.496 ( -3.158 0.000 -4.767) 5.718 6.592 ( 2.530 0.000 3.254) 4.122 6.789 ( -1.863 0.000 -5.666) 5.964 6.881 ( 0.812 0.000 -0.484) 0.945 6.959 ( -4.482 0.000 2.131) 4.963 7.139 ( 2.215 0.000 4.182) 4.732 7.202 ( 1.203 0.000 -2.737) 2.990 7.888 ( -0.573 0.000 -1.321) 1.440 8.457 ( -7.960 0.000 -7.650) 11.040 8.726 ( 1.100 0.000 -4.149) 4.292 8.833 ( -17.464 0.000 -8.097) 19.250 9.214 ( 1.100 0.000 2.537) 2.765 9.363 ( -4.979 0.000 -6.013) 7.807 13.142 ( 4.201 0.000 6.371) 7.632 13.443 ( -0.219 0.000 -7.524) 7.528 15.124 ( 2.981 0.000 4.641) 5.516 15.179 ( 3.577 0.000 0.420) 3.601 15.244 ( 2.706 0.000 1.082) 2.914 15.425 ( -1.616 0.000 -5.286) 5.527 15.959 ( 30.364 0.000 18.390) 35.498 16.657 ( -0.615 0.000 6.765) 6.793 ======================= Grid point 285 (131/190) ======================= q-point: ( 0.00 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.766 ( -5.806 11.695 13.421) 18.724 0.968 ( 1.065 12.379 16.199) 20.415 1.041 ( 4.594 11.522 -11.731) 17.073 1.312 ( -2.284 16.148 -14.951) 22.125 1.700 ( 4.404 19.604 24.044) 31.334 2.160 ( 0.537 5.042 -19.508) 20.156 2.803 ( -3.731 7.116 6.864) 10.568 2.933 ( 0.810 7.822 -5.495) 9.594 3.303 ( 0.152 -15.453 9.463) 18.121 3.539 ( -1.176 -15.779 -13.614) 20.874 4.084 ( -0.507 -19.418 4.556) 19.952 4.170 ( -0.647 -23.900 -3.525) 24.168 4.878 ( -3.564 8.700 4.263) 10.323 4.942 ( 5.689 8.837 -1.758) 10.656 5.311 ( -0.804 3.575 11.802) 12.358 5.437 ( 2.517 5.831 0.278) 6.357 5.637 ( -3.310 -6.013 -0.720) 6.902 5.672 ( 1.107 2.276 -4.059) 4.784 5.927 ( 3.982 -16.124 5.336) 17.445 6.085 ( -1.489 -3.888 -9.106) 10.012 6.246 ( -0.754 -15.673 5.637) 16.673 6.365 ( 0.556 -13.922 -4.556) 14.659 6.746 ( 1.503 6.961 1.570) 7.293 6.809 ( -3.310 5.580 -3.447) 7.346 6.950 ( 0.186 8.180 2.938) 8.694 7.012 ( 1.008 10.248 -3.192) 10.781 7.379 ( -1.576 11.629 0.974) 11.776 7.394 ( 4.987 9.630 -0.591) 10.860 7.894 ( 1.089 -8.092 2.361) 8.499 7.939 ( -9.078 -7.325 -1.781) 11.800 8.632 ( 1.180 -0.576 5.226) 5.388 8.741 ( -2.083 -0.591 -4.902) 5.359 9.234 ( 0.186 -0.676 3.653) 3.719 9.319 ( -1.406 1.253 -5.055) 5.395 13.253 ( 2.564 3.150 8.107) 9.067 13.428 ( -2.160 2.798 -8.592) 9.290 15.151 ( 1.146 -2.021 3.662) 4.337 15.207 ( -1.103 -1.126 -2.018) 2.561 15.352 ( 2.698 5.667 5.086) 8.079 15.475 ( -3.310 7.872 -6.566) 10.772 16.483 ( -4.699 -2.825 7.344) 9.165 16.643 ( 12.602 2.854 -9.093) 15.800 ======================= Grid point 286 (132/190) ======================= q-point: ( 0.07 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.830 ( 9.454 10.951 12.991) 19.444 1.096 ( 8.577 10.951 15.726) 20.995 1.192 ( 9.801 8.003 -11.517) 17.110 1.339 ( 8.319 14.289 -12.858) 20.945 1.874 ( 9.289 16.356 17.646) 25.791 2.146 ( 2.373 6.867 -21.921) 23.093 2.860 ( 7.620 8.857 9.652) 15.155 3.042 ( 9.518 4.609 -2.128) 10.787 3.273 ( -2.607 -12.039 7.417) 14.379 3.425 ( -7.578 -14.015 -11.244) 19.500 4.113 ( 2.902 -18.882 4.894) 19.721 4.218 ( 4.908 -20.611 -2.503) 21.335 4.805 ( -4.533 5.646 3.081) 7.869 5.045 ( 4.855 8.891 -3.768) 10.809 5.283 ( -2.077 4.773 7.621) 9.229 5.486 ( 1.429 3.562 1.688) 4.193 5.525 ( -6.294 -7.305 -0.266) 9.646 5.695 ( 0.599 4.163 -2.621) 4.956 5.953 ( -2.098 -13.001 -0.531) 13.180 6.050 ( 0.089 -5.246 -5.503) 7.604 6.257 ( 0.299 -12.547 6.645) 14.201 6.388 ( 3.292 -14.248 -4.834) 15.402 6.720 ( -4.910 6.446 0.834) 8.146 6.762 ( -0.420 5.615 0.862) 5.696 6.947 ( -0.393 8.183 0.444) 8.204 7.034 ( 1.034 7.886 -2.628) 8.376 7.284 ( -4.843 9.494 -0.306) 10.663 7.426 ( -1.207 12.346 -0.989) 12.444 7.839 ( 5.801 -4.395 -2.013) 7.551 8.165 ( 13.471 -9.909 7.220) 18.215 8.630 ( -2.230 -0.678 1.681) 2.873 8.749 ( 3.356 -2.320 0.920) 4.182 9.238 ( -0.577 -1.403 3.462) 3.780 9.301 ( 0.187 1.100 -2.342) 2.594 13.280 ( -1.924 2.358 3.576) 4.695 13.363 ( -2.057 4.612 -4.585) 6.822 15.144 ( -3.790 -1.991 -0.168) 4.284 15.160 ( -1.928 -2.084 1.134) 3.057 15.369 ( -3.356 6.937 -1.897) 7.936 15.420 ( 0.543 6.313 2.105) 6.677 16.228 ( -16.268 2.560 -3.585) 16.854 16.751 ( -2.705 -3.164 -6.695) 7.883 ======================= Grid point 287 (133/190) ======================= q-point: ( 0.13 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.102 ( 14.656 6.546 9.949) 18.885 1.319 ( 11.215 8.417 7.707) 16.001 1.366 ( 11.136 6.726 -5.539) 14.140 1.510 ( 8.209 8.788 -13.100) 17.783 2.086 ( 10.625 8.162 1.386) 13.469 2.258 ( 12.521 15.415 -6.164) 20.794 3.033 ( 3.254 -4.099 8.316) 9.826 3.176 ( 6.190 2.482 7.903) 10.341 3.228 ( -7.184 -9.208 -8.323) 14.342 3.418 ( 15.124 0.776 -2.076) 15.285 4.188 ( 2.819 -11.417 5.625) 13.036 4.325 ( 6.557 -18.120 -3.937) 19.668 4.715 ( -5.064 0.688 4.610) 6.882 5.104 ( 1.943 2.328 -6.281) 6.975 5.293 ( 2.076 1.935 4.201) 5.070 5.418 ( -4.286 -7.189 0.722) 8.400 5.493 ( -0.961 1.802 2.434) 3.177 5.696 ( 0.369 4.843 -3.870) 6.210 5.903 ( -1.535 -3.389 -2.799) 4.656 6.023 ( -2.385 -0.541 -3.673) 4.413 6.288 ( 2.101 -9.111 5.561) 10.879 6.479 ( 6.180 -11.721 -2.620) 13.507 6.614 ( -6.378 6.163 2.261) 9.153 6.756 ( -0.011 3.490 1.155) 3.676 6.944 ( 0.181 5.742 -0.874) 5.811 7.024 ( -0.746 3.701 -3.621) 5.231 7.259 ( 1.504 8.873 3.088) 9.515 7.416 ( 0.667 12.856 -0.790) 12.898 7.965 ( 6.228 -4.503 -7.915) 11.032 8.377 ( 6.386 -8.531 6.826) 12.655 8.573 ( -3.349 -3.002 -0.370) 4.512 8.839 ( 4.176 -5.382 6.164) 9.187 9.224 ( -1.278 -1.542 2.098) 2.900 9.310 ( 0.435 -0.308 1.102) 1.224 13.201 ( -4.373 2.984 -4.728) 7.098 13.343 ( -1.043 4.368 4.144) 6.111 15.043 ( -5.514 -2.055 -1.330) 6.033 15.109 ( -3.678 -2.875 1.041) 4.784 15.280 ( -4.232 6.437 -4.436) 8.890 15.448 ( 0.712 6.142 6.377) 8.883 15.920 ( -13.132 5.281 -10.142) 17.413 16.591 ( -10.963 -2.948 -0.717) 11.375 ======================= Grid point 288 (134/190) ======================= q-point: ( 0.20 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.398 ( 13.997 2.435 4.346) 14.857 1.511 ( 3.854 3.957 -14.070) 15.115 1.566 ( 13.205 4.997 0.887) 14.146 1.679 ( 12.642 8.570 3.962) 15.779 2.315 ( 12.077 5.016 -2.608) 13.335 2.536 ( 14.857 15.938 -0.965) 21.810 3.025 ( -2.131 -8.799 5.723) 10.710 3.074 ( -5.582 -6.335 -3.471) 9.129 3.391 ( 9.816 3.945 8.137) 13.347 3.748 ( 17.065 0.548 -2.368) 17.238 4.210 ( -1.783 -3.014 3.186) 4.734 4.445 ( 5.693 -12.943 -4.967) 14.987 4.642 ( -3.197 -1.296 7.388) 8.153 5.099 ( -0.683 -4.433 -11.719) 12.547 5.332 ( -0.783 -5.639 8.508) 10.237 5.413 ( 5.400 -4.654 -2.575) 7.580 5.470 ( -1.017 -0.640 2.317) 2.610 5.681 ( -1.496 -0.149 -4.797) 5.027 5.930 ( 3.717 12.971 -1.330) 13.558 5.958 ( -1.348 0.407 -4.084) 4.320 6.354 ( 2.981 -3.342 2.700) 5.229 6.493 ( -5.163 4.038 4.398) 7.894 6.598 ( 5.830 -6.850 -1.467) 9.115 6.773 ( 1.628 1.121 2.063) 2.857 6.953 ( 1.063 3.203 -2.212) 4.035 7.026 ( 1.709 -1.399 -2.505) 3.339 7.312 ( 2.572 7.863 5.170) 9.755 7.441 ( 1.766 11.909 -1.224) 12.102 8.038 ( 2.909 -4.312 -9.258) 10.620 8.444 ( -0.241 -0.817 2.617) 2.752 8.508 ( -2.841 -8.004 0.855) 8.536 8.900 ( 0.538 -7.576 6.931) 10.282 9.197 ( -1.863 -2.007 2.038) 3.414 9.305 ( -1.261 -1.692 1.040) 2.353 13.124 ( -2.611 3.379 -3.763) 5.692 13.321 ( -1.906 3.604 4.226) 5.872 14.943 ( -4.284 -2.940 -1.181) 5.329 15.029 ( -4.406 -2.695 0.424) 5.182 15.201 ( -3.159 5.719 -2.790) 7.104 15.452 ( -1.946 7.573 5.159) 9.368 15.700 ( -7.256 3.520 -9.988) 12.838 16.370 ( -11.205 -2.584 1.484) 11.595 ======================= Grid point 289 (135/190) ======================= q-point: ( 0.27 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.535 ( 3.868 2.738 -13.402) 14.216 1.685 ( 13.688 -0.705 2.274) 13.893 1.838 ( 13.733 2.733 3.510) 14.435 1.943 ( 12.625 6.831 4.880) 15.162 2.511 ( 8.203 2.100 -3.094) 9.015 2.792 ( 10.593 13.228 0.182) 16.948 2.998 ( -1.844 -5.374 0.858) 5.746 3.009 ( -0.179 -4.540 3.253) 5.588 3.546 ( 4.700 -1.061 5.359) 7.207 4.027 ( 10.019 1.027 1.248) 10.148 4.139 ( -4.190 -2.966 -3.051) 5.971 4.490 ( -0.579 -3.731 -6.104) 7.178 4.600 ( -3.157 0.068 8.158) 8.748 5.058 ( -1.196 -6.719 -10.391) 12.431 5.340 ( 1.340 -5.523 4.124) 7.022 5.467 ( -0.977 -1.936 0.538) 2.235 5.523 ( 2.796 3.205 -2.185) 4.782 5.667 ( 3.398 -7.186 -0.385) 7.958 5.903 ( 1.593 4.575 -3.005) 5.701 6.118 ( 11.431 10.610 -1.554) 15.673 6.337 ( -3.271 -2.782 2.629) 5.034 6.517 ( 5.028 0.205 3.571) 6.171 6.703 ( 5.679 1.746 0.264) 5.948 6.831 ( 3.934 -1.408 2.888) 5.080 6.977 ( 1.818 0.421 -3.647) 4.096 7.070 ( 2.663 -2.996 -1.618) 4.323 7.365 ( 1.690 6.709 6.238) 9.315 7.476 ( 2.204 9.263 -2.171) 9.766 8.052 ( 0.135 -3.762 -8.566) 9.357 8.391 ( -4.175 -0.058 -0.064) 4.176 8.470 ( -2.226 -6.007 2.188) 6.769 8.879 ( -4.080 -7.779 6.910) 11.177 9.159 ( -2.196 -3.169 1.691) 4.210 9.269 ( -2.141 -1.533 -1.318) 2.945 13.085 ( -0.987 3.340 -1.966) 3.999 13.285 ( -2.387 3.023 2.983) 4.872 14.872 ( -3.015 -3.258 -0.824) 4.515 14.949 ( -3.623 -2.790 0.518) 4.602 15.148 ( -1.905 4.911 -0.849) 5.336 15.373 ( -6.004 9.558 -0.841) 11.318 15.612 ( -1.196 0.030 -3.410) 3.613 16.170 ( -9.516 -2.678 1.251) 9.965 ======================= Grid point 290 (136/190) ======================= q-point: ( 0.33 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.622 ( 6.993 1.531 -6.652) 9.773 1.943 ( 11.769 -2.371 3.325) 12.457 2.093 ( 11.123 -0.011 4.197) 11.889 2.182 ( 12.078 4.430 0.555) 12.877 2.628 ( 4.564 -0.316 -1.569) 4.837 2.912 ( 1.371 3.608 4.332) 5.802 2.983 ( 0.007 -3.756 0.107) 3.758 3.063 ( 4.864 4.246 1.024) 6.537 3.602 ( 0.689 -5.445 2.100) 5.876 3.980 ( -7.714 4.044 -4.811) 9.950 4.180 ( 1.327 -5.464 -0.283) 5.630 4.433 ( -2.535 0.551 -4.873) 5.521 4.548 ( -2.846 2.372 6.540) 7.517 5.018 ( -1.318 -4.615 -5.576) 7.357 5.295 ( -8.719 0.790 -2.684) 9.158 5.433 ( -2.386 7.184 -10.192) 12.696 5.569 ( 7.007 0.672 10.415) 12.571 5.808 ( 8.808 -9.545 0.865) 13.017 6.036 ( 10.307 -3.841 0.855) 11.033 6.263 ( 0.867 -0.057 1.343) 1.600 6.373 ( 8.474 3.977 -0.128) 9.361 6.610 ( 3.221 0.598 1.414) 3.569 6.852 ( 9.606 -0.722 2.614) 9.981 6.938 ( 6.961 2.353 0.428) 7.360 7.007 ( 1.824 -1.040 -3.957) 4.479 7.112 ( 1.805 -0.607 -0.688) 2.025 7.398 ( 0.841 6.184 5.331) 8.208 7.524 ( 3.206 4.511 -2.207) 5.958 8.009 ( -3.368 -2.995 -6.974) 8.304 8.308 ( -4.028 -1.842 0.122) 4.430 8.420 ( -3.011 -1.713 1.373) 3.726 8.760 ( -9.132 -6.763 6.241) 12.965 9.127 ( -1.141 -4.120 0.621) 4.320 9.228 ( -1.712 -1.315 -2.097) 3.009 13.074 ( 0.023 3.147 -0.768) 3.240 13.241 ( -2.501 2.713 1.591) 4.018 14.818 ( -2.457 -2.225 -0.475) 3.348 14.895 ( -2.156 -3.664 0.641) 4.299 15.121 ( -0.884 4.149 0.297) 4.253 15.251 ( -5.660 8.798 -2.564) 10.771 15.608 ( 0.599 -0.874 -0.256) 1.090 16.004 ( -7.633 -2.956 0.295) 8.191 ======================= Grid point 291 (137/190) ======================= q-point: ( 0.40 0.11 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.777 ( 9.059 0.349 -0.254) 9.070 2.121 ( 4.758 0.714 4.153) 6.356 2.287 ( 9.674 -4.258 1.023) 10.619 2.430 ( 12.708 -0.269 -0.158) 12.712 2.690 ( 1.909 -2.102 0.471) 2.878 2.896 ( -3.301 -3.583 1.885) 5.224 3.000 ( 1.639 0.298 2.312) 2.850 3.141 ( 2.051 5.455 2.069) 6.184 3.579 ( -3.051 -5.205 -2.790) 6.647 3.816 ( -7.301 3.317 -11.747) 14.224 4.142 ( -2.506 -0.527 5.616) 6.173 4.399 ( -1.898 -2.802 2.066) 3.965 4.530 ( 0.483 5.949 1.569) 6.171 4.985 ( -2.031 -1.516 -9.346) 9.683 5.084 ( -10.133 3.334 3.175) 11.130 5.345 ( -3.865 8.672 -10.507) 14.161 5.797 ( 12.507 1.071 10.737) 16.518 5.975 ( 7.566 -9.746 1.559) 12.436 6.183 ( 2.320 -10.295 0.151) 10.554 6.317 ( 5.419 -2.087 2.523) 6.332 6.513 ( 5.395 6.449 -1.510) 8.543 6.635 ( -0.938 2.385 1.753) 3.105 7.004 ( 1.767 -6.304 1.936) 6.827 7.062 ( 7.639 0.686 -7.389) 10.650 7.119 ( 9.150 -0.971 -1.769) 9.370 7.150 ( 3.360 5.777 3.727) 7.652 7.430 ( 2.321 4.774 2.329) 5.797 7.599 ( 4.962 1.241 -0.669) 5.158 7.894 ( -7.010 -1.901 -4.185) 8.383 8.237 ( -3.656 -2.246 -0.309) 4.302 8.370 ( -1.978 0.304 0.592) 2.087 8.560 ( -11.605 -4.411 4.643) 13.255 9.117 ( -0.018 -4.273 0.465) 4.298 9.194 ( -1.399 -2.014 -1.821) 3.054 13.081 ( 0.772 2.954 -0.027) 3.053 13.195 ( -2.356 2.588 0.433) 3.526 14.780 ( -1.231 -1.314 0.169) 1.809 14.859 ( -1.716 -3.651 -0.060) 4.035 15.111 ( -0.260 3.394 0.209) 3.410 15.157 ( -3.471 7.712 -1.188) 8.540 15.629 ( 1.492 -1.398 0.697) 2.160 15.873 ( -5.839 -3.206 -0.656) 6.693 ======================= Grid point 292 (138/190) ======================= q-point: ( 0.47 0.11 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.957 ( 8.676 -0.061 3.137) 9.226 2.138 ( -2.697 1.994 -0.087) 3.355 2.493 ( 10.492 -5.584 3.105) 12.284 2.641 ( 7.561 -2.242 -0.474) 7.901 2.699 ( -1.057 -4.875 1.173) 5.125 2.786 ( -7.749 -7.884 -3.545) 11.609 3.049 ( 2.093 2.848 8.017) 8.762 3.158 ( 0.477 0.552 2.726) 2.822 3.496 ( -4.162 2.206 -5.191) 7.010 3.662 ( -5.136 5.288 -15.329) 17.009 4.174 ( 3.647 -3.754 11.200) 12.362 4.342 ( -3.936 -2.221 3.680) 5.828 4.567 ( 2.430 7.269 0.870) 7.714 4.829 ( -7.603 4.193 -12.768) 15.440 5.032 ( 0.538 2.804 6.971) 7.533 5.264 ( -2.435 6.294 -10.003) 12.066 6.042 ( 8.704 -3.436 8.278) 12.494 6.105 ( 6.216 -5.842 4.136) 9.480 6.183 ( -0.618 -10.130 -0.605) 10.166 6.369 ( -2.206 -2.336 -1.793) 3.680 6.590 ( 2.325 5.335 -0.633) 5.854 6.598 ( -1.597 4.392 1.516) 4.913 7.014 ( -0.558 -2.621 4.130) 4.923 7.138 ( 1.431 -2.394 -6.615) 7.179 7.206 ( 1.836 3.309 4.761) 6.082 7.302 ( 7.591 -2.029 -5.719) 9.719 7.501 ( 4.677 2.526 -1.000) 5.409 7.624 ( -6.654 2.375 -1.675) 7.261 7.860 ( 8.877 -2.131 2.307) 9.416 8.122 ( -9.477 -3.026 -0.766) 9.978 8.353 ( 0.044 0.289 0.413) 0.506 8.380 ( -5.280 -0.238 2.304) 5.766 9.123 ( 0.279 -3.807 1.067) 3.964 9.167 ( -1.013 -3.054 -1.680) 3.630 13.104 ( 1.472 2.821 0.482) 3.218 13.152 ( -2.026 2.564 -0.327) 3.284 14.773 ( 0.374 -0.985 0.953) 1.421 14.825 ( -1.650 -2.690 -1.076) 3.335 15.106 ( -0.539 3.885 0.019) 3.922 15.117 ( -0.382 5.623 -0.131) 5.637 15.670 ( 2.599 -1.911 1.406) 3.519 15.774 ( -4.128 -3.184 -1.449) 5.411 ======================= Grid point 293 (139/190) ======================= q-point: (-0.47 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.025 ( -7.423 1.441 -2.721) 8.037 2.118 ( 6.068 1.029 1.802) 6.413 2.541 ( -11.901 -9.470 -0.239) 15.211 2.608 ( -6.998 -1.216 2.008) 7.381 2.713 ( 6.856 -7.681 0.988) 10.343 2.747 ( 1.583 -0.461 -3.924) 4.256 3.092 ( 1.167 -2.777 8.669) 9.177 3.221 ( 5.155 -2.547 0.066) 5.750 3.403 ( -3.638 9.228 0.138) 9.920 3.610 ( 1.824 5.268 -13.544) 14.646 4.198 ( -4.303 -7.312 10.054) 13.155 4.355 ( 5.240 -0.673 2.763) 5.962 4.568 ( -3.058 8.524 3.559) 9.730 4.770 ( 4.273 4.134 -11.260) 12.733 5.073 ( 2.197 6.631 7.393) 10.171 5.222 ( 0.155 2.579 -9.847) 10.180 6.060 ( -5.809 -11.036 4.213) 13.164 6.178 ( 1.508 -9.949 -1.616) 10.191 6.242 ( -8.429 -1.303 -4.973) 9.873 6.285 ( 6.405 0.829 6.620) 9.249 6.551 ( -2.929 5.440 2.049) 6.509 6.637 ( 1.947 4.821 -1.452) 5.398 6.997 ( -2.269 0.354 6.142) 6.557 7.102 ( -4.564 -5.715 -4.341) 8.505 7.194 ( -3.764 -2.433 4.033) 6.029 7.339 ( -3.346 5.892 -6.432) 9.343 7.496 ( -2.109 1.697 -0.754) 2.810 7.623 ( 5.389 0.452 -1.824) 5.707 7.901 ( -9.695 -1.622 -1.384) 9.927 8.087 ( 10.356 -3.833 2.652) 11.356 8.336 ( 0.401 1.285 1.563) 2.063 8.418 ( 6.387 -0.818 -0.769) 6.485 9.123 ( -0.621 -3.687 1.497) 4.027 9.156 ( 0.276 -3.165 -1.187) 3.391 13.116 ( -1.567 2.623 -0.683) 3.131 13.140 ( 2.186 2.734 0.783) 3.587 14.792 ( 0.218 -1.514 0.361) 1.571 14.802 ( 0.690 -1.662 -0.158) 1.806 15.104 ( 0.375 4.749 0.548) 4.795 15.122 ( 0.723 4.288 -0.853) 4.431 15.702 ( -2.378 -2.864 -1.354) 3.961 15.741 ( 3.872 -2.209 1.364) 4.662 ======================= Grid point 294 (140/190) ======================= q-point: (-0.40 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.828 ( -11.539 1.835 -4.578) 12.549 2.190 ( -2.334 1.721 -1.654) 3.338 2.295 ( -9.230 -9.298 0.628) 13.116 2.422 ( -11.619 -0.926 0.071) 11.656 2.701 ( -4.239 2.994 -1.918) 5.533 2.830 ( 2.894 0.483 3.667) 4.696 3.126 ( 1.287 -5.854 -4.675) 7.602 3.268 ( -0.567 -3.207 -3.667) 4.904 3.456 ( 8.228 6.734 7.693) 13.124 3.632 ( 1.145 -0.944 -0.981) 1.779 4.165 ( 1.006 -2.472 5.812) 6.396 4.394 ( -2.766 5.690 -0.719) 6.367 4.569 ( 3.140 -2.576 4.466) 6.037 4.872 ( 5.919 5.187 -4.938) 9.291 5.134 ( 2.494 9.040 6.629) 11.484 5.252 ( 4.953 -1.339 -7.536) 9.117 5.888 ( -11.676 -9.950 2.279) 15.508 6.052 ( -8.596 -0.885 -6.305) 10.697 6.194 ( -1.615 -8.626 -0.494) 8.790 6.337 ( -1.481 -1.631 1.558) 2.698 6.478 ( -5.275 6.312 1.178) 8.310 6.672 ( 1.446 3.508 -1.542) 4.096 6.912 ( -6.940 1.298 4.775) 8.523 7.016 ( -2.129 -1.027 3.567) 4.279 7.078 ( -8.692 -4.932 0.704) 10.019 7.229 ( -6.047 5.305 -3.816) 8.903 7.489 ( 0.304 5.976 -2.833) 6.620 7.578 ( -6.675 -1.696 1.154) 6.983 7.886 ( 5.425 -1.258 -3.473) 6.563 8.230 ( 4.907 -3.729 0.639) 6.196 8.372 ( 2.749 1.021 0.444) 2.966 8.610 ( 12.170 -4.574 -0.024) 13.001 9.113 ( -0.359 -4.153 1.330) 4.375 9.166 ( 0.632 -1.964 0.137) 2.068 13.089 ( -1.032 2.780 -0.739) 3.056 13.191 ( 2.899 2.623 0.770) 3.985 14.790 ( 0.577 -1.841 -0.749) 2.070 14.844 ( 2.490 -2.217 1.361) 3.601 15.116 ( 0.738 3.908 -0.462) 4.004 15.146 ( 2.004 6.325 0.025) 6.635 15.660 ( -1.416 -1.599 -2.345) 3.172 15.841 ( 5.932 -2.794 2.313) 6.953 ======================= Grid point 295 (141/190) ======================= q-point: (-0.33 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.580 ( -12.777 2.759 -2.190) 13.253 1.957 ( -15.310 -4.310 1.379) 15.965 2.174 ( -12.801 2.502 -0.342) 13.048 2.245 ( -2.511 0.924 -7.964) 8.402 2.590 ( -6.665 4.208 1.498) 8.023 2.841 ( -3.059 8.504 6.002) 10.849 3.123 ( 0.296 -3.379 -10.533) 11.066 3.220 ( -2.718 -6.587 -9.796) 12.114 3.581 ( 1.161 -8.357 2.450) 8.786 3.744 ( 10.676 3.767 15.537) 19.224 4.230 ( 1.215 -1.864 -1.175) 2.517 4.313 ( -2.707 7.743 4.282) 9.253 4.630 ( 1.898 -6.028 1.401) 6.473 4.943 ( 1.111 5.014 0.678) 5.180 5.194 ( 3.018 1.602 4.077) 5.319 5.380 ( 7.764 -0.900 -3.262) 8.470 5.662 ( -10.212 -7.920 1.501) 13.010 5.880 ( -7.834 -0.052 -5.898) 9.805 6.068 ( -10.505 -6.817 -2.037) 12.688 6.293 ( -5.318 7.009 -1.873) 8.995 6.359 ( -3.623 -0.294 1.486) 3.927 6.656 ( -2.480 2.043 -2.768) 4.241 6.835 ( -3.720 1.395 6.201) 7.365 6.885 ( -7.978 2.018 -0.231) 8.232 6.996 ( -1.349 -1.666 2.653) 3.411 7.112 ( -5.045 -0.231 -2.782) 5.766 7.465 ( -3.578 4.682 3.076) 6.647 7.496 ( -0.844 4.322 -3.164) 5.422 7.966 ( 2.711 -2.560 -3.009) 4.791 8.315 ( 4.163 -2.995 -0.348) 5.140 8.438 ( 3.819 -1.037 -0.323) 3.971 8.839 ( 10.267 -8.210 -1.128) 13.194 9.126 ( 1.896 -3.831 1.886) 4.672 9.179 ( 0.542 -0.842 1.132) 1.512 13.073 ( -0.469 3.053 -0.590) 3.145 13.255 ( 3.477 2.365 0.259) 4.213 14.815 ( 1.975 -2.362 -0.236) 3.088 14.895 ( 2.559 -3.445 0.733) 4.353 15.132 ( 0.997 3.532 -0.698) 3.736 15.203 ( 3.723 9.436 1.514) 10.256 15.637 ( -0.571 0.232 -2.920) 2.985 15.979 ( 7.748 -3.350 2.633) 8.842 ======================= Grid point 296 (142/190) ======================= q-point: (-0.27 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.347 ( -10.782 4.918 4.248) 12.589 1.652 ( -16.169 -0.079 3.804) 16.610 1.918 ( -12.969 2.647 -3.371) 13.659 2.123 ( -8.320 6.937 -12.107) 16.246 2.449 ( -8.846 4.174 3.092) 10.259 2.719 ( -10.097 15.109 6.108) 19.171 3.099 ( -1.404 -7.483 -8.285) 11.252 3.179 ( 1.417 -7.474 -11.564) 13.841 3.576 ( -1.798 -7.416 1.098) 7.710 3.960 ( 2.686 1.258 11.345) 11.727 4.121 ( -3.253 4.838 -2.795) 6.465 4.360 ( 1.367 -3.114 6.262) 7.126 4.662 ( 1.969 -4.142 2.439) 5.194 4.904 ( -5.256 -1.052 4.755) 7.166 5.272 ( 4.337 -10.357 2.929) 11.605 5.413 ( -5.299 -0.280 3.893) 6.581 5.602 ( 3.077 -3.325 -4.444) 6.346 5.740 ( -5.235 0.454 -5.180) 7.379 5.872 ( -6.206 -0.933 -0.284) 6.282 6.102 ( -10.879 12.300 -0.350) 16.425 6.370 ( 1.715 0.384 -0.254) 1.775 6.593 ( -2.890 1.248 -4.049) 5.129 6.700 ( -6.248 2.711 1.159) 6.909 6.855 ( -0.016 -0.009 1.798) 1.798 6.951 ( -3.120 -3.583 -1.382) 4.948 7.032 ( -3.021 -0.516 0.900) 3.194 7.404 ( -3.053 4.965 3.615) 6.859 7.477 ( -1.133 9.122 -2.920) 9.644 7.981 ( -0.512 -3.309 -1.797) 3.800 8.393 ( 3.884 -1.619 -0.246) 4.215 8.509 ( 3.328 -4.612 -1.527) 5.889 8.969 ( 3.267 -9.849 -2.177) 10.603 9.191 ( 0.645 0.335 0.693) 1.004 9.217 ( 6.777 -4.871 2.215) 8.635 13.069 ( 0.085 3.426 -0.245) 3.435 13.325 ( 3.662 1.835 -0.813) 4.176 14.861 ( 2.651 -3.181 0.132) 4.143 14.950 ( 3.187 -3.610 0.513) 4.843 15.151 ( 1.124 4.062 -0.860) 4.302 15.300 ( 5.828 12.375 4.205) 14.311 15.625 ( -0.241 2.365 -3.472) 4.208 16.150 ( 9.223 -3.892 2.930) 10.431 ======================= Grid point 297 (143/190) ======================= q-point: (-0.20 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.190 ( -6.729 7.460 12.688) 16.184 1.353 ( -15.152 5.327 6.436) 17.303 1.655 ( -13.245 2.518 -6.909) 15.149 1.899 ( -11.855 11.593 -12.152) 20.557 2.221 ( -15.783 10.514 4.960) 19.603 2.516 ( -10.242 10.868 1.663) 15.026 3.065 ( -0.658 -5.368 -2.498) 5.957 3.207 ( 2.151 -11.531 -9.725) 15.237 3.509 ( -4.455 -2.915 -4.652) 7.071 3.744 ( -17.125 5.333 -2.123) 18.062 4.241 ( 6.497 -4.486 3.613) 8.683 4.334 ( -4.245 -7.316 4.234) 9.459 4.728 ( 2.999 -2.924 0.054) 4.189 4.813 ( -2.631 -8.271 13.531) 16.075 5.292 ( -6.469 -1.933 6.251) 9.201 5.369 ( 3.894 -13.038 3.114) 13.959 5.595 ( -0.807 1.627 -7.022) 7.253 5.664 ( -2.221 3.950 -2.231) 5.051 5.868 ( -0.223 0.457 3.883) 3.916 5.940 ( -1.862 13.001 -2.493) 13.368 6.386 ( -0.397 1.862 1.024) 2.162 6.544 ( -2.522 -1.573 -2.114) 3.648 6.617 ( -1.577 0.030 -2.571) 3.016 6.852 ( -0.213 -1.795 -3.422) 3.870 6.902 ( -1.512 -1.877 1.713) 2.957 6.987 ( -1.707 3.556 0.766) 4.018 7.359 ( -2.161 7.087 2.208) 7.731 7.435 ( -2.735 11.106 -1.827) 11.583 7.950 ( -2.353 -3.727 -0.360) 4.422 8.464 ( 3.305 0.249 0.097) 3.316 8.552 ( 1.337 -9.297 -3.023) 9.867 8.988 ( -0.487 -9.787 -1.873) 9.976 9.203 ( 0.459 0.646 1.639) 1.820 9.354 ( 6.116 -6.269 -2.603) 9.137 13.077 ( 0.777 3.803 0.660) 3.937 13.390 ( 3.214 1.138 -2.213) 4.065 14.922 ( 3.793 -2.622 0.695) 4.663 15.023 ( 4.021 -3.526 1.073) 5.455 15.175 ( 1.574 5.243 -0.377) 5.487 15.447 ( 8.445 15.315 6.913) 18.806 15.612 ( -0.433 4.207 -3.630) 5.574 16.342 ( 9.637 -4.296 3.703) 11.182 ======================= Grid point 298 (144/190) ======================= q-point: (-0.13 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.098 ( -11.936 10.065 10.400) 18.760 1.113 ( -5.045 8.449 17.168) 19.789 1.376 ( -13.603 3.476 -10.963) 17.813 1.652 ( -10.651 14.488 -11.511) 21.351 1.882 ( -18.449 18.583 11.318) 28.527 2.339 ( -7.616 6.610 -5.275) 11.381 3.055 ( -2.252 -4.587 4.852) 7.047 3.190 ( -1.836 -9.321 -3.093) 9.991 3.366 ( -16.233 7.092 -6.664) 18.927 3.471 ( -0.023 -5.862 -11.179) 12.623 4.221 ( -6.023 -16.095 5.035) 17.907 4.311 ( -0.717 -11.967 -4.750) 12.895 4.750 ( 2.011 -1.332 3.052) 3.890 4.893 ( 4.355 -4.409 12.598) 14.040 5.201 ( -2.969 -0.111 7.999) 8.533 5.421 ( 0.725 -0.459 1.262) 1.526 5.618 ( 1.414 1.917 3.139) 3.941 5.628 ( 1.310 -0.079 -6.531) 6.662 5.826 ( -1.337 -0.117 3.867) 4.093 6.001 ( 4.191 5.681 -1.960) 7.327 6.371 ( -0.777 -4.250 -1.257) 4.500 6.445 ( -6.512 -11.701 -0.077) 13.391 6.646 ( 3.405 5.720 -1.565) 6.839 6.845 ( 0.583 1.302 -5.442) 5.626 6.899 ( 0.526 -0.597 3.919) 3.999 6.975 ( 0.462 9.298 -0.392) 9.318 7.322 ( -1.952 6.817 -1.996) 7.366 7.379 ( -2.157 14.168 2.088) 14.482 7.894 ( -3.191 -3.996 -0.053) 5.114 8.501 ( -1.200 -2.480 -4.581) 5.346 8.555 ( 0.571 -11.436 0.010) 11.450 8.943 ( -4.035 -9.003 -2.879) 10.277 9.214 ( 0.326 0.636 1.949) 2.076 9.415 ( 0.676 -4.728 -7.529) 8.916 13.107 ( 2.198 3.973 3.015) 5.451 13.439 ( 2.177 0.869 -3.756) 4.428 15.016 ( 5.354 -0.875 0.926) 5.503 15.106 ( 4.252 -3.731 1.903) 5.969 15.216 ( 2.570 5.979 0.968) 6.580 15.581 ( -0.496 8.568 -6.659) 10.863 15.688 ( 14.221 15.001 12.289) 24.048 16.522 ( 7.474 -4.287 5.226) 10.077 ======================= Grid point 299 (145/190) ======================= q-point: (-0.07 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.920 ( -9.146 11.401 12.916) 19.505 1.011 ( -7.860 10.537 15.707) 20.482 1.117 ( -9.289 6.973 -13.409) 17.740 1.449 ( -8.277 16.542 -14.392) 23.437 1.653 ( -5.647 21.527 22.778) 31.845 2.211 ( -3.578 5.783 -11.995) 13.788 2.935 ( -8.877 1.210 4.858) 10.191 3.052 ( -11.799 8.081 -6.224) 15.596 3.232 ( 4.231 -11.450 5.883) 13.550 3.521 ( 4.636 -12.956 -14.834) 20.234 4.122 ( -4.349 -19.233 3.910) 20.102 4.242 ( -4.474 -21.097 -4.851) 22.105 4.828 ( 4.985 6.983 2.125) 8.839 4.935 ( -1.808 1.500 5.995) 6.439 5.239 ( 4.240 -0.259 11.974) 12.705 5.421 ( -0.313 8.352 0.596) 8.379 5.618 ( 1.301 4.759 -0.987) 5.031 5.695 ( 1.612 -5.508 -3.242) 6.592 5.839 ( 2.423 -11.017 5.705) 12.641 6.072 ( 3.252 1.007 -2.076) 3.987 6.309 ( -5.587 -15.490 -1.416) 16.528 6.367 ( -0.342 -10.750 -1.799) 10.905 6.704 ( 2.459 5.882 0.769) 6.422 6.850 ( 0.029 5.476 -5.154) 7.520 6.926 ( 1.384 4.186 3.637) 5.715 6.997 ( 1.394 11.138 -0.760) 11.250 7.297 ( 1.475 8.063 -1.464) 8.327 7.378 ( 1.055 14.120 3.230) 14.523 7.841 ( -1.222 -4.620 -1.257) 4.942 8.325 ( -16.326 -16.746 -8.566) 24.907 8.592 ( 1.961 -2.547 3.576) 4.808 8.828 ( -5.838 -2.615 -4.330) 7.724 9.223 ( 0.293 0.138 2.630) 2.650 9.371 ( -2.645 -0.333 -7.618) 8.071 13.175 ( 3.690 3.617 6.253) 8.112 13.457 ( 0.434 1.521 -6.080) 6.282 15.104 ( 3.131 -1.002 2.261) 3.990 15.190 ( 3.247 -2.452 -0.338) 4.083 15.279 ( 3.536 5.679 3.351) 7.483 15.540 ( -2.205 8.040 -6.542) 10.597 16.107 ( 25.929 12.327 8.640) 29.982 16.620 ( 0.793 -2.993 5.599) 6.398 ======================= Grid point 300 (146/190) ======================= q-point: ( 0.00 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.046 ( -2.958 16.060 9.499) 18.892 1.178 ( 1.330 12.166 4.183) 12.933 1.336 ( 2.203 14.365 2.212) 14.700 1.634 ( -2.138 12.906 -19.131) 23.176 2.220 ( 3.471 29.527 8.693) 30.975 2.331 ( -2.001 12.656 -1.746) 12.932 2.977 ( -0.964 -9.830 4.663) 10.923 3.036 ( 1.457 8.985 6.326) 11.085 3.120 ( -0.174 2.337 -5.700) 6.163 3.244 ( -1.432 -4.228 -12.655) 13.419 3.646 ( -3.228 -22.877 1.839) 23.176 3.689 ( 2.743 -22.935 -2.293) 23.212 4.877 ( -0.536 -5.418 10.530) 11.854 5.095 ( 2.363 0.663 -9.775) 10.078 5.170 ( 3.064 -13.223 9.815) 16.750 5.305 ( -3.387 -10.597 -2.866) 11.489 5.560 ( 6.302 -11.618 10.544) 16.908 5.740 ( -7.875 -7.565 -2.608) 11.227 5.859 ( 1.844 5.105 3.787) 6.619 5.943 ( -0.545 0.575 -2.951) 3.055 6.116 ( -0.433 -1.044 1.270) 1.700 6.193 ( 1.112 8.151 -6.782) 10.662 6.812 ( 2.125 -0.742 -0.057) 2.252 6.865 ( -4.242 -0.919 -4.304) 6.113 7.142 ( 2.266 9.153 4.478) 10.439 7.232 ( -1.422 9.914 -4.601) 11.022 7.533 ( 7.117 4.977 2.330) 8.991 7.579 ( -5.780 6.168 -2.326) 8.767 7.707 ( -2.866 -8.391 3.398) 9.496 7.774 ( 1.548 -7.734 -2.772) 8.361 8.632 ( 1.340 0.204 5.157) 5.332 8.732 ( -2.163 0.324 -3.608) 4.219 9.211 ( -0.529 -1.607 4.190) 4.518 9.314 ( -0.475 -1.875 -5.972) 6.277 13.357 ( 2.378 6.754 7.265) 10.200 13.500 ( -1.111 4.376 -5.662) 7.242 15.117 ( 0.445 -1.128 4.397) 4.561 15.195 ( -0.709 0.061 -3.108) 3.189 15.429 ( 3.182 1.519 5.441) 6.484 15.586 ( -4.297 1.622 -9.686) 10.720 16.462 ( -2.306 1.321 10.953) 11.271 16.687 ( 5.493 1.501 -11.519) 12.850 ======================= Grid point 301 (147/190) ======================= q-point: ( 0.07 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.112 ( 7.564 16.384 9.396) 20.345 1.296 ( 8.451 10.925 9.247) 16.622 1.427 ( 6.276 12.764 -3.137) 14.565 1.612 ( 3.166 11.555 -16.354) 20.273 2.249 ( 0.764 18.898 -0.375) 18.918 2.420 ( 8.893 19.103 4.650) 21.578 2.935 ( -2.989 -7.855 2.242) 8.698 3.123 ( -2.548 -13.768 -9.102) 16.700 3.141 ( 7.608 12.075 7.435) 16.092 3.246 ( 6.903 7.970 -5.368) 11.831 3.653 ( 4.635 -24.482 1.372) 24.955 3.819 ( 9.549 -18.118 -1.402) 20.528 4.813 ( -7.177 -5.409 7.181) 11.504 5.108 ( 0.916 -3.949 -8.700) 9.598 5.229 ( -1.742 -7.005 0.145) 7.220 5.245 ( 0.790 -14.169 5.159) 15.100 5.553 ( -7.081 -5.069 -1.023) 8.769 5.718 ( 3.683 -6.625 9.034) 11.793 5.925 ( 4.219 5.901 1.464) 7.400 5.975 ( 4.045 -5.641 -1.289) 7.060 6.126 ( 1.722 1.985 0.968) 2.801 6.201 ( 1.045 8.191 -6.744) 10.662 6.760 ( -5.195 -1.911 -0.876) 5.605 6.828 ( -0.783 -0.504 0.800) 1.228 7.139 ( -2.845 9.316 -1.074) 9.799 7.219 ( 0.317 8.706 -0.799) 8.748 7.462 ( -3.799 7.701 -2.504) 8.944 7.620 ( -0.491 6.179 2.636) 6.736 7.727 ( 7.117 -5.410 -1.782) 9.116 7.917 ( 9.693 -13.303 1.288) 16.510 8.629 ( -2.734 0.552 1.822) 3.331 8.712 ( 0.749 -1.054 1.090) 1.691 9.202 ( -1.302 -2.253 4.534) 5.228 9.298 ( -0.161 -1.387 -4.069) 4.302 13.372 ( -2.419 6.367 2.368) 7.211 13.465 ( -0.819 5.576 -3.418) 6.591 15.109 ( -2.372 -1.154 3.792) 4.619 15.143 ( -3.721 0.073 -2.358) 4.406 15.470 ( -4.777 1.249 -6.765) 8.376 15.485 ( 0.642 0.362 5.568) 5.616 16.326 ( -11.068 7.028 3.766) 13.641 16.690 ( -3.940 -2.427 -8.214) 9.428 ======================= Grid point 302 (148/190) ======================= q-point: ( 0.13 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.328 ( 11.627 14.640 9.465) 20.955 1.493 ( 8.901 8.823 10.331) 16.242 1.553 ( 8.303 12.329 -9.784) 17.795 1.672 ( 4.464 7.042 -11.365) 14.096 2.326 ( 7.602 15.323 -1.642) 17.184 2.617 ( 9.131 12.392 5.667) 16.402 2.896 ( -0.689 -3.678 -0.545) 3.782 3.029 ( -3.916 -6.823 -5.051) 9.349 3.322 ( 8.314 8.626 5.414) 13.147 3.449 ( 13.102 -0.494 -2.240) 13.301 3.810 ( 10.479 -21.762 0.568) 24.160 4.043 ( 13.542 -9.121 -1.501) 16.396 4.658 ( -8.864 -6.806 5.450) 12.433 5.101 ( -1.642 -3.956 -7.321) 8.482 5.174 ( 0.022 -10.995 -4.584) 11.913 5.289 ( 0.562 -7.238 8.007) 10.808 5.422 ( -5.002 -3.463 -3.793) 7.169 5.765 ( -0.573 1.387 7.833) 7.975 6.011 ( 3.052 1.461 -0.343) 3.401 6.069 ( 5.421 -6.377 1.068) 8.438 6.202 ( 5.649 9.502 1.116) 11.111 6.235 ( 4.520 1.560 -4.483) 6.555 6.667 ( -4.767 -1.636 1.263) 5.196 6.795 ( -2.026 -0.940 0.181) 2.241 7.060 ( -4.226 6.354 -4.351) 8.785 7.209 ( -1.109 10.543 0.247) 10.604 7.438 ( 0.907 8.913 0.479) 8.972 7.623 ( 0.666 6.577 1.257) 6.729 7.853 ( 5.738 -5.427 -5.424) 9.581 8.104 ( 8.219 -16.270 3.305) 18.525 8.563 ( -3.758 0.457 -0.350) 3.802 8.733 ( 0.396 -4.299 4.474) 6.217 9.176 ( -2.148 -3.006 4.426) 5.765 9.288 ( -0.486 -1.944 -2.686) 3.351 13.296 ( -4.173 6.260 -3.441) 8.273 13.448 ( -1.390 5.716 1.187) 6.001 15.024 ( -5.893 0.002 0.118) 5.894 15.068 ( -3.882 -1.005 0.250) 4.017 15.359 ( -4.549 0.224 -6.461) 7.905 15.510 ( 0.114 0.132 8.812) 8.813 16.094 ( -12.082 11.047 -2.163) 16.513 16.534 ( -9.943 -2.138 -3.757) 10.842 ======================= Grid point 303 (149/190) ======================= q-point: ( 0.20 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.555 ( 9.449 12.422 6.280) 16.823 1.637 ( 2.205 8.415 -12.701) 15.395 1.681 ( 10.175 6.436 0.529) 12.051 1.821 ( 11.585 6.412 4.538) 13.997 2.494 ( 8.264 11.054 -2.408) 14.010 2.746 ( 2.800 -6.039 6.364) 9.209 2.917 ( 1.527 -2.190 -0.410) 2.702 2.999 ( 3.096 9.438 -3.113) 10.410 3.457 ( 4.640 1.692 1.892) 5.288 3.711 ( 13.144 -4.866 1.245) 14.071 4.027 ( 10.696 -15.542 -0.434) 18.872 4.303 ( 10.433 1.376 -1.417) 10.618 4.527 ( -3.476 -8.371 5.098) 10.400 5.020 ( -3.515 -5.478 -11.491) 13.206 5.199 ( -0.154 -8.290 -7.349) 11.080 5.307 ( 4.517 -1.942 4.691) 6.796 5.394 ( 1.124 -4.389 6.360) 7.809 5.737 ( -2.644 4.081 2.623) 5.525 6.006 ( -2.521 -1.272 -1.891) 3.398 6.199 ( 7.360 3.975 0.908) 8.414 6.321 ( 5.540 4.292 -0.176) 7.010 6.354 ( 5.918 -2.839 1.205) 6.674 6.577 ( -3.154 1.571 1.783) 3.949 6.780 ( 0.828 -2.661 -0.246) 2.798 6.984 ( -2.247 3.189 -4.699) 6.107 7.194 ( -0.289 11.521 0.743) 11.548 7.468 ( 1.327 7.729 2.407) 8.203 7.642 ( 0.817 7.289 0.425) 7.347 7.927 ( 3.109 -5.852 -6.927) 9.587 8.231 ( 4.044 -14.928 2.747) 15.709 8.488 ( -3.766 0.898 -0.172) 3.875 8.733 ( -1.404 -8.098 4.988) 9.614 9.133 ( -2.948 -3.746 3.981) 6.211 9.266 ( -1.349 -2.456 -2.714) 3.901 13.220 ( -2.788 6.065 -3.123) 7.370 13.411 ( -2.503 4.934 1.395) 5.706 14.912 ( -5.147 -0.307 -0.612) 5.192 14.988 ( -4.233 -1.105 0.119) 4.377 15.273 ( -3.441 0.557 -3.810) 5.164 15.520 ( -0.690 -0.675 8.733) 8.786 15.866 ( -10.494 11.631 -4.807) 16.386 16.322 ( -10.814 -1.544 -1.783) 11.068 ======================= Grid point 304 (150/190) ======================= q-point: ( 0.27 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.630 ( 1.744 6.744 -9.480) 11.764 1.754 ( 9.076 7.392 1.608) 11.816 1.899 ( 11.154 3.413 2.170) 11.865 2.060 ( 11.293 5.513 5.224) 13.610 2.606 ( 3.672 4.415 -0.194) 5.745 2.792 ( 1.649 -9.190 5.321) 10.746 2.929 ( 0.473 -1.134 -0.514) 1.332 3.102 ( 5.691 9.602 -1.673) 11.286 3.511 ( 1.101 -2.111 -0.851) 2.529 3.934 ( 8.266 -6.310 2.809) 10.772 4.178 ( 4.118 -1.912 -2.909) 5.392 4.337 ( -2.851 -7.092 6.643) 10.127 4.593 ( 4.754 1.299 -4.206) 6.479 4.951 ( -0.689 -2.690 -13.538) 13.820 5.224 ( 5.733 -8.136 -2.117) 10.176 5.433 ( 0.937 -1.349 7.944) 8.112 5.478 ( 10.212 -1.081 5.400) 11.602 5.691 ( -1.689 4.748 -2.200) 5.499 5.943 ( -2.302 -0.115 -4.245) 4.830 6.273 ( -4.741 -3.986 3.629) 7.179 6.377 ( 6.534 3.636 1.535) 7.633 6.479 ( 6.740 2.863 -0.693) 7.356 6.629 ( 6.150 1.435 1.940) 6.607 6.830 ( 4.557 -4.038 0.538) 6.113 6.963 ( 0.770 0.570 -4.844) 4.938 7.205 ( 1.319 11.322 1.353) 11.479 7.489 ( 0.272 6.226 3.168) 6.991 7.651 ( 0.090 7.270 -0.477) 7.286 7.954 ( 0.847 -5.376 -6.501) 8.478 8.266 ( -0.820 -11.118 0.991) 11.193 8.425 ( -2.401 0.302 0.655) 2.507 8.690 ( -4.066 -10.300 5.031) 12.163 9.080 ( -2.889 -4.013 2.418) 5.504 9.228 ( -1.926 -2.634 -2.745) 4.264 13.177 ( -1.315 5.626 -1.783) 6.046 13.360 ( -2.788 4.137 1.061) 5.100 14.829 ( -3.264 -0.987 -0.601) 3.463 14.910 ( -3.691 -1.039 0.112) 3.836 15.212 ( -2.305 0.799 -1.624) 2.930 15.505 ( -2.757 0.491 6.527) 7.103 15.682 ( -6.874 8.872 -4.473) 12.082 16.118 ( -9.717 -1.777 -1.271) 9.960 ======================= Grid point 305 (151/190) ======================= q-point: ( 0.33 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.676 ( 4.589 3.893 -4.660) 7.611 1.935 ( 9.235 2.152 1.097) 9.546 2.101 ( 8.586 1.219 2.845) 9.127 2.262 ( 8.781 3.516 1.783) 9.626 2.658 ( 1.943 0.513 2.741) 3.399 2.822 ( -0.394 -8.592 6.434) 10.742 2.943 ( 1.865 1.429 -4.526) 5.099 3.178 ( 1.927 2.205 -0.150) 2.932 3.516 ( 0.160 -2.527 -1.367) 2.877 3.995 ( -2.121 -2.737 1.324) 3.707 4.172 ( -4.157 -2.430 -3.275) 5.823 4.332 ( 2.085 -0.538 4.186) 4.707 4.624 ( 0.499 2.530 -5.806) 6.353 4.959 ( 2.659 -0.140 -6.860) 7.358 5.295 ( -3.450 -1.744 0.907) 3.970 5.506 ( 9.010 -3.884 1.195) 9.884 5.640 ( -2.990 8.714 -5.466) 10.712 5.696 ( 9.815 0.465 9.322) 13.545 5.955 ( 3.957 -4.091 -3.408) 6.634 6.191 ( -1.909 -4.575 5.208) 7.190 6.514 ( 5.832 -3.789 1.195) 7.057 6.589 ( 4.402 6.497 -1.495) 7.989 6.765 ( 7.651 -0.358 1.420) 7.790 6.953 ( 7.180 -4.206 0.728) 8.353 6.988 ( 2.717 -0.055 -5.429) 6.071 7.249 ( 2.563 9.923 3.323) 10.774 7.492 ( -0.241 4.855 2.415) 5.428 7.647 ( -0.032 6.482 -1.433) 6.639 7.933 ( -2.186 -4.113 -4.700) 6.617 8.221 ( -2.967 -6.920 -0.503) 7.546 8.392 ( -1.516 -1.255 1.065) 2.237 8.589 ( -6.958 -9.661 4.615) 12.769 9.038 ( -1.498 -4.052 0.950) 4.423 9.183 ( -2.245 -3.037 -2.332) 4.438 13.159 ( -0.308 5.161 -0.823) 5.236 13.309 ( -2.630 3.739 0.647) 4.617 14.780 ( -1.798 -1.218 -0.293) 2.191 14.849 ( -2.463 -1.052 0.324) 2.698 15.176 ( -1.244 0.891 -0.346) 1.569 15.419 ( -6.019 5.567 0.727) 8.231 15.604 ( -1.277 1.907 0.004) 2.295 15.942 ( -8.080 -2.490 -1.098) 8.526 ======================= Grid point 306 (152/190) ======================= q-point: ( 0.40 0.22 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.793 ( 7.457 1.165 1.172) 7.638 2.114 ( 8.742 -2.256 1.843) 9.215 2.218 ( 2.854 0.367 -0.293) 2.893 2.419 ( 7.126 -1.846 0.381) 7.371 2.690 ( 0.174 -0.437 1.802) 1.862 2.781 ( -3.878 -6.454 3.153) 8.163 3.000 ( 4.316 1.044 -1.928) 4.841 3.173 ( -2.029 -1.858 0.022) 2.752 3.526 ( 0.709 -1.802 0.471) 1.993 3.911 ( -4.969 6.343 -7.162) 10.781 4.062 ( -5.260 -9.179 5.508) 11.927 4.380 ( 1.172 3.914 -0.578) 4.126 4.631 ( 1.716 2.588 -4.313) 5.315 4.992 ( 0.091 2.690 -3.190) 4.174 5.171 ( -5.800 4.711 0.165) 7.475 5.531 ( -6.179 8.002 -3.227) 10.613 5.712 ( 9.746 -7.801 0.440) 12.491 5.925 ( 11.638 4.120 6.963) 14.174 5.996 ( -0.084 -7.172 -0.193) 7.175 6.249 ( 5.341 -4.289 3.066) 7.505 6.594 ( 2.224 -4.756 2.059) 5.640 6.647 ( 2.166 4.640 -2.390) 5.651 6.896 ( 4.169 -2.191 0.238) 4.716 7.065 ( 4.951 -1.091 -4.711) 6.920 7.092 ( 8.292 -1.113 -2.455) 8.719 7.292 ( 0.103 5.182 6.943) 8.664 7.501 ( 1.318 3.990 -0.305) 4.213 7.669 ( 3.405 5.314 -1.164) 6.418 7.849 ( -5.616 -2.235 -1.933) 6.346 8.159 ( -3.651 -5.519 -1.590) 6.806 8.364 ( -1.411 -1.314 0.944) 2.147 8.451 ( -7.216 -6.147 3.531) 10.115 9.025 ( -0.027 -4.275 0.519) 4.307 9.135 ( -2.319 -3.677 -1.865) 4.731 13.161 ( 0.509 4.742 -0.214) 4.774 13.261 ( -2.334 3.712 0.144) 4.387 14.756 ( -0.638 -0.878 0.118) 1.092 14.813 ( -1.418 -1.011 0.373) 1.781 15.161 ( -0.319 1.076 0.206) 1.141 15.309 ( -4.784 6.092 -0.996) 7.809 15.603 ( 0.709 -0.638 0.883) 1.300 15.801 ( -6.181 -3.168 -0.819) 6.993 ======================= Grid point 307 (153/190) ======================= q-point: ( 0.47 0.22 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.956 ( 8.193 -0.275 5.345) 9.787 2.197 ( -2.648 3.819 -0.774) 4.711 2.301 ( 8.408 -10.380 -1.672) 13.463 2.483 ( -3.478 -11.646 -2.000) 12.318 2.660 ( -0.399 -0.700 3.159) 3.261 2.746 ( -0.222 1.924 -0.474) 1.994 3.077 ( 2.158 -0.644 2.223) 3.164 3.130 ( -0.947 -1.704 -1.215) 2.297 3.528 ( -0.473 -0.173 3.043) 3.084 3.794 ( -4.893 6.594 -14.249) 16.445 4.037 ( 0.691 -7.453 15.933) 17.603 4.362 ( -1.744 2.700 -7.199) 7.883 4.688 ( 4.262 4.012 0.168) 5.856 4.899 ( -6.482 3.506 -8.098) 10.949 5.165 ( 3.204 9.214 6.828) 11.907 5.407 ( -5.519 7.055 -4.842) 10.182 5.863 ( 5.202 -8.582 2.487) 10.340 5.970 ( -1.950 -8.581 -0.883) 8.844 6.155 ( 10.122 4.245 4.842) 11.996 6.309 ( -1.104 -3.510 1.639) 4.028 6.624 ( 1.058 -0.873 1.447) 1.994 6.671 ( 0.756 1.609 -2.485) 3.055 6.952 ( 2.368 -2.503 1.465) 3.744 7.090 ( -1.663 -2.179 -4.852) 5.573 7.261 ( -4.205 1.279 7.120) 8.367 7.274 ( 9.416 -1.126 -5.886) 11.161 7.554 ( 4.310 3.243 -0.072) 5.394 7.687 ( -6.313 3.106 -1.813) 7.265 7.823 ( 7.584 -0.860 2.471) 8.023 8.043 ( -8.283 -4.371 -1.483) 9.482 8.344 ( -1.027 -1.764 1.711) 2.663 8.362 ( -1.310 -1.783 0.336) 2.238 9.035 ( 0.687 -4.372 0.988) 4.535 9.090 ( -1.801 -4.247 -1.697) 4.916 13.178 ( 1.284 4.385 0.208) 4.574 13.219 ( -1.922 3.879 -0.285) 4.338 14.756 ( 0.566 -0.542 0.629) 1.005 14.790 ( -1.112 -0.679 -0.156) 1.312 15.166 ( 0.886 1.774 0.864) 2.163 15.234 ( -2.699 4.623 -1.409) 5.536 15.631 ( 2.043 -1.448 0.651) 2.587 15.700 ( -3.913 -3.343 -0.594) 5.181 ======================= Grid point 308 (154/190) ======================= q-point: (-0.47 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.068 ( -4.751 2.643 -1.393) 5.612 2.128 ( 2.590 -1.514 0.984) 3.157 2.321 ( -9.035 -8.954 -1.536) 12.812 2.446 ( 4.197 -11.859 -0.091) 12.580 2.676 ( 0.501 1.508 3.626) 3.958 2.758 ( 1.631 0.498 -2.986) 3.439 3.063 ( -2.306 -0.802 2.886) 3.780 3.153 ( 1.692 -3.906 -1.713) 4.589 3.555 ( 2.977 5.187 7.580) 9.655 3.683 ( -4.174 1.071 -11.507) 12.288 4.091 ( 0.694 -2.469 14.435) 14.661 4.339 ( 2.112 -0.850 -8.891) 9.178 4.715 ( -4.583 5.819 -0.719) 7.442 4.841 ( 4.645 2.950 -4.447) 7.075 5.258 ( 3.233 8.875 6.308) 11.358 5.313 ( -1.842 7.785 -4.148) 9.011 5.859 ( -5.903 -7.752 2.860) 10.155 5.982 ( 3.242 -8.773 -1.780) 9.521 6.214 ( -7.578 -1.148 -0.608) 7.689 6.301 ( 3.071 0.324 2.527) 3.990 6.639 ( 0.084 2.747 0.091) 2.749 6.671 ( -0.212 -1.375 -2.502) 2.863 6.995 ( 0.698 -0.450 3.589) 3.684 7.005 ( -4.982 -3.622 -3.235) 6.957 7.161 ( -6.809 -0.389 5.081) 8.505 7.414 ( 5.619 -0.125 -7.873) 9.673 7.540 ( -5.971 3.771 1.290) 7.179 7.656 ( 2.959 2.878 1.159) 4.288 7.869 ( -6.712 -1.201 -1.827) 7.059 7.999 ( 8.036 -4.429 2.679) 9.559 8.344 ( 0.970 -0.932 0.806) 1.568 8.387 ( 3.575 -2.607 -0.967) 4.529 9.037 ( -0.963 -4.303 1.230) 4.577 9.077 ( 1.059 -4.304 -1.030) 4.551 13.186 ( -1.376 4.151 -0.512) 4.403 13.211 ( 2.014 4.057 0.453) 4.552 14.770 ( -0.696 -0.480 -0.621) 1.049 14.777 ( 1.414 -0.497 0.871) 1.734 15.193 ( -1.042 2.923 -1.428) 3.416 15.203 ( 2.382 3.049 1.311) 4.085 15.641 ( -1.565 -2.429 -0.141) 2.893 15.692 ( 3.629 -2.103 0.062) 4.195 ======================= Grid point 309 (155/190) ======================= q-point: (-0.40 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.878 ( -11.018 2.455 -6.561) 13.056 2.089 ( -8.659 -7.114 2.416) 11.464 2.264 ( 2.708 3.948 -0.480) 4.811 2.404 ( -7.275 -2.814 -0.618) 7.825 2.741 ( 3.337 -2.210 -1.055) 4.140 2.783 ( 2.570 -3.279 0.043) 4.166 3.008 ( -3.530 -1.881 -0.435) 4.023 3.181 ( 1.240 -5.139 0.149) 5.288 3.578 ( -4.469 0.857 -5.189) 6.902 3.677 ( 6.733 6.233 10.083) 13.632 4.115 ( 0.771 -2.601 6.648) 7.180 4.403 ( 4.150 -2.371 -4.485) 6.555 4.608 ( -4.739 4.354 -3.155) 7.167 4.934 ( 2.390 1.549 0.870) 2.978 5.238 ( -0.075 1.280 -4.747) 4.917 5.394 ( 5.030 13.940 8.431) 17.050 5.704 ( -9.729 -6.534 2.057) 11.899 6.025 ( -0.853 -7.156 -2.199) 7.535 6.045 ( -7.431 0.044 -4.559) 8.718 6.281 ( -3.658 -3.621 0.554) 5.177 6.617 ( -2.766 3.812 -0.867) 4.789 6.655 ( -1.118 -3.512 -2.591) 4.505 6.901 ( -4.452 -1.634 -0.087) 4.744 6.982 ( -4.428 -0.117 2.589) 5.131 7.032 ( -5.564 0.429 3.689) 6.690 7.413 ( -4.084 9.984 -3.940) 11.484 7.490 ( -0.775 -3.440 -0.069) 3.527 7.635 ( -1.652 5.834 1.901) 6.354 7.856 ( 3.273 -1.478 -2.703) 4.494 8.126 ( 4.777 -6.544 1.916) 8.326 8.375 ( 1.869 -1.095 -0.128) 2.170 8.498 ( 7.524 -6.361 -0.772) 9.883 9.024 ( -0.194 -4.154 0.946) 4.264 9.107 ( 1.736 -3.647 0.256) 4.048 13.164 ( -0.728 4.518 -0.533) 4.607 13.257 ( 2.617 3.667 0.444) 4.527 14.764 ( 0.309 -0.525 -0.647) 0.889 14.810 ( 1.749 -0.907 0.655) 2.076 15.175 ( -0.286 1.314 -1.363) 1.915 15.277 ( 4.657 5.370 2.111) 7.415 15.628 ( 0.335 -1.094 -1.377) 1.791 15.783 ( 5.533 -2.311 0.807) 6.051 ======================= Grid point 310 (156/190) ======================= q-point: (-0.33 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.658 ( -10.108 4.843 -2.749) 11.541 1.908 ( -10.033 0.290 2.553) 10.357 2.219 ( -10.227 2.434 -4.567) 11.462 2.294 ( -0.381 3.361 -3.174) 4.639 2.723 ( -3.256 4.724 -3.245) 6.592 2.862 ( 1.901 -3.336 3.317) 5.074 2.955 ( 0.200 -10.527 -4.699) 11.530 3.176 ( -2.607 -0.551 -0.406) 2.695 3.492 ( -3.030 -0.318 -0.684) 3.122 3.843 ( 7.521 4.346 11.743) 14.606 4.144 ( 0.358 -5.963 4.504) 7.481 4.426 ( -1.801 2.452 -4.163) 5.157 4.555 ( 0.413 -0.962 -1.355) 1.712 4.883 ( -6.776 -5.909 0.492) 9.004 5.257 ( -1.929 0.034 3.681) 4.156 5.486 ( 3.385 9.817 2.592) 10.703 5.548 ( -4.142 0.393 3.962) 5.746 5.863 ( -8.037 -1.374 -5.884) 10.055 5.937 ( -8.648 -6.127 -1.867) 10.762 6.284 ( 4.851 -2.060 -3.103) 6.116 6.520 ( -6.755 2.607 0.077) 7.241 6.612 ( -3.115 -1.848 -3.054) 4.738 6.792 ( -6.778 -1.153 -1.085) 6.960 6.898 ( -2.426 2.790 2.788) 4.631 6.951 ( -4.715 -3.004 1.253) 5.729 7.302 ( -5.475 11.916 -2.122) 13.284 7.485 ( 0.230 1.823 3.233) 3.718 7.646 ( 1.385 7.134 -1.019) 7.338 7.899 ( 1.014 -3.873 -1.868) 4.418 8.209 ( 3.729 -7.622 0.882) 8.531 8.412 ( 1.906 -1.769 -0.779) 2.714 8.645 ( 6.936 -10.441 -0.540) 12.547 9.042 ( 2.023 -3.944 1.293) 4.617 9.141 ( 1.692 -2.747 0.729) 3.308 13.156 ( -0.046 4.973 -0.421) 4.991 13.312 ( 2.940 3.120 0.185) 4.291 14.781 ( 1.535 -0.742 -0.461) 1.767 14.849 ( 2.249 -1.186 0.401) 2.574 15.178 ( 0.673 0.609 -0.489) 1.031 15.392 ( 6.782 8.012 2.572) 10.807 15.645 ( 1.629 0.593 -3.159) 3.604 15.910 ( 7.314 -2.503 1.758) 7.928 ======================= Grid point 311 (157/190) ======================= q-point: (-0.27 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.490 ( -6.998 9.286 3.358) 12.103 1.712 ( -10.406 6.026 3.845) 12.624 1.999 ( -11.180 5.614 -5.652) 13.728 2.235 ( -4.508 4.186 -10.808) 12.436 2.615 ( -7.254 10.580 -0.227) 12.830 2.866 ( -0.087 -9.090 -0.300) 9.096 2.992 ( 2.569 -9.594 -5.809) 11.506 3.063 ( -8.511 10.259 0.571) 13.342 3.461 ( -0.969 -3.122 1.474) 3.586 3.951 ( -0.587 -4.094 4.906) 6.417 4.110 ( -4.111 -5.107 3.560) 7.460 4.362 ( -4.282 2.561 2.807) 5.725 4.586 ( 2.270 -3.461 -1.048) 4.270 4.746 ( -5.401 -9.307 2.456) 11.037 5.119 ( -9.394 -5.449 6.266) 12.538 5.467 ( -7.945 2.821 4.345) 9.485 5.598 ( 7.104 5.827 -4.435) 10.202 5.714 ( -6.249 -4.910 -4.947) 9.361 5.835 ( 0.425 -0.974 5.282) 5.388 6.366 ( -5.508 6.068 -2.625) 8.605 6.407 ( 3.491 0.311 -2.378) 4.235 6.506 ( -6.823 -3.104 -2.601) 7.935 6.685 ( -3.626 2.193 -3.879) 5.745 6.845 ( -4.157 -4.533 -0.843) 6.208 6.884 ( -0.882 1.771 2.887) 3.500 7.226 ( -1.860 12.712 -1.021) 12.887 7.494 ( -0.131 5.197 2.642) 5.831 7.663 ( 0.338 8.489 -0.903) 8.543 7.890 ( -1.422 -5.425 -0.900) 5.680 8.270 ( 1.997 -10.742 0.470) 10.936 8.446 ( 1.891 -1.534 -1.326) 2.772 8.747 ( 3.492 -11.492 -0.369) 12.016 9.111 ( 4.649 -4.893 1.849) 6.998 9.174 ( 1.641 -1.938 0.032) 2.540 13.161 ( 0.573 5.484 -0.187) 5.517 13.370 ( 2.907 2.493 -0.032) 3.829 14.824 ( 3.010 -0.462 -0.210) 3.053 14.904 ( 3.349 -1.077 0.639) 3.575 15.198 ( 1.438 0.521 0.058) 1.530 15.550 ( 8.894 10.409 3.065) 14.030 15.675 ( 2.039 2.476 -4.907) 5.862 16.072 ( 8.843 -2.583 2.834) 9.638 ======================= Grid point 312 (158/190) ======================= q-point: (-0.20 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.390 ( -4.847 11.944 9.255) 15.868 1.523 ( -9.699 11.235 6.363) 16.149 1.768 ( -11.212 8.828 -8.286) 16.502 2.088 ( -7.737 6.285 -16.113) 18.947 2.451 ( -9.461 13.574 1.913) 16.656 2.851 ( -11.609 12.880 0.474) 17.346 2.875 ( 0.544 -9.644 0.695) 9.684 3.031 ( 1.716 -3.265 -5.844) 6.910 3.431 ( -2.658 -3.211 0.400) 4.188 3.797 ( -12.733 -3.495 -4.684) 14.010 4.007 ( -8.314 -15.368 2.676) 17.677 4.231 ( -10.257 -1.967 4.517) 11.379 4.639 ( 3.314 -5.815 0.941) 6.759 4.744 ( 4.246 -0.892 7.402) 8.580 5.014 ( -2.003 -11.827 9.649) 15.395 5.309 ( -6.713 -2.388 1.841) 7.359 5.577 ( -4.313 -6.482 -8.678) 11.659 5.745 ( 5.559 8.846 1.402) 10.542 5.908 ( 3.941 -0.989 7.052) 8.139 6.228 ( -6.560 6.521 -0.974) 9.301 6.324 ( -9.005 -6.244 -1.217) 11.025 6.445 ( -4.098 4.459 -5.528) 8.200 6.656 ( 2.565 1.257 -5.635) 6.318 6.803 ( 0.540 -3.844 -1.974) 4.355 6.899 ( 1.891 4.229 3.260) 5.665 7.217 ( 0.870 13.129 -1.988) 13.307 7.484 ( -1.232 6.300 1.132) 6.519 7.654 ( -1.101 9.581 -0.237) 9.647 7.848 ( -2.676 -5.839 0.340) 6.432 8.268 ( -2.583 -16.299 -0.784) 16.521 8.487 ( 2.558 -0.132 -0.599) 2.630 8.788 ( 0.999 -9.128 -0.016) 9.183 9.189 ( 1.251 -2.312 4.597) 5.296 9.227 ( 5.103 -5.440 -4.551) 8.738 13.178 ( 1.235 6.006 0.565) 6.158 13.425 ( 2.702 2.235 0.138) 3.509 14.904 ( 5.347 0.601 -0.033) 5.381 14.977 ( 3.842 -0.997 1.097) 4.118 15.234 ( 2.154 0.733 0.426) 2.315 15.694 ( 2.037 1.497 -8.404) 8.776 15.758 ( 10.785 14.823 5.525) 19.146 16.259 ( 9.588 -2.441 3.836) 10.611 ======================= Grid point 313 (159/190) ======================= q-point: (-0.13 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.304 ( -6.683 11.047 12.026) 17.644 1.362 ( -8.274 14.654 9.597) 19.372 1.540 ( -10.284 12.599 -10.501) 19.359 1.903 ( -7.552 8.799 -18.329) 21.689 2.271 ( -8.602 18.654 3.218) 20.792 2.620 ( -11.492 19.925 3.818) 23.316 2.904 ( 1.996 -14.595 0.478) 14.739 3.045 ( 0.466 0.457 -3.675) 3.733 3.356 ( -4.411 -3.092 -3.872) 6.634 3.512 ( -14.388 3.426 -5.621) 15.822 3.822 ( -9.532 -22.208 0.350) 24.170 4.011 ( -11.707 -11.870 1.260) 16.719 4.718 ( 4.458 -6.454 2.781) 8.323 4.889 ( 7.874 1.633 9.335) 12.321 5.039 ( 1.255 -10.910 10.227) 15.007 5.260 ( 1.652 -7.696 4.148) 8.897 5.490 ( -3.267 -9.397 -7.406) 12.402 5.827 ( 2.083 11.726 2.959) 12.272 5.968 ( 0.480 -0.605 4.106) 4.178 6.109 ( -6.525 -11.939 -3.092) 13.953 6.165 ( -5.116 7.147 0.846) 8.830 6.308 ( -6.978 3.767 -7.111) 10.651 6.710 ( 2.856 -0.246 -2.942) 4.108 6.854 ( 4.288 -1.146 -3.744) 5.807 6.964 ( 4.031 6.443 4.005) 8.591 7.240 ( 1.582 13.349 -3.513) 13.894 7.454 ( -1.720 6.554 -0.450) 6.791 7.630 ( -0.988 9.766 0.953) 9.862 7.790 ( -3.454 -5.376 0.587) 6.417 8.159 ( -8.386 -20.132 -1.892) 21.891 8.538 ( 2.565 -0.041 0.992) 2.751 8.794 ( -0.236 -5.144 -0.370) 5.163 9.206 ( 0.220 -1.242 3.003) 3.258 9.306 ( 3.218 -5.890 -5.586) 8.732 13.215 ( 2.443 6.514 2.668) 7.452 13.475 ( 2.321 2.671 -0.039) 3.539 15.019 ( 5.213 0.933 -0.120) 5.297 15.059 ( 4.991 -0.784 1.474) 5.263 15.284 ( 2.851 0.977 1.096) 3.207 15.698 ( 0.123 2.758 -9.426) 9.822 16.016 ( 14.430 14.030 5.421) 20.843 16.447 ( 8.520 -1.679 4.048) 9.582 ======================= Grid point 314 (160/190) ======================= q-point: (-0.07 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.162 ( -9.010 12.901 10.256) 18.783 1.233 ( -6.653 13.200 8.766) 17.186 1.361 ( -5.133 15.055 -5.837) 16.944 1.745 ( -5.374 10.900 -19.398) 22.890 2.173 ( -1.533 25.618 6.591) 26.496 2.435 ( -7.845 18.246 2.305) 19.994 2.951 ( 2.314 -15.635 2.648) 16.025 3.034 ( -1.342 7.302 3.407) 8.169 3.231 ( -8.686 1.830 -7.071) 11.348 3.299 ( -3.453 -0.101 -9.462) 10.072 3.680 ( -4.201 -23.463 -0.477) 23.841 3.802 ( -9.522 -20.045 -0.256) 22.193 4.816 ( 4.234 -6.596 7.496) 10.845 5.038 ( 5.244 3.073 0.766) 6.126 5.086 ( 2.878 -11.467 8.651) 14.650 5.343 ( 2.250 -8.547 5.255) 10.282 5.441 ( 1.394 -14.426 -1.749) 14.599 5.841 ( -0.396 10.725 3.113) 11.174 5.904 ( -7.642 -6.751 2.032) 10.397 5.992 ( -3.386 -4.483 -4.561) 7.236 6.128 ( -0.850 0.327 1.734) 1.959 6.201 ( -1.830 7.219 -7.222) 10.374 6.761 ( 2.875 -0.606 -1.574) 3.333 6.908 ( 1.070 -0.683 -5.205) 5.357 7.062 ( 4.699 7.591 5.161) 10.312 7.255 ( 0.325 12.114 -4.040) 12.774 7.439 ( 1.308 6.544 0.068) 6.674 7.631 ( 0.605 9.931 1.503) 10.062 7.719 ( -3.243 -6.626 -0.879) 7.429 7.946 ( -12.229 -17.816 -1.316) 21.650 8.588 ( 2.212 -0.099 2.944) 3.684 8.776 ( -1.496 -1.367 -1.959) 2.818 9.211 ( -0.174 -1.244 3.223) 3.459 9.329 ( 0.401 -3.756 -6.703) 7.694 13.283 ( 3.549 6.773 5.587) 9.470 13.508 ( 1.027 3.458 -2.129) 4.189 15.085 ( 2.064 -0.574 2.736) 3.475 15.166 ( 4.313 0.116 -1.604) 4.603 15.350 ( 3.682 1.220 2.968) 4.884 15.664 ( -1.967 2.691 -9.927) 10.472 16.317 ( 13.865 7.216 6.220) 16.823 16.588 ( 5.531 0.934 -0.358) 5.621 ======================= Grid point 315 (161/190) ======================= q-point: ( 0.00 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.381 ( -0.336 16.609 7.590) 18.264 1.470 ( -0.292 17.349 3.224) 17.648 1.620 ( 0.714 14.728 -0.173) 14.746 1.842 ( -0.996 10.445 -17.969) 20.809 2.442 ( -1.657 -7.088 6.793) 9.956 2.611 ( 2.277 -6.257 -7.396) 9.951 2.866 ( -2.697 8.814 4.957) 10.466 2.973 ( 0.650 -7.231 -5.503) 9.110 3.138 ( 0.531 -11.780 4.054) 12.470 3.226 ( -1.035 -4.295 -4.772) 6.503 3.477 ( 1.571 15.073 3.171) 15.483 3.552 ( -0.178 15.386 -3.757) 15.839 4.750 ( -2.048 -6.101 12.669) 14.210 4.912 ( 3.957 -10.896 6.878) 13.480 4.982 ( 2.714 -10.341 -9.225) 14.120 5.067 ( -2.696 -12.580 -8.006) 15.154 5.272 ( 4.304 -17.574 9.355) 20.369 5.399 ( -6.133 -17.769 -3.183) 19.065 5.921 ( 2.237 5.378 12.127) 13.453 6.122 ( -1.061 10.573 -6.214) 12.310 6.347 ( 0.112 11.722 3.846) 12.338 6.390 ( 0.228 12.432 -0.504) 12.445 6.731 ( 0.372 -5.088 -2.797) 5.818 6.792 ( -2.189 -5.040 -6.978) 8.882 7.267 ( 3.644 1.956 2.432) 4.798 7.343 ( -3.084 -1.518 -5.084) 6.137 7.504 ( -0.856 -4.237 1.332) 4.524 7.530 ( 1.044 -4.726 -1.126) 4.969 7.706 ( 1.448 4.907 2.707) 5.789 7.769 ( -1.455 4.469 -3.427) 5.817 8.648 ( 1.731 1.706 6.152) 6.614 8.748 ( -2.218 0.716 -2.847) 3.679 9.175 ( -0.839 -1.831 3.157) 3.744 9.254 ( 0.566 -3.755 -4.418) 5.826 13.498 ( 2.282 6.812 6.190) 9.483 13.589 ( -0.457 4.044 -1.639) 4.388 15.120 ( 0.053 1.734 3.874) 4.245 15.212 ( -0.698 1.637 -4.387) 4.734 15.414 ( 3.008 -2.647 3.200) 5.128 15.527 ( -4.770 -6.542 -8.043) 11.412 16.532 ( 0.184 4.912 8.730) 10.019 16.704 ( 1.570 0.153 -8.224) 8.374 ======================= Grid point 316 (162/190) ======================= q-point: ( 0.07 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.456 ( 6.571 17.055 5.885) 19.202 1.553 ( 6.291 15.234 9.338) 18.944 1.694 ( 6.932 14.626 -5.078) 16.964 1.816 ( 1.150 10.895 -14.774) 18.392 2.422 ( -0.872 -7.498 6.919) 10.240 2.612 ( -0.463 -7.165 -9.308) 11.755 2.862 ( 1.133 4.467 5.460) 7.145 3.074 ( 9.518 -2.744 -2.143) 10.135 3.134 ( -1.023 -8.024 1.775) 8.281 3.249 ( 3.869 -8.748 -1.665) 9.709 3.474 ( 2.482 16.229 -0.143) 16.418 3.749 ( 15.527 13.273 -1.905) 20.516 4.656 ( -8.448 -8.587 9.106) 15.101 4.948 ( -0.271 -12.232 1.475) 12.324 4.996 ( 0.271 -8.199 -9.230) 12.349 5.083 ( 3.602 -7.044 -2.781) 8.386 5.284 ( -1.000 -17.844 0.277) 17.874 5.446 ( 7.883 -17.298 8.844) 20.967 5.968 ( 0.178 5.984 10.085) 11.728 6.083 ( -1.232 8.827 -8.676) 12.439 6.372 ( 1.794 11.687 4.023) 12.489 6.422 ( 2.455 11.048 -0.428) 11.326 6.683 ( -3.246 -2.426 -3.555) 5.391 6.761 ( -0.863 -4.735 -2.999) 5.671 7.258 ( -4.021 1.063 -4.837) 6.380 7.335 ( 1.924 1.687 2.417) 3.520 7.526 ( 2.819 -2.400 0.384) 3.723 7.571 ( 2.652 -6.008 -1.249) 6.685 7.737 ( 1.600 0.726 -0.545) 1.839 7.776 ( 2.813 3.774 0.373) 4.722 8.647 ( -3.330 1.256 1.772) 3.976 8.708 ( -0.893 0.338 1.810) 2.046 9.156 ( -1.689 -1.994 3.182) 4.118 9.250 ( -0.180 -3.259 -3.651) 4.897 13.507 ( -2.504 6.619 1.198) 7.177 13.572 ( -0.460 4.738 -0.976) 4.859 15.109 ( -2.118 1.362 4.181) 4.881 15.162 ( -3.501 2.017 -3.205) 5.157 15.405 ( -5.597 -5.683 -5.870) 9.903 15.455 ( 0.187 -4.052 4.983) 6.426 16.474 ( -6.832 7.044 4.435) 10.768 16.660 ( -4.593 -0.807 -6.670) 8.138 ======================= Grid point 317 (163/190) ======================= q-point: ( 0.13 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.624 ( 8.934 12.991 4.028) 16.273 1.714 ( 7.898 14.326 11.900) 20.229 1.813 ( 3.352 9.653 -10.588) 14.715 1.846 ( 5.879 16.191 -7.247) 18.688 2.461 ( 3.762 -7.697 5.487) 10.174 2.581 ( -0.881 -8.591 -7.238) 11.268 2.906 ( 2.360 6.913 3.897) 8.279 3.122 ( -0.306 -6.795 0.055) 6.802 3.296 ( 12.190 -3.735 0.092) 12.750 3.369 ( 8.306 -6.894 0.793) 10.824 3.576 ( 7.843 7.698 -1.020) 11.037 4.098 ( 19.814 12.784 -2.552) 23.718 4.493 ( -8.725 -8.413 6.418) 13.715 4.916 ( -2.861 -11.534 -7.190) 13.890 5.011 ( 4.170 -5.394 -4.577) 8.212 5.148 ( 3.324 -6.378 4.883) 8.693 5.312 ( 2.359 -9.579 -3.494) 10.466 5.616 ( 7.074 -14.955 11.399) 20.091 5.959 ( -2.092 3.670 3.280) 5.349 6.058 ( 0.494 4.393 -7.604) 8.796 6.405 ( -0.526 2.948 7.760) 8.318 6.474 ( 2.987 10.016 -2.171) 10.675 6.643 ( 0.289 4.938 -3.686) 6.169 6.738 ( -0.395 -0.803 -1.435) 1.691 7.161 ( -4.906 2.613 -4.763) 7.320 7.360 ( 0.221 3.554 2.965) 4.634 7.597 ( 3.665 2.862 -0.985) 4.754 7.607 ( 1.680 -3.414 -0.668) 3.863 7.798 ( 4.168 -8.815 -1.268) 9.833 7.852 ( 4.571 0.704 1.965) 5.025 8.564 ( -4.504 0.078 -0.971) 4.608 8.684 ( -2.750 -1.254 4.625) 5.525 9.120 ( -2.438 -2.040 2.859) 4.276 9.234 ( -0.875 -3.360 -3.024) 4.604 13.432 ( -4.200 6.952 -3.050) 8.676 13.551 ( -1.976 4.198 0.091) 4.641 15.043 ( -5.341 1.878 2.168) 6.063 15.075 ( -4.538 1.874 -1.107) 5.033 15.302 ( -3.837 -4.777 -4.239) 7.451 15.455 ( -1.155 -5.591 7.741) 9.619 16.305 ( -10.340 9.261 -0.196) 13.883 16.515 ( -8.879 -0.048 -3.894) 9.695 ======================= Grid point 318 (164/190) ======================= q-point: ( 0.20 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.791 ( 5.918 7.806 -6.316) 11.656 1.824 ( 2.391 7.223 2.543) 8.022 1.869 ( 5.505 17.076 2.690) 18.141 1.995 ( 9.580 12.369 1.590) 15.726 2.548 ( 2.330 -10.272 -1.576) 10.650 2.570 ( 1.895 -4.918 2.429) 5.804 2.962 ( 2.619 6.703 -0.032) 7.197 3.118 ( -0.195 -7.536 0.646) 7.566 3.478 ( 4.502 2.828 -2.318) 5.800 3.571 ( 13.177 -8.364 4.088) 16.134 3.774 ( 10.798 -4.552 0.552) 11.732 4.353 ( -1.448 -3.738 1.371) 4.236 4.486 ( 14.814 9.954 -2.168) 17.979 4.869 ( 0.859 -6.459 -7.274) 9.765 5.085 ( 2.156 -3.311 -5.817) 7.032 5.260 ( 7.292 -3.458 7.186) 10.806 5.344 ( 3.253 -2.623 -3.156) 5.237 5.737 ( 2.552 -8.324 13.214) 15.825 5.915 ( -1.898 -1.505 -3.978) 4.658 6.086 ( 3.523 -1.370 -5.763) 6.892 6.357 ( -5.543 -4.535 7.718) 10.529 6.525 ( 2.918 0.255 -1.469) 3.277 6.680 ( 3.552 10.602 -2.831) 11.534 6.766 ( 3.214 9.010 -0.208) 9.569 7.063 ( -3.924 3.250 -3.973) 6.461 7.362 ( -0.240 4.325 2.799) 5.157 7.620 ( 0.581 5.514 0.577) 5.574 7.675 ( 3.470 -1.893 -1.534) 4.241 7.862 ( 2.383 -3.616 -1.301) 4.522 7.952 ( 4.868 -8.953 1.649) 10.323 8.481 ( -3.775 -1.440 -0.828) 4.124 8.612 ( -5.246 -3.947 4.087) 7.733 9.073 ( -2.786 -1.768 2.157) 3.942 9.205 ( -1.560 -3.537 -2.632) 4.677 13.352 ( -3.311 6.742 -2.980) 8.080 13.498 ( -3.214 3.339 -0.577) 4.670 14.929 ( -5.786 2.013 0.275) 6.133 14.988 ( -4.395 1.060 0.141) 4.524 15.236 ( -2.614 -3.263 -2.297) 4.770 15.444 ( -1.376 -6.615 8.534) 10.885 16.091 ( -10.917 10.124 -2.452) 15.089 16.318 ( -10.443 0.673 -2.686) 10.804 ======================= Grid point 319 (165/190) ======================= q-point: ( 0.27 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.785 ( -0.818 8.235 -5.422) 9.893 1.951 ( 5.729 9.187 -4.380) 11.680 1.983 ( 6.607 7.095 6.402) 11.618 2.189 ( 8.766 7.696 4.946) 12.670 2.566 ( 1.819 -6.136 -2.794) 6.983 2.635 ( 2.268 -5.565 6.847) 9.110 2.989 ( 0.442 1.901 -4.542) 4.944 3.122 ( 0.341 -6.583 2.551) 7.068 3.509 ( 0.036 1.689 -2.007) 2.624 3.841 ( 12.563 -6.444 0.785) 14.141 3.890 ( 0.028 -11.741 6.557) 13.448 4.418 ( 8.123 4.636 -1.835) 9.531 4.644 ( 2.057 3.373 -6.235) 7.381 4.948 ( 4.560 2.613 -12.426) 13.491 5.108 ( 5.233 0.006 -1.946) 5.583 5.371 ( 4.283 -4.795 8.339) 10.530 5.527 ( 12.278 2.666 5.029) 13.533 5.751 ( -2.111 0.071 5.217) 5.628 5.888 ( 0.313 -4.456 -5.966) 7.453 6.147 ( 0.971 -4.037 1.629) 4.460 6.266 ( -1.686 -7.479 1.944) 7.909 6.599 ( 4.679 -6.129 -0.700) 7.743 6.750 ( 3.728 8.926 -1.298) 9.760 6.839 ( 4.043 12.366 0.256) 13.012 7.010 ( -0.742 3.065 -3.255) 4.532 7.364 ( -0.165 3.610 3.209) 4.833 7.630 ( 0.419 7.290 1.018) 7.372 7.723 ( 1.604 -0.120 -1.125) 1.963 7.887 ( 0.605 -0.922 -2.159) 2.424 8.028 ( 2.374 -11.351 1.149) 11.653 8.414 ( -3.088 -1.937 -0.439) 3.672 8.505 ( -5.973 -7.291 3.281) 9.979 9.024 ( -2.460 -1.258 1.210) 3.016 9.165 ( -2.177 -3.659 -2.262) 4.822 13.296 ( -1.946 6.056 -1.871) 6.630 13.433 ( -3.200 2.734 -0.631) 4.256 14.833 ( -3.947 1.396 -0.063) 4.187 14.907 ( -3.821 0.556 0.137) 3.863 15.190 ( -1.756 -2.036 -0.807) 2.807 15.429 ( -1.677 -6.815 7.038) 9.939 15.884 ( -9.550 9.714 -2.851) 13.917 16.111 ( -10.143 0.609 -2.156) 10.388 ======================= Grid point 320 (166/190) ======================= q-point: ( 0.33 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.775 ( 0.821 5.995 -2.564) 6.571 2.037 ( 4.097 7.659 -1.305) 8.784 2.126 ( 6.553 0.082 2.962) 7.192 2.324 ( 4.047 2.414 3.098) 5.640 2.617 ( 2.916 -3.281 -1.785) 4.739 2.677 ( 1.526 -3.332 5.650) 6.734 2.980 ( -0.051 -2.287 -3.642) 4.301 3.130 ( -0.101 -4.400 0.766) 4.468 3.497 ( -0.615 -0.044 -0.255) 0.668 3.853 ( -3.512 -15.269 9.270) 18.205 4.024 ( 5.489 1.087 -4.275) 7.042 4.553 ( 4.696 10.192 -3.536) 11.766 4.626 ( -1.979 1.456 -7.620) 8.006 4.994 ( 4.902 2.307 -7.835) 9.525 5.237 ( 4.039 -0.833 -2.705) 4.932 5.462 ( 3.112 -1.916 10.699) 11.306 5.718 ( -0.964 1.003 4.758) 4.958 5.751 ( 7.833 -1.234 4.447) 9.091 5.917 ( 4.329 1.648 -5.328) 7.060 6.133 ( 0.832 1.142 3.710) 3.970 6.335 ( 6.146 -10.277 -1.909) 12.126 6.666 ( 1.611 -3.279 -3.633) 5.152 6.850 ( 7.516 0.734 2.288) 7.890 6.925 ( 4.538 9.779 -0.033) 10.781 7.011 ( 1.025 2.293 -3.215) 4.080 7.357 ( -1.570 1.048 4.355) 4.746 7.640 ( 0.184 9.178 -0.090) 9.180 7.738 ( 0.571 1.661 -0.464) 1.817 7.878 ( -1.349 -0.441 -1.778) 2.276 8.048 ( -0.187 -9.914 -0.174) 9.917 8.355 ( -2.956 -2.619 0.369) 3.967 8.405 ( -4.627 -8.176 2.435) 9.705 8.986 ( -1.530 -1.051 0.496) 1.921 9.114 ( -2.573 -3.687 -1.920) 4.889 13.267 ( -0.870 5.341 -0.972) 5.498 13.375 ( -2.623 2.577 -0.351) 3.694 14.776 ( -1.993 0.886 0.205) 2.190 14.845 ( -2.469 0.316 0.202) 2.497 15.163 ( -0.996 -1.408 -0.093) 1.727 15.397 ( -2.670 -5.933 3.643) 7.457 15.722 ( -6.370 7.845 -1.660) 10.241 15.922 ( -8.724 0.173 -1.523) 8.857 ======================= Grid point 321 (167/190) ======================= q-point: ( 0.40 0.33 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.818 ( 3.849 1.683 0.986) 4.315 2.106 ( 2.837 1.551 0.064) 3.234 2.232 ( 3.703 -2.087 0.768) 4.320 2.360 ( -0.684 -1.538 0.738) 1.838 2.629 ( -0.235 -2.867 -0.534) 2.926 2.747 ( 3.928 2.445 1.417) 4.839 2.986 ( 0.855 -5.068 0.206) 5.144 3.118 ( -0.724 -2.555 -2.527) 3.665 3.492 ( -0.044 -1.190 2.594) 2.854 3.807 ( -2.929 -13.814 8.788) 16.632 4.054 ( -0.095 7.618 -6.010) 9.704 4.532 ( -4.262 6.933 -10.563) 13.334 4.641 ( 4.179 1.184 -0.749) 4.407 5.053 ( -0.928 1.769 -3.373) 3.921 5.254 ( 1.618 3.805 -1.450) 4.382 5.537 ( 0.684 -3.940 7.347) 8.365 5.687 ( 0.021 1.584 3.962) 4.266 5.867 ( 2.860 -3.210 3.498) 5.542 6.053 ( 9.284 3.547 -0.770) 9.968 6.210 ( 4.876 3.149 -0.553) 5.831 6.461 ( 6.666 -7.304 -0.096) 9.889 6.664 ( -0.461 -2.252 -3.866) 4.498 6.973 ( -0.067 8.094 0.203) 8.097 7.012 ( 6.197 -3.079 0.147) 6.921 7.078 ( 7.949 -0.897 -2.486) 8.377 7.312 ( -3.633 -1.722 4.802) 6.263 7.621 ( -1.678 6.340 -1.315) 6.689 7.773 ( 2.938 3.841 1.082) 4.955 7.824 ( -3.852 0.680 -0.692) 3.972 8.028 ( -1.732 -7.088 -1.520) 7.453 8.303 ( -2.390 -4.862 1.665) 5.668 8.336 ( -2.682 -4.847 0.780) 5.594 8.967 ( -0.398 -1.370 0.257) 1.450 9.061 ( -2.513 -3.488 -1.592) 4.584 13.258 ( 0.011 4.702 -0.410) 4.720 13.329 ( -2.057 2.823 -0.242) 3.501 14.754 ( -0.443 0.789 0.693) 1.139 14.811 ( -1.154 0.461 0.346) 1.290 15.151 ( -0.181 -1.432 0.217) 1.459 15.335 ( -3.826 -3.726 -0.241) 5.346 15.638 ( -2.131 4.312 0.050) 4.810 15.771 ( -6.470 -0.014 -0.627) 6.500 ======================= Grid point 322 (168/190) ======================= q-point: ( 0.47 0.33 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.924 ( 6.126 -2.930 4.437) 8.112 2.129 ( -1.089 -8.314 -1.431) 8.507 2.274 ( 0.432 1.920 -1.004) 2.209 2.308 ( -2.882 -1.493 -2.012) 3.819 2.655 ( 2.568 0.372 3.499) 4.356 2.794 ( 0.558 2.913 -2.305) 3.756 3.005 ( 0.961 -6.298 1.584) 6.565 3.097 ( -1.093 -2.379 -4.032) 4.808 3.513 ( 1.907 -0.867 6.391) 6.726 3.746 ( -4.595 -9.301 0.703) 10.398 4.067 ( 2.424 8.824 3.618) 9.840 4.419 ( -4.741 2.520 -13.686) 14.702 4.735 ( 5.133 1.550 2.402) 5.875 4.955 ( -6.230 1.105 -6.178) 8.843 5.330 ( 4.220 5.701 5.601) 9.038 5.485 ( -3.935 0.109 1.850) 4.350 5.769 ( 5.235 -0.546 3.029) 6.072 5.881 ( -1.673 0.499 0.156) 1.753 6.217 ( 5.888 -0.860 1.589) 6.159 6.267 ( 0.834 1.774 -0.386) 1.998 6.581 ( 5.289 -2.776 -0.879) 6.037 6.645 ( -1.082 -3.628 -2.754) 4.682 6.968 ( 0.382 4.081 0.982) 4.214 7.054 ( -1.638 -0.892 -2.577) 3.181 7.234 ( 2.826 -3.319 1.829) 4.727 7.260 ( 1.409 -1.061 -0.139) 1.770 7.617 ( 2.681 2.458 -0.186) 3.643 7.718 ( -6.069 0.024 0.622) 6.101 7.850 ( 3.472 3.186 1.947) 5.099 7.972 ( -3.574 -2.167 -1.842) 4.567 8.278 ( -0.227 -4.435 1.175) 4.593 8.303 ( -0.734 -4.093 -0.348) 4.173 8.970 ( 0.444 -1.953 0.636) 2.102 9.015 ( -1.792 -3.034 -1.406) 3.793 13.266 ( 0.813 4.081 -0.051) 4.162 13.294 ( -1.521 3.309 -0.315) 3.655 14.759 ( 0.686 0.940 1.154) 1.639 14.794 ( -0.716 0.918 -0.096) 1.169 15.161 ( 1.271 -1.902 1.100) 2.538 15.258 ( -3.548 -2.477 -2.209) 4.858 15.631 ( 1.102 1.609 0.229) 1.964 15.672 ( -3.545 0.465 0.111) 3.577 ======================= Grid point 323 (169/190) ======================= q-point: (-0.47 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.005 ( -3.530 -7.468 0.792) 8.298 2.083 ( 1.336 -5.030 -1.913) 5.545 2.240 ( -1.029 0.154 2.599) 2.799 2.314 ( 1.803 0.765 -2.474) 3.155 2.710 ( 1.472 1.813 5.003) 5.521 2.763 ( -2.477 0.648 -5.750) 6.294 3.023 ( -0.088 -3.867 1.785) 4.260 3.069 ( -0.305 -4.662 -3.320) 5.731 3.596 ( 4.920 -0.778 10.014) 11.185 3.645 ( -4.743 -3.934 -4.007) 7.351 4.125 ( 0.398 5.513 8.511) 10.148 4.336 ( 0.198 0.839 -13.515) 13.542 4.789 ( -4.199 1.648 -0.684) 4.562 4.879 ( 3.479 0.065 -1.283) 3.708 5.344 ( -3.987 2.119 5.108) 6.817 5.505 ( 5.903 7.129 -0.383) 9.264 5.807 ( -5.062 2.654 -0.482) 5.736 5.857 ( 2.918 -2.810 1.951) 4.496 6.203 ( -5.447 0.164 1.876) 5.763 6.292 ( -0.383 -1.037 -1.492) 1.857 6.598 ( -3.542 -4.742 -2.468) 6.413 6.644 ( 1.108 -3.127 -2.747) 4.307 6.987 ( -1.316 2.516 0.540) 2.890 7.002 ( 0.085 1.737 0.969) 1.991 7.168 ( -5.232 0.462 3.970) 6.584 7.351 ( 3.261 -5.112 -4.749) 7.702 7.615 ( -3.093 2.695 -0.026) 4.102 7.712 ( 5.224 1.429 1.250) 5.558 7.863 ( -3.431 0.992 1.500) 3.873 7.940 ( 1.877 -0.805 0.302) 2.065 8.293 ( 1.289 -3.999 0.228) 4.208 8.311 ( 1.816 -4.756 -1.310) 5.257 8.972 ( -0.684 -2.059 0.821) 2.320 9.003 ( 1.097 -2.887 -0.728) 3.173 13.269 ( -0.912 3.890 -0.365) 4.012 13.289 ( 1.519 3.440 0.123) 3.762 14.776 ( 0.034 1.071 0.356) 1.129 14.785 ( 0.595 1.128 0.022) 1.276 15.196 ( -2.284 -2.345 -2.207) 3.948 15.210 ( 3.363 -2.426 2.351) 4.767 15.634 ( -0.481 1.656 -0.032) 1.725 15.677 ( 3.552 0.538 -0.261) 3.602 ======================= Grid point 324 (170/190) ======================= q-point: (-0.40 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.878 ( -6.377 -1.307 -4.234) 7.765 2.073 ( -3.504 4.157 1.193) 5.567 2.270 ( 1.458 -8.989 2.080) 9.341 2.346 ( 1.798 2.784 -1.259) 3.545 2.696 ( -1.648 -0.439 -6.279) 6.506 2.725 ( -1.261 -0.662 2.861) 3.196 3.005 ( -1.662 -2.257 -0.098) 2.805 3.081 ( 1.558 -4.600 -0.218) 4.862 3.562 ( -3.081 -1.204 -3.348) 4.706 3.722 ( 5.604 -2.876 11.329) 12.963 4.084 ( -3.914 1.060 0.447) 4.080 4.395 ( 5.630 1.396 -3.022) 6.540 4.672 ( -6.017 1.943 -3.738) 7.345 4.955 ( 0.964 -1.072 4.930) 5.136 5.253 ( -5.198 2.579 0.504) 5.825 5.612 ( 3.248 5.492 1.135) 6.481 5.717 ( -2.711 7.480 1.184) 8.043 5.901 ( 1.297 -5.490 -1.021) 5.733 6.052 ( -10.150 0.322 -0.803) 10.187 6.233 ( -3.485 0.150 -1.972) 4.007 6.484 ( -7.662 -8.913 -2.634) 12.045 6.640 ( -0.237 -3.937 -1.311) 4.156 6.973 ( -0.008 6.784 0.303) 6.790 6.984 ( -2.983 0.926 1.420) 3.431 7.054 ( -7.348 1.304 1.144) 7.550 7.382 ( 1.826 -5.104 -1.554) 5.639 7.612 ( 1.427 7.258 -1.041) 7.470 7.755 ( -1.266 6.214 2.850) 6.952 7.834 ( 1.175 -0.743 -1.760) 2.243 7.986 ( 2.315 -6.847 2.448) 7.631 8.323 ( 1.773 -3.957 -0.371) 4.352 8.366 ( 3.802 -6.586 -1.541) 7.759 8.966 ( 0.253 -1.526 0.579) 1.652 9.036 ( 2.054 -3.188 0.377) 3.811 13.257 ( -0.232 4.497 -0.339) 4.515 13.324 ( 2.036 2.745 0.170) 3.422 14.771 ( 0.174 1.170 -0.862) 1.464 14.810 ( 1.421 0.720 0.515) 1.674 15.164 ( -0.654 -1.914 -1.120) 2.312 15.301 ( 5.377 -3.245 2.918) 6.925 15.650 ( 2.176 3.556 -0.934) 4.273 15.767 ( 5.792 0.438 -0.299) 5.816 ======================= Grid point 325 (171/190) ======================= q-point: (-0.33 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.769 ( -4.152 6.558 -1.980) 8.011 1.983 ( -5.607 6.761 2.156) 9.044 2.240 ( -3.988 -1.726 -3.999) 5.905 2.365 ( -0.252 2.538 -1.910) 3.187 2.646 ( -3.208 -5.938 -4.285) 7.995 2.740 ( 3.158 -4.601 -0.251) 5.586 2.954 ( -3.344 1.644 -0.561) 3.768 3.120 ( 1.949 -3.950 0.544) 4.438 3.510 ( -1.979 0.897 -1.342) 2.554 3.830 ( 2.688 -6.113 9.815) 11.872 4.008 ( -3.715 -5.007 0.575) 6.261 4.501 ( 4.937 1.115 0.182) 5.064 4.543 ( -6.837 2.972 -2.388) 7.828 4.862 ( -10.243 3.004 6.019) 12.255 5.179 ( -3.526 -2.686 2.071) 4.893 5.628 ( 0.530 3.265 -4.410) 5.512 5.713 ( -1.771 8.463 5.467) 10.230 5.817 ( -12.164 -0.396 0.907) 12.205 5.859 ( -4.684 -0.991 -3.286) 5.807 6.249 ( 6.278 -1.189 -6.363) 9.017 6.313 ( -8.920 -13.142 -0.061) 15.883 6.635 ( -0.562 -3.923 -0.405) 3.984 6.893 ( -6.725 -0.180 -2.106) 7.049 6.918 ( -4.449 7.398 0.398) 8.642 6.974 ( -0.556 6.787 0.579) 6.835 7.407 ( 0.133 -0.263 0.005) 0.295 7.629 ( 0.620 10.560 0.499) 10.590 7.751 ( 0.614 1.998 -1.262) 2.441 7.842 ( -0.398 -0.208 1.090) 1.179 8.030 ( 1.457 -9.522 1.579) 9.762 8.361 ( 2.207 -3.287 -0.274) 3.969 8.445 ( 4.504 -9.225 -1.043) 10.319 8.987 ( 1.836 -1.362 0.641) 2.375 9.080 ( 2.268 -3.191 0.799) 3.996 13.259 ( 0.464 5.065 -0.192) 5.090 13.367 ( 2.283 2.059 0.266) 3.086 14.787 ( 1.666 1.198 -0.765) 2.190 14.845 ( 2.273 0.513 0.296) 2.349 15.165 ( 0.795 -1.145 -0.176) 1.406 15.421 ( 6.263 -5.277 1.623) 8.349 15.715 ( 4.712 6.712 -1.159) 8.283 15.901 ( 7.846 0.867 0.313) 7.900 ======================= Grid point 326 (172/190) ======================= q-point: (-0.27 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.703 ( -3.017 11.721 1.939) 12.257 1.874 ( -5.618 9.704 3.088) 11.630 2.128 ( -6.122 6.298 -6.231) 10.769 2.318 ( -3.880 4.377 -7.606) 9.595 2.575 ( -2.820 -11.017 -3.114) 11.791 2.789 ( -0.103 -4.815 -7.005) 8.501 2.900 ( -0.734 2.842 3.949) 4.921 3.143 ( 0.133 -1.824 0.016) 1.829 3.477 ( -1.383 2.871 0.466) 3.221 3.799 ( -7.612 -7.430 4.794) 11.668 3.949 ( -4.194 -11.241 2.004) 12.164 4.369 ( -9.619 -3.329 3.786) 10.860 4.588 ( 2.712 6.200 -2.340) 7.161 4.707 ( -4.782 3.677 8.936) 10.781 5.061 ( -8.724 1.398 2.385) 9.151 5.508 ( -12.877 -5.328 -1.666) 14.035 5.595 ( -9.342 -0.541 -5.284) 10.746 5.692 ( 1.730 0.545 7.020) 7.251 5.874 ( 4.630 5.896 0.820) 7.542 6.132 ( -9.055 -14.905 -0.035) 17.440 6.406 ( 8.884 -1.605 -7.838) 11.956 6.594 ( -3.654 -4.817 -0.627) 6.078 6.782 ( -4.288 5.162 -4.341) 7.992 6.845 ( -2.887 11.717 -0.138) 12.068 6.965 ( 0.087 5.241 0.884) 5.316 7.396 ( -0.574 3.492 0.278) 3.550 7.641 ( 0.324 9.115 0.056) 9.121 7.739 ( -1.898 -3.734 -2.767) 5.020 7.840 ( 0.002 2.904 2.402) 3.768 8.031 ( -1.797 -11.239 0.861) 11.414 8.407 ( 2.491 -2.790 0.090) 3.742 8.540 ( 5.380 -8.776 0.178) 10.295 9.039 ( 3.285 -2.146 0.528) 3.960 9.124 ( 2.039 -2.926 0.680) 3.631 13.274 ( 1.089 5.609 0.157) 5.715 13.414 ( 2.466 1.603 0.903) 3.077 14.838 ( 3.842 1.712 -0.503) 4.236 14.904 ( 3.709 0.796 0.442) 3.819 15.189 ( 1.600 -0.680 -0.181) 1.748 15.536 ( 5.195 -8.170 -2.348) 9.963 15.836 ( 7.844 10.388 0.998) 13.055 16.072 ( 9.491 1.528 1.171) 9.684 ======================= Grid point 327 (173/190) ======================= q-point: (-0.20 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.635 ( -5.010 12.134 5.449) 14.214 1.785 ( -4.473 14.753 4.706) 16.118 1.992 ( -6.615 12.615 -7.130) 15.929 2.192 ( -6.709 5.692 -14.158) 16.669 2.532 ( -1.388 -13.658 -1.556) 13.816 2.697 ( -6.250 1.893 -5.863) 8.777 2.938 ( 2.323 -1.412 1.081) 2.926 3.125 ( -1.683 0.397 0.297) 1.755 3.444 ( -2.756 4.690 0.433) 5.457 3.610 ( -10.786 -10.531 0.633) 15.088 3.750 ( -15.372 -6.382 1.763) 16.737 4.258 ( -5.153 -2.418 9.048) 10.689 4.558 ( -3.690 2.661 -6.812) 8.192 4.685 ( -0.794 -1.233 10.027) 10.134 4.945 ( -1.693 1.864 6.011) 6.518 5.286 ( -9.010 -3.506 1.869) 9.847 5.408 ( -7.562 -7.336 -6.061) 12.155 5.757 ( 1.601 -9.466 7.829) 12.388 5.952 ( -6.671 -6.517 6.846) 11.569 5.977 ( 3.084 1.501 -7.188) 7.964 6.503 ( -3.192 -1.287 0.455) 3.471 6.534 ( 2.544 3.619 -6.471) 7.838 6.696 ( -3.112 6.525 -4.970) 8.772 6.806 ( -0.743 8.738 -4.193) 9.720 7.001 ( 3.358 4.433 1.818) 5.851 7.399 ( 0.875 4.121 -0.769) 4.282 7.635 ( -0.991 8.271 -0.650) 8.355 7.678 ( -3.540 -6.327 -1.996) 7.520 7.834 ( -1.505 0.579 1.501) 2.203 7.965 ( -4.697 -9.471 0.514) 10.584 8.458 ( 2.720 -2.350 1.040) 3.742 8.649 ( 5.354 -5.049 0.916) 7.416 9.111 ( 3.791 -3.619 0.659) 5.282 9.159 ( 1.642 -2.694 -0.481) 3.192 13.303 ( 1.806 6.237 1.167) 6.597 13.468 ( 2.820 1.648 2.145) 3.907 14.937 ( 6.324 2.475 -0.499) 6.809 14.984 ( 4.156 1.540 0.555) 4.466 15.225 ( 2.184 -0.874 -0.611) 2.430 15.609 ( 3.083 -9.171 -6.698) 11.767 16.021 ( 10.428 11.395 3.882) 15.927 16.269 ( 10.325 2.101 1.508) 10.644 ======================= Grid point 328 (174/190) ======================= q-point: (-0.13 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( -6.199 12.058 6.971) 15.245 1.690 ( -6.657 18.410 6.952) 20.775 1.839 ( -8.127 16.261 -6.886) 19.439 2.034 ( -5.790 6.567 -18.458) 20.429 2.503 ( -2.112 -9.153 0.628) 9.415 2.581 ( -3.213 -2.810 -4.212) 5.997 2.960 ( -0.408 2.901 -1.856) 3.468 3.100 ( -0.582 -2.358 2.261) 3.318 3.318 ( -11.224 1.420 -4.173) 12.058 3.413 ( -8.656 -15.346 -2.235) 17.760 3.502 ( -7.724 7.415 5.668) 12.115 4.047 ( -16.232 10.851 2.781) 19.722 4.568 ( 5.465 -8.747 -0.172) 10.315 4.715 ( 2.131 -7.277 11.309) 13.616 4.947 ( -0.433 -5.561 1.331) 5.734 5.199 ( -0.840 -2.944 5.935) 6.678 5.274 ( -5.564 -10.939 -5.909) 13.621 5.714 ( -7.353 -17.327 1.472) 18.880 5.851 ( -1.936 -4.469 7.986) 9.354 6.063 ( 4.500 7.070 -2.819) 8.842 6.423 ( -4.324 7.748 2.184) 9.138 6.510 ( -3.916 13.492 -1.948) 14.183 6.676 ( 1.439 -0.848 -5.801) 6.036 6.810 ( 1.989 -0.598 -7.857) 8.126 7.088 ( 4.745 4.469 2.083) 6.843 7.416 ( 0.745 3.306 -2.675) 4.318 7.597 ( -2.981 2.895 -1.037) 4.283 7.609 ( -2.766 -3.721 -0.934) 4.730 7.772 ( -4.819 -7.863 1.276) 9.310 7.878 ( -3.733 1.099 -0.275) 3.901 8.519 ( 3.212 -0.566 2.683) 4.223 8.738 ( 3.309 -1.730 0.345) 3.750 9.168 ( 1.074 -2.620 3.300) 4.348 9.196 ( 2.960 -4.473 -4.498) 7.000 13.352 ( 2.923 6.896 3.267) 8.171 13.529 ( 2.814 2.151 2.815) 4.524 15.054 ( 3.188 2.827 0.589) 4.301 15.075 ( 7.092 2.228 -0.824) 7.479 15.273 ( 2.857 -1.561 -0.759) 3.343 15.634 ( 0.832 -8.679 -8.949) 12.494 16.241 ( 10.807 9.533 5.841) 15.550 16.469 ( 9.680 2.280 0.139) 9.946 ======================= Grid point 329 (175/190) ======================= q-point: (-0.07 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.429 ( -5.276 13.874 7.280) 16.532 1.557 ( -7.689 18.979 6.193) 21.393 1.674 ( -6.062 15.924 -4.303) 17.574 1.915 ( -3.222 8.699 -19.117) 21.249 2.461 ( -1.730 -3.712 3.997) 5.723 2.572 ( 1.994 -9.122 -4.731) 10.468 2.921 ( -2.933 9.775 0.736) 10.232 3.079 ( -9.431 -12.536 -4.470) 16.311 3.114 ( 0.603 -1.969 2.714) 3.407 3.286 ( -4.123 -9.864 -4.600) 11.638 3.430 ( -0.913 14.707 3.642) 15.178 3.738 ( -14.147 13.442 -0.583) 19.523 4.691 ( 5.134 -4.878 7.373) 10.223 4.805 ( 4.881 -13.386 9.716) 17.246 4.949 ( 1.436 -10.680 -4.019) 11.501 5.162 ( -4.926 -11.835 -6.480) 14.364 5.215 ( 0.633 -10.500 6.317) 12.270 5.552 ( -8.373 -17.281 -1.477) 19.259 5.863 ( 1.142 0.876 10.828) 10.923 6.126 ( 1.964 8.513 -3.592) 9.446 6.358 ( -2.322 10.762 2.956) 11.399 6.428 ( -3.582 14.988 -0.329) 15.414 6.705 ( 2.174 -3.305 -4.542) 6.023 6.828 ( 0.521 -5.422 -8.227) 9.867 7.182 ( 4.492 3.216 2.166) 5.934 7.403 ( -1.765 0.795 -4.237) 4.658 7.541 ( -2.169 -5.241 -0.316) 5.681 7.550 ( -3.172 -1.990 -0.124) 3.747 7.700 ( -1.799 -0.983 2.047) 2.897 7.816 ( -2.630 5.021 -2.102) 6.046 8.589 ( 3.132 1.174 4.553) 5.650 8.772 ( 0.292 0.032 -1.257) 1.291 9.179 ( -0.155 -1.835 2.826) 3.373 9.239 ( 1.876 -4.723 -4.640) 6.881 13.426 ( 3.614 7.121 5.481) 9.686 13.578 ( 1.613 2.972 1.533) 3.713 15.100 ( 1.426 2.409 2.105) 3.503 15.190 ( 4.018 2.215 -2.987) 5.475 15.337 ( 3.881 -2.180 0.686) 4.504 15.608 ( -1.898 -7.654 -9.133) 12.066 16.438 ( 7.500 6.160 7.973) 12.560 16.630 ( 6.795 1.745 -4.129) 8.140 ======================= Grid point 330 (176/190) ======================= q-point: ( 0.00 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.690 ( 0.878 14.081 5.761) 15.239 1.798 ( -0.274 9.339 -3.426) 9.951 1.927 ( -0.599 16.693 4.774) 17.373 2.100 ( -0.344 13.569 -11.787) 17.977 2.198 ( -1.459 -10.498 3.762) 11.247 2.363 ( 0.489 -13.184 -10.666) 16.965 2.587 ( -0.188 -17.412 2.190) 17.551 2.645 ( -0.459 -18.779 -3.507) 19.109 3.319 ( -1.512 10.140 1.143) 10.316 3.346 ( 0.716 6.726 -1.342) 6.895 3.849 ( -0.342 16.567 2.813) 16.807 3.884 ( 1.483 13.731 -0.741) 13.831 4.609 ( -4.471 -8.363 5.123) 10.778 4.679 ( 2.237 -15.473 -2.145) 15.781 4.792 ( 6.541 1.031 8.204) 10.542 4.944 ( 3.895 -12.011 9.466) 15.781 4.961 ( -2.984 0.986 -7.949) 8.547 5.107 ( -4.689 -11.451 -6.725) 14.083 6.072 ( 2.040 8.555 14.551) 17.002 6.214 ( 0.963 -3.252 6.593) 7.414 6.453 ( -2.110 4.066 -3.782) 5.940 6.553 ( -1.684 -2.700 -7.421) 8.075 6.751 ( 1.278 7.605 -2.929) 8.249 6.781 ( -0.059 4.951 -5.955) 7.744 7.186 ( 0.941 -6.731 -0.772) 6.840 7.202 ( -0.595 -7.897 -2.275) 8.240 7.497 ( 0.035 0.826 0.769) 1.129 7.502 ( -0.357 0.567 0.196) 0.698 7.800 ( 0.790 3.470 0.516) 3.596 7.827 ( -1.002 0.880 -2.158) 2.537 8.698 ( 0.658 2.923 4.185) 5.146 8.744 ( -1.375 -1.302 -0.005) 1.894 9.153 ( -0.321 -0.003 0.643) 0.719 9.183 ( 0.629 -2.894 -2.130) 3.648 13.608 ( 1.634 3.832 4.608) 6.211 13.640 ( 0.514 0.652 1.931) 2.102 15.191 ( -0.504 5.204 0.793) 5.288 15.255 ( -0.835 1.770 -5.077) 5.441 15.342 ( 1.667 -3.793 1.021) 4.267 15.380 ( -2.982 -6.588 -3.056) 7.851 16.627 ( 0.604 4.164 3.095) 5.223 16.688 ( 0.497 -1.863 -2.815) 3.412 ======================= Grid point 331 (177/190) ======================= q-point: ( 0.07 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.760 ( 4.513 13.732 4.970) 15.285 1.860 ( 5.136 10.333 -2.889) 11.895 1.989 ( 6.243 14.055 1.669) 15.470 2.099 ( 2.462 13.734 -5.833) 15.123 2.198 ( 1.469 -7.091 2.324) 7.605 2.352 ( 0.451 -12.518 -7.305) 14.500 2.624 ( 3.294 -17.992 2.741) 18.495 2.673 ( 3.517 -20.668 -3.136) 21.198 3.315 ( 0.951 11.173 1.949) 11.381 3.380 ( 3.062 5.129 -0.647) 6.009 3.829 ( 0.064 18.670 0.953) 18.694 4.037 ( 10.799 6.479 -0.435) 12.601 4.502 ( -6.111 -2.484 5.381) 8.513 4.706 ( 2.582 -13.491 0.006) 13.736 4.868 ( -0.301 -2.654 -5.560) 6.169 4.972 ( -1.319 -11.041 -1.737) 11.254 5.015 ( 8.622 1.873 0.295) 8.828 5.150 ( 8.651 -11.291 5.301) 15.180 6.109 ( -0.735 7.452 12.862) 14.883 6.214 ( -1.431 0.657 -0.252) 1.595 6.397 ( -3.566 0.282 1.578) 3.909 6.502 ( -2.540 -5.854 -7.775) 10.059 6.791 ( 2.998 9.219 -3.917) 10.456 6.810 ( 4.377 8.599 -3.302) 10.198 7.175 ( -0.845 -5.678 -2.151) 6.130 7.234 ( 2.855 -9.481 -0.364) 9.908 7.507 ( 1.070 -0.062 0.775) 1.323 7.507 ( 0.811 0.271 0.254) 0.892 7.805 ( -0.282 3.280 -1.137) 3.483 7.831 ( 1.574 0.868 0.361) 1.834 8.679 ( -3.543 1.784 1.993) 4.439 8.707 ( -2.244 -0.759 2.611) 3.525 9.140 ( -1.114 0.670 0.450) 1.375 9.182 ( -0.349 -3.206 -2.053) 3.823 13.612 ( -1.914 3.478 0.808) 4.051 13.635 ( -0.992 1.194 0.447) 1.616 15.166 ( -2.482 4.261 1.780) 5.242 15.224 ( -1.606 3.409 -2.421) 4.480 15.285 ( -5.649 -5.075 -1.632) 7.767 15.346 ( -1.499 -6.133 1.989) 6.619 16.587 ( -5.006 4.147 1.268) 6.623 16.641 ( -4.592 -1.490 -2.814) 5.588 ======================= Grid point 332 (178/190) ======================= q-point: ( 0.13 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.854 ( 4.295 10.462 2.228) 11.527 1.924 ( 1.819 6.111 -2.163) 6.733 2.113 ( 5.274 13.585 0.106) 14.574 2.160 ( 2.659 6.438 -0.226) 6.969 2.311 ( 9.656 4.800 -3.142) 11.232 2.384 ( 4.100 -4.496 0.395) 6.097 2.717 ( 5.313 -20.140 4.594) 21.329 2.749 ( 4.363 -21.700 -3.744) 22.449 3.375 ( 5.159 10.384 2.004) 11.767 3.466 ( 5.723 2.168 -0.152) 6.121 3.834 ( -0.006 16.819 0.600) 16.830 4.183 ( 0.480 -14.188 0.564) 14.207 4.511 ( 10.046 16.914 1.939) 19.768 4.793 ( 4.060 -2.299 -3.197) 5.656 4.888 ( 6.584 -7.358 -4.865) 11.007 4.966 ( 1.641 -11.979 0.037) 12.091 5.188 ( 7.935 2.278 -1.042) 8.321 5.342 ( 9.050 -11.533 6.468) 16.024 6.081 ( -4.078 7.392 6.385) 10.584 6.170 ( -1.971 3.080 -6.014) 7.038 6.323 ( -4.825 -3.207 8.683) 10.439 6.427 ( -3.392 -8.716 -6.152) 11.194 6.854 ( 3.721 11.532 -3.435) 12.595 6.922 ( 6.920 10.690 -1.587) 12.833 7.142 ( -2.246 -1.976 -2.317) 3.784 7.293 ( 2.766 -10.375 1.082) 10.792 7.532 ( 1.922 -0.715 -0.253) 2.067 7.552 ( 3.503 -3.402 0.343) 4.895 7.805 ( 0.546 4.906 -0.584) 4.971 7.869 ( 2.091 -1.053 1.328) 2.691 8.589 ( -5.475 2.541 0.592) 6.065 8.648 ( -4.605 -2.710 3.570) 6.426 9.112 ( -1.751 1.303 0.226) 2.194 9.163 ( -1.152 -3.450 -1.812) 4.064 13.551 ( -3.794 4.490 -2.229) 6.287 13.597 ( -2.906 0.067 -0.980) 3.068 15.095 ( -5.019 3.339 1.359) 6.180 15.139 ( -6.716 2.621 -0.088) 7.210 15.213 ( -1.300 -1.817 -0.235) 2.247 15.313 ( -1.969 -7.755 4.000) 8.945 16.448 ( -8.972 5.022 -0.903) 10.321 16.508 ( -8.406 -1.282 -2.146) 8.770 ======================= Grid point 333 (179/190) ======================= q-point: ( 0.20 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.930 ( 2.768 5.739 -4.208) 7.636 1.949 ( 1.792 4.468 3.743) 6.098 2.174 ( 1.366 8.203 -1.798) 8.508 2.218 ( 3.423 2.830 1.651) 4.738 2.462 ( 6.576 9.297 -8.115) 13.984 2.511 ( 6.530 6.065 9.415) 12.964 2.802 ( 2.089 -18.875 -2.390) 19.140 2.841 ( 5.265 -18.795 4.532) 20.037 3.507 ( 6.181 4.817 0.541) 7.854 3.575 ( 4.500 -0.307 0.808) 4.582 3.854 ( 3.194 12.664 0.651) 13.076 4.168 ( 1.895 -15.018 -0.657) 15.152 4.741 ( 6.721 13.798 -0.901) 15.374 4.885 ( 9.589 5.291 -7.265) 13.143 5.003 ( 6.371 -4.434 1.801) 7.968 5.154 ( 15.267 -12.630 -0.063) 19.814 5.300 ( 4.196 6.537 -3.782) 8.640 5.509 ( 6.938 -12.137 5.789) 15.131 5.986 ( -5.380 7.465 0.548) 9.218 6.127 ( -1.673 -1.366 -5.022) 5.467 6.240 ( -4.834 -0.819 9.818) 10.974 6.376 ( -0.682 -9.773 -2.089) 10.017 6.908 ( 2.229 10.659 -3.056) 11.311 7.048 ( 4.370 3.826 -2.022) 6.150 7.088 ( -1.420 8.769 -0.930) 8.932 7.336 ( 1.328 -7.865 1.850) 8.188 7.584 ( 3.455 -1.170 -0.581) 3.694 7.640 ( 5.118 -7.018 0.117) 8.686 7.822 ( 1.019 5.736 0.406) 5.840 7.910 ( 1.594 -2.240 1.828) 3.302 8.477 ( -5.854 1.856 0.010) 6.141 8.541 ( -6.710 -3.757 2.468) 8.076 9.074 ( -2.103 1.786 0.026) 2.759 9.132 ( -1.769 -3.624 -1.532) 4.313 13.471 ( -3.740 4.774 -2.700) 6.639 13.527 ( -3.714 -0.677 -1.898) 4.225 14.982 ( -6.162 2.868 0.434) 6.810 15.015 ( -5.841 0.475 0.158) 5.862 15.193 ( -1.014 0.740 1.431) 1.903 15.290 ( -1.255 -7.681 5.357) 9.449 16.251 ( -10.612 5.710 -1.958) 12.209 16.318 ( -10.351 -1.275 -2.027) 10.624 ======================= Grid point 334 (180/190) ======================= q-point: ( 0.27 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.938 ( -0.551 6.668 -0.653) 6.723 2.016 ( 3.433 -0.249 1.591) 3.792 2.185 ( 0.581 7.578 -3.127) 8.218 2.280 ( 2.466 -1.757 0.445) 3.060 2.560 ( 4.686 8.500 -3.797) 10.422 2.639 ( 5.218 9.357 7.860) 13.288 2.815 ( 0.136 -14.508 -1.843) 14.625 2.935 ( 3.439 -14.905 4.264) 15.879 3.543 ( -1.170 2.367 -0.030) 2.640 3.626 ( -0.382 -6.660 3.051) 7.336 3.991 ( 9.916 12.778 -1.049) 16.208 4.286 ( 8.600 -14.349 -3.566) 17.105 4.827 ( 4.723 12.112 -1.079) 13.045 4.986 ( 2.935 -1.843 -7.559) 8.315 5.220 ( 9.646 5.890 -0.259) 11.305 5.291 ( 1.562 -1.538 -5.097) 5.548 5.494 ( 13.282 -1.138 3.318) 13.737 5.644 ( 5.997 -10.298 8.063) 14.389 5.910 ( -1.087 7.443 -0.893) 7.575 6.087 ( -1.333 -9.009 1.082) 9.171 6.205 ( 0.477 7.111 2.606) 7.588 6.398 ( 3.165 -11.181 -0.449) 11.629 6.928 ( 0.383 7.523 -3.068) 8.133 7.012 ( -2.270 -0.296 -2.707) 3.546 7.155 ( 3.235 13.133 0.502) 13.535 7.350 ( -0.312 -5.129 2.160) 5.574 7.661 ( 4.392 -0.116 -0.166) 4.397 7.738 ( 4.587 -6.561 -0.019) 8.006 7.839 ( 0.505 4.730 1.005) 4.861 7.927 ( -0.393 -2.335 1.690) 2.909 8.371 ( -4.716 -0.535 -0.314) 4.756 8.407 ( -6.887 -3.405 1.032) 7.752 9.032 ( -2.107 1.947 -0.169) 2.874 9.090 ( -2.189 -3.587 -1.333) 4.408 13.403 ( -2.709 4.286 -1.966) 5.438 13.455 ( -3.222 -0.737 -1.640) 3.689 14.876 ( -4.547 2.533 0.117) 5.206 14.913 ( -4.504 -0.623 0.079) 4.547 15.177 ( -0.936 1.892 1.834) 2.796 15.277 ( -1.150 -7.346 4.718) 8.806 16.041 ( -10.236 5.749 -2.065) 11.920 16.110 ( -10.372 -1.351 -1.869) 10.625 ======================= Grid point 335 (181/190) ======================= q-point: ( 0.33 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.914 ( -1.626 7.782 -0.050) 7.950 2.062 ( 0.203 -6.212 2.825) 6.827 2.202 ( 2.224 7.556 -4.130) 8.894 2.317 ( 1.561 -3.667 -0.611) 4.032 2.623 ( 1.994 5.895 0.609) 6.253 2.750 ( 5.367 9.057 1.417) 10.623 2.817 ( 0.340 -10.243 1.743) 10.396 2.993 ( 2.228 -11.193 0.977) 11.455 3.511 ( -1.708 1.969 1.784) 3.159 3.601 ( -2.009 -8.048 5.229) 9.806 4.161 ( 6.850 11.252 -4.107) 13.798 4.415 ( 4.662 -12.589 -4.781) 14.251 4.889 ( -0.285 12.960 -7.764) 15.110 5.023 ( 3.193 -0.461 -6.281) 7.061 5.279 ( 1.804 3.109 -4.212) 5.538 5.376 ( 4.344 -6.275 7.788) 10.904 5.673 ( 3.311 -0.231 8.214) 8.859 5.728 ( 1.705 -2.836 9.889) 10.428 5.985 ( 7.250 5.480 -2.846) 9.523 6.135 ( 6.550 -9.273 -2.976) 11.737 6.265 ( 5.918 10.415 -0.106) 11.980 6.493 ( 6.074 -11.478 -0.928) 13.020 6.926 ( 0.697 4.962 -2.073) 5.423 6.992 ( 0.720 -1.246 -2.640) 3.007 7.183 ( -0.464 10.354 0.833) 10.397 7.326 ( -2.659 -4.002 2.458) 5.397 7.743 ( 2.960 1.028 0.240) 3.142 7.789 ( 0.291 2.671 0.284) 2.702 7.862 ( 2.546 -3.254 0.567) 4.170 7.897 ( -2.670 -1.643 0.978) 3.284 8.289 ( -4.487 -2.452 0.560) 5.144 8.300 ( -3.272 -2.699 -0.402) 4.261 8.994 ( -1.719 1.681 -0.328) 2.427 9.044 ( -2.251 -3.184 -1.194) 4.079 13.359 ( -1.605 3.550 -1.111) 4.051 13.399 ( -2.282 -0.372 -0.973) 2.509 14.809 ( -2.367 2.144 0.403) 3.219 14.844 ( -2.547 -0.886 0.295) 2.713 15.162 ( -0.973 2.190 1.102) 2.637 15.257 ( -1.543 -6.853 2.560) 7.477 15.856 ( -8.165 5.092 -1.387) 9.722 15.918 ( -8.815 -1.267 -1.284) 8.997 ======================= Grid point 336 (182/190) ======================= q-point: ( 0.40 0.44 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.886 ( -0.956 5.528 0.270) 5.616 2.031 ( -3.199 -8.227 1.042) 8.888 2.256 ( 3.401 5.131 -2.126) 6.513 2.342 ( 0.862 -2.555 0.326) 2.716 2.654 ( 1.523 5.718 1.120) 6.022 2.821 ( 0.687 -9.604 1.910) 9.817 2.853 ( 3.632 7.753 -1.051) 8.626 3.024 ( 0.953 -7.748 -2.869) 8.317 3.493 ( -0.547 1.695 4.497) 4.837 3.581 ( -1.014 -7.789 6.859) 10.428 4.238 ( 2.317 10.739 -5.085) 12.106 4.453 ( 0.275 -9.723 -5.937) 11.396 4.827 ( -2.549 11.782 -8.174) 14.565 5.015 ( -3.115 -6.058 -8.574) 10.950 5.339 ( 3.171 4.908 5.290) 7.882 5.447 ( 0.281 -5.450 10.804) 12.104 5.724 ( 3.404 3.614 6.630) 8.283 5.810 ( 5.403 -3.865 4.511) 8.030 6.116 ( 6.199 4.933 -1.764) 8.116 6.236 ( 3.718 -5.522 -3.098) 7.342 6.432 ( 9.187 6.951 -2.034) 11.699 6.581 ( 2.258 -6.292 -4.132) 7.859 6.982 ( 4.871 0.907 0.448) 4.975 7.031 ( 3.941 -2.892 -1.590) 5.141 7.152 ( -2.291 7.541 0.880) 7.930 7.261 ( -3.951 -3.532 1.989) 5.660 7.715 ( -3.852 3.665 -0.081) 5.318 7.786 ( -3.586 -2.354 1.117) 4.433 7.876 ( 2.044 2.583 0.891) 3.412 7.920 ( 2.744 -2.677 -0.222) 3.840 8.223 ( -2.228 -1.665 0.336) 2.802 8.250 ( -2.051 -3.611 -0.257) 4.161 8.966 ( -1.007 1.034 -0.328) 1.480 9.001 ( -1.852 -2.411 -1.012) 3.204 13.335 ( -0.700 2.797 -0.546) 2.934 13.361 ( -1.472 0.224 -0.511) 1.574 14.784 ( -0.476 1.936 0.992) 2.227 14.814 ( -0.746 -0.659 0.739) 1.240 15.143 ( -0.967 1.575 -0.011) 1.849 15.223 ( -2.185 -5.897 -0.099) 6.290 15.727 ( -4.735 3.686 -0.332) 6.010 15.771 ( -6.000 -0.727 -0.404) 6.057 ======================= Grid point 337 (183/190) ======================= q-point: ( 0.47 0.44 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.888 ( 1.258 0.580 0.978) 1.696 1.964 ( -3.228 -6.823 -0.706) 7.581 2.312 ( 2.362 3.014 -0.189) 3.834 2.343 ( -0.985 0.616 0.789) 1.405 2.698 ( 2.726 4.530 2.208) 5.730 2.822 ( -0.575 -5.343 -0.786) 5.431 2.906 ( 1.938 2.536 -1.482) 3.519 3.014 ( -1.323 -5.758 -5.145) 7.834 3.510 ( 1.367 1.141 6.799) 7.028 3.580 ( -0.521 -6.159 5.800) 8.476 4.259 ( 1.103 9.566 -2.493) 9.947 4.411 ( -2.840 -4.489 -8.674) 10.172 4.797 ( 0.340 5.418 -2.011) 5.790 4.917 ( -4.930 -4.976 -6.584) 9.613 5.391 ( 1.045 2.285 7.878) 8.268 5.448 ( 0.478 -2.968 4.104) 5.087 5.830 ( 4.802 5.216 4.826) 8.576 5.905 ( 2.269 -0.955 2.004) 3.174 6.215 ( 3.804 2.399 0.722) 4.555 6.279 ( 1.043 -2.140 -2.203) 3.243 6.545 ( 2.127 -0.290 -4.379) 4.876 6.573 ( -1.174 -2.819 -4.553) 5.482 7.044 ( 1.357 3.449 1.763) 4.104 7.112 ( -0.721 6.205 -1.074) 6.339 7.140 ( 3.565 -5.524 2.952) 7.207 7.218 ( 0.312 -3.615 -1.143) 3.804 7.653 ( -1.273 1.647 0.222) 2.094 7.693 ( -4.672 -2.164 0.531) 5.176 7.918 ( 1.025 3.235 2.418) 4.166 7.958 ( 0.929 -0.392 -0.484) 1.118 8.201 ( -0.101 -2.135 -0.151) 2.143 8.220 ( -0.835 -3.475 -0.783) 3.659 8.954 ( -0.230 0.186 -0.029) 0.297 8.971 ( -1.069 -1.460 -0.776) 1.969 13.328 ( 0.062 1.990 -0.241) 2.005 13.339 ( -0.803 0.985 -0.332) 1.314 14.789 ( 0.667 1.794 1.373) 2.355 14.810 ( 0.005 0.080 0.605) 0.611 15.130 ( -0.190 -0.147 -0.104) 0.261 15.176 ( -2.295 -4.348 -1.645) 5.184 15.673 ( -0.841 1.855 0.149) 2.042 15.688 ( -2.409 0.375 0.119) 2.441 ======================= Grid point 338 (184/190) ======================= q-point: (-0.47 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.907 ( -1.104 -1.613 -0.292) 1.976 1.948 ( 3.403 -5.461 0.225) 6.438 2.305 ( -2.976 3.787 0.474) 4.840 2.343 ( 0.655 0.284 0.821) 1.087 2.757 ( 1.941 3.401 3.201) 5.058 2.799 ( -0.619 1.731 -5.724) 6.012 2.925 ( -0.433 -3.868 1.638) 4.223 2.965 ( -1.770 -5.415 -5.075) 7.630 3.563 ( 2.430 -1.319 6.750) 7.294 3.573 ( -0.814 -2.454 2.547) 3.629 4.265 ( -1.620 7.067 0.462) 7.265 4.349 ( -0.399 -0.844 -7.456) 7.515 4.799 ( -2.910 0.212 -0.347) 2.938 4.834 ( -0.181 -3.373 -0.234) 3.386 5.413 ( 0.801 5.244 4.494) 6.953 5.521 ( 5.831 -4.225 -1.295) 7.316 5.879 ( -1.209 2.759 4.137) 5.118 5.885 ( -3.744 2.738 0.280) 4.647 6.231 ( -3.427 2.581 -0.277) 4.299 6.272 ( -0.936 -1.071 -2.012) 2.464 6.514 ( -3.414 -2.437 -1.444) 4.436 6.546 ( -1.188 -5.009 -2.632) 5.782 7.066 ( -1.706 4.777 0.669) 5.116 7.092 ( 0.607 6.441 -0.119) 6.471 7.152 ( -2.321 -2.508 1.742) 3.835 7.230 ( 0.912 -6.750 -2.228) 7.166 7.653 ( 1.143 1.642 0.237) 2.014 7.693 ( 4.670 -2.265 0.622) 5.228 7.914 ( -1.828 3.211 3.054) 4.794 7.948 ( -1.806 0.240 -0.028) 1.823 8.214 ( 1.196 -2.673 -0.816) 3.040 8.223 ( 1.442 -3.265 -1.403) 3.835 8.952 ( -0.095 -0.072 0.265) 0.291 8.963 ( 0.552 -1.176 -0.276) 1.328 13.329 ( -0.165 1.842 -0.253) 1.866 13.336 ( 0.727 1.107 -0.115) 1.329 14.805 ( 0.297 1.394 0.563) 1.533 14.811 ( 0.311 0.952 0.003) 1.001 15.138 ( -0.801 -2.142 -0.861) 2.444 15.145 ( 1.592 -2.740 0.964) 3.312 15.677 ( 1.165 1.843 -0.136) 2.184 15.692 ( 2.618 0.330 -0.183) 2.645 ======================= Grid point 339 (185/190) ======================= q-point: (-0.40 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.901 ( 0.786 4.127 -1.076) 4.337 2.034 ( 4.837 -8.419 0.471) 9.721 2.233 ( -4.329 5.836 0.162) 7.268 2.340 ( -1.063 -3.728 0.588) 3.921 2.736 ( -2.448 5.737 -4.509) 7.697 2.806 ( -0.686 7.192 0.765) 7.265 2.887 ( -1.111 -8.040 -2.507) 8.494 2.967 ( 1.335 -7.685 0.577) 7.822 3.556 ( -0.932 1.126 0.002) 1.462 3.620 ( 1.997 -5.233 4.483) 7.175 4.192 ( -4.911 8.830 -0.543) 10.119 4.364 ( 0.667 -6.234 -0.034) 6.270 4.732 ( -2.367 5.230 0.749) 5.789 4.861 ( 1.057 -6.788 5.680) 8.914 5.407 ( -3.787 11.075 -0.192) 11.706 5.610 ( 1.327 -6.986 -4.652) 8.498 5.824 ( -1.894 2.019 0.875) 2.903 5.833 ( 0.213 -0.153 0.443) 0.515 6.099 ( -9.284 4.967 -1.137) 10.590 6.218 ( -4.642 -5.226 -2.265) 7.348 6.404 ( -7.387 3.682 0.399) 8.263 6.527 ( -1.154 -6.679 0.814) 6.827 6.988 ( -4.282 1.180 -0.427) 4.462 7.027 ( -6.129 -1.972 -0.701) 6.477 7.164 ( 2.778 7.943 -0.360) 8.423 7.288 ( 4.393 -4.726 -0.522) 6.474 7.713 ( 3.789 3.844 0.047) 5.398 7.794 ( 4.435 -3.934 0.460) 5.946 7.866 ( -2.886 3.776 2.010) 5.160 7.900 ( -2.816 -1.086 1.136) 3.224 8.243 ( 2.101 -2.581 -1.135) 3.517 8.259 ( 2.135 -3.717 -1.134) 4.434 8.959 ( 0.809 0.615 0.378) 1.084 8.985 ( 1.525 -1.925 0.371) 2.484 13.331 ( 0.448 2.657 -0.176) 2.700 13.356 ( 1.256 0.241 -0.021) 1.279 14.804 ( 0.222 1.793 -0.841) 1.992 14.824 ( 0.837 0.128 -0.109) 0.854 15.139 ( 0.993 0.495 0.252) 1.138 15.201 ( 3.470 -5.222 1.971) 6.572 15.730 ( 4.362 3.490 -0.577) 5.616 15.772 ( 5.578 -0.633 -0.463) 5.633 ======================= Grid point 340 (186/190) ======================= q-point: (-0.33 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.927 ( 1.754 9.295 -1.213) 9.536 2.120 ( 3.282 -9.090 -1.639) 9.802 2.144 ( -4.286 8.565 0.845) 9.615 2.310 ( -1.702 -7.370 -0.276) 7.568 2.662 ( -4.859 7.072 -1.864) 8.780 2.767 ( -1.818 3.591 -1.758) 4.392 2.882 ( -0.151 -4.200 -2.900) 5.106 3.004 ( 2.163 -8.882 -0.939) 9.190 3.539 ( -0.678 3.037 -0.250) 3.121 3.653 ( 0.935 -8.520 1.666) 8.732 4.076 ( -7.482 10.400 3.088) 13.179 4.328 ( -5.104 -12.819 2.774) 14.074 4.726 ( 1.141 9.496 4.934) 10.762 4.872 ( -1.707 -4.094 7.029) 8.311 5.271 ( -7.548 11.345 -0.989) 13.663 5.521 ( -7.400 -11.467 -4.507) 14.373 5.813 ( -8.424 5.181 -5.403) 11.269 5.869 ( 2.067 1.498 -3.661) 4.463 5.929 ( -3.553 4.509 3.655) 6.806 6.057 ( -9.782 -10.421 2.470) 14.504 6.305 ( -0.585 6.605 -3.244) 7.381 6.485 ( -3.124 -9.753 -0.391) 10.249 6.919 ( -1.878 2.554 -1.389) 3.461 6.959 ( -0.872 -0.764 0.325) 1.204 7.199 ( 0.423 11.093 -0.629) 11.118 7.359 ( 2.411 -4.778 -0.536) 5.378 7.745 ( -2.536 0.752 -0.012) 2.645 7.789 ( -1.717 1.072 0.496) 2.084 7.858 ( -0.958 0.295 0.816) 1.292 7.897 ( 3.387 -1.190 1.060) 3.743 8.295 ( 2.971 -2.534 0.036) 3.905 8.303 ( 3.402 -4.138 -0.759) 5.410 8.985 ( 1.793 1.031 0.477) 2.123 9.022 ( 2.114 -2.487 0.656) 3.330 13.345 ( 1.030 3.338 0.082) 3.494 13.384 ( 1.649 -0.491 0.274) 1.742 14.822 ( 1.935 2.027 -0.749) 2.900 14.851 ( 2.190 -0.466 -0.272) 2.255 15.171 ( 2.026 2.651 0.360) 3.356 15.277 ( 3.903 -7.408 0.891) 8.421 15.843 ( 7.204 5.132 -0.283) 8.850 15.905 ( 8.088 -1.131 -0.150) 8.168 ======================= Grid point 341 (187/190) ======================= q-point: (-0.27 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.939 ( -1.319 11.480 -0.793) 11.583 2.066 ( -2.210 6.754 -1.519) 7.267 2.164 ( 0.699 -2.303 -1.632) 2.907 2.287 ( -0.441 -8.440 -0.802) 8.490 2.543 ( -6.862 9.604 -1.220) 11.866 2.738 ( -1.477 -4.100 -0.544) 4.392 2.853 ( -2.193 -0.157 -6.600) 6.957 3.027 ( 0.093 -10.677 -4.210) 11.478 3.529 ( -0.566 3.959 1.208) 4.178 3.660 ( -0.844 -8.683 0.238) 8.727 3.911 ( -9.620 10.537 5.827) 15.412 4.183 ( -9.313 -13.758 5.753) 17.582 4.765 ( 0.735 7.884 6.499) 10.244 4.815 ( -4.276 4.231 4.568) 7.553 5.169 ( -3.283 7.871 1.771) 8.711 5.351 ( -10.755 -8.535 -5.075) 14.638 5.538 ( -13.765 -0.354 -1.295) 13.830 5.672 ( -15.374 -8.127 0.937) 17.415 5.959 ( -0.072 3.217 -1.393) 3.506 5.998 ( 1.135 1.637 5.585) 5.930 6.365 ( 6.366 -0.954 -8.181) 10.410 6.432 ( -0.972 -7.803 -3.885) 8.770 6.908 ( 0.069 5.988 -1.480) 6.169 6.974 ( 2.195 0.031 0.643) 2.287 7.171 ( -3.158 13.442 -0.916) 13.839 7.377 ( -0.205 -5.808 -0.321) 5.820 7.661 ( -4.753 -0.651 -0.116) 4.799 7.733 ( -4.181 -6.034 0.427) 7.353 7.857 ( -0.176 5.886 -0.586) 5.918 7.945 ( 1.158 -1.240 0.172) 1.705 8.357 ( 3.907 -0.611 0.916) 4.059 8.407 ( 6.666 -4.869 1.155) 8.335 9.028 ( 2.400 0.913 0.335) 2.589 9.066 ( 2.209 -2.652 0.621) 3.507 13.372 ( 1.644 3.927 0.776) 4.328 13.422 ( 2.143 -1.000 1.194) 2.650 14.882 ( 4.408 2.360 -0.412) 5.017 14.914 ( 4.370 -0.426 -0.024) 4.391 15.211 ( 2.003 3.876 -0.872) 4.449 15.348 ( 3.323 -9.215 -1.591) 9.924 16.006 ( 9.399 6.337 0.833) 11.366 16.082 ( 9.890 -1.298 0.546) 9.990 ======================= Grid point 342 (188/190) ======================= q-point: (-0.20 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.873 ( -4.532 11.990 1.231) 12.877 2.043 ( -0.690 3.888 -4.172) 5.744 2.156 ( -1.149 3.859 0.212) 4.032 2.282 ( -0.050 -4.939 -3.663) 6.149 2.396 ( -7.755 12.264 -1.936) 14.639 2.674 ( -6.205 -6.290 -2.957) 9.317 2.777 ( -3.727 -5.344 -4.840) 8.116 2.974 ( -4.840 -14.560 -6.741) 16.759 3.495 ( -4.158 5.087 1.499) 6.739 3.594 ( -5.649 -2.028 -0.953) 6.077 3.778 ( -3.974 11.592 7.152) 14.189 4.068 ( -1.928 -13.989 8.342) 16.401 4.727 ( -6.824 7.672 5.767) 11.777 4.754 ( -2.317 7.298 0.622) 7.682 5.034 ( -14.340 3.421 0.288) 14.745 5.144 ( -5.129 -5.192 0.432) 7.312 5.281 ( -11.314 -3.324 -3.119) 12.198 5.484 ( -5.447 -15.936 5.574) 17.739 5.918 ( -2.302 6.600 5.687) 9.011 6.041 ( 1.621 -2.273 3.062) 4.144 6.439 ( 2.581 -1.414 -5.849) 6.548 6.482 ( 6.098 -4.377 -10.691) 13.063 6.891 ( -1.783 9.818 -1.909) 10.159 7.024 ( 0.626 -2.461 -0.356) 2.564 7.089 ( -3.021 15.529 -0.836) 15.842 7.360 ( -1.387 -9.274 -0.497) 9.390 7.575 ( -3.910 -0.977 0.349) 4.046 7.642 ( -4.835 -7.132 -0.050) 8.617 7.839 ( -1.386 7.142 -1.118) 7.360 7.942 ( -1.249 -1.925 -1.042) 2.520 8.453 ( 5.435 2.927 2.223) 6.562 8.550 ( 7.217 -5.473 1.852) 9.245 9.077 ( 2.524 0.197 0.026) 2.532 9.107 ( 1.854 -2.403 0.271) 3.047 13.414 ( 2.437 4.572 2.189) 5.624 13.474 ( 2.847 -1.311 2.754) 4.172 14.990 ( 6.561 2.496 -0.316) 7.027 15.016 ( 5.845 0.527 0.044) 5.869 15.243 ( 1.486 4.076 -2.512) 5.013 15.398 ( 2.230 -10.489 -4.214) 11.521 16.203 ( 10.288 6.754 2.090) 12.483 16.284 ( 10.489 -1.362 0.949) 10.620 ======================= Grid point 343 (189/190) ======================= q-point: (-0.13 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.787 ( -4.545 13.399 3.256) 14.519 2.004 ( -2.833 -0.878 -3.985) 4.967 2.104 ( -5.512 15.630 3.619) 16.964 2.227 ( -5.004 10.547 -9.721) 15.191 2.288 ( -1.585 -0.894 -2.451) 3.053 2.490 ( -9.567 -7.953 -5.783) 13.719 2.705 ( -3.626 -14.993 -0.790) 15.445 2.831 ( -7.542 -18.324 -6.016) 20.709 3.403 ( -3.994 7.748 -0.691) 8.744 3.469 ( -6.173 3.216 -0.628) 6.989 3.774 ( 1.085 17.352 5.836) 18.340 4.096 ( -0.034 -11.178 8.164) 13.842 4.546 ( -8.070 10.393 -0.440) 13.166 4.721 ( -1.504 4.820 2.960) 5.853 4.802 ( -9.080 -7.302 3.765) 12.245 5.007 ( -6.491 -15.539 -1.825) 16.939 5.160 ( -4.121 4.144 0.580) 5.873 5.382 ( -6.417 -15.488 1.126) 16.803 5.921 ( 1.257 8.975 10.716) 14.035 6.089 ( 2.630 -5.249 6.542) 8.790 6.481 ( 2.351 2.303 -7.234) 7.947 6.561 ( 3.761 -4.671 -10.194) 11.827 6.831 ( -3.700 11.724 -1.810) 12.426 6.929 ( -6.277 6.804 -2.910) 9.704 7.121 ( 2.821 1.633 -0.279) 3.271 7.314 ( -3.242 -12.546 -1.205) 13.014 7.520 ( -1.773 0.247 0.952) 2.028 7.561 ( -3.166 -4.051 -0.329) 5.152 7.809 ( -1.284 6.729 -0.907) 6.910 7.903 ( -2.192 -1.916 -1.788) 3.417 8.564 ( 5.105 4.998 2.959) 7.733 8.675 ( 5.050 -4.968 1.399) 7.221 9.123 ( 2.072 -0.823 0.024) 2.230 9.138 ( 1.406 -1.930 -0.564) 2.453 13.475 ( 3.249 5.051 4.069) 7.254 13.540 ( 3.205 -1.300 4.090) 5.357 15.115 ( 5.253 2.771 -0.525) 5.962 15.138 ( 6.919 2.113 -0.029) 7.234 15.261 ( 1.000 2.823 -3.822) 4.855 15.421 ( 1.017 -11.037 -5.670) 12.450 16.401 ( 9.202 6.310 2.972) 11.547 16.481 ( 9.240 -1.585 0.386) 9.383 ======================= Grid point 344 (190/190) ======================= q-point: (-0.07 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 3.09e-04 Number of triplets: 338 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.712 ( -3.550 14.272 4.920) 15.509 1.895 ( -7.466 3.147 -2.707) 8.542 1.981 ( -5.514 20.381 4.618) 21.613 2.143 ( -1.898 12.380 -12.795) 17.904 2.240 ( -3.158 -6.535 0.831) 7.306 2.374 ( -0.888 -13.110 -8.927) 15.886 2.628 ( -3.821 -17.705 0.341) 18.116 2.701 ( -4.448 -18.419 -4.122) 19.392 3.351 ( -1.356 8.301 -1.151) 8.490 3.372 ( -3.603 7.134 -0.446) 8.005 3.805 ( 1.332 19.505 3.131) 19.799 4.001 ( -8.755 5.996 3.160) 11.072 4.549 ( 6.597 -5.283 1.233) 8.541 4.683 ( -2.850 -10.687 1.025) 11.108 4.723 ( -0.206 1.365 8.618) 8.728 4.919 ( -2.590 -14.548 3.483) 15.182 5.063 ( -5.381 2.379 -3.933) 7.077 5.242 ( -7.295 -13.561 -3.518) 15.795 5.991 ( 3.228 9.442 13.936) 17.140 6.160 ( 2.944 -5.319 8.345) 10.325 6.490 ( -0.381 4.521 -6.382) 7.831 6.586 ( 0.290 -3.509 -8.589) 9.283 6.763 ( -2.220 10.029 -2.072) 10.479 6.823 ( -3.444 4.744 -4.921) 7.654 7.162 ( 1.559 -3.152 -1.000) 3.656 7.245 ( -3.081 -10.692 -1.541) 11.234 7.501 ( -0.583 0.684 0.861) 1.245 7.518 ( -1.315 -0.856 -0.265) 1.591 7.793 ( -0.201 5.390 -0.204) 5.397 7.859 ( -1.836 -0.852 -2.070) 2.895 8.652 ( 3.262 4.786 3.496) 6.765 8.743 ( 1.650 -3.383 0.535) 3.802 9.149 ( 0.558 -0.712 0.825) 1.224 9.165 ( 1.509 -2.328 -2.001) 3.421 13.549 ( 3.244 4.821 5.243) 7.827 13.605 ( 2.449 -0.649 3.994) 4.730 15.181 ( 1.727 5.201 -0.448) 5.499 15.260 ( 3.248 5.174 -2.510) 6.605 15.275 ( 2.766 -3.768 -2.115) 5.130 15.418 ( -0.414 -9.938 -4.983) 11.125 16.557 ( 5.825 5.210 3.403) 8.523 16.630 ( 5.697 -1.908 -1.226) 6.132 =================== 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 3/28350 10.0 384.370 399.916 311.507 0.000 17.681 0.000 3/28350 20.0 107.838 132.785 85.595 0.000 4.869 0.000 3/28350 30.0 46.003 60.390 34.742 0.000 2.843 0.000 3/28350 40.0 25.413 34.468 18.993 0.000 1.757 0.000 3/28350 50.0 16.244 22.430 12.160 0.000 1.181 0.000 3/28350 60.0 11.459 16.008 8.609 0.000 0.855 0.000 3/28350 70.0 8.676 12.224 6.539 0.000 0.656 0.000 3/28350 80.0 6.919 9.812 5.226 0.000 0.527 0.000 3/28350 90.0 5.734 8.174 4.337 0.000 0.438 0.000 3/28350 100.0 4.892 7.002 3.704 0.000 0.374 0.000 3/28350 110.0 4.268 6.128 3.232 0.000 0.327 0.000 3/28350 120.0 3.789 5.453 2.870 0.000 0.290 0.000 3/28350 130.0 3.411 4.917 2.583 0.000 0.261 0.000 3/28350 140.0 3.106 4.481 2.350 0.000 0.237 0.000 3/28350 150.0 2.853 4.120 2.158 0.000 0.218 0.000 3/28350 160.0 2.642 3.815 1.996 0.000 0.202 0.000 3/28350 170.0 2.462 3.555 1.858 0.000 0.188 0.000 3/28350 180.0 2.307 3.330 1.739 0.000 0.176 0.000 3/28350 190.0 2.172 3.133 1.635 0.000 0.165 0.000 3/28350 200.0 2.052 2.959 1.544 0.000 0.156 0.000 3/28350 210.0 1.947 2.805 1.463 0.000 0.148 0.000 3/28350 220.0 1.852 2.667 1.390 0.000 0.141 0.000 3/28350 230.0 1.767 2.542 1.325 0.000 0.134 0.000 3/28350 240.0 1.690 2.429 1.266 0.000 0.128 0.000 3/28350 250.0 1.619 2.326 1.212 0.000 0.123 0.000 3/28350 260.0 1.555 2.231 1.162 0.000 0.118 0.000 3/28350 270.0 1.496 2.145 1.117 0.000 0.113 0.000 3/28350 280.0 1.441 2.065 1.075 0.000 0.109 0.000 3/28350 290.0 1.390 1.991 1.037 0.000 0.105 0.000 3/28350 300.0 1.343 1.922 1.001 0.000 0.102 0.000 3/28350 310.0 1.300 1.858 0.968 0.000 0.098 0.000 3/28350 320.0 1.259 1.798 0.936 0.000 0.095 0.000 3/28350 330.0 1.220 1.742 0.907 0.000 0.092 0.000 3/28350 340.0 1.184 1.689 0.880 0.000 0.090 0.000 3/28350 350.0 1.150 1.640 0.854 0.000 0.087 0.000 3/28350 360.0 1.118 1.594 0.830 0.000 0.084 0.000 3/28350 370.0 1.088 1.550 0.807 0.000 0.082 0.000 3/28350 380.0 1.059 1.508 0.785 0.000 0.080 0.000 3/28350 390.0 1.032 1.469 0.765 0.000 0.078 0.000 3/28350 400.0 1.007 1.431 0.745 0.000 0.076 0.000 3/28350 410.0 0.982 1.396 0.727 0.000 0.074 0.000 3/28350 420.0 0.959 1.362 0.709 0.000 0.072 0.000 3/28350 430.0 0.937 1.330 0.693 0.000 0.071 0.000 3/28350 440.0 0.915 1.300 0.677 0.000 0.069 0.000 3/28350 450.0 0.895 1.270 0.662 0.000 0.067 0.000 3/28350 460.0 0.876 1.243 0.647 0.000 0.066 0.000 3/28350 470.0 0.857 1.216 0.633 0.000 0.065 0.000 3/28350 480.0 0.840 1.190 0.620 0.000 0.063 0.000 3/28350 490.0 0.822 1.166 0.607 0.000 0.062 0.000 3/28350 500.0 0.806 1.142 0.595 0.000 0.061 0.000 3/28350 510.0 0.790 1.120 0.583 0.000 0.060 0.000 3/28350 520.0 0.775 1.098 0.572 0.000 0.058 0.000 3/28350 530.0 0.761 1.077 0.561 0.000 0.057 0.000 3/28350 540.0 0.747 1.057 0.551 0.000 0.056 0.000 3/28350 550.0 0.733 1.038 0.541 0.000 0.055 0.000 3/28350 560.0 0.720 1.019 0.531 0.000 0.054 0.000 3/28350 570.0 0.708 1.001 0.521 0.000 0.053 0.000 3/28350 580.0 0.696 0.984 0.512 0.000 0.052 0.000 3/28350 590.0 0.684 0.967 0.504 0.000 0.051 0.000 3/28350 600.0 0.673 0.951 0.495 0.000 0.051 0.000 3/28350 610.0 0.662 0.935 0.487 0.000 0.050 0.000 3/28350 620.0 0.651 0.920 0.479 0.000 0.049 0.000 3/28350 630.0 0.641 0.905 0.472 0.000 0.048 0.000 3/28350 640.0 0.631 0.891 0.464 0.000 0.047 0.000 3/28350 650.0 0.621 0.877 0.457 0.000 0.047 0.000 3/28350 660.0 0.612 0.864 0.450 0.000 0.046 0.000 3/28350 670.0 0.603 0.851 0.443 0.000 0.045 0.000 3/28350 680.0 0.594 0.839 0.437 0.000 0.045 0.000 3/28350 690.0 0.585 0.826 0.431 0.000 0.044 0.000 3/28350 700.0 0.577 0.815 0.424 0.000 0.043 0.000 3/28350 710.0 0.569 0.803 0.418 0.000 0.043 0.000 3/28350 720.0 0.561 0.792 0.413 0.000 0.042 0.000 3/28350 730.0 0.553 0.781 0.407 0.000 0.042 0.000 3/28350 740.0 0.546 0.770 0.401 0.000 0.041 0.000 3/28350 750.0 0.539 0.760 0.396 0.000 0.041 0.000 3/28350 760.0 0.532 0.750 0.391 0.000 0.040 0.000 3/28350 770.0 0.525 0.740 0.386 0.000 0.039 0.000 3/28350 780.0 0.518 0.731 0.381 0.000 0.039 0.000 3/28350 790.0 0.512 0.722 0.376 0.000 0.038 0.000 3/28350 800.0 0.505 0.713 0.371 0.000 0.038 0.000 3/28350 810.0 0.499 0.704 0.367 0.000 0.038 0.000 3/28350 820.0 0.493 0.695 0.362 0.000 0.037 0.000 3/28350 830.0 0.487 0.687 0.358 0.000 0.037 0.000 3/28350 840.0 0.481 0.679 0.354 0.000 0.036 0.000 3/28350 850.0 0.476 0.671 0.349 0.000 0.036 0.000 3/28350 860.0 0.470 0.663 0.345 0.000 0.035 0.000 3/28350 870.0 0.465 0.655 0.341 0.000 0.035 0.000 3/28350 880.0 0.460 0.648 0.337 0.000 0.035 0.000 3/28350 890.0 0.454 0.640 0.334 0.000 0.034 0.000 3/28350 900.0 0.449 0.633 0.330 0.000 0.034 0.000 3/28350 910.0 0.444 0.626 0.326 0.000 0.033 0.000 3/28350 920.0 0.440 0.619 0.323 0.000 0.033 0.000 3/28350 930.0 0.435 0.613 0.319 0.000 0.033 0.000 3/28350 940.0 0.430 0.606 0.316 0.000 0.032 0.000 3/28350 950.0 0.426 0.600 0.313 0.000 0.032 0.000 3/28350 960.0 0.421 0.594 0.309 0.000 0.032 0.000 3/28350 970.0 0.417 0.588 0.306 0.000 0.031 0.000 3/28350 980.0 0.413 0.582 0.303 0.000 0.031 0.000 3/28350 990.0 0.409 0.576 0.300 0.000 0.031 0.000 3/28350 1000.0 0.405 0.570 0.297 0.000 0.030 0.000 3/28350 Thermal conductivity related properties were written into "kappa-m1595.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 19:41:45]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|