----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 20:27:49]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.806565665184419 -4.472414190000000 0.000000000000000 b 4.806565665184419 4.472414190000000 0.000000000000000 c -0.964407234396606 0.000000000000000 5.086322558299147 Atomic positions (fractional): *1 O 0.43160840767592 0.29127578970329 0.90181396821953 15.999 2 O 0.70872421029671 0.56839159232408 0.59818603178047 15.999 3 O 0.56839159232408 0.70872421029671 0.09818603178047 15.999 4 O 0.29127578970329 0.43160840767592 0.40181396821953 15.999 *5 O 0.62663595832364 0.13845901500226 0.38257234979165 15.999 6 O 0.86154098499774 0.37336404167636 0.11742765020835 15.999 7 O 0.37336404167636 0.86154098499774 0.61742765020835 15.999 8 O 0.13845901500226 0.62663595832364 0.88257234979165 15.999 *9 O 0.02463277959698 0.20589300153737 0.63101913685703 15.999 10 O 0.79410699846263 0.97536722040302 0.86898086314297 15.999 11 O 0.97536722040302 0.79410699846263 0.36898086314298 15.999 12 O 0.20589300153737 0.02463277959698 0.13101913685702 15.999 *13 Mg 0.09232113861855 0.90767886138145 0.75000000000000 24.305 14 Mg 0.90767886138145 0.09232113861855 0.25000000000000 24.305 *15 Mg 0.72909641993700 0.27090358006300 0.75000000000000 24.305 16 Mg 0.27090358006300 0.72909641993700 0.25000000000000 24.305 *17 Ge 0.20475890074699 0.39529616041511 0.71046607097158 72.640 18 Ge 0.60470383958489 0.79524109925301 0.78953392902842 72.640 19 Ge 0.79524109925301 0.60470383958489 0.28953392902842 72.640 20 Ge 0.39529616041511 0.20475890074699 0.21046607097158 72.640 -------------------------------- unit cell --------------------------------- Lattice vectors: a 9.613131330368837 0.000000000000000 0.000000000000000 b 0.000000000000000 8.944828380000001 0.000000000000000 c -0.964407234396606 0.000000000000000 5.086322558299147 Atomic positions (fractional): *1 O 0.86144209868960 0.42983369101369 0.90181396821953 15.999 > 1 2 O 0.13855790131039 0.42983369101369 0.59818603178047 15.999 > 2 3 O 0.13855790131039 0.57016630898632 0.09818603178047 15.999 > 3 4 O 0.86144209868960 0.57016630898632 0.40181396821953 15.999 > 4 *5 O 0.88254748666295 0.25591152833931 0.38257234979165 15.999 > 5 6 O 0.11745251333705 0.25591152833931 0.11742765020835 15.999 > 6 7 O 0.11745251333705 0.74408847166069 0.61742765020835 15.999 > 7 8 O 0.88254748666295 0.74408847166069 0.88257234979165 15.999 > 8 *9 O 0.61526289056718 0.59063011097020 0.63101913685703 15.999 > 9 10 O 0.38473710943282 0.59063011097020 0.86898086314297 15.999 > 10 11 O 0.38473710943282 0.40936988902980 0.36898086314298 15.999 > 11 12 O 0.61526289056718 0.40936988902980 0.13101913685702 15.999 > 12 13 O 0.36144209868960 0.92983369101368 0.90181396821953 15.999 > 1 14 O 0.63855790131040 0.92983369101368 0.59818603178047 15.999 > 2 15 O 0.63855790131040 0.07016630898631 0.09818603178047 15.999 > 3 16 O 0.36144209868960 0.07016630898631 0.40181396821953 15.999 > 4 17 O 0.38254748666295 0.75591152833931 0.38257234979165 15.999 > 5 18 O 0.61745251333705 0.75591152833931 0.11742765020835 15.999 > 6 19 O 0.61745251333705 0.24408847166069 0.61742765020835 15.999 > 7 20 O 0.38254748666295 0.24408847166069 0.88257234979165 15.999 > 8 21 O 0.11526289056718 0.09063011097020 0.63101913685703 15.999 > 9 22 O 0.88473710943282 0.09063011097020 0.86898086314297 15.999 > 10 23 O 0.88473710943282 0.90936988902980 0.36898086314298 15.999 > 11 24 O 0.11526289056718 0.90936988902980 0.13101913685702 15.999 > 12 *25 Mg 0.00000000000000 0.90767886138145 0.75000000000000 24.305 > 13 26 Mg 0.00000000000000 0.09232113861855 0.25000000000000 24.305 > 14 *27 Mg 0.00000000000000 0.27090358006300 0.75000000000000 24.305 > 15 28 Mg 0.00000000000000 0.72909641993700 0.25000000000000 24.305 > 16 29 Mg 0.50000000000000 0.40767886138145 0.75000000000000 24.305 > 13 30 Mg 0.50000000000000 0.59232113861855 0.25000000000000 24.305 > 14 31 Mg 0.50000000000000 0.77090358006300 0.75000000000000 24.305 > 15 32 Mg 0.50000000000000 0.22909641993700 0.25000000000000 24.305 > 16 *33 Ge 0.80002753058105 0.59526862983406 0.71046607097158 72.640 > 17 34 Ge 0.19997246941895 0.59526862983406 0.78953392902842 72.640 > 18 35 Ge 0.19997246941895 0.40473137016594 0.28953392902842 72.640 > 19 36 Ge 0.80002753058105 0.40473137016594 0.21046607097158 72.640 > 20 37 Ge 0.30002753058105 0.09526862983406 0.71046607097158 72.640 > 17 38 Ge 0.69997246941895 0.09526862983406 0.78953392902842 72.640 > 18 39 Ge 0.69997246941895 0.90473137016594 0.28953392902842 72.640 > 19 40 Ge 0.30002753058105 0.90473137016594 0.21046607097158 72.640 > 20 -------------------------------- super cell -------------------------------- Lattice vectors: a 9.613131330368837 0.000000000000000 0.000000000000000 b 0.000000000000000 8.944828380000001 0.000000000000000 c -1.928814468793212 0.000000000000000 10.172645116598295 Atomic positions (fractional): *1 O 0.86144209868960 0.42983369101369 0.45090698410976 15.999 > 1 2 O 0.86144209868960 0.42983369101369 0.95090698410977 15.999 > 1 3 O 0.13855790131039 0.42983369101369 0.29909301589024 15.999 > 2 4 O 0.13855790131039 0.42983369101369 0.79909301589023 15.999 > 2 5 O 0.13855790131039 0.57016630898632 0.04909301589024 15.999 > 3 6 O 0.13855790131039 0.57016630898632 0.54909301589023 15.999 > 3 7 O 0.86144209868960 0.57016630898632 0.20090698410977 15.999 > 4 8 O 0.86144209868960 0.57016630898632 0.70090698410977 15.999 > 4 *9 O 0.88254748666295 0.25591152833931 0.19128617489583 15.999 > 5 10 O 0.88254748666295 0.25591152833931 0.69128617489583 15.999 > 5 11 O 0.11745251333705 0.25591152833931 0.05871382510417 15.999 > 6 12 O 0.11745251333705 0.25591152833931 0.55871382510417 15.999 > 6 13 O 0.11745251333705 0.74408847166069 0.30871382510417 15.999 > 7 14 O 0.11745251333705 0.74408847166069 0.80871382510417 15.999 > 7 15 O 0.88254748666295 0.74408847166069 0.44128617489583 15.999 > 8 16 O 0.88254748666295 0.74408847166069 0.94128617489583 15.999 > 8 *17 O 0.61526289056718 0.59063011097020 0.31550956842851 15.999 > 9 18 O 0.61526289056718 0.59063011097020 0.81550956842851 15.999 > 9 19 O 0.38473710943282 0.59063011097020 0.43449043157149 15.999 > 10 20 O 0.38473710943282 0.59063011097020 0.93449043157149 15.999 > 10 21 O 0.38473710943282 0.40936988902980 0.18449043157149 15.999 > 11 22 O 0.38473710943282 0.40936988902980 0.68449043157149 15.999 > 11 23 O 0.61526289056718 0.40936988902980 0.06550956842851 15.999 > 12 24 O 0.61526289056718 0.40936988902980 0.56550956842851 15.999 > 12 25 O 0.36144209868960 0.92983369101368 0.45090698410976 15.999 > 1 26 O 0.36144209868960 0.92983369101368 0.95090698410977 15.999 > 1 27 O 0.63855790131040 0.92983369101368 0.29909301589024 15.999 > 2 28 O 0.63855790131040 0.92983369101368 0.79909301589023 15.999 > 2 29 O 0.63855790131040 0.07016630898631 0.04909301589024 15.999 > 3 30 O 0.63855790131040 0.07016630898631 0.54909301589023 15.999 > 3 31 O 0.36144209868960 0.07016630898631 0.20090698410977 15.999 > 4 32 O 0.36144209868960 0.07016630898631 0.70090698410977 15.999 > 4 33 O 0.38254748666295 0.75591152833931 0.19128617489583 15.999 > 5 34 O 0.38254748666295 0.75591152833931 0.69128617489583 15.999 > 5 35 O 0.61745251333705 0.75591152833931 0.05871382510417 15.999 > 6 36 O 0.61745251333705 0.75591152833931 0.55871382510417 15.999 > 6 37 O 0.61745251333705 0.24408847166069 0.30871382510417 15.999 > 7 38 O 0.61745251333705 0.24408847166069 0.80871382510417 15.999 > 7 39 O 0.38254748666295 0.24408847166069 0.44128617489583 15.999 > 8 40 O 0.38254748666295 0.24408847166069 0.94128617489583 15.999 > 8 41 O 0.11526289056718 0.09063011097020 0.31550956842851 15.999 > 9 42 O 0.11526289056718 0.09063011097020 0.81550956842851 15.999 > 9 43 O 0.88473710943282 0.09063011097020 0.43449043157149 15.999 > 10 44 O 0.88473710943282 0.09063011097020 0.93449043157149 15.999 > 10 45 O 0.88473710943282 0.90936988902980 0.18449043157149 15.999 > 11 46 O 0.88473710943282 0.90936988902980 0.68449043157149 15.999 > 11 47 O 0.11526289056718 0.90936988902980 0.06550956842851 15.999 > 12 48 O 0.11526289056718 0.90936988902980 0.56550956842851 15.999 > 12 *49 Mg 0.00000000000000 0.90767886138145 0.37500000000000 24.305 > 13 50 Mg 0.00000000000000 0.90767886138145 0.87500000000000 24.305 > 13 51 Mg 0.00000000000000 0.09232113861855 0.12500000000000 24.305 > 14 52 Mg 0.00000000000000 0.09232113861855 0.62500000000000 24.305 > 14 *53 Mg 0.00000000000000 0.27090358006300 0.37500000000000 24.305 > 15 54 Mg 0.00000000000000 0.27090358006300 0.87500000000000 24.305 > 15 55 Mg 0.00000000000000 0.72909641993700 0.12500000000000 24.305 > 16 56 Mg 0.00000000000000 0.72909641993700 0.62500000000000 24.305 > 16 57 Mg 0.50000000000000 0.40767886138145 0.37500000000000 24.305 > 13 58 Mg 0.50000000000000 0.40767886138145 0.87500000000000 24.305 > 13 59 Mg 0.50000000000000 0.59232113861855 0.12500000000000 24.305 > 14 60 Mg 0.50000000000000 0.59232113861855 0.62500000000000 24.305 > 14 61 Mg 0.50000000000000 0.77090358006300 0.37500000000000 24.305 > 15 62 Mg 0.50000000000000 0.77090358006300 0.87500000000000 24.305 > 15 63 Mg 0.50000000000000 0.22909641993700 0.12500000000000 24.305 > 16 64 Mg 0.50000000000000 0.22909641993700 0.62500000000000 24.305 > 16 *65 Ge 0.80002753058105 0.59526862983406 0.35523303548579 72.640 > 17 66 Ge 0.80002753058105 0.59526862983406 0.85523303548579 72.640 > 17 67 Ge 0.19997246941895 0.59526862983406 0.39476696451421 72.640 > 18 68 Ge 0.19997246941895 0.59526862983406 0.89476696451421 72.640 > 18 69 Ge 0.19997246941895 0.40473137016594 0.14476696451421 72.640 > 19 70 Ge 0.19997246941895 0.40473137016594 0.64476696451421 72.640 > 19 71 Ge 0.80002753058105 0.40473137016594 0.10523303548579 72.640 > 20 72 Ge 0.80002753058105 0.40473137016594 0.60523303548579 72.640 > 20 73 Ge 0.30002753058105 0.09526862983406 0.35523303548579 72.640 > 17 74 Ge 0.30002753058105 0.09526862983406 0.85523303548579 72.640 > 17 75 Ge 0.69997246941895 0.09526862983406 0.39476696451421 72.640 > 18 76 Ge 0.69997246941895 0.09526862983406 0.89476696451421 72.640 > 18 77 Ge 0.69997246941895 0.90473137016594 0.14476696451421 72.640 > 19 78 Ge 0.69997246941895 0.90473137016594 0.64476696451421 72.640 > 19 79 Ge 0.30002753058105 0.90473137016594 0.10523303548579 72.640 > 20 80 Ge 0.30002753058105 0.90473137016594 0.60523303548579 72.640 > 20 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.4037341 0.0000000 0.0191317 0.0000000 3.3800661 0.0000000 0.0191267 0.0000000 3.5145827 -------------------------- Born effective charges -------------------------- 1 O -1.4932405 0.0898318 0.3379544 0.0754694 -1.7870378 0.5142867 0.3389963 0.5551121 -2.2999745 2 O -1.4932405 -0.0898318 0.3379544 -0.0754694 -1.7870378 -0.5142867 0.3389963 -0.5551121 -2.2999745 3 O -1.4932405 0.0898318 0.3379544 0.0754694 -1.7870378 0.5142867 0.3389963 0.5551121 -2.2999745 4 O -1.4932405 -0.0898318 0.3379544 -0.0754694 -1.7870378 -0.5142867 0.3389963 -0.5551121 -2.2999745 5 O -1.5824263 0.3041976 -0.1745560 0.2597289 -1.8447643 0.2607791 -0.1808752 0.0922650 -1.7177589 6 O -1.5824263 -0.3041976 -0.1745560 -0.2597289 -1.8447643 -0.2607791 -0.1808752 -0.0922650 -1.7177589 7 O -1.5824263 0.3041976 -0.1745560 0.2597289 -1.8447643 0.2607791 -0.1808752 0.0922650 -1.7177589 8 O -1.5824263 -0.3041976 -0.1745560 -0.2597289 -1.8447643 -0.2607791 -0.1808752 -0.0922650 -1.7177589 9 O -2.2348187 -0.0500329 -0.1992909 0.1445486 -1.6515377 0.0228875 -0.2136703 0.0479786 -1.6210117 10 O -2.2348187 0.0500329 -0.1992909 -0.1445486 -1.6515377 -0.0228875 -0.2136703 -0.0479786 -1.6210117 11 O -2.2348187 -0.0500329 -0.1992909 0.1445486 -1.6515377 0.0228875 -0.2136703 0.0479786 -1.6210117 12 O -2.2348187 0.0500329 -0.1992909 -0.1445486 -1.6515377 -0.0228875 -0.2136703 -0.0479786 -1.6210117 13 Mg 2.2919194 0.0000000 0.1221856 0.0000000 2.3495409 0.0000000 0.1841410 0.0000000 2.0263140 14 Mg 2.2919194 0.0000000 0.1221856 0.0000000 2.3495409 0.0000000 0.1841410 0.0000000 2.0263140 15 Mg 2.3877011 0.0000000 -0.0374454 0.0000000 2.1043239 0.0000000 0.0109138 0.0000000 2.2310306 16 Mg 2.3877011 0.0000000 -0.0374454 0.0000000 2.1043239 0.0000000 0.0109138 0.0000000 2.2310306 17 Ge 2.9706753 0.2087915 -0.0064776 -0.2685990 3.0564074 0.1613427 -0.0419782 -0.3034069 3.5100728 18 Ge 2.9706753 -0.2087915 -0.0064776 0.2685990 3.0564074 -0.1613427 -0.0419782 0.3034069 3.5100728 19 Ge 2.9706753 0.2087915 -0.0064776 -0.2685990 3.0564074 0.1613427 -0.0419782 -0.3034069 3.5100728 20 Ge 2.9706753 -0.2087915 -0.0064776 0.2685990 3.0564074 -0.1613427 -0.0419782 0.3034069 3.5100728 ---------------------------------------------------------------------------- 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: 240/240 Permutation basis: 8844/8844 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1894 Number of blocks in projector: 1894 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: 408 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 234 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 234 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 234 Use standard eigh solver. Tree of FC basis block matrices: - (1894, 1849), data: False |-- (234, 228), data: True |-- (234, 228), data: True |-- (234, 228), data: True |-- (392, 384), data: True |-- (392, 384), data: True |-- (408, 397), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 640 - Time: 2.189 Solver_block: 200 / 640 - Time: 2.185 Solver_block: 300 / 640 - Time: 2.189 Solver_block: 400 / 640 - Time: 2.186 Solver_block: 500 / 640 - Time: 2.191 Solver_block: 600 / 640 - Time: 2.190 Solver_block: 640 / 640 - Time: 0.937 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 14.115 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (yy) 0.00000000 (yy) Permutation basis: 240/240 Permutation basis: 8844/8844 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1894 Number of blocks in projector: 1894 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: 408 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 234 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 234 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 234 Use standard eigh solver. Tree of FC basis block matrices: - (1894, 1849), data: False |-- (234, 228), data: True |-- (234, 228), data: True |-- (234, 228), data: True |-- (392, 384), data: True |-- (392, 384), data: True |-- (408, 397), 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 20:28:23]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 20:28:23]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.806565665184419 -4.472414190000000 0.000000000000000 b 4.806565665184419 4.472414190000000 0.000000000000000 c -0.964407234396606 0.000000000000000 5.086322558299147 Atomic positions (fractional): 1 O 0.43160840767592 0.29127578970329 0.90181396821953 15.999 2 O 0.70872421029671 0.56839159232408 0.59818603178047 15.999 3 O 0.56839159232408 0.70872421029671 0.09818603178047 15.999 4 O 0.29127578970329 0.43160840767592 0.40181396821953 15.999 5 O 0.62663595832364 0.13845901500226 0.38257234979165 15.999 6 O 0.86154098499774 0.37336404167636 0.11742765020835 15.999 7 O 0.37336404167636 0.86154098499774 0.61742765020835 15.999 8 O 0.13845901500226 0.62663595832364 0.88257234979165 15.999 9 O 0.02463277959698 0.20589300153737 0.63101913685703 15.999 10 O 0.79410699846263 0.97536722040302 0.86898086314297 15.999 11 O 0.97536722040302 0.79410699846263 0.36898086314298 15.999 12 O 0.20589300153737 0.02463277959698 0.13101913685702 15.999 13 Mg 0.09232113861855 0.90767886138145 0.75000000000000 24.305 14 Mg 0.90767886138145 0.09232113861855 0.25000000000000 24.305 15 Mg 0.72909641993700 0.27090358006300 0.75000000000000 24.305 16 Mg 0.27090358006300 0.72909641993700 0.25000000000000 24.305 17 Ge 0.20475890074699 0.39529616041511 0.71046607097158 72.640 18 Ge 0.60470383958489 0.79524109925301 0.78953392902842 72.640 19 Ge 0.79524109925301 0.60470383958489 0.28953392902842 72.640 20 Ge 0.39529616041511 0.20475890074699 0.21046607097158 72.640 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.613131330368837 0.000000000000000 0.000000000000000 b 0.000000000000000 8.944828380000001 0.000000000000000 c -1.928814468793212 0.000000000000000 10.172645116598295 Atomic positions (fractional): 1 O 0.86144209868960 0.42983369101369 0.45090698410976 15.999 > 1 2 O 0.86144209868960 0.42983369101369 0.95090698410977 15.999 > 1 3 O 0.13855790131039 0.42983369101369 0.29909301589024 15.999 > 3 4 O 0.13855790131039 0.42983369101369 0.79909301589023 15.999 > 3 5 O 0.13855790131039 0.57016630898632 0.04909301589024 15.999 > 5 6 O 0.13855790131039 0.57016630898632 0.54909301589023 15.999 > 5 7 O 0.86144209868960 0.57016630898632 0.20090698410977 15.999 > 7 8 O 0.86144209868960 0.57016630898632 0.70090698410977 15.999 > 7 9 O 0.88254748666295 0.25591152833931 0.19128617489583 15.999 > 9 10 O 0.88254748666295 0.25591152833931 0.69128617489583 15.999 > 9 11 O 0.11745251333705 0.25591152833931 0.05871382510417 15.999 > 11 12 O 0.11745251333705 0.25591152833931 0.55871382510417 15.999 > 11 13 O 0.11745251333705 0.74408847166069 0.30871382510417 15.999 > 13 14 O 0.11745251333705 0.74408847166069 0.80871382510417 15.999 > 13 15 O 0.88254748666295 0.74408847166069 0.44128617489583 15.999 > 15 16 O 0.88254748666295 0.74408847166069 0.94128617489583 15.999 > 15 17 O 0.61526289056718 0.59063011097020 0.31550956842851 15.999 > 17 18 O 0.61526289056718 0.59063011097020 0.81550956842851 15.999 > 17 19 O 0.38473710943282 0.59063011097020 0.43449043157149 15.999 > 19 20 O 0.38473710943282 0.59063011097020 0.93449043157149 15.999 > 19 21 O 0.38473710943282 0.40936988902980 0.18449043157149 15.999 > 21 22 O 0.38473710943282 0.40936988902980 0.68449043157149 15.999 > 21 23 O 0.61526289056718 0.40936988902980 0.06550956842851 15.999 > 23 24 O 0.61526289056718 0.40936988902980 0.56550956842851 15.999 > 23 25 O 0.36144209868960 0.92983369101368 0.45090698410976 15.999 > 1 26 O 0.36144209868960 0.92983369101368 0.95090698410977 15.999 > 1 27 O 0.63855790131040 0.92983369101368 0.29909301589024 15.999 > 3 28 O 0.63855790131040 0.92983369101368 0.79909301589023 15.999 > 3 29 O 0.63855790131040 0.07016630898631 0.04909301589024 15.999 > 5 30 O 0.63855790131040 0.07016630898631 0.54909301589023 15.999 > 5 31 O 0.36144209868960 0.07016630898631 0.20090698410977 15.999 > 7 32 O 0.36144209868960 0.07016630898631 0.70090698410977 15.999 > 7 33 O 0.38254748666295 0.75591152833931 0.19128617489583 15.999 > 9 34 O 0.38254748666295 0.75591152833931 0.69128617489583 15.999 > 9 35 O 0.61745251333705 0.75591152833931 0.05871382510417 15.999 > 11 36 O 0.61745251333705 0.75591152833931 0.55871382510417 15.999 > 11 37 O 0.61745251333705 0.24408847166069 0.30871382510417 15.999 > 13 38 O 0.61745251333705 0.24408847166069 0.80871382510417 15.999 > 13 39 O 0.38254748666295 0.24408847166069 0.44128617489583 15.999 > 15 40 O 0.38254748666295 0.24408847166069 0.94128617489583 15.999 > 15 41 O 0.11526289056718 0.09063011097020 0.31550956842851 15.999 > 17 42 O 0.11526289056718 0.09063011097020 0.81550956842851 15.999 > 17 43 O 0.88473710943282 0.09063011097020 0.43449043157149 15.999 > 19 44 O 0.88473710943282 0.09063011097020 0.93449043157149 15.999 > 19 45 O 0.88473710943282 0.90936988902980 0.18449043157149 15.999 > 21 46 O 0.88473710943282 0.90936988902980 0.68449043157149 15.999 > 21 47 O 0.11526289056718 0.90936988902980 0.06550956842851 15.999 > 23 48 O 0.11526289056718 0.90936988902980 0.56550956842851 15.999 > 23 49 Mg 0.00000000000000 0.90767886138145 0.37500000000000 24.305 > 49 50 Mg 0.00000000000000 0.90767886138145 0.87500000000000 24.305 > 49 51 Mg 0.00000000000000 0.09232113861855 0.12500000000000 24.305 > 51 52 Mg 0.00000000000000 0.09232113861855 0.62500000000000 24.305 > 51 53 Mg 0.00000000000000 0.27090358006300 0.37500000000000 24.305 > 53 54 Mg 0.00000000000000 0.27090358006300 0.87500000000000 24.305 > 53 55 Mg 0.00000000000000 0.72909641993700 0.12500000000000 24.305 > 55 56 Mg 0.00000000000000 0.72909641993700 0.62500000000000 24.305 > 55 57 Mg 0.50000000000000 0.40767886138145 0.37500000000000 24.305 > 49 58 Mg 0.50000000000000 0.40767886138145 0.87500000000000 24.305 > 49 59 Mg 0.50000000000000 0.59232113861855 0.12500000000000 24.305 > 51 60 Mg 0.50000000000000 0.59232113861855 0.62500000000000 24.305 > 51 61 Mg 0.50000000000000 0.77090358006300 0.37500000000000 24.305 > 53 62 Mg 0.50000000000000 0.77090358006300 0.87500000000000 24.305 > 53 63 Mg 0.50000000000000 0.22909641993700 0.12500000000000 24.305 > 55 64 Mg 0.50000000000000 0.22909641993700 0.62500000000000 24.305 > 55 65 Ge 0.80002753058105 0.59526862983406 0.35523303548579 72.640 > 65 66 Ge 0.80002753058105 0.59526862983406 0.85523303548579 72.640 > 65 67 Ge 0.19997246941895 0.59526862983406 0.39476696451421 72.640 > 67 68 Ge 0.19997246941895 0.59526862983406 0.89476696451421 72.640 > 67 69 Ge 0.19997246941895 0.40473137016594 0.14476696451421 72.640 > 69 70 Ge 0.19997246941895 0.40473137016594 0.64476696451421 72.640 > 69 71 Ge 0.80002753058105 0.40473137016594 0.10523303548579 72.640 > 71 72 Ge 0.80002753058105 0.40473137016594 0.60523303548579 72.640 > 71 73 Ge 0.30002753058105 0.09526862983406 0.35523303548579 72.640 > 65 74 Ge 0.30002753058105 0.09526862983406 0.85523303548579 72.640 > 65 75 Ge 0.69997246941895 0.09526862983406 0.39476696451421 72.640 > 67 76 Ge 0.69997246941895 0.09526862983406 0.89476696451421 72.640 > 67 77 Ge 0.69997246941895 0.90473137016594 0.14476696451421 72.640 > 69 78 Ge 0.69997246941895 0.90473137016594 0.64476696451421 72.640 > 69 79 Ge 0.30002753058105 0.90473137016594 0.10523303548579 72.640 > 71 80 Ge 0.30002753058105 0.90473137016594 0.60523303548579 72.640 > 71 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.4037341 0.0000000 0.0191317 0.0000000 3.3800661 0.0000000 0.0191267 0.0000000 3.5145827 -------------------------- Born effective charges -------------------------- 1 O -1.4932405 0.0898318 0.3379544 0.0754694 -1.7870378 0.5142867 0.3389963 0.5551121 -2.2999745 2 O -1.4932405 -0.0898318 0.3379544 -0.0754694 -1.7870378 -0.5142867 0.3389963 -0.5551121 -2.2999745 3 O -1.4932405 0.0898318 0.3379544 0.0754694 -1.7870378 0.5142867 0.3389963 0.5551121 -2.2999745 4 O -1.4932405 -0.0898318 0.3379544 -0.0754694 -1.7870378 -0.5142867 0.3389963 -0.5551121 -2.2999745 5 O -1.5824263 0.3041976 -0.1745560 0.2597289 -1.8447643 0.2607791 -0.1808752 0.0922650 -1.7177589 6 O -1.5824263 -0.3041976 -0.1745560 -0.2597289 -1.8447643 -0.2607791 -0.1808752 -0.0922650 -1.7177589 7 O -1.5824263 0.3041976 -0.1745560 0.2597289 -1.8447643 0.2607791 -0.1808752 0.0922650 -1.7177589 8 O -1.5824263 -0.3041976 -0.1745560 -0.2597289 -1.8447643 -0.2607791 -0.1808752 -0.0922650 -1.7177589 9 O -2.2348187 -0.0500329 -0.1992909 0.1445486 -1.6515377 0.0228875 -0.2136703 0.0479786 -1.6210117 10 O -2.2348187 0.0500329 -0.1992909 -0.1445486 -1.6515377 -0.0228875 -0.2136703 -0.0479786 -1.6210117 11 O -2.2348187 -0.0500329 -0.1992909 0.1445486 -1.6515377 0.0228875 -0.2136703 0.0479786 -1.6210117 12 O -2.2348187 0.0500329 -0.1992909 -0.1445486 -1.6515377 -0.0228875 -0.2136703 -0.0479786 -1.6210117 13 Mg 2.2919194 0.0000000 0.1221856 0.0000000 2.3495409 0.0000000 0.1841410 0.0000000 2.0263140 14 Mg 2.2919194 0.0000000 0.1221856 0.0000000 2.3495409 0.0000000 0.1841410 0.0000000 2.0263140 15 Mg 2.3877011 0.0000000 -0.0374454 0.0000000 2.1043239 0.0000000 0.0109138 0.0000000 2.2310306 16 Mg 2.3877011 0.0000000 -0.0374454 0.0000000 2.1043239 0.0000000 0.0109138 0.0000000 2.2310306 17 Ge 2.9706753 0.2087915 -0.0064776 -0.2685990 3.0564074 0.1613427 -0.0419782 -0.3034069 3.5100728 18 Ge 2.9706753 -0.2087915 -0.0064776 0.2685990 3.0564074 -0.1613427 -0.0419782 0.3034069 3.5100728 19 Ge 2.9706753 0.2087915 -0.0064776 -0.2685990 3.0564074 0.1613427 -0.0419782 -0.3034069 3.5100728 20 Ge 2.9706753 -0.2087915 -0.0064776 0.2685990 3.0564074 -0.1613427 -0.0419782 0.3034069 3.5100728 ---------------------------------------------------------------------------- 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] [-0.0019 0.0000 0.0098] [ 0.0019 0.0000 -0.0098] Computing fc3[ 9, 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] [-0.0019 0.0000 0.0098] [ 0.0019 0.0000 -0.0098] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0019 0.0000 0.0098] [ 0.0019 0.0000 -0.0098] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0019 0.0000 0.0098] [ 0.0019 0.0000 -0.0098] Computing fc3[ 53, 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] [-0.0019 0.0000 0.0098] [ 0.0019 0.0000 -0.0098] Computing fc3[ 65, 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] [-0.0019 0.0000 0.0098] [ 0.0019 0.0000 -0.0098] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000003 (zzz) 0.00000003 (zzz) 0.00000003 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000002 (zx) 0.00000002 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 20:28:38]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 20:28:38]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.806565665184419 -4.472414190000000 0.000000000000000 b 4.806565665184419 4.472414190000000 0.000000000000000 c -0.964407234396606 0.000000000000000 5.086322558299147 Atomic positions (fractional): 1 O 0.43160840767592 0.29127578970329 0.90181396821953 15.999 2 O 0.70872421029671 0.56839159232408 0.59818603178047 15.999 3 O 0.56839159232408 0.70872421029671 0.09818603178047 15.999 4 O 0.29127578970329 0.43160840767592 0.40181396821953 15.999 5 O 0.62663595832364 0.13845901500226 0.38257234979165 15.999 6 O 0.86154098499774 0.37336404167636 0.11742765020835 15.999 7 O 0.37336404167636 0.86154098499774 0.61742765020835 15.999 8 O 0.13845901500226 0.62663595832364 0.88257234979165 15.999 9 O 0.02463277959698 0.20589300153737 0.63101913685703 15.999 10 O 0.79410699846263 0.97536722040302 0.86898086314297 15.999 11 O 0.97536722040302 0.79410699846263 0.36898086314298 15.999 12 O 0.20589300153737 0.02463277959698 0.13101913685702 15.999 13 Mg 0.09232113861855 0.90767886138145 0.75000000000000 24.305 14 Mg 0.90767886138145 0.09232113861855 0.25000000000000 24.305 15 Mg 0.72909641993700 0.27090358006300 0.75000000000000 24.305 16 Mg 0.27090358006300 0.72909641993700 0.25000000000000 24.305 17 Ge 0.20475890074699 0.39529616041511 0.71046607097158 72.640 18 Ge 0.60470383958489 0.79524109925301 0.78953392902842 72.640 19 Ge 0.79524109925301 0.60470383958489 0.28953392902842 72.640 20 Ge 0.39529616041511 0.20475890074699 0.21046607097158 72.640 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.613131330368837 0.000000000000000 0.000000000000000 b 0.000000000000000 8.944828380000001 0.000000000000000 c -1.928814468793212 0.000000000000000 10.172645116598295 Atomic positions (fractional): 1 O 0.86144209868960 0.42983369101369 0.45090698410976 15.999 > 1 2 O 0.86144209868960 0.42983369101369 0.95090698410977 15.999 > 1 3 O 0.13855790131039 0.42983369101369 0.29909301589024 15.999 > 3 4 O 0.13855790131039 0.42983369101369 0.79909301589023 15.999 > 3 5 O 0.13855790131039 0.57016630898632 0.04909301589024 15.999 > 5 6 O 0.13855790131039 0.57016630898632 0.54909301589023 15.999 > 5 7 O 0.86144209868960 0.57016630898632 0.20090698410977 15.999 > 7 8 O 0.86144209868960 0.57016630898632 0.70090698410977 15.999 > 7 9 O 0.88254748666295 0.25591152833931 0.19128617489583 15.999 > 9 10 O 0.88254748666295 0.25591152833931 0.69128617489583 15.999 > 9 11 O 0.11745251333705 0.25591152833931 0.05871382510417 15.999 > 11 12 O 0.11745251333705 0.25591152833931 0.55871382510417 15.999 > 11 13 O 0.11745251333705 0.74408847166069 0.30871382510417 15.999 > 13 14 O 0.11745251333705 0.74408847166069 0.80871382510417 15.999 > 13 15 O 0.88254748666295 0.74408847166069 0.44128617489583 15.999 > 15 16 O 0.88254748666295 0.74408847166069 0.94128617489583 15.999 > 15 17 O 0.61526289056718 0.59063011097020 0.31550956842851 15.999 > 17 18 O 0.61526289056718 0.59063011097020 0.81550956842851 15.999 > 17 19 O 0.38473710943282 0.59063011097020 0.43449043157149 15.999 > 19 20 O 0.38473710943282 0.59063011097020 0.93449043157149 15.999 > 19 21 O 0.38473710943282 0.40936988902980 0.18449043157149 15.999 > 21 22 O 0.38473710943282 0.40936988902980 0.68449043157149 15.999 > 21 23 O 0.61526289056718 0.40936988902980 0.06550956842851 15.999 > 23 24 O 0.61526289056718 0.40936988902980 0.56550956842851 15.999 > 23 25 O 0.36144209868960 0.92983369101368 0.45090698410976 15.999 > 1 26 O 0.36144209868960 0.92983369101368 0.95090698410977 15.999 > 1 27 O 0.63855790131040 0.92983369101368 0.29909301589024 15.999 > 3 28 O 0.63855790131040 0.92983369101368 0.79909301589023 15.999 > 3 29 O 0.63855790131040 0.07016630898631 0.04909301589024 15.999 > 5 30 O 0.63855790131040 0.07016630898631 0.54909301589023 15.999 > 5 31 O 0.36144209868960 0.07016630898631 0.20090698410977 15.999 > 7 32 O 0.36144209868960 0.07016630898631 0.70090698410977 15.999 > 7 33 O 0.38254748666295 0.75591152833931 0.19128617489583 15.999 > 9 34 O 0.38254748666295 0.75591152833931 0.69128617489583 15.999 > 9 35 O 0.61745251333705 0.75591152833931 0.05871382510417 15.999 > 11 36 O 0.61745251333705 0.75591152833931 0.55871382510417 15.999 > 11 37 O 0.61745251333705 0.24408847166069 0.30871382510417 15.999 > 13 38 O 0.61745251333705 0.24408847166069 0.80871382510417 15.999 > 13 39 O 0.38254748666295 0.24408847166069 0.44128617489583 15.999 > 15 40 O 0.38254748666295 0.24408847166069 0.94128617489583 15.999 > 15 41 O 0.11526289056718 0.09063011097020 0.31550956842851 15.999 > 17 42 O 0.11526289056718 0.09063011097020 0.81550956842851 15.999 > 17 43 O 0.88473710943282 0.09063011097020 0.43449043157149 15.999 > 19 44 O 0.88473710943282 0.09063011097020 0.93449043157149 15.999 > 19 45 O 0.88473710943282 0.90936988902980 0.18449043157149 15.999 > 21 46 O 0.88473710943282 0.90936988902980 0.68449043157149 15.999 > 21 47 O 0.11526289056718 0.90936988902980 0.06550956842851 15.999 > 23 48 O 0.11526289056718 0.90936988902980 0.56550956842851 15.999 > 23 49 Mg 0.00000000000000 0.90767886138145 0.37500000000000 24.305 > 49 50 Mg 0.00000000000000 0.90767886138145 0.87500000000000 24.305 > 49 51 Mg 0.00000000000000 0.09232113861855 0.12500000000000 24.305 > 51 52 Mg 0.00000000000000 0.09232113861855 0.62500000000000 24.305 > 51 53 Mg 0.00000000000000 0.27090358006300 0.37500000000000 24.305 > 53 54 Mg 0.00000000000000 0.27090358006300 0.87500000000000 24.305 > 53 55 Mg 0.00000000000000 0.72909641993700 0.12500000000000 24.305 > 55 56 Mg 0.00000000000000 0.72909641993700 0.62500000000000 24.305 > 55 57 Mg 0.50000000000000 0.40767886138145 0.37500000000000 24.305 > 49 58 Mg 0.50000000000000 0.40767886138145 0.87500000000000 24.305 > 49 59 Mg 0.50000000000000 0.59232113861855 0.12500000000000 24.305 > 51 60 Mg 0.50000000000000 0.59232113861855 0.62500000000000 24.305 > 51 61 Mg 0.50000000000000 0.77090358006300 0.37500000000000 24.305 > 53 62 Mg 0.50000000000000 0.77090358006300 0.87500000000000 24.305 > 53 63 Mg 0.50000000000000 0.22909641993700 0.12500000000000 24.305 > 55 64 Mg 0.50000000000000 0.22909641993700 0.62500000000000 24.305 > 55 65 Ge 0.80002753058105 0.59526862983406 0.35523303548579 72.640 > 65 66 Ge 0.80002753058105 0.59526862983406 0.85523303548579 72.640 > 65 67 Ge 0.19997246941895 0.59526862983406 0.39476696451421 72.640 > 67 68 Ge 0.19997246941895 0.59526862983406 0.89476696451421 72.640 > 67 69 Ge 0.19997246941895 0.40473137016594 0.14476696451421 72.640 > 69 70 Ge 0.19997246941895 0.40473137016594 0.64476696451421 72.640 > 69 71 Ge 0.80002753058105 0.40473137016594 0.10523303548579 72.640 > 71 72 Ge 0.80002753058105 0.40473137016594 0.60523303548579 72.640 > 71 73 Ge 0.30002753058105 0.09526862983406 0.35523303548579 72.640 > 65 74 Ge 0.30002753058105 0.09526862983406 0.85523303548579 72.640 > 65 75 Ge 0.69997246941895 0.09526862983406 0.39476696451421 72.640 > 67 76 Ge 0.69997246941895 0.09526862983406 0.89476696451421 72.640 > 67 77 Ge 0.69997246941895 0.90473137016594 0.14476696451421 72.640 > 69 78 Ge 0.69997246941895 0.90473137016594 0.64476696451421 72.640 > 69 79 Ge 0.30002753058105 0.90473137016594 0.10523303548579 72.640 > 71 80 Ge 0.30002753058105 0.90473137016594 0.60523303548579 72.640 > 71 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.4037341 0.0000000 0.0191317 0.0000000 3.3800661 0.0000000 0.0191267 0.0000000 3.5145827 -------------------------- Born effective charges -------------------------- 1 O -1.4932405 0.0898318 0.3379544 0.0754694 -1.7870378 0.5142867 0.3389963 0.5551121 -2.2999745 2 O -1.4932405 -0.0898318 0.3379544 -0.0754694 -1.7870378 -0.5142867 0.3389963 -0.5551121 -2.2999745 3 O -1.4932405 0.0898318 0.3379544 0.0754694 -1.7870378 0.5142867 0.3389963 0.5551121 -2.2999745 4 O -1.4932405 -0.0898318 0.3379544 -0.0754694 -1.7870378 -0.5142867 0.3389963 -0.5551121 -2.2999745 5 O -1.5824263 0.3041976 -0.1745560 0.2597289 -1.8447643 0.2607791 -0.1808752 0.0922650 -1.7177589 6 O -1.5824263 -0.3041976 -0.1745560 -0.2597289 -1.8447643 -0.2607791 -0.1808752 -0.0922650 -1.7177589 7 O -1.5824263 0.3041976 -0.1745560 0.2597289 -1.8447643 0.2607791 -0.1808752 0.0922650 -1.7177589 8 O -1.5824263 -0.3041976 -0.1745560 -0.2597289 -1.8447643 -0.2607791 -0.1808752 -0.0922650 -1.7177589 9 O -2.2348187 -0.0500329 -0.1992909 0.1445486 -1.6515377 0.0228875 -0.2136703 0.0479786 -1.6210117 10 O -2.2348187 0.0500329 -0.1992909 -0.1445486 -1.6515377 -0.0228875 -0.2136703 -0.0479786 -1.6210117 11 O -2.2348187 -0.0500329 -0.1992909 0.1445486 -1.6515377 0.0228875 -0.2136703 0.0479786 -1.6210117 12 O -2.2348187 0.0500329 -0.1992909 -0.1445486 -1.6515377 -0.0228875 -0.2136703 -0.0479786 -1.6210117 13 Mg 2.2919194 0.0000000 0.1221856 0.0000000 2.3495409 0.0000000 0.1841410 0.0000000 2.0263140 14 Mg 2.2919194 0.0000000 0.1221856 0.0000000 2.3495409 0.0000000 0.1841410 0.0000000 2.0263140 15 Mg 2.3877011 0.0000000 -0.0374454 0.0000000 2.1043239 0.0000000 0.0109138 0.0000000 2.2310306 16 Mg 2.3877011 0.0000000 -0.0374454 0.0000000 2.1043239 0.0000000 0.0109138 0.0000000 2.2310306 17 Ge 2.9706753 0.2087915 -0.0064776 -0.2685990 3.0564074 0.1613427 -0.0419782 -0.3034069 3.5100728 18 Ge 2.9706753 -0.2087915 -0.0064776 0.2685990 3.0564074 -0.1613427 -0.0419782 0.3034069 3.5100728 19 Ge 2.9706753 0.2087915 -0.0064776 -0.2685990 3.0564074 0.1613427 -0.0419782 -0.3034069 3.5100728 20 Ge 2.9706753 -0.2087915 -0.0064776 0.2685990 3.0564074 -0.1613427 -0.0419782 0.3034069 3.5100728 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000003 (zzz) 0.00000003 (zzz) 0.00000003 (zzz) 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 ... [ 8 8 10 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.69, Number of G-points: 305, Lambda: 0.13 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/186) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 186 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 3.328 ( 0.000 0.000 0.000) 0.000 3.470 ( 0.000 0.000 0.000) 0.000 4.920 ( 0.000 0.000 0.000) 0.000 5.330 ( 0.000 0.000 0.000) 0.000 5.415 ( 0.000 0.000 0.000) 0.000 5.584 ( 0.000 0.000 0.000) 0.000 5.799 ( 0.000 0.000 0.000) 0.000 5.827 ( 0.000 0.000 0.000) 0.000 6.110 ( 0.000 0.000 0.000) 0.000 6.300 ( 0.000 0.000 0.000) 0.000 6.314 ( 0.000 0.000 0.000) 0.000 7.116 ( 0.000 0.000 0.000) 0.000 7.692 ( 0.000 0.000 0.000) 0.000 7.754 ( 0.000 0.000 0.000) 0.000 7.985 ( 0.000 0.000 0.000) 0.000 8.026 ( 0.000 0.000 0.000) 0.000 8.202 ( 0.000 0.000 0.000) 0.000 8.221 ( 0.000 0.000 0.000) 0.000 8.608 ( 0.000 0.000 0.000) 0.000 8.745 ( 0.000 0.000 0.000) 0.000 9.449 ( 0.000 0.000 0.000) 0.000 9.530 ( 0.000 0.000 0.000) 0.000 9.845 ( 0.000 0.000 0.000) 0.000 9.862 ( 0.000 0.000 0.000) 0.000 10.076 ( 0.000 0.000 0.000) 0.000 10.083 ( 0.000 0.000 0.000) 0.000 10.431 ( 0.000 0.000 0.000) 0.000 11.152 ( 0.000 0.000 0.000) 0.000 11.477 ( 0.000 0.000 0.000) 0.000 11.512 ( 0.000 0.000 0.000) 0.000 11.663 ( 0.000 0.000 0.000) 0.000 11.922 ( 0.000 0.000 0.000) 0.000 12.097 ( 0.000 0.000 0.000) 0.000 12.199 ( 0.000 0.000 0.000) 0.000 12.568 ( 0.000 0.000 0.000) 0.000 12.898 ( 0.000 0.000 0.000) 0.000 13.471 ( 0.000 0.000 0.000) 0.000 13.678 ( 0.000 0.000 0.000) 0.000 13.720 ( 0.000 0.000 0.000) 0.000 13.765 ( 0.000 0.000 0.000) 0.000 14.249 ( 0.000 0.000 0.000) 0.000 15.863 ( 0.000 0.000 0.000) 0.000 16.554 ( 0.000 0.000 0.000) 0.000 17.037 ( 0.000 0.000 0.000) 0.000 17.316 ( 0.000 0.000 0.000) 0.000 19.653 ( 0.000 0.000 0.000) 0.000 19.685 ( 0.000 0.000 0.000) 0.000 20.609 ( 0.000 0.000 0.000) 0.000 20.781 ( 0.000 0.000 0.000) 0.000 21.693 ( 0.000 0.000 0.000) 0.000 22.613 ( 0.000 0.000 0.000) 0.000 22.675 ( 0.000 0.000 0.000) 0.000 23.250 ( 0.000 0.000 0.000) 0.000 24.356 ( 0.000 0.000 0.000) 0.000 24.594 ( 0.000 0.000 0.000) 0.000 24.650 ( 0.000 0.000 0.000) 0.000 24.785 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/186) ======================= q-point: ( 0.12 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.676 ( 15.762 -34.520 -4.231) 38.184 0.788 ( 31.942 -24.384 8.950) 41.170 1.366 ( 48.897 -45.217 26.332) 71.616 3.342 ( 0.321 -0.602 -0.351) 0.767 3.445 ( -1.153 1.871 -1.384) 2.597 4.846 ( -9.164 0.084 -4.226) 10.092 5.281 ( 1.900 6.945 -2.953) 7.783 5.467 ( 5.001 3.075 0.970) 5.951 5.602 ( -8.631 -0.096 1.723) 8.802 5.673 ( -9.972 -7.567 -1.726) 12.636 5.749 ( -1.956 7.842 -1.711) 8.262 6.236 ( 9.718 6.602 -4.953) 12.750 6.324 ( 18.218 -1.509 -1.078) 18.312 6.594 ( 5.670 -15.933 0.985) 16.940 7.165 ( -6.365 -0.820 -3.924) 7.522 7.536 ( -16.273 4.116 1.360) 16.841 7.927 ( -0.239 7.889 -6.952) 10.518 8.031 ( -6.060 2.635 -3.196) 7.341 8.095 ( 1.762 7.266 0.075) 7.477 8.285 ( 10.422 1.041 0.207) 10.476 8.338 ( 27.548 32.901 22.078) 48.258 8.639 ( -0.493 -2.054 -1.535) 2.611 8.848 ( 8.118 1.667 0.981) 8.345 9.371 ( 3.459 19.303 -3.800) 19.975 9.447 ( -2.956 1.953 -2.355) 4.255 9.864 ( -3.019 -1.911 7.813) 8.591 9.909 ( -1.979 -3.640 -9.878) 10.712 10.171 ( 4.080 -0.535 4.057) 5.778 10.224 ( 5.830 -10.626 1.636) 12.230 10.437 ( -2.503 -3.167 2.148) 4.572 11.178 ( 2.131 4.534 3.302) 6.001 11.517 ( 3.912 3.791 1.252) 5.589 11.647 ( 4.332 4.276 -2.665) 6.644 11.854 ( -10.411 -4.166 -3.021) 11.614 12.065 ( -5.783 -13.541 -25.319) 29.289 12.141 ( 0.798 -1.603 15.044) 15.150 12.341 ( 4.114 4.840 0.221) 6.356 12.938 ( 4.464 -0.505 2.228) 5.015 13.350 ( -17.341 -6.110 -12.910) 22.465 13.466 ( -7.566 -11.963 -33.010) 35.917 13.701 ( -0.032 -5.026 -10.450) 11.596 13.777 ( -0.027 -1.218 18.360) 18.400 14.225 ( -0.856 2.298 -1.327) 2.788 14.574 ( -50.207 -35.106 63.252) 88.057 16.191 ( 26.775 18.666 -60.235) 68.510 16.580 ( 2.040 -1.757 -3.009) 4.037 17.018 ( -2.255 0.142 -1.291) 2.602 17.518 ( -8.974 -12.671 -11.099) 19.086 19.644 ( -0.743 0.460 -0.270) 0.915 19.690 ( -0.270 -0.064 3.658) 3.669 20.623 ( 1.106 -0.903 -0.403) 1.483 21.026 ( -19.855 -21.802 -5.151) 29.935 22.587 ( -0.886 1.650 -3.561) 4.023 22.680 ( 4.208 1.935 2.865) 5.446 23.216 ( 53.263 52.894 17.760) 77.138 23.260 ( -1.967 -3.190 0.050) 3.748 24.336 ( -0.896 1.810 -1.622) 2.590 24.541 ( -4.216 1.725 3.221) 5.580 24.711 ( 5.263 2.289 0.412) 5.754 25.843 ( -15.906 -12.341 28.631) 35.001 ======================= Grid point 2 (3/186) ======================= q-point: ( 0.25 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.351 ( 16.504 -33.404 -4.362) 37.513 1.544 ( 30.065 -22.442 8.397) 38.445 2.615 ( 40.100 -38.397 22.339) 59.845 3.311 ( -2.009 2.890 -1.844) 3.973 3.386 ( -1.425 4.598 0.222) 4.819 4.690 ( -11.927 0.420 -6.113) 13.409 5.150 ( -0.174 11.913 -1.337) 11.989 5.372 ( -4.333 3.145 -2.556) 5.933 5.523 ( -5.313 -2.956 4.976) 7.856 5.689 ( -2.517 -6.488 0.591) 6.984 5.783 ( 1.804 -5.702 -2.980) 6.682 6.266 ( 8.758 6.867 -1.771) 11.269 6.572 ( 12.392 -5.633 -0.514) 13.622 6.899 ( 8.271 -11.841 2.255) 14.619 7.052 ( -1.453 10.430 -0.694) 10.553 7.240 ( -16.608 4.124 0.581) 17.122 7.644 ( -9.205 15.448 -11.595) 21.397 7.905 ( -3.694 5.942 1.652) 7.189 8.000 ( -4.509 3.079 -5.335) 7.634 8.277 ( 7.295 13.387 9.060) 17.734 8.482 ( 13.902 -2.588 -2.270) 14.322 8.630 ( 1.547 2.411 -1.398) 3.187 8.891 ( -2.305 2.147 8.003) 8.601 9.161 ( 3.872 12.831 -6.470) 14.882 9.394 ( -0.406 1.089 0.186) 1.177 9.864 ( -5.800 -4.395 -1.302) 7.392 9.908 ( -0.150 -2.735 -3.361) 4.335 10.259 ( 0.507 -1.340 18.306) 18.362 10.420 ( 1.936 -7.472 1.954) 7.962 10.495 ( 2.526 -5.850 -2.696) 6.919 11.125 ( -2.619 2.371 3.961) 5.308 11.464 ( 2.734 10.848 1.827) 11.336 11.675 ( 0.812 -2.138 -11.796) 12.015 11.819 ( 1.819 -3.798 -1.422) 4.445 12.114 ( 0.003 -6.997 -18.640) 19.911 12.189 ( 0.102 0.326 8.618) 8.624 12.348 ( -1.764 -2.250 7.042) 7.600 12.994 ( 1.785 2.402 -6.403) 7.068 13.173 ( -10.854 -2.804 -4.447) 12.061 13.455 ( -3.398 -4.671 -11.515) 12.882 13.754 ( 1.045 -5.637 -14.750) 15.825 13.834 ( -1.625 -1.172 23.074) 23.161 14.160 ( -0.872 4.534 -2.498) 5.249 14.564 ( -19.406 -12.507 26.313) 35.006 16.122 ( 10.237 10.299 -24.077) 28.117 16.625 ( 1.802 -1.794 -2.816) 3.794 16.978 ( -2.596 0.195 -1.463) 2.987 17.557 ( -1.900 -5.304 -4.094) 6.965 19.624 ( -0.812 0.567 -0.431) 1.080 19.697 ( -0.021 -0.124 1.690) 1.695 20.655 ( 1.491 -1.206 -0.673) 2.033 21.071 ( -6.997 -9.987 1.399) 12.274 22.537 ( -1.448 1.957 -3.406) 4.187 22.721 ( 3.209 -0.018 0.947) 3.346 23.210 ( 22.501 23.062 8.185) 33.243 23.283 ( -2.338 -3.920 0.019) 4.564 24.276 ( -1.884 3.062 -2.176) 4.203 24.486 ( -2.549 0.518 2.591) 3.671 24.734 ( 2.569 1.475 -1.275) 3.225 25.886 ( -5.307 -5.999 12.834) 15.128 ======================= Grid point 3 (4/186) ======================= q-point: ( 0.38 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.004 ( 16.304 -30.107 -4.081) 34.480 2.210 ( 25.095 -17.143 6.524) 31.083 3.110 ( -10.174 -1.472 1.696) 10.419 3.132 ( -8.917 15.649 3.020) 18.263 3.687 ( 30.402 -14.443 4.571) 33.967 4.543 ( -8.752 -5.418 4.842) 11.375 4.994 ( -0.806 8.046 -4.453) 9.231 5.415 ( 3.895 -9.303 -2.373) 10.360 5.518 ( -5.363 -4.995 3.861) 8.284 5.753 ( -0.350 -2.617 0.248) 2.652 5.822 ( 0.066 2.133 -2.708) 3.448 6.223 ( 1.498 8.169 -1.086) 8.376 6.789 ( -1.602 5.493 7.698) 9.591 6.817 ( 6.035 4.713 -3.248) 8.318 7.019 ( -9.816 -3.750 -3.871) 11.199 7.134 ( 3.733 -1.369 2.074) 4.485 7.353 ( -3.841 6.614 -10.638) 13.103 7.782 ( 2.752 10.852 7.193) 13.307 7.861 ( -13.330 -2.923 -9.739) 16.766 8.199 ( 2.267 7.753 3.380) 8.756 8.623 ( 3.967 1.823 1.263) 4.545 8.674 ( 8.583 -1.933 -6.822) 11.133 8.786 ( -1.994 6.423 5.627) 8.769 9.093 ( -0.214 1.730 -1.047) 2.033 9.407 ( 1.977 -0.396 2.230) 3.006 9.844 ( -5.078 -4.830 -6.869) 9.813 9.959 ( 1.283 -2.587 1.447) 3.229 10.277 ( -2.907 2.035 17.740) 18.092 10.481 ( 0.875 0.617 -8.351) 8.420 10.633 ( 3.231 -7.828 6.203) 10.498 11.104 ( -1.573 -1.125 3.582) 4.070 11.330 ( 0.015 8.466 -3.706) 9.241 11.636 ( -2.861 -0.305 -7.755) 8.272 11.977 ( 8.289 -4.189 0.078) 9.287 12.151 ( -0.697 -1.512 -0.363) 1.704 12.221 ( 3.522 -2.687 -6.973) 8.261 12.379 ( -1.132 -3.037 9.290) 9.839 12.805 ( -11.552 6.779 -9.541) 16.445 13.202 ( 2.239 -4.072 -1.162) 4.790 13.449 ( -1.762 -1.571 -2.129) 3.179 13.800 ( 1.603 -2.550 -10.517) 10.940 13.891 ( -2.745 -4.217 17.426) 18.138 14.070 ( -0.111 6.104 -3.919) 7.254 14.551 ( -7.551 -4.243 10.883) 13.908 16.063 ( 4.050 5.128 -9.912) 11.873 16.657 ( 0.836 -0.959 -1.595) 2.041 16.945 ( -1.519 0.119 -0.818) 1.729 17.590 ( -0.212 -2.210 -1.573) 2.721 19.608 ( -0.502 0.378 -0.306) 0.699 19.701 ( 0.002 -0.091 0.774) 0.779 20.685 ( 0.977 -0.792 -0.544) 1.370 21.121 ( -2.284 -4.662 2.250) 5.658 22.487 ( -1.175 1.358 -2.151) 2.802 22.762 ( 2.038 -0.512 -0.062) 2.102 23.198 ( 9.108 10.021 3.821) 14.071 23.304 ( -1.399 -2.458 0.024) 2.828 24.209 ( -1.422 2.231 -1.378) 2.983 24.469 ( -0.795 -0.081 1.429) 1.637 24.735 ( 0.900 0.968 -1.022) 1.671 25.926 ( -1.764 -2.789 5.665) 6.556 ======================= Grid point 4 (5/186) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.511 ( -0.000 0.000 0.000) 0.000 2.518 ( 0.000 -0.000 -0.000) 0.000 2.840 ( 0.000 -0.000 0.000) 0.000 2.971 ( 0.000 -0.000 0.000) 0.000 3.935 ( 0.000 -0.000 0.000) 0.000 4.698 ( 0.000 -0.000 0.000) 0.000 4.865 ( -0.000 0.000 -0.000) 0.000 5.508 ( 0.000 -0.000 -0.000) 0.000 5.600 ( -0.000 0.000 0.000) 0.000 5.738 ( -0.000 -0.000 -0.000) 0.000 5.758 ( 0.000 -0.000 0.000) 0.000 6.158 ( 0.000 -0.000 0.000) 0.000 6.601 ( -0.000 -0.000 -0.000) 0.000 6.930 ( 0.000 0.000 0.000) 0.000 6.989 ( -0.000 -0.000 0.000) 0.000 7.190 ( 0.000 -0.000 0.000) 0.000 7.255 ( -0.000 0.000 0.000) 0.000 7.747 ( 0.000 0.000 0.000) 0.000 7.748 ( -0.000 -0.000 -0.000) 0.000 8.161 ( 0.000 -0.000 -0.000) 0.000 8.637 ( 0.000 -0.000 0.000) 0.000 8.699 ( 0.000 -0.000 0.000) 0.000 8.781 ( 0.000 -0.000 -0.000) 0.000 9.073 ( -0.000 -0.000 -0.000) 0.000 9.434 ( 0.000 -0.000 0.000) 0.000 9.836 ( 0.000 -0.000 -0.000) 0.000 9.992 ( 0.000 -0.000 0.000) 0.000 10.255 ( 0.000 -0.000 0.000) 0.000 10.459 ( 0.000 -0.000 -0.000) 0.000 10.745 ( 0.000 -0.000 0.000) 0.000 11.090 ( 0.000 -0.000 0.000) 0.000 11.268 ( 0.000 -0.000 0.000) 0.000 11.606 ( 0.000 -0.000 -0.000) 0.000 12.061 ( -0.000 -0.000 -0.000) 0.000 12.159 ( 0.000 -0.000 0.000) 0.000 12.262 ( 0.000 -0.000 0.000) 0.000 12.495 ( 0.000 -0.000 0.000) 0.000 12.568 ( -0.000 0.000 -0.000) 0.000 13.251 ( -0.000 -0.000 0.000) 0.000 13.444 ( 0.000 -0.000 0.000) 0.000 13.814 ( 0.000 -0.000 -0.000) 0.000 13.959 ( -0.000 -0.000 0.000) 0.000 13.985 ( 0.000 0.000 -0.000) 0.000 14.544 ( 0.000 -0.000 0.000) 0.000 16.040 ( 0.000 -0.000 -0.000) 0.000 16.667 ( 0.000 -0.000 0.000) 0.000 16.933 ( 0.000 -0.000 0.000) 0.000 17.602 ( 0.000 -0.000 0.000) 0.000 19.601 ( 0.000 -0.000 0.000) 0.000 19.703 ( 0.000 -0.000 0.000) 0.000 20.696 ( 0.000 -0.000 -0.000) 0.000 21.143 ( 0.000 -0.000 0.000) 0.000 22.466 ( 0.000 -0.000 0.000) 0.000 22.780 ( 0.000 -0.000 0.000) 0.000 23.191 ( 0.000 0.000 0.000) 0.000 23.313 ( -0.000 -0.000 -0.000) 0.000 24.181 ( 0.000 -0.000 0.000) 0.000 24.467 ( 0.000 -0.000 0.000) 0.000 24.732 ( -0.000 -0.000 -0.000) 0.000 25.942 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 10 (6/186) ======================= q-point: ( 0.12 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.982 ( 33.634 0.000 16.961) 37.669 1.000 ( 33.775 0.000 20.607) 39.565 1.948 ( 67.931 0.000 21.654) 71.299 3.372 ( 4.060 0.000 -0.674) 4.116 3.432 ( -1.958 -0.000 -2.837) 3.447 4.697 ( -11.166 -0.000 -5.769) 12.568 5.248 ( -17.413 -0.000 -6.426) 18.561 5.464 ( -0.051 -0.000 5.687) 5.687 5.531 ( 4.691 0.000 -2.469) 5.301 5.624 ( 2.740 0.000 0.141) 2.743 5.814 ( -4.799 -0.000 -5.401) 7.225 6.154 ( -7.871 -0.000 4.476) 9.054 6.597 ( 14.412 0.000 -9.395) 17.204 6.619 ( 13.793 0.000 1.266) 13.851 7.160 ( 6.064 0.000 -2.759) 6.662 7.357 ( -16.744 -0.000 7.243) 18.244 7.853 ( -6.894 -0.000 -15.577) 17.034 7.947 ( -11.072 -0.000 -9.663) 14.695 8.183 ( 0.336 0.000 5.739) 5.749 8.472 ( 13.031 0.000 -1.857) 13.162 8.490 ( -8.301 -0.000 3.408) 8.973 8.609 ( -5.875 -0.000 8.690) 10.490 9.223 ( -1.614 -0.000 9.901) 10.031 9.367 ( -2.038 -0.000 -7.060) 7.348 9.530 ( -0.261 -0.000 0.870) 0.909 9.850 ( -2.722 -0.000 9.168) 9.564 9.966 ( 2.008 0.000 -21.768) 21.861 10.165 ( 2.642 0.000 -3.182) 4.136 10.277 ( 3.729 0.000 24.847) 25.125 10.409 ( 2.773 0.000 -5.009) 5.725 11.253 ( -9.314 -0.000 -10.228) 13.834 11.259 ( -8.530 -0.000 1.229) 8.618 11.732 ( -6.376 -0.000 -2.377) 6.805 11.846 ( 3.965 0.000 17.712) 18.151 11.892 ( 14.666 0.000 -21.496) 26.023 12.202 ( 3.998 0.000 15.868) 16.364 12.512 ( -1.198 -0.000 -8.282) 8.369 12.740 ( 1.348 0.000 -26.604) 26.638 13.022 ( 7.085 0.000 3.461) 7.885 13.306 ( -3.893 -0.000 -23.236) 23.560 13.658 ( -1.726 -0.000 4.052) 4.404 13.843 ( 1.062 0.000 22.918) 22.943 14.220 ( -5.521 -0.000 36.360) 36.777 14.241 ( 0.222 0.000 -4.013) 4.019 16.378 ( 6.424 0.000 -49.798) 50.211 16.597 ( 3.455 0.000 -4.548) 5.712 16.937 ( -5.593 -0.000 -1.099) 5.700 17.429 ( 6.573 0.000 0.687) 6.608 19.637 ( -1.344 -0.000 1.874) 2.306 19.695 ( 0.094 0.000 1.417) 1.420 20.614 ( 1.169 0.000 0.466) 1.259 20.885 ( 5.734 0.000 7.395) 9.357 22.563 ( -1.977 -0.000 -4.037) 4.495 22.722 ( 1.995 0.000 1.377) 2.424 23.166 ( -6.730 -0.000 1.385) 6.871 23.933 ( 2.085 0.000 -14.054) 14.208 24.323 ( -1.860 -0.000 -2.961) 3.497 24.533 ( -4.007 -0.000 3.138) 5.089 24.728 ( -3.877 -0.000 -2.057) 4.389 25.694 ( -0.451 -0.000 43.803) 43.806 ======================= Grid point 11 (7/186) ======================= q-point: ( 0.25 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.413 ( 31.071 -5.948 11.494) 33.659 1.700 ( 31.085 -19.256 16.887) 40.277 2.903 ( 45.401 -9.137 15.936) 48.977 3.382 ( 6.354 2.979 0.669) 7.049 3.451 ( 7.349 -0.031 0.637) 7.376 4.531 ( -11.056 1.427 -6.030) 12.674 5.043 ( -17.427 -9.455 -1.636) 19.894 5.385 ( -1.222 16.694 -1.106) 16.776 5.586 ( -2.866 0.844 -2.338) 3.794 5.642 ( 7.175 2.794 0.402) 7.711 5.719 ( 1.182 -6.125 -0.495) 6.257 6.262 ( -5.902 -19.841 3.171) 20.942 6.572 ( 3.556 8.526 0.468) 9.250 6.904 ( 8.368 -9.341 -6.862) 14.295 7.079 ( -16.365 3.758 2.527) 16.980 7.281 ( 13.938 9.224 -0.463) 16.720 7.660 ( -12.547 10.548 -14.670) 21.998 7.731 ( -10.964 -2.007 -12.971) 17.103 8.107 ( -3.166 8.951 8.274) 12.594 8.379 ( -5.263 0.699 0.036) 5.309 8.586 ( -1.528 -4.456 -1.054) 4.827 8.639 ( 1.714 -4.045 3.938) 5.900 9.054 ( 3.846 16.793 5.089) 17.964 9.388 ( 1.152 -1.148 1.527) 2.231 9.492 ( 7.050 13.418 -6.766) 16.599 9.780 ( -3.579 5.536 3.520) 7.473 9.881 ( 1.290 -0.245 -4.108) 4.313 10.228 ( -2.856 -4.668 5.649) 7.865 10.396 ( 2.553 -3.120 16.215) 16.709 10.476 ( 7.227 -2.268 -2.504) 7.978 11.080 ( -9.234 0.408 4.153) 10.133 11.312 ( -10.110 -12.156 -14.164) 21.227 11.686 ( -4.213 -8.974 -9.487) 13.721 11.832 ( 3.940 9.371 10.942) 14.935 12.064 ( 7.781 -4.010 -5.907) 10.560 12.306 ( 6.491 2.136 16.582) 17.935 12.362 ( 2.105 7.536 -10.594) 13.171 12.831 ( -10.186 -8.930 -11.919) 18.043 13.129 ( 7.011 -0.822 0.496) 7.077 13.272 ( -0.622 -8.111 -18.361) 20.082 13.675 ( -0.005 -3.154 1.690) 3.578 13.887 ( -0.632 1.502 19.629) 19.696 14.206 ( -0.062 2.922 -0.491) 2.963 14.308 ( -4.226 -8.596 13.662) 16.685 16.271 ( 1.994 7.412 -24.081) 25.275 16.634 ( 3.157 -0.454 -4.571) 5.574 16.889 ( -5.318 -3.343 -2.012) 6.596 17.531 ( 5.565 -1.562 -0.043) 5.780 19.621 ( -1.137 0.398 1.411) 1.855 19.699 ( 0.201 -0.024 0.375) 0.426 20.652 ( 1.682 -1.324 2.457) 3.258 21.011 ( 6.530 -2.372 6.759) 9.693 22.519 ( -2.509 0.734 -2.964) 3.952 22.750 ( 1.876 -0.225 -0.423) 1.936 23.088 ( -10.188 -3.628 1.596) 10.932 23.781 ( 6.716 18.000 -5.880) 20.092 24.276 ( -2.321 1.625 -3.925) 4.841 24.472 ( -2.254 1.449 3.538) 4.438 24.701 ( -4.477 -3.668 -3.370) 6.697 25.832 ( 2.191 -3.298 21.316) 21.681 ======================= Grid point 12 (8/186) ======================= q-point: ( 0.38 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.969 ( 26.283 -15.444 5.189) 30.923 2.382 ( 28.733 -15.970 13.080) 35.379 3.043 ( -4.887 7.875 -2.591) 9.624 3.305 ( -0.574 16.565 7.083) 18.025 3.943 ( 22.861 -4.572 3.049) 23.512 4.423 ( 5.562 -5.902 5.467) 9.780 5.046 ( -11.179 -0.076 -6.839) 13.105 5.143 ( -1.505 -7.428 3.227) 8.237 5.550 ( 1.396 1.477 -1.333) 2.430 5.740 ( 4.188 -1.262 -0.680) 4.427 5.826 ( 3.388 -3.276 -2.272) 5.232 6.328 ( -5.981 6.765 2.942) 9.497 6.610 ( -7.315 -19.988 7.781) 22.662 6.844 ( -7.799 2.317 1.975) 8.372 6.971 ( -2.243 10.814 -12.077) 16.366 7.193 ( -2.671 5.700 -6.036) 8.721 7.403 ( -1.073 6.619 -12.779) 14.432 7.606 ( -8.102 -2.078 -11.065) 13.871 7.972 ( -0.491 8.431 10.511) 13.484 8.323 ( -0.124 3.176 3.329) 4.603 8.607 ( -4.064 -4.364 -3.688) 7.012 8.710 ( 0.715 -3.435 1.070) 3.668 8.916 ( 1.540 11.561 6.522) 13.363 9.305 ( 6.725 16.871 0.025) 18.162 9.483 ( 9.158 3.182 -3.654) 10.361 9.708 ( -2.955 -2.245 -5.642) 6.753 9.917 ( -0.849 -3.710 0.912) 3.914 10.252 ( -5.532 -3.433 14.783) 16.153 10.513 ( 2.596 0.681 5.372) 6.005 10.567 ( 2.842 -5.596 -2.173) 6.642 11.042 ( -5.327 -6.748 11.084) 14.027 11.226 ( -8.197 -0.508 -18.202) 19.969 11.759 ( 2.678 6.932 5.283) 9.118 11.810 ( -3.406 -12.651 -8.758) 15.759 12.192 ( 5.601 -0.599 5.675) 7.996 12.325 ( 3.662 -2.108 -9.325) 10.237 12.381 ( 6.030 4.353 12.480) 14.528 12.697 ( -9.161 2.899 -7.512) 12.197 13.225 ( 6.310 -1.801 -6.875) 9.504 13.355 ( -0.458 -6.406 -4.395) 7.782 13.748 ( 2.626 -4.272 -2.257) 5.499 13.893 ( -1.833 0.977 15.458) 15.597 14.148 ( 0.327 5.123 -1.333) 5.304 14.401 ( -3.252 -8.365 4.899) 10.225 16.135 ( -1.518 6.072 -9.541) 11.411 16.663 ( 2.349 -0.147 -4.622) 5.187 16.876 ( -3.937 -3.849 -1.425) 5.687 17.606 ( 4.495 0.183 0.214) 4.504 19.607 ( -0.639 0.313 1.091) 1.303 19.702 ( 0.172 -0.013 -0.124) 0.212 20.692 ( 1.253 -0.312 3.680) 3.900 21.138 ( 7.679 -0.259 4.537) 8.923 22.471 ( -2.505 0.303 -0.992) 2.711 22.772 ( 1.004 -0.427 -1.648) 1.976 23.002 ( -13.610 -5.646 0.518) 14.744 23.642 ( 8.566 14.536 -2.827) 17.107 24.212 ( -1.768 1.832 -3.135) 4.039 24.455 ( -0.946 -0.432 1.839) 2.112 24.683 ( -4.875 -3.620 -2.975) 6.762 25.933 ( 3.277 -0.574 10.472) 10.988 ======================= Grid point 13 (9/186) ======================= q-point: ( 0.50 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.479 ( 14.215 -10.848 1.513) 17.946 2.721 ( -1.112 17.604 -0.980) 17.666 2.931 ( 9.370 3.975 3.016) 10.616 3.059 ( 6.241 7.053 10.623) 14.197 3.879 ( -12.336 4.258 2.632) 13.313 4.819 ( -3.059 -2.056 0.546) 3.726 4.850 ( 15.753 4.276 -6.855) 17.704 5.372 ( -2.549 -13.463 3.752) 14.207 5.581 ( 3.299 -4.051 -3.406) 6.236 5.740 ( -0.448 2.884 -1.769) 3.413 5.836 ( 2.636 4.394 2.476) 5.691 6.171 ( -4.535 3.627 2.731) 6.417 6.624 ( -5.050 7.212 -2.249) 9.087 6.719 ( -11.534 -9.053 -2.237) 14.832 6.972 ( 3.417 -13.753 2.779) 14.441 7.154 ( -4.319 -0.509 -5.750) 7.210 7.267 ( 0.153 3.606 -3.633) 5.121 7.528 ( -4.834 -2.853 -9.765) 11.263 7.916 ( 1.563 3.161 5.151) 6.242 8.290 ( 4.111 8.333 8.513) 12.602 8.581 ( -5.747 -2.083 -4.974) 7.880 8.755 ( 1.318 -1.011 -3.762) 4.113 8.784 ( -2.218 8.111 9.279) 12.522 9.201 ( 6.555 10.660 0.271) 12.517 9.483 ( 1.611 5.382 -3.424) 6.579 9.789 ( 6.047 -7.731 -7.036) 12.077 9.945 ( -2.771 -3.715 -2.756) 5.392 10.253 ( -5.495 -0.827 19.457) 20.235 10.474 ( 1.829 3.702 -5.704) 7.042 10.706 ( 0.713 -6.176 -0.671) 6.254 11.085 ( -2.545 1.364 -10.381) 10.775 11.121 ( -5.545 -7.274 5.327) 10.585 11.725 ( 3.087 4.652 12.681) 13.856 11.877 ( -6.861 -8.546 -12.053) 16.291 12.239 ( 5.948 4.517 -0.340) 7.477 12.362 ( -1.172 2.204 14.112) 14.331 12.435 ( -2.619 -0.821 -9.536) 9.923 12.616 ( 8.439 -2.033 1.970) 8.901 13.292 ( 4.247 0.966 -5.095) 6.703 13.405 ( -0.740 -3.602 -1.780) 4.086 13.817 ( 1.459 -0.647 0.286) 1.621 13.919 ( 0.568 -3.160 8.826) 9.392 14.069 ( 0.693 6.410 -1.665) 6.659 14.491 ( 0.974 -6.962 -3.079) 7.675 16.024 ( -4.617 2.240 -0.072) 5.133 16.677 ( 1.636 0.419 -3.527) 3.910 16.886 ( -2.373 -3.856 -0.629) 4.571 17.646 ( 3.762 1.788 1.039) 4.293 19.602 ( -0.055 -0.011 1.177) 1.179 19.703 ( 0.122 0.046 -0.676) 0.689 20.707 ( 0.168 0.908 3.689) 3.802 21.235 ( 9.350 3.255 2.126) 10.126 22.449 ( -2.127 -1.352 1.186) 2.786 22.771 ( -1.417 0.098 -1.150) 1.827 22.895 ( -15.875 -7.209 -2.787) 17.656 23.570 ( 8.103 10.998 -1.674) 13.763 24.177 ( -0.359 0.046 -1.591) 1.632 24.456 ( -0.889 -0.883 -0.194) 1.268 24.667 ( -4.442 -3.739 -1.510) 6.000 25.988 ( 3.706 1.696 4.038) 5.737 ======================= Grid point 14 (10/186) ======================= q-point: (-0.38 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.214 ( -15.935 25.268 -3.374) 30.063 2.386 ( -2.240 33.476 8.817) 34.690 3.093 ( 13.022 -9.324 1.010) 16.047 3.279 ( 12.632 0.547 -1.123) 12.693 3.582 ( -19.373 17.339 1.108) 26.023 4.680 ( 1.981 1.514 -10.466) 10.759 4.927 ( -0.311 1.559 2.986) 3.383 5.361 ( -6.438 1.167 0.926) 6.608 5.674 ( 1.590 -1.092 -5.652) 5.972 5.772 ( -1.355 -1.202 3.871) 4.274 5.842 ( 9.224 1.686 2.360) 9.669 6.119 ( -3.231 -2.582 1.523) 4.408 6.604 ( -15.271 -3.028 -5.017) 16.356 6.670 ( 1.980 -8.003 0.650) 8.269 7.093 ( -0.436 -4.706 -2.325) 5.267 7.198 ( 10.407 0.576 -2.704) 10.768 7.330 ( 1.039 -8.523 10.797) 13.795 7.528 ( -3.665 -8.667 -6.955) 11.701 7.974 ( 2.293 -6.949 0.855) 7.367 8.207 ( -1.701 9.080 7.192) 11.707 8.507 ( -5.009 -1.363 -5.862) 7.830 8.684 ( -1.883 7.046 10.957) 13.162 8.775 ( 3.363 0.013 -3.696) 4.997 9.156 ( 3.576 5.250 -2.746) 6.921 9.404 ( -2.211 3.515 -2.134) 4.668 9.946 ( -1.530 -2.302 -3.079) 4.137 9.959 ( 7.547 -1.932 0.454) 7.804 10.239 ( -1.384 -0.175 2.580) 2.933 10.464 ( -1.186 -1.753 2.703) 3.433 10.671 ( -2.153 5.800 -9.692) 11.498 11.115 ( -2.933 -0.108 4.279) 5.189 11.127 ( -0.989 -10.685 -5.902) 12.246 11.751 ( -2.048 2.295 6.148) 6.875 11.834 ( -3.728 -2.800 4.038) 6.168 12.213 ( 0.952 4.554 -1.739) 4.967 12.316 ( -1.115 4.550 7.434) 8.787 12.410 ( 4.457 1.347 -6.642) 8.111 12.840 ( 7.693 -7.772 5.514) 12.247 13.274 ( 1.274 4.569 0.805) 4.811 13.447 ( 0.969 -3.244 -4.575) 5.691 13.816 ( -1.231 0.763 4.166) 4.411 13.982 ( 0.942 6.751 -2.468) 7.250 14.021 ( 2.780 -4.535 4.397) 6.901 14.625 ( 9.248 -5.883 -10.998) 15.528 15.953 ( -7.647 -1.898 7.353) 10.777 16.675 ( 0.792 1.394 -1.578) 2.249 16.918 ( -0.861 -3.810 -0.221) 3.912 17.664 ( 3.658 2.835 2.239) 5.142 19.611 ( 0.442 -0.371 1.443) 1.554 19.701 ( 0.055 0.136 -1.289) 1.297 20.690 ( -1.023 1.648 2.361) 3.056 21.311 ( 13.220 6.792 2.297) 15.039 22.447 ( -5.819 -4.190 1.340) 7.295 22.710 ( -9.577 -1.753 -0.673) 9.759 22.796 ( -10.240 -5.182 -5.979) 12.941 23.520 ( 6.147 9.482 -1.047) 11.349 24.196 ( 1.152 -2.178 0.074) 2.465 24.459 ( -0.640 -1.619 -1.760) 2.475 24.663 ( -3.805 -3.403 -0.096) 5.106 26.006 ( 3.899 3.256 -0.450) 5.100 ======================= Grid point 15 (11/186) ======================= q-point: (-0.25 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.592 ( -15.340 31.591 -2.924) 35.240 1.861 ( 0.962 42.200 11.374) 43.716 2.776 ( -21.909 46.636 -14.988) 53.661 3.332 ( 4.861 -3.907 1.198) 6.350 3.382 ( 4.197 0.629 -0.099) 4.245 4.820 ( 8.750 -5.082 4.963) 11.270 4.962 ( -2.065 -11.282 -2.562) 11.752 5.280 ( -4.286 -0.855 0.231) 4.376 5.671 ( 4.202 2.526 -2.972) 5.734 5.754 ( -2.133 0.898 -0.165) 2.320 5.941 ( 10.041 5.260 3.717) 11.929 6.096 ( -5.991 -1.747 0.205) 6.244 6.342 ( -18.699 2.605 -0.710) 18.893 6.889 ( 2.068 -15.087 -1.984) 15.357 7.061 ( 0.144 11.132 -1.833) 11.283 7.358 ( 12.288 -6.745 -1.356) 14.083 7.544 ( 0.379 -12.982 9.371) 16.015 7.649 ( -2.692 -15.583 -2.340) 15.986 8.024 ( -6.434 3.487 -4.290) 8.483 8.155 ( 3.867 -4.510 4.520) 7.465 8.415 ( -7.413 4.080 -2.239) 8.752 8.633 ( 3.423 3.551 8.969) 10.236 8.835 ( 1.378 -5.213 -6.485) 8.434 9.115 ( 0.657 3.944 -1.676) 4.335 9.354 ( -2.198 -2.437 0.536) 3.326 9.946 ( 1.063 1.943 -0.093) 2.217 10.032 ( 4.983 3.745 11.339) 12.939 10.204 ( -1.842 1.331 -17.523) 17.669 10.475 ( -2.029 0.701 4.793) 5.252 10.544 ( -0.709 5.172 -3.726) 6.414 11.074 ( -3.476 -2.134 -0.333) 4.093 11.288 ( 2.715 -9.799 -4.585) 11.154 11.614 ( -9.368 2.029 1.831) 9.758 11.920 ( 5.209 -0.376 11.744) 12.852 12.158 ( -1.422 1.734 -2.580) 3.418 12.268 ( 0.717 4.436 5.600) 7.180 12.418 ( 3.883 4.262 -6.283) 8.527 12.963 ( -0.596 -0.230 2.892) 2.961 13.286 ( 4.245 -2.195 4.109) 6.302 13.495 ( 1.410 -2.835 -2.992) 4.356 13.796 ( -1.377 0.949 4.343) 4.654 13.893 ( 0.741 6.649 -2.890) 7.288 14.121 ( 1.395 -4.313 3.208) 5.553 14.858 ( 19.407 -5.923 -16.340) 26.052 15.902 ( -11.375 -4.236 13.438) 18.108 16.649 ( -0.106 2.553 0.120) 2.558 16.964 ( 0.059 -3.384 -0.073) 3.385 17.681 ( 4.150 2.741 3.421) 6.037 19.629 ( 0.598 -0.582 1.503) 1.720 19.695 ( -0.011 0.209 -1.684) 1.697 20.652 ( -1.373 1.672 0.661) 2.262 21.437 ( 23.410 8.962 7.232) 26.089 22.339 ( -28.730 -9.805 -7.999) 31.393 22.628 ( -3.188 -0.664 0.375) 3.278 22.734 ( -4.765 -1.377 -3.772) 6.232 23.452 ( 3.229 8.681 -0.572) 9.280 24.256 ( 1.331 -3.279 0.858) 3.641 24.486 ( 1.003 -2.854 -1.943) 3.595 24.656 ( -3.463 -2.209 0.459) 4.133 26.002 ( 3.805 3.597 -2.979) 6.024 ======================= Grid point 16 (12/186) ======================= q-point: (-0.12 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.989 ( -0.000 35.452 0.000) 35.452 1.289 ( -0.000 44.964 0.000) 44.964 1.792 ( -0.000 60.990 0.000) 60.990 3.372 ( -0.000 2.588 0.000) 2.588 3.419 ( 0.000 -3.455 -0.000) 3.455 4.917 ( 0.000 -0.401 -0.000) 0.401 5.154 ( 0.000 -11.706 -0.000) 11.706 5.310 ( 0.000 -9.589 -0.000) 9.589 5.685 ( -0.000 3.118 0.000) 3.118 5.699 ( -0.000 1.965 0.000) 1.965 5.946 ( -0.000 10.589 0.000) 10.589 6.069 ( 0.000 -3.953 -0.000) 3.953 6.143 ( 0.000 -0.045 -0.000) 0.045 6.841 ( -0.000 18.287 0.000) 18.287 7.123 ( 0.000 -15.608 -0.000) 15.608 7.605 ( 0.000 -6.377 -0.000) 6.377 7.706 ( 0.000 -16.745 -0.000) 16.745 7.787 ( 0.000 -3.422 -0.000) 3.422 7.961 ( 0.000 -7.427 -0.000) 7.427 8.207 ( -0.000 4.343 0.000) 4.343 8.256 ( -0.000 7.414 0.000) 7.414 8.660 ( 0.000 -1.012 -0.000) 1.012 8.869 ( -0.000 1.889 0.000) 1.889 9.139 ( 0.000 -10.076 -0.000) 10.076 9.408 ( 0.000 -5.226 -0.000) 5.226 9.911 ( -0.000 3.452 0.000) 3.452 10.038 ( -0.000 6.770 0.000) 6.770 10.117 ( 0.000 -0.370 -0.000) 0.370 10.375 ( -0.000 11.975 0.000) 11.975 10.489 ( -0.000 2.607 0.000) 2.607 11.099 ( 0.000 -4.038 -0.000) 4.038 11.421 ( 0.000 -6.678 -0.000) 6.678 11.546 ( 0.000 -2.804 -0.000) 2.804 11.972 ( -0.000 1.876 0.000) 1.876 12.123 ( -0.000 0.852 0.000) 0.852 12.238 ( -0.000 1.820 0.000) 1.820 12.349 ( -0.000 7.523 0.000) 7.523 12.926 ( -0.000 2.279 0.000) 2.279 13.393 ( 0.000 -5.092 -0.000) 5.092 13.546 ( 0.000 -3.281 -0.000) 3.281 13.780 ( -0.000 0.884 0.000) 0.884 13.804 ( -0.000 6.109 0.000) 6.109 14.190 ( 0.000 -3.691 -0.000) 3.691 15.157 ( 0.000 -10.540 -0.000) 10.540 15.844 ( 0.000 -1.147 -0.000) 1.147 16.607 ( -0.000 3.037 0.000) 3.037 17.006 ( 0.000 -2.302 -0.000) 2.302 17.703 ( -0.000 0.819 0.000) 0.819 19.645 ( 0.000 -0.555 -0.000) 0.555 19.688 ( -0.000 0.228 0.000) 0.228 20.622 ( -0.000 1.087 0.000) 1.087 21.734 ( -0.000 2.918 0.000) 2.918 21.965 ( 0.000 -2.319 -0.000) 2.319 22.621 ( -0.000 0.376 0.000) 0.376 22.705 ( 0.000 -0.603 -0.000) 0.603 23.361 ( -0.000 7.157 0.000) 7.157 24.311 ( 0.000 -2.876 -0.000) 2.876 24.545 ( 0.000 -3.333 -0.000) 3.333 24.644 ( 0.000 -0.563 -0.000) 0.563 25.988 ( -0.000 2.280 0.000) 2.280 ======================= Grid point 19 (13/186) ======================= q-point: ( 0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.888 ( 29.328 0.000 14.456) 32.697 1.934 ( 30.054 0.000 18.880) 35.492 3.238 ( 2.490 0.000 -4.536) 5.175 3.561 ( 10.397 0.000 -0.044) 10.397 3.772 ( 46.489 0.000 18.246) 49.941 4.434 ( -3.360 -0.000 -4.526) 5.637 4.696 ( -20.092 -0.000 -0.411) 20.096 5.535 ( -6.186 -0.000 -4.183) 7.467 5.623 ( -0.757 -0.000 -2.000) 2.138 5.642 ( 9.052 0.000 -0.801) 9.088 5.772 ( 5.817 0.000 -0.495) 5.838 5.937 ( -9.653 -0.000 6.720) 11.762 6.587 ( -14.951 -0.000 8.512) 17.204 6.930 ( -11.560 -0.000 2.081) 11.746 6.967 ( 14.946 0.000 -12.617) 19.560 7.480 ( -6.610 -0.000 -11.969) 13.673 7.513 ( -11.147 -0.000 -15.998) 19.499 7.590 ( 2.397 0.000 -10.174) 10.453 8.178 ( 0.307 0.000 8.182) 8.188 8.257 ( -9.915 -0.000 0.190) 9.916 8.452 ( -8.431 -0.000 7.670) 11.398 8.636 ( 2.118 0.000 -5.895) 6.264 9.203 ( -4.845 -0.000 6.684) 8.256 9.428 ( 4.955 0.000 -0.174) 4.958 9.609 ( 9.956 0.000 -4.850) 11.074 9.811 ( -4.265 -0.000 13.533) 14.189 9.925 ( 0.698 0.000 -12.805) 12.824 10.155 ( -1.625 -0.000 2.195) 2.731 10.503 ( 4.034 0.000 23.108) 23.458 10.548 ( 6.013 0.000 -6.626) 8.947 10.969 ( -8.343 -0.000 -6.952) 10.859 11.049 ( -6.407 -0.000 4.684) 7.937 11.547 ( -2.386 -0.000 -10.415) 10.685 11.930 ( -3.309 -0.000 10.331) 10.848 12.098 ( 5.257 0.000 -3.236) 6.173 12.417 ( 5.196 0.000 0.994) 5.290 12.468 ( 0.087 0.000 -4.561) 4.562 12.684 ( 0.922 0.000 1.089) 1.427 13.135 ( 1.174 0.000 -16.217) 16.259 13.251 ( 7.349 0.000 0.167) 7.351 13.680 ( 3.311 0.000 2.954) 4.437 13.925 ( -2.076 -0.000 14.271) 14.421 14.227 ( -0.080 -0.000 -1.818) 1.819 14.245 ( -0.461 -0.000 5.206) 5.227 16.263 ( -2.750 -0.000 -17.388) 17.604 16.663 ( 3.013 0.000 -3.962) 4.978 16.787 ( -5.062 -0.000 -1.004) 5.160 17.609 ( 6.534 0.000 0.440) 6.549 19.612 ( -1.084 -0.000 1.748) 2.057 19.702 ( 0.274 0.000 -0.360) 0.452 20.685 ( 2.617 0.000 6.078) 6.618 21.134 ( 10.831 0.000 6.156) 12.459 22.477 ( -3.888 -0.000 -1.481) 4.160 22.764 ( 1.226 0.000 -2.520) 2.802 22.922 ( -11.933 -0.000 1.726) 12.058 23.907 ( 0.274 0.000 -8.410) 8.414 24.244 ( -2.382 -0.000 -4.431) 5.030 24.475 ( -1.297 -0.000 3.343) 3.586 24.574 ( -6.565 -0.000 -3.432) 7.408 25.921 ( 5.453 0.000 16.913) 17.770 ======================= Grid point 20 (14/186) ======================= q-point: ( 0.38 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.233 ( 26.143 -0.369 10.454) 28.158 2.522 ( 24.712 -17.049 16.325) 34.174 3.139 ( -1.912 9.445 -5.092) 10.899 3.610 ( 9.114 13.469 4.174) 16.790 4.026 ( -9.513 8.626 -2.874) 13.159 4.657 ( 1.811 -12.021 1.671) 12.271 4.707 ( 28.856 -13.840 10.382) 33.645 5.247 ( -6.882 17.945 0.318) 19.222 5.577 ( 1.729 1.619 -4.463) 5.053 5.789 ( 5.328 -1.383 0.942) 5.585 5.849 ( 7.480 -2.265 -2.958) 8.356 6.109 ( -5.994 -23.353 4.525) 24.531 6.356 ( -17.069 2.117 10.796) 20.307 6.783 ( -7.797 3.367 2.194) 8.771 7.042 ( -2.504 4.765 -16.815) 17.656 7.173 ( -12.559 7.065 -12.015) 18.762 7.373 ( -0.641 2.527 -9.359) 9.716 7.558 ( -3.086 3.443 -14.994) 15.690 8.071 ( -4.861 5.875 3.790) 8.516 8.328 ( 4.692 -5.300 10.093) 12.327 8.421 ( -7.091 -7.136 3.044) 10.511 8.674 ( 1.923 -3.041 -2.597) 4.437 9.055 ( -8.443 7.805 3.986) 12.169 9.472 ( 2.547 1.729 -0.093) 3.080 9.698 ( 9.894 6.686 -6.741) 13.712 9.730 ( -1.534 4.951 -2.048) 5.573 9.906 ( 2.263 1.792 -1.416) 3.215 10.177 ( -1.988 -1.890 10.192) 10.554 10.482 ( -0.106 -0.813 2.683) 2.806 10.677 ( 5.963 4.707 7.328) 10.555 10.844 ( -7.955 -7.280 4.677) 11.754 11.117 ( -1.070 -5.017 -4.068) 6.547 11.574 ( -0.269 -9.127 -9.969) 13.519 11.861 ( -3.828 3.693 5.668) 7.773 12.191 ( 2.585 -5.411 2.642) 6.553 12.400 ( 4.285 4.864 -7.685) 10.054 12.469 ( -1.197 0.453 -0.186) 1.293 12.687 ( -0.078 3.013 7.514) 8.096 13.183 ( 3.196 -6.238 -12.554) 14.378 13.348 ( 5.334 -0.530 1.839) 5.667 13.766 ( 6.332 -1.580 2.088) 6.852 13.911 ( -2.536 0.900 8.267) 8.694 14.203 ( -0.403 2.668 1.088) 2.909 14.291 ( 0.906 -5.010 -1.760) 5.387 16.141 ( -5.551 4.201 -7.900) 10.530 16.685 ( 2.323 0.324 -4.908) 5.440 16.759 ( -3.943 -4.106 -0.239) 5.698 17.683 ( 5.334 0.736 0.370) 5.397 19.604 ( -0.620 0.066 1.541) 1.663 19.704 ( 0.213 0.030 -0.645) 0.680 20.730 ( 1.966 0.582 6.898) 7.197 21.297 ( 13.018 1.152 4.218) 13.732 22.418 ( -5.379 -0.666 0.509) 5.444 22.768 ( -0.789 -0.169 -2.938) 3.046 22.780 ( -11.477 -1.668 -0.050) 11.597 23.841 ( 1.612 6.604 -5.572) 8.790 24.198 ( -1.781 0.877 -3.997) 4.463 24.445 ( -2.179 0.950 0.626) 2.458 24.538 ( -4.800 -4.985 -1.568) 7.096 26.022 ( 5.063 0.662 10.124) 11.339 ======================= Grid point 21 (15/186) ======================= q-point: ( 0.50 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.581 ( 14.518 -3.132 4.419) 15.495 2.880 ( -0.008 9.408 -2.076) 9.635 3.131 ( 21.313 -8.414 10.221) 25.091 3.412 ( 2.723 25.636 6.143) 26.502 3.774 ( -11.606 2.757 1.109) 11.980 4.706 ( -9.246 -0.072 -4.212) 10.161 5.078 ( 4.675 -2.714 -4.398) 6.969 5.268 ( 17.560 -3.393 10.129) 20.554 5.577 ( 1.412 0.035 -4.239) 4.468 5.807 ( -0.181 8.012 -1.387) 8.133 5.931 ( 7.568 -0.998 0.486) 7.649 6.121 ( -8.371 0.828 2.176) 8.688 6.418 ( -6.624 -17.145 8.399) 20.208 6.618 ( -11.318 3.916 -1.477) 12.067 6.782 ( -4.745 -1.651 -11.157) 12.236 7.090 ( -2.224 -4.732 -1.036) 5.331 7.338 ( 3.255 4.204 -8.417) 9.956 7.458 ( -0.176 0.501 -8.786) 8.802 7.944 ( -4.868 3.534 0.417) 6.030 8.343 ( -9.840 -1.062 4.924) 11.054 8.528 ( 5.791 -0.448 5.679) 8.123 8.749 ( 3.281 -3.319 -3.586) 5.885 8.848 ( -8.248 4.498 5.150) 10.713 9.423 ( 2.730 9.271 -1.265) 9.747 9.605 ( 1.488 10.016 -0.295) 10.130 9.752 ( 1.132 -5.053 -12.611) 13.633 9.916 ( 6.836 2.182 -5.352) 8.952 10.186 ( -5.055 -1.770 20.242) 20.938 10.587 ( 1.487 -6.056 -1.579) 6.433 10.604 ( 0.624 5.000 2.926) 5.827 10.942 ( -1.573 -7.754 -1.502) 8.053 11.101 ( -1.240 2.252 0.787) 2.688 11.669 ( -2.668 -7.972 -8.173) 11.725 11.805 ( -1.073 0.850 7.673) 7.794 12.286 ( -2.377 -3.547 2.118) 4.766 12.387 ( 4.508 3.743 -8.506) 10.329 12.440 ( 1.305 0.169 3.706) 3.933 12.689 ( 2.296 -0.664 6.310) 6.747 13.287 ( 3.537 -5.786 -11.422) 13.283 13.393 ( 1.291 1.656 4.496) 4.962 13.836 ( 0.051 0.740 2.526) 2.632 13.927 ( 3.094 -2.256 4.814) 6.151 14.149 ( -0.303 4.590 1.127) 4.736 14.401 ( 4.091 -7.677 -5.532) 10.309 15.989 ( -6.797 3.721 -0.762) 7.786 16.697 ( 1.950 0.228 -4.625) 5.025 16.782 ( -2.844 -5.271 0.470) 6.007 17.727 ( 3.916 1.652 0.646) 4.299 19.604 ( -0.082 -0.170 1.388) 1.401 19.704 ( 0.112 0.084 -0.856) 0.867 20.745 ( 0.712 2.001 5.204) 5.621 21.453 ( 14.704 3.422 2.874) 15.368 22.350 ( -9.658 -2.136 0.826) 9.926 22.649 ( -9.669 -1.557 0.329) 9.800 22.760 ( -0.865 -0.073 -4.184) 4.273 23.764 ( 2.943 7.163 -2.847) 8.251 24.167 ( -0.386 0.028 -2.274) 2.307 24.408 ( -3.800 -1.623 -1.854) 4.529 24.555 ( -2.271 -3.953 0.206) 4.563 26.080 ( 3.958 1.994 4.841) 6.564 ======================= Grid point 22 (16/186) ======================= q-point: (-0.38 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.422 ( -6.420 24.248 -1.504) 25.129 2.819 ( 6.552 20.118 3.912) 21.517 3.184 ( 1.803 3.735 -0.458) 4.173 3.456 ( 12.260 2.414 1.155) 12.549 3.633 ( -4.156 7.510 10.131) 13.278 4.574 ( -5.638 -3.032 -8.238) 10.433 5.091 ( 2.374 16.083 -2.869) 16.509 5.291 ( -4.478 -3.092 1.863) 5.752 5.595 ( -0.783 -4.288 -3.498) 5.589 5.778 ( 2.004 1.897 2.732) 3.884 5.942 ( -3.807 1.966 2.823) 5.131 6.108 ( 5.935 0.777 -0.089) 5.987 6.395 ( -6.936 -3.574 -5.551) 9.576 6.640 ( 2.065 -2.373 3.663) 4.829 6.858 ( -5.324 -19.805 -3.727) 20.844 7.231 ( 3.628 -7.932 9.867) 13.170 7.336 ( 4.375 -1.513 -7.119) 8.491 7.455 ( 2.137 1.599 -3.941) 4.759 7.893 ( -1.321 -3.937 0.338) 4.167 8.180 ( -11.833 2.596 -0.758) 12.138 8.522 ( -0.177 5.511 3.065) 6.309 8.774 ( -0.409 -0.236 6.747) 6.764 8.825 ( 3.595 1.622 -2.791) 4.832 9.312 ( 4.341 10.790 -4.467) 12.459 9.456 ( -3.187 9.819 0.645) 10.344 9.819 ( -1.878 -9.337 -5.140) 10.822 10.023 ( 9.062 -2.620 -7.295) 11.925 10.204 ( -5.096 -3.739 16.741) 17.895 10.494 ( 0.301 7.732 -0.098) 7.738 10.681 ( -0.378 -0.559 -5.254) 5.297 11.000 ( 1.796 -4.543 -7.745) 9.157 11.073 ( -3.559 -2.404 7.384) 8.542 11.666 ( -4.200 -0.794 -4.546) 6.239 11.855 ( 1.856 -3.214 9.857) 10.533 12.227 ( -3.462 2.621 -3.220) 5.406 12.377 ( 2.271 2.881 -2.972) 4.721 12.489 ( 3.088 1.032 4.397) 5.471 12.811 ( 3.157 -8.467 2.045) 9.265 13.345 ( 2.008 3.433 -5.145) 6.504 13.389 ( -0.645 -3.735 1.427) 4.049 13.815 ( -1.352 0.569 1.763) 2.293 14.016 ( 2.164 -2.889 3.985) 5.376 14.075 ( 0.061 5.743 -0.442) 5.761 14.586 ( 6.500 -10.499 -6.037) 13.745 15.871 ( -5.736 1.545 2.758) 6.549 16.700 ( 1.029 1.023 -2.095) 2.548 16.834 ( -1.242 -5.715 0.101) 5.849 17.745 ( 2.446 1.968 0.891) 3.263 19.613 ( 0.234 -0.516 1.097) 1.234 19.700 ( 0.014 0.185 -0.853) 0.873 20.721 ( -0.251 3.013 2.248) 3.767 21.616 ( 18.406 4.333 4.179) 19.366 22.185 ( -20.072 -1.836 -3.670) 20.487 22.602 ( -1.686 -1.550 1.551) 2.766 22.730 ( -1.675 0.449 -3.052) 3.510 23.693 ( 2.310 7.672 -1.036) 8.079 24.180 ( 0.813 -1.803 -0.396) 2.017 24.392 ( -2.741 -3.341 -1.931) 4.734 24.583 ( -1.213 -2.972 0.449) 3.241 26.094 ( 2.394 2.917 1.260) 3.979 ======================= Grid point 23 (17/186) ======================= q-point: (-0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.958 ( -0.000 32.699 0.000) 32.699 2.446 ( -0.000 35.597 0.000) 35.597 3.148 ( -0.000 16.724 0.000) 16.724 3.394 ( -0.000 15.493 0.000) 15.493 3.459 ( -0.000 4.477 0.000) 4.477 4.675 ( 0.000 -15.551 -0.000) 15.551 4.930 ( -0.000 5.030 0.000) 5.030 5.272 ( -0.000 2.316 0.000) 2.316 5.674 ( 0.000 -6.716 -0.000) 6.716 5.734 ( -0.000 2.841 0.000) 2.841 5.972 ( 0.000 -4.032 -0.000) 4.032 6.110 ( -0.000 0.701 0.000) 0.701 6.318 ( -0.000 9.183 0.000) 9.183 6.717 ( 0.000 -9.338 -0.000) 9.338 7.091 ( 0.000 -11.705 -0.000) 11.705 7.357 ( 0.000 -7.959 -0.000) 7.959 7.383 ( 0.000 -0.105 -0.000) 0.105 7.495 ( 0.000 -7.419 -0.000) 7.419 8.030 ( 0.000 -12.228 -0.000) 12.228 8.039 ( -0.000 3.244 0.000) 3.244 8.438 ( -0.000 6.020 0.000) 6.020 8.767 ( -0.000 4.602 0.000) 4.602 8.807 ( -0.000 2.031 0.000) 2.031 9.212 ( -0.000 8.420 0.000) 8.420 9.320 ( -0.000 2.569 0.000) 2.569 9.925 ( 0.000 -6.470 -0.000) 6.470 10.097 ( 0.000 -0.284 -0.000) 0.284 10.225 ( -0.000 2.376 0.000) 2.376 10.431 ( 0.000 -1.528 -0.000) 1.528 10.613 ( -0.000 6.044 0.000) 6.044 11.028 ( 0.000 -0.832 -0.000) 0.832 11.169 ( 0.000 -10.051 -0.000) 10.051 11.598 ( -0.000 3.828 0.000) 3.828 11.941 ( 0.000 -3.650 -0.000) 3.650 12.161 ( -0.000 2.200 0.000) 2.200 12.339 ( -0.000 4.124 0.000) 4.124 12.491 ( -0.000 2.630 0.000) 2.630 12.944 ( 0.000 -5.112 -0.000) 5.112 13.297 ( -0.000 1.765 0.000) 1.765 13.448 ( 0.000 -4.041 -0.000) 4.041 13.801 ( -0.000 0.511 0.000) 0.511 13.987 ( -0.000 6.589 0.000) 6.589 14.081 ( 0.000 -3.565 -0.000) 3.565 14.803 ( 0.000 -13.368 -0.000) 13.368 15.821 ( -0.000 0.065 0.000) 0.065 16.683 ( -0.000 2.003 0.000) 2.003 16.903 ( 0.000 -5.027 -0.000) 5.027 17.739 ( -0.000 1.659 0.000) 1.659 19.626 ( 0.000 -0.722 -0.000) 0.722 19.696 ( -0.000 0.274 0.000) 0.274 20.677 ( -0.000 2.876 0.000) 2.876 21.851 ( -0.000 5.348 0.000) 5.348 21.890 ( 0.000 -2.749 -0.000) 2.749 22.619 ( 0.000 -0.854 -0.000) 0.854 22.703 ( -0.000 0.487 0.000) 0.487 23.594 ( -0.000 8.588 0.000) 8.588 24.222 ( 0.000 -2.952 -0.000) 2.952 24.428 ( 0.000 -4.502 -0.000) 4.502 24.609 ( 0.000 -2.022 -0.000) 2.022 26.069 ( -0.000 3.167 0.000) 3.167 ======================= Grid point 28 (18/186) ======================= q-point: ( 0.38 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.585 ( 17.308 0.000 8.759) 19.398 2.724 ( 23.842 0.000 15.505) 28.440 3.185 ( 1.078 0.000 -1.934) 2.214 3.744 ( -2.319 -0.000 -6.775) 7.161 4.063 ( -9.087 -0.000 -3.860) 9.873 4.353 ( -2.038 -0.000 5.417) 5.787 5.219 ( 36.558 0.000 7.880) 37.398 5.352 ( -4.875 -0.000 2.969) 5.708 5.640 ( 3.322 0.000 1.549) 3.665 5.736 ( -5.631 -0.000 5.911) 8.163 5.874 ( 6.126 0.000 -4.533) 7.621 5.983 ( 10.138 0.000 -1.992) 10.332 6.172 ( -16.350 -0.000 11.132) 19.780 6.769 ( -2.239 -0.000 6.625) 6.993 6.879 ( -14.651 -0.000 -14.570) 20.662 7.011 ( -14.737 -0.000 -14.530) 20.695 7.442 ( -10.602 -0.000 -17.914) 20.816 7.480 ( 12.020 0.000 -7.196) 14.010 8.002 ( -9.182 -0.000 0.777) 9.215 8.290 ( -5.367 -0.000 2.506) 5.923 8.443 ( 10.954 0.000 13.711) 17.550 8.674 ( 2.492 0.000 -2.454) 3.498 8.925 ( -17.509 -0.000 0.751) 17.525 9.520 ( 3.551 0.000 -2.540) 4.366 9.729 ( -1.043 -0.000 -17.922) 17.953 9.792 ( -1.602 -0.000 10.928) 11.044 10.012 ( 7.758 0.000 6.613) 10.194 10.150 ( 0.801 0.000 1.123) 1.380 10.545 ( -2.035 -0.000 -4.058) 4.540 10.661 ( 0.247 0.000 8.341) 8.345 10.831 ( 0.167 0.000 5.681) 5.683 11.092 ( 5.161 0.000 6.003) 7.917 11.502 ( 1.495 0.000 -8.924) 9.048 11.816 ( -5.911 -0.000 -0.393) 5.924 12.196 ( 3.081 0.000 2.255) 3.819 12.444 ( -0.767 -0.000 -1.491) 1.677 12.450 ( 1.088 0.000 -8.102) 8.175 12.715 ( -3.188 -0.000 11.306) 11.747 13.167 ( 4.663 0.000 -6.011) 7.608 13.418 ( 4.594 0.000 0.156) 4.596 13.852 ( 6.186 0.000 3.154) 6.944 13.890 ( -2.984 -0.000 2.575) 3.942 14.217 ( -0.839 -0.000 2.224) 2.377 14.284 ( 4.595 0.000 -4.967) 6.766 16.069 ( -7.215 -0.000 -4.522) 8.514 16.678 ( -2.891 -0.000 -0.532) 2.939 16.708 ( 1.689 0.000 -2.991) 3.435 17.752 ( 4.017 0.000 0.141) 4.020 19.601 ( -0.348 -0.000 1.304) 1.350 19.705 ( 0.130 0.000 -0.726) 0.737 20.778 ( 1.560 0.000 6.695) 6.874 21.502 ( 15.011 0.000 2.758) 15.262 22.325 ( -8.172 -0.000 1.827) 8.373 22.626 ( -9.870 -0.000 0.939) 9.915 22.760 ( 0.037 0.000 -4.736) 4.736 23.874 ( -0.185 -0.000 -4.706) 4.710 24.175 ( -1.152 -0.000 -3.513) 3.697 24.386 ( -5.873 -0.000 -2.690) 6.460 24.485 ( 0.443 0.000 2.149) 2.194 26.110 ( 4.059 0.000 6.768) 7.892 ======================= Grid point 29 (19/186) ======================= q-point: ( 0.50 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.733 ( 5.733 2.333 2.809) 6.797 3.043 ( 13.315 1.950 6.275) 14.848 3.281 ( 13.064 -6.160 6.850) 15.986 3.607 ( -15.293 5.270 -5.269) 17.012 3.755 ( -2.086 14.258 -2.824) 14.684 4.556 ( 0.835 -13.094 2.053) 13.280 5.123 ( -2.377 15.004 0.509) 15.200 5.527 ( 5.312 0.108 2.788) 6.000 5.650 ( 10.744 8.823 -0.020) 13.903 5.875 ( -4.437 -2.442 1.141) 5.192 5.993 ( 9.012 -7.398 -3.668) 12.223 6.060 ( 2.326 -0.967 1.546) 2.956 6.131 ( -2.213 -12.386 11.382) 16.967 6.527 ( -12.613 10.009 -4.908) 16.833 6.752 ( -5.222 6.363 -11.330) 14.005 6.944 ( -0.092 -13.063 6.927) 14.786 7.265 ( -8.778 -0.964 -13.247) 15.921 7.595 ( 11.740 4.643 -4.076) 13.266 7.890 ( -7.586 0.430 0.741) 7.634 8.234 ( -4.795 0.812 -0.195) 4.867 8.608 ( 3.138 -0.411 6.920) 7.609 8.715 ( -6.022 -2.072 1.250) 6.490 8.731 ( -2.036 -5.124 -1.038) 5.611 9.536 ( 2.596 3.080 -0.608) 4.073 9.651 ( -2.246 0.000 -7.159) 7.503 9.780 ( -0.345 6.994 -1.273) 7.117 9.987 ( 2.302 2.995 2.650) 4.615 10.288 ( 4.859 3.144 8.336) 10.149 10.430 ( -2.864 -4.310 -4.811) 7.066 10.713 ( -1.720 1.511 1.129) 2.553 10.871 ( 3.420 -3.011 6.272) 7.752 11.145 ( 1.571 3.659 0.851) 4.072 11.546 ( 0.328 -5.663 -4.353) 7.151 11.766 ( -3.001 -2.658 0.108) 4.011 12.249 ( 0.992 -1.039 1.471) 2.057 12.428 ( 0.779 0.786 -2.746) 2.961 12.455 ( 1.147 -1.791 -3.242) 3.877 12.691 ( -2.620 -0.122 7.198) 7.661 13.240 ( 2.948 -3.752 -3.443) 5.884 13.451 ( 1.826 1.782 0.692) 2.644 13.844 ( -1.595 1.590 0.695) 2.357 13.939 ( 2.213 -2.566 2.229) 4.055 14.195 ( -0.554 2.374 1.501) 2.863 14.371 ( 5.226 -4.070 -4.167) 7.826 15.953 ( -5.325 2.943 -0.913) 6.152 16.677 ( -1.070 -3.742 -1.200) 4.073 16.719 ( 0.479 -0.099 -0.909) 1.032 17.786 ( 2.140 0.828 0.135) 2.298 19.603 ( -0.060 -0.200 0.809) 0.835 19.704 ( 0.041 0.065 -0.532) 0.537 20.794 ( 0.634 1.674 3.707) 4.116 21.688 ( 13.995 1.078 1.543) 14.121 22.200 ( -11.063 1.674 0.867) 11.222 22.542 ( -4.598 -2.088 0.850) 5.120 22.745 ( -0.328 0.430 -3.189) 3.235 23.844 ( 0.339 2.750 -2.171) 3.520 24.158 ( -0.157 -0.069 -1.789) 1.797 24.326 ( -3.626 -1.186 -1.546) 4.116 24.508 ( 0.139 -1.829 0.983) 2.081 26.154 ( 2.214 1.200 2.999) 3.917 ======================= Grid point 30 (20/186) ======================= q-point: (-0.38 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.654 ( -0.000 13.137 0.000) 13.137 3.153 ( 0.000 -0.410 -0.000) 0.410 3.202 ( -0.000 21.464 0.000) 21.464 3.598 ( 0.000 -9.380 -0.000) 9.380 3.624 ( -0.000 4.080 0.000) 4.080 4.563 ( -0.000 8.134 0.000) 8.134 5.102 ( 0.000 -11.780 -0.000) 11.780 5.436 ( -0.000 24.237 0.000) 24.237 5.559 ( 0.000 -0.721 -0.000) 0.721 5.875 ( 0.000 -0.983 -0.000) 0.983 5.923 ( -0.000 10.803 0.000) 10.803 6.252 ( -0.000 8.780 0.000) 8.780 6.252 ( 0.000 -8.368 -0.000) 8.368 6.453 ( 0.000 -26.370 -0.000) 26.370 6.670 ( -0.000 0.987 0.000) 0.987 7.189 ( 0.000 -14.352 -0.000) 14.352 7.207 ( 0.000 -3.540 -0.000) 3.540 7.581 ( -0.000 8.526 0.000) 8.526 7.841 ( 0.000 -1.601 -0.000) 1.601 8.142 ( -0.000 4.637 0.000) 4.637 8.576 ( -0.000 2.170 0.000) 2.170 8.741 ( 0.000 -3.191 -0.000) 3.191 8.829 ( 0.000 -4.808 -0.000) 4.808 9.487 ( -0.000 7.860 0.000) 7.860 9.603 ( -0.000 14.039 0.000) 14.039 9.672 ( 0.000 -7.032 -0.000) 7.032 10.035 ( 0.000 -4.101 -0.000) 4.101 10.191 ( -0.000 6.584 0.000) 6.584 10.585 ( 0.000 -11.771 -0.000) 11.771 10.625 ( -0.000 8.757 0.000) 8.757 10.959 ( 0.000 -4.375 -0.000) 4.375 11.068 ( -0.000 5.437 0.000) 5.437 11.610 ( 0.000 -3.665 -0.000) 3.665 11.811 ( 0.000 -5.113 -0.000) 5.113 12.237 ( -0.000 2.303 0.000) 2.303 12.420 ( -0.000 1.582 0.000) 1.582 12.507 ( 0.000 -2.632 -0.000) 2.632 12.719 ( 0.000 -5.655 -0.000) 5.655 13.316 ( 0.000 -4.930 -0.000) 4.930 13.420 ( -0.000 4.134 0.000) 4.134 13.816 ( -0.000 0.879 0.000) 0.879 13.995 ( 0.000 -2.879 -0.000) 2.879 14.146 ( -0.000 4.333 0.000) 4.333 14.489 ( 0.000 -8.028 -0.000) 8.028 15.870 ( -0.000 3.220 0.000) 3.220 16.716 ( -0.000 0.529 0.000) 0.529 16.740 ( 0.000 -5.954 -0.000) 5.954 17.785 ( -0.000 1.400 0.000) 1.400 19.608 ( 0.000 -0.469 -0.000) 0.469 19.702 ( -0.000 0.152 0.000) 0.152 20.768 ( -0.000 3.064 0.000) 3.064 21.825 ( 0.000 -1.698 -0.000) 1.698 22.022 ( -0.000 6.390 0.000) 6.390 22.560 ( 0.000 -3.255 -0.000) 3.255 22.727 ( -0.000 0.993 0.000) 0.993 23.793 ( -0.000 4.933 0.000) 4.933 24.165 ( 0.000 -1.064 -0.000) 1.064 24.324 ( 0.000 -2.538 -0.000) 2.538 24.540 ( 0.000 -2.505 -0.000) 2.505 26.148 ( -0.000 2.241 0.000) 2.241 ======================= Grid point 38 (21/186) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 106 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.788 ( 0.000 0.000 -0.000) 0.000 3.242 ( 0.000 0.000 -0.000) 0.000 3.305 ( 0.000 0.000 0.000) 0.000 3.467 ( 0.000 0.000 0.000) 0.000 3.854 ( 0.000 0.000 0.000) 0.000 4.447 ( 0.000 0.000 0.000) 0.000 5.292 ( 0.000 0.000 0.000) 0.000 5.582 ( 0.000 0.000 0.000) 0.000 5.669 ( 0.000 0.000 -0.000) 0.000 5.914 ( 0.000 0.000 0.000) 0.000 5.936 ( 0.000 0.000 0.000) 0.000 5.998 ( 0.000 0.000 0.000) 0.000 6.173 ( 0.000 0.000 0.000) 0.000 6.523 ( 0.000 0.000 -0.000) 0.000 6.742 ( -0.000 -0.000 0.000) 0.000 6.836 ( 0.000 0.000 0.000) 0.000 7.163 ( 0.000 0.000 0.000) 0.000 7.753 ( -0.000 -0.000 0.000) 0.000 7.795 ( 0.000 0.000 -0.000) 0.000 8.221 ( 0.000 0.000 -0.000) 0.000 8.591 ( 0.000 0.000 0.000) 0.000 8.677 ( 0.000 0.000 0.000) 0.000 8.680 ( 0.000 0.000 -0.000) 0.000 9.576 ( 0.000 0.000 -0.000) 0.000 9.625 ( 0.000 0.000 -0.000) 0.000 9.806 ( 0.000 0.000 0.000) 0.000 10.140 ( 0.000 0.000 0.000) 0.000 10.173 ( 0.000 0.000 0.000) 0.000 10.500 ( 0.000 0.000 -0.000) 0.000 10.663 ( 0.000 0.000 0.000) 0.000 10.902 ( 0.000 0.000 0.000) 0.000 11.203 ( 0.000 0.000 -0.000) 0.000 11.498 ( 0.000 0.000 0.000) 0.000 11.713 ( 0.000 0.000 0.000) 0.000 12.260 ( 0.000 0.000 0.000) 0.000 12.428 ( 0.000 0.000 0.000) 0.000 12.439 ( 0.000 0.000 0.000) 0.000 12.677 ( 0.000 0.000 -0.000) 0.000 13.232 ( 0.000 0.000 0.000) 0.000 13.477 ( 0.000 0.000 0.000) 0.000 13.847 ( 0.000 0.000 0.000) 0.000 13.934 ( 0.000 0.000 0.000) 0.000 14.210 ( 0.000 0.000 -0.000) 0.000 14.377 ( 0.000 0.000 0.000) 0.000 15.937 ( 0.000 0.000 -0.000) 0.000 16.638 ( 0.000 0.000 0.000) 0.000 16.722 ( 0.000 0.000 0.000) 0.000 17.806 ( 0.000 0.000 0.000) 0.000 19.602 ( 0.000 0.000 0.000) 0.000 19.704 ( 0.000 0.000 0.000) 0.000 20.816 ( 0.000 0.000 0.000) 0.000 21.801 ( -0.000 -0.000 0.000) 0.000 22.140 ( 0.000 0.000 0.000) 0.000 22.489 ( 0.000 0.000 0.000) 0.000 22.743 ( 0.000 0.000 -0.000) 0.000 23.859 ( 0.000 0.000 0.000) 0.000 24.154 ( 0.000 0.000 0.000) 0.000 24.291 ( 0.000 0.000 0.000) 0.000 24.499 ( 0.000 0.000 0.000) 0.000 26.181 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 67 (22/186) ======================= q-point: ( 0.00 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.791 ( 14.664 0.000 39.943) 42.550 0.811 ( 11.556 0.000 41.010) 42.607 1.438 ( 6.438 0.000 72.431) 72.717 3.391 ( -2.256 -0.000 6.100) 6.503 3.538 ( -4.055 -0.000 6.625) 7.768 4.896 ( -5.459 -0.000 -2.187) 5.881 5.217 ( -1.200 -0.000 -10.439) 10.508 5.416 ( 0.241 0.000 -1.184) 1.209 5.554 ( 1.041 0.000 -1.820) 2.097 5.852 ( 1.109 0.000 1.952) 2.245 5.911 ( -14.570 -0.000 3.043) 14.884 6.080 ( -2.841 -0.000 -3.411) 4.439 6.218 ( 10.335 0.000 -7.766) 12.927 6.351 ( -13.496 -0.000 0.430) 13.503 7.080 ( 0.142 0.000 -2.771) 2.775 7.702 ( 1.099 0.000 -1.290) 1.694 7.755 ( -4.301 -0.000 -16.501) 17.052 7.864 ( 34.322 0.000 -4.060) 34.561 8.030 ( 7.639 0.000 -2.196) 7.948 8.048 ( -4.911 -0.000 -6.639) 8.258 8.318 ( 0.332 0.000 4.947) 4.958 8.612 ( 2.563 0.000 -0.069) 2.564 8.946 ( -2.075 -0.000 9.270) 9.500 9.265 ( -3.899 -0.000 -15.861) 16.333 9.505 ( 6.498 0.000 -18.670) 19.768 9.575 ( -0.848 -0.000 0.560) 1.017 9.806 ( -5.610 -0.000 -1.070) 5.711 10.142 ( 2.521 0.000 10.934) 11.221 10.601 ( -11.384 -0.000 11.120) 15.913 10.612 ( 1.663 0.000 27.842) 27.892 11.214 ( 8.072 0.000 7.620) 11.101 11.222 ( -4.937 -0.000 -18.790) 19.427 11.446 ( 0.982 0.000 -7.146) 7.213 11.683 ( 13.283 0.000 -2.093) 13.447 11.871 ( -1.960 -0.000 -3.064) 3.638 12.170 ( -5.461 -0.000 -3.401) 6.433 12.578 ( -4.413 -0.000 -10.382) 11.281 12.916 ( 3.461 0.000 4.999) 6.080 13.055 ( -7.907 -0.000 0.072) 7.908 13.134 ( -8.178 -0.000 -11.264) 13.919 13.725 ( -6.506 -0.000 4.401) 7.855 14.092 ( 8.441 0.000 17.575) 19.497 14.220 ( -4.554 -0.000 0.260) 4.562 14.920 ( 31.622 0.000 5.928) 32.172 16.565 ( 2.607 0.000 0.980) 2.785 17.040 ( -1.414 -0.000 0.179) 1.425 17.068 ( -81.160 -0.000 -2.016) 81.185 17.314 ( 1.125 0.000 -0.218) 1.146 19.691 ( -1.826 -0.000 3.734) 4.156 20.576 ( -0.716 -0.000 -2.838) 2.927 20.811 ( 7.077 0.000 2.500) 7.505 21.037 (-100.865 -0.000 -0.537) 100.867 22.585 ( -4.779 -0.000 -2.021) 5.189 22.722 ( 2.251 0.000 3.908) 4.510 22.822 ( 80.786 0.000 -2.850) 80.836 23.260 ( 1.763 0.000 0.940) 1.998 24.362 ( -2.530 -0.000 0.593) 2.599 24.581 ( 0.420 0.000 -1.396) 1.458 24.772 ( -1.316 -0.000 -1.139) 1.741 25.376 ( 56.969 0.000 -2.598) 57.028 ======================= Grid point 68 (23/186) ======================= q-point: ( 0.12 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.125 ( 21.551 -3.664 35.413) 41.617 1.293 ( 22.996 -12.409 35.277) 43.901 2.177 ( 32.501 -33.396 51.555) 69.495 3.401 ( -3.047 -1.446 5.286) 6.270 3.493 ( -2.740 0.469 6.417) 6.993 4.762 ( -12.181 0.418 -3.952) 12.813 5.159 ( -0.553 2.131 -9.097) 9.359 5.440 ( 2.178 -1.089 -4.858) 5.434 5.601 ( -0.096 1.035 -0.903) 1.376 5.631 ( -11.534 2.568 -1.042) 11.862 5.780 ( -6.260 0.580 3.091) 7.005 6.153 ( 6.289 0.711 -2.948) 6.982 6.304 ( 14.742 -1.026 -0.711) 14.795 6.540 ( 6.444 -16.082 -6.799) 18.611 7.078 ( -0.136 0.508 -3.370) 3.410 7.562 ( -10.305 5.785 -5.106) 12.874 7.651 ( -6.353 2.526 -11.388) 13.283 7.929 ( -6.371 3.044 -6.706) 9.737 8.146 ( 8.874 4.672 3.680) 10.682 8.232 ( 8.131 10.859 -4.216) 14.206 8.372 ( 25.303 2.748 -11.955) 28.120 8.594 ( 5.477 10.448 -0.916) 11.832 8.946 ( -1.692 -5.462 7.894) 9.747 9.094 ( -2.195 9.799 -10.999) 14.894 9.523 ( -2.894 0.991 -0.812) 3.165 9.658 ( 4.223 -9.089 -15.134) 18.152 9.780 ( -1.676 -4.577 -3.098) 5.776 10.245 ( 4.144 -2.592 11.775) 12.750 10.493 ( -4.904 -1.068 4.089) 6.474 10.712 ( 2.465 0.842 25.913) 26.043 11.169 ( -0.540 -0.395 -20.788) 20.799 11.281 ( -3.486 -3.009 2.428) 5.206 11.502 ( 10.099 2.241 -0.891) 10.383 11.778 ( -5.773 1.467 -4.548) 7.494 11.916 ( 2.829 -6.833 0.035) 7.395 12.201 ( 5.489 -9.247 -8.234) 13.543 12.471 ( -5.776 2.943 1.753) 6.715 12.899 ( -0.664 -0.430 -20.254) 20.269 13.003 ( -1.289 0.364 9.913) 10.003 13.137 ( -3.511 -9.063 -4.130) 10.561 13.682 ( -4.636 -2.596 3.096) 6.149 14.139 ( -4.030 1.990 -5.842) 7.371 14.237 ( 4.325 -0.209 22.061) 22.482 15.159 ( -0.397 0.283 -2.768) 2.810 16.050 ( -41.102 4.935 24.618) 48.164 16.620 ( 1.447 -1.408 3.997) 4.478 17.004 ( -4.322 -0.776 -0.423) 4.411 17.417 ( 0.967 -6.907 -2.041) 7.266 19.675 ( -1.277 0.504 3.207) 3.489 20.107 ( -23.338 10.980 22.171) 34.011 20.601 ( 0.523 -1.659 -1.544) 2.326 21.013 ( -2.584 -11.485 1.713) 11.896 22.515 ( -3.225 1.126 -3.785) 5.098 22.744 ( 2.244 1.540 3.949) 4.796 23.205 ( 24.301 16.219 -6.375) 29.904 23.299 ( 5.313 3.886 0.123) 6.583 24.311 ( -3.293 1.683 -0.868) 3.799 24.566 ( -1.067 0.831 -0.580) 1.472 24.726 ( -1.231 1.416 0.068) 1.878 25.888 ( 15.618 -1.098 -12.571) 20.079 ======================= Grid point 69 (24/186) ======================= q-point: ( 0.25 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( 19.606 -14.509 26.303) 35.871 1.898 ( 26.568 -15.014 25.299) 39.640 3.137 ( 20.924 -24.460 26.981) 42.001 3.359 ( 3.533 -0.520 8.059) 8.815 3.484 ( -2.198 2.946 9.012) 9.733 4.609 ( -10.259 -3.749 -1.701) 11.054 5.132 ( 2.101 3.101 -1.086) 3.900 5.277 ( -9.463 5.669 -6.571) 12.840 5.563 ( 1.591 -4.708 -2.749) 5.679 5.647 ( -5.756 -5.098 -2.199) 7.997 5.768 ( 0.483 -3.531 1.601) 3.907 6.209 ( 7.262 4.703 -3.585) 9.366 6.540 ( 11.010 -8.119 -2.532) 13.912 6.769 ( 3.377 -7.446 -12.175) 14.666 7.098 ( 5.507 -0.620 1.875) 5.850 7.289 ( -15.760 7.044 2.541) 17.449 7.405 ( -9.404 13.345 -10.267) 19.286 7.767 ( -8.154 2.901 -6.173) 10.630 8.044 ( 5.005 14.418 3.399) 15.636 8.271 ( 1.969 0.287 -9.523) 9.729 8.463 ( 1.443 1.431 -14.104) 14.250 8.555 ( 17.078 12.665 7.876) 22.674 8.909 ( 2.504 11.054 -7.012) 13.327 9.083 ( -1.135 -8.407 5.453) 10.085 9.471 ( -2.141 0.190 2.642) 3.406 9.729 ( -1.411 -3.313 -7.623) 8.431 9.861 ( 0.846 -6.977 -5.519) 8.936 10.340 ( 2.410 -0.677 1.872) 3.126 10.525 ( 0.572 -6.138 -1.202) 6.280 10.751 ( -0.318 4.364 21.856) 22.290 11.096 ( -1.402 2.646 -16.503) 16.772 11.255 ( -7.174 -3.300 -5.376) 9.553 11.504 ( 4.594 5.672 0.203) 7.302 11.821 ( 7.119 -3.653 1.227) 8.095 12.011 ( 4.068 -3.932 3.960) 6.906 12.364 ( -5.314 -4.463 -6.965) 9.832 12.374 ( 1.893 -0.443 -0.690) 2.063 12.881 ( -0.775 -5.577 -17.703) 18.577 12.976 ( -3.736 2.690 10.841) 11.778 13.221 ( 2.285 -5.303 -9.254) 10.908 13.694 ( -1.482 -3.663 3.115) 5.032 14.023 ( -4.928 3.639 -7.581) 9.747 14.319 ( 1.205 1.337 21.989) 22.063 14.974 ( -20.304 0.102 9.491) 22.413 15.874 ( 1.010 -0.191 2.305) 2.524 16.673 ( 0.571 -2.436 5.143) 5.720 16.961 ( -3.882 -1.176 -0.468) 4.083 17.509 ( 2.065 -3.980 -1.258) 4.657 19.661 ( -0.716 0.756 3.503) 3.654 19.885 ( -8.410 2.883 14.128) 16.693 20.637 ( 3.019 -0.314 -1.079) 3.221 21.119 ( -0.259 -5.354 3.057) 6.171 22.454 ( -1.560 1.262 -4.790) 5.193 22.763 ( 1.614 0.482 3.243) 3.655 23.237 ( 19.570 17.968 -3.213) 26.761 23.291 ( -7.209 -6.091 0.378) 9.445 24.236 ( -3.073 2.070 -1.617) 4.042 24.537 ( -1.787 0.486 1.926) 2.672 24.705 ( -0.723 -0.156 -1.876) 2.016 25.956 ( 3.343 1.953 -4.896) 6.242 ======================= Grid point 70 (25/186) ======================= q-point: ( 0.38 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.144 ( 18.592 -19.054 17.602) 31.915 2.468 ( 21.061 -11.795 18.473) 30.397 3.126 ( -12.246 5.328 4.968) 14.249 3.315 ( -8.639 14.171 10.313) 19.539 3.819 ( 19.240 -4.658 9.190) 21.825 4.664 ( -4.129 -10.458 0.921) 11.281 4.982 ( -4.611 1.452 7.218) 8.687 5.355 ( 6.915 -9.609 -3.381) 12.312 5.576 ( -4.690 -3.084 1.802) 5.895 5.682 ( -0.912 -4.079 -5.865) 7.202 5.822 ( 0.589 -0.895 2.450) 2.674 6.173 ( 3.043 7.650 -3.616) 8.992 6.629 ( -5.786 7.308 -14.122) 16.921 6.842 ( 8.859 -2.456 -2.215) 9.456 7.050 ( -11.631 -2.072 5.203) 12.909 7.127 ( -2.568 6.239 -7.211) 9.875 7.230 ( 2.913 -5.727 3.343) 7.243 7.620 ( -8.325 -0.116 -9.834) 12.885 7.939 ( 4.991 11.261 5.214) 13.376 8.185 ( 1.541 7.197 -8.675) 11.377 8.482 ( 0.365 -5.234 -10.818) 12.023 8.597 ( 7.135 8.550 1.599) 11.250 8.847 ( 8.306 5.814 0.264) 10.142 9.141 ( -3.470 -2.753 4.669) 6.436 9.484 ( 0.471 -1.603 1.860) 2.500 9.720 ( -5.983 -5.407 -3.095) 8.638 9.936 ( -0.359 -5.012 -4.795) 6.946 10.309 ( 3.933 9.833 -4.892) 11.666 10.617 ( 0.895 -4.592 -5.483) 7.208 10.716 ( -5.513 2.947 18.609) 19.631 10.971 ( -4.247 -1.840 -18.955) 19.512 11.219 ( -1.172 0.879 -3.101) 3.430 11.542 ( 11.780 5.595 4.074) 13.663 11.936 ( -2.668 -8.276 -1.733) 8.866 12.196 ( 9.285 -2.488 8.423) 12.781 12.298 ( -0.656 -1.513 2.819) 3.265 12.390 ( -0.854 -0.699 -15.471) 15.510 12.875 ( -8.079 3.221 22.523) 24.144 12.963 ( 3.121 -6.459 -17.823) 19.213 13.285 ( 3.799 -2.095 -12.637) 13.361 13.753 ( 0.573 -3.678 4.669) 5.972 13.879 ( -4.301 4.632 -11.026) 12.710 14.346 ( -1.304 2.102 21.803) 21.943 14.760 ( -14.296 1.328 7.395) 16.150 15.939 ( 5.666 -1.400 -0.870) 5.901 16.724 ( -1.110 -3.318 6.652) 7.516 16.938 ( -2.357 -1.502 0.069) 2.796 17.575 ( 2.124 -1.820 -0.146) 2.801 19.656 ( -0.084 0.480 4.806) 4.830 19.811 ( -4.468 0.819 9.441) 10.477 20.676 ( 4.022 1.239 -0.356) 4.223 21.163 ( -0.850 -0.832 1.956) 2.289 22.425 ( 0.886 0.485 -4.047) 4.171 22.788 ( 0.557 -0.854 2.562) 2.757 23.196 ( 4.339 8.130 -3.258) 9.775 23.299 ( -1.841 -2.793 -0.566) 3.393 24.181 ( -1.677 0.516 -1.048) 2.044 24.516 ( -1.777 0.329 2.826) 3.354 24.701 ( -0.410 -1.223 -2.545) 2.854 25.932 ( 1.254 3.757 -4.860) 6.269 ======================= Grid point 71 (26/186) ======================= q-point: (-0.50 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.641 ( 2.551 -3.999 13.986) 14.769 2.666 ( -3.143 2.561 8.668) 9.570 2.841 ( -6.012 14.492 7.139) 17.237 3.111 ( 4.775 1.644 12.336) 13.330 4.033 ( 3.527 -1.724 8.131) 9.029 4.493 ( -9.694 9.553 -10.440) 17.153 5.107 ( -3.514 -5.185 14.533) 15.826 5.476 ( 2.999 1.959 -3.432) 4.961 5.577 ( -4.697 -1.244 -2.327) 5.387 5.709 ( 1.879 -3.765 -1.602) 4.502 5.794 ( 1.229 3.605 2.492) 4.552 6.133 ( 3.073 2.076 -2.259) 4.342 6.494 ( 0.584 -6.709 -8.409) 10.773 6.850 ( 0.421 5.622 -6.223) 8.397 7.050 ( -2.920 -6.369 3.941) 8.039 7.149 ( -0.163 -5.155 -4.176) 6.637 7.316 ( 2.376 -0.836 3.592) 4.387 7.543 ( -7.238 -9.133 -8.589) 14.476 7.924 ( 7.777 3.602 6.032) 10.481 8.143 ( 6.944 4.014 -2.597) 8.431 8.479 ( -5.254 -0.474 -7.630) 9.276 8.585 ( 2.280 -2.371 -9.482) 10.036 8.870 ( 2.828 4.944 2.853) 6.370 9.125 ( -1.513 1.410 3.342) 3.930 9.486 ( -2.740 0.362 2.523) 3.743 9.762 ( -0.403 -8.915 -3.391) 9.546 9.961 ( -2.258 -2.076 -3.483) 4.641 10.199 ( 6.574 12.968 -0.377) 14.544 10.515 ( -5.447 6.755 -12.605) 15.304 10.736 ( -0.631 -4.193 14.629) 15.231 10.995 ( 0.261 -6.380 -11.321) 12.997 11.147 ( -2.272 2.639 -10.267) 10.841 11.652 ( 14.393 5.935 5.886) 16.645 11.980 ( -6.093 -6.419 -3.064) 9.366 12.189 ( -4.014 1.135 2.508) 4.867 12.304 ( -1.587 3.128 -5.057) 6.154 12.559 ( 14.122 -9.414 -1.608) 17.048 12.774 ( -6.590 4.696 23.463) 24.819 13.050 ( 2.149 -4.792 -12.810) 13.845 13.326 ( 4.224 -1.263 -10.381) 11.279 13.706 ( -4.595 5.376 -9.217) 11.617 13.857 ( 4.486 -2.823 -0.054) 5.301 14.339 ( -2.984 2.568 21.578) 21.934 14.594 ( -8.577 3.236 3.365) 9.765 16.050 ( 5.286 -4.287 1.341) 6.936 16.769 ( -2.351 -3.663 8.489) 9.540 16.943 ( -1.058 -2.261 1.292) 2.811 17.615 ( 1.948 -0.006 1.064) 2.220 19.672 ( 0.570 -0.212 7.269) 7.295 19.778 ( -2.887 0.098 7.051) 7.620 20.701 ( 3.545 2.433 0.490) 4.328 21.135 ( -0.154 3.545 -0.782) 3.634 22.447 ( 3.119 -0.839 -1.738) 3.668 22.806 ( -1.351 -1.183 2.380) 2.981 23.121 ( -7.006 -1.776 -6.759) 9.896 23.307 ( 1.848 1.592 -0.556) 2.502 24.179 ( 0.068 -1.850 0.179) 1.860 24.492 ( -1.856 0.485 2.061) 2.815 24.717 ( -0.157 -2.278 -1.359) 2.657 25.859 ( 1.184 6.753 -7.984) 10.523 ======================= Grid point 72 (27/186) ======================= q-point: (-0.38 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.163 ( -20.699 24.885 6.727) 33.060 2.311 ( -16.228 27.082 18.635) 36.662 3.020 ( 3.129 1.493 0.637) 3.525 3.289 ( 5.634 -7.694 12.971) 16.099 3.666 ( -28.947 17.019 3.980) 33.815 4.563 ( 17.598 -5.232 5.513) 19.169 5.084 ( -6.147 -4.047 4.840) 8.809 5.424 ( 6.093 11.154 -5.040) 13.672 5.440 ( -6.137 2.893 -0.305) 6.792 5.699 ( -0.819 2.212 -3.926) 4.580 5.893 ( 2.326 -1.031 3.580) 4.391 6.196 ( 2.134 -5.977 -4.400) 7.722 6.629 ( 3.579 -1.025 -6.937) 7.873 6.803 ( 2.357 -3.446 -3.228) 5.277 7.094 ( -13.251 -1.684 -1.546) 13.447 7.131 ( 0.586 -6.276 5.673) 8.480 7.447 ( 8.240 -9.824 -8.891) 15.603 7.626 ( 0.936 -9.255 0.927) 9.348 8.023 ( 5.668 -1.751 -1.457) 6.109 8.193 ( 0.071 2.426 5.782) 6.270 8.441 ( -1.239 -8.987 -11.523) 14.666 8.610 ( -2.225 -4.009 -12.660) 13.464 8.798 ( -2.898 6.085 5.321) 8.587 9.070 ( -2.213 1.008 -4.549) 5.158 9.465 ( 0.169 0.306 3.951) 3.966 9.894 ( 2.713 -0.148 -4.140) 4.952 9.929 ( 0.824 -1.621 2.304) 2.935 10.130 ( 4.575 8.186 4.366) 10.344 10.349 ( -1.824 4.966 -9.998) 11.311 10.806 ( -3.179 -1.745 14.305) 14.757 10.999 ( 5.172 5.335 -6.164) 9.654 11.129 ( -4.022 -11.416 -20.086) 23.451 11.750 ( 10.721 5.912 1.266) 12.308 11.923 ( -6.080 1.512 -3.362) 7.110 12.125 ( -0.700 4.032 2.310) 4.699 12.257 ( -2.535 -1.587 -2.464) 3.875 12.703 ( -4.352 3.368 25.505) 26.092 12.828 ( 7.770 -7.902 -12.513) 16.715 13.068 ( 1.364 0.946 -7.232) 7.420 13.416 ( 6.397 -4.311 -0.940) 7.771 13.554 ( -2.504 4.360 -14.301) 15.159 13.969 ( 9.406 0.293 1.414) 9.516 14.300 ( -5.173 3.192 21.227) 22.081 14.460 ( -3.673 5.193 0.762) 6.406 16.203 ( 4.154 -7.809 3.466) 9.500 16.810 ( -2.947 -4.004 10.448) 11.570 16.981 ( -1.045 -4.155 3.735) 5.684 17.635 ( 2.513 1.613 2.643) 3.988 19.709 ( -0.174 -0.801 9.508) 9.543 19.776 ( -0.272 -1.254 8.544) 8.640 20.697 ( 0.835 2.524 0.691) 2.747 21.082 ( 6.072 7.929 -1.290) 10.070 22.512 ( 3.678 -1.849 0.609) 4.161 22.789 ( -3.740 -0.113 2.431) 4.462 23.031 ( -17.603 -11.428 -12.974) 24.674 23.300 ( 3.456 4.193 -0.364) 5.446 24.232 ( 1.582 -3.649 1.262) 4.172 24.469 ( -1.218 0.291 1.121) 1.681 24.747 ( -0.822 -2.700 0.364) 2.846 25.732 ( 2.752 11.557 -12.903) 17.540 ======================= Grid point 73 (28/186) ======================= q-point: (-0.25 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.538 ( -19.938 28.411 11.977) 36.718 1.727 ( -18.477 31.062 19.948) 41.281 2.424 ( -37.046 34.940 9.650) 51.830 3.438 ( -1.786 -1.784 11.150) 11.432 3.481 ( 1.535 -4.324 9.309) 10.378 4.813 ( 10.089 0.297 5.427) 11.460 5.189 ( -0.889 -13.758 2.161) 13.955 5.387 ( -5.637 -6.321 -3.551) 9.183 5.399 ( 16.199 7.869 -3.371) 18.321 5.639 ( 0.095 3.098 -3.824) 4.922 5.837 ( -0.136 8.897 1.942) 9.107 6.258 ( -5.386 -7.078 -3.038) 9.399 6.542 ( -1.266 9.768 -3.623) 10.495 6.826 ( -19.814 0.472 -2.383) 19.963 7.018 ( 7.254 -5.972 -4.474) 10.407 7.289 ( 9.693 -6.117 4.106) 12.175 7.694 ( 7.289 -11.182 -14.517) 19.721 7.843 ( 4.803 -14.359 7.472) 16.884 8.068 ( -1.106 2.555 -7.075) 7.603 8.093 ( -11.150 -6.225 -8.585) 15.388 8.431 ( -12.370 0.746 -9.493) 15.610 8.670 ( -0.102 4.157 5.638) 7.006 8.712 ( 4.374 -7.653 -7.315) 11.455 9.083 ( 0.783 -6.740 -7.941) 10.445 9.499 ( 2.035 -1.136 4.185) 4.790 9.786 ( 2.900 12.794 -5.502) 14.226 9.975 ( -3.306 0.055 -3.954) 5.155 10.134 ( 4.976 3.749 11.191) 12.809 10.315 ( 3.260 -1.929 0.957) 3.907 10.749 ( -4.825 4.550 14.950) 16.355 11.048 ( 2.979 -4.100 -3.703) 6.277 11.198 ( -0.824 -9.725 -20.763) 22.942 11.708 ( -5.054 4.698 -5.268) 8.682 11.854 ( 8.756 8.687 -1.050) 12.379 12.045 ( 1.062 9.557 -2.046) 9.831 12.251 ( -3.440 -3.413 -2.423) 5.417 12.684 ( -4.753 0.738 24.695) 25.159 12.855 ( -0.871 1.025 -18.939) 18.986 13.093 ( 1.037 -3.796 -8.712) 9.560 13.431 ( 0.186 3.038 -16.221) 16.504 13.631 ( 7.482 -7.620 9.023) 13.980 14.075 ( 12.160 8.373 -3.471) 15.167 14.231 ( -3.194 2.297 20.745) 21.115 14.372 ( 2.871 7.152 7.876) 11.020 16.380 ( 3.352 -8.550 2.306) 9.469 16.875 ( -2.304 -7.199 11.997) 14.180 17.046 ( -4.526 -8.129 7.079) 11.691 17.660 ( 4.425 2.031 4.589) 6.691 19.716 ( -2.177 -0.358 6.015) 6.407 19.900 ( 5.204 -8.009 22.950) 24.858 20.657 ( -2.257 1.525 -0.724) 2.818 21.099 ( 20.158 13.368 5.537) 24.813 22.585 ( 0.918 -3.205 1.385) 3.610 22.726 ( -6.515 0.053 1.113) 6.610 22.895 ( -31.686 -19.789 -22.014) 43.362 23.280 ( 3.686 5.040 -0.178) 6.247 24.316 ( 1.787 -3.954 2.022) 4.787 24.464 ( 0.804 -0.091 0.336) 0.876 24.765 ( -2.601 -2.342 2.013) 4.038 25.538 ( 7.563 20.566 -18.702) 28.808 ======================= Grid point 74 (29/186) ======================= q-point: (-0.12 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.963 ( -12.417 28.733 22.775) 38.711 1.035 ( -27.998 25.446 18.074) 41.929 1.617 ( -19.517 29.636 52.099) 63.035 3.436 ( -2.165 2.419 8.004) 8.637 3.541 ( -2.527 -2.788 8.442) 9.242 4.904 ( 3.836 -0.043 1.493) 4.116 5.242 ( -3.630 -3.024 -7.122) 8.547 5.431 ( -3.005 -3.397 -1.756) 4.863 5.573 ( 5.518 1.418 -1.184) 5.819 5.667 ( 15.692 2.133 -0.485) 15.844 5.798 ( 1.593 -10.095 1.543) 10.335 6.243 ( -7.598 -3.105 -4.387) 9.307 6.328 ( -11.523 8.106 -1.910) 14.217 6.558 ( -12.214 2.552 -1.518) 12.570 7.133 ( 4.618 1.186 -6.422) 7.999 7.550 ( 14.186 -4.855 0.932) 15.023 7.786 ( -6.672 -0.413 -11.550) 13.345 7.897 ( -11.337 -5.411 -15.180) 19.704 8.010 ( -0.178 5.112 -8.952) 10.310 8.157 ( -3.173 -13.460 3.184) 14.191 8.213 ( -6.019 1.146 -5.327) 8.119 8.603 ( -1.083 0.669 -5.194) 5.348 8.879 ( 4.404 -3.839 6.986) 9.107 9.209 ( -0.721 -12.480 -10.188) 16.127 9.538 ( 3.362 3.210 -4.014) 6.141 9.628 ( 2.677 9.786 -8.098) 12.981 9.890 ( -5.202 1.361 -2.089) 5.769 10.139 ( 2.104 4.145 4.430) 6.421 10.461 ( 3.525 -6.038 18.781) 20.041 10.682 ( -6.536 0.417 19.433) 20.507 11.123 ( 0.989 -4.092 -2.547) 4.920 11.276 ( 2.448 -6.271 -18.906) 20.069 11.542 ( -6.363 5.479 -8.212) 11.745 11.785 ( 9.378 23.559 -7.909) 26.562 11.896 ( 2.323 6.147 -2.789) 7.139 12.235 ( -5.215 -2.621 -2.260) 6.258 12.642 ( -7.532 -2.244 1.871) 8.078 12.842 ( 3.855 -0.449 0.911) 3.986 13.103 ( -4.517 -4.835 -12.823) 14.429 13.337 ( -3.470 4.271 -16.874) 17.749 13.800 ( -1.484 -2.319 6.591) 7.143 13.992 ( 5.180 9.284 9.349) 14.157 14.263 ( -3.372 -1.325 2.614) 4.468 14.494 ( 30.170 8.324 25.335) 40.267 16.509 ( 2.929 -3.290 -0.167) 4.408 17.003 ( 2.950 -4.550 3.375) 6.388 17.134 ( -15.281 -21.350 8.913) 27.727 17.690 ( -4.290 0.146 -3.769) 5.712 19.704 ( -2.195 -0.306 4.624) 5.128 20.343 ( 8.628 -32.711 31.554) 46.261 20.609 ( -1.509 0.602 -1.491) 2.206 21.392 ( 60.782 13.581 32.228) 70.125 22.417 ( -68.254 -23.231 -34.425) 79.896 22.662 ( -3.700 0.135 2.189) 4.301 22.702 ( -4.168 -1.159 -4.642) 6.345 23.259 ( 2.831 3.762 0.089) 4.709 24.371 ( -1.105 -2.013 2.062) 3.086 24.513 ( 4.986 -1.911 0.201) 5.344 24.751 ( -3.653 -1.213 3.836) 5.434 25.263 ( 21.130 36.923 -16.268) 45.546 ======================= Grid point 76 (30/186) ======================= q-point: ( 0.12 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.556 ( 26.403 0.000 32.724) 42.047 1.629 ( 24.499 0.000 38.345) 45.503 2.606 ( 48.026 0.000 42.977) 64.448 3.418 ( 2.918 0.000 4.999) 5.788 3.461 ( -2.065 -0.000 6.023) 6.367 4.594 ( -11.768 -0.000 -4.144) 12.476 5.084 ( -8.933 -0.000 -9.874) 13.316 5.416 ( 1.632 0.000 -8.963) 9.110 5.521 ( -6.389 -0.000 -0.872) 6.449 5.641 ( 3.986 0.000 2.424) 4.665 5.779 ( -3.872 -0.000 1.424) 4.125 6.112 ( -4.552 -0.000 -7.867) 9.089 6.434 ( 12.010 0.000 -6.531) 13.671 6.588 ( 12.538 0.000 -4.249) 13.238 7.093 ( 2.158 0.000 -2.922) 3.633 7.483 ( -7.236 -0.000 -18.932) 20.268 7.541 ( -8.347 -0.000 9.284) 12.485 7.835 ( -9.908 -0.000 -1.631) 10.041 8.269 ( -2.520 -0.000 4.230) 4.924 8.360 ( 8.457 0.000 -8.749) 12.169 8.426 ( -2.516 -0.000 -8.141) 8.521 8.829 ( -8.202 -0.000 9.822) 12.796 9.044 ( 22.697 0.000 -13.369) 26.341 9.116 ( 2.594 0.000 -19.065) 19.241 9.566 ( -1.914 -0.000 3.354) 3.862 9.568 ( 6.113 0.000 -19.134) 20.087 9.699 ( 1.438 0.000 -4.748) 4.961 10.318 ( -1.071 -0.000 7.258) 7.337 10.472 ( 2.601 0.000 8.967) 9.337 10.817 ( 2.747 0.000 27.143) 27.281 10.989 ( -5.822 -0.000 -14.612) 15.729 11.259 ( -4.932 -0.000 -0.849) 5.005 11.567 ( -7.189 -0.000 -3.621) 8.049 11.801 ( 12.125 0.000 3.283) 12.562 11.980 ( 9.834 0.000 -6.392) 11.729 12.174 ( 5.788 0.000 -4.659) 7.430 12.433 ( -5.525 -0.000 -0.813) 5.584 12.807 ( -2.447 -0.000 -24.680) 24.801 12.946 ( -3.728 -0.000 17.574) 17.965 13.139 ( 4.769 0.000 10.383) 11.426 13.617 ( -2.142 -0.000 -2.280) 3.128 14.076 ( -5.080 -0.000 -6.534) 8.277 14.352 ( 3.795 0.000 20.791) 21.135 14.906 ( -29.699 -0.000 18.675) 35.082 15.873 ( 1.483 0.000 0.641) 1.615 16.653 ( 2.176 0.000 4.176) 4.709 16.920 ( -5.824 -0.000 -0.632) 5.858 17.444 ( 6.757 0.000 0.722) 6.795 19.674 ( -0.713 -0.000 2.891) 2.978 19.945 ( -14.997 -0.000 15.829) 21.805 20.623 ( 4.904 0.000 0.430) 4.922 21.028 ( 7.159 0.000 7.084) 10.072 22.472 ( -2.209 -0.000 -5.129) 5.585 22.773 ( -0.115 -0.000 3.635) 3.637 23.190 ( -5.892 -0.000 0.977) 5.973 23.625 ( 10.380 0.000 -15.005) 18.245 24.274 ( -3.632 -0.000 -1.947) 4.120 24.549 ( -1.889 -0.000 -0.655) 1.999 24.679 ( -4.937 -0.000 -2.712) 5.633 26.004 ( 5.150 0.000 -4.013) 6.529 ======================= Grid point 77 (31/186) ======================= q-point: ( 0.25 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.901 ( 23.916 2.819 32.680) 40.594 2.167 ( 27.519 -11.137 28.542) 41.183 3.177 ( 4.230 0.166 10.934) 11.725 3.517 ( 5.974 -2.353 5.575) 8.504 3.622 ( 32.843 -3.110 23.050) 40.244 4.444 ( -8.596 -0.415 -2.028) 8.842 4.985 ( -11.447 -10.569 -4.155) 16.124 5.338 ( -1.484 15.730 -4.786) 16.509 5.475 ( 0.141 -4.938 -7.518) 8.995 5.658 ( 0.222 5.746 0.791) 5.805 5.726 ( 1.765 -4.361 1.747) 5.018 6.191 ( -3.603 -16.948 -9.891) 19.951 6.509 ( 7.632 4.544 -6.127) 10.791 6.751 ( 5.664 -6.096 -7.770) 11.385 7.085 ( -6.136 -1.121 -2.089) 6.578 7.302 ( -4.025 6.931 -8.433) 11.634 7.418 ( -6.706 9.219 2.529) 11.677 7.644 ( -14.996 3.312 3.651) 15.785 8.214 ( -0.470 5.843 2.629) 6.425 8.305 ( -0.029 2.180 -6.842) 7.181 8.441 ( 0.707 -1.401 -10.229) 10.349 8.781 ( -6.332 -3.439 7.564) 10.447 9.095 ( 7.627 7.908 -12.134) 16.369 9.141 ( 12.598 8.876 -6.646) 16.783 9.469 ( -0.481 3.341 -1.073) 3.542 9.679 ( 2.288 -2.805 -13.138) 13.628 9.751 ( 1.024 -3.569 -2.536) 4.496 10.329 ( -2.386 -6.935 -0.328) 7.341 10.519 ( 4.239 3.101 10.303) 11.565 10.850 ( -1.420 3.415 9.647) 10.332 10.948 ( -6.657 -1.686 -5.775) 8.973 11.200 ( -2.084 -0.700 2.595) 3.402 11.517 ( -2.529 -7.587 -0.809) 8.038 11.886 ( 5.458 6.392 -0.969) 8.461 12.103 ( 8.975 -3.968 -1.282) 9.897 12.266 ( 0.280 -0.598 0.157) 0.679 12.367 ( -0.934 -1.720 -6.761) 7.038 12.774 ( 2.859 -3.191 -19.232) 19.704 12.966 ( -2.563 0.229 16.315) 16.517 13.236 ( 5.798 -0.881 4.241) 7.237 13.626 ( 0.399 -3.955 -2.689) 4.799 13.977 ( -5.074 1.926 -8.896) 10.420 14.418 ( 0.762 2.283 20.919) 21.057 14.658 ( -20.846 -5.782 13.682) 25.597 15.930 ( 6.239 0.247 -5.623) 8.403 16.681 ( 0.639 0.412 4.849) 4.908 16.867 ( -4.907 -2.823 -0.694) 5.704 17.540 ( 6.247 -0.651 0.716) 6.322 19.671 ( -0.458 0.386 3.514) 3.565 19.833 ( -7.104 0.554 10.564) 12.743 20.702 ( 6.324 0.514 2.541) 6.835 21.140 ( 5.664 -0.580 6.317) 8.504 22.438 ( -0.390 0.342 -5.109) 5.135 22.770 ( -1.463 -0.358 2.285) 2.736 23.110 ( -10.423 -2.890 0.624) 10.834 23.610 ( 7.992 10.508 -9.978) 16.549 24.213 ( -3.166 1.153 -2.306) 4.083 24.519 ( -2.032 0.433 1.194) 2.396 24.629 ( -4.959 -3.299 -3.810) 7.070 26.028 ( 3.022 2.525 -0.341) 3.953 ======================= Grid point 78 (32/186) ======================= q-point: ( 0.38 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.294 ( 21.409 -5.921 25.380) 33.727 2.717 ( 25.574 -6.514 19.499) 32.812 3.066 ( -9.016 5.721 6.324) 12.410 3.495 ( 0.387 14.048 10.735) 17.684 4.009 ( 5.749 1.002 4.406) 7.312 4.571 ( 15.272 -8.841 5.386) 18.450 4.940 ( -9.930 1.167 -0.777) 10.028 5.234 ( 3.919 -9.230 3.455) 10.606 5.495 ( -3.840 -2.737 -2.917) 5.545 5.678 ( 6.578 0.137 -5.520) 8.588 5.809 ( 2.041 -3.344 1.730) 4.282 6.267 ( -1.795 0.675 -9.663) 9.851 6.541 ( -2.420 -3.166 -10.804) 11.515 6.824 ( -0.718 -5.349 -3.905) 6.661 6.921 ( -11.535 4.803 4.170) 13.172 7.152 ( -4.666 6.398 -4.341) 9.031 7.235 ( -1.339 1.819 1.544) 2.736 7.444 ( -11.757 -0.174 -2.815) 12.091 8.084 ( -3.340 6.833 -0.092) 7.606 8.349 ( 9.629 2.616 -1.071) 10.035 8.441 ( 2.123 0.352 -11.145) 11.351 8.738 ( -4.902 2.485 1.115) 5.608 9.030 ( 3.873 8.292 1.434) 9.264 9.169 ( 7.898 4.669 -6.162) 11.053 9.472 ( 1.538 -2.977 -2.911) 4.439 9.627 ( -2.398 3.958 -0.159) 4.630 9.805 ( -1.947 -6.424 -9.700) 11.797 10.434 ( 2.981 -4.819 0.561) 5.694 10.557 ( 1.298 -0.644 0.722) 1.619 10.755 ( -4.341 8.771 16.749) 19.398 10.820 ( -5.898 -1.313 -19.242) 20.169 11.226 ( 0.737 -0.738 3.717) 3.861 11.678 ( 0.789 -11.910 5.856) 13.295 11.843 ( 3.866 5.550 -1.092) 6.851 12.203 ( -5.110 -1.461 -2.587) 5.911 12.296 ( 7.395 -4.404 -11.230) 14.149 12.379 ( 1.850 -0.680 1.886) 2.728 12.862 ( 4.811 -3.895 -3.042) 6.897 12.932 ( -2.310 3.219 7.997) 8.925 13.325 ( 6.616 0.045 -3.730) 7.595 13.716 ( 3.436 -5.220 0.790) 6.299 13.852 ( -4.097 3.465 -11.778) 12.943 14.423 ( -1.644 2.643 20.127) 20.366 14.551 ( -13.343 -5.432 7.317) 16.159 15.987 ( 4.037 -0.527 -2.612) 4.837 16.690 ( -1.298 -0.986 5.031) 5.288 16.863 ( -2.909 -3.670 -0.238) 4.689 17.619 ( 5.173 0.268 0.921) 5.261 19.672 ( -0.268 0.156 5.138) 5.147 19.782 ( -3.877 0.084 7.250) 8.222 20.769 ( 5.193 2.280 4.108) 7.003 21.213 ( 5.481 1.907 3.092) 6.576 22.434 ( 1.505 -0.182 -2.850) 3.228 22.760 ( -2.762 -1.718 0.228) 3.261 22.989 ( -14.841 -3.440 -1.751) 15.335 23.551 ( 8.658 10.044 -5.472) 14.345 24.163 ( -1.669 0.473 -1.472) 2.275 24.489 ( -3.075 -0.319 1.074) 3.272 24.620 ( -3.374 -4.356 -3.072) 6.308 26.017 ( 3.152 4.466 -1.765) 5.744 ======================= Grid point 79 (33/186) ======================= q-point: (-0.50 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.697 ( 13.364 -7.316 18.443) 23.922 2.735 ( -9.894 17.153 4.574) 20.324 3.131 ( 14.651 7.570 14.880) 22.212 3.259 ( 0.138 13.084 11.390) 17.348 3.988 ( -10.195 0.021 4.265) 11.051 4.574 ( 1.668 7.936 -6.553) 10.427 5.061 ( 3.062 -4.046 12.304) 13.309 5.454 ( 0.044 -9.078 0.501) 9.092 5.467 ( -1.901 0.036 -4.306) 4.707 5.710 ( 4.710 -1.466 -1.265) 5.093 5.877 ( 3.739 0.743 1.705) 4.177 6.198 ( -2.506 4.894 0.171) 5.501 6.385 ( -3.753 -0.581 -14.465) 14.955 6.787 ( -8.495 -2.731 2.548) 9.280 6.945 ( -2.882 -10.339 -4.304) 11.564 7.076 ( 0.824 1.906 -3.881) 4.402 7.305 ( 3.798 -9.102 7.380) 12.318 7.330 ( -6.007 -2.787 -8.370) 10.673 7.982 ( -2.281 1.580 0.379) 2.800 8.382 ( -6.392 2.356 -12.122) 13.905 8.422 ( 13.707 9.284 1.777) 16.651 8.619 ( -1.372 4.141 -8.078) 9.180 8.979 ( 0.153 5.819 8.913) 10.645 9.141 ( -0.582 4.636 -5.884) 7.514 9.521 ( 1.752 2.649 1.763) 3.633 9.626 ( 2.380 -8.741 -3.047) 9.558 9.851 ( -1.375 -7.080 -7.135) 10.145 10.464 ( 4.784 9.570 2.529) 10.994 10.513 ( -1.714 4.927 -9.700) 11.014 10.669 ( -4.875 -1.441 16.453) 17.220 10.817 ( -0.473 -9.341 -13.621) 16.523 11.212 ( 0.554 4.762 0.009) 4.794 11.763 ( -7.024 -6.017 -2.085) 9.480 11.916 ( 8.746 -0.383 8.358) 12.104 12.152 ( -1.667 0.003 -5.742) 5.979 12.282 ( -1.969 1.850 -6.604) 7.135 12.560 ( 6.885 -9.827 -1.084) 12.048 12.843 ( -3.122 6.091 21.357) 22.427 12.991 ( 5.453 -5.050 -15.923) 17.572 13.385 ( 5.327 0.874 -3.328) 6.342 13.712 ( -2.723 5.448 -11.740) 13.226 13.869 ( 8.124 -5.170 0.279) 9.634 14.405 ( -3.095 3.875 22.008) 22.560 14.484 ( -7.509 -3.943 0.528) 8.498 16.043 ( 0.816 -3.259 2.579) 4.235 16.706 ( -2.108 -2.605 5.448) 6.396 16.885 ( -1.479 -3.558 0.318) 3.866 17.672 ( 4.172 1.183 1.292) 4.524 19.687 ( -0.475 -0.628 7.203) 7.246 19.760 ( -1.912 -0.202 5.834) 6.142 20.781 ( 1.183 3.512 3.878) 5.364 21.263 ( 9.742 4.816 0.726) 10.892 22.464 ( 1.115 -1.475 0.490) 1.912 22.736 ( -7.361 -3.647 -4.852) 9.541 22.823 ( -14.423 -2.244 -2.250) 14.769 23.523 ( 8.243 8.680 -2.625) 12.255 24.158 ( 0.291 -1.438 0.026) 1.468 24.454 ( -3.767 -1.131 -0.513) 3.966 24.643 ( -2.125 -4.377 -0.685) 4.914 25.976 ( 3.581 6.505 -5.033) 8.970 ======================= Grid point 80 (34/186) ======================= q-point: (-0.38 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.280 ( -14.750 25.206 9.191) 30.617 2.643 ( -5.437 28.564 15.717) 33.053 3.141 ( 5.417 4.631 3.410) 7.901 3.332 ( 4.650 0.252 8.230) 9.456 3.672 ( -12.196 18.069 8.397) 23.361 4.683 ( 10.092 -8.948 8.839) 16.126 4.997 ( -5.781 5.184 5.541) 9.539 5.362 ( -5.909 2.502 -1.209) 6.529 5.532 ( 0.898 -3.119 -7.839) 8.484 5.822 ( 1.927 11.232 0.307) 11.400 5.910 ( 8.372 -5.495 5.365) 11.362 6.110 ( -3.498 -3.477 -3.498) 6.047 6.490 ( -3.855 -12.114 -5.333) 13.785 6.674 ( -9.665 -1.505 -0.584) 9.799 7.032 ( -0.907 -5.636 -3.784) 6.849 7.114 ( 10.351 -0.055 -4.598) 11.326 7.335 ( -0.805 -9.289 -11.285) 14.638 7.543 ( 4.409 -10.063 9.381) 14.446 7.987 ( -1.096 -3.849 -0.148) 4.005 8.179 ( -9.973 3.369 -11.926) 15.907 8.461 ( 5.450 6.085 2.401) 8.514 8.552 ( 2.342 0.865 -15.805) 16.001 8.889 ( -3.117 8.125 8.623) 12.251 9.053 ( 0.334 3.012 -5.955) 6.682 9.496 ( -0.539 1.977 4.819) 5.236 9.820 ( 4.332 -9.819 -3.549) 11.304 9.928 ( 1.582 -4.489 -2.874) 5.560 10.347 ( 0.500 8.897 3.125) 9.443 10.423 ( 4.971 9.369 -2.762) 10.960 10.679 ( -7.530 -6.314 7.320) 12.254 10.937 ( 1.507 -8.879 -10.755) 14.028 11.137 ( 2.819 6.886 -1.485) 7.587 11.728 ( -6.672 -2.555 -1.415) 7.283 11.980 ( -2.841 -1.749 -2.747) 4.321 12.140 ( 3.426 3.193 -4.652) 6.601 12.238 ( 0.763 1.620 5.532) 5.815 12.723 ( -0.973 -4.445 2.356) 5.124 12.809 ( 2.393 0.717 5.104) 5.682 13.061 ( 3.038 -1.243 -12.636) 13.055 13.450 ( 3.684 -3.537 -0.019) 5.107 13.572 ( -0.230 6.426 -13.777) 15.203 14.064 ( 9.514 -4.241 3.404) 10.959 14.327 ( -6.702 3.988 15.758) 17.582 14.498 ( 4.119 -0.960 2.282) 4.805 16.118 ( -2.999 -7.642 7.694) 11.251 16.728 ( -2.962 -2.868 6.500) 7.697 16.925 ( -0.428 -3.583 0.673) 3.671 17.704 ( 3.107 1.493 1.267) 3.673 19.700 ( -2.123 -0.817 6.340) 6.736 19.781 ( 0.639 -1.829 9.792) 9.982 20.727 ( -2.297 3.558 1.278) 4.424 21.364 ( 18.163 6.427 3.160) 19.524 22.431 ( -19.081 -5.387 -4.611) 20.356 22.635 ( -4.165 -2.006 -6.086) 7.643 22.733 ( -4.935 -0.601 0.682) 5.018 23.497 ( 6.488 8.509 -1.108) 10.758 24.209 ( 1.767 -3.276 1.437) 3.990 24.430 ( -2.488 -2.070 -1.380) 3.519 24.675 ( -2.166 -3.837 1.387) 4.620 25.907 ( 4.876 8.537 -9.029) 13.348 ======================= Grid point 81 (35/186) ======================= q-point: (-0.25 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.747 ( -11.891 28.885 17.231) 35.674 2.046 ( -15.996 39.077 4.337) 42.447 2.770 ( -3.431 39.324 17.899) 43.342 3.418 ( 0.220 -3.772 9.026) 9.785 3.534 ( 1.770 4.440 12.666) 13.538 4.909 ( -0.047 1.048 1.052) 1.486 4.994 ( 2.315 -14.955 8.581) 17.397 5.267 ( -4.084 -0.008 -2.016) 4.555 5.585 ( 6.168 -1.400 -4.408) 7.709 5.720 ( 2.562 6.366 -2.957) 7.472 6.007 ( 6.701 8.519 2.245) 11.069 6.086 ( -6.644 -4.473 -1.933) 8.239 6.356 ( -18.921 -0.262 2.633) 19.106 6.778 ( 4.099 -7.882 -8.069) 12.001 7.021 ( 2.711 4.560 -2.462) 5.849 7.309 ( 9.356 -9.656 -4.430) 14.157 7.502 ( -1.051 -17.306 -9.439) 19.740 7.730 ( -0.356 -10.872 5.970) 12.409 7.912 ( -4.901 5.589 -7.292) 10.413 8.124 ( 3.423 -2.119 -6.164) 7.362 8.341 ( -4.753 6.155 -6.322) 10.023 8.604 ( -3.051 -2.516 -9.707) 10.482 8.779 ( 3.729 0.949 0.283) 3.858 9.036 ( 2.312 2.249 -0.733) 3.308 9.495 ( -1.339 -1.767 6.791) 7.144 9.885 ( -0.906 0.734 -11.651) 11.709 9.976 ( 0.641 3.349 4.186) 5.398 10.336 ( 6.854 1.982 15.372) 16.947 10.357 ( 4.330 6.371 -5.266) 9.331 10.677 ( -8.165 -4.954 5.694) 11.119 10.997 ( 0.625 -2.340 -6.515) 6.951 11.159 ( 8.113 -0.966 -5.014) 9.586 11.651 ( -5.961 1.699 -0.052) 6.199 11.927 ( -8.231 -4.464 -10.611) 14.151 12.100 ( 0.825 4.403 -3.219) 5.516 12.260 ( 4.247 3.691 6.507) 8.603 12.701 ( -4.941 2.741 7.217) 9.166 12.850 ( 3.258 0.039 -3.981) 5.144 13.047 ( 0.559 0.824 -14.015) 14.050 13.439 ( -0.394 3.342 -20.059) 20.340 13.615 ( 4.362 -6.866 6.913) 10.675 14.196 ( -0.063 -2.939 5.481) 6.220 14.216 ( -4.567 5.396 11.215) 13.257 14.659 ( 19.298 -0.000 1.972) 19.398 16.215 ( -8.621 -13.168 12.170) 19.895 16.731 ( -5.301 -2.386 7.811) 9.737 16.973 ( 0.222 -3.111 0.815) 3.224 17.710 ( 0.014 1.316 -0.935) 1.614 19.691 ( -2.472 -0.599 4.534) 5.199 19.879 ( 0.353 -6.355 17.680) 18.791 20.651 ( -2.157 2.517 -0.813) 3.412 21.608 ( 30.457 4.394 9.925) 32.333 22.097 ( -35.956 -4.050 -15.015) 39.175 22.662 ( 0.757 -0.397 2.919) 3.041 22.678 ( -1.965 -0.426 -2.080) 2.893 23.444 ( 3.811 8.320 -0.218) 9.154 24.282 ( 0.352 -3.720 1.851) 4.170 24.452 ( 1.380 -2.952 -1.564) 3.615 24.696 ( -2.692 -2.743 3.252) 5.034 25.829 ( 8.095 10.147 -13.061) 18.414 ======================= Grid point 82 (36/186) ======================= q-point: (-0.12 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.270 ( -8.357 35.355 13.859) 38.883 1.342 ( 0.143 28.577 25.143) 38.064 2.322 ( 14.846 44.172 41.962) 62.709 3.477 ( -1.236 -2.529 8.427) 8.885 3.485 ( -4.467 3.472 7.479) 9.378 4.882 ( -5.661 -1.106 -2.546) 6.305 5.135 ( -2.019 -4.637 -2.827) 5.794 5.332 ( 2.020 -10.026 1.604) 10.353 5.649 ( 1.339 2.681 -2.996) 4.238 5.682 ( -0.166 0.944 -1.763) 2.007 5.913 ( -2.138 5.751 -2.286) 6.548 6.115 ( 4.173 -1.390 2.709) 5.166 6.154 ( -6.245 1.594 1.658) 6.655 6.745 ( 4.275 14.856 -8.684) 17.732 7.067 ( -0.889 -6.050 -3.850) 7.226 7.553 ( 3.781 -10.263 -8.299) 13.730 7.638 ( -6.699 -10.857 -5.306) 13.817 7.841 ( 5.706 -7.475 2.739) 9.794 7.907 ( -1.729 -10.198 -6.453) 12.192 8.130 ( 4.969 8.694 -3.574) 10.633 8.223 ( 3.826 4.152 -2.486) 6.169 8.532 ( -3.088 -4.094 -10.307) 11.512 8.939 ( 5.225 -7.834 -0.874) 9.457 9.020 ( -1.270 0.572 -0.551) 1.498 9.530 ( -2.249 -3.105 6.370) 7.435 9.784 ( 0.191 6.886 -14.700) 16.234 9.878 ( -1.844 7.214 0.617) 7.471 10.283 ( 2.736 8.670 3.470) 9.731 10.500 ( 4.586 -2.580 11.185) 12.361 10.636 ( -5.080 -1.033 13.865) 14.803 11.068 ( 3.303 -6.514 -5.734) 9.285 11.291 ( 10.168 -1.112 -4.129) 11.031 11.521 ( -5.515 5.099 -6.053) 9.647 11.850 ( -9.510 -4.864 -9.710) 14.436 12.022 ( -1.033 6.142 -1.324) 6.367 12.261 ( 5.720 6.946 -0.657) 9.022 12.563 ( -7.623 4.183 1.631) 8.847 12.900 ( 4.514 0.171 1.348) 4.714 13.001 ( -1.229 -0.475 -14.411) 14.471 13.327 ( -1.824 4.967 -19.700) 20.398 13.736 ( -2.375 -3.232 6.428) 7.576 14.137 ( -0.457 1.679 5.919) 6.169 14.206 ( -2.783 0.541 10.377) 10.757 14.961 ( 22.960 -1.195 -2.747) 23.155 16.286 ( -23.694 -18.614 17.424) 34.806 16.679 ( -8.129 0.343 7.405) 11.001 17.016 ( 0.044 -2.011 0.843) 2.181 17.614 ( -7.837 5.607 -6.423) 11.581 19.680 ( -2.044 -0.647 3.814) 4.375 20.044 ( -7.287 -14.701 23.991) 29.065 20.611 ( 0.203 0.872 -0.922) 1.286 21.502 ( -36.193 9.966 -12.426) 39.543 22.208 ( 42.851 -13.023 11.969) 46.358 22.617 ( -1.712 -0.146 -0.469) 1.781 22.738 ( 5.408 -0.968 3.146) 6.331 23.366 ( 0.740 6.932 0.471) 6.987 24.317 ( -2.357 -2.884 0.577) 3.768 24.530 ( 3.177 -2.886 -1.206) 4.459 24.703 ( -1.780 -1.808 4.401) 5.080 25.793 ( 14.203 9.470 -15.464) 23.034 ======================= Grid point 85 (37/186) ======================= q-point: ( 0.25 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.382 ( 24.941 0.000 25.249) 35.491 2.412 ( 21.114 0.000 34.733) 40.647 3.230 ( -2.498 -0.000 3.996) 4.713 3.589 ( 7.154 0.000 2.447) 7.561 4.144 ( 24.994 0.000 16.182) 29.776 4.414 ( 12.627 0.000 4.701) 13.474 4.696 ( -14.989 -0.000 0.793) 15.010 5.417 ( 1.455 0.000 -9.273) 9.387 5.554 ( 6.939 0.000 -9.188) 11.514 5.653 ( -3.239 -0.000 6.852) 7.579 5.773 ( 4.734 0.000 1.265) 4.900 5.874 ( -8.141 -0.000 -12.007) 14.507 6.652 ( -5.712 -0.000 -1.746) 5.973 6.701 ( 9.191 0.000 -13.496) 16.328 6.974 ( -8.579 -0.000 0.912) 8.628 7.248 ( -3.241 -0.000 -10.465) 10.956 7.424 ( -11.513 -0.000 4.373) 12.315 7.478 ( -14.584 -0.000 3.240) 14.940 8.210 ( -9.650 -0.000 -3.260) 10.185 8.324 ( 9.285 0.000 5.427) 10.755 8.459 ( 5.177 0.000 -11.207) 12.345 8.623 ( -10.710 -0.000 8.109) 13.434 9.226 ( 9.717 0.000 -23.499) 25.429 9.254 ( -3.622 -0.000 0.222) 3.629 9.504 ( -1.967 -0.000 2.059) 2.848 9.630 ( 6.840 0.000 -24.032) 24.986 9.870 ( 9.642 0.000 3.972) 10.429 10.190 ( -4.776 -0.000 -3.028) 5.655 10.615 ( -0.636 -0.000 9.720) 9.740 10.752 ( -4.566 -0.000 -10.513) 11.462 11.043 ( 1.646 0.000 25.133) 25.187 11.149 ( -1.897 -0.000 1.476) 2.404 11.407 ( -0.383 -0.000 1.497) 1.545 12.030 ( 5.141 0.000 -7.365) 8.982 12.031 ( -7.133 -0.000 0.698) 7.167 12.293 ( 1.104 0.000 -15.361) 15.400 12.365 ( 5.089 0.000 7.072) 8.712 12.776 ( 7.870 0.000 -19.095) 20.653 13.017 ( 0.194 0.000 20.358) 20.359 13.318 ( 4.666 0.000 8.246) 9.475 13.618 ( 6.021 0.000 -7.320) 9.478 13.903 ( -4.604 -0.000 -10.068) 11.071 14.409 ( -14.282 -0.000 7.835) 16.290 14.489 ( -1.035 -0.000 20.552) 20.578 15.988 ( 4.336 0.000 -6.238) 7.597 16.710 ( 0.489 0.000 4.849) 4.873 16.775 ( -4.829 -0.000 -0.327) 4.840 17.624 ( 6.330 0.000 0.973) 6.404 19.675 ( -0.711 -0.000 4.239) 4.298 19.783 ( -4.338 -0.000 7.299) 8.491 20.806 ( 6.323 0.000 6.077) 8.770 21.240 ( 7.460 0.000 4.533) 8.730 22.432 ( 0.669 0.000 -3.204) 3.273 22.733 ( -3.661 -0.000 -0.552) 3.702 22.944 ( -12.501 -0.000 0.345) 12.506 23.721 ( 3.904 0.000 -9.740) 10.493 24.177 ( -2.555 -0.000 -2.326) 3.455 24.509 ( -6.511 -0.000 -2.870) 7.115 24.513 ( -0.664 -0.000 0.619) 0.908 26.086 ( 2.958 0.000 0.347) 2.979 ======================= Grid point 86 (38/186) ======================= q-point: ( 0.38 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.627 ( 19.519 4.883 26.788) 33.502 2.919 ( 17.042 -12.895 23.293) 31.611 3.131 ( -0.258 9.838 4.025) 10.633 3.681 ( 4.008 0.037 2.553) 4.752 4.022 ( -11.858 13.557 3.754) 18.398 4.703 ( -7.326 -15.393 4.092) 17.532 4.852 ( 27.576 1.059 2.769) 27.735 5.349 ( 3.945 14.025 4.859) 15.358 5.432 ( 1.699 -1.349 -7.985) 8.274 5.716 ( 4.170 -2.730 -9.123) 10.395 5.858 ( 7.583 0.948 6.683) 10.152 6.015 ( -3.924 -21.189 -11.877) 24.606 6.504 ( -8.689 2.339 2.704) 9.396 6.711 ( -5.785 1.184 -9.794) 11.436 6.883 ( -5.631 2.939 2.594) 6.861 7.171 ( -10.007 5.971 8.007) 14.139 7.216 ( -0.030 1.950 -4.699) 5.087 7.321 ( -7.333 0.226 -6.498) 9.800 8.066 ( -8.049 1.944 -2.480) 8.644 8.421 ( -1.118 2.429 -7.605) 8.061 8.515 ( 10.360 -1.782 7.133) 12.704 8.606 ( -4.390 -6.623 -0.379) 7.955 9.110 ( -9.454 4.020 2.573) 10.590 9.288 ( 7.912 -0.432 -23.646) 24.938 9.473 ( 0.965 3.348 -1.320) 3.726 9.648 ( 1.583 -0.650 -15.557) 15.651 9.851 ( 5.136 12.376 1.675) 13.503 10.305 ( 2.189 -14.122 -1.115) 14.334 10.570 ( -3.769 2.529 8.746) 9.853 10.704 ( -2.773 -1.269 -12.526) 12.892 10.964 ( 1.839 13.622 14.911) 20.280 11.217 ( 0.202 -3.732 6.686) 7.660 11.522 ( 0.809 -8.965 7.844) 11.939 11.900 ( -6.427 -0.092 -0.861) 6.485 12.100 ( 2.125 -3.692 -9.702) 10.596 12.297 ( 4.090 -0.194 -14.942) 15.493 12.417 ( 0.775 -0.375 9.379) 9.418 12.869 ( 9.077 -2.739 -17.928) 20.281 13.011 ( -3.218 4.602 19.161) 19.967 13.391 ( 3.175 -0.574 2.492) 4.077 13.747 ( 11.615 -2.729 -3.152) 12.340 13.816 ( -2.845 1.785 -9.808) 10.367 14.311 ( -8.746 -5.365 1.644) 10.391 14.498 ( -3.321 1.964 20.290) 20.654 16.009 ( 0.669 0.038 -2.720) 2.801 16.688 ( -1.371 1.458 2.672) 3.338 16.774 ( -1.968 -4.065 2.063) 4.965 17.698 ( 5.135 0.559 0.971) 5.256 19.675 ( -1.226 -0.190 5.358) 5.500 19.757 ( -2.076 -0.048 5.379) 5.766 20.868 ( 2.226 2.020 6.979) 7.599 21.352 ( 10.589 1.562 1.204) 10.771 22.436 ( -0.891 -0.463 1.281) 1.628 22.679 ( -4.551 -0.542 -5.284) 6.995 22.783 ( -12.258 -0.966 -0.502) 12.306 23.717 ( 4.440 4.214 -6.424) 8.873 24.146 ( -1.013 0.152 -1.226) 1.598 24.425 ( -5.468 -0.612 -1.696) 5.758 24.530 ( -0.871 -2.850 0.109) 2.982 26.104 ( 2.755 2.518 -1.539) 4.037 ======================= Grid point 87 (39/186) ======================= q-point: (-0.50 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.845 ( -0.928 7.197 18.113) 19.513 2.924 ( 10.260 8.419 9.528) 16.338 3.334 ( 10.825 -2.406 9.880) 14.852 3.580 ( 0.005 20.873 12.145) 24.149 3.802 ( -11.354 -6.960 -0.989) 13.354 4.662 ( -4.039 8.407 1.017) 9.382 5.043 ( 3.231 -10.020 1.805) 10.681 5.420 ( 3.927 0.089 -9.018) 9.836 5.505 ( 7.214 3.367 9.420) 12.333 5.772 ( 5.190 0.881 -3.404) 6.269 5.922 ( 5.566 -1.157 1.234) 5.817 6.134 ( -3.904 -7.809 -5.983) 10.584 6.347 ( -7.738 9.991 -2.680) 12.918 6.617 ( -12.578 -9.358 -7.102) 17.211 6.745 ( -2.465 -0.024 9.272) 9.594 7.137 ( -0.267 -0.977 -5.134) 5.233 7.218 ( 3.207 -7.090 6.789) 10.327 7.313 ( 6.921 1.398 -5.535) 8.972 7.948 ( -5.749 0.922 -0.730) 5.868 8.283 ( -10.625 3.660 -9.044) 14.425 8.598 ( -1.356 -0.252 -8.835) 8.942 8.659 ( 7.029 2.923 3.847) 8.530 8.976 ( -8.740 -0.780 5.335) 10.269 9.295 ( 8.414 10.101 -12.274) 17.986 9.478 ( 2.584 -5.857 -9.790) 11.697 9.660 ( 1.446 -0.911 1.565) 2.317 9.772 ( 2.571 3.511 -5.804) 7.254 10.480 ( -0.320 -2.959 -6.764) 7.390 10.518 ( -3.228 -0.594 10.828) 11.314 10.674 ( -0.650 -5.434 -7.813) 9.539 10.841 ( 4.407 13.703 9.340) 17.159 11.247 ( -2.198 0.055 5.862) 6.261 11.614 ( -2.430 -4.635 1.511) 5.447 11.875 ( -5.485 -5.205 -2.494) 7.962 12.170 ( 6.121 -2.092 -7.575) 9.961 12.293 ( 0.720 2.065 -1.290) 2.539 12.498 ( 1.904 -6.995 0.222) 7.253 12.908 ( -2.550 3.613 3.700) 5.766 13.004 ( 6.783 -1.442 -4.996) 8.547 13.413 ( -0.212 -0.372 -3.953) 3.976 13.731 ( -0.712 4.146 -7.450) 8.555 13.946 ( 10.964 -3.403 2.447) 11.738 14.326 ( -2.419 -6.731 -2.891) 7.714 14.461 ( -3.849 2.538 20.229) 20.748 15.997 ( -3.429 -1.330 2.517) 4.457 16.679 ( -0.221 -0.793 1.898) 2.068 16.817 ( -1.119 -3.876 2.940) 4.992 17.745 ( 3.531 1.256 0.859) 3.845 19.676 ( -1.902 -0.737 5.509) 5.874 19.757 ( -0.424 -0.308 5.966) 5.989 20.839 ( -2.148 3.799 4.051) 5.955 21.487 ( 14.972 2.688 0.690) 15.226 22.362 ( -14.246 0.127 -0.244) 14.248 22.616 ( -0.334 0.031 -3.735) 3.750 22.693 ( -5.458 -2.169 -1.781) 6.138 23.701 ( 5.022 5.397 -3.273) 8.066 24.149 ( 0.888 -0.972 0.486) 1.403 24.373 ( -4.252 -1.631 -1.419) 4.770 24.565 ( -1.005 -3.598 0.604) 3.784 26.082 ( 2.330 4.272 -4.492) 6.623 ======================= Grid point 88 (40/186) ======================= q-point: (-0.38 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.530 ( -5.857 24.680 11.086) 27.683 2.989 ( -0.795 22.251 12.025) 25.305 3.239 ( -1.151 2.403 7.569) 8.024 3.469 ( 2.504 10.124 0.141) 10.430 3.729 ( -6.947 0.314 1.672) 7.152 4.655 ( 2.585 -7.026 13.876) 15.767 5.134 ( 2.525 9.937 6.318) 12.043 5.353 ( -5.816 6.552 5.071) 10.122 5.456 ( 3.071 -3.737 -8.553) 9.825 5.877 ( 2.814 -1.503 5.205) 6.105 5.980 ( -9.691 -0.236 -0.569) 9.710 6.103 ( 8.320 7.945 0.962) 11.545 6.271 ( 0.372 -11.331 -6.228) 12.935 6.566 ( -4.766 -4.128 -8.448) 10.542 6.865 ( 0.772 -11.528 2.815) 11.892 7.152 ( -1.166 -6.390 -8.754) 10.901 7.342 ( 9.687 7.065 -5.325) 13.119 7.466 ( 3.486 -10.707 9.121) 14.491 7.925 ( -1.124 -4.847 2.180) 5.432 8.052 ( -8.853 4.061 -10.458) 14.291 8.503 ( -3.659 4.983 -9.851) 11.630 8.668 ( 2.805 4.713 -2.844) 6.178 8.881 ( -5.732 1.947 -4.668) 7.644 9.244 ( 9.977 11.425 2.098) 15.313 9.518 ( -1.451 2.219 -0.731) 2.750 9.753 ( 4.331 -6.878 1.911) 8.350 9.833 ( 2.091 -9.490 -9.363) 13.494 10.405 ( -4.729 2.462 0.413) 5.348 10.487 ( -3.040 1.013 -0.150) 3.208 10.739 ( 3.857 10.941 10.707) 15.787 10.820 ( 3.746 -9.407 -7.084) 12.358 11.214 ( -1.962 1.368 4.821) 5.382 11.635 ( -1.262 -2.334 -0.104) 2.655 11.826 ( -7.218 -1.697 -10.708) 13.025 12.208 ( 0.936 2.284 -5.596) 6.116 12.318 ( 4.093 0.362 9.808) 10.634 12.619 ( 0.091 -7.754 -7.559) 10.829 12.846 ( -2.468 0.845 7.545) 7.983 13.091 ( 6.501 0.426 -10.636) 12.473 13.404 ( -0.836 -2.471 -8.818) 9.196 13.646 ( 1.174 5.591 -4.619) 7.347 14.090 ( 0.456 -3.978 5.254) 6.606 14.343 ( -2.032 3.000 10.125) 10.753 14.530 ( 7.272 -6.784 5.200) 11.223 15.977 ( -7.102 -3.966 7.306) 10.934 16.704 ( 0.787 -0.902 2.126) 2.440 16.869 ( -0.429 -3.995 3.245) 5.164 17.757 ( 1.295 1.800 0.118) 2.221 19.671 ( -2.337 -0.792 4.415) 5.058 19.786 ( 0.052 -1.484 9.170) 9.289 20.747 ( -3.350 4.062 0.366) 5.278 21.685 ( 19.634 1.235 2.655) 19.851 22.085 ( -21.979 2.738 -6.303) 23.028 22.633 ( -3.279 -2.317 1.406) 4.254 22.672 ( 2.831 0.300 -2.247) 3.626 23.669 ( 3.805 6.924 -1.301) 8.007 24.193 ( 1.266 -2.297 1.621) 3.083 24.363 ( -0.930 -2.852 -0.934) 3.142 24.604 ( -1.376 -3.634 1.578) 4.194 26.029 ( 2.062 5.063 -7.606) 9.367 ======================= Grid point 89 (41/186) ======================= q-point: (-0.25 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.131 ( 0.012 29.674 16.414) 33.911 2.419 ( -11.228 38.898 -1.504) 40.514 3.263 ( 9.297 14.548 12.801) 21.493 3.370 ( -4.673 -1.650 5.528) 7.424 3.631 ( -6.231 4.099 8.002) 10.940 4.864 ( 1.802 -8.566 17.084) 19.196 4.963 ( -1.525 9.901 3.450) 10.595 5.261 ( -0.632 3.357 -1.347) 3.672 5.588 ( 6.320 -6.241 -4.197) 9.824 5.799 ( -3.024 5.145 2.618) 6.517 5.942 ( -5.264 -3.703 -3.390) 7.274 6.140 ( 0.662 -1.535 3.032) 3.462 6.310 ( 3.828 8.606 -0.123) 9.420 6.656 ( 3.159 -11.815 -6.650) 13.921 7.057 ( 3.466 -9.836 -3.425) 10.976 7.228 ( -3.171 -10.309 -7.347) 13.050 7.334 ( 4.113 2.435 -5.727) 7.460 7.574 ( -5.384 -5.629 3.847) 8.687 7.948 ( 2.619 3.707 -10.157) 11.125 8.051 ( 0.869 -10.166 3.651) 10.837 8.391 ( 1.793 2.727 -5.510) 6.404 8.577 ( -2.558 7.624 -8.325) 11.574 8.769 ( -2.447 1.877 -10.457) 10.902 9.227 ( 8.349 9.746 4.591) 13.630 9.463 ( -3.595 0.228 7.412) 8.241 9.839 ( 0.834 -1.753 -11.246) 11.412 9.992 ( 1.734 -5.310 2.405) 6.082 10.337 ( -5.345 -3.785 -0.188) 6.552 10.469 ( 1.260 -0.850 2.974) 3.340 10.673 ( 4.227 8.727 7.690) 12.376 10.957 ( 2.561 -5.300 -4.162) 7.209 11.218 ( 1.158 -2.382 3.422) 4.327 11.658 ( 2.779 1.310 4.337) 5.315 11.694 ( -9.281 -0.668 -18.117) 20.367 12.157 ( -0.383 3.537 -3.431) 4.943 12.361 ( 1.490 2.087 7.657) 8.075 12.643 ( -3.906 -1.952 -7.766) 8.910 12.866 ( -0.336 -2.693 6.189) 6.758 13.084 ( 2.997 4.873 -11.750) 13.069 13.398 ( -0.452 -0.609 -17.312) 17.328 13.633 ( 4.130 -0.310 2.644) 4.913 14.100 ( -6.460 -2.788 2.433) 7.445 14.295 ( -1.997 3.932 16.236) 16.824 14.788 ( 10.778 -9.781 0.565) 14.565 15.957 ( -10.389 -5.861 10.661) 15.998 16.721 ( 0.546 1.071 3.348) 3.557 16.931 ( 0.138 -3.849 2.813) 4.769 17.719 ( -2.196 2.908 -1.898) 4.108 19.661 ( -2.166 -0.661 3.723) 4.358 19.839 ( -1.575 -3.279 12.873) 13.377 20.662 ( -1.740 2.679 -1.554) 3.552 21.702 ( -23.231 5.227 -8.939) 25.434 22.007 ( 25.682 -2.997 5.884) 26.518 22.603 ( -3.394 -1.255 -1.807) 4.045 22.727 ( 4.548 0.174 2.582) 5.233 23.592 ( 0.973 8.340 -0.269) 8.401 24.232 ( -1.187 -2.609 0.850) 2.989 24.431 ( 3.441 -3.853 0.256) 5.172 24.638 ( -1.249 -3.030 2.720) 4.259 25.966 ( 2.310 4.427 -9.844) 11.038 ======================= Grid point 90 (42/186) ======================= q-point: (-0.12 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.769 ( 2.579 34.786 8.169) 35.826 1.876 ( 11.438 27.393 20.598) 36.131 3.177 ( 19.310 27.828 23.735) 41.359 3.375 ( -6.943 -4.808 6.435) 10.618 3.503 ( -7.426 2.086 9.239) 12.036 4.794 ( -6.957 5.800 1.502) 9.181 5.036 ( -0.953 -8.264 6.012) 10.264 5.254 ( 2.203 -1.851 -2.986) 4.147 5.666 ( -1.739 3.735 -3.032) 5.115 5.738 ( 2.551 1.318 -2.173) 3.601 5.872 ( -7.427 3.149 -2.490) 8.443 6.108 ( -0.014 0.006 1.450) 1.450 6.371 ( 18.012 3.744 2.389) 18.551 6.817 ( 0.686 -6.801 -8.758) 11.110 7.104 ( 3.516 7.538 0.561) 8.337 7.319 ( -6.686 -15.463 -8.316) 18.787 7.384 ( -8.034 -6.936 -1.854) 10.775 7.647 ( 1.734 -13.893 -3.414) 14.411 7.901 ( 1.920 0.939 -10.777) 10.987 8.234 ( 4.358 -9.038 9.248) 13.645 8.374 ( -0.054 10.917 -8.917) 14.096 8.438 ( 5.736 0.349 -7.979) 9.833 8.768 ( -1.001 -8.764 -8.307) 12.117 9.189 ( 2.765 8.707 5.244) 10.533 9.467 ( -2.090 -2.434 7.229) 7.909 9.803 ( 0.702 3.229 -10.019) 10.550 9.966 ( -2.402 5.555 0.244) 6.057 10.349 ( -2.969 -3.158 -5.264) 6.819 10.548 ( 3.955 -0.761 4.460) 6.010 10.655 ( 2.678 2.752 14.947) 15.432 11.035 ( 3.457 -3.272 -4.479) 6.536 11.318 ( 0.251 -7.741 0.493) 7.760 11.505 ( -7.362 4.275 -14.750) 17.031 11.724 ( 7.776 0.750 1.630) 7.981 12.082 ( -1.173 4.970 -1.393) 5.293 12.359 ( -0.305 0.796 6.220) 6.278 12.536 ( -5.648 4.592 -10.260) 12.580 12.924 ( -1.082 -3.800 10.918) 11.611 13.001 ( 1.642 5.993 -16.485) 17.618 13.323 ( -0.454 3.547 -18.787) 19.124 13.711 ( 1.314 -1.162 5.059) 5.354 14.052 ( -5.924 -3.282 -3.115) 7.454 14.272 ( -1.172 2.223 20.027) 20.184 15.019 ( 0.237 -9.703 0.579) 9.723 15.911 ( -10.640 -3.456 11.020) 15.703 16.702 ( 0.079 3.294 4.633) 5.686 16.980 ( -0.799 -2.325 1.593) 2.930 17.607 ( -4.001 5.404 -3.624) 7.639 19.655 ( -1.483 -0.738 3.617) 3.978 19.887 ( -5.389 -4.457 15.185) 16.718 20.626 ( 0.603 0.852 -1.894) 2.163 21.322 ( -14.448 8.976 -4.706) 17.648 22.403 ( 10.666 -7.126 -0.196) 12.829 22.642 ( 10.103 -4.306 1.144) 11.041 22.814 ( 8.936 -3.348 3.948) 10.327 23.462 ( -2.876 8.409 0.188) 8.889 24.243 ( -2.514 -2.506 -0.484) 3.582 24.520 ( 1.518 -2.516 1.169) 3.163 24.677 ( 0.756 -2.298 2.151) 3.237 25.930 ( 3.007 1.803 -9.414) 10.046 ======================= Grid point 94 (43/186) ======================= q-point: ( 0.38 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.941 ( 3.351 0.000 24.384) 24.613 3.065 ( 18.660 0.000 18.287) 26.127 3.261 ( 7.093 0.000 9.789) 12.089 3.608 ( -7.964 -0.000 -6.595) 10.340 4.071 ( -9.773 -0.000 5.840) 11.385 4.500 ( -0.995 -0.000 9.338) 9.391 5.163 ( 12.294 0.000 -5.747) 13.571 5.452 ( 6.130 0.000 -2.871) 6.769 5.580 ( -5.161 -0.000 -19.746) 20.410 5.715 ( 4.985 0.000 -10.614) 11.726 5.736 ( 9.077 0.000 6.118) 10.946 6.032 ( 12.259 0.000 9.813) 15.703 6.341 ( -15.048 -0.000 3.451) 15.439 6.662 ( -5.841 -0.000 -6.592) 8.807 6.848 ( -4.421 -0.000 8.368) 9.464 7.090 ( -8.729 -0.000 14.177) 16.649 7.168 ( -8.335 -0.000 -8.824) 12.138 7.342 ( 12.903 0.000 -6.107) 14.276 7.957 ( -8.011 -0.000 -3.332) 8.677 8.367 ( -10.084 -0.000 3.382) 10.635 8.510 ( 3.830 0.000 -13.517) 14.049 8.671 ( 8.106 0.000 8.640) 11.847 8.947 ( -16.703 -0.000 2.066) 16.831 9.306 ( 6.893 0.000 -23.037) 24.046 9.541 ( 4.219 0.000 4.615) 6.253 9.623 ( 1.077 0.000 -24.859) 24.882 10.110 ( 4.720 0.000 3.792) 6.054 10.130 ( 0.963 0.000 -2.856) 3.015 10.572 ( -3.083 -0.000 4.883) 5.775 10.660 ( 0.622 0.000 -4.395) 4.439 11.129 ( -4.840 -0.000 17.876) 18.519 11.175 ( 2.211 0.000 -0.762) 2.338 11.535 ( 4.955 0.000 13.323) 14.214 11.757 ( -8.375 -0.000 -5.490) 10.014 12.108 ( 5.643 0.000 -11.568) 12.871 12.325 ( 4.419 0.000 -9.832) 10.779 12.410 ( -3.853 -0.000 7.997) 8.877 12.939 ( 10.170 0.000 -17.084) 19.882 13.015 ( -7.088 -0.000 15.159) 16.734 13.406 ( -0.303 -0.000 -2.061) 2.083 13.791 ( 0.012 0.000 -4.367) 4.367 13.897 ( 11.818 0.000 1.568) 11.921 14.194 ( -1.158 -0.000 -5.023) 5.154 14.508 ( -4.880 -0.000 19.391) 19.996 15.992 ( -2.482 -0.000 -1.280) 2.792 16.676 ( -2.592 -0.000 0.310) 2.611 16.746 ( 0.864 0.000 5.398) 5.466 17.764 ( 3.751 0.000 0.893) 3.856 19.665 ( -1.934 -0.000 4.808) 5.182 19.753 ( -0.609 -0.000 5.309) 5.344 20.899 ( -2.230 -0.000 5.300) 5.750 21.524 ( 13.562 0.000 -0.344) 13.567 22.382 ( -8.572 -0.000 3.725) 9.347 22.618 ( -10.489 -0.000 -1.696) 10.625 22.648 ( 2.101 0.000 -6.424) 6.759 23.777 ( 3.433 0.000 -4.792) 5.895 24.140 ( 0.418 0.000 0.025) 0.419 24.350 ( -4.269 -0.000 -0.675) 4.322 24.507 ( -0.342 -0.000 0.189) 0.391 26.143 ( 1.337 0.000 -3.221) 3.488 ======================= Grid point 95 (44/186) ======================= q-point: ( 0.50 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.948 ( -3.433 5.191 16.589) 17.718 3.213 ( 8.509 6.080 11.446) 15.504 3.437 ( 4.797 0.731 7.187) 8.672 3.522 ( -10.962 -9.014 -2.128) 14.350 3.834 ( -3.000 15.373 11.638) 19.513 4.641 ( -2.145 -9.443 5.995) 11.389 5.033 ( -0.573 11.813 -6.785) 13.635 5.446 ( 2.384 0.587 -9.999) 10.296 5.699 ( 6.524 5.527 -0.468) 8.563 5.731 ( 3.205 -17.594 -12.792) 21.988 5.940 ( 1.396 -2.343 -1.363) 3.049 6.088 ( 3.580 5.803 3.104) 7.492 6.267 ( -8.312 -9.722 1.172) 12.845 6.481 ( -4.188 12.297 4.108) 13.624 6.807 ( -0.497 2.720 10.385) 10.746 7.022 ( -6.676 -2.252 0.002) 7.046 7.193 ( 6.454 -6.041 7.806) 11.793 7.507 ( 15.291 2.764 -4.082) 16.066 7.856 ( -6.831 -0.585 -3.431) 7.666 8.224 ( -5.164 5.728 -2.005) 7.969 8.543 ( 0.004 -3.160 -10.717) 11.173 8.702 ( -5.622 1.354 3.386) 6.701 8.826 ( -5.695 -5.927 1.924) 8.442 9.393 ( 9.034 -4.614 -15.624) 18.628 9.531 ( 3.621 5.073 -14.757) 16.019 9.627 ( 3.032 -1.280 -0.569) 3.340 9.932 ( 0.127 13.544 -0.677) 13.562 10.346 ( -1.025 -12.207 -3.680) 12.791 10.535 ( -1.012 1.158 10.007) 10.124 10.639 ( 0.489 3.374 -6.276) 7.142 11.025 ( -5.636 5.371 7.828) 11.040 11.205 ( -1.602 -0.943 2.823) 3.380 11.593 ( 1.694 1.226 4.474) 4.939 11.741 ( -1.624 -5.304 -0.056) 5.548 12.183 ( 6.168 -2.950 -12.262) 14.040 12.334 ( 0.045 1.560 3.908) 4.208 12.413 ( -0.922 -4.925 -1.517) 5.235 12.917 ( -5.908 3.404 7.170) 9.895 13.051 ( 7.720 -2.637 -10.850) 13.575 13.374 ( -2.127 -0.264 -9.225) 9.471 13.778 ( 1.287 3.205 -0.079) 3.454 13.995 ( -0.082 -2.428 4.335) 4.969 14.284 ( 10.093 -4.210 -5.099) 12.066 14.474 ( -5.460 1.181 18.464) 19.290 15.945 ( -3.763 0.429 1.233) 3.983 16.664 ( -0.463 -1.484 0.423) 1.611 16.786 ( 0.850 -1.456 6.348) 6.568 17.797 ( 1.821 0.829 0.742) 2.134 19.653 ( -1.989 -0.402 4.016) 4.499 19.765 ( -0.178 -0.265 6.553) 6.561 20.844 ( -4.560 2.141 1.119) 5.161 21.696 ( 12.960 0.001 -0.530) 12.971 22.207 ( -13.436 4.432 -0.797) 14.170 22.536 ( -5.555 -3.703 -1.484) 6.839 22.687 ( 4.867 0.428 -2.045) 5.296 23.798 ( 3.546 2.175 -2.389) 4.797 24.160 ( 1.851 -0.293 1.861) 2.641 24.314 ( -1.800 -0.667 0.467) 1.975 24.515 ( -0.853 -2.113 -0.208) 2.288 26.125 ( -0.301 1.798 -5.813) 6.092 ======================= Grid point 96 (45/186) ======================= q-point: (-0.38 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.808 ( -1.491 14.477 13.757) 20.027 3.176 ( -14.007 4.513 3.551) 15.139 3.358 ( 10.106 14.054 13.303) 21.832 3.480 ( -14.175 -7.042 -5.159) 16.647 3.665 ( -2.593 12.537 1.248) 12.863 4.653 ( 1.695 -1.504 8.743) 9.032 5.101 ( 0.971 -13.805 1.019) 13.876 5.420 ( 0.536 5.590 -7.475) 9.349 5.622 ( 3.199 12.479 9.881) 16.236 5.835 ( -5.779 -1.499 -3.868) 7.113 5.984 ( 3.320 3.186 1.381) 4.804 6.074 ( -2.777 -7.718 -8.965) 12.152 6.301 ( -5.891 -10.172 -6.318) 13.345 6.379 ( 7.358 4.418 6.146) 10.556 6.851 ( 5.195 0.430 10.451) 11.679 7.016 ( -1.690 -5.802 -4.263) 7.396 7.410 ( 5.372 -6.686 7.147) 11.164 7.546 ( 3.405 9.208 -2.764) 10.199 7.833 ( 1.083 -4.658 0.049) 4.782 8.094 ( 2.250 7.818 -5.495) 9.817 8.510 ( -0.907 3.285 -7.842) 8.550 8.651 ( -3.221 -1.845 -1.799) 4.125 8.834 ( -2.434 -1.974 -6.240) 6.983 9.479 ( 0.159 1.979 -0.880) 2.171 9.567 ( 11.691 3.086 -6.410) 13.685 9.703 ( 3.056 -6.515 -3.796) 8.136 9.763 ( -1.470 4.245 -3.677) 5.806 10.327 ( -8.704 1.688 2.327) 9.167 10.533 ( 0.821 5.069 -3.453) 6.188 10.676 ( 0.526 -10.776 2.441) 11.062 10.906 ( -4.326 2.903 0.853) 5.279 11.194 ( -0.755 1.042 5.695) 5.839 11.609 ( 1.259 -0.110 -6.272) 6.398 11.767 ( -0.107 -0.080 2.544) 2.548 12.216 ( 0.033 0.601 -8.390) 8.411 12.379 ( 2.917 -1.583 9.309) 9.884 12.487 ( -0.060 -7.155 -8.107) 10.813 12.817 ( -5.667 1.279 6.673) 8.848 13.150 ( 6.441 -0.831 -12.287) 13.898 13.340 ( -0.476 -2.007 -10.667) 10.865 13.731 ( 1.081 5.068 0.285) 5.190 14.013 ( -4.601 -3.252 2.340) 6.100 14.388 ( -2.315 2.256 13.130) 13.522 14.522 ( 4.907 -7.533 5.242) 10.407 15.900 ( -2.413 0.802 3.284) 4.153 16.704 ( 1.606 -2.468 0.201) 2.951 16.836 ( 0.458 -2.033 7.696) 7.973 17.788 ( -0.601 1.882 0.136) 1.980 19.644 ( -1.816 -0.527 3.556) 4.027 19.787 ( -0.596 -0.897 8.311) 8.381 20.745 ( -4.209 2.812 -2.242) 5.536 21.781 ( -8.409 0.477 -4.610) 9.602 22.032 ( 7.533 4.251 1.159) 8.727 22.535 ( -2.409 -3.503 -2.603) 4.985 22.742 ( 4.662 0.717 1.844) 5.065 23.786 ( 2.242 4.928 -0.796) 5.473 24.192 ( 0.909 -0.271 2.518) 2.691 24.339 ( 2.622 -2.288 1.493) 3.786 24.541 ( -1.019 -3.459 0.281) 3.617 26.062 ( -1.783 2.438 -8.463) 8.986 ======================= Grid point 97 (46/186) ======================= q-point: (-0.25 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.596 ( 5.294 23.314 15.034) 28.242 2.797 ( -6.755 28.925 -0.262) 29.705 3.218 ( -13.270 -0.363 4.317) 13.959 3.422 ( -17.059 -10.597 -2.538) 20.242 3.560 ( 9.789 7.457 8.356) 14.874 4.799 ( 2.398 -7.190 9.134) 11.869 5.229 ( 0.033 17.156 6.221) 18.249 5.270 ( -0.349 -5.691 1.796) 5.978 5.613 ( 5.387 -0.946 2.855) 6.170 5.772 ( -4.972 -1.332 -0.605) 5.183 5.903 ( -1.215 6.721 -0.278) 6.835 6.095 ( -2.949 -2.213 -1.086) 3.844 6.431 ( 0.666 -10.750 -8.448) 13.689 6.511 ( 9.459 -5.925 -1.335) 11.241 6.958 ( 3.640 -5.826 5.507) 8.804 7.081 ( 1.532 -2.654 -4.093) 5.113 7.421 ( -3.345 5.925 0.876) 6.860 7.497 ( 1.260 -0.966 0.105) 1.591 7.966 ( 0.488 -2.728 6.698) 7.249 8.035 ( 7.064 2.639 -13.074) 15.093 8.450 ( 3.728 2.392 -4.333) 6.196 8.609 ( -0.507 3.681 -7.807) 8.646 8.785 ( -0.695 3.951 -8.479) 9.380 9.387 ( -5.550 5.825 5.254) 9.609 9.523 ( 2.801 8.418 2.675) 9.266 9.818 ( 7.323 -4.734 -14.712) 17.102 9.903 ( 3.007 -10.465 2.570) 11.188 10.170 ( -12.324 -0.206 2.692) 12.617 10.515 ( 4.204 0.204 -0.359) 4.224 10.760 ( -5.894 -2.786 3.692) 7.492 10.904 ( 3.191 -5.390 -4.859) 7.927 11.197 ( 0.953 0.653 7.115) 7.208 11.553 ( -3.449 2.123 -16.887) 17.366 11.814 ( 8.091 1.605 8.851) 12.099 12.173 ( -0.976 1.564 -5.770) 6.057 12.412 ( -0.538 2.723 6.467) 7.038 12.531 ( -2.412 -3.904 -9.922) 10.932 12.798 ( -3.944 -4.451 8.263) 10.181 13.153 ( 2.534 3.257 -13.279) 13.905 13.359 ( 1.879 -0.975 -12.322) 12.503 13.702 ( 3.061 1.898 1.700) 3.983 13.975 ( -7.563 -2.411 0.226) 7.941 14.344 ( -3.761 2.579 16.822) 17.429 14.705 ( -0.342 -10.941 5.392) 12.202 15.881 ( 0.603 1.336 3.556) 3.846 16.753 ( 1.820 -0.298 2.018) 2.734 16.895 ( 0.442 -2.943 7.019) 7.624 17.726 ( -3.035 3.319 -1.048) 4.618 19.638 ( -1.356 -0.473 3.679) 3.949 19.811 ( -1.905 -1.496 9.856) 10.150 20.663 ( -1.956 1.699 -3.514) 4.366 21.520 ( -15.761 5.412 -5.622) 17.587 22.236 ( 15.520 -3.745 1.730) 16.059 22.563 ( 3.253 -2.273 -2.551) 4.718 22.793 ( 3.523 0.389 3.629) 5.072 23.702 ( -1.301 8.044 -0.374) 8.157 24.201 ( -0.492 -0.227 1.425) 1.524 24.436 ( 4.025 -3.136 2.413) 5.644 24.590 ( 0.684 -3.842 1.246) 4.096 25.980 ( -2.552 1.594 -9.982) 10.426 ======================= Grid point 98 (47/186) ======================= q-point: (-0.12 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.310 ( 6.013 31.373 4.822) 32.306 2.446 ( 12.721 22.326 16.467) 30.520 3.154 ( -12.920 -10.646 7.787) 18.463 3.317 ( -16.932 -8.401 2.419) 19.056 3.655 ( 14.398 6.192 9.506) 18.331 4.850 ( -6.548 0.209 -5.041) 8.266 5.027 ( 1.341 12.834 20.205) 23.974 5.330 ( 6.167 1.752 -1.855) 6.674 5.705 ( 1.406 1.244 -2.450) 3.086 5.730 ( -3.835 1.029 -0.903) 4.072 5.809 ( -3.669 -2.693 0.839) 4.628 6.087 ( -0.402 -1.791 -1.213) 2.200 6.565 ( 2.366 -7.234 -7.014) 10.350 6.702 ( 9.299 -4.092 -0.196) 10.161 7.090 ( -0.435 -4.853 -7.705) 9.116 7.133 ( 0.078 -4.659 2.524) 5.299 7.299 ( -4.371 4.546 2.930) 6.954 7.564 ( 6.992 -3.845 -3.329) 8.646 7.879 ( -4.685 1.698 -8.710) 10.035 8.136 ( 0.682 -4.482 -1.542) 4.788 8.470 ( 3.921 2.401 -4.853) 6.685 8.582 ( 5.213 5.300 -0.749) 7.472 8.696 ( 2.933 0.206 -8.571) 9.061 9.244 ( -7.744 3.002 5.610) 10.023 9.495 ( 2.431 3.027 2.525) 4.631 9.866 ( 1.050 5.610 -4.988) 7.580 9.968 ( -1.432 -0.197 0.020) 1.445 10.157 ( -3.376 -12.940 -5.962) 14.642 10.608 ( 5.334 -0.954 3.852) 6.648 10.718 ( -4.834 -1.460 4.048) 6.472 11.001 ( 2.186 -3.525 -6.984) 8.123 11.235 ( 1.200 -1.130 0.787) 1.827 11.429 ( -2.215 0.992 -11.217) 11.476 11.953 ( 13.122 3.721 6.865) 15.269 12.127 ( 0.906 2.462 -1.354) 2.952 12.349 ( -4.822 1.798 5.788) 7.745 12.482 ( -2.906 1.417 -14.115) 14.480 12.843 ( -4.879 -5.723 13.367) 15.337 13.079 ( 1.049 6.380 -11.782) 13.439 13.328 ( 1.550 2.470 -16.568) 16.822 13.751 ( 3.117 0.333 4.337) 5.351 13.907 ( -7.095 -3.653 -4.976) 9.405 14.315 ( -3.032 1.026 19.642) 19.901 14.814 ( -8.540 -9.649 6.587) 14.471 15.896 ( 3.980 1.830 1.831) 4.747 16.760 ( 0.251 2.547 5.430) 6.003 16.949 ( -0.243 -1.761 3.606) 4.020 17.627 ( -2.639 4.038 -1.617) 5.088 19.642 ( -0.613 -0.506 4.277) 4.351 19.823 ( -3.557 -1.522 10.422) 11.116 20.637 ( 1.055 -0.041 -2.899) 3.085 21.267 ( -9.141 4.710 -2.316) 10.541 22.402 ( 2.514 -2.377 -3.063) 4.621 22.727 ( 10.019 -3.256 0.969) 10.580 22.881 ( 9.358 -5.574 3.005) 11.299 23.525 ( -6.475 9.615 -0.818) 11.621 24.196 ( -1.229 -0.384 0.008) 1.287 24.507 ( 0.159 -1.847 2.987) 3.515 24.670 ( 3.102 -2.564 0.320) 4.037 25.920 ( -1.607 -0.834 -8.807) 8.991 ======================= Grid point 103 (48/186) ======================= q-point: (-0.50 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.969 ( -6.022 -0.000 16.860) 17.903 3.129 ( -19.182 -0.000 -6.967) 20.408 3.384 ( -6.749 -0.000 8.369) 10.752 3.606 ( 13.276 0.000 9.904) 16.563 3.999 ( 3.394 0.000 13.489) 13.909 4.482 ( -7.727 -0.000 3.147) 8.343 5.199 ( 0.232 0.000 -7.609) 7.613 5.393 ( 1.722 0.000 -20.179) 20.252 5.528 ( 0.988 0.000 -4.928) 5.026 5.782 ( 3.861 0.000 -8.575) 9.404 5.951 ( -10.083 -0.000 1.016) 10.134 6.062 ( -5.276 -0.000 0.944) 5.360 6.173 ( -0.463 -0.000 0.738) 0.871 6.664 ( 10.330 0.000 12.949) 16.565 6.692 ( -8.202 -0.000 -6.121) 10.234 7.084 ( 5.554 0.000 24.296) 24.923 7.305 ( 13.796 0.000 8.633) 16.275 7.687 ( 10.152 0.000 -5.590) 11.589 7.771 ( -4.357 -0.000 -2.743) 5.148 8.279 ( 3.126 0.000 5.820) 6.606 8.463 ( -2.828 -0.000 -12.510) 12.825 8.625 ( -3.792 -0.000 1.666) 4.142 8.725 ( -3.574 -0.000 -2.128) 4.160 9.461 ( 10.616 0.000 -11.456) 15.619 9.487 ( -0.541 -0.000 -26.455) 26.460 9.721 ( 4.562 0.000 9.673) 10.694 10.112 ( -3.680 -0.000 -2.300) 4.340 10.133 ( -0.538 -0.000 -3.246) 3.290 10.541 ( -0.541 -0.000 0.774) 0.945 10.694 ( 1.132 0.000 1.701) 2.044 10.910 ( -13.038 -0.000 0.703) 13.057 11.193 ( -1.482 -0.000 0.601) 1.599 11.677 ( 2.738 0.000 -4.899) 5.612 11.690 ( 0.500 0.000 13.947) 13.956 12.204 ( 4.618 0.000 -14.868) 15.569 12.316 ( -3.074 -0.000 5.966) 6.711 12.397 ( 3.165 0.000 -0.900) 3.291 12.880 ( -6.952 -0.000 12.305) 14.133 13.097 ( 7.843 0.000 -15.504) 17.375 13.314 ( -2.149 -0.000 -12.984) 13.161 13.831 ( 1.338 0.000 3.515) 3.761 13.944 ( -4.105 -0.000 0.577) 4.146 14.381 ( 7.800 0.000 0.669) 7.828 14.449 ( -5.933 -0.000 16.756) 17.775 15.929 ( 0.652 0.000 0.143) 0.668 16.648 ( 0.230 0.000 0.954) 0.981 16.814 ( 1.459 0.000 8.577) 8.700 17.816 ( -0.222 -0.000 0.767) 0.799 19.636 ( -1.563 -0.000 3.428) 3.768 19.776 ( -0.480 -0.000 7.147) 7.164 20.789 ( -5.361 -0.000 -2.661) 5.985 21.780 ( -1.925 -0.000 -2.520) 3.171 22.128 ( -1.851 -0.000 -1.006) 2.107 22.459 ( -0.027 -0.000 -2.813) 2.813 22.754 ( 4.640 0.000 1.462) 4.865 23.854 ( 3.420 0.000 -0.713) 3.494 24.196 ( 2.415 0.000 4.057) 4.721 24.309 ( 1.499 0.000 1.757) 2.310 24.483 ( -1.353 -0.000 -1.410) 1.954 26.097 ( -3.056 -0.000 -8.307) 8.851 ======================= Grid point 104 (49/186) ======================= q-point: (-0.38 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.828 ( -17.890 -0.577 5.971) 18.869 2.953 ( -16.013 -8.342 2.558) 18.236 3.282 ( -7.077 4.923 7.970) 11.741 3.750 ( 14.012 8.902 8.855) 18.815 3.823 ( -7.130 22.486 2.617) 23.734 4.580 ( -1.046 -17.493 4.665) 18.134 5.034 ( 1.311 7.242 -5.374) 9.113 5.428 ( -5.733 0.162 -7.163) 9.177 5.698 ( -13.398 2.813 3.215) 14.063 5.724 ( 2.814 -19.729 -12.832) 23.702 5.823 ( 7.344 -1.454 -9.882) 12.398 6.020 ( -8.559 -1.167 -0.080) 8.638 6.145 ( -4.241 -1.347 3.471) 5.643 6.556 ( 2.839 5.308 -3.123) 6.782 6.958 ( 16.256 -5.630 10.474) 20.141 7.146 ( 8.683 12.686 23.686) 28.237 7.496 ( 11.137 2.686 4.704) 12.385 7.649 ( -6.055 7.853 1.410) 10.016 7.842 ( 10.793 -6.654 -1.535) 12.772 8.208 ( -2.434 8.417 -4.720) 9.952 8.461 ( -4.682 -5.905 -2.542) 7.953 8.677 ( 8.721 1.630 -4.025) 9.742 8.715 ( -1.137 -5.346 -4.764) 7.250 9.441 ( 0.658 -2.348 -16.421) 16.601 9.589 ( 4.905 -4.462 -8.608) 10.866 9.774 ( 1.474 0.828 -0.657) 1.813 9.881 ( 1.114 13.489 1.143) 13.583 10.216 ( -6.779 -4.420 -2.670) 8.522 10.572 ( 0.093 -4.575 4.167) 6.189 10.617 ( -1.721 7.632 -2.991) 8.376 10.776 ( -8.097 -1.985 -2.846) 8.810 11.211 ( -0.374 -3.959 4.628) 6.102 11.656 ( 2.709 4.144 -5.712) 7.559 11.750 ( -1.273 -3.755 6.528) 7.637 12.192 ( -1.081 0.237 -7.880) 7.958 12.364 ( 2.145 -4.560 -0.815) 5.105 12.449 ( 3.093 -1.288 2.449) 4.150 12.802 ( -4.626 3.931 10.163) 11.839 13.173 ( 5.757 -1.783 -16.691) 17.746 13.277 ( -0.321 -2.736 -8.664) 9.091 13.803 ( -0.956 4.172 1.202) 4.446 13.907 ( -5.666 -2.580 -0.057) 6.226 14.401 ( -4.523 1.447 14.320) 15.087 14.478 ( -0.514 -4.739 7.237) 8.665 15.957 ( 6.087 2.726 -0.139) 6.671 16.685 ( 1.944 -2.844 0.668) 3.509 16.857 ( 0.975 -0.270 11.337) 11.382 17.792 ( -2.448 1.244 0.495) 2.790 19.629 ( -1.009 -0.190 3.642) 3.784 19.787 ( -1.079 -0.371 7.765) 7.849 20.706 ( -4.365 0.983 -5.146) 6.819 21.624 ( -15.428 1.908 -5.247) 16.407 22.191 ( 10.241 -0.088 0.191) 10.244 22.502 ( 4.864 -1.660 -3.032) 5.967 22.808 ( 2.988 0.396 3.444) 4.577 23.872 ( 2.311 3.497 0.268) 4.200 24.225 ( 1.451 1.277 4.662) 5.046 24.368 ( 4.771 -1.330 2.529) 5.561 24.482 ( -0.857 -3.080 -1.271) 3.441 26.012 ( -5.435 0.600 -11.154) 12.422 ======================= Grid point 105 (50/186) ======================= q-point: (-0.25 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.664 ( -20.065 -9.469 9.165) 24.005 2.892 ( -16.642 -13.079 -1.369) 21.210 3.104 ( -3.347 14.751 10.739) 18.551 3.310 ( -8.165 27.644 -1.966) 28.891 3.842 ( 13.835 8.046 7.563) 17.702 4.773 ( -0.671 -2.601 1.421) 3.039 5.072 ( -6.247 -19.261 -3.975) 20.635 5.244 ( -14.326 -0.654 6.166) 15.611 5.602 ( -0.905 0.289 -1.242) 1.563 5.795 ( 4.520 4.963 -4.923) 8.324 5.878 ( -7.717 1.734 -2.231) 8.218 6.129 ( -2.735 -1.476 1.853) 3.618 6.171 ( 10.780 -20.971 -11.141) 26.079 6.602 ( 8.512 -0.931 -3.048) 9.089 7.099 ( 7.162 14.360 18.021) 24.130 7.226 ( 13.636 3.783 10.275) 17.488 7.452 ( -4.584 7.793 3.202) 9.592 7.548 ( 5.410 1.704 -1.161) 5.790 7.995 ( -4.691 5.866 1.573) 7.674 8.128 ( 10.414 -1.525 -8.613) 13.600 8.459 ( -1.119 -3.022 -2.707) 4.209 8.702 ( 4.198 1.898 -9.077) 10.180 8.765 ( 1.568 1.623 -4.802) 5.306 9.384 ( -5.842 4.895 -4.166) 8.686 9.638 ( -2.380 6.481 -3.290) 7.648 9.729 ( 3.372 -12.094 -6.559) 14.166 9.924 ( 8.345 0.736 -4.567) 9.542 10.066 ( -10.832 5.621 6.648) 13.896 10.537 ( -2.063 -3.086 -7.513) 8.380 10.622 ( -1.125 -1.169 4.414) 4.702 10.795 ( -0.067 -9.486 -3.920) 10.264 11.285 ( 4.020 0.063 8.616) 9.508 11.562 ( -0.641 7.600 -15.423) 17.205 11.866 ( 3.198 -9.581 7.379) 12.509 12.152 ( -1.348 0.630 -5.301) 5.506 12.407 ( -2.799 -1.109 -2.572) 3.960 12.520 ( 5.040 0.680 2.617) 5.719 12.729 ( -3.894 1.192 11.333) 12.042 13.167 ( 1.597 0.760 -20.272) 20.349 13.350 ( 3.309 -2.651 -3.007) 5.198 13.749 ( -0.134 0.624 -1.168) 1.331 13.842 ( -8.226 -1.187 -0.064) 8.311 14.357 ( -4.391 1.602 14.898) 15.614 14.549 ( -4.941 -7.764 8.614) 12.606 15.997 ( 8.260 5.096 0.097) 9.706 16.762 ( 2.533 -2.634 0.598) 3.703 16.905 ( 0.867 -0.627 13.265) 13.308 17.721 ( -4.081 2.528 -0.146) 4.803 19.633 ( -0.313 -0.180 4.635) 4.649 19.795 ( -1.901 -0.582 8.181) 8.419 20.640 ( -1.790 0.204 -5.384) 5.678 21.372 ( -14.463 2.721 -5.353) 15.660 22.337 ( 7.688 -1.897 -0.583) 7.940 22.623 ( 11.230 -2.721 -2.083) 11.741 22.839 ( 1.295 0.153 4.114) 4.315 23.793 ( -2.065 8.735 -0.476) 8.988 24.224 ( 0.846 2.192 2.993) 3.805 24.443 ( 1.298 -2.255 2.129) 3.362 24.565 ( 4.752 -4.761 1.148) 6.824 25.899 ( -6.453 -0.639 -12.962) 14.494 ======================= Grid point 106 (51/186) ======================= q-point: (-0.12 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.617 ( -17.052 -14.246 12.685) 25.586 2.791 ( -0.308 22.028 7.932) 23.415 2.853 ( -16.519 -11.572 -6.028) 21.051 3.052 ( 4.611 9.395 13.150) 16.807 3.940 ( 14.270 6.731 7.734) 17.571 4.631 ( -20.830 -5.644 -8.843) 23.322 5.170 ( -5.002 0.515 14.770) 15.603 5.317 ( 2.154 -15.577 -2.005) 15.852 5.604 ( -3.662 -4.332 -0.772) 5.725 5.758 ( -1.524 2.380 -0.592) 2.888 5.778 ( 3.465 5.888 -3.222) 7.553 6.114 ( 1.457 2.131 -2.129) 3.346 6.495 ( 8.429 -5.944 -8.163) 13.154 6.735 ( 5.582 -5.271 -4.415) 8.856 7.059 ( 1.949 2.680 9.395) 9.962 7.250 ( 3.878 6.241 3.099) 7.975 7.326 ( 0.877 8.743 -1.329) 8.887 7.667 ( 9.852 0.624 5.755) 11.427 7.818 ( -6.920 3.395 -4.102) 8.731 8.147 ( 1.060 4.596 -5.882) 7.539 8.511 ( 2.364 0.481 -8.310) 8.653 8.703 ( 0.014 6.573 -0.840) 6.626 8.742 ( 6.701 -2.106 -4.484) 8.333 9.186 ( -8.107 4.433 -0.637) 9.262 9.551 ( -2.683 2.891 -1.245) 4.136 9.880 ( -6.044 1.856 3.568) 7.260 9.934 ( 0.987 -11.699 -3.128) 12.150 10.005 ( 5.617 0.839 -4.230) 7.081 10.529 ( -6.818 -6.911 -11.431) 14.997 10.695 ( 5.406 -0.419 10.633) 11.936 10.936 ( 2.018 -8.913 -5.782) 10.814 11.311 ( 0.583 9.497 -7.778) 12.290 11.436 ( 4.611 -0.764 -1.543) 4.922 12.075 ( 2.310 -3.022 1.294) 4.018 12.130 ( 1.078 -5.681 -1.927) 6.095 12.324 ( -5.378 2.923 2.541) 6.627 12.546 ( 8.685 7.950 -4.554) 12.624 12.731 ( -5.759 -4.856 18.315) 19.803 13.120 ( 0.457 2.040 -14.701) 14.849 13.357 ( 2.099 3.343 -9.862) 10.623 13.745 ( -7.716 -3.354 -6.992) 10.939 13.802 ( 3.611 -1.518 3.807) 5.462 14.323 ( -4.213 0.444 17.695) 18.195 14.602 ( -7.269 -7.966 6.646) 12.667 16.029 ( 7.659 5.253 0.476) 9.299 16.801 ( 0.267 0.965 5.168) 5.264 16.952 ( 0.651 0.062 8.461) 8.486 17.635 ( -2.674 2.255 -0.195) 3.503 19.649 ( 0.401 -0.074 6.142) 6.155 19.792 ( -2.657 -0.465 8.024) 8.465 20.637 ( 1.752 -1.457 -3.302) 4.012 21.180 ( -8.902 0.450 -3.393) 9.537 22.416 ( 3.614 -0.132 -2.061) 4.162 22.804 ( 4.395 -0.320 1.795) 4.758 22.921 ( 10.231 -7.001 0.502) 12.407 23.566 ( -9.388 12.086 -2.532) 15.512 24.204 ( 0.270 2.207 1.132) 2.495 24.483 ( -0.623 -2.027 2.801) 3.513 24.690 ( 4.692 -2.108 0.531) 5.171 25.825 ( -4.032 -3.892 -11.847) 13.106 ======================= Grid point 112 (52/186) ======================= q-point: (-0.38 -0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.490 ( -26.467 -0.000 -7.406) 27.484 2.635 ( -25.365 -0.000 12.814) 28.418 3.337 ( 1.435 0.000 13.267) 13.345 3.860 ( -4.159 -0.000 4.945) 6.461 4.166 ( 1.804 0.000 5.298) 5.597 4.291 ( 4.552 0.000 -0.874) 4.635 4.947 ( -29.068 -0.000 -11.913) 31.415 5.452 ( -0.229 -0.000 8.303) 8.306 5.478 ( 9.593 0.000 -15.284) 18.045 5.614 ( -0.984 -0.000 -1.515) 1.807 5.920 ( -9.182 -0.000 0.889) 9.225 5.948 ( 14.002 0.000 -11.692) 18.242 6.022 ( -10.011 -0.000 1.283) 10.093 6.631 ( 7.744 0.000 -5.737) 9.637 7.223 ( 20.055 0.000 20.232) 28.487 7.446 ( 11.486 0.000 20.493) 23.492 7.601 ( -10.475 -0.000 4.517) 11.408 7.779 ( 14.707 0.000 13.226) 19.779 7.885 ( 11.723 0.000 -9.297) 14.962 8.201 ( -14.467 -0.000 -6.049) 15.681 8.302 ( -0.791 -0.000 1.489) 1.686 8.634 ( 0.694 0.000 -5.166) 5.212 8.862 ( 12.274 0.000 -8.396) 14.871 9.396 ( 3.273 0.000 -21.583) 21.830 9.571 ( -2.219 -0.000 -1.628) 2.752 9.763 ( -3.301 -0.000 -13.492) 13.890 10.011 ( -0.989 -0.000 8.513) 8.570 10.075 ( -1.144 -0.000 -5.783) 5.895 10.568 ( -9.584 -0.000 3.791) 10.306 10.568 ( 4.294 0.000 -3.182) 5.345 10.812 ( 5.735 0.000 -0.357) 5.746 11.102 ( -6.050 -0.000 5.390) 8.102 11.686 ( -3.354 -0.000 5.594) 6.522 11.714 ( 1.645 0.000 -11.498) 11.615 12.165 ( -0.777 -0.000 -6.239) 6.287 12.359 ( 1.526 0.000 -1.209) 1.947 12.488 ( 3.033 0.000 6.043) 6.762 12.842 ( 0.031 0.000 14.485) 14.485 13.170 ( 2.483 0.000 -24.608) 24.733 13.244 ( 2.484 0.000 0.887) 2.637 13.775 ( -8.355 -0.000 -4.559) 9.518 13.829 ( -3.053 -0.000 2.012) 3.656 14.391 ( -3.921 -0.000 12.720) 13.311 14.426 ( -4.785 -0.000 10.115) 11.190 16.097 ( 11.062 0.000 -1.530) 11.167 16.697 ( 3.028 0.000 1.359) 3.319 16.901 ( 0.965 0.000 15.485) 15.515 17.758 ( -4.360 -0.000 0.576) 4.398 19.630 ( -0.123 -0.000 4.753) 4.754 19.787 ( -1.449 -0.000 7.512) 7.651 20.644 ( -3.373 -0.000 -6.772) 7.566 21.412 ( -16.372 -0.000 -6.312) 17.547 22.310 ( 8.747 0.000 0.077) 8.747 22.586 ( 9.944 0.000 -2.926) 10.366 22.844 ( 0.698 0.000 4.196) 4.254 23.939 ( 2.766 0.000 0.994) 2.939 24.272 ( 1.729 0.000 6.216) 6.452 24.430 ( -1.598 -0.000 -2.947) 3.352 24.445 ( 6.770 0.000 3.114) 7.451 25.889 ( -8.759 -0.000 -14.960) 17.336 ======================= Grid point 113 (53/186) ======================= q-point: (-0.25 -0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.188 ( -28.574 -10.526 -0.152) 30.452 2.387 ( -28.245 -11.722 8.145) 31.647 3.333 ( 0.782 9.558 14.211) 17.144 3.554 ( -9.809 20.887 -0.067) 23.076 4.088 ( -3.433 0.113 2.741) 4.395 4.500 ( -25.050 -3.955 -6.099) 26.084 4.687 ( 7.124 -18.798 1.935) 20.195 5.299 ( 5.322 13.925 3.423) 15.295 5.605 ( -0.261 1.504 -1.541) 2.169 5.766 ( -6.726 -0.736 -1.213) 6.874 5.822 ( 0.639 -10.888 -4.829) 11.928 6.007 ( -1.195 -15.804 -1.729) 15.943 6.122 ( 17.679 0.604 -12.349) 21.573 6.738 ( 11.326 2.503 -1.630) 11.713 7.330 ( -11.737 4.697 9.445) 15.781 7.519 ( 12.175 13.646 17.515) 25.322 7.625 ( 14.071 -0.303 16.201) 21.460 7.742 ( 7.768 17.043 -1.448) 18.786 7.926 ( -15.206 3.317 -6.465) 16.853 8.199 ( 10.603 -8.705 -0.302) 13.722 8.360 ( 0.888 -6.206 -4.726) 7.852 8.678 ( 3.110 -2.323 -1.466) 4.150 8.903 ( 5.485 6.521 -12.710) 15.302 9.356 ( -3.071 3.455 -14.438) 15.160 9.570 ( -3.540 -7.748 -8.882) 12.307 9.633 ( -4.609 1.489 -6.968) 8.487 10.025 ( 3.748 2.382 -4.543) 6.353 10.062 ( -1.895 2.069 5.399) 6.085 10.435 ( -7.860 2.991 4.333) 9.460 10.681 ( 6.541 -5.737 -3.859) 9.518 10.740 ( 3.581 8.276 3.758) 9.769 11.261 ( 3.161 -14.558 5.652) 15.934 11.630 ( -0.757 7.246 -16.265) 17.822 11.722 ( -1.504 -9.329 1.980) 9.655 12.134 ( -1.247 0.355 -7.333) 7.447 12.361 ( -2.654 -0.336 1.068) 2.881 12.566 ( 2.931 -2.589 9.620) 10.384 12.843 ( 3.953 8.262 15.086) 17.649 13.119 ( -0.640 -0.627 -23.668) 23.685 13.358 ( 5.654 -4.608 5.445) 9.102 13.658 ( -7.801 -2.007 -7.447) 10.970 13.772 ( -4.607 0.521 0.847) 4.713 14.353 ( -4.600 1.340 12.111) 13.025 14.418 ( -5.453 -4.255 9.766) 11.967 16.201 ( 10.549 5.219 -1.423) 11.855 16.766 ( 3.686 -2.244 1.047) 4.440 16.961 ( 1.891 0.348 20.156) 20.247 17.684 ( -5.561 1.009 0.305) 5.660 19.649 ( 0.810 0.044 7.061) 7.108 19.786 ( -1.690 -0.066 7.422) 7.612 20.601 ( -1.020 -0.893 -6.201) 6.347 21.191 ( -13.988 0.250 -6.514) 15.433 22.414 ( 6.624 -0.042 0.076) 6.625 22.740 ( 12.512 -2.189 -2.524) 12.951 22.850 ( -1.182 -0.167 4.104) 4.274 23.900 ( -0.782 9.365 -0.770) 9.430 24.288 ( 1.587 2.921 4.321) 5.452 24.417 ( -0.522 -1.914 -0.474) 2.040 24.584 ( 7.031 -4.656 2.447) 8.781 25.730 ( -10.588 -2.301 -18.239) 21.214 ======================= Grid point 114 (54/186) ======================= q-point: (-0.12 -0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.071 ( -25.405 -22.289 9.907) 35.219 2.273 ( -26.631 -19.807 5.935) 33.715 3.096 ( -5.566 12.401 3.593) 14.059 3.338 ( 4.323 12.218 11.126) 17.081 3.895 ( -34.960 -11.826 -0.215) 36.907 4.414 ( 12.138 4.964 3.301) 13.523 5.078 ( 7.690 -20.075 -0.974) 21.520 5.197 ( 0.227 7.947 5.562) 9.702 5.540 ( -4.460 2.026 -2.097) 5.329 5.711 ( -2.878 -1.486 -3.027) 4.434 5.864 ( -2.621 -3.877 0.823) 4.752 6.204 ( 10.720 3.116 -7.928) 13.693 6.424 ( 10.035 -17.319 -8.485) 21.740 6.798 ( 7.189 5.409 -2.456) 9.325 7.168 ( -5.308 2.470 7.186) 9.269 7.389 ( -4.689 15.336 10.713) 19.287 7.558 ( 3.591 15.999 -4.351) 16.965 7.725 ( -2.851 2.699 -6.140) 7.288 7.883 ( 12.011 0.053 13.666) 18.194 8.237 ( 1.650 6.663 -4.804) 8.379 8.505 ( 4.640 -3.802 -9.861) 11.543 8.726 ( -1.108 -1.347 -1.236) 2.138 8.814 ( -0.009 6.751 -4.882) 8.332 9.162 ( -5.744 7.187 -11.752) 14.925 9.496 ( -5.125 0.426 -5.492) 7.524 9.737 ( 1.385 -12.655 -0.222) 12.733 9.971 ( 1.473 5.964 7.938) 10.037 10.054 ( 1.567 0.468 -4.623) 4.904 10.354 ( -4.834 -2.992 -5.185) 7.695 10.755 ( -0.465 -4.547 10.204) 11.181 10.868 ( 10.163 -3.046 -5.279) 11.850 11.411 ( -4.061 11.700 -21.074) 24.444 11.493 ( 9.621 -6.104 6.357) 13.048 11.914 ( -1.314 -15.144 -1.893) 15.318 12.085 ( -2.443 -0.411 -7.168) 7.584 12.310 ( -3.332 1.742 4.343) 5.745 12.658 ( -1.871 -3.161 17.783) 18.159 12.825 ( 10.544 9.770 4.259) 14.992 13.071 ( -1.729 -1.898 -14.775) 14.996 13.432 ( 3.230 3.849 -1.041) 5.131 13.591 ( -5.487 -2.391 -10.371) 11.975 13.803 ( 3.687 -7.063 4.067) 8.946 14.306 ( -5.578 0.132 14.994) 15.998 14.437 ( -5.580 -5.705 5.912) 9.931 16.226 ( 7.884 7.539 0.127) 10.909 16.827 ( 1.484 0.037 4.323) 4.571 17.016 ( 1.405 3.064 16.713) 17.049 17.615 ( -2.965 -0.194 1.058) 3.155 19.682 ( 1.339 0.429 9.796) 9.896 19.781 ( -1.560 0.338 7.475) 7.643 20.627 ( 2.558 -2.935 -2.817) 4.805 21.039 ( -8.196 -2.714 -5.356) 10.160 22.478 ( 4.715 1.204 -0.108) 4.868 22.824 ( -2.204 0.218 3.344) 4.011 22.971 ( 12.056 -6.087 -2.533) 13.741 23.622 ( -11.692 17.411 -5.625) 21.714 24.263 ( 1.279 3.844 1.714) 4.399 24.452 ( -0.147 -2.370 2.235) 3.261 24.728 ( 4.896 -2.067 1.463) 5.512 25.639 ( -6.188 -8.608 -17.701) 20.633 ======================= Grid point 121 (55/186) ======================= q-point: (-0.25 -0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.703 ( -31.295 -0.000 -3.146) 31.452 1.927 ( -32.594 -0.000 16.678) 36.613 3.356 ( -32.385 -0.000 4.338) 32.675 3.572 ( -20.784 -0.000 2.967) 20.995 3.609 ( -10.108 -0.000 5.248) 11.389 4.543 ( 5.561 0.000 5.972) 8.161 4.696 ( 20.839 0.000 -0.658) 20.849 5.614 ( -7.084 -0.000 -4.228) 8.250 5.629 ( 1.111 0.000 -1.874) 2.179 5.644 ( 3.709 0.000 5.877) 6.949 5.712 ( 8.602 0.000 -11.688) 14.512 5.801 ( -3.679 -0.000 3.435) 5.033 6.355 ( 19.314 0.000 -13.545) 23.590 6.925 ( 13.299 0.000 1.180) 13.351 7.167 ( -18.662 -0.000 7.201) 20.003 7.649 ( -23.822 -0.000 0.384) 23.825 7.808 ( 10.455 0.000 3.846) 11.140 7.816 ( 10.902 0.000 10.055) 14.831 8.077 ( 4.180 0.000 5.539) 6.939 8.188 ( 10.651 0.000 -2.281) 10.892 8.362 ( 8.315 0.000 -2.936) 8.819 8.690 ( -1.009 -0.000 -1.894) 2.146 8.977 ( 2.943 0.000 -14.876) 15.164 9.332 ( 0.712 0.000 -28.122) 28.131 9.420 ( -4.419 -0.000 -1.213) 4.582 9.560 ( -3.261 -0.000 -6.126) 6.940 10.064 ( 2.077 0.000 -6.005) 6.354 10.065 ( -0.598 -0.000 -2.193) 2.273 10.416 ( -5.147 -0.000 17.117) 17.875 10.710 ( 1.492 0.000 4.764) 4.993 11.036 ( 3.204 0.000 3.669) 4.871 11.037 ( 10.849 0.000 -0.778) 10.877 11.628 ( -2.270 -0.000 -18.018) 18.161 11.652 ( 0.737 0.000 -0.160) 0.755 12.070 ( -4.721 -0.000 -16.221) 16.894 12.327 ( -4.099 -0.000 9.707) 10.537 12.613 ( 3.080 0.000 11.233) 11.648 13.026 ( -2.884 -0.000 -24.968) 25.134 13.054 ( 8.985 0.000 24.298) 25.906 13.418 ( 7.169 0.000 10.178) 12.449 13.521 ( -6.583 -0.000 -9.764) 11.776 13.699 ( -6.025 -0.000 -2.946) 6.707 14.307 ( -8.167 -0.000 11.611) 14.196 14.360 ( -2.754 -0.000 8.180) 8.632 16.364 ( 8.554 0.000 -3.323) 9.177 16.811 ( 5.073 0.000 1.307) 5.239 17.073 ( 5.534 0.000 29.446) 29.961 17.607 ( -7.011 -0.000 0.144) 7.012 19.690 ( 1.639 0.000 10.938) 11.060 19.790 ( -0.212 -0.000 8.815) 8.817 20.571 ( 0.341 0.000 -5.477) 5.487 21.001 ( -11.970 -0.000 -7.235) 13.986 22.499 ( 5.691 0.000 1.014) 5.780 22.827 ( -3.337 -0.000 3.673) 4.962 22.878 ( 12.133 0.000 -2.843) 12.461 23.989 ( 0.760 0.000 -3.026) 3.119 24.347 ( 1.449 0.000 5.915) 6.090 24.392 ( 0.417 0.000 -3.713) 3.737 24.633 ( 5.913 0.000 2.503) 6.421 25.481 ( -15.598 -0.000 -24.272) 28.852 ======================= Grid point 122 (56/186) ======================= q-point: (-0.12 -0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.441 ( -27.761 -19.797 6.845) 34.777 1.671 ( -29.837 -16.440 17.984) 38.522 2.722 ( -53.678 -9.427 1.895) 54.532 3.501 ( -7.989 1.465 8.941) 12.079 3.516 ( 0.032 4.146 9.579) 10.437 4.654 ( 11.486 1.054 6.022) 13.012 5.043 ( 19.477 -8.860 -1.717) 21.466 5.394 ( -2.793 13.125 0.033) 13.419 5.557 ( -0.018 9.429 -4.183) 10.315 5.633 ( -3.918 -1.988 -1.470) 4.633 5.734 ( -0.462 -5.829 0.299) 5.855 6.157 ( 8.753 -21.362 -4.210) 23.467 6.475 ( 7.000 6.613 -8.932) 13.134 6.964 ( -1.958 -0.068 -0.765) 2.103 7.084 ( -1.056 0.062 3.532) 3.687 7.332 ( -15.638 4.339 3.039) 16.511 7.815 ( 4.351 10.328 -12.902) 17.090 7.904 ( 9.371 9.105 8.126) 15.386 8.041 ( 4.250 5.217 3.214) 7.457 8.297 ( -0.459 0.674 -7.036) 7.083 8.537 ( 9.674 -2.749 2.977) 10.488 8.608 ( -11.043 -2.280 -5.255) 12.440 8.877 ( -4.359 8.051 -11.806) 14.940 9.211 ( 2.781 9.281 -21.936) 23.980 9.454 ( 2.211 -2.847 -1.811) 4.034 9.592 ( 1.380 -9.245 -3.297) 9.912 10.028 ( -3.200 -0.593 -5.743) 6.601 10.070 ( 1.825 1.722 1.267) 2.811 10.343 ( -1.976 6.874 14.499) 16.167 10.698 ( -2.692 -1.680 12.065) 12.475 11.021 ( 10.212 3.965 -1.853) 11.111 11.405 ( 3.407 -6.560 -17.440) 18.942 11.509 ( 1.917 -3.348 -3.326) 5.093 11.727 ( 1.280 -7.739 -2.105) 8.121 11.967 ( -6.521 -4.770 -15.316) 17.317 12.304 ( -2.669 0.609 8.888) 9.300 12.674 ( 0.291 0.701 17.008) 17.025 12.927 ( -3.519 -0.796 -23.418) 23.694 13.139 ( 7.133 9.557 13.254) 17.829 13.448 ( -1.644 -0.790 -10.631) 10.786 13.595 ( 7.057 2.125 7.941) 10.834 13.705 ( 3.747 -15.280 4.135) 16.268 14.236 ( -8.650 -1.600 14.488) 16.950 14.347 ( -3.338 -1.121 5.893) 6.865 16.410 ( 5.859 4.923 -2.424) 8.027 16.879 ( 4.298 0.875 2.848) 5.230 17.182 ( 4.028 9.187 27.400) 29.178 17.556 ( -2.047 -4.296 3.385) 5.840 19.723 ( -0.760 0.208 8.947) 8.982 19.843 ( 5.809 2.923 19.540) 20.593 20.610 ( 3.157 -3.871 -1.496) 5.214 20.879 ( -6.043 -4.530 -6.480) 9.951 22.559 ( 4.479 1.233 1.509) 4.885 22.784 ( -4.546 -0.208 2.715) 5.300 23.043 ( 10.156 -3.368 -3.251) 11.183 23.732 ( -13.832 25.235 -13.804) 31.917 24.342 ( 1.663 3.699 1.547) 4.341 24.429 ( 1.191 -2.578 1.796) 3.360 24.757 ( 4.388 -3.427 2.193) 5.984 25.312 ( -11.097 -15.637 -25.127) 31.608 ======================= Grid point 130 (57/186) ======================= q-point: (-0.12 -0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.920 ( -27.340 -0.000 14.243) 30.827 1.192 ( -31.380 -0.000 25.449) 40.402 1.895 ( -57.517 -0.000 22.071) 61.606 3.452 ( -5.034 -0.000 7.343) 8.903 3.566 ( -1.235 -0.000 10.360) 10.434 4.802 ( 9.338 0.000 4.801) 10.500 5.247 ( 16.432 0.000 -8.372) 18.442 5.417 ( 1.060 0.000 3.543) 3.698 5.527 ( -6.445 -0.000 -1.931) 6.728 5.600 ( -2.360 -0.000 -2.731) 3.609 5.956 ( 5.151 0.000 7.753) 9.308 5.970 ( 12.908 0.000 -12.218) 17.773 6.539 ( -9.445 -0.000 -7.224) 11.891 6.752 ( -12.994 -0.000 5.404) 14.073 7.097 ( -3.223 -0.000 -6.773) 7.501 7.375 ( 13.355 0.000 6.154) 14.705 7.918 ( -1.463 -0.000 -10.179) 10.284 7.970 ( 3.804 0.000 -11.019) 11.657 8.208 ( -9.270 -0.000 -22.357) 24.203 8.213 ( 3.483 0.000 11.192) 11.721 8.397 ( -14.465 -0.000 -10.025) 17.599 8.603 ( 0.074 0.000 1.125) 1.128 8.880 ( 1.197 0.000 -7.081) 7.181 9.361 ( 11.839 0.000 -26.720) 29.225 9.394 ( -1.346 -0.000 -5.073) 5.249 9.556 ( 2.032 0.000 3.184) 3.777 9.952 ( -4.799 -0.000 -4.400) 6.510 10.095 ( 1.773 0.000 -3.065) 3.541 10.463 ( -0.582 -0.000 26.332) 26.338 10.691 ( -2.940 -0.000 15.754) 16.026 11.186 ( 2.630 0.000 -4.178) 4.937 11.329 ( 11.943 0.000 -10.088) 15.634 11.455 ( -3.334 -0.000 -11.732) 12.197 11.634 ( -9.533 -0.000 -10.626) 14.275 11.818 ( 1.545 0.000 -7.263) 7.425 12.296 ( -2.899 -0.000 7.407) 7.954 12.731 ( -1.004 -0.000 8.829) 8.886 12.824 ( -0.767 -0.000 -17.165) 17.182 13.268 ( -3.316 -0.000 -13.595) 13.994 13.422 ( -8.555 -0.000 -7.592) 11.438 13.643 ( 17.720 0.000 21.185) 27.618 13.764 ( 9.614 0.000 14.357) 17.279 14.172 ( -2.885 -0.000 25.962) 26.122 14.313 ( -3.328 -0.000 3.822) 5.068 16.492 ( 3.434 0.000 -2.665) 4.347 16.959 ( 5.391 0.000 1.001) 5.483 17.418 ( -6.866 -0.000 -0.451) 6.880 17.544 ( 16.876 0.000 29.003) 33.556 19.721 ( -1.999 -0.000 5.926) 6.254 20.199 ( 33.336 0.000 55.629) 64.852 20.605 ( 2.335 0.000 -0.500) 2.388 20.740 ( -4.249 -0.000 -7.287) 8.435 22.628 ( 3.719 0.000 2.590) 4.532 22.722 ( -5.301 -0.000 1.355) 5.472 23.124 ( 6.719 0.000 -4.380) 8.020 23.724 ( -27.688 -0.000 -47.603) 55.070 24.389 ( -0.308 -0.000 3.732) 3.745 24.443 ( 5.555 0.000 1.325) 5.711 24.756 ( 2.640 0.000 0.764) 2.748 24.872 ( -17.069 -0.000 -13.388) 21.693 ======================= Grid point 131 (58/186) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.564 ( 12.806 0.000 38.574) 40.644 1.607 ( 10.499 0.000 39.792) 41.154 2.823 ( 5.910 0.000 67.406) 67.664 3.548 ( -4.212 -0.000 9.223) 10.139 3.709 ( -6.465 -0.000 10.094) 11.986 4.847 ( -8.076 -0.000 -2.500) 8.454 4.966 ( -1.740 -0.000 -14.163) 14.269 5.311 ( -4.955 -0.000 -8.903) 10.189 5.572 ( 5.053 0.000 3.424) 6.104 5.824 ( -14.274 -0.000 -8.596) 16.663 5.984 ( 5.405 0.000 -6.241) 8.256 6.004 ( -9.935 -0.000 6.723) 11.996 6.065 ( 18.745 0.000 -3.567) 19.082 6.378 ( -11.426 -0.000 2.663) 11.733 7.040 ( 1.672 0.000 -0.859) 1.879 7.379 ( -5.964 -0.000 -19.271) 20.173 7.572 ( 5.882 0.000 -11.325) 12.761 7.802 ( 21.061 0.000 -2.535) 21.213 7.823 ( 0.141 0.000 -12.448) 12.449 8.063 ( 5.754 0.000 -0.747) 5.802 8.432 ( 1.353 0.000 7.256) 7.381 8.524 ( 7.906 0.000 -11.316) 13.804 8.973 ( -10.227 -0.000 -10.836) 14.900 9.020 ( 6.529 0.000 -2.133) 6.869 9.338 ( -3.579 -0.000 4.018) 5.381 9.576 ( -1.521 -0.000 -0.013) 1.521 9.876 ( -8.355 -0.000 3.985) 9.256 10.355 ( 8.079 0.000 10.079) 12.917 10.680 ( -13.847 -0.000 -4.005) 14.415 10.871 ( -1.797 -0.000 -13.927) 14.043 11.117 ( 1.992 0.000 20.480) 20.577 11.240 ( 1.140 0.000 -12.355) 12.407 11.488 ( 14.310 0.000 18.291) 23.224 11.573 ( 6.754 0.000 -8.834) 11.121 11.880 ( -3.630 -0.000 4.925) 6.118 12.057 ( -3.276 -0.000 -7.326) 8.025 12.093 ( 7.844 0.000 -28.551) 29.609 12.984 ( -15.096 -0.000 -0.993) 15.129 13.042 ( -0.299 -0.000 -1.841) 1.865 13.240 ( 3.468 0.000 15.903) 16.277 13.831 ( -5.333 -0.000 5.927) 7.973 14.062 ( -2.266 -0.000 -8.124) 8.435 14.516 ( 5.624 0.000 17.383) 18.271 15.075 ( 9.120 0.000 9.069) 12.861 16.586 ( 2.364 0.000 1.049) 2.586 17.027 ( -40.910 -0.000 -1.604) 40.942 17.036 ( -1.927 -0.000 -0.861) 2.111 17.303 ( 2.049 0.000 -1.039) 2.298 19.794 ( -3.615 -0.000 6.614) 7.537 20.511 ( 1.232 0.000 -3.606) 3.811 20.864 ( 11.195 0.000 2.695) 11.515 21.023 ( -51.167 -0.000 -0.892) 51.175 22.547 ( -7.507 -0.000 -1.740) 7.706 22.749 ( 40.896 0.000 -4.290) 41.121 22.818 ( 2.374 0.000 5.860) 6.323 23.281 ( 2.323 0.000 1.027) 2.540 24.375 ( -4.706 -0.000 0.518) 4.735 24.539 ( 0.664 0.000 -2.822) 2.899 24.749 ( -2.570 -0.000 -0.890) 2.719 25.302 ( 27.837 0.000 -4.846) 28.256 ======================= Grid point 132 (59/186) ======================= q-point: ( 0.12 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.840 ( 20.536 1.036 36.456) 41.855 2.010 ( 16.929 -9.271 36.085) 40.923 3.252 ( 16.568 -14.299 53.474) 57.779 3.538 ( -5.111 -0.960 8.430) 9.906 3.677 ( -2.297 -2.750 12.415) 12.922 4.702 ( -11.845 -0.041 -1.833) 11.986 4.939 ( 0.052 -3.594 -12.849) 13.342 5.273 ( -1.976 -3.992 -10.964) 11.835 5.535 ( -12.292 6.787 -7.326) 15.838 5.647 ( 1.630 -0.044 2.641) 3.104 5.850 ( -3.300 2.892 4.072) 5.986 6.101 ( -1.836 -6.999 -2.323) 7.600 6.299 ( 10.507 -2.098 0.086) 10.715 6.396 ( 5.455 -8.629 -5.065) 11.395 7.037 ( 1.413 1.256 -1.173) 2.225 7.263 ( -4.716 0.763 -15.195) 15.929 7.591 ( 2.774 4.102 -4.541) 6.718 7.776 ( 3.017 4.284 -8.180) 9.714 8.049 ( 6.202 3.175 -8.901) 11.304 8.172 ( 13.429 -2.823 -7.861) 15.814 8.316 ( 2.123 20.590 -1.366) 20.744 8.472 ( 3.879 4.005 -0.431) 5.592 9.002 ( -4.922 -7.232 0.539) 8.765 9.067 ( 6.676 2.885 -4.526) 8.566 9.274 ( -5.625 -6.859 -5.722) 10.556 9.616 ( 3.246 -2.959 -0.196) 4.397 9.790 ( -8.178 -2.413 3.348) 9.161 10.416 ( -4.072 1.685 0.502) 4.435 10.534 ( 0.869 3.056 3.126) 4.457 10.781 ( -5.266 0.827 -15.881) 16.752 11.199 ( 5.209 2.443 20.522) 21.313 11.214 ( -2.500 -1.102 -8.360) 8.795 11.557 ( 1.740 4.962 -5.732) 7.779 11.708 ( 10.998 1.480 -0.152) 11.099 11.880 ( -6.200 -10.989 -5.329) 13.697 12.095 ( 7.610 -0.507 4.746) 8.984 12.219 ( 9.887 -8.637 -14.307) 19.417 12.756 ( -15.275 2.660 -1.895) 15.621 13.042 ( 1.944 0.732 -3.561) 4.122 13.320 ( 2.579 0.271 17.145) 17.340 13.772 ( -5.703 -0.454 4.197) 7.095 13.988 ( -6.351 -0.539 -8.244) 10.421 14.635 ( 5.393 0.418 18.006) 18.801 15.143 ( -0.226 1.603 1.706) 2.352 16.345 ( -30.405 6.320 7.129) 31.863 16.732 ( -1.551 -2.045 7.127) 7.575 16.994 ( -4.957 -1.348 -0.765) 5.193 17.388 ( 4.260 -3.773 -1.415) 5.864 19.769 ( -2.351 0.179 6.125) 6.563 20.419 ( -19.307 8.045 10.167) 23.257 20.570 ( -2.163 -1.468 -1.189) 2.872 21.061 ( 5.926 -5.418 2.846) 8.519 22.440 ( -6.129 1.024 -3.694) 7.229 22.833 ( 2.790 3.023 4.711) 6.255 23.066 ( 21.837 7.868 -6.469) 24.096 23.305 ( -1.885 -1.867 0.238) 2.664 24.300 ( -4.961 1.547 -0.369) 5.210 24.534 ( 0.539 -0.117 -2.489) 2.550 24.713 ( -4.539 -1.379 -0.901) 4.829 25.630 ( 19.416 -1.710 -12.366) 23.083 ======================= Grid point 133 (60/186) ======================= q-point: ( 0.25 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.215 ( 19.714 -3.872 33.466) 39.034 2.459 ( 19.333 -9.438 30.129) 37.021 3.453 ( -9.296 1.413 10.157) 13.842 3.643 ( 2.342 -2.429 12.378) 12.830 3.842 ( 11.482 -3.651 28.201) 30.667 4.608 ( -6.736 -6.611 0.638) 9.460 5.037 ( 2.835 -9.900 -9.852) 14.251 5.182 ( -6.864 3.773 -1.969) 8.077 5.423 ( -1.188 -8.428 -9.132) 12.483 5.643 ( -1.777 1.991 0.580) 2.731 5.854 ( -0.136 -5.023 7.460) 8.995 6.128 ( -0.033 0.621 -4.595) 4.637 6.431 ( -2.422 -8.204 -7.740) 11.535 6.603 ( 11.652 -5.844 -2.678) 13.307 7.052 ( 1.998 2.353 -6.838) 7.502 7.172 ( -2.461 -1.622 -4.615) 5.476 7.444 ( -7.137 13.804 5.817) 16.593 7.674 ( 1.794 12.959 -5.252) 14.098 7.999 ( 0.385 5.018 -15.216) 16.027 8.093 ( 6.969 9.131 -7.166) 13.539 8.218 ( -2.294 2.165 -1.928) 3.697 8.624 ( 14.448 -3.375 -0.808) 14.859 8.874 ( 1.160 15.911 1.587) 16.032 9.172 ( 0.282 -7.365 1.525) 7.526 9.339 ( -4.861 -10.997 -10.778) 16.147 9.706 ( 5.154 -1.265 -4.393) 6.889 9.769 ( -5.564 -6.469 4.210) 9.515 10.289 ( -3.755 4.183 -7.917) 9.710 10.529 ( 0.037 3.745 -2.361) 4.427 10.685 ( -2.997 -2.017 -10.763) 11.353 11.134 ( -4.615 4.001 0.171) 6.110 11.234 ( 0.498 3.987 10.497) 11.240 11.558 ( 7.551 2.413 2.470) 8.303 11.788 ( 7.087 -2.842 -15.488) 17.268 11.937 ( -4.210 -7.238 -8.952) 12.258 12.261 ( 13.316 0.446 11.768) 17.776 12.420 ( 0.547 -4.176 1.188) 4.375 12.561 ( -8.149 -5.510 -10.133) 14.122 13.054 ( 4.054 1.316 -5.532) 6.984 13.369 ( -0.980 1.463 20.847) 20.921 13.714 ( -3.222 0.837 -6.270) 7.099 13.893 ( -7.628 -1.967 -1.445) 8.009 14.716 ( 2.094 1.634 17.941) 18.136 15.031 ( -11.656 2.043 -0.112) 11.834 16.037 ( -10.762 1.736 10.065) 14.837 16.793 ( 1.256 -2.804 6.494) 7.184 16.956 ( -4.896 -2.924 0.015) 5.703 17.489 ( 4.492 -2.739 -1.069) 5.369 19.763 ( -0.761 -0.123 6.671) 6.715 20.155 ( -13.343 2.908 12.325) 18.396 20.613 ( 5.840 1.032 -1.399) 6.093 21.183 ( 3.774 -1.274 3.411) 5.244 22.354 ( -2.894 0.760 -5.374) 6.151 22.837 ( 1.468 1.665 3.789) 4.392 23.153 ( 14.462 10.930 -4.324) 18.636 23.285 ( -7.613 -5.264 -0.952) 9.305 24.218 ( -3.564 1.425 -0.219) 3.845 24.551 ( 0.807 -1.399 -0.661) 1.746 24.665 ( -4.992 -1.351 -1.725) 5.452 25.774 ( 9.325 2.598 -11.863) 15.311 ======================= Grid point 134 (61/186) ======================= q-point: ( 0.38 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.612 ( 16.826 -7.472 27.637) 33.208 2.872 ( 12.518 -6.383 21.122) 25.369 3.321 ( -8.049 4.089 14.532) 17.108 3.544 ( -5.810 13.740 13.459) 20.092 4.048 ( 9.030 -1.396 13.458) 16.267 4.569 ( -10.510 2.005 -6.870) 12.715 5.127 ( 6.386 -10.670 -0.371) 12.440 5.322 ( 1.743 -11.994 2.515) 12.378 5.530 ( 1.701 -7.126 -8.537) 11.249 5.578 ( -3.686 -0.197 -2.072) 4.233 5.982 ( -2.284 -3.562 12.585) 13.278 6.090 ( 2.248 -1.630 -4.378) 5.184 6.344 ( -6.838 7.409 -11.548) 15.330 6.802 ( 4.697 -0.622 -1.631) 5.010 6.979 ( 2.422 2.970 -5.870) 7.011 7.138 ( -12.471 -0.640 3.687) 13.021 7.297 ( 4.315 -5.821 1.064) 7.324 7.480 ( 0.178 13.705 -4.785) 14.518 7.885 ( 0.476 4.370 -12.974) 13.698 8.096 ( 8.063 5.722 6.214) 11.678 8.255 ( 0.374 -9.592 -11.913) 15.299 8.649 ( -2.578 14.536 -0.927) 14.792 8.817 ( 10.181 -0.084 -2.304) 10.439 9.219 ( -2.971 -1.339 2.988) 4.421 9.400 ( 0.496 -4.739 -7.803) 9.143 9.761 ( -0.792 -4.400 -6.170) 7.619 9.801 ( -5.422 -7.234 2.236) 9.312 10.199 ( 7.661 9.180 -7.300) 14.009 10.424 ( -5.039 1.781 -11.468) 12.652 10.693 ( -0.061 -2.827 -3.906) 4.822 11.049 ( -3.745 0.900 8.699) 9.514 11.153 ( -2.182 7.740 -0.407) 8.052 11.625 ( 10.721 5.912 0.191) 12.245 11.924 ( -4.400 -3.254 -6.960) 8.854 11.956 ( 8.640 -9.767 -16.205) 20.800 12.304 ( -9.840 0.121 -5.776) 11.411 12.445 ( 10.265 1.974 12.947) 16.641 12.678 ( 2.483 -8.996 -5.586) 10.876 13.097 ( 6.427 -0.168 -3.912) 7.526 13.353 ( -3.420 3.764 21.204) 21.806 13.612 ( -5.922 1.699 -13.102) 14.478 13.869 ( -2.451 -3.366 4.416) 6.070 14.724 ( -3.406 2.248 13.247) 13.861 14.850 ( -10.594 1.790 5.675) 12.151 16.008 ( 1.745 -0.895 6.675) 6.957 16.857 ( 1.012 -1.742 5.015) 5.404 16.957 ( -4.759 -6.116 2.744) 8.220 17.572 ( 3.909 -1.456 -0.479) 4.199 19.791 ( 1.038 -1.152 8.517) 8.657 20.021 ( -8.617 0.716 10.955) 13.956 20.672 ( 7.867 3.250 -0.022) 8.512 21.197 ( -0.721 3.012 1.545) 3.461 22.335 ( 2.370 -0.743 -4.906) 5.499 22.844 ( -0.512 -0.465 2.272) 2.375 23.109 ( -1.546 5.128 -4.410) 6.938 23.280 ( -0.268 -1.416 -1.457) 2.049 24.179 ( -1.432 -0.572 0.925) 1.799 24.567 ( -2.749 -0.747 2.238) 3.623 24.638 ( -0.880 -2.826 -3.617) 4.674 25.765 ( 4.197 6.527 -11.123) 13.563 ======================= Grid point 135 (62/186) ======================= q-point: (-0.50 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.785 ( -10.847 11.437 8.945) 18.124 3.037 ( 10.751 -5.680 23.282) 26.266 3.164 ( -10.372 19.684 20.513) 30.262 3.435 ( 5.385 -2.479 19.688) 20.561 4.155 ( -9.913 0.283 2.875) 10.326 4.410 ( 7.361 1.705 3.209) 8.209 5.332 ( -7.623 1.417 5.779) 9.670 5.364 ( 4.010 -3.880 -7.722) 9.527 5.540 ( -4.506 2.707 -0.015) 5.256 5.677 ( 5.329 -6.446 -1.301) 8.464 5.844 ( -1.073 7.359 2.174) 7.748 6.084 ( -1.004 6.291 -2.173) 6.731 6.351 ( 1.503 -16.253 -4.977) 17.065 6.734 ( 1.621 7.758 -4.847) 9.290 6.985 ( 1.375 -3.894 -10.310) 11.106 7.137 ( -3.538 -6.947 2.915) 8.323 7.291 ( -7.269 4.335 -4.763) 9.712 7.510 ( 5.996 -10.645 4.394) 12.983 7.849 ( 3.189 1.126 -9.664) 10.239 8.187 ( 6.622 -2.456 4.217) 8.226 8.335 ( -5.626 -8.363 -14.457) 17.623 8.415 ( -4.462 10.377 -1.418) 11.384 8.871 ( 6.930 4.500 -3.176) 8.852 9.157 ( -4.468 5.151 0.258) 6.824 9.430 ( 1.727 -0.607 -5.295) 5.603 9.768 ( -4.003 -4.753 -4.307) 7.561 9.922 ( 1.754 -11.654 5.295) 12.920 10.179 ( 11.528 9.847 -4.979) 15.958 10.331 ( -1.338 2.841 -3.262) 4.528 10.725 ( -0.764 -4.105 -7.964) 8.993 10.986 ( -4.098 6.567 -1.535) 7.892 11.042 ( -0.854 0.850 6.170) 6.287 11.666 ( 7.957 5.492 -4.011) 10.467 11.878 ( -0.883 1.152 -11.461) 11.553 12.141 ( 2.779 -3.659 -12.566) 13.380 12.200 ( -4.156 -5.612 -4.728) 8.434 12.510 ( 2.952 4.266 2.229) 5.647 12.809 ( 4.476 -5.222 -1.302) 7.000 13.202 ( 2.940 -2.115 5.181) 6.321 13.318 ( 2.765 1.441 9.043) 9.565 13.465 ( -8.387 2.401 -4.880) 9.996 13.926 ( 2.852 -2.495 3.913) 5.447 14.619 ( -8.880 1.829 1.060) 9.128 14.767 ( -3.874 2.576 19.351) 19.902 16.104 ( 5.806 -3.128 4.330) 7.890 16.891 ( 1.453 0.051 2.299) 2.720 17.017 ( -5.514 -9.920 6.363) 13.011 17.629 ( 3.177 -0.342 0.041) 3.195 19.870 ( 2.765 -3.175 11.894) 12.617 19.950 ( -6.031 -0.294 9.638) 11.373 20.719 ( 7.058 4.662 1.479) 8.587 21.115 ( 0.054 6.252 -1.095) 6.347 22.405 ( 6.091 -2.051 -2.437) 6.873 22.837 ( -5.346 -3.058 -2.036) 6.487 22.975 ( -11.429 -0.530 -4.673) 12.359 23.292 ( 4.288 3.274 -0.945) 5.477 24.200 ( 0.437 -2.648 2.001) 3.347 24.526 ( -4.643 -1.004 0.929) 4.840 24.690 ( 1.684 -3.405 -1.042) 3.939 25.656 ( 2.090 10.762 -11.955) 16.220 ======================= Grid point 136 (63/186) ======================= q-point: (-0.38 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.368 ( -15.496 22.343 14.943) 31.026 2.687 ( -18.738 26.696 16.878) 36.724 3.229 ( -2.377 1.238 20.441) 20.616 3.607 ( 2.814 -5.617 17.947) 19.015 3.861 ( -15.767 8.726 14.932) 23.403 4.685 ( 19.890 -3.637 5.658) 20.996 5.190 ( -7.698 0.059 4.584) 8.960 5.323 ( -1.740 7.967 -2.950) 8.672 5.430 ( -2.279 2.007 -1.006) 3.199 5.633 ( -0.426 5.471 -1.745) 5.758 5.938 ( 5.635 2.213 -0.953) 6.128 6.070 ( 1.086 -3.691 -5.123) 6.407 6.519 ( 2.331 -3.059 -4.819) 6.165 6.723 ( 8.509 -1.024 -4.818) 9.832 7.065 ( -8.298 -10.043 -7.179) 14.875 7.141 ( -4.408 -3.210 -12.062) 13.237 7.215 ( -2.259 -8.336 2.493) 8.990 7.711 ( 3.379 -6.559 1.146) 7.466 7.866 ( 6.878 0.959 -6.715) 9.660 8.139 ( -17.121 -0.778 -11.104) 20.421 8.283 ( -4.111 -1.652 -18.021) 18.558 8.414 ( 6.870 -6.302 3.098) 9.824 8.946 ( 8.451 0.425 0.304) 8.468 8.954 ( -7.572 9.794 3.568) 12.883 9.465 ( 3.030 -1.502 -1.813) 3.837 9.741 ( -2.227 1.728 -9.333) 9.750 10.106 ( 0.566 -3.085 8.711) 9.259 10.216 ( 6.622 4.957 3.308) 8.909 10.323 ( 7.843 -2.981 6.618) 10.686 10.738 ( -2.671 -5.646 -15.784) 16.975 10.903 ( 5.062 3.818 -2.619) 6.860 11.033 ( -4.323 -1.425 7.681) 8.929 11.648 ( 2.348 4.632 -8.479) 9.943 11.808 ( 2.322 6.480 -10.568) 12.612 12.091 ( -4.321 -2.427 -14.873) 15.677 12.263 ( 2.450 3.458 3.570) 5.542 12.440 ( -0.874 3.640 -15.177) 15.632 12.938 ( 4.017 -4.380 5.356) 8.000 13.196 ( -2.295 0.368 1.835) 2.962 13.295 ( -10.334 2.109 1.624) 10.672 13.505 ( 9.702 -7.249 5.939) 13.489 14.022 ( 8.900 1.560 3.953) 9.862 14.484 ( -8.350 1.495 1.628) 8.637 14.746 ( -1.782 2.372 21.594) 21.797 16.251 ( 6.435 -4.711 2.614) 8.393 16.917 ( 2.430 0.211 1.478) 2.852 17.107 ( -7.476 -12.107 6.539) 15.660 17.666 ( 2.330 0.168 -0.053) 2.337 19.896 ( -5.404 -0.648 9.550) 10.992 20.039 ( 5.692 -7.343 14.963) 17.613 20.707 ( -0.422 4.077 0.048) 4.099 21.091 ( 14.331 8.339 2.720) 16.802 22.521 ( 6.648 -2.473 0.333) 7.101 22.720 ( -23.549 -8.713 -16.286) 29.928 22.852 ( -6.709 0.011 2.936) 7.323 23.292 ( 5.477 5.583 -0.399) 7.831 24.268 ( 2.071 -3.654 2.288) 4.783 24.491 ( -4.090 -1.954 0.814) 4.605 24.757 ( 1.452 -3.139 0.824) 3.555 25.466 ( 2.514 15.863 -13.274) 20.837 ======================= Grid point 137 (64/186) ======================= q-point: (-0.25 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.896 ( -12.141 25.160 22.878) 36.109 2.053 ( -25.640 24.849 18.591) 40.255 3.019 ( -13.889 16.697 41.598) 46.927 3.701 ( -1.732 3.469 13.742) 14.278 3.735 ( -4.162 -3.612 16.292) 17.199 4.887 ( 6.149 1.509 2.152) 6.688 5.175 ( -3.317 5.594 -6.009) 8.854 5.276 ( 5.045 -11.708 -1.526) 12.840 5.446 ( 7.931 0.650 4.478) 9.131 5.567 ( -0.474 2.467 -2.052) 3.244 5.854 ( 0.449 9.592 -0.376) 9.610 6.141 ( -1.994 -6.920 -8.148) 10.875 6.460 ( 2.749 12.097 -3.483) 12.885 6.820 ( -25.075 -2.088 1.214) 25.191 6.916 ( 8.513 -4.811 -6.141) 11.546 7.286 ( 1.633 -9.391 -12.051) 15.365 7.396 ( 9.892 -12.742 -9.770) 18.859 7.773 ( 6.484 0.832 -12.615) 14.208 7.851 ( -16.014 0.695 -12.479) 20.314 8.052 ( 5.440 -8.562 4.502) 11.098 8.166 ( -7.010 2.348 -12.918) 14.884 8.602 ( -3.654 -4.456 -3.278) 6.630 8.711 ( 0.051 1.342 -6.379) 6.519 9.106 ( 5.702 -3.593 11.655) 13.463 9.525 ( 2.731 0.543 -0.559) 2.840 9.603 ( -2.292 8.254 -9.718) 12.954 10.091 ( -2.991 4.303 8.346) 9.855 10.195 ( 4.679 4.750 2.614) 7.161 10.613 ( 7.530 -11.644 19.409) 23.854 10.770 ( -0.205 -8.655 -18.639) 20.552 10.979 ( 8.394 1.410 5.506) 10.137 11.011 ( -3.540 -3.499 0.944) 5.066 11.550 ( -3.322 5.669 -8.896) 11.060 11.711 ( 3.656 8.381 -13.255) 16.103 12.024 ( -0.164 5.132 -7.924) 9.442 12.174 ( 1.898 9.393 -4.347) 10.522 12.338 ( -4.002 1.092 -19.481) 19.918 13.054 ( 2.364 -3.411 9.485) 10.354 13.141 ( -4.969 1.711 -4.858) 7.157 13.186 ( -8.248 -3.768 9.313) 12.998 13.734 ( 5.727 -8.158 0.665) 9.990 14.106 ( 10.987 8.009 3.801) 14.118 14.393 ( -5.540 -1.618 5.877) 8.237 14.776 ( 3.280 1.605 22.044) 22.344 16.401 ( 5.746 -4.218 1.259) 7.238 16.960 ( 3.697 -0.463 0.722) 3.795 17.178 ( -10.671 -12.681 3.952) 17.038 17.674 ( -1.481 0.215 -2.869) 3.236 19.861 ( -4.900 -0.599 8.630) 9.942 20.307 ( 6.665 -13.296 13.459) 20.058 20.622 ( -3.001 2.585 -2.495) 4.681 21.317 ( 34.306 5.724 15.274) 37.986 22.398 ( -39.517 -10.423 -21.806) 46.322 22.639 ( 5.109 -2.233 0.967) 5.659 22.775 ( -6.314 0.161 2.760) 6.893 23.278 ( 5.157 6.041 -0.001) 7.943 24.359 ( 2.909 -3.559 2.025) 5.023 24.477 ( -3.151 -2.359 0.634) 3.987 24.811 ( -0.133 -2.348 2.477) 3.415 25.231 ( 7.067 20.798 -12.482) 25.264 ======================= Grid point 138 (65/186) ======================= q-point: (-0.12 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.485 ( -11.736 12.029 32.227) 36.345 1.624 ( -4.050 17.401 35.002) 39.298 2.779 ( -6.101 14.196 60.595) 62.534 3.624 ( -4.880 4.492 10.626) 12.526 3.751 ( -5.571 -1.907 11.876) 13.256 4.907 ( -1.204 -0.512 -1.193) 1.771 5.048 ( -3.239 2.848 -11.199) 12.001 5.395 ( -3.589 -2.266 -3.937) 5.789 5.531 ( 1.818 2.455 -0.442) 3.087 5.685 ( 16.858 -6.916 0.531) 18.229 5.825 ( 6.068 -1.397 2.280) 6.631 6.102 ( -10.831 -1.800 -10.131) 14.940 6.263 ( -3.552 14.444 -2.383) 15.064 6.562 ( -18.100 -2.685 2.124) 18.421 7.016 ( 3.744 0.638 -4.822) 6.138 7.410 ( 1.810 -8.682 -16.788) 18.986 7.558 ( 4.689 1.274 -16.291) 17.001 7.659 ( -2.620 0.642 -5.906) 6.493 7.871 ( 9.299 1.393 -6.960) 11.698 8.002 ( -4.183 0.675 -6.401) 7.676 8.279 ( 3.544 -12.862 2.391) 13.554 8.467 ( -3.416 0.116 -6.842) 7.648 8.887 ( 8.472 -6.309 -5.594) 11.953 9.194 ( -6.256 0.093 4.309) 7.597 9.353 ( 0.696 10.015 -3.535) 10.643 9.597 ( 0.078 -1.146 -0.169) 1.161 9.985 ( -7.073 2.939 6.043) 9.756 10.238 ( 6.878 1.517 6.748) 9.754 10.776 ( -7.251 -8.408 -0.975) 11.145 10.905 ( 1.298 -4.217 -10.384) 11.283 11.003 ( -0.257 -5.509 17.307) 18.165 11.166 ( 13.954 -0.530 2.469) 14.181 11.387 ( -4.219 4.633 -3.572) 7.213 11.606 ( 4.749 9.759 -10.411) 15.039 11.918 ( 4.285 10.117 3.780) 11.619 12.101 ( 2.840 1.551 -21.901) 22.139 12.195 ( -7.038 2.309 -15.670) 17.332 13.063 ( -3.530 -0.317 -0.038) 3.545 13.129 ( -11.430 -6.320 -2.768) 13.352 13.158 ( 2.586 0.970 16.865) 17.090 13.852 ( -0.130 -2.676 0.803) 2.797 14.097 ( 3.077 4.933 -0.955) 5.892 14.421 ( 1.810 -1.139 12.825) 13.002 14.905 ( 9.958 -0.003 17.738) 20.342 16.516 ( 4.803 -2.023 1.100) 5.326 17.021 ( 3.384 -0.655 -0.453) 3.476 17.204 ( -13.455 -13.071 0.457) 18.765 17.543 ( -13.646 5.211 -7.900) 16.607 19.827 ( -4.408 -0.355 7.646) 8.833 20.513 ( -1.986 -3.460 -3.241) 5.140 20.651 ( 7.476 -7.470 4.418) 11.454 21.735 ( -27.101 1.753 -7.279) 28.116 22.046 ( 24.445 -12.463 4.368) 27.784 22.651 ( -5.940 0.493 -0.690) 6.001 22.764 ( 3.145 -0.704 5.310) 6.211 23.265 ( 3.995 4.040 0.479) 5.702 24.415 ( -2.859 -1.838 2.103) 3.997 24.499 ( 2.266 -2.713 -1.763) 3.950 24.805 ( -2.945 1.752 1.239) 3.644 25.095 ( 18.736 15.214 -4.592) 24.568 ======================= Grid point 140 (66/186) ======================= q-point: ( 0.12 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.218 ( 19.976 0.000 33.624) 39.110 2.330 ( 25.627 0.000 32.575) 41.447 3.448 ( 3.430 0.000 30.216) 30.410 3.550 ( 1.385 0.000 7.806) 7.927 3.739 ( 17.892 0.000 30.385) 35.262 4.551 ( -10.191 -0.000 0.161) 10.193 4.862 ( -1.979 -0.000 -12.760) 12.913 5.199 ( 0.347 0.000 -12.428) 12.433 5.413 ( -9.246 -0.000 -9.766) 13.448 5.706 ( 3.558 0.000 3.128) 4.737 5.876 ( -3.393 -0.000 9.586) 10.168 5.916 ( -7.385 -0.000 -10.056) 12.477 6.345 ( 4.832 0.000 -2.434) 5.410 6.485 ( 10.502 0.000 -5.625) 11.913 7.048 ( -0.648 -0.000 -1.629) 1.753 7.176 ( -3.124 -0.000 -11.394) 11.814 7.666 ( 4.190 0.000 1.773) 4.549 7.803 ( -1.204 -0.000 -3.622) 3.817 8.156 ( 4.380 0.000 -11.324) 12.142 8.257 ( 6.299 0.000 -6.981) 9.403 8.409 ( -8.804 -0.000 10.185) 13.463 8.717 ( -0.987 -0.000 -18.325) 18.352 8.771 ( 16.613 0.000 -14.653) 22.152 9.064 ( -8.271 -0.000 8.065) 11.553 9.252 ( 3.761 0.000 -9.376) 10.103 9.649 ( 3.472 0.000 -2.238) 4.131 9.695 ( -1.735 -0.000 9.118) 9.281 10.286 ( -10.374 -0.000 -8.439) 13.373 10.660 ( 6.284 0.000 4.432) 7.690 10.677 ( -5.599 -0.000 -14.008) 15.086 11.164 ( -1.569 -0.000 -4.661) 4.918 11.337 ( 4.499 0.000 22.265) 22.715 11.602 ( -9.609 -0.000 3.785) 10.328 11.657 ( 8.027 0.000 -23.910) 25.221 11.864 ( 4.333 0.000 0.855) 4.416 12.252 ( 10.857 0.000 -16.379) 19.651 12.274 ( 14.517 0.000 16.747) 22.163 12.556 ( -17.462 -0.000 -1.237) 17.506 13.079 ( 4.355 0.000 -3.135) 5.366 13.402 ( 2.904 0.000 14.158) 14.453 13.683 ( -8.184 -0.000 8.554) 11.838 13.880 ( -6.229 -0.000 -12.112) 13.620 14.747 ( 3.916 0.000 18.387) 18.800 15.039 ( -17.254 -0.000 1.063) 17.287 16.060 ( -16.473 -0.000 11.558) 20.124 16.752 ( 2.278 0.000 6.097) 6.509 16.907 ( -5.700 -0.000 -0.824) 5.759 17.450 ( 7.421 0.000 -0.203) 7.424 19.762 ( -1.107 -0.000 5.893) 5.996 20.202 ( -18.574 -0.000 10.127) 21.156 20.628 ( 8.403 0.000 -0.023) 8.403 21.162 ( 8.682 0.000 6.505) 10.849 22.366 ( -4.013 -0.000 -5.572) 6.866 22.861 ( -1.841 -0.000 5.167) 5.485 23.202 ( -3.883 -0.000 0.026) 3.883 23.366 ( 10.339 0.000 -11.307) 15.322 24.245 ( -4.601 -0.000 -1.025) 4.714 24.520 ( -0.529 -0.000 -2.065) 2.131 24.632 ( -5.550 -0.000 -1.746) 5.818 25.816 ( 13.504 0.000 -12.107) 18.136 ======================= Grid point 141 (67/186) ======================= q-point: ( 0.25 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.545 ( 19.474 1.334 31.335) 36.918 2.748 ( 23.504 -2.520 28.487) 37.017 3.414 ( -6.779 3.708 13.865) 15.873 3.652 ( 3.031 -5.005 7.922) 9.848 4.131 ( 19.565 4.775 24.919) 32.039 4.474 ( -1.123 -4.072 5.538) 6.965 4.881 ( -1.912 -10.157 -6.687) 12.310 5.168 ( -1.343 4.137 -10.915) 11.750 5.307 ( 0.616 -3.403 -9.933) 10.518 5.663 ( -4.745 4.935 -0.874) 6.902 5.812 ( 0.479 -2.875 2.688) 3.965 6.007 ( -2.860 -11.485 -1.002) 11.878 6.386 ( 5.091 1.555 -4.240) 6.806 6.611 ( 4.540 -5.942 -6.489) 9.901 7.038 ( -3.030 -3.007 -2.292) 4.845 7.111 ( -1.568 2.323 -5.878) 6.512 7.575 ( -8.959 12.029 7.371) 16.712 7.772 ( -3.489 4.215 6.200) 8.269 8.091 ( 1.799 7.323 -11.961) 14.140 8.162 ( -2.689 6.607 -13.284) 15.078 8.337 ( 3.603 5.959 3.220) 7.672 8.722 ( 10.476 -4.038 -15.059) 18.784 8.918 ( -10.297 -2.249 5.536) 11.905 9.098 ( 4.128 -12.796 -22.379) 26.108 9.228 ( 5.354 6.928 1.397) 8.867 9.630 ( -4.088 -3.064 0.046) 5.109 9.787 ( 5.136 3.298 6.182) 8.687 10.193 ( -3.357 -6.114 -10.693) 12.767 10.551 ( -3.632 4.093 -15.825) 16.745 10.698 ( 2.441 2.292 2.778) 4.351 11.122 ( -3.589 2.151 -1.228) 4.361 11.323 ( -0.237 7.431 14.597) 16.381 11.661 ( 3.881 -8.733 7.769) 12.316 11.753 ( 10.011 -3.400 -22.502) 24.862 11.863 ( -0.003 2.960 -1.461) 3.301 12.317 ( -17.037 -1.036 -5.535) 17.944 12.397 ( 8.908 -5.107 -10.916) 14.986 12.495 ( 10.654 0.276 19.442) 22.172 13.146 ( 9.126 1.520 -4.123) 10.129 13.427 ( -2.050 3.088 16.096) 16.517 13.628 ( -6.165 -2.660 -1.403) 6.859 13.782 ( -4.305 -1.195 -5.808) 7.328 14.767 ( -15.172 0.383 6.164) 16.381 14.836 ( -4.978 -1.270 13.745) 14.673 15.988 ( -1.380 -0.542 8.438) 8.567 16.793 ( 0.126 -0.687 6.455) 6.493 16.855 ( -4.042 -2.454 -0.606) 4.767 17.549 ( 6.900 -0.307 -0.005) 6.907 19.772 ( 0.073 -0.282 6.623) 6.629 20.033 ( -11.181 0.166 9.061) 14.393 20.747 ( 10.666 1.684 1.892) 10.962 21.258 ( 3.836 1.161 5.656) 6.932 22.326 ( 0.683 -0.077 -6.178) 6.216 22.829 ( -4.573 -0.317 3.460) 5.743 23.108 ( -11.616 -1.291 -0.922) 11.724 23.421 ( 9.912 5.610 -8.696) 14.330 24.186 ( -3.159 0.503 -0.508) 3.239 24.525 ( -0.439 -1.674 -0.542) 1.813 24.564 ( -5.678 -1.668 -2.343) 6.365 25.904 ( 7.641 2.895 -10.403) 13.228 ======================= Grid point 142 (68/186) ======================= q-point: ( 0.38 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.841 ( 15.282 0.045 27.463) 31.429 3.068 ( 11.071 3.608 15.483) 19.373 3.346 ( -0.030 0.261 21.427) 21.429 3.718 ( 2.377 6.926 11.918) 13.988 4.118 ( -5.827 4.119 6.157) 9.425 4.583 ( 5.896 7.784 -0.411) 9.774 5.026 ( 3.824 -14.200 3.650) 15.152 5.190 ( 3.463 -8.835 -4.002) 10.299 5.434 ( 4.176 -8.900 -7.248) 12.214 5.556 ( -2.070 1.225 -4.057) 4.716 5.916 ( 2.498 -9.022 -0.257) 9.365 6.039 ( -3.528 1.546 -3.839) 5.438 6.407 ( 2.422 6.198 -0.755) 6.698 6.742 ( -0.141 -10.802 -2.285) 11.042 7.007 ( -8.053 1.427 3.857) 9.043 7.040 ( 0.662 4.676 -3.647) 5.967 7.301 ( -5.606 5.301 2.593) 8.139 7.545 ( -14.039 8.677 9.095) 18.845 7.968 ( 1.383 6.883 -10.317) 12.479 8.147 ( 3.211 -3.350 -15.739) 16.409 8.340 ( 11.488 9.275 -2.057) 14.907 8.727 ( -10.668 7.089 -3.796) 13.359 8.881 ( 7.135 -4.284 -11.201) 13.955 9.228 ( 1.204 0.949 5.395) 5.608 9.267 ( 0.573 -11.074 -12.377) 16.618 9.636 ( -3.090 -4.810 -3.908) 6.925 9.746 ( -0.059 3.987 5.724) 6.976 10.301 ( 5.805 -5.949 -7.482) 11.184 10.417 ( 0.666 5.363 -15.813) 16.711 10.692 ( -0.023 2.048 3.263) 3.852 11.021 ( -4.993 3.188 5.718) 8.233 11.273 ( 2.838 7.873 5.947) 10.266 11.779 ( -4.361 1.039 -1.594) 4.758 11.800 ( 5.674 -4.068 -15.158) 16.689 11.965 ( 12.891 -5.121 -2.792) 14.149 12.127 ( -12.241 -2.397 -6.166) 13.914 12.560 ( 5.688 -6.503 -8.337) 12.007 12.612 ( 2.214 0.120 14.175) 14.348 13.235 ( 9.638 4.138 -2.935) 10.892 13.386 ( -4.625 1.383 21.376) 21.914 13.532 ( -3.794 1.761 -16.813) 17.325 13.814 ( 1.419 -4.630 4.696) 6.745 14.583 ( -15.542 -4.135 -0.208) 16.084 14.839 ( -2.073 2.292 18.284) 18.543 16.038 ( 2.762 -1.794 6.572) 7.351 16.805 ( -4.232 -3.915 4.885) 7.557 16.869 ( -0.111 -2.055 1.977) 2.854 17.631 ( 5.614 0.345 0.001) 5.624 19.808 ( 0.993 -1.359 8.475) 8.640 19.939 ( -7.170 -0.408 7.951) 10.714 20.850 ( 9.387 4.183 4.004) 11.029 21.257 ( 1.267 3.647 1.295) 4.072 22.364 ( 5.875 -0.910 -4.098) 7.221 22.761 ( -9.908 -1.635 -0.941) 10.086 22.949 ( -13.119 -0.983 -1.550) 13.247 23.450 ( 9.416 5.796 -4.525) 11.947 24.158 ( -1.002 -0.487 0.842) 1.397 24.490 ( -5.882 -1.228 -0.751) 6.055 24.577 ( 0.237 -4.044 -1.077) 4.192 25.893 ( 4.577 6.111 -9.909) 12.509 ======================= Grid point 143 (69/186) ======================= q-point: (-0.50 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.873 ( -6.100 14.036 11.349) 19.053 3.163 ( 8.024 -0.161 24.249) 25.542 3.455 ( 4.241 12.225 16.903) 21.288 3.554 ( -1.689 12.233 18.596) 22.323 3.980 ( -13.298 -2.296 -1.717) 13.603 4.614 ( 13.778 0.960 7.862) 15.893 5.257 ( -0.094 -8.376 1.699) 8.547 5.270 ( -3.540 -2.489 -7.887) 8.996 5.537 ( -0.159 1.855 0.680) 1.982 5.691 ( 13.850 -10.948 3.104) 17.926 5.899 ( -3.281 5.400 -1.161) 6.425 6.111 ( 0.924 -13.124 -10.322) 16.722 6.229 ( -2.144 13.820 3.308) 14.371 6.801 ( -5.483 -0.442 1.150) 5.620 6.913 ( -3.065 -6.048 -0.815) 6.829 6.978 ( -1.285 2.830 -5.104) 5.976 7.227 ( -9.289 2.821 -2.083) 9.929 7.474 ( 5.187 -9.147 8.543) 13.548 7.914 ( 3.263 2.177 -6.008) 7.176 8.116 ( -8.176 0.414 -14.497) 16.649 8.310 ( 3.575 7.853 -11.816) 14.631 8.530 ( 0.521 7.595 -2.928) 8.156 8.949 ( 2.507 -0.771 -9.970) 10.309 9.175 ( -4.222 4.295 7.117) 9.323 9.398 ( 2.717 -5.652 -5.419) 8.288 9.655 ( -1.640 -5.594 -9.843) 11.440 9.814 ( 3.657 -7.063 11.433) 13.927 10.334 ( 2.185 2.348 -5.939) 6.750 10.437 ( 9.900 1.270 -10.106) 14.204 10.652 ( -3.244 1.447 1.632) 3.909 10.945 ( -4.243 1.402 7.466) 8.701 11.193 ( 4.210 10.228 0.594) 11.077 11.708 ( -2.982 0.091 -3.779) 4.814 11.848 ( -4.435 -3.446 -15.633) 16.611 12.041 ( 0.298 -2.729 -10.831) 11.174 12.185 ( 9.879 -2.794 -2.336) 10.529 12.583 ( -1.258 3.341 3.671) 5.121 12.736 ( 2.619 -8.803 -0.877) 9.226 13.242 ( -1.970 1.233 8.749) 9.053 13.319 ( -5.773 2.251 -5.839) 8.514 13.499 ( 6.871 3.765 1.060) 7.907 13.953 ( 8.140 -4.820 5.783) 11.088 14.469 ( -10.791 -3.762 -1.982) 11.599 14.813 ( -3.082 2.637 19.002) 19.430 16.131 ( 2.949 -3.739 6.114) 7.750 16.831 ( -5.323 -6.795 4.985) 9.968 16.903 ( 0.794 -1.358 2.642) 3.075 17.684 ( 3.980 1.025 -0.390) 4.129 19.860 ( -3.620 -2.140 9.075) 10.002 19.912 ( 0.467 -1.987 9.508) 9.725 20.855 ( 0.142 6.047 3.486) 6.982 21.265 ( 10.945 4.329 -0.552) 11.783 22.467 ( 7.798 -1.298 -0.796) 7.945 22.571 ( -20.783 -1.901 -9.209) 22.811 22.832 ( -8.128 -1.652 1.885) 8.505 23.476 ( 8.452 6.233 -2.183) 10.727 24.181 ( 1.088 -2.214 2.150) 3.272 24.434 ( -5.257 -1.716 -1.160) 5.651 24.643 ( 0.341 -4.662 0.649) 4.720 25.811 ( 3.421 9.114 -11.048) 14.725 ======================= Grid point 144 (70/186) ======================= q-point: (-0.38 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.543 ( -9.284 20.977 17.168) 28.653 2.900 ( -18.296 32.263 10.103) 38.441 3.350 ( 4.693 5.431 18.495) 19.839 3.610 ( -0.471 -3.237 19.002) 19.281 3.874 ( -4.405 3.207 11.060) 12.329 4.883 ( 14.307 -5.023 8.869) 17.567 5.148 ( -5.047 4.606 2.311) 7.213 5.341 ( -3.273 7.537 5.572) 9.928 5.405 ( -0.395 -2.692 -4.379) 5.155 5.798 ( 3.459 9.640 -3.387) 10.787 5.989 ( -1.849 2.122 -5.887) 6.525 6.048 ( 6.625 -3.954 8.339) 11.361 6.356 ( 2.076 -15.891 -8.708) 18.239 6.706 ( -16.634 -3.187 4.721) 17.582 6.939 ( 5.663 1.449 -5.998) 8.376 7.001 ( 3.161 -6.008 -9.436) 11.625 7.129 ( -1.165 -3.398 -7.022) 7.888 7.691 ( 3.378 -6.076 4.702) 8.392 7.896 ( -11.114 2.320 -15.725) 19.395 7.961 ( 5.263 -0.683 -1.206) 5.443 8.220 ( -0.151 0.544 -14.724) 14.735 8.472 ( 3.142 4.376 -3.018) 6.175 8.876 ( -11.154 3.154 -6.908) 13.494 9.110 ( 4.700 5.097 7.463) 10.186 9.466 ( 2.329 -1.786 -3.082) 4.256 9.702 ( 1.438 -3.509 -10.276) 10.953 10.024 ( 2.070 -10.607 10.019) 14.737 10.338 ( 2.934 3.198 3.228) 5.409 10.511 ( 9.291 1.386 -7.701) 12.147 10.586 ( -3.806 0.158 0.855) 3.904 10.923 ( -0.556 -1.426 2.511) 2.941 11.127 ( 5.476 8.180 2.277) 10.104 11.677 ( 0.374 1.747 -4.099) 4.472 11.733 ( -11.959 -4.069 -18.580) 22.468 12.074 ( 4.728 1.898 -6.807) 8.503 12.283 ( 2.589 -1.574 -11.637) 12.025 12.510 ( 0.469 6.646 1.418) 6.811 12.874 ( 0.590 -7.497 -1.176) 7.612 13.205 ( -5.230 0.519 -1.473) 5.458 13.211 ( -3.064 2.260 4.836) 6.155 13.557 ( 5.617 -0.487 3.313) 6.540 14.174 ( 13.496 -3.071 6.900) 15.465 14.375 ( -8.406 -0.716 -1.679) 8.601 14.801 ( -1.376 0.617 18.457) 18.519 16.244 ( 1.428 -6.226 5.815) 8.638 16.870 ( -6.936 -7.788 5.883) 11.974 16.943 ( 1.749 -1.278 1.864) 2.858 17.700 ( 1.491 1.590 -1.702) 2.765 19.836 ( -4.917 -1.174 7.454) 9.006 20.035 ( 3.245 -6.317 13.898) 15.607 20.737 ( -4.515 5.424 -0.234) 7.061 21.434 ( 22.058 2.750 3.559) 22.512 22.245 ( -28.003 -1.031 -11.894) 30.442 22.586 ( 6.903 -1.337 0.004) 7.031 22.763 ( -6.833 -1.351 2.309) 7.338 23.478 ( 6.651 7.203 -0.872) 9.843 24.253 ( 2.226 -3.635 2.866) 5.136 24.402 ( -3.403 -2.412 -1.422) 4.407 24.713 ( -0.215 -4.504 2.349) 5.085 25.682 ( 4.244 11.773 -13.057) 18.086 ======================= Grid point 145 (71/186) ======================= q-point: (-0.25 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.168 ( -11.456 28.505 16.983) 35.102 2.211 ( -13.344 26.499 23.150) 37.632 3.314 ( 4.120 15.877 31.098) 35.158 3.671 ( -4.075 -3.163 15.505) 16.340 3.798 ( -2.844 6.297 13.727) 15.368 4.946 ( -2.940 4.413 1.723) 5.576 5.160 ( -4.762 6.488 -2.736) 8.500 5.209 ( 4.811 -7.331 6.782) 11.086 5.531 ( 6.288 -4.605 -1.362) 7.912 5.683 ( 3.349 8.344 0.733) 9.021 5.936 ( -2.801 1.968 -8.327) 9.004 6.097 ( 4.428 5.111 2.977) 7.388 6.436 ( -16.944 -1.543 4.463) 17.590 6.610 ( 0.433 -4.892 -7.473) 8.942 6.977 ( 6.900 3.451 -2.805) 8.209 7.109 ( 1.180 -10.026 -16.197) 19.086 7.291 ( 5.282 -15.157 -10.132) 18.981 7.699 ( -4.801 1.831 -13.574) 14.514 7.776 ( -0.551 -6.564 -2.489) 7.041 8.085 ( 7.614 0.165 2.476) 8.008 8.189 ( 4.106 5.464 -5.211) 8.595 8.477 ( -6.834 -1.980 -4.168) 8.246 8.654 ( -4.523 -2.237 -9.544) 10.796 9.140 ( 2.396 1.850 7.514) 8.101 9.518 ( 1.992 -3.225 -2.877) 4.759 9.688 ( 0.546 5.258 -9.409) 10.792 10.106 ( -4.849 1.892 6.274) 8.152 10.319 ( 3.471 3.808 2.887) 5.906 10.557 ( -5.174 -8.314 -8.655) 13.069 10.688 ( 10.906 -3.191 11.412) 16.104 10.954 ( -0.127 -1.322 0.989) 1.656 11.157 ( 11.268 2.358 4.271) 12.279 11.537 ( -9.946 2.509 -13.321) 16.813 11.676 ( -1.227 -1.559 -11.259) 11.432 12.068 ( 2.496 3.258 -3.156) 5.177 12.247 ( -2.240 0.807 -20.386) 20.525 12.415 ( 3.732 11.703 1.528) 12.378 12.937 ( -4.154 -6.078 -7.697) 10.651 13.101 ( -5.170 3.514 1.932) 6.543 13.197 ( 0.758 0.963 13.069) 13.127 13.678 ( 3.313 -6.670 -0.294) 7.453 14.255 ( -7.294 2.664 -1.129) 7.847 14.384 ( 10.478 -0.498 10.166) 14.608 14.874 ( 4.506 -2.502 14.637) 15.518 16.364 ( -1.437 -8.660 4.977) 10.091 16.884 ( -9.751 -7.114 5.946) 13.456 16.992 ( 2.182 -1.329 1.264) 2.850 17.654 ( -3.098 3.273 -4.290) 6.222 19.809 ( -4.237 -0.902 7.216) 8.416 20.222 ( 1.067 -10.492 14.561) 17.979 20.626 ( -2.242 2.783 -1.264) 3.791 21.782 ( 6.515 -5.129 -4.324) 9.351 21.825 ( -7.443 4.078 -0.531) 8.504 22.640 ( -3.557 -1.163 -1.949) 4.219 22.740 ( 2.471 -0.711 5.089) 5.701 23.442 ( 4.000 7.579 -0.094) 8.571 24.325 ( -1.816 -3.945 2.281) 4.905 24.422 ( 2.269 -2.702 -1.511) 3.838 24.767 ( -1.471 -3.339 3.642) 5.155 25.548 ( 8.176 13.060 -14.614) 21.236 ======================= Grid point 146 (72/186) ======================= q-point: (-0.12 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.707 ( -0.011 18.844 30.053) 35.472 1.974 ( 4.268 17.499 34.447) 38.872 3.220 ( 9.324 21.133 45.270) 50.823 3.645 ( -8.000 2.055 9.561) 12.635 3.712 ( -2.651 3.019 14.112) 14.673 4.843 ( -7.601 1.056 -1.489) 7.817 5.027 ( -1.456 4.784 -7.977) 9.415 5.331 ( -0.809 -3.940 -2.618) 4.799 5.581 ( -1.145 1.190 -3.274) 3.667 5.661 ( -1.620 -0.835 -0.003) 1.823 5.865 ( -2.157 0.301 -2.733) 3.494 6.141 ( 14.798 5.060 1.848) 15.748 6.231 ( -12.310 1.738 4.959) 13.384 6.560 ( 0.991 10.633 -8.403) 13.588 7.009 ( 0.889 -0.957 -1.915) 2.318 7.252 ( 2.497 -10.428 -19.785) 22.504 7.488 ( 1.536 -9.613 -10.450) 14.282 7.705 ( 4.934 -2.664 -9.463) 10.999 7.898 ( -0.130 -12.358 -1.550) 12.456 8.072 ( 10.875 8.272 -5.318) 14.662 8.195 ( -1.985 0.975 -1.063) 2.454 8.379 ( -0.296 -4.074 -0.403) 4.105 8.826 ( 4.458 -14.526 -6.197) 16.410 9.135 ( -1.654 2.528 6.312) 6.998 9.517 ( -1.827 13.704 -10.025) 17.078 9.588 ( 2.431 -2.439 -1.400) 3.717 9.951 ( -8.783 5.788 4.409) 11.406 10.350 ( 4.176 0.412 4.923) 6.468 10.568 ( -7.163 -5.526 -4.418) 10.068 10.835 ( 0.163 -2.435 -7.581) 7.964 11.027 ( 5.912 -3.688 15.617) 17.101 11.312 ( 1.151 2.174 -9.903) 10.204 11.391 ( 4.346 -3.423 6.004) 8.164 11.648 ( 1.561 1.262 -11.051) 11.232 12.052 ( 2.291 2.307 -0.025) 3.251 12.111 ( -4.698 5.727 -17.532) 19.032 12.294 ( 6.932 13.679 -5.667) 16.349 12.890 ( -11.542 -4.046 -3.224) 12.648 13.032 ( -0.573 0.100 -3.353) 3.403 13.248 ( 2.271 0.652 17.818) 17.974 13.783 ( -0.693 -4.923 -1.545) 5.206 14.114 ( -7.162 3.035 -2.217) 8.088 14.517 ( 6.437 0.461 15.308) 16.613 15.034 ( 7.587 -3.390 7.468) 11.173 16.453 ( -9.008 -10.635 3.759) 14.435 16.829 ( -12.990 -3.616 6.162) 14.825 17.032 ( 0.241 -0.841 0.698) 1.120 17.500 ( -5.672 7.378 -5.153) 10.638 19.786 ( -3.444 -0.540 6.779) 7.623 20.386 ( -4.669 -10.688 9.224) 14.870 20.611 ( -1.561 -2.768 2.417) 3.993 21.308 ( -23.977 9.564 -7.810) 26.970 22.354 ( 25.159 -12.620 3.904) 28.416 22.595 ( 1.521 -1.879 -1.905) 3.078 22.824 ( 5.637 -0.953 5.577) 7.986 23.375 ( 0.890 6.290 0.349) 6.363 24.330 ( -4.636 -3.050 0.664) 5.589 24.500 ( 3.647 -1.858 -1.827) 4.482 24.773 ( -3.371 -0.597 2.423) 4.194 25.499 ( 15.752 9.605 -13.567) 22.900 ======================= Grid point 149 (73/186) ======================= q-point: ( 0.25 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.886 ( 19.169 0.000 25.321) 31.758 3.085 ( 19.937 0.000 28.896) 35.106 3.411 ( -5.888 -0.000 15.759) 16.823 3.642 ( 0.987 0.000 2.629) 2.808 4.370 ( -2.086 -0.000 10.835) 11.034 4.633 ( 24.329 0.000 13.600) 27.872 4.726 ( -4.588 -0.000 1.415) 4.802 5.191 ( 3.986 0.000 -12.864) 13.467 5.278 ( 2.179 0.000 -16.685) 16.827 5.606 ( -9.745 -0.000 -12.546) 15.886 5.733 ( -1.474 -0.000 0.251) 1.495 5.985 ( 6.949 0.000 18.806) 20.048 6.484 ( 7.462 0.000 -5.718) 9.400 6.554 ( -2.210 -0.000 -6.860) 7.208 6.969 ( -2.185 -0.000 -0.939) 2.379 7.120 ( 1.374 0.000 -2.131) 2.536 7.514 ( -15.237 -0.000 5.424) 16.174 7.714 ( -15.942 -0.000 14.131) 21.303 8.122 ( 4.686 0.000 -18.083) 18.680 8.165 ( -8.174 -0.000 -1.113) 8.250 8.474 ( 12.784 0.000 5.034) 13.740 8.736 ( 7.853 0.000 -23.565) 24.839 8.738 ( -14.139 -0.000 2.935) 14.440 9.051 ( 8.569 0.000 -31.164) 32.320 9.291 ( -4.188 -0.000 2.132) 4.699 9.578 ( -1.168 -0.000 4.512) 4.661 9.982 ( 10.490 0.000 6.389) 12.283 10.039 ( -2.288 -0.000 -10.391) 10.640 10.520 ( -0.688 -0.000 -11.415) 11.436 10.706 ( -1.944 -0.000 -2.668) 3.302 11.098 ( -1.535 -0.000 -3.365) 3.699 11.458 ( -0.522 -0.000 9.389) 9.404 11.616 ( 6.033 0.000 15.558) 16.687 11.868 ( 14.124 0.000 -12.293) 18.724 11.893 ( 0.754 0.000 -4.845) 4.903 12.042 ( -19.401 -0.000 -8.476) 21.171 12.450 ( 8.464 0.000 -11.051) 13.920 12.636 ( 2.667 0.000 16.991) 17.199 13.317 ( 14.236 0.000 3.434) 14.644 13.445 ( -4.461 -0.000 -3.056) 5.407 13.507 ( -6.370 -0.000 3.355) 7.199 13.735 ( 0.778 0.000 -0.985) 1.256 14.494 ( -19.276 -0.000 1.095) 19.308 14.875 ( -1.098 -0.000 18.099) 18.132 16.010 ( 1.730 0.000 6.734) 6.953 16.770 ( -4.381 -0.000 -0.349) 4.394 16.823 ( 0.752 0.000 6.594) 6.637 17.638 ( 6.532 0.000 0.200) 6.535 19.790 ( 0.308 0.000 7.337) 7.344 19.932 ( -7.354 -0.000 7.232) 10.314 20.915 ( 10.755 0.000 4.706) 11.739 21.309 ( 1.186 0.000 2.570) 2.830 22.352 ( 5.738 0.000 -4.783) 7.470 22.743 ( -8.940 -0.000 1.394) 9.048 22.932 ( -13.961 -0.000 -1.664) 14.060 23.543 ( 7.307 0.000 -8.151) 10.947 24.155 ( -1.697 -0.000 0.109) 1.700 24.472 ( -5.628 -0.000 -0.644) 5.664 24.509 ( 0.067 0.000 -0.733) 0.736 25.982 ( 4.879 0.000 -9.649) 10.813 ======================= Grid point 150 (74/186) ======================= q-point: ( 0.38 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.140 ( 14.639 4.923 22.558) 27.339 3.278 ( 1.402 8.548 10.687) 13.757 3.434 ( 8.299 -3.365 27.853) 29.257 3.709 ( -3.312 -9.428 0.810) 10.026 4.202 ( -6.820 16.742 14.186) 22.979 4.793 ( 0.377 -0.338 3.876) 3.909 4.895 ( 9.117 -4.598 2.587) 10.534 5.161 ( 4.112 -0.203 -11.993) 12.680 5.387 ( 8.712 -9.012 -7.133) 14.422 5.500 ( -1.474 -3.036 -11.186) 11.684 5.789 ( 0.806 -7.311 -6.315) 9.694 6.095 ( 3.656 3.907 8.686) 10.202 6.535 ( -6.772 -5.256 -7.236) 11.218 6.558 ( 6.433 1.396 9.445) 11.513 6.981 ( 1.169 -0.243 4.192) 4.358 7.120 ( 2.068 4.965 -1.280) 5.529 7.272 ( -11.680 4.313 3.562) 12.951 7.469 ( -15.729 5.937 13.834) 21.772 8.005 ( -5.738 4.110 -3.921) 8.074 8.145 ( 3.575 1.442 -17.444) 17.865 8.545 ( -5.703 3.550 -3.840) 7.737 8.635 ( 3.653 1.072 -3.914) 5.460 8.857 ( 8.422 -6.336 -15.561) 18.794 9.082 ( -2.394 -7.363 -22.559) 23.851 9.217 ( -3.922 -1.876 1.401) 4.568 9.596 ( 1.681 0.895 5.391) 5.718 9.897 ( 4.203 9.957 1.581) 10.923 10.242 ( 5.266 -10.804 -3.171) 12.430 10.464 ( 2.309 5.180 -10.577) 12.002 10.686 ( -2.497 -1.671 0.499) 3.046 11.058 ( 0.816 4.027 -3.074) 5.131 11.438 ( 0.269 4.736 13.234) 14.059 11.732 ( -0.596 1.335 8.192) 8.321 11.743 ( -8.250 0.403 -17.634) 19.473 11.924 ( -1.533 -3.719 -8.621) 9.513 12.080 ( 12.400 -5.918 -0.684) 13.757 12.545 ( 7.103 -2.668 -11.658) 13.910 12.655 ( -3.371 1.000 13.123) 13.586 13.321 ( -5.015 3.260 -6.870) 9.109 13.365 ( -8.945 0.689 9.754) 13.253 13.587 ( 16.424 2.178 -5.913) 17.591 13.811 ( 5.880 -4.479 5.552) 9.245 14.313 ( -13.734 -4.894 -0.947) 14.610 14.878 ( -3.616 1.480 17.746) 18.171 16.054 ( 0.695 -1.470 6.526) 6.726 16.727 ( -3.305 -1.205 0.836) 3.615 16.859 ( 0.676 -1.321 6.424) 6.593 17.711 ( 5.164 0.657 0.046) 5.206 19.809 ( -2.037 -1.025 7.848) 8.172 19.886 ( -2.175 -0.328 7.383) 7.703 20.997 ( 0.948 3.111 5.795) 6.645 21.342 ( 7.936 1.338 -2.170) 8.336 22.446 ( 9.063 -0.326 -1.795) 9.245 22.585 ( -14.745 1.869 -2.666) 15.100 22.763 ( -12.285 -2.668 -1.284) 12.637 23.600 ( 7.073 2.301 -5.478) 9.238 24.149 ( 0.375 -0.264 1.468) 1.538 24.408 ( -4.580 -0.257 0.278) 4.596 24.528 ( -0.117 -2.790 -0.316) 2.810 25.984 ( 2.700 3.196 -9.960) 10.803 ======================= Grid point 151 (75/186) ======================= q-point: (-0.50 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.059 ( -2.680 15.327 10.773) 18.925 3.369 ( 10.793 2.890 23.763) 26.259 3.578 ( -1.310 -0.363 16.759) 16.814 3.741 ( -13.496 -0.572 -2.933) 13.823 3.854 ( -2.887 19.289 14.909) 24.550 4.765 ( 4.058 0.621 9.066) 9.953 5.111 ( 1.791 -13.824 1.406) 14.010 5.201 ( 0.467 -0.808 -10.074) 10.117 5.561 ( 5.658 -4.147 -7.739) 10.445 5.705 ( 11.037 -15.204 -1.572) 18.853 5.885 ( 1.934 -2.669 -7.254) 7.968 6.044 ( 1.306 5.155 4.758) 7.136 6.411 ( -4.175 10.410 1.177) 11.277 6.585 ( -11.687 -3.353 9.079) 15.174 6.901 ( -1.451 7.995 6.856) 10.632 7.034 ( -1.791 1.692 -4.947) 5.526 7.225 ( 4.096 5.125 -1.877) 6.824 7.421 ( 3.829 -8.657 10.256) 13.957 7.917 ( -3.694 -1.357 -2.450) 4.635 8.034 ( -5.388 6.314 -14.607) 16.801 8.385 ( -3.374 6.787 -13.554) 15.529 8.624 ( 3.365 4.304 -11.912) 13.105 8.881 ( -6.929 -1.048 -8.931) 11.352 9.158 ( 4.492 -6.573 -3.522) 8.706 9.345 ( 5.647 -11.977 -3.534) 13.705 9.588 ( 1.019 4.337 0.424) 4.475 9.869 ( 3.051 2.540 8.714) 9.575 10.394 ( 2.655 -0.944 -1.270) 3.091 10.420 ( 2.117 -2.307 -12.564) 12.948 10.676 ( -0.570 0.482 2.317) 2.434 10.998 ( 1.439 6.001 1.353) 6.318 11.360 ( -3.858 5.775 6.399) 9.444 11.569 ( -9.585 -2.622 -11.941) 15.535 11.765 ( 2.802 2.585 -0.676) 3.872 11.989 ( 4.631 -5.733 -12.230) 14.279 12.268 ( 6.279 -1.837 -3.611) 7.472 12.601 ( -0.820 1.001 2.025) 2.403 12.669 ( 2.346 -5.425 0.627) 5.943 13.205 ( -4.808 1.080 -15.425) 16.193 13.258 ( -7.301 0.737 12.604) 14.585 13.673 ( 7.202 5.990 0.822) 9.404 14.045 ( 14.676 -5.193 6.374) 16.822 14.255 ( -8.219 -7.236 -3.317) 11.441 14.838 ( -5.055 1.779 17.322) 18.132 16.098 ( -2.242 -3.690 7.356) 8.529 16.724 ( -2.240 -2.980 1.779) 4.130 16.907 ( 1.428 -1.269 6.284) 6.568 17.750 ( 3.238 1.630 -0.568) 3.669 19.798 ( -4.247 -1.349 6.518) 7.896 19.926 ( 1.626 -1.966 10.754) 11.053 20.895 ( -6.867 5.013 1.398) 8.617 21.483 ( 15.802 0.986 -1.241) 15.882 22.301 ( -19.233 4.335 -6.060) 20.626 22.566 ( 7.932 -0.250 -0.921) 7.989 22.683 ( -8.036 -4.399 1.082) 9.225 23.637 ( 6.555 3.753 -3.315) 8.248 24.182 ( 2.121 -1.235 2.617) 3.589 24.362 ( -3.027 -0.365 0.473) 3.086 24.578 ( -0.492 -4.656 0.780) 4.746 25.920 ( 1.338 5.597 -11.345) 12.721 ======================= Grid point 152 (76/186) ======================= q-point: (-0.38 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.802 ( -2.409 20.453 15.591) 25.830 3.140 ( -17.414 31.426 4.725) 36.238 3.549 ( 6.886 4.435 17.225) 19.073 3.595 ( -3.927 -1.585 18.191) 18.677 3.799 ( -8.130 -4.541 6.292) 11.238 4.921 ( 2.654 -7.688 10.438) 13.233 5.156 ( -0.080 2.573 -6.817) 7.287 5.316 ( 3.118 -9.779 -3.481) 10.838 5.583 ( 4.696 13.862 13.810) 20.123 5.830 ( -0.765 -1.075 -7.014) 7.137 5.985 ( -1.744 -3.614 -2.902) 4.952 6.115 ( 3.037 -6.098 3.271) 7.557 6.251 ( 6.162 4.214 4.502) 8.718 6.464 ( -12.556 -2.473 1.446) 12.879 6.893 ( 3.843 -2.282 -1.383) 4.679 7.017 ( -1.004 -3.189 -4.654) 5.730 7.201 ( 9.194 8.132 -7.709) 14.495 7.623 ( -0.443 -7.057 5.917) 9.220 7.787 ( -6.657 3.969 -16.174) 17.934 7.996 ( 4.514 -4.046 5.384) 8.108 8.226 ( 1.083 4.963 -14.936) 15.776 8.568 ( 2.726 5.219 -11.312) 12.752 8.731 ( -13.043 1.900 -5.495) 14.280 9.280 ( 10.215 3.216 -3.635) 11.309 9.493 ( 1.335 4.108 2.503) 4.992 9.603 ( 1.765 -10.756 -8.345) 13.728 9.947 ( 0.580 -6.618 10.188) 12.163 10.408 ( 3.178 0.536 -0.869) 3.338 10.418 ( -6.450 -1.012 -4.208) 7.767 10.710 ( 6.662 -0.281 -2.038) 6.973 10.947 ( 0.628 3.641 4.692) 5.972 11.272 ( -3.023 0.649 0.821) 3.199 11.452 ( -7.836 -0.737 -15.442) 17.332 11.763 ( 5.157 5.043 3.892) 8.196 12.090 ( 3.085 -3.649 -9.930) 11.020 12.262 ( -1.199 1.855 -14.770) 14.935 12.595 ( 0.718 2.048 5.864) 6.253 12.779 ( 0.641 -5.833 -3.728) 6.952 13.116 ( -3.069 -2.656 -11.889) 12.563 13.221 ( -2.565 1.254 11.314) 11.669 13.659 ( 3.414 4.804 2.008) 6.226 14.202 ( -6.180 -4.199 3.933) 8.443 14.362 ( 14.251 -3.633 0.524) 14.716 14.807 ( -3.759 -1.023 15.716) 16.191 16.134 ( -6.057 -6.383 8.382) 12.152 16.753 ( -1.224 -3.418 2.190) 4.240 16.961 ( 2.238 -0.827 6.049) 6.503 17.742 ( 0.538 2.905 -1.821) 3.471 19.779 ( -3.666 -1.150 6.432) 7.492 20.021 ( 0.994 -4.426 13.522) 14.263 20.734 ( -6.401 4.363 -1.651) 7.920 21.691 ( 11.944 -1.835 -3.465) 12.571 21.974 ( -12.730 6.343 -3.224) 14.583 22.592 ( -5.198 -2.643 -3.688) 6.899 22.717 ( 5.051 -0.877 5.055) 7.200 23.639 ( 4.507 5.751 -2.008) 7.577 24.237 ( 0.763 -1.854 2.645) 3.319 24.358 ( 1.194 -1.560 0.362) 1.998 24.643 ( -0.924 -5.189 2.389) 5.787 25.817 ( 1.196 6.752 -13.266) 14.934 ======================= Grid point 153 (77/186) ======================= q-point: (-0.25 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.483 ( -10.124 32.189 9.964) 35.184 2.543 ( 0.762 22.887 24.212) 33.326 3.571 ( -2.295 -0.690 14.747) 14.941 3.637 ( 0.544 4.185 17.873) 18.364 3.766 ( -8.779 -4.677 10.839) 14.712 4.945 ( -4.877 2.815 -3.326) 6.540 5.153 ( -0.643 -2.414 -2.382) 3.452 5.339 ( 0.640 10.384 12.892) 16.567 5.574 ( 9.029 2.606 5.981) 11.140 5.790 ( -2.054 6.489 -3.524) 7.665 5.887 ( -3.374 0.082 0.322) 3.390 6.214 ( -4.049 -5.056 4.245) 7.744 6.342 ( 4.413 7.493 3.057) 9.217 6.466 ( 3.956 -14.202 -10.276) 17.971 6.970 ( 1.080 -2.897 -6.059) 6.802 7.101 ( 1.253 -12.227 -6.687) 13.992 7.201 ( 9.165 8.022 -5.903) 13.535 7.616 ( -7.411 -4.438 0.100) 8.639 7.667 ( 0.583 1.797 -15.317) 15.433 8.169 ( 4.006 -6.307 5.652) 9.369 8.275 ( 8.179 -2.909 -3.666) 9.423 8.448 ( -3.901 11.023 -6.758) 13.506 8.529 ( -3.726 -0.383 -10.973) 11.594 9.298 ( 7.054 8.813 1.658) 11.410 9.499 ( 2.997 -2.506 -3.998) 5.590 9.673 ( -3.352 -2.218 -6.008) 7.228 10.053 ( -2.678 -3.866 3.229) 5.705 10.310 ( -8.561 -1.493 -2.667) 9.090 10.463 ( 3.804 -1.221 0.761) 4.067 10.811 ( 6.991 -0.186 -2.332) 7.372 10.955 ( 0.947 -1.688 7.707) 7.946 11.247 ( -9.460 -6.697 -10.289) 15.498 11.343 ( 2.713 3.137 -4.615) 6.205 11.776 ( 7.857 7.116 4.673) 11.585 12.103 ( -0.534 1.000 -2.963) 3.172 12.184 ( -0.373 0.247 -23.967) 23.971 12.562 ( -1.237 4.463 6.838) 8.258 12.802 ( -2.083 -2.876 -14.198) 14.636 13.113 ( -0.357 2.652 -4.924) 5.604 13.214 ( -1.269 -2.635 15.580) 15.852 13.670 ( 3.098 -0.207 -0.234) 3.114 14.145 ( -8.676 -1.241 1.437) 8.881 14.546 ( 7.919 0.931 9.848) 12.671 14.882 ( 2.294 -6.662 8.433) 10.989 16.154 ( -10.525 -8.476 8.966) 16.218 16.787 ( -0.295 -1.578 2.766) 3.198 17.012 ( 1.988 -0.256 5.298) 5.664 17.667 ( -2.571 4.943 -3.353) 6.503 19.767 ( -2.801 -0.781 6.845) 7.437 20.128 ( -2.360 -6.561 14.971) 16.515 20.621 ( -3.173 1.884 -2.367) 4.384 21.522 ( -17.578 6.028 -9.299) 20.780 22.106 ( 21.534 -4.794 4.293) 22.475 22.547 ( -4.136 -2.205 -3.729) 5.989 22.807 ( 5.284 -0.166 5.545) 7.661 23.578 ( 0.921 7.365 -1.338) 7.542 24.251 ( -2.438 -1.763 1.104) 3.205 24.439 ( 5.230 -2.464 0.497) 5.803 24.702 ( -1.698 -4.193 3.418) 5.670 25.716 ( 3.084 5.840 -14.655) 16.074 ======================= Grid point 154 (78/186) ======================= q-point: (-0.12 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.107 ( 7.032 20.377 25.237) 33.190 2.391 ( 9.726 17.944 29.134) 35.571 3.549 ( -10.391 -0.958 9.849) 14.349 3.612 ( 2.245 3.047 14.727) 15.206 3.766 ( 0.024 2.734 22.710) 22.874 4.792 ( -6.369 6.322 -2.635) 9.353 5.132 ( 0.846 3.429 -9.014) 9.681 5.240 ( -2.482 5.443 11.486) 12.950 5.579 ( -1.549 6.284 -5.602) 8.560 5.674 ( -1.921 2.304 -2.587) 3.961 5.883 ( 2.144 2.588 4.586) 5.685 6.143 ( -5.645 0.213 2.011) 5.996 6.444 ( 15.923 4.076 4.854) 17.138 6.591 ( -1.525 -2.430 -12.299) 12.629 7.009 ( 0.186 -4.805 -9.577) 10.716 7.174 ( 5.326 3.839 -7.742) 10.151 7.319 ( 2.704 -14.604 -4.809) 15.611 7.551 ( -10.420 -7.511 -3.983) 13.448 7.801 ( 10.470 -9.292 -0.404) 14.004 8.105 ( -10.185 1.084 -12.871) 16.449 8.286 ( 4.582 9.060 -6.785) 12.212 8.461 ( 12.054 0.495 8.531) 14.776 8.627 ( 2.336 -14.839 -5.198) 15.895 9.256 ( 3.544 7.769 1.761) 8.719 9.533 ( -6.951 1.044 -2.452) 7.445 9.633 ( 6.892 0.770 -7.737) 10.390 9.956 ( -6.193 7.398 0.104) 9.648 10.268 ( -6.909 -7.493 -3.587) 10.804 10.512 ( 2.027 0.316 -0.534) 2.120 10.806 ( -2.426 2.705 -13.191) 13.683 11.073 ( 2.072 -6.174 16.776) 17.995 11.174 ( -4.952 -4.161 -11.363) 13.075 11.427 ( 4.999 -4.036 3.168) 7.163 11.782 ( 9.109 8.138 -2.485) 12.465 12.088 ( 0.273 2.805 -17.749) 17.971 12.117 ( 3.102 0.793 0.621) 3.262 12.487 ( -1.269 5.120 3.642) 6.410 12.735 ( -4.968 2.216 -12.054) 13.224 13.040 ( 0.577 2.675 -4.260) 5.063 13.300 ( -0.094 -2.660 18.956) 19.142 13.718 ( 0.693 -2.680 -4.979) 5.697 14.029 ( -9.097 1.249 0.855) 9.222 14.629 ( 3.153 0.346 16.132) 16.441 15.028 ( 0.675 -6.815 1.544) 7.021 16.127 ( -14.529 -7.235 9.401) 18.757 16.799 ( 0.736 1.486 4.427) 4.728 17.028 ( -1.143 1.235 3.269) 3.677 17.541 ( -1.722 6.094 -3.289) 7.136 19.762 ( -1.799 -0.287 6.976) 7.210 20.196 ( -8.159 -6.735 14.835) 18.221 20.582 ( -0.381 0.005 -2.511) 2.540 21.243 ( -6.458 6.357 -3.433) 9.690 22.372 ( 0.526 -3.931 -2.446) 4.660 22.647 ( 14.729 -7.645 -0.882) 16.618 22.899 ( 6.350 -2.014 5.168) 8.431 23.453 ( -3.600 7.327 -1.183) 8.249 24.240 ( -3.324 -1.835 0.240) 3.805 24.527 ( 3.795 -0.908 -0.365) 3.919 24.719 ( -3.197 -1.519 1.809) 3.975 25.687 ( 7.006 1.915 -13.969) 15.744 ======================= Grid point 158 (79/186) ======================= q-point: ( 0.38 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.361 ( -3.368 -0.000 16.320) 16.664 3.414 ( 9.051 0.000 15.732) 18.150 3.509 ( -7.271 -0.000 -1.724) 7.473 3.601 ( 7.261 0.000 22.818) 23.946 4.318 ( -6.083 -0.000 18.919) 19.872 4.702 ( -1.302 -0.000 10.311) 10.393 5.057 ( 5.258 0.000 -4.871) 7.168 5.172 ( -5.181 -0.000 -18.223) 18.946 5.311 ( 7.796 0.000 -8.463) 11.506 5.462 ( 5.407 0.000 -14.167) 15.164 5.818 ( 10.555 0.000 3.746) 11.201 6.197 ( 2.153 0.000 1.108) 2.421 6.324 ( -12.398 -0.000 -3.165) 12.796 6.722 ( 6.117 0.000 14.295) 15.549 7.049 ( 8.666 0.000 1.527) 8.800 7.072 ( -19.540 -0.000 4.541) 20.061 7.280 ( 13.335 0.000 1.341) 13.402 7.400 ( -7.354 -0.000 15.384) 17.051 7.896 ( -11.441 -0.000 -3.301) 11.907 8.196 ( 5.865 0.000 -16.776) 17.772 8.407 ( -8.814 -0.000 1.013) 8.872 8.716 ( 2.771 0.000 -9.411) 9.810 8.871 ( -11.254 -0.000 -25.507) 27.879 8.931 ( 13.521 0.000 -8.252) 15.840 9.141 ( -2.271 -0.000 -5.477) 5.929 9.698 ( 7.751 0.000 10.557) 13.097 10.060 ( 3.211 0.000 -3.627) 4.844 10.154 ( 0.298 0.000 0.488) 0.572 10.557 ( 5.958 0.000 -5.641) 8.204 10.617 ( -3.571 -0.000 -0.963) 3.698 11.106 ( 3.313 0.000 -6.040) 6.889 11.403 ( -16.722 -0.000 7.457) 18.309 11.540 ( -3.527 -0.000 -16.420) 16.795 11.860 ( 3.421 0.000 14.945) 15.332 11.911 ( 3.607 0.000 -5.988) 6.990 12.174 ( 11.701 0.000 -4.713) 12.614 12.595 ( 7.393 0.000 -13.687) 15.556 12.623 ( -6.680 -0.000 12.311) 14.006 13.234 ( -5.549 -0.000 -14.014) 15.073 13.262 ( -10.356 -0.000 9.108) 13.791 13.838 ( 3.609 0.000 6.410) 7.356 13.888 ( 22.472 0.000 -4.739) 22.966 14.124 ( -9.069 -0.000 1.304) 9.162 14.868 ( -5.873 -0.000 16.659) 17.664 16.047 ( -2.492 -0.000 6.580) 7.036 16.685 ( -2.020 -0.000 0.441) 2.068 16.886 ( 1.992 0.000 8.367) 8.600 17.775 ( 3.753 0.000 -0.040) 3.753 19.776 ( -3.710 -0.000 6.161) 7.192 19.902 ( 0.951 0.000 9.594) 9.641 20.972 ( -8.183 -0.000 1.766) 8.371 21.496 ( 13.949 0.000 -2.411) 14.156 22.412 ( -15.042 -0.000 -3.835) 15.523 22.565 ( -11.310 -0.000 -3.489) 11.836 22.572 ( 9.841 0.000 2.204) 10.085 23.687 ( 6.245 0.000 -4.550) 7.727 24.171 ( 2.389 0.000 2.848) 3.718 24.364 ( -2.601 -0.000 2.170) 3.388 24.500 ( -0.821 -0.000 -0.704) 1.081 25.999 ( 0.195 0.000 -10.879) 10.880 ======================= Grid point 159 (80/186) ======================= q-point: (-0.50 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.221 ( -6.420 8.344 6.960) 12.621 3.415 ( -12.157 -5.061 9.608) 16.301 3.611 ( 10.726 3.068 15.486) 19.086 3.669 ( -4.841 1.039 13.771) 14.634 4.113 ( -7.300 21.368 14.223) 26.687 4.776 ( -3.981 -5.499 7.983) 10.479 4.971 ( 1.227 -4.016 1.451) 4.443 5.204 ( 3.808 -2.286 -12.954) 13.694 5.487 ( 2.869 -14.698 -9.821) 17.909 5.563 ( 6.388 -6.358 -11.329) 14.477 5.959 ( 5.011 2.316 2.899) 6.235 6.155 ( 2.358 2.994 3.095) 4.910 6.232 ( -10.811 -6.123 -2.498) 12.674 6.679 ( -4.973 11.829 10.703) 16.710 6.898 ( -5.371 -2.449 3.831) 7.037 7.194 ( 12.033 6.245 6.173) 14.897 7.310 ( 1.091 4.730 6.352) 7.994 7.489 ( 12.085 0.374 4.161) 12.786 7.775 ( -7.648 -3.490 -4.868) 9.714 8.114 ( 2.397 10.847 -7.442) 13.371 8.386 ( 0.846 0.586 -7.722) 7.790 8.634 ( -4.174 1.346 -22.809) 23.226 8.726 ( -8.096 -2.114 -2.262) 8.668 9.143 ( 11.671 -7.935 -8.418) 16.433 9.189 ( 0.920 -11.490 -6.668) 13.317 9.778 ( 7.398 9.039 8.834) 14.646 9.964 ( -1.819 6.909 4.116) 8.245 10.261 ( -1.720 -10.142 -5.085) 11.475 10.512 ( 1.637 5.623 -4.899) 7.635 10.654 ( 0.679 -2.755 1.152) 3.063 11.076 ( -5.250 4.254 -3.372) 7.551 11.200 ( -9.501 -3.257 -6.449) 11.936 11.512 ( -0.050 1.269 -6.183) 6.312 11.895 ( 2.119 3.159 10.674) 11.331 11.954 ( 4.251 -3.005 -10.753) 11.947 12.304 ( 5.877 0.303 -6.025) 8.422 12.580 ( -4.805 -2.011 13.422) 14.397 12.658 ( 5.761 -1.417 -13.016) 14.304 13.113 ( -6.446 2.106 -8.561) 10.922 13.193 ( -4.015 -2.789 3.273) 5.883 13.827 ( 2.319 6.374 1.676) 6.986 14.058 ( -5.550 -6.490 -2.042) 8.780 14.224 ( 19.092 -3.310 4.690) 19.937 14.815 ( -7.132 0.688 15.465) 17.044 16.027 ( -4.809 -1.599 7.011) 8.651 16.680 ( -0.518 -1.541 0.952) 1.884 16.945 ( 3.210 -0.290 9.369) 9.908 17.803 ( 1.776 1.242 -0.441) 2.212 19.752 ( -2.939 -0.617 5.944) 6.659 19.948 ( 0.812 -1.096 11.632) 11.712 20.833 ( -9.479 2.118 -2.193) 9.957 21.662 ( 10.577 -0.423 -3.565) 11.169 22.160 ( -12.515 5.917 -3.276) 14.226 22.480 ( -6.936 -4.589 -3.941) 9.203 22.704 ( 8.522 -0.115 4.055) 9.438 23.743 ( 5.493 1.742 -3.517) 6.751 24.221 ( 3.791 0.225 3.942) 5.473 24.345 ( -0.653 0.423 2.641) 2.753 24.509 ( -1.289 -3.523 -0.081) 3.752 25.941 ( -2.078 2.192 -12.460) 12.820 ======================= Grid point 160 (81/186) ======================= q-point: (-0.38 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.054 ( -4.220 8.706 6.714) 11.777 3.261 ( -11.247 10.815 9.149) 18.087 3.548 ( -11.946 3.223 10.915) 16.499 3.679 ( -9.183 13.283 15.162) 22.151 3.753 ( 4.160 4.340 12.680) 14.033 4.853 ( -0.630 -5.842 9.118) 10.847 5.132 ( -1.301 -10.503 0.260) 10.586 5.239 ( 5.536 -0.900 -8.461) 10.151 5.666 ( 0.913 -4.433 -7.268) 8.562 5.755 ( 3.061 -19.209 -12.419) 23.078 5.878 ( -5.677 3.874 9.522) 11.744 6.134 ( -3.214 0.752 4.869) 5.882 6.240 ( -2.356 -1.448 0.164) 2.770 6.493 ( -2.350 5.713 3.491) 7.096 6.960 ( 8.848 0.663 5.352) 10.362 7.120 ( 6.632 16.086 8.039) 19.167 7.367 ( 6.629 1.434 -6.523) 9.410 7.565 ( -1.429 0.718 3.223) 3.598 7.754 ( 2.520 1.583 -12.302) 12.657 8.057 ( 5.611 1.929 6.346) 8.688 8.309 ( 4.576 6.787 -15.728) 17.730 8.561 ( -5.223 -0.694 -9.441) 10.812 8.636 ( -2.238 1.422 -7.092) 7.571 9.363 ( 9.110 -7.727 -10.631) 15.991 9.417 ( 1.448 -14.646 -4.603) 15.420 9.670 ( 2.318 14.390 3.995) 15.114 9.895 ( -4.132 -0.690 7.782) 8.838 10.307 ( -5.175 -2.951 -2.816) 6.589 10.457 ( 0.801 2.856 -2.390) 3.809 10.724 ( 2.734 -4.660 1.803) 5.696 10.916 ( -11.915 -2.635 -3.376) 12.661 11.172 ( 2.694 2.028 -8.749) 9.376 11.451 ( -1.548 3.075 -3.545) 4.942 11.916 ( 2.959 1.062 9.039) 9.570 12.037 ( 2.764 -4.707 -11.713) 12.923 12.267 ( 1.921 6.360 -13.182) 14.762 12.602 ( -2.868 -1.334 9.061) 9.597 12.720 ( 2.367 -2.931 -10.184) 10.858 13.016 ( -2.930 -1.847 -4.123) 5.384 13.228 ( 1.124 -1.824 3.408) 4.025 13.758 ( 0.009 4.964 -0.305) 4.974 14.064 ( -5.929 -4.215 2.244) 7.613 14.508 ( 13.790 -3.506 5.010) 15.086 14.760 ( -6.271 -1.185 13.597) 15.020 16.006 ( -5.408 -2.469 7.479) 9.553 16.718 ( 1.073 -2.774 0.980) 3.131 17.016 ( 3.713 0.290 9.996) 10.667 17.780 ( -0.687 2.952 -1.260) 3.283 19.746 ( -1.859 -0.672 6.696) 6.982 20.007 ( -0.735 -2.512 13.360) 13.614 20.683 ( -7.151 2.078 -4.046) 8.475 21.645 ( -11.141 2.707 -8.983) 14.566 22.068 ( 10.378 1.484 2.339) 10.741 22.463 ( -3.202 -3.656 -4.416) 6.567 22.810 ( 6.131 0.261 5.163) 8.019 23.750 ( 2.955 4.498 -3.203) 6.263 24.254 ( 1.029 1.745 3.581) 4.115 24.376 ( 4.092 -1.663 2.086) 4.885 24.561 ( -1.012 -5.401 1.888) 5.810 25.834 ( -3.421 2.700 -14.194) 14.848 ======================= Grid point 161 (82/186) ======================= q-point: (-0.25 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.818 ( -4.603 22.972 4.974) 23.951 2.949 ( 3.899 20.702 19.471) 28.687 3.415 ( -13.544 -6.937 12.675) 19.804 3.484 ( -16.930 -4.652 10.479) 20.447 3.841 ( 6.650 3.179 18.232) 19.665 4.872 ( -6.821 -1.079 -1.048) 6.985 5.172 ( 3.886 2.596 -6.370) 7.900 5.355 ( 1.247 -6.421 1.144) 6.641 5.672 ( -2.546 -0.466 -4.218) 4.949 5.796 ( -7.851 -7.645 5.043) 12.063 6.010 ( -3.055 11.850 12.578) 17.548 6.065 ( 5.273 -7.865 -1.716) 9.623 6.222 ( -2.152 -7.819 -7.023) 10.728 6.524 ( 5.880 -3.750 0.486) 6.991 7.003 ( 2.238 7.690 -4.862) 9.369 7.074 ( 9.283 3.840 3.769) 10.730 7.400 ( 5.506 5.623 -2.285) 8.195 7.514 ( -2.432 2.664 0.870) 3.710 7.697 ( 4.433 1.754 -13.038) 13.883 8.129 ( -3.039 2.149 3.440) 5.068 8.340 ( 10.858 -3.138 -11.731) 16.290 8.459 ( -0.247 1.980 0.294) 2.017 8.603 ( 3.634 4.813 -8.821) 10.685 9.471 ( -3.730 4.150 0.085) 5.581 9.489 ( -4.508 -2.754 -4.350) 6.843 9.586 ( 10.414 -0.301 -9.193) 13.894 9.952 ( -0.771 -7.920 2.687) 8.399 10.189 ( -9.838 3.296 0.127) 10.377 10.469 ( -0.063 -3.183 -2.264) 3.907 10.795 ( -3.653 -3.079 -2.925) 5.601 10.892 ( -1.067 -8.247 0.134) 8.317 11.140 ( 2.712 4.467 -7.321) 8.995 11.402 ( -0.023 1.181 0.920) 1.498 11.994 ( 5.619 -0.248 6.901) 8.903 12.082 ( 0.536 -2.411 -4.922) 5.507 12.164 ( 5.088 7.522 -21.769) 23.587 12.556 ( -6.676 1.641 6.941) 9.769 12.735 ( 1.506 -1.698 -15.889) 16.051 13.089 ( 1.691 -6.592 4.451) 8.132 13.235 ( 0.030 3.728 4.056) 5.509 13.711 ( 0.058 1.414 -1.714) 2.223 14.023 ( -7.565 -1.556 3.473) 8.468 14.650 ( 1.325 0.673 13.811) 13.890 14.804 ( -0.219 -7.677 5.282) 9.321 15.993 ( -4.363 -2.165 7.471) 8.919 16.780 ( 2.029 -2.454 0.996) 3.336 17.073 ( 2.936 1.739 9.806) 10.383 17.697 ( -2.673 4.770 -2.146) 5.874 19.754 ( -0.640 -0.245 7.905) 7.935 20.057 ( -3.534 -3.376 14.250) 15.065 20.586 ( -3.067 0.362 -4.189) 5.204 21.394 ( -12.515 4.362 -7.114) 15.042 22.259 ( 9.892 -3.265 0.619) 10.435 22.501 ( 6.113 -3.471 -3.620) 7.907 22.883 ( 3.772 0.223 5.624) 6.776 23.667 ( -1.964 7.364 -3.476) 8.377 24.234 ( -0.749 1.655 2.062) 2.748 24.480 ( 5.474 -2.289 1.901) 6.231 24.630 ( -0.601 -4.634 2.684) 5.389 25.727 ( -2.739 0.868 -15.008) 15.281 ======================= Grid point 162 (83/186) ======================= q-point: (-0.12 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.550 ( 9.020 19.026 19.236) 28.520 2.837 ( 9.263 15.693 21.477) 28.166 3.373 ( -14.610 -5.259 11.715) 19.451 3.435 ( -11.421 -13.381 12.372) 21.507 3.929 ( 7.277 2.789 17.065) 18.760 4.734 ( -11.708 0.463 -6.568) 13.432 5.163 ( 7.064 6.536 -5.862) 11.268 5.402 ( 0.225 2.467 5.302) 5.852 5.627 ( -2.229 0.425 -5.518) 5.966 5.701 ( -4.416 10.334 -0.691) 11.259 5.981 ( -0.582 -3.782 17.341) 17.758 6.069 ( -3.050 -0.145 -0.958) 3.200 6.362 ( -0.709 -7.491 -11.437) 13.690 6.683 ( 7.948 -4.339 -0.284) 9.060 6.938 ( 2.375 1.161 -9.644) 10.000 7.188 ( 3.776 -6.231 1.713) 7.485 7.340 ( -2.924 3.086 1.117) 4.396 7.393 ( 2.872 8.545 -11.197) 14.375 7.842 ( 8.211 -4.304 4.903) 10.487 7.987 ( -3.854 1.987 -9.361) 10.317 8.425 ( -0.167 8.400 -8.490) 11.944 8.492 ( 3.572 -7.140 -5.778) 9.855 8.649 ( 12.071 -0.511 6.289) 13.621 9.318 ( -9.581 1.501 1.379) 9.795 9.452 ( -1.166 0.616 -5.791) 5.939 9.749 ( 13.058 0.101 -11.073) 17.121 9.969 ( -5.731 5.231 2.266) 8.083 10.061 ( -5.974 -7.145 -2.693) 9.696 10.480 ( -4.201 -3.326 -7.102) 8.897 10.759 ( -1.784 1.070 -9.130) 9.364 11.003 ( 0.497 -5.992 1.227) 6.137 11.117 ( -1.383 -0.958 5.145) 5.414 11.443 ( 5.131 -3.056 0.867) 6.035 12.003 ( 2.044 5.588 -2.351) 6.398 12.056 ( 1.913 4.273 -24.702) 25.142 12.225 ( 11.958 -1.903 8.291) 14.675 12.442 ( -8.219 1.365 1.248) 8.425 12.739 ( 2.240 1.029 -10.587) 10.871 13.111 ( 1.863 6.548 -3.236) 7.538 13.263 ( -1.407 -6.349 15.980) 17.253 13.684 ( -2.652 -0.195 -6.391) 6.923 13.943 ( -6.187 0.811 4.424) 7.649 14.680 ( -1.182 -0.922 16.738) 16.805 14.894 ( -5.459 -6.914 2.608) 9.187 15.991 ( -1.645 -0.735 7.048) 7.274 16.834 ( 2.016 -0.700 2.037) 2.951 17.069 ( -0.894 4.773 7.614) 9.031 17.594 ( -0.792 4.441 -1.896) 4.893 19.772 ( 0.412 0.524 8.615) 8.640 20.069 ( -6.833 -2.807 13.751) 15.609 20.577 ( 2.107 -1.432 -3.225) 4.110 21.219 ( -5.692 1.144 -2.536) 6.336 22.332 ( 0.829 -0.590 -3.935) 4.064 22.729 ( 13.101 -6.217 -1.067) 14.541 22.949 ( 4.133 -2.498 4.532) 6.623 23.480 ( -7.891 8.271 -3.804) 12.048 24.205 ( -1.307 0.998 1.237) 2.058 24.563 ( 2.317 -0.812 2.303) 3.366 24.669 ( -0.839 -1.285 -0.263) 1.557 25.690 ( 0.686 -3.236 -13.624) 14.020 ======================= Grid point 167 (84/186) ======================= q-point: (-0.50 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.043 ( -20.132 -0.000 -0.968) 20.155 3.358 ( -7.018 -0.000 20.346) 21.522 3.630 ( -7.701 -0.000 15.706) 17.492 3.792 ( 9.339 0.000 8.622) 12.710 4.307 ( -2.584 -0.000 15.695) 15.906 4.545 ( -13.906 -0.000 2.703) 14.166 5.067 ( -0.286 -0.000 -5.175) 5.183 5.089 ( 5.449 0.000 -8.344) 9.966 5.431 ( 4.583 0.000 -2.942) 5.446 5.581 ( 6.114 0.000 -11.222) 12.780 5.978 ( -10.750 -0.000 2.487) 11.034 6.063 ( -3.313 -0.000 0.127) 3.316 6.199 ( -0.162 -0.000 1.370) 1.379 6.606 ( -14.359 -0.000 -2.531) 14.580 6.991 ( 15.331 0.000 19.550) 24.844 7.289 ( 7.642 0.000 -10.127) 12.687 7.567 ( 0.603 0.000 -5.922) 5.952 7.609 ( 14.959 0.000 24.603) 28.794 7.700 ( 3.862 0.000 -3.680) 5.335 8.282 ( 5.886 0.000 -5.628) 8.144 8.428 ( 7.790 0.000 -7.420) 10.758 8.454 ( -9.312 -0.000 -9.461) 13.275 8.624 ( -6.067 -0.000 -6.622) 8.981 9.085 ( 1.035 0.000 -6.247) 6.332 9.209 ( 10.427 0.000 -12.370) 16.178 9.946 ( -2.059 -0.000 11.257) 11.444 10.065 ( -2.109 -0.000 -3.424) 4.022 10.066 ( 0.195 0.000 -1.327) 1.341 10.513 ( -3.311 -0.000 -2.676) 4.257 10.674 ( 3.887 0.000 -4.257) 5.764 10.915 ( -14.076 -0.000 -0.850) 14.102 11.163 ( 2.468 0.000 -5.235) 5.788 11.513 ( 0.635 0.000 -9.907) 9.927 11.901 ( -6.073 -0.000 6.244) 8.710 11.948 ( 3.198 0.000 -10.452) 10.931 12.415 ( 8.676 0.000 -4.934) 9.980 12.527 ( -4.340 -0.000 14.589) 15.221 12.682 ( 4.162 0.000 -15.513) 16.062 13.078 ( -5.518 -0.000 7.577) 9.373 13.112 ( 1.854 0.000 -8.733) 8.927 13.904 ( -5.748 -0.000 -5.919) 8.251 13.925 ( 0.383 0.000 4.373) 4.389 14.447 ( 15.217 0.000 7.383) 16.914 14.755 ( -7.944 -0.000 13.604) 15.754 15.980 ( -2.677 -0.000 5.565) 6.175 16.672 ( 0.627 0.000 1.345) 1.484 17.021 ( 4.390 0.000 11.555) 12.361 17.823 ( -0.153 -0.000 -0.449) 0.474 19.735 ( -1.362 -0.000 6.633) 6.771 19.973 ( -0.411 -0.000 12.556) 12.563 20.715 ( -8.933 -0.000 -4.838) 10.159 21.680 ( -6.808 -0.000 -8.017) 10.517 22.117 ( 1.472 0.000 0.279) 1.499 22.389 ( 0.042 0.000 -3.987) 3.987 22.815 ( 6.551 0.000 4.874) 8.165 23.815 ( 4.864 0.000 -3.621) 6.064 24.299 ( 5.280 0.000 5.638) 7.724 24.360 ( 1.103 0.000 3.785) 3.942 24.455 ( -2.140 -0.000 -1.132) 2.421 25.871 ( -5.574 -0.000 -14.175) 15.231 ======================= Grid point 168 (85/186) ======================= q-point: (-0.38 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.824 ( -20.740 -7.842 1.193) 22.205 3.252 ( -16.878 -1.291 19.011) 25.455 3.546 ( -1.563 9.037 16.676) 19.032 3.867 ( -6.795 16.475 4.993) 18.507 3.955 ( 4.476 15.336 10.718) 19.238 4.704 ( -3.781 -20.906 6.401) 22.189 4.970 ( -5.525 -0.189 -1.928) 5.855 5.251 ( 2.911 -6.908 -8.446) 11.293 5.528 ( 1.632 -6.733 -5.930) 9.119 5.629 ( 3.546 -0.124 -8.318) 9.043 5.834 ( -7.001 -3.813 9.362) 12.297 6.033 ( -7.627 -0.393 1.569) 7.796 6.185 ( -5.143 -3.852 0.764) 6.471 6.475 ( -0.784 0.497 -3.861) 3.971 7.229 ( 17.284 7.027 5.163) 19.359 7.408 ( 9.953 -2.695 -0.240) 10.315 7.511 ( 8.927 9.878 2.258) 13.504 7.627 ( -0.798 9.963 3.113) 10.469 7.850 ( 8.405 4.745 0.032) 9.652 8.184 ( 1.504 5.679 -0.738) 5.921 8.412 ( 5.267 -0.817 -13.601) 14.608 8.498 ( -4.554 2.882 0.926) 5.468 8.572 ( 1.211 -4.045 -8.917) 9.866 9.208 ( 2.631 -11.685 -4.871) 12.930 9.336 ( 5.390 -7.312 -13.257) 16.071 9.814 ( -8.036 4.037 1.986) 9.210 9.920 ( -0.339 9.390 1.221) 9.475 10.187 ( -1.990 -5.736 0.917) 6.140 10.475 ( -1.725 1.548 -4.262) 4.851 10.700 ( 1.344 -1.563 -3.404) 3.979 10.763 ( -6.254 2.269 5.926) 8.910 11.220 ( 3.942 -3.598 -5.153) 7.419 11.449 ( -2.210 3.676 -10.170) 11.037 11.853 ( -6.501 -5.425 2.146) 8.735 11.982 ( 1.783 -3.147 -11.288) 11.854 12.422 ( 5.607 7.442 -5.594) 10.869 12.561 ( -0.889 -2.250 3.112) 3.942 12.696 ( 1.739 -1.021 -8.618) 8.851 13.006 ( 0.394 3.385 5.475) 6.449 13.217 ( 4.941 -5.518 0.186) 7.410 13.776 ( -5.648 3.100 -4.561) 7.894 13.951 ( -4.220 -3.159 2.861) 5.998 14.630 ( 6.943 -1.654 10.977) 13.093 14.689 ( -7.125 -0.650 11.713) 13.726 15.984 ( 1.869 0.624 3.743) 4.230 16.706 ( 1.940 -1.961 1.288) 3.044 17.109 ( 4.962 0.686 13.109) 14.033 17.792 ( -2.354 1.827 -0.800) 3.085 19.749 ( 0.437 -0.117 8.485) 8.497 19.997 ( -1.994 -0.986 13.231) 13.416 20.597 ( -6.185 0.258 -5.843) 8.512 21.481 ( -15.472 1.690 -9.097) 18.027 22.206 ( 9.437 -0.678 1.197) 9.537 22.430 ( 5.528 -1.477 -4.032) 7.000 22.892 ( 3.658 0.272 5.346) 6.484 23.833 ( 2.438 3.762 -4.622) 6.439 24.323 ( 1.080 4.260 4.680) 6.420 24.418 ( 4.585 -1.622 2.490) 5.464 24.481 ( 0.290 -5.469 1.893) 5.794 25.739 ( -8.192 0.131 -15.881) 17.870 ======================= Grid point 169 (86/186) ======================= q-point: (-0.25 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.739 ( -17.794 -14.716 2.901) 23.273 3.079 ( -19.087 -2.261 15.593) 24.750 3.395 ( -8.913 20.663 17.047) 28.232 3.447 ( 3.069 14.215 16.135) 21.721 4.030 ( 9.531 3.993 10.739) 14.903 4.748 ( -13.911 1.598 -3.267) 14.378 5.044 ( -4.770 -21.927 0.399) 22.444 5.335 ( 0.421 -4.376 1.756) 4.734 5.547 ( -2.715 -3.646 -4.020) 6.068 5.661 ( 4.861 0.869 -5.573) 7.446 5.864 ( -11.153 0.407 -0.348) 11.166 6.051 ( 2.370 -14.856 0.984) 15.076 6.187 ( -0.820 -4.319 3.336) 5.518 6.542 ( 8.416 -0.896 -2.777) 8.907 7.207 ( 5.610 13.101 -14.896) 20.615 7.400 ( 8.098 18.559 11.571) 23.322 7.442 ( -4.140 6.377 -1.508) 7.751 7.711 ( 9.956 9.086 -1.416) 13.553 7.752 ( 9.132 -0.909 3.809) 9.936 8.170 ( -2.262 7.303 -3.354) 8.348 8.438 ( 6.107 -1.840 -9.406) 11.365 8.448 ( -0.948 -0.290 -1.021) 1.423 8.652 ( 6.244 -3.004 -5.593) 8.905 9.282 ( -9.132 -4.735 -8.940) 13.628 9.426 ( -1.724 -4.025 -7.797) 8.942 9.753 ( 3.400 1.439 0.065) 3.692 9.859 ( 3.018 -2.704 -0.579) 4.093 10.150 ( -6.041 4.425 3.096) 8.103 10.398 ( -2.610 1.468 -4.565) 5.459 10.728 ( 0.131 -2.249 2.891) 3.666 10.780 ( 0.328 -6.368 0.574) 6.402 11.255 ( 3.030 6.969 -8.760) 11.597 11.380 ( -0.894 -3.185 -2.532) 4.165 11.908 ( -2.432 -9.201 -4.109) 10.366 12.021 ( 0.195 -5.196 -7.142) 8.834 12.369 ( 6.024 7.353 -12.103) 15.389 12.533 ( -2.443 3.614 0.386) 4.379 12.708 ( 2.586 -0.455 -6.692) 7.189 13.061 ( 3.721 -3.308 11.853) 12.856 13.313 ( 4.167 2.643 -0.088) 4.935 13.668 ( -6.265 -0.741 -4.401) 7.692 13.925 ( -5.511 -2.037 4.135) 7.185 14.646 ( -5.601 -1.633 11.959) 13.306 14.733 ( -1.230 -3.344 11.825) 12.351 16.018 ( 5.027 2.358 2.796) 6.217 16.775 ( 2.770 -2.765 0.766) 3.988 17.182 ( 4.361 2.963 13.324) 14.329 17.711 ( -3.656 3.364 -1.254) 5.124 19.789 ( 2.315 0.581 10.955) 11.213 20.010 ( -3.853 -1.382 13.252) 13.870 20.536 ( -1.563 -1.349 -5.140) 5.539 21.246 ( -13.318 0.792 -7.332) 15.224 22.323 ( 5.913 -0.143 -0.960) 5.992 22.574 ( 12.594 -4.014 -2.686) 13.488 22.931 ( 0.973 0.171 5.373) 5.463 23.727 ( -3.814 8.693 -6.365) 11.429 24.278 ( -0.020 3.917 2.628) 4.717 24.505 ( 1.924 -3.116 3.945) 5.383 24.592 ( 4.409 -4.066 1.557) 6.196 25.602 ( -8.167 -2.722 -16.347) 18.475 ======================= Grid point 170 (87/186) ======================= q-point: (-0.12 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.754 ( -13.023 -13.448 4.680) 19.296 2.957 ( -5.723 -0.736 16.984) 17.937 3.149 ( -11.559 1.956 23.511) 26.271 3.391 ( 6.538 9.855 19.556) 22.855 4.129 ( 10.377 3.990 10.438) 15.250 4.498 ( -19.771 -2.219 -4.377) 20.371 5.272 ( 3.292 -10.369 -3.314) 11.372 5.377 ( -4.067 -2.645 5.916) 7.651 5.557 ( -2.774 -2.872 -3.210) 5.123 5.730 ( -0.076 -6.626 -0.456) 6.642 5.735 ( -3.205 1.819 -1.686) 4.052 6.089 ( -2.824 0.723 -1.190) 3.149 6.403 ( 8.369 -4.681 0.604) 9.608 6.641 ( 3.203 -3.551 -4.901) 6.848 7.032 ( 3.991 10.137 -15.994) 19.352 7.255 ( -1.491 8.447 3.000) 9.087 7.355 ( 1.440 6.135 2.585) 6.811 7.593 ( 3.222 9.071 -6.977) 11.889 7.905 ( -1.282 5.516 -3.097) 6.454 8.077 ( 12.653 3.348 9.462) 16.150 8.381 ( -5.958 -0.915 -5.733) 8.319 8.544 ( 4.808 3.115 -10.648) 12.092 8.737 ( 2.252 -2.966 -1.533) 4.027 9.155 ( -8.489 -3.829 -3.064) 9.804 9.427 ( -0.498 -1.590 -6.868) 7.067 9.876 ( 5.080 -6.406 -2.621) 8.586 9.913 ( 1.765 2.951 -5.934) 6.858 10.027 ( 0.597 4.298 8.710) 9.731 10.344 ( -4.490 -2.202 -5.310) 7.294 10.770 ( 2.462 0.775 -3.746) 4.550 10.885 ( -0.296 -8.672 -4.775) 9.904 11.134 ( -4.385 5.611 3.981) 8.159 11.473 ( 7.586 -4.647 -2.742) 9.309 11.926 ( -3.680 -3.076 -14.744) 15.505 12.126 ( 3.477 -3.572 -2.304) 5.491 12.326 ( -0.841 1.286 -10.404) 10.516 12.442 ( 3.011 5.334 -1.546) 6.317 12.762 ( 5.554 -0.647 -2.026) 5.948 13.200 ( 1.788 -5.175 13.832) 14.876 13.257 ( 2.972 8.818 -0.818) 9.341 13.581 ( -9.130 -1.219 -4.023) 10.051 13.914 ( -0.989 -0.961 3.994) 4.226 14.644 ( -4.882 -3.536 9.528) 11.275 14.760 ( -5.912 -3.101 13.624) 15.171 16.060 ( 6.117 3.127 3.117) 7.544 16.847 ( 2.515 -1.860 0.890) 3.253 17.171 ( -0.483 7.665 10.620) 13.106 17.629 ( -0.802 2.402 -0.687) 2.624 19.838 ( 3.286 2.111 12.266) 12.872 19.996 ( -5.609 -0.888 12.170) 13.430 20.579 ( 4.527 -3.386 -2.516) 6.188 21.106 ( -7.830 -3.062 -4.000) 9.310 22.370 ( 4.737 1.698 -2.571) 5.650 22.807 ( 10.525 -4.239 -1.999) 11.522 22.956 ( 0.800 -2.439 3.700) 4.503 23.468 ( -11.406 10.172 -7.056) 16.833 24.233 ( 0.016 3.191 2.025) 3.779 24.556 ( -1.360 -1.581 4.227) 4.713 24.683 ( 4.028 -0.095 -1.245) 4.217 25.557 ( -3.528 -7.991 -14.459) 16.893 ======================= Grid point 176 (88/186) ======================= q-point: (-0.38 -0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.461 ( -25.005 -0.000 4.841) 25.469 2.994 ( -25.651 -0.000 20.883) 33.077 3.671 ( 1.728 0.000 19.080) 19.159 3.949 ( -4.649 -0.000 4.541) 6.499 4.270 ( -7.102 -0.000 6.897) 9.899 4.316 ( 3.831 0.000 3.404) 5.125 4.805 ( -20.222 -0.000 -3.724) 20.563 5.245 ( 8.322 0.000 -7.332) 11.091 5.529 ( 3.133 0.000 -2.844) 4.232 5.722 ( -3.136 -0.000 15.373) 15.689 5.725 ( 11.691 0.000 -10.322) 15.596 5.929 ( -11.764 -0.000 0.153) 11.765 6.034 ( -9.582 -0.000 0.540) 9.598 6.553 ( 12.500 0.000 -2.471) 12.742 7.411 ( 7.703 0.000 -18.839) 20.353 7.567 ( 0.036 0.000 -2.954) 2.954 7.636 ( 8.776 0.000 6.164) 10.724 7.792 ( 17.385 0.000 9.460) 19.792 8.100 ( 9.458 0.000 17.323) 19.737 8.174 ( -2.686 -0.000 -20.233) 20.411 8.270 ( -16.233 -0.000 5.052) 17.001 8.517 ( 8.052 0.000 -5.982) 10.031 8.596 ( 2.987 0.000 -9.148) 9.624 9.164 ( 1.655 0.000 -3.796) 4.141 9.286 ( 2.963 0.000 -15.969) 16.241 9.715 ( -9.900 -0.000 2.293) 10.162 9.951 ( -1.990 -0.000 -6.386) 6.689 10.152 ( -0.390 -0.000 6.209) 6.222 10.496 ( 4.953 0.000 -2.760) 5.670 10.683 ( -0.035 -0.000 0.679) 0.680 10.827 ( 3.053 0.000 6.455) 7.141 11.160 ( -1.442 -0.000 -1.441) 2.039 11.435 ( -1.518 -0.000 -14.274) 14.355 11.706 ( -6.882 -0.000 -1.181) 6.982 11.938 ( -0.937 -0.000 -11.541) 11.579 12.513 ( -2.303 -0.000 8.280) 8.594 12.522 ( 4.043 0.000 -31.132) 31.393 12.719 ( 2.898 0.000 9.219) 9.663 13.116 ( 5.161 0.000 12.984) 13.972 13.250 ( 9.583 0.000 -0.958) 9.630 13.676 ( -9.998 -0.000 -5.270) 11.302 13.878 ( -5.126 -0.000 1.295) 5.287 14.621 ( -6.508 -0.000 9.990) 11.923 14.692 ( -0.738 -0.000 16.459) 16.475 16.067 ( 8.057 0.000 -0.068) 8.057 16.726 ( 2.905 0.000 1.438) 3.242 17.225 ( 6.510 0.000 15.450) 16.765 17.760 ( -4.312 -0.000 -0.720) 4.372 19.798 ( 3.414 0.000 12.151) 12.622 19.991 ( -2.923 -0.000 12.959) 13.285 20.514 ( -3.784 -0.000 -6.386) 7.423 21.259 ( -16.090 -0.000 -9.115) 18.493 22.321 ( 8.701 0.000 0.958) 8.754 22.518 ( 10.264 0.000 -3.835) 10.957 22.935 ( 0.633 0.000 5.235) 5.273 23.879 ( 1.339 0.000 -7.362) 7.483 24.392 ( -1.927 -0.000 -0.646) 2.032 24.411 ( 1.454 0.000 7.373) 7.516 24.503 ( 6.909 0.000 3.025) 7.542 25.560 ( -12.311 -0.000 -17.464) 21.367 ======================= Grid point 177 (89/186) ======================= q-point: (-0.25 -0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.245 ( -24.750 -13.854 8.728) 29.676 2.735 ( -27.163 -6.026 21.479) 35.149 3.634 ( -10.647 19.649 14.043) 26.394 3.691 ( 1.502 8.727 15.652) 17.983 4.158 ( -11.965 -5.585 5.536) 14.317 4.459 ( -8.845 -0.592 0.971) 8.917 4.738 ( 4.456 -16.489 3.327) 17.402 5.312 ( 4.171 2.015 -1.905) 5.009 5.549 ( 1.664 0.871 -2.893) 3.449 5.736 ( -10.561 2.105 -2.361) 11.025 5.784 ( 3.994 -1.523 -0.814) 4.351 5.917 ( 9.070 -5.908 -6.075) 12.413 6.037 ( -0.606 -12.539 5.746) 13.806 6.717 ( 14.017 3.688 -1.008) 14.529 7.396 ( 4.739 8.768 -20.378) 22.685 7.409 ( -9.168 4.651 -1.252) 10.356 7.724 ( 5.223 1.866 -4.632) 7.226 7.842 ( -4.786 19.212 -1.660) 19.868 8.002 ( 0.445 2.465 4.276) 4.956 8.238 ( 7.371 2.669 3.453) 8.566 8.285 ( 4.414 -7.786 5.428) 10.468 8.563 ( 5.224 3.107 -11.031) 12.595 8.639 ( 2.677 -4.937 -9.940) 11.417 9.102 ( -10.306 -0.812 -10.882) 15.009 9.353 ( 4.079 -3.304 -3.121) 6.108 9.647 ( -5.984 -6.632 2.440) 9.260 9.942 ( 4.496 0.328 -4.226) 6.179 10.137 ( -3.451 0.975 4.358) 5.644 10.521 ( 7.394 10.881 -0.272) 13.158 10.730 ( 2.544 -2.230 6.755) 7.555 10.769 ( 1.242 5.135 0.462) 5.303 11.270 ( -2.276 -8.051 -4.970) 9.731 11.345 ( 2.874 2.478 -9.495) 10.225 11.714 ( -3.157 -10.337 -1.121) 10.866 11.906 ( -3.385 -4.698 -11.402) 12.788 12.422 ( -0.911 4.193 -20.130) 20.583 12.523 ( -0.833 -1.500 -10.959) 11.092 12.789 ( 4.819 1.297 12.067) 13.059 13.189 ( 8.762 5.359 14.146) 17.481 13.418 ( 8.908 -0.170 1.026) 8.969 13.529 ( -9.804 -1.443 -4.026) 10.697 13.823 ( -5.976 -3.338 1.661) 7.044 14.572 ( -5.659 -1.079 8.172) 9.998 14.702 ( -5.177 -1.170 19.536) 20.244 16.161 ( 9.099 2.912 -1.158) 9.623 16.786 ( 3.695 -1.716 0.851) 4.162 17.336 ( 6.859 3.477 15.422) 17.233 17.683 ( -5.164 1.109 -0.768) 5.337 19.892 ( 5.926 1.238 16.876) 17.929 19.985 ( -2.662 0.104 12.451) 12.733 20.489 ( 0.526 -2.428 -5.122) 5.692 21.046 ( -13.398 -1.060 -8.032) 15.657 22.419 ( 7.050 1.383 0.348) 7.193 22.681 ( 12.629 -3.135 -3.467) 13.466 22.938 ( -2.039 -0.036 4.852) 5.263 23.777 ( -5.250 9.284 -11.454) 15.650 24.338 ( -0.292 3.715 1.393) 3.978 24.480 ( 0.767 -3.548 5.895) 6.923 24.623 ( 6.493 -3.223 1.694) 7.444 25.368 ( -13.291 -4.241 -17.194) 22.142 ======================= Grid point 178 (90/186) ======================= q-point: (-0.12 -0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.243 ( -20.563 -23.111 11.946) 33.162 2.605 ( -23.102 -16.061 20.671) 34.913 3.313 ( -8.435 10.777 19.446) 23.778 3.635 ( 1.723 8.528 16.548) 18.696 3.992 ( -26.594 -8.762 10.497) 29.903 4.491 ( 16.061 5.051 3.602) 17.217 5.075 ( 5.538 -18.165 0.927) 19.013 5.285 ( -3.483 2.271 2.938) 5.091 5.497 ( -5.642 1.444 -0.862) 5.887 5.640 ( -2.666 -0.557 -3.734) 4.622 5.843 ( 2.343 -3.642 -3.116) 5.335 6.053 ( 8.172 -0.423 -6.881) 10.692 6.338 ( 6.826 -16.001 0.685) 17.410 6.739 ( 5.738 9.066 -4.194) 11.520 7.233 ( 4.796 13.485 -21.847) 26.118 7.292 ( -2.633 2.710 5.672) 6.815 7.468 ( -14.149 11.706 -3.755) 18.743 7.763 ( 8.520 9.422 5.606) 13.885 7.869 ( -7.204 0.509 -15.757) 17.333 8.249 ( -1.013 -0.069 -0.859) 1.330 8.421 ( 8.498 8.681 2.352) 12.374 8.546 ( -10.369 3.890 -16.078) 19.524 8.715 ( 12.897 -4.376 0.721) 13.639 8.967 ( -9.229 -6.269 -6.605) 12.966 9.429 ( 4.499 0.107 0.786) 4.568 9.725 ( -3.946 -9.644 -2.023) 10.614 10.025 ( 6.579 -1.563 -1.575) 6.943 10.104 ( 0.016 -0.769 7.618) 7.656 10.393 ( 2.828 14.201 6.092) 15.710 10.788 ( 2.963 -3.686 1.027) 4.840 10.816 ( 3.957 0.551 -11.116) 11.812 11.152 ( -5.860 5.531 0.252) 8.062 11.487 ( 8.151 -6.736 -5.864) 12.092 11.778 ( -4.239 -5.694 -12.133) 14.057 12.022 ( 1.010 -14.653 1.558) 14.770 12.290 ( -3.244 3.414 -18.429) 19.021 12.484 ( -0.617 0.945 -14.607) 14.651 12.873 ( 6.604 1.312 10.128) 12.162 13.240 ( 2.170 4.118 7.640) 8.947 13.378 ( -6.704 -0.688 2.162) 7.078 13.498 ( 4.643 6.777 1.566) 8.363 13.880 ( 2.242 -6.703 2.594) 7.529 14.539 ( -6.054 -2.309 5.154) 8.279 14.703 ( -5.140 -2.015 21.873) 22.560 16.217 ( 7.987 4.462 0.205) 9.151 16.861 ( 3.518 -1.616 0.548) 3.910 17.316 ( -1.224 10.442 10.152) 14.615 17.639 ( 0.240 -0.194 1.008) 1.054 19.938 ( -3.807 0.161 12.881) 13.432 20.009 ( 6.888 5.590 16.155) 18.431 20.591 ( 7.046 -5.034 -0.371) 8.667 20.935 ( -6.355 -5.692 -4.877) 9.827 22.474 ( 6.357 2.680 -0.199) 6.902 22.869 ( 5.787 -1.663 -2.667) 6.586 22.923 ( -1.020 -2.497 1.136) 2.927 23.434 ( -15.314 12.756 -11.856) 23.191 24.294 ( 0.926 3.658 1.706) 4.141 24.529 ( -1.311 -1.057 4.872) 5.155 24.739 ( 5.044 -0.634 -0.350) 5.095 25.307 ( -6.604 -12.936 -14.831) 20.759 ======================= Grid point 185 (91/186) ======================= q-point: (-0.25 -0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.833 ( -25.509 -0.000 15.790) 30.000 2.363 ( -30.357 -0.000 23.209) 38.213 3.531 ( -40.777 -0.000 18.413) 44.741 3.772 ( -8.083 -0.000 10.967) 13.624 3.815 ( -3.548 -0.000 16.397) 16.776 4.663 ( 6.488 0.000 6.227) 8.993 4.671 ( 18.394 0.000 -1.619) 18.465 5.438 ( 8.421 0.000 -8.615) 12.048 5.568 ( 0.803 0.000 -3.446) 3.538 5.614 ( -8.217 -0.000 -1.927) 8.439 5.688 ( -7.471 -0.000 -0.980) 7.535 5.970 ( 3.926 0.000 13.325) 13.892 6.099 ( 19.047 0.000 -11.789) 22.400 6.941 ( 13.307 0.000 -1.226) 13.363 7.239 ( -17.035 -0.000 -0.139) 17.035 7.498 ( 1.841 0.000 -12.328) 12.465 7.696 ( -16.006 -0.000 -10.117) 18.935 7.765 ( 1.297 0.000 -12.204) 12.273 8.027 ( 0.851 0.000 -16.398) 16.420 8.320 ( 1.518 0.000 4.884) 5.115 8.510 ( -6.943 -0.000 -8.463) 10.946 8.517 ( 14.880 0.000 10.601) 18.270 8.683 ( 14.369 0.000 -8.313) 16.601 8.904 ( -13.819 -0.000 -11.707) 18.111 9.433 ( 6.721 0.000 4.146) 7.897 9.508 ( -4.846 -0.000 0.321) 4.856 9.981 ( 4.213 0.000 -2.007) 4.666 10.105 ( -4.331 -0.000 5.314) 6.855 10.736 ( 10.967 0.000 -0.880) 11.002 10.770 ( 3.762 0.000 8.304) 9.117 10.933 ( 3.341 0.000 -1.819) 3.805 11.112 ( -1.077 -0.000 1.970) 2.245 11.354 ( 0.647 0.000 -7.514) 7.542 11.605 ( -0.167 -0.000 -3.046) 3.051 11.763 ( -7.299 -0.000 -13.176) 15.062 12.374 ( -0.708 -0.000 -38.107) 38.113 12.461 ( -3.863 -0.000 1.830) 4.274 12.888 ( 4.085 0.000 15.623) 16.148 13.367 ( -10.808 -0.000 -2.272) 11.045 13.450 ( 13.999 0.000 11.832) 18.330 13.534 ( 7.923 0.000 1.537) 8.071 13.710 ( -4.475 -0.000 1.681) 4.780 14.513 ( -5.178 -0.000 6.941) 8.660 14.669 ( -6.209 -0.000 23.106) 23.925 16.294 ( 8.273 0.000 -2.484) 8.638 16.831 ( 4.695 0.000 0.475) 4.719 17.517 ( 9.423 0.000 13.728) 16.651 17.603 ( -7.140 -0.000 -0.936) 7.202 19.937 ( -4.033 -0.000 12.498) 13.133 20.141 ( 16.900 0.000 25.806) 30.848 20.471 ( 2.609 0.000 -4.717) 5.390 20.851 ( -11.485 -0.000 -7.981) 13.986 22.524 ( 6.486 0.000 1.647) 6.692 22.806 ( 11.700 0.000 -4.664) 12.595 22.905 ( -4.495 -0.000 4.179) 6.138 23.726 ( -10.979 -0.000 -20.940) 23.643 24.375 ( 1.108 0.000 0.792) 1.362 24.469 ( 0.131 0.000 5.969) 5.970 24.675 ( 4.905 0.000 2.233) 5.389 25.098 ( -15.077 -0.000 -13.644) 20.334 ======================= Grid point 186 (92/186) ======================= q-point: (-0.12 -0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.716 ( -19.311 -18.574 21.668) 34.460 2.103 ( -29.845 -12.332 21.310) 38.690 3.093 ( -34.440 -4.856 34.147) 48.741 3.701 ( -6.181 0.273 12.373) 13.834 3.797 ( -3.679 2.852 15.960) 16.625 4.753 ( 12.165 2.194 3.484) 12.843 4.990 ( 12.713 -10.303 -2.696) 16.584 5.383 ( 0.971 9.404 -2.007) 9.665 5.474 ( -2.203 5.551 -2.241) 6.379 5.586 ( -3.864 -0.713 -2.352) 4.579 5.714 ( 1.069 -8.958 -1.984) 9.237 6.159 ( 5.377 -9.442 2.930) 11.254 6.271 ( 10.486 0.425 -9.409) 14.095 6.917 ( 1.268 7.490 -4.783) 8.977 7.119 ( -16.947 -5.537 -1.532) 17.894 7.380 ( -4.858 3.406 -0.679) 5.972 7.512 ( 6.811 14.440 -12.895) 20.523 7.757 ( -0.522 -2.012 -21.145) 21.247 7.969 ( 0.293 2.356 -6.954) 7.348 8.250 ( -3.876 9.603 -0.629) 10.375 8.306 ( -13.151 1.300 -20.716) 24.573 8.656 ( 1.199 -6.855 -6.131) 9.274 8.724 ( -4.429 4.800 -3.564) 7.440 8.949 ( 18.373 0.751 10.276) 21.065 9.459 ( -3.560 -6.743 -0.716) 7.659 9.566 ( 2.201 -2.057 0.915) 3.149 10.057 ( 3.185 -1.749 1.893) 4.097 10.076 ( -1.229 -2.407 6.154) 6.721 10.723 ( 2.233 18.209 19.450) 26.737 10.838 ( 5.992 1.531 -3.303) 7.011 10.872 ( 7.796 2.013 -11.584) 14.108 11.137 ( -5.126 2.448 -0.753) 5.731 11.459 ( 6.234 -9.318 -4.669) 12.145 11.606 ( -5.784 -5.949 -11.123) 13.877 11.800 ( 1.570 -15.726 0.256) 15.806 12.242 ( -1.911 2.944 -31.120) 31.317 12.414 ( -4.413 -1.322 -8.268) 9.465 12.980 ( 4.186 -0.127 15.139) 15.708 13.234 ( -8.795 -0.370 -3.161) 9.353 13.379 ( -4.333 11.051 4.580) 12.723 13.715 ( 9.947 2.896 2.065) 10.564 13.824 ( 9.423 -9.442 6.624) 14.894 14.463 ( -5.373 0.104 5.900) 7.981 14.679 ( -2.544 -1.896 25.329) 25.527 16.366 ( 6.803 2.651 -1.135) 7.389 16.901 ( 4.847 -0.545 0.056) 4.877 17.435 ( -6.354 8.915 2.425) 11.213 17.660 ( 3.985 -0.643 3.446) 5.308 19.906 ( -4.839 0.127 10.492) 11.555 20.334 ( 13.904 13.521 17.681) 26.245 20.625 ( 5.897 -3.005 3.203) 7.353 20.797 ( 8.073 -11.433 3.368) 14.395 22.592 ( 5.733 2.000 1.972) 6.384 22.846 ( -6.112 -0.219 3.401) 6.998 22.912 ( 0.186 1.192 -12.673) 12.731 23.341 ( -19.761 10.462 -18.060) 28.742 24.367 ( 2.449 3.501 1.221) 4.444 24.511 ( -1.117 -1.666 4.785) 5.189 24.784 ( 5.704 -3.337 0.490) 6.626 24.981 ( -8.371 -12.704 -9.317) 17.840 ======================= Grid point 194 (93/186) ======================= q-point: (-0.12 -0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.426 ( -11.964 -0.000 32.966) 35.070 1.665 ( -29.190 -0.000 25.623) 38.841 2.747 ( -25.158 -0.000 54.860) 60.354 3.644 ( -6.525 -0.000 11.409) 13.143 3.804 ( -4.594 -0.000 12.773) 13.574 4.882 ( 5.253 0.000 3.060) 6.079 5.046 ( 5.458 0.000 -10.825) 12.123 5.495 ( -5.168 0.000 -1.736) 5.452 5.495 ( 11.395 0.000 2.664) 11.703 5.521 ( -2.992 -0.000 -3.504) 4.608 5.755 ( 12.503 0.000 -7.332) 14.494 6.107 ( 0.189 0.000 7.885) 7.888 6.335 ( -5.277 -0.000 -13.204) 14.220 6.820 ( -15.349 -0.000 2.258) 15.514 6.960 ( -0.002 -0.000 -7.509) 7.509 7.432 ( 6.917 0.000 -5.673) 8.946 7.615 ( -4.879 -0.000 -19.486) 20.087 7.764 ( 10.833 0.000 -5.387) 12.099 7.799 ( -14.399 -0.000 -15.069) 20.842 8.117 ( -10.288 -0.000 -15.315) 18.450 8.400 ( -1.486 -0.000 6.813) 6.973 8.440 ( 1.030 0.000 -17.121) 17.152 8.845 ( 7.435 0.000 -4.088) 8.485 9.202 ( 12.488 0.000 11.615) 17.055 9.275 ( -9.229 -0.000 -4.600) 10.312 9.608 ( 0.847 0.000 1.810) 1.998 10.025 ( -4.872 -0.000 6.876) 8.427 10.121 ( 6.339 0.000 4.648) 7.860 10.875 ( 3.511 0.000 -7.002) 7.833 10.975 ( 5.259 0.000 12.132) 13.223 11.021 ( 1.811 0.000 11.141) 11.288 11.068 ( -3.117 -0.000 -9.167) 9.682 11.414 ( 5.170 0.000 -0.176) 5.173 11.423 ( -6.889 -0.000 -8.633) 11.045 11.752 ( 7.223 0.000 -0.602) 7.248 12.165 ( 0.420 0.000 -38.446) 38.448 12.307 ( -7.962 -0.000 -4.044) 8.930 13.067 ( 3.536 0.000 16.691) 17.062 13.129 ( -6.023 -0.000 -1.739) 6.269 13.353 ( -12.302 -0.000 -2.197) 12.497 13.818 ( 7.032 0.000 4.063) 8.122 13.951 ( 11.013 0.000 3.822) 11.657 14.425 ( -3.527 -0.000 7.755) 8.520 14.739 ( 4.893 0.000 25.864) 26.323 16.460 ( 5.543 0.000 -0.352) 5.554 16.966 ( 5.330 0.000 -0.535) 5.357 17.404 ( -7.067 -0.000 -1.178) 7.164 17.679 ( -4.281 -0.000 -4.247) 6.030 19.869 ( -4.761 -0.000 9.063) 10.237 20.588 ( -1.475 -0.000 -2.929) 3.279 20.605 ( 4.218 0.000 -4.749) 6.352 21.177 ( 51.124 0.000 36.156) 62.617 22.670 ( -40.151 -0.000 -35.202) 53.397 22.674 ( 3.151 0.000 2.419) 3.972 22.769 ( -5.742 -0.000 3.265) 6.606 23.199 ( -1.032 -0.000 -3.687) 3.829 24.462 ( -2.504 -0.000 3.388) 4.213 24.472 ( 5.349 0.000 -0.468) 5.370 24.766 ( 1.342 0.000 0.703) 1.515 24.845 ( 1.725 0.000 2.325) 2.895 ======================= Grid point 195 (94/186) ======================= q-point: ( 0.00 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.299 ( 10.193 0.000 35.828) 37.250 2.364 ( 8.847 0.000 36.818) 37.866 3.731 ( -5.079 -0.000 8.966) 10.304 3.866 ( -4.362 -0.000 13.619) 14.300 4.026 ( 3.453 0.000 40.611) 40.758 4.671 ( -3.132 -0.000 -16.116) 16.418 4.815 ( -7.271 -0.000 0.221) 7.275 5.142 ( -8.956 -0.000 -4.745) 10.135 5.547 ( -13.665 -0.000 -16.526) 21.444 5.664 ( 3.472 0.000 5.772) 6.735 5.837 ( 8.356 0.000 -7.182) 11.019 6.088 ( 12.108 0.000 2.524) 12.369 6.201 ( -7.243 -0.000 14.553) 16.256 6.471 ( -11.640 -0.000 6.975) 13.570 7.048 ( -0.472 -0.000 -13.390) 13.398 7.051 ( 3.712 0.000 1.818) 4.133 7.293 ( 11.726 0.000 -16.246) 20.036 7.564 ( 4.853 0.000 -13.426) 14.276 7.766 ( 16.813 0.000 -1.356) 16.867 7.962 ( -4.298 -0.000 -8.149) 9.213 8.195 ( 9.734 0.000 -19.272) 21.591 8.599 ( 5.122 0.000 7.265) 8.889 8.843 ( -14.147 -0.000 -3.819) 14.654 9.008 ( 7.448 0.000 0.946) 7.507 9.490 ( -8.961 -0.000 8.756) 12.529 9.571 ( -0.941 -0.000 -0.473) 1.053 9.890 ( -3.617 -0.000 -2.235) 4.252 10.454 ( -11.482 -0.000 -10.338) 15.450 10.519 ( 4.631 0.000 -1.761) 4.954 10.732 ( -6.588 -0.000 0.487) 6.606 11.034 ( 5.831 0.000 -7.117) 9.201 11.103 ( 2.958 0.000 -25.345) 25.517 11.413 ( 5.117 0.000 -5.227) 7.315 11.699 ( 3.281 0.000 -4.409) 5.496 11.872 ( 9.100 0.000 9.664) 13.274 11.970 ( -7.117 -0.000 6.638) 9.732 12.147 ( 14.595 0.000 20.273) 24.980 12.924 ( -12.597 -0.000 -5.212) 13.633 12.975 ( -1.769 -0.000 -4.817) 5.131 13.548 ( 1.925 0.000 13.542) 13.679 13.870 ( -6.017 -0.000 -10.845) 12.402 13.940 ( -2.348 -0.000 4.709) 5.262 14.819 ( 8.495 0.000 13.573) 16.012 15.240 ( -1.101 -0.000 6.674) 6.764 16.608 ( -1.408 -0.000 1.466) 2.033 16.997 ( -1.086 -0.000 -3.212) 3.390 17.022 ( -22.331 -0.000 1.248) 22.366 17.270 ( 2.682 0.000 -2.314) 3.542 19.941 ( -5.197 -0.000 7.990) 9.531 20.436 ( 3.581 0.000 -4.069) 5.420 20.912 ( 14.427 0.000 2.107) 14.580 21.004 ( -34.767 -0.000 -0.971) 34.781 22.519 ( -10.411 -0.000 -0.930) 10.453 22.663 ( 28.148 0.000 -4.304) 28.475 22.949 ( 2.350 0.000 7.275) 7.645 23.294 ( 1.999 0.000 0.184) 2.008 24.375 ( -5.727 -0.000 -0.632) 5.762 24.473 ( 0.944 0.000 -3.777) 3.893 24.753 ( -4.251 -0.000 1.613) 4.547 25.190 ( 18.030 0.000 -6.371) 19.123 ======================= Grid point 196 (95/186) ======================= q-point: ( 0.12 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.537 ( 16.560 0.954 33.842) 37.689 2.688 ( 12.586 -8.425 32.420) 35.784 3.700 ( -4.170 0.304 8.367) 9.353 3.841 ( -3.857 -2.425 10.775) 11.699 4.229 ( 6.982 -1.273 29.938) 30.767 4.660 ( 0.594 -6.874 -15.135) 16.633 4.701 ( -8.590 -0.055 1.762) 8.769 5.095 ( -4.442 -6.679 -2.157) 8.306 5.335 ( -10.433 0.919 -11.329) 15.428 5.706 ( 1.375 1.521 3.116) 3.730 5.872 ( -0.507 -1.914 -2.780) 3.413 6.182 ( -6.819 -3.129 12.566) 14.636 6.288 ( 12.262 -5.566 -1.642) 13.566 6.403 ( -2.895 -2.136 6.370) 7.316 6.973 ( 1.967 5.208 -5.819) 8.053 7.099 ( 0.616 -1.890 -0.201) 1.998 7.414 ( 13.214 1.410 -12.778) 18.436 7.610 ( 8.579 2.268 -8.979) 12.624 7.843 ( -1.247 4.460 -11.109) 12.035 8.037 ( 6.065 4.296 -5.320) 9.140 8.113 ( 9.480 8.005 -13.759) 18.528 8.615 ( -0.878 2.681 2.339) 3.664 8.801 ( -3.076 -10.750 -7.895) 13.688 9.080 ( 3.798 2.641 3.216) 5.634 9.341 ( -9.672 1.285 4.930) 10.932 9.573 ( 0.302 0.358 -3.173) 3.208 9.884 ( -0.780 -2.224 6.210) 6.642 10.263 ( -13.054 -2.472 -13.272) 18.779 10.501 ( -3.905 6.933 -6.171) 10.070 10.639 ( -2.471 -1.447 -0.776) 2.967 11.042 ( 5.444 4.015 -12.865) 14.535 11.206 ( 6.221 -8.215 -14.834) 18.062 11.455 ( 7.644 3.239 -1.780) 8.491 11.621 ( -6.664 5.594 -2.327) 9.006 11.875 ( 3.233 2.661 0.394) 4.206 12.134 ( 6.889 -10.709 11.463) 17.133 12.448 ( 14.343 -3.603 19.366) 24.367 12.670 ( -11.484 7.509 -4.024) 14.299 12.990 ( -2.595 -4.207 -2.612) 5.591 13.593 ( -1.975 -1.287 2.648) 3.545 13.721 ( -3.238 5.225 -1.959) 6.452 13.945 ( -5.288 -4.138 3.089) 7.391 14.948 ( 7.005 1.177 14.012) 15.710 15.180 ( -7.521 2.237 0.914) 7.900 16.441 ( -17.428 3.690 4.577) 18.393 16.869 ( -1.742 0.021 5.588) 5.853 16.973 ( -4.819 -3.224 -0.742) 5.846 17.352 ( 6.049 -2.424 -2.329) 6.920 19.906 ( -3.001 -0.204 7.572) 8.147 20.491 ( 6.369 1.268 -1.799) 6.739 20.607 ( -22.443 1.501 4.464) 22.932 21.120 ( 11.898 -1.630 3.110) 12.405 22.372 ( -9.625 1.182 -3.228) 10.221 22.866 ( 14.409 8.341 -3.189) 16.952 23.023 ( 5.529 -2.023 3.713) 6.960 23.300 ( -3.549 -1.714 -0.985) 4.062 24.293 ( -5.354 0.927 -0.327) 5.443 24.476 ( 1.379 -0.555 -3.123) 3.459 24.708 ( -5.823 -1.908 0.683) 6.165 25.405 ( 15.929 -0.326 -10.681) 19.182 ======================= Grid point 197 (96/186) ======================= q-point: ( 0.25 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.856 ( 17.037 -2.714 30.913) 35.401 3.034 ( 12.473 -6.561 27.514) 30.913 3.637 ( -5.287 1.701 8.438) 10.102 3.885 ( -0.973 -1.805 12.120) 12.292 4.311 ( 1.535 4.558 15.011) 15.763 4.605 ( -5.583 0.394 -0.930) 5.674 4.785 ( 3.864 -7.559 -15.294) 17.492 5.177 ( -1.375 -12.245 2.148) 12.508 5.273 ( -2.920 -8.107 -3.547) 9.318 5.654 ( -3.559 4.149 0.387) 5.480 5.904 ( -4.762 -8.215 -5.024) 10.743 6.136 ( -5.176 0.360 4.994) 7.201 6.440 ( 0.322 -0.182 9.819) 9.825 6.573 ( 12.058 -11.457 0.342) 16.637 6.927 ( 3.846 5.811 -3.780) 7.928 7.166 ( 2.242 -5.424 3.095) 6.635 7.478 ( 10.809 9.408 -9.793) 17.356 7.548 ( -5.455 17.616 -0.274) 18.443 7.730 ( 2.484 7.317 -11.664) 13.991 7.869 ( 0.976 -5.154 -9.651) 10.985 8.251 ( 6.596 2.949 -2.637) 7.691 8.548 ( -0.436 2.536 -8.693) 9.066 8.854 ( 1.928 4.412 -2.138) 5.268 9.119 ( -0.238 -9.627 -0.918) 9.674 9.279 ( -4.230 -2.486 -0.673) 4.952 9.547 ( 2.383 3.223 -6.976) 8.045 9.906 ( -4.844 -1.461 2.746) 5.757 10.165 ( -4.549 -3.435 -0.942) 5.778 10.310 ( -5.960 4.311 -9.227) 11.800 10.650 ( 0.618 -1.142 -3.679) 3.901 11.042 ( 7.212 4.328 -6.527) 10.647 11.292 ( -2.662 -2.919 -19.545) 19.940 11.482 ( -1.249 1.806 6.653) 7.006 11.551 ( 10.653 0.626 -2.974) 11.079 11.867 ( 0.616 1.936 -4.336) 4.788 12.326 ( -8.422 9.349 -11.010) 16.719 12.419 ( 6.009 -9.280 10.595) 15.313 12.755 ( 8.598 -3.142 22.610) 24.393 13.011 ( 0.251 -3.056 -0.208) 3.073 13.460 ( -8.129 4.026 -16.869) 19.153 13.726 ( 1.429 -0.611 14.853) 14.934 13.930 ( -5.625 -3.263 2.255) 6.882 14.972 ( -10.516 3.004 1.836) 11.090 15.062 ( 1.304 1.287 9.457) 9.633 16.231 ( -9.417 2.317 9.983) 13.918 16.882 ( 0.674 0.127 0.846) 1.089 16.986 ( -4.001 -6.492 4.182) 8.697 17.459 ( 6.143 -1.969 -1.992) 6.752 19.911 ( -0.419 -1.115 8.083) 8.170 20.355 ( -15.442 0.093 7.939) 17.364 20.582 ( 9.626 2.229 -1.716) 10.029 21.255 ( 6.649 2.195 3.938) 8.034 22.246 ( -4.892 0.453 -5.578) 7.433 22.877 ( 5.049 5.791 -0.628) 7.708 23.112 ( 5.818 2.541 1.084) 6.440 23.251 ( -7.372 -3.476 -2.644) 8.568 24.226 ( -3.160 0.268 0.989) 3.322 24.516 ( 2.310 -2.437 -2.426) 4.143 24.652 ( -6.654 -1.638 0.469) 6.868 25.530 ( 10.177 2.928 -12.368) 16.283 ======================= Grid point 198 (97/186) ======================= q-point: ( 0.38 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.150 ( 8.135 -0.243 25.385) 26.658 3.284 ( 5.238 -3.617 21.284) 22.216 3.622 ( 3.906 -0.653 13.295) 13.872 3.854 ( -2.913 10.124 17.996) 20.853 4.276 ( -5.121 -0.162 6.197) 8.041 4.484 ( -2.793 4.397 0.247) 5.215 4.957 ( 8.865 -9.782 -14.642) 19.715 5.391 ( -3.238 -13.595 -1.863) 14.099 5.417 ( 5.879 -8.772 4.155) 11.348 5.541 ( -1.980 0.223 -1.222) 2.337 5.913 ( -5.877 -4.582 -9.371) 11.973 6.107 ( -3.812 -3.814 -0.647) 5.431 6.394 ( -3.162 7.973 8.938) 12.388 6.763 ( 3.795 5.019 -1.743) 6.529 6.935 ( 4.391 3.199 -0.012) 5.433 7.187 ( -11.393 5.755 -0.301) 12.768 7.310 ( 4.650 -1.525 4.882) 6.912 7.419 ( 4.541 4.676 -1.053) 6.603 7.672 ( 5.995 4.439 -8.080) 10.997 8.005 ( -0.126 -9.955 -10.796) 14.686 8.242 ( -0.587 0.816 3.614) 3.751 8.497 ( 4.068 4.494 -12.337) 13.746 8.738 ( -6.689 4.426 -7.214) 10.788 9.233 ( 1.022 -0.152 -4.594) 4.708 9.305 ( 2.074 -4.808 2.626) 5.858 9.563 ( 6.966 -1.709 -8.471) 11.099 9.853 ( -4.821 -3.717 -1.587) 6.291 10.096 ( -3.315 3.578 -3.966) 6.287 10.308 ( 2.696 -3.885 3.620) 5.955 10.663 ( 0.735 -0.565 -3.454) 3.576 11.050 ( 7.647 8.950 -4.054) 12.451 11.176 ( -9.641 -2.005 -4.099) 10.667 11.535 ( 6.005 -1.002 -5.657) 8.310 11.628 ( 3.541 4.098 -7.930) 9.603 11.842 ( 0.923 0.190 -8.420) 8.473 12.086 ( -4.644 2.967 -11.542) 12.790 12.637 ( 3.872 -5.215 9.122) 11.198 12.847 ( -0.561 1.451 13.630) 13.719 13.146 ( 9.542 -4.116 8.445) 13.390 13.258 ( -6.875 3.322 -16.669) 18.334 13.764 ( -3.972 -0.104 14.304) 14.845 13.924 ( -0.799 -2.651 1.483) 3.141 14.767 ( -13.365 0.949 -2.622) 13.653 15.101 ( 1.155 1.488 13.723) 13.852 16.174 ( -0.566 0.807 9.923) 9.972 16.887 ( 0.419 -0.180 -0.920) 1.027 17.054 ( -3.858 -8.138 5.562) 10.585 17.549 ( 4.934 -1.142 -1.791) 5.372 19.971 ( 2.231 -2.766 9.213) 9.875 20.214 ( -11.227 -1.441 8.143) 13.944 20.677 ( 12.106 4.269 0.670) 12.854 21.227 ( -2.007 6.525 1.639) 7.021 22.236 ( 3.871 -2.038 -5.053) 6.684 22.833 ( -2.910 2.485 -3.619) 5.267 23.077 ( -6.386 0.519 1.462) 6.572 23.243 ( 2.756 0.207 -2.119) 3.483 24.214 ( -0.992 -1.633 2.392) 3.061 24.564 ( -2.913 -2.203 -3.231) 4.876 24.612 ( -0.636 -2.791 2.116) 3.560 25.528 ( 5.254 7.125 -12.385) 15.224 ======================= Grid point 199 (98/186) ======================= q-point: (-0.50 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.058 ( -9.501 12.765 18.155) 24.142 3.477 ( 2.881 5.219 19.879) 20.754 3.572 ( -11.507 8.990 20.358) 25.053 3.799 ( 6.846 -1.965 14.794) 16.420 4.225 ( -8.253 -4.491 6.038) 11.169 4.534 ( 13.988 1.496 6.529) 15.509 5.145 ( 4.074 -7.939 -14.207) 16.777 5.348 ( -6.702 1.082 -1.212) 6.896 5.536 ( 0.853 -8.272 -1.061) 8.384 5.728 ( 0.659 4.888 5.105) 7.098 5.862 ( 5.148 -0.195 0.147) 5.154 6.078 ( -0.023 3.259 2.533) 4.128 6.291 ( -5.307 -6.001 -2.320) 8.340 6.668 ( 0.242 9.192 -2.649) 9.569 6.776 ( -0.137 8.102 -8.911) 12.044 7.178 ( -5.110 -7.843 0.695) 9.387 7.221 ( -5.040 3.274 -1.564) 6.211 7.622 ( 6.348 -7.786 3.934) 10.789 7.720 ( 9.993 1.501 -1.143) 10.170 7.996 ( -10.540 -4.364 -17.788) 21.132 8.172 ( -12.244 1.321 -4.517) 13.117 8.421 ( -2.520 2.303 -0.791) 3.505 8.712 ( 10.066 -2.505 -11.941) 15.817 9.196 ( 1.316 6.057 2.447) 6.663 9.379 ( 2.418 -1.853 2.344) 3.844 9.641 ( -4.977 -5.539 -6.623) 9.966 9.960 ( 14.924 1.015 -7.629) 16.792 10.076 ( 0.174 -10.245 1.731) 10.392 10.395 ( 3.617 -0.383 7.301) 8.157 10.643 ( -1.512 3.171 -2.388) 4.247 10.952 ( -0.004 6.263 -2.183) 6.632 11.142 ( -3.033 -1.922 3.693) 5.150 11.519 ( -0.362 6.478 -15.751) 17.035 11.585 ( 4.411 1.493 -13.120) 13.922 11.771 ( -0.513 4.469 -14.405) 15.091 12.125 ( 3.154 -6.977 -3.842) 8.567 12.643 ( -2.886 7.313 8.311) 11.440 12.858 ( -1.845 -2.531 -3.888) 4.993 13.164 ( 0.667 -0.898 -0.548) 1.246 13.354 ( 7.726 -5.331 8.708) 12.804 13.690 ( -8.068 2.424 9.127) 12.420 13.997 ( 5.736 -1.212 4.068) 7.136 14.606 ( -10.189 -0.631 -1.736) 10.355 15.116 ( -1.507 0.841 15.136) 15.235 16.223 ( 4.222 -0.713 7.731) 8.838 16.896 ( 1.542 0.263 -1.213) 1.980 17.130 ( -5.457 -9.497 4.459) 11.826 17.609 ( 3.128 -0.491 -2.092) 3.795 20.093 ( 4.596 -4.938 9.802) 11.899 20.132 ( -8.719 -2.182 8.355) 12.272 20.763 ( 9.057 5.962 3.025) 11.258 21.096 ( 0.879 6.822 -0.817) 6.927 22.350 ( 7.825 -3.377 -3.229) 9.114 22.696 ( -14.403 -1.222 -8.362) 16.700 22.994 ( -7.045 -0.599 3.361) 7.829 23.271 ( 6.142 3.920 -1.158) 7.378 24.250 ( 0.601 -2.663 2.798) 3.909 24.522 ( -5.937 -3.067 -1.164) 6.783 24.690 ( 3.371 -3.112 1.195) 4.741 25.416 ( 2.281 11.180 -11.807) 16.419 ======================= Grid point 200 (99/186) ======================= q-point: (-0.38 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.749 ( -10.213 18.758 23.096) 31.458 3.019 ( -21.862 22.930 18.237) 36.556 3.674 ( -1.201 -4.702 20.874) 21.431 3.917 ( 2.191 -1.294 11.881) 12.150 4.195 ( -6.862 0.375 16.777) 18.130 4.755 ( 17.514 0.836 0.313) 17.537 5.141 ( -6.373 -0.373 -6.477) 9.094 5.373 ( 3.672 -5.892 -1.138) 7.035 5.463 ( -8.067 13.926 10.925) 19.452 5.637 ( 2.625 -1.008 -0.085) 2.813 5.853 ( 0.357 7.172 -0.811) 7.226 6.098 ( 2.944 6.524 5.343) 8.932 6.402 ( 1.152 -13.871 -9.959) 17.115 6.615 ( 5.244 5.973 -3.986) 8.892 6.751 ( 8.615 -4.495 -13.214) 16.402 7.098 ( -13.573 -1.888 -2.285) 13.893 7.223 ( -6.974 -8.643 -2.290) 11.339 7.577 ( -2.478 7.854 -8.935) 12.151 7.817 ( -15.628 -2.500 -15.153) 21.911 7.934 ( 12.341 -4.667 6.628) 14.765 8.038 ( -1.750 -0.076 -8.396) 8.577 8.434 ( 0.815 -5.503 0.175) 5.566 8.762 ( -3.271 4.058 -11.129) 12.289 9.201 ( 4.930 -2.188 10.384) 11.701 9.448 ( 2.992 -2.381 1.610) 4.148 9.576 ( -7.193 0.305 -7.057) 10.082 10.043 ( 7.590 0.514 -9.553) 12.212 10.374 ( 7.024 -9.425 0.087) 11.754 10.430 ( 2.685 4.351 11.819) 12.878 10.576 ( 3.138 -1.951 -4.002) 5.447 10.949 ( 3.376 -2.738 5.477) 6.992 11.121 ( -3.418 0.506 2.576) 4.309 11.400 ( 0.868 4.252 -22.007) 22.431 11.529 ( -2.742 2.312 -15.065) 15.486 11.694 ( 6.576 7.667 -10.591) 14.635 12.213 ( -3.294 -4.955 -4.945) 7.737 12.473 ( 0.584 15.241 8.483) 17.453 12.861 ( -4.860 -8.299 -12.906) 16.095 13.247 ( 4.015 -1.389 12.413) 13.120 13.510 ( -3.732 -3.245 9.640) 10.835 13.582 ( 0.186 -0.320 1.076) 1.138 14.103 ( 9.804 2.915 3.492) 10.808 14.513 ( -6.462 -2.112 1.585) 6.980 15.123 ( -2.324 -0.251 16.055) 16.224 16.328 ( 5.895 -2.000 5.315) 8.185 16.914 ( 2.999 0.850 -1.583) 3.496 17.191 ( -7.610 -9.829 2.311) 12.643 17.630 ( 0.305 -0.023 -3.310) 3.324 20.082 ( -7.337 -2.281 8.850) 11.720 20.267 ( 5.893 -6.465 7.583) 11.577 20.695 ( -3.735 6.614 -1.012) 7.663 21.189 ( 22.007 2.149 6.438) 23.030 22.387 ( -19.552 -3.939 -13.890) 24.305 22.560 ( 2.134 -3.122 1.085) 3.934 22.918 ( -7.141 -0.297 3.547) 7.979 23.284 ( 6.763 6.001 -0.470) 9.053 24.309 ( 2.092 -2.281 1.538) 3.456 24.501 ( -5.827 -4.936 0.355) 7.645 24.778 ( 3.810 -2.221 1.198) 4.570 25.231 ( 1.488 14.271 -10.252) 17.634 ======================= Grid point 201 (100/186) ======================= q-point: (-0.25 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.397 ( -13.127 18.450 27.795) 35.851 2.533 ( -12.764 17.916 28.438) 35.953 3.734 ( -3.505 -1.225 24.242) 24.525 3.942 ( -2.624 1.286 9.846) 10.271 4.110 ( -6.639 5.253 22.310) 23.862 4.866 ( 4.740 4.245 -6.691) 9.233 5.030 ( -6.678 2.867 -5.398) 9.053 5.322 ( 0.541 0.457 5.834) 5.877 5.508 ( 5.899 -1.064 3.261) 6.824 5.645 ( 1.582 4.374 9.185) 10.295 5.774 ( 0.104 -0.349 -9.377) 9.384 6.027 ( -0.439 5.480 -0.693) 5.541 6.455 ( -1.694 7.404 4.279) 8.718 6.699 ( 10.729 -9.931 -15.780) 21.511 6.854 ( -19.180 0.321 -0.828) 19.200 6.957 ( 7.159 -5.732 -12.916) 15.841 7.213 ( -2.502 -3.102 -11.231) 11.917 7.529 ( -2.018 -4.205 -12.875) 13.694 7.680 ( 0.249 -0.698 -2.706) 2.805 7.953 ( -4.583 3.496 -9.556) 11.160 8.154 ( 11.265 -0.903 5.034) 12.372 8.532 ( -10.939 3.951 -5.439) 12.840 8.606 ( 4.812 -9.733 -1.062) 10.909 9.353 ( -1.331 -6.629 9.266) 11.470 9.414 ( -3.651 7.062 -7.362) 10.835 9.536 ( 1.860 -4.293 1.758) 4.999 10.084 ( 1.059 1.354 -9.195) 9.355 10.310 ( 2.065 5.744 5.423) 8.165 10.571 ( 4.410 -5.180 0.132) 6.804 10.741 ( 3.397 -5.265 -7.329) 9.642 11.065 ( -1.569 0.929 -1.879) 2.618 11.136 ( 5.218 -9.666 10.921) 15.489 11.313 ( 1.760 1.927 -24.489) 24.628 11.429 ( -0.646 2.088 -3.092) 3.787 11.663 ( 9.233 7.936 -9.508) 15.448 12.130 ( -6.319 4.251 -3.631) 8.437 12.324 ( 1.987 12.351 9.055) 15.443 12.896 ( -5.482 -9.945 -10.859) 15.713 13.287 ( -4.343 1.996 6.501) 8.069 13.446 ( -1.145 1.530 12.965) 13.105 13.712 ( 2.963 -7.878 -1.428) 8.538 14.140 ( 4.748 6.879 -0.524) 8.375 14.532 ( 2.188 -3.412 7.654) 8.661 15.149 ( -0.951 -1.167 15.436) 15.509 16.448 ( 5.849 -2.359 3.624) 7.274 16.944 ( 4.168 0.773 -2.364) 4.854 17.212 ( -9.636 -8.760 0.165) 13.024 17.584 ( -5.128 1.499 -5.540) 7.696 20.042 ( -6.812 -1.677 9.357) 11.695 20.428 ( 2.413 -4.194 0.211) 4.843 20.585 ( 1.979 2.664 -0.552) 3.364 21.596 ( 33.144 -4.751 10.981) 35.238 22.025 ( -34.472 -2.710 -14.956) 37.675 22.673 ( 2.368 -3.071 1.946) 4.339 22.846 ( -4.071 -0.116 4.521) 6.085 23.279 ( 6.066 6.353 -0.013) 8.784 24.374 ( 3.311 -1.922 -0.686) 3.889 24.494 ( -6.266 -4.233 1.062) 7.636 24.853 ( 2.620 -1.452 1.617) 3.404 25.035 ( 4.511 14.410 -7.441) 16.833 ======================= Grid point 202 (101/186) ======================= q-point: (-0.12 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.166 ( -4.717 4.729 35.552) 36.174 2.324 ( 0.874 13.398 35.282) 37.751 3.758 ( -4.123 -1.199 20.730) 21.170 3.881 ( -3.668 4.330 18.799) 19.637 4.015 ( -5.180 4.534 23.503) 24.491 4.782 ( -3.128 3.567 -13.208) 14.034 4.902 ( -5.444 1.654 -1.549) 5.897 5.294 ( -7.875 1.349 -2.758) 8.452 5.592 ( 2.746 -1.826 3.349) 4.700 5.658 ( 7.643 1.226 -0.321) 7.747 5.794 ( -5.234 -2.348 -13.445) 14.617 5.962 ( 7.212 3.957 4.311) 9.288 6.312 ( -4.476 7.783 8.262) 12.202 6.638 ( -16.570 -1.503 5.405) 17.494 6.937 ( 11.828 -2.694 -3.777) 12.705 7.032 ( -0.375 -7.825 -18.101) 19.723 7.219 ( 7.059 1.782 -17.304) 18.773 7.527 ( -0.335 -4.499 -8.329) 9.472 7.709 ( 5.221 8.543 -6.037) 11.691 7.929 ( 2.948 -8.643 -6.493) 11.205 8.168 ( -0.272 4.958 -9.624) 10.829 8.482 ( 3.796 -3.487 6.649) 8.413 8.820 ( 5.121 -9.305 -1.405) 10.714 9.145 ( -8.868 11.251 -4.518) 15.021 9.476 ( -3.270 -6.922 7.982) 11.060 9.598 ( -0.455 -1.244 1.582) 2.063 9.983 ( -4.889 3.101 -7.255) 9.282 10.378 ( 8.513 -0.539 6.488) 10.717 10.674 ( -11.000 -0.292 -11.797) 16.132 10.700 ( 2.813 -5.098 -1.919) 6.131 11.046 ( 4.364 5.313 -9.171) 11.462 11.172 ( -4.712 -1.486 -20.301) 20.894 11.336 ( 4.297 -3.336 -7.874) 9.570 11.583 ( 9.350 -6.227 19.277) 22.312 11.687 ( 10.822 2.173 -5.745) 12.444 12.003 ( 0.822 5.839 2.532) 6.418 12.180 ( -2.378 11.253 9.335) 14.813 12.932 ( -5.939 -9.074 -8.277) 13.642 13.148 ( -8.512 4.634 -1.215) 9.767 13.489 ( 2.573 0.893 15.360) 15.600 13.838 ( -0.384 -8.003 -2.781) 8.481 14.051 ( -1.618 7.214 -2.194) 7.712 14.668 ( 7.868 -1.704 11.518) 14.052 15.203 ( 0.659 -1.365 12.123) 12.217 16.555 ( 4.633 -1.675 2.863) 5.698 16.985 ( 3.568 0.085 -3.334) 4.884 17.191 ( -11.871 -8.339 -1.202) 14.557 17.408 ( -11.040 6.121 -5.869) 13.921 19.994 ( -6.470 -0.591 8.985) 11.088 20.427 ( -0.417 0.145 -4.965) 4.984 20.709 ( 11.370 -2.748 1.785) 11.833 21.522 ( -38.744 0.750 -9.717) 39.951 22.175 ( 35.302 -8.007 4.711) 36.504 22.646 ( -8.546 -0.608 0.179) 8.569 22.885 ( 4.124 -0.750 6.888) 8.064 23.274 ( 4.656 3.942 0.271) 6.106 24.436 ( 0.509 -1.147 -1.137) 1.694 24.454 ( -3.779 -1.739 -1.742) 4.509 24.827 ( -3.607 3.604 1.894) 5.439 25.014 ( 14.383 4.363 -4.243) 15.617 ======================= Grid point 204 (102/186) ======================= q-point: ( 0.12 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.853 ( 14.396 0.000 30.345) 33.587 2.915 ( 21.075 0.000 26.844) 34.128 3.707 ( -0.499 -0.000 7.851) 7.867 3.777 ( -4.831 -0.000 11.359) 12.344 4.431 ( 11.303 0.000 21.423) 24.222 4.575 ( 2.491 0.000 -16.642) 16.827 4.619 ( -4.730 -0.000 7.534) 8.896 5.011 ( -1.476 -0.000 -0.175) 1.486 5.195 ( -7.438 -0.000 -10.455) 12.831 5.745 ( 0.599 0.000 0.828) 1.022 5.771 ( -9.320 -0.000 -4.120) 10.190 6.142 ( -2.249 -0.000 11.805) 12.017 6.368 ( 7.789 0.000 -6.541) 10.171 6.401 ( 2.579 0.000 14.197) 14.429 7.022 ( -3.515 -0.000 -1.764) 3.933 7.066 ( 3.577 0.000 1.171) 3.764 7.571 ( 13.402 0.000 -11.269) 17.510 7.650 ( 2.180 0.000 -11.278) 11.487 7.934 ( 6.865 0.000 -10.842) 12.832 8.166 ( 9.057 0.000 -2.910) 9.513 8.337 ( 9.767 0.000 -26.495) 28.238 8.470 ( -8.352 -0.000 -7.899) 11.496 8.612 ( -9.046 -0.000 8.247) 12.241 9.182 ( -12.513 -0.000 3.837) 13.088 9.233 ( 6.044 0.000 4.320) 7.429 9.577 ( 1.643 0.000 -3.538) 3.901 9.920 ( 4.055 0.000 13.180) 13.789 10.037 ( -12.022 -0.000 -15.604) 19.698 10.466 ( -8.264 -0.000 -7.066) 10.873 10.586 ( 1.197 0.000 -8.643) 8.725 11.140 ( 7.095 0.000 -26.107) 27.054 11.149 ( -0.205 -0.000 0.276) 0.344 11.568 ( 7.918 0.000 -2.060) 8.182 11.620 ( 1.123 0.000 -3.273) 3.460 11.942 ( -1.021 -0.000 9.888) 9.941 12.122 ( 6.138 0.000 7.274) 9.517 12.543 ( -14.905 -0.000 -1.201) 14.953 12.716 ( 16.962 0.000 24.821) 30.063 12.936 ( 1.868 0.000 -9.266) 9.453 13.501 ( -8.563 -0.000 -12.678) 15.299 13.749 ( 1.275 0.000 6.663) 6.784 13.855 ( -6.135 -0.000 7.229) 9.481 15.027 ( -17.511 -0.000 -2.211) 17.650 15.070 ( 4.754 0.000 14.470) 15.231 16.265 ( -12.790 -0.000 9.856) 16.147 16.879 ( -5.071 -0.000 -2.270) 5.556 16.890 ( 1.597 0.000 7.531) 7.699 17.433 ( 8.271 0.000 -1.477) 8.402 19.896 ( -0.997 -0.000 7.501) 7.567 20.354 ( -17.659 -0.000 5.794) 18.585 20.616 ( 11.153 0.000 -1.424) 11.244 21.286 ( 10.518 0.000 6.201) 12.210 22.256 ( -6.873 -0.000 -5.545) 8.831 22.968 ( -4.008 -0.000 5.472) 6.783 23.146 ( 13.680 0.000 -7.464) 15.584 23.214 ( -8.049 -0.000 -2.640) 8.471 24.234 ( -4.237 -0.000 -0.046) 4.238 24.476 ( 0.857 0.000 -2.183) 2.345 24.620 ( -5.860 -0.000 0.675) 5.898 25.572 ( 13.234 0.000 -12.377) 18.120 ======================= Grid point 205 (103/186) ======================= q-point: ( 0.25 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.116 ( 14.715 -0.595 26.416) 30.244 3.239 ( 15.733 -0.490 21.413) 26.576 3.660 ( -0.948 3.749 9.031) 9.824 3.841 ( -1.008 -7.023 10.947) 13.045 4.464 ( 2.168 8.762 7.519) 11.748 4.627 ( 4.788 2.964 2.239) 6.060 4.712 ( 6.884 -6.692 -7.559) 12.220 5.025 ( -1.271 -6.035 1.772) 6.417 5.157 ( 0.184 -7.087 -2.682) 7.579 5.621 ( -10.772 0.327 -1.989) 10.959 5.740 ( -2.733 -1.567 -4.279) 5.314 6.119 ( -1.838 2.005 1.166) 2.960 6.467 ( 2.601 -3.454 -2.690) 5.093 6.571 ( 9.607 -6.900 19.867) 23.121 6.983 ( -2.017 -1.437 -3.509) 4.295 7.117 ( 2.392 -0.339 7.212) 7.605 7.605 ( -0.772 4.168 -7.028) 8.207 7.735 ( 8.098 -3.378 -10.537) 13.712 7.849 ( -4.775 17.581 -13.936) 22.937 7.978 ( 5.795 16.652 1.540) 17.699 8.330 ( 1.683 3.122 -13.062) 13.535 8.506 ( -1.322 -2.260 -9.881) 10.222 8.676 ( -3.800 -18.233 -9.032) 20.699 9.006 ( -11.485 -2.230 3.265) 12.147 9.321 ( 6.637 2.571 5.101) 8.756 9.595 ( 2.775 1.061 -1.645) 3.396 9.835 ( -5.640 3.044 -8.090) 10.321 10.084 ( 3.731 -6.994 6.072) 9.985 10.312 ( -3.098 6.387 -7.830) 10.569 10.607 ( 0.770 -3.232 -9.034) 9.626 11.099 ( -3.964 -0.263 -1.644) 4.299 11.214 ( 7.022 -4.659 -25.497) 26.854 11.570 ( 3.517 9.978 5.876) 12.102 11.683 ( 8.555 0.217 -7.520) 11.392 11.912 ( -0.269 3.988 4.874) 6.304 12.260 ( -12.388 -1.931 5.670) 13.760 12.360 ( 3.450 -4.038 2.675) 5.947 12.880 ( -0.037 0.063 10.942) 10.943 13.064 ( 16.142 -1.829 4.733) 16.921 13.331 ( -9.280 1.077 -18.837) 21.027 13.763 ( -3.311 1.076 11.953) 12.449 13.834 ( -1.636 -3.357 5.057) 6.287 14.763 ( -20.373 -0.659 -2.705) 20.562 15.142 ( 1.864 1.026 14.187) 14.345 16.188 ( -3.468 0.087 11.203) 11.727 16.827 ( -4.480 -2.315 -2.036) 5.438 16.937 ( 1.225 -1.113 7.526) 7.706 17.536 ( 7.471 -0.059 -1.253) 7.576 19.921 ( 1.049 -0.848 8.266) 8.375 20.181 ( -12.245 -0.713 6.062) 13.682 20.767 ( 13.882 1.771 -0.186) 13.996 21.365 ( 0.816 2.791 5.366) 6.103 22.202 ( 1.574 -0.536 -6.288) 6.504 22.891 ( -7.815 1.404 2.241) 8.250 23.072 ( -11.869 -0.421 -2.414) 12.120 23.278 ( 10.693 1.217 -5.826) 12.238 24.192 ( -2.221 -0.103 1.105) 2.483 24.500 ( 1.298 -2.091 -1.250) 2.761 24.553 ( -5.780 -0.791 0.925) 5.907 25.667 ( 8.670 2.614 -12.988) 15.833 ======================= Grid point 206 (104/186) ======================= q-point: ( 0.38 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.310 ( 1.659 6.378 19.911) 20.973 3.393 ( 8.924 -1.105 18.327) 20.414 3.725 ( 7.737 -1.345 11.723) 14.111 3.957 ( 0.250 -5.667 12.607) 13.824 4.264 ( -9.173 17.969 10.219) 22.615 4.628 ( 9.718 5.255 2.386) 11.302 4.887 ( 6.633 -8.328 -12.932) 16.751 5.168 ( 0.190 -12.941 -1.860) 13.075 5.377 ( 3.115 -8.554 4.265) 10.053 5.514 ( 0.473 -6.111 0.234) 6.134 5.731 ( -2.278 -4.919 -7.877) 9.562 6.074 ( -0.502 1.698 -0.044) 1.771 6.485 ( -0.398 3.796 2.731) 4.693 6.788 ( 1.492 -4.723 2.477) 5.538 6.969 ( 0.089 1.739 -0.327) 1.771 7.186 ( -4.717 6.142 14.308) 16.269 7.355 ( -3.566 6.331 3.646) 8.130 7.580 ( -0.831 12.243 -8.833) 15.120 7.808 ( 3.539 1.926 -6.784) 7.890 7.878 ( -0.967 0.831 -5.569) 5.713 8.232 ( -3.225 3.548 -11.283) 12.259 8.533 ( 0.107 0.891 -13.326) 13.356 8.651 ( -3.902 -1.596 -11.142) 11.913 9.101 ( -0.396 -14.463 -3.000) 14.776 9.365 ( 1.416 0.168 6.704) 6.854 9.591 ( 1.012 3.154 -0.074) 3.314 9.807 ( 5.787 -2.009 -0.336) 6.135 10.127 ( 0.845 4.756 -10.520) 11.576 10.298 ( 3.962 -4.529 3.995) 7.223 10.643 ( 1.324 -2.434 -5.916) 6.533 11.037 ( -6.183 -1.128 -3.934) 7.415 11.304 ( 11.274 5.214 -14.401) 19.018 11.502 ( -0.266 1.227 -0.489) 1.347 11.685 ( -2.807 3.653 -11.765) 12.635 11.864 ( 0.410 3.490 1.215) 3.718 12.096 ( 0.121 3.824 -1.944) 4.292 12.557 ( 0.354 -9.362 5.422) 10.824 12.885 ( -0.949 0.208 11.009) 11.052 13.128 ( -7.725 0.989 -16.849) 18.562 13.323 ( 13.868 0.218 6.215) 15.198 13.709 ( -7.904 -0.619 10.050) 12.801 13.912 ( 3.829 -3.552 5.606) 7.662 14.546 ( -15.640 -3.317 -2.590) 16.197 15.160 ( -1.153 1.893 13.972) 14.146 16.208 ( 1.235 -0.640 10.123) 10.219 16.817 ( -3.594 -4.505 -1.756) 6.025 16.984 ( 0.205 -1.423 7.428) 7.565 17.615 ( 5.679 0.677 -1.580) 5.933 19.990 ( 2.457 -2.472 9.585) 10.199 20.078 ( -8.295 -1.456 6.121) 10.412 20.914 ( 13.497 4.113 1.952) 14.244 21.266 ( -5.570 5.056 -0.215) 7.526 22.280 ( 8.538 -1.658 -4.107) 9.618 22.713 ( -14.920 2.414 -3.415) 15.495 22.950 ( -9.736 -2.639 1.457) 10.192 23.370 ( 9.295 2.482 -3.917) 10.387 24.190 ( -0.152 -1.240 2.244) 2.568 24.482 ( -5.098 -0.061 0.437) 5.117 24.572 ( 1.358 -4.578 0.361) 4.789 25.661 ( 4.857 6.071 -13.020) 15.165 ======================= Grid point 207 (105/186) ======================= q-point: (-0.50 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.172 ( -6.191 11.793 18.594) 22.872 3.577 ( 6.484 -1.516 17.380) 18.612 3.700 ( -12.366 19.263 7.169) 23.987 3.943 ( 2.595 7.793 17.729) 19.539 4.076 ( -4.329 -7.749 12.670) 15.470 4.780 ( 16.510 0.812 6.416) 17.731 5.018 ( 0.627 -7.404 -14.028) 15.875 5.256 ( -4.752 -3.081 -2.527) 6.202 5.442 ( 5.129 -8.802 -4.847) 11.281 5.747 ( -2.471 -5.410 -9.112) 10.881 5.897 ( 14.722 -10.438 10.964) 21.116 6.074 ( 1.491 -2.055 4.567) 5.225 6.350 ( -2.030 13.970 7.723) 16.091 6.775 ( 2.270 4.721 -9.804) 11.116 6.844 ( -5.939 12.441 -1.972) 13.927 6.966 ( -9.812 -5.164 3.206) 11.542 7.238 ( -9.774 9.457 3.111) 13.951 7.637 ( 8.417 -6.651 8.142) 13.467 7.773 ( -10.402 0.878 -19.060) 21.732 7.856 ( 7.096 0.125 0.778) 7.139 8.068 ( -6.364 4.028 -10.712) 13.095 8.408 ( -3.688 1.272 -9.484) 10.255 8.742 ( 7.382 -3.162 -10.299) 13.060 9.185 ( -4.636 -2.823 -4.543) 7.078 9.438 ( 3.326 -4.825 4.052) 7.125 9.541 ( -1.013 4.273 2.120) 4.876 9.981 ( 4.355 -6.705 3.827) 8.864 10.117 ( 11.630 -0.919 -11.041) 16.063 10.417 ( 3.209 -4.080 3.360) 6.184 10.657 ( -0.851 1.325 0.432) 1.633 10.949 ( -3.711 1.485 -6.628) 7.740 11.280 ( 7.157 11.123 5.961) 14.508 11.457 ( -9.938 -2.267 -21.467) 23.764 11.565 ( 1.935 1.974 -13.821) 14.095 11.845 ( 3.225 2.755 -0.327) 4.255 12.124 ( 4.910 -0.103 -4.605) 6.732 12.611 ( -4.590 -3.919 0.321) 6.044 12.849 ( -2.936 5.965 -4.672) 8.125 13.086 ( -0.977 -8.113 4.541) 9.348 13.462 ( 5.301 0.863 8.287) 9.875 13.634 ( -5.293 1.374 5.308) 7.621 14.067 ( 9.077 -4.462 5.156) 11.352 14.432 ( -9.754 -4.104 -0.746) 10.609 15.138 ( -3.381 1.461 13.679) 14.166 16.276 ( 2.717 -1.823 8.427) 9.040 16.847 ( -2.699 -5.912 -1.662) 6.708 17.017 ( -0.733 -1.356 6.974) 7.142 17.654 ( 3.349 1.528 -2.522) 4.462 20.014 ( -6.854 -2.450 6.818) 9.973 20.116 ( 4.579 -3.913 10.258) 11.896 20.909 ( -4.059 7.856 1.639) 8.993 21.239 ( 12.865 1.368 -2.216) 13.126 22.343 ( -9.692 0.229 -8.691) 13.020 22.512 ( -1.484 0.149 0.874) 1.728 22.880 ( -8.340 -2.816 2.866) 9.257 23.431 ( 8.227 3.939 -2.565) 9.475 24.233 ( 1.551 -2.644 2.927) 4.238 24.422 ( -4.614 -0.475 0.143) 4.640 24.665 ( 1.626 -5.303 1.524) 5.753 25.567 ( 2.635 9.286 -13.119) 16.288 ======================= Grid point 208 (106/186) ======================= q-point: (-0.38 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.940 ( -7.135 16.442 22.561) 28.814 3.143 ( -18.684 26.005 15.818) 35.715 3.706 ( 4.068 -0.513 15.002) 15.552 3.961 ( -1.033 1.264 12.790) 12.894 4.147 ( -3.934 -4.133 17.420) 18.331 4.973 ( 11.486 1.666 -4.321) 12.385 5.003 ( -6.501 -1.814 -8.584) 10.920 5.326 ( 4.299 -7.702 -1.763) 8.995 5.596 ( 3.374 0.716 5.657) 6.626 5.684 ( 2.110 7.466 0.179) 7.760 5.984 ( -1.834 9.118 4.677) 10.411 6.196 ( 0.909 -5.759 -1.001) 5.916 6.272 ( 5.669 2.550 9.670) 11.495 6.732 ( 1.494 1.147 -11.362) 11.517 6.780 ( 11.816 -1.833 -9.853) 15.494 6.852 ( -19.734 -2.513 5.148) 20.549 7.077 ( -3.306 0.367 0.088) 3.328 7.544 ( -9.453 2.456 -17.949) 20.434 7.657 ( -3.705 2.603 -7.673) 8.909 8.041 ( 9.551 -2.719 6.760) 12.013 8.050 ( 7.166 -3.730 -1.068) 8.149 8.371 ( -0.700 -3.012 -5.738) 6.518 8.714 ( -9.405 4.937 -9.505) 14.254 9.170 ( -0.090 -4.384 -1.416) 4.608 9.469 ( -3.393 1.298 -0.828) 3.726 9.539 ( 5.122 0.323 -2.062) 5.530 10.080 ( 3.960 -2.306 -5.910) 7.478 10.338 ( 5.356 -7.402 -1.074) 9.200 10.514 ( 1.212 -1.311 8.926) 9.103 10.602 ( 2.626 1.646 -0.951) 3.242 10.924 ( 1.443 -2.590 -2.591) 3.937 11.220 ( 1.649 8.168 -2.673) 8.751 11.319 ( -5.729 -3.121 -13.582) 15.068 11.533 ( 4.076 4.729 -13.492) 14.866 11.848 ( 4.856 4.063 -5.355) 8.292 12.134 ( -1.685 0.288 -4.208) 4.542 12.627 ( -1.963 -4.899 0.256) 5.283 12.693 ( -2.499 7.213 -8.841) 11.681 13.230 ( -0.998 -8.011 11.412) 13.979 13.477 ( -4.483 0.194 9.863) 10.835 13.592 ( 2.391 1.607 0.201) 2.888 14.241 ( 5.917 -0.744 -1.805) 6.231 14.415 ( 0.196 -4.555 7.175) 8.501 15.115 ( -3.738 -0.661 12.844) 13.393 16.365 ( 2.278 -3.400 6.616) 7.779 16.894 ( -2.852 -6.219 -1.800) 7.074 17.038 ( -0.950 -0.859 6.020) 6.155 17.642 ( 0.197 2.635 -4.011) 4.803 19.984 ( -5.603 -2.249 7.390) 9.543 20.272 ( 4.632 -5.596 9.480) 11.943 20.722 ( -6.189 6.223 -1.028) 8.836 21.472 ( 19.144 -3.110 -0.722) 19.408 22.045 ( -21.346 3.371 -6.995) 22.714 22.594 ( 3.515 -2.264 0.420) 4.202 22.829 ( -4.345 -1.447 4.555) 6.459 23.456 ( 6.376 5.500 -1.523) 8.557 24.311 ( 2.561 -3.312 2.799) 5.036 24.381 ( -3.735 -1.636 -0.468) 4.105 24.762 ( 1.182 -4.928 2.519) 5.659 25.419 ( 2.614 11.569 -13.186) 17.735 ======================= Grid point 209 (107/186) ======================= q-point: (-0.25 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.567 ( -11.811 21.672 25.045) 35.163 2.768 ( -3.076 16.828 29.745) 34.313 3.776 ( 1.306 1.033 14.023) 14.121 3.926 ( -5.565 0.895 9.894) 11.387 4.169 ( -2.949 1.411 21.702) 21.947 4.908 ( -7.659 -1.045 -6.293) 9.967 4.972 ( 1.259 6.969 -11.583) 13.576 5.416 ( -0.582 3.965 3.691) 5.448 5.555 ( 2.858 3.975 7.780) 9.192 5.706 ( 1.833 -0.088 -1.987) 2.705 5.827 ( 1.629 8.920 2.785) 9.485 6.191 ( 5.630 11.222 6.951) 14.351 6.430 ( 2.335 -11.925 -3.611) 12.676 6.613 ( -19.033 -1.463 6.126) 20.048 6.706 ( 5.246 2.435 -15.949) 16.965 6.961 ( 6.615 -0.430 -5.641) 8.704 7.098 ( 1.005 -8.368 -7.614) 11.358 7.463 ( 3.403 -1.752 -8.336) 9.173 7.646 ( 1.424 -7.126 -9.739) 12.151 8.023 ( 4.010 9.821 -6.408) 12.393 8.289 ( 7.130 -1.556 9.100) 11.665 8.407 ( -13.081 2.964 -5.026) 14.323 8.494 ( 2.576 -10.966 -3.325) 11.745 9.249 ( -1.197 -4.511 2.616) 5.350 9.420 ( -0.562 0.737 -8.064) 8.117 9.550 ( 1.252 1.941 -1.896) 2.989 10.083 ( -1.912 2.507 -8.421) 8.992 10.377 ( -0.732 -0.655 1.395) 1.707 10.550 ( -0.673 -2.101 10.109) 10.346 10.682 ( 0.302 -2.033 -10.012) 10.221 11.039 ( 5.496 -6.303 2.302) 8.674 11.100 ( -3.855 -0.132 -18.557) 18.954 11.353 ( 6.870 0.582 -0.564) 6.918 11.480 ( 3.597 3.668 -5.387) 7.444 11.831 ( 5.288 4.704 -9.257) 11.653 12.083 ( -1.722 1.964 1.111) 2.838 12.552 ( -0.175 8.597 -1.922) 8.811 12.674 ( -3.023 -5.985 -3.084) 7.380 13.241 ( -8.104 1.245 7.317) 10.989 13.502 ( 1.867 -2.782 13.008) 13.433 13.628 ( 0.925 -3.332 -3.250) 4.745 14.205 ( -4.032 2.918 -3.393) 6.024 14.593 ( 10.492 -3.340 10.439) 15.172 15.131 ( -2.411 -3.255 10.501) 11.255 16.456 ( 0.101 -5.101 4.949) 7.108 16.924 ( -5.512 -5.860 -1.534) 8.190 17.050 ( 0.533 0.419 4.416) 4.468 17.557 ( -3.661 4.831 -5.394) 8.114 19.963 ( -4.896 -1.516 8.153) 9.630 20.398 ( 0.719 -3.276 2.718) 4.317 20.635 ( 1.025 -0.391 3.110) 3.298 21.543 ( -22.424 0.263 -11.652) 25.273 21.968 ( 22.726 -3.745 6.747) 24.001 22.601 ( -6.681 -2.444 -1.932) 7.372 22.861 ( 4.263 -0.635 7.152) 8.350 23.435 ( 3.541 6.333 -0.884) 7.309 24.358 ( -5.053 -3.797 0.605) 6.350 24.400 ( 4.270 -1.347 -0.209) 4.482 24.831 ( -1.139 -3.071 2.898) 4.373 25.277 ( 6.546 11.099 -12.630) 18.043 ======================= Grid point 210 (108/186) ======================= q-point: (-0.12 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.356 ( 4.071 9.772 34.234) 35.833 2.646 ( 4.812 13.364 33.135) 36.051 3.758 ( -4.561 2.252 9.629) 10.890 3.879 ( -3.713 0.552 11.669) 12.258 4.160 ( 0.601 4.898 27.362) 27.803 4.796 ( -6.923 1.436 -7.655) 10.420 4.825 ( -1.840 7.393 -8.324) 11.283 5.284 ( -5.024 8.707 0.499) 10.065 5.488 ( -9.387 0.115 -7.094) 11.767 5.684 ( -0.827 0.849 3.358) 3.561 5.843 ( 7.893 2.238 0.440) 8.215 6.204 ( 13.712 8.117 3.743) 16.368 6.344 ( -11.608 4.607 8.158) 14.917 6.492 ( -6.319 2.754 2.569) 7.356 6.866 ( 5.251 -11.948 -16.868) 21.328 7.006 ( 5.808 -2.027 1.331) 6.294 7.252 ( 8.289 -6.535 -12.552) 16.400 7.536 ( 6.479 2.020 -7.829) 10.361 7.784 ( 0.018 -11.922 -9.524) 15.259 7.952 ( 11.215 8.224 -5.642) 15.008 8.090 ( -11.184 1.574 -7.713) 13.676 8.519 ( 5.519 -4.395 7.927) 10.612 8.723 ( 5.159 -12.342 -3.320) 13.783 9.192 ( -5.404 7.014 -1.038) 8.915 9.392 ( -0.449 0.754 -2.580) 2.726 9.558 ( -1.162 -3.233 -0.736) 3.514 9.964 ( -4.112 4.400 -2.878) 6.674 10.416 ( -2.511 -4.748 1.105) 5.483 10.511 ( -7.818 1.396 -8.415) 11.571 10.650 ( -1.176 -1.508 0.085) 1.914 11.018 ( -1.923 -2.121 -18.966) 19.181 11.230 ( 10.717 1.004 -1.367) 10.850 11.338 ( 4.019 2.064 -13.068) 13.827 11.585 ( -0.446 -7.413 8.369) 11.189 11.825 ( 5.857 2.700 -9.202) 11.237 12.081 ( 6.899 3.802 10.875) 13.429 12.435 ( 3.095 11.266 7.274) 13.763 12.691 ( -6.792 -7.361 -6.034) 11.693 13.110 ( -7.111 3.558 3.295) 8.607 13.584 ( 3.132 1.930 14.839) 15.288 13.683 ( -3.377 -8.285 -7.863) 11.911 14.080 ( -5.486 4.652 -1.316) 7.313 14.788 ( 9.358 -1.866 12.305) 15.571 15.180 ( -2.188 -4.097 6.001) 7.589 16.515 ( -6.347 -6.304 3.450) 9.588 16.903 ( -7.199 -3.499 0.917) 8.057 17.052 ( -0.357 1.859 1.987) 2.744 17.404 ( -2.850 6.735 -4.726) 8.708 19.936 ( -4.359 -0.368 8.144) 9.244 20.425 ( 1.927 -0.922 -2.390) 3.205 20.726 ( -3.341 -7.035 7.261) 10.648 21.178 ( -14.957 6.696 -5.720) 17.357 22.399 ( 13.284 -9.222 1.293) 16.223 22.545 ( 2.440 -3.221 -2.914) 4.982 22.954 ( 4.882 -0.511 7.424) 8.901 23.373 ( 0.152 5.210 -0.735) 5.264 24.339 ( -5.506 -2.874 0.143) 6.213 24.458 ( 3.207 -0.101 -2.387) 3.999 24.807 ( -5.059 1.303 1.480) 5.430 25.264 ( 13.629 5.038 -10.495) 17.924 ======================= Grid point 213 (109/186) ======================= q-point: ( 0.25 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.360 ( 13.981 0.000 22.569) 26.549 3.472 ( 10.618 0.000 13.992) 17.565 3.694 ( -4.400 -0.000 3.202) 5.441 3.791 ( 2.378 0.000 15.921) 16.098 4.645 ( 4.206 0.000 15.503) 16.063 4.649 ( 8.406 0.000 -12.226) 14.837 4.870 ( 12.869 0.000 9.038) 15.726 4.984 ( 0.202 0.000 -2.685) 2.693 5.045 ( -2.624 -0.000 -4.328) 5.061 5.445 ( -12.091 -0.000 -2.390) 12.325 5.717 ( -0.312 -0.000 -2.055) 2.079 6.126 ( 0.082 0.000 -3.350) 3.351 6.420 ( -0.774 -0.000 -6.335) 6.383 6.755 ( 12.273 0.000 28.182) 30.738 6.911 ( -1.633 -0.000 -6.389) 6.594 7.194 ( 3.782 0.000 12.085) 12.663 7.582 ( -7.176 -0.000 0.448) 7.190 7.738 ( 5.960 0.000 -19.171) 20.076 7.903 ( -11.894 -0.000 1.566) 11.996 8.152 ( -7.407 -0.000 -1.023) 7.477 8.332 ( -0.160 -0.000 -37.094) 37.095 8.366 ( 0.779 0.000 -9.441) 9.473 8.565 ( 12.106 0.000 1.608) 12.212 8.812 ( -13.361 -0.000 2.001) 13.510 9.370 ( -4.020 -0.000 4.993) 6.410 9.660 ( 5.227 0.000 3.470) 6.274 9.833 ( 5.067 0.000 -9.682) 10.928 10.104 ( 4.090 0.000 6.017) 7.275 10.338 ( 1.608 0.000 -6.518) 6.713 10.568 ( 1.287 0.000 -8.970) 9.062 11.022 ( -4.405 -0.000 -4.963) 6.636 11.197 ( 5.901 0.000 -22.516) 23.277 11.707 ( 1.539 0.000 -14.200) 14.283 11.759 ( 4.407 0.000 -3.242) 5.471 12.004 ( 2.698 0.000 16.029) 16.255 12.071 ( -11.310 -0.000 12.088) 16.555 12.388 ( 4.503 0.000 3.511) 5.710 12.869 ( -1.364 -0.000 1.884) 2.325 13.169 ( -8.735 -0.000 -19.927) 21.757 13.308 ( 17.176 0.000 6.362) 18.316 13.694 ( -9.016 -0.000 8.954) 12.707 13.853 ( 2.914 0.000 7.522) 8.066 14.484 ( -18.621 -0.000 -1.172) 18.658 15.192 ( -0.993 -0.000 13.893) 13.929 16.194 ( -0.242 -0.000 11.034) 11.037 16.752 ( -3.623 -0.000 -1.770) 4.032 16.968 ( 1.341 0.000 8.048) 8.159 17.628 ( 6.674 0.000 -1.170) 6.776 19.955 ( 1.383 0.000 9.178) 9.282 20.058 ( -7.721 -0.000 5.541) 9.504 20.972 ( 15.004 0.000 0.552) 15.015 21.344 ( -7.881 -0.000 1.100) 7.957 22.257 ( 9.009 0.000 -4.348) 10.004 22.784 ( -10.923 -0.000 2.749) 11.264 22.878 ( -14.918 -0.000 -3.641) 15.356 23.403 ( 9.413 0.000 -6.230) 11.288 24.179 ( -0.259 -0.000 2.202) 2.218 24.488 ( -4.298 -0.000 2.233) 4.844 24.493 ( 0.641 0.000 -0.680) 0.935 25.747 ( 5.530 0.000 -13.550) 14.635 ======================= Grid point 214 (110/186) ======================= q-point: ( 0.38 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.461 ( -2.307 9.777 11.793) 15.492 3.574 ( 10.966 0.660 17.799) 20.916 3.740 ( -2.169 -8.704 3.070) 9.481 3.898 ( 3.067 -1.995 15.728) 16.148 4.526 ( -3.385 20.962 16.597) 26.951 4.791 ( 8.888 -0.640 -13.263) 15.979 4.892 ( 4.237 1.351 6.891) 8.201 5.033 ( 3.042 -7.985 -3.153) 9.108 5.274 ( 2.747 -12.176 0.578) 12.496 5.348 ( -4.211 -9.453 -2.784) 10.716 5.744 ( 7.843 0.024 0.886) 7.893 6.109 ( 1.798 1.987 -2.389) 3.591 6.424 ( -4.663 -5.876 -3.637) 8.337 6.836 ( 3.715 4.366 0.515) 5.755 6.980 ( 0.736 -0.760 4.966) 5.077 7.298 ( 5.011 2.596 21.388) 22.120 7.378 ( -11.904 8.227 5.487) 15.476 7.646 ( -7.839 7.205 -0.671) 10.668 7.803 ( 2.611 0.556 -13.148) 13.416 7.939 ( -4.842 7.551 -1.664) 9.123 8.181 ( -4.338 2.440 -31.690) 32.079 8.404 ( -5.461 -1.250 -12.976) 14.134 8.678 ( 7.543 -1.592 -4.687) 9.023 8.877 ( 2.463 -14.977 1.962) 15.305 9.313 ( -6.560 -1.970 5.343) 8.687 9.715 ( 6.074 5.170 5.096) 9.465 9.911 ( 9.272 0.213 0.287) 9.278 10.159 ( 1.388 0.111 -5.922) 6.083 10.338 ( 5.225 2.029 -2.171) 6.011 10.603 ( 1.668 -4.139 -6.339) 7.752 10.969 ( -1.731 0.264 -5.766) 6.026 11.246 ( -0.345 -6.775 -23.162) 24.135 11.610 ( -8.518 0.953 -8.042) 11.753 11.693 ( 3.330 11.265 -3.417) 12.234 11.954 ( 1.332 5.265 9.338) 10.802 12.130 ( 1.749 -2.224 3.315) 4.358 12.486 ( 2.893 -3.041 3.180) 5.266 12.886 ( -0.156 -2.548 10.339) 10.650 13.007 ( -6.209 1.752 -19.236) 20.289 13.461 ( -0.077 -0.985 0.589) 1.150 13.650 ( 2.105 0.033 6.836) 7.153 13.934 ( 4.342 -3.549 5.625) 7.943 14.315 ( -10.211 -2.906 2.370) 10.878 15.183 ( -4.075 1.168 13.035) 13.707 16.228 ( -0.198 -1.213 10.362) 10.434 16.723 ( -2.515 -2.144 -1.230) 3.527 17.009 ( 1.714 -0.032 8.474) 8.645 17.695 ( 4.997 0.984 -1.664) 5.358 19.957 ( -5.582 -1.292 6.649) 8.777 20.052 ( 2.901 -0.937 9.584) 10.057 21.081 ( -3.269 3.561 2.276) 5.343 21.266 ( 6.796 0.518 -5.671) 8.867 22.358 ( 3.392 0.340 -5.178) 6.200 22.587 ( -9.428 5.042 0.882) 10.728 22.754 ( -10.627 -5.885 1.175) 12.204 23.497 ( 8.291 0.965 -5.199) 9.833 24.195 ( 1.641 -0.158 2.980) 3.406 24.440 ( -3.150 1.041 2.911) 4.414 24.525 ( 0.384 -3.714 0.243) 3.742 25.742 ( 2.438 3.156 -13.996) 14.553 ======================= Grid point 215 (111/186) ======================= q-point: (-0.50 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.305 ( -4.469 10.076 14.184) 17.964 3.672 ( -4.809 2.501 8.611) 10.175 3.766 ( 0.372 4.049 6.502) 7.669 3.982 ( -1.334 -3.227 18.750) 19.073 4.166 ( -6.601 18.876 16.766) 26.095 4.917 ( 5.228 -3.400 -14.104) 15.421 4.963 ( 4.912 -2.794 8.618) 10.305 5.151 ( -0.317 -5.106 -2.864) 5.863 5.389 ( 7.149 -8.857 -5.235) 12.529 5.558 ( 0.748 -13.904 -6.551) 15.389 5.971 ( 11.187 -7.206 8.441) 15.758 6.132 ( 5.502 0.599 5.340) 7.691 6.409 ( -7.198 -2.986 1.175) 7.881 6.823 ( 1.065 3.959 0.459) 4.125 6.850 ( -10.086 5.968 -4.169) 12.439 7.030 ( -1.034 18.307 2.882) 18.561 7.296 ( -3.628 12.664 9.992) 16.535 7.602 ( -4.669 -2.127 -1.221) 5.274 7.714 ( 0.984 1.930 -4.949) 5.403 7.904 ( 1.519 -0.464 -8.531) 8.678 8.054 ( 1.650 0.548 -9.031) 9.197 8.309 ( -2.322 -1.311 -15.357) 15.587 8.774 ( 1.204 -0.537 -4.538) 4.726 9.071 ( 1.745 -6.144 -3.410) 7.240 9.337 ( -0.829 -8.558 1.192) 8.680 9.694 ( 3.426 8.631 7.604) 12.002 10.014 ( 3.995 0.895 4.193) 5.860 10.184 ( 7.133 -3.411 -10.036) 12.776 10.407 ( 3.117 -2.776 0.571) 4.213 10.662 ( 1.517 -1.464 -0.830) 2.266 10.932 ( 0.368 1.586 -6.612) 6.810 11.172 ( -13.630 -4.967 -20.078) 24.770 11.501 ( -2.881 4.941 1.008) 5.808 11.617 ( 8.646 5.025 -15.097) 18.109 11.938 ( 2.917 4.019 6.576) 8.240 12.157 ( -0.113 -0.049 -4.547) 4.548 12.517 ( -0.802 -0.655 -3.616) 3.761 12.868 ( -2.087 3.890 -11.241) 12.077 12.987 ( -1.506 -6.823 14.569) 16.158 13.427 ( -7.013 -3.906 4.332) 9.122 13.686 ( 3.504 3.379 -1.176) 5.008 14.104 ( 5.947 -7.592 -0.491) 9.656 14.306 ( 0.976 -2.798 9.092) 9.563 15.127 ( -6.209 1.148 11.780) 13.366 16.269 ( -1.966 -3.026 9.683) 10.334 16.736 ( -1.772 -3.825 -0.586) 4.257 17.053 ( 2.708 0.783 8.257) 8.725 17.718 ( 2.835 2.395 -2.676) 4.575 19.926 ( -4.590 -1.745 6.451) 8.107 20.154 ( 4.099 -2.704 11.770) 12.753 20.887 ( -11.620 4.813 -2.152) 12.760 21.424 ( 14.435 -0.662 -5.309) 15.394 22.179 ( -14.671 5.751 -4.853) 16.488 22.543 ( -1.069 -1.764 -1.630) 2.629 22.756 ( -0.312 -3.443 6.095) 7.007 23.563 ( 6.782 2.161 -4.427) 8.382 24.242 ( 2.916 -1.009 3.266) 4.493 24.392 ( -2.162 1.603 2.429) 3.626 24.602 ( 0.422 -5.868 1.870) 6.173 25.660 ( 0.287 5.707 -14.551) 15.632 ======================= Grid point 216 (112/186) ======================= q-point: (-0.38 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.124 ( -5.637 13.613 17.267) 22.699 3.322 ( -12.244 22.640 14.379) 29.483 3.778 ( -0.262 -0.111 8.805) 8.810 3.980 ( -6.665 3.992 14.273) 16.250 4.080 ( -1.405 -4.712 20.405) 20.989 4.906 ( -1.592 0.800 -10.682) 10.830 5.064 ( 0.842 -0.242 -4.124) 4.216 5.253 ( 3.564 -8.173 -3.432) 9.554 5.598 ( 5.833 -6.425 -2.925) 9.157 5.765 ( 6.634 -11.791 -3.714) 14.030 6.048 ( 0.555 5.404 9.968) 11.352 6.225 ( -0.796 5.594 5.076) 7.595 6.388 ( -2.653 -5.526 9.458) 11.271 6.595 ( -13.674 2.653 5.788) 15.084 6.835 ( 5.722 8.270 -10.959) 14.874 6.852 ( 7.133 4.955 -3.070) 9.212 7.171 ( 5.159 8.626 5.196) 11.315 7.429 ( -4.921 2.030 -18.488) 19.239 7.650 ( -4.088 5.551 -5.011) 8.523 8.024 ( 4.602 -11.042 1.413) 12.046 8.164 ( 8.573 0.186 6.890) 11.000 8.314 ( 3.717 -3.718 -11.530) 12.672 8.627 ( -13.192 7.422 -5.667) 16.163 9.152 ( 6.374 -2.379 -7.479) 10.111 9.429 ( -0.472 -2.416 -4.862) 5.450 9.629 ( 1.101 5.580 3.805) 6.843 10.061 ( 0.091 -3.224 -0.423) 3.253 10.304 ( 1.424 -3.041 -0.986) 3.499 10.484 ( 0.308 -4.506 1.489) 4.755 10.679 ( 3.777 2.862 1.740) 5.049 10.930 ( 3.270 -1.800 -4.662) 5.972 11.020 ( -12.388 -5.397 -18.685) 23.059 11.420 ( 2.362 5.151 4.026) 6.951 11.635 ( 7.475 3.652 -20.640) 22.254 11.935 ( 2.369 3.714 0.155) 4.408 12.118 ( -2.606 0.067 0.370) 2.633 12.492 ( -1.581 -0.968 -14.424) 14.543 12.788 ( 0.128 4.320 3.446) 5.528 13.100 ( -2.921 -9.323 8.686) 13.073 13.418 ( -4.544 -2.156 6.776) 8.439 13.669 ( 2.409 2.713 -0.992) 3.761 14.191 ( -3.485 -3.747 -2.499) 5.695 14.488 ( 13.339 -3.732 9.953) 17.057 15.065 ( -6.464 -0.941 10.002) 11.946 16.306 ( -4.806 -4.989 9.115) 11.448 16.774 ( -1.309 -4.283 -0.289) 4.488 17.096 ( 3.798 1.958 7.390) 8.536 17.684 ( 0.176 4.143 -3.934) 5.716 19.917 ( -3.136 -1.608 7.421) 8.215 20.278 ( 2.620 -4.032 11.744) 12.690 20.690 ( -8.210 3.073 -2.445) 9.101 21.536 ( -2.058 -0.407 -10.971) 11.170 21.982 ( 3.023 3.718 2.854) 5.578 22.518 ( -7.002 -3.574 -3.609) 8.650 22.845 ( 5.605 -0.651 7.747) 9.584 23.582 ( 3.938 3.871 -3.901) 6.761 24.293 ( 0.031 -0.655 3.131) 3.199 24.375 ( 2.318 -0.112 1.203) 2.614 24.697 ( -0.020 -5.980 3.152) 6.759 25.533 ( -0.059 6.839 -15.059) 16.539 ======================= Grid point 217 (113/186) ======================= q-point: (-0.25 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.814 ( -5.473 20.330 22.351) 30.705 3.047 ( 0.691 15.502 26.340) 30.571 3.784 ( -5.953 -2.384 5.956) 8.752 3.887 ( -6.599 0.664 14.213) 15.684 4.169 ( -1.147 -2.723 19.980) 20.197 4.830 ( -2.684 2.887 -7.032) 8.062 4.995 ( -3.874 2.439 -12.042) 12.883 5.360 ( 0.178 -3.330 -6.242) 7.077 5.666 ( -1.549 -0.370 0.199) 1.605 5.854 ( -1.941 14.694 4.826) 15.588 6.004 ( 8.436 7.729 10.041) 15.222 6.233 ( 2.233 -15.202 -2.049) 15.502 6.363 ( -14.405 -2.962 6.151) 15.941 6.493 ( 7.751 8.630 8.368) 14.303 6.749 ( 1.137 4.371 -15.332) 15.983 6.979 ( 6.418 -8.776 -6.301) 12.566 7.124 ( 5.371 9.043 -0.968) 10.562 7.451 ( 2.122 -6.586 -5.749) 8.996 7.591 ( 7.400 0.595 -2.045) 7.700 8.170 ( -5.247 4.450 -5.328) 8.702 8.230 ( -2.871 -6.414 -1.621) 7.212 8.279 ( -2.664 3.083 -9.741) 10.558 8.504 ( 10.492 -2.816 7.979) 13.479 9.255 ( 7.188 -0.408 -6.969) 10.020 9.401 ( -0.748 0.246 -4.520) 4.588 9.563 ( -3.968 2.512 -4.076) 6.218 10.061 ( -2.668 0.659 -2.835) 3.948 10.292 ( -6.668 -2.432 2.134) 7.412 10.518 ( -3.665 -2.106 -2.139) 4.738 10.676 ( 0.286 2.659 -3.253) 4.211 10.930 ( -4.472 -4.931 -15.053) 16.459 11.073 ( 8.946 -6.405 2.355) 11.252 11.449 ( 4.199 -0.085 6.939) 8.111 11.576 ( 3.144 7.224 -21.566) 22.960 11.892 ( 0.781 2.449 -8.597) 8.973 12.149 ( 4.832 -0.493 11.098) 12.114 12.430 ( -3.740 -1.721 -20.115) 20.532 12.761 ( 0.908 3.978 12.564) 13.210 13.166 ( -4.516 -1.607 5.461) 7.266 13.417 ( -3.210 -6.226 0.564) 7.027 13.678 ( 2.786 2.180 4.856) 6.008 14.148 ( -5.837 0.078 -1.058) 5.932 14.729 ( 12.191 -2.457 9.309) 15.534 15.046 ( -5.466 -4.417 6.618) 9.653 16.322 ( -8.552 -6.368 8.613) 13.706 16.815 ( -0.321 -3.138 -0.051) 3.154 17.128 ( 3.573 3.209 6.125) 7.783 17.587 ( -2.040 6.099 -4.774) 8.009 19.920 ( -2.154 -0.707 8.457) 8.755 20.368 ( -0.320 -3.136 7.053) 7.725 20.599 ( -4.594 -1.703 2.370) 5.443 21.339 ( -11.967 4.708 -9.340) 15.894 22.180 ( 16.959 -5.055 3.329) 18.007 22.464 ( -5.230 -3.065 -4.450) 7.520 22.941 ( 5.148 -0.184 7.914) 9.443 23.532 ( -0.391 5.363 -3.575) 6.457 24.281 ( -2.591 -0.353 1.997) 3.290 24.446 ( 5.103 -0.958 0.068) 5.193 24.766 ( -2.127 -3.890 3.176) 5.454 25.421 ( 2.793 5.200 -14.798) 15.931 ======================= Grid point 218 (114/186) ======================= q-point: (-0.12 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.680 ( 9.435 11.061 31.094) 34.325 2.971 ( 6.485 11.783 28.913) 31.888 3.704 ( -8.914 -0.114 6.837) 11.234 3.877 ( -3.195 -1.701 13.038) 13.531 4.228 ( -0.716 -1.461 18.568) 18.639 4.717 ( -6.110 2.909 -3.878) 7.799 4.882 ( -0.523 4.116 -15.500) 16.046 5.319 ( -1.165 5.188 -4.841) 7.190 5.522 ( -5.652 16.381 1.921) 17.435 5.662 ( -4.002 -0.231 1.223) 4.191 6.024 ( 5.136 7.793 3.188) 9.862 6.226 ( -8.757 2.002 7.989) 12.022 6.423 ( -3.948 -7.169 0.976) 8.242 6.539 ( 13.534 8.577 0.473) 16.030 6.766 ( 6.350 -8.030 -10.172) 14.432 7.102 ( 6.859 2.334 1.132) 7.333 7.216 ( 9.546 -10.295 -4.987) 14.899 7.502 ( -7.867 -8.075 -2.133) 11.474 7.718 ( 6.887 3.221 -9.638) 12.275 7.938 ( -6.403 0.968 -4.423) 7.842 8.162 ( 5.933 4.655 -4.974) 9.034 8.455 ( 2.486 -11.309 -6.798) 13.427 8.692 ( 7.645 -3.859 7.953) 11.687 9.253 ( 1.978 7.220 -2.253) 7.818 9.399 ( -3.058 1.731 -11.591) 12.111 9.480 ( -1.197 -4.211 -4.019) 5.943 9.986 ( -2.193 4.383 2.155) 5.354 10.245 ( -9.462 -4.975 1.872) 10.853 10.417 ( -7.473 1.531 -12.886) 14.975 10.648 ( 0.597 0.687 1.298) 1.586 10.945 ( 2.486 -3.371 -12.445) 13.131 11.310 ( 10.122 -6.988 3.545) 12.801 11.432 ( -3.666 4.240 -14.276) 15.336 11.517 ( 3.992 2.093 0.291) 4.517 11.863 ( 1.166 0.371 -9.401) 9.480 12.290 ( 8.520 -0.900 11.072) 14.000 12.370 ( -2.711 -3.454 -13.232) 13.941 12.739 ( 1.819 6.882 15.089) 16.684 13.083 ( -4.747 3.392 4.122) 7.144 13.485 ( -4.327 -8.899 -9.532) 13.740 13.692 ( 2.144 2.880 11.817) 12.350 14.047 ( -6.393 2.312 0.181) 6.801 14.906 ( 7.075 -1.271 12.173) 14.137 15.062 ( -5.791 -5.807 1.003) 8.262 16.296 ( -11.558 -5.547 8.585) 15.429 16.853 ( 1.063 -1.415 0.826) 1.953 17.106 ( -0.668 5.520 4.498) 7.152 17.471 ( 0.653 5.640 -3.918) 6.898 19.918 ( -1.560 0.587 8.522) 8.684 20.423 ( 0.102 -3.270 5.471) 6.375 20.555 ( -9.150 -1.785 2.479) 9.646 21.185 ( 0.990 2.512 -2.480) 3.666 22.316 ( -5.648 -2.478 -3.259) 6.975 22.614 ( 16.171 -8.330 -2.132) 18.315 23.023 ( 3.808 -0.677 7.295) 8.257 23.410 ( -5.155 5.326 -3.402) 8.156 24.256 ( -3.033 -0.738 1.459) 3.446 24.506 ( 3.983 0.895 -1.801) 4.462 24.748 ( -5.553 0.009 1.398) 5.727 25.416 ( 7.983 0.356 -13.066) 15.316 ======================= Grid point 222 (115/186) ======================= q-point: ( 0.38 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.483 ( -12.299 -0.000 2.714) 12.594 3.643 ( 1.456 0.000 12.772) 12.855 3.757 ( 8.005 0.000 16.154) 18.029 3.964 ( 1.318 0.000 10.608) 10.690 4.730 ( -6.643 -0.000 19.774) 20.860 4.841 ( 5.671 0.000 -0.917) 5.745 4.911 ( -4.829 -0.000 -7.157) 8.634 4.962 ( 0.169 0.000 -3.725) 3.729 5.243 ( 11.620 0.000 3.147) 12.038 5.249 ( 0.376 0.000 -3.531) 3.551 5.894 ( 13.054 0.000 3.299) 13.465 6.152 ( 3.251 0.000 -1.772) 3.703 6.275 ( -8.830 -0.000 -0.918) 8.878 6.873 ( 0.333 0.000 -15.557) 15.560 7.042 ( 2.939 0.000 13.827) 14.136 7.228 ( -20.530 -0.000 5.520) 21.259 7.473 ( 9.901 0.000 18.279) 20.788 7.654 ( 2.289 0.000 9.844) 10.107 7.813 ( -15.842 -0.000 -3.800) 16.292 7.881 ( 10.117 0.000 -15.005) 18.097 8.038 ( -5.497 -0.000 -40.724) 41.094 8.458 ( 7.579 0.000 -10.178) 12.690 8.592 ( -3.714 -0.000 8.223) 9.023 8.904 ( 9.335 0.000 0.186) 9.337 9.219 ( -6.876 -0.000 6.228) 9.277 9.885 ( 9.633 0.000 5.161) 10.928 9.997 ( 5.362 0.000 -2.791) 6.045 10.157 ( -0.950 -0.000 1.282) 1.596 10.444 ( 6.800 0.000 -5.860) 8.977 10.544 ( -1.106 -0.000 -5.829) 5.933 10.960 ( 1.944 0.000 -7.919) 8.154 11.092 ( -7.618 -0.000 -21.931) 23.216 11.495 ( -6.507 -0.000 -1.688) 6.723 11.775 ( 0.763 0.000 -5.957) 6.006 12.030 ( 2.489 0.000 -8.667) 9.017 12.115 ( -2.276 -0.000 6.585) 6.967 12.560 ( 5.857 0.000 8.378) 10.222 12.882 ( -1.235 -0.000 14.315) 14.368 12.923 ( -1.870 -0.000 -16.536) 16.642 13.335 ( -11.034 -0.000 -2.165) 11.244 13.749 ( 6.442 0.000 -6.345) 9.042 13.952 ( 2.039 0.000 4.250) 4.714 14.269 ( 3.842 0.000 11.442) 12.070 15.148 ( -7.059 -0.000 11.537) 13.525 16.223 ( -3.062 -0.000 10.504) 10.941 16.685 ( -0.903 -0.000 -0.687) 1.134 17.065 ( 3.368 0.000 9.637) 10.209 17.754 ( 3.549 0.000 -2.096) 4.122 19.899 ( -4.067 -0.000 6.297) 7.496 20.117 ( 3.741 0.000 11.918) 12.491 20.959 ( -13.947 -0.000 -3.167) 14.302 21.418 ( 13.544 0.000 -6.101) 14.854 22.299 ( -10.334 -0.000 -5.002) 11.481 22.493 ( -11.596 -0.000 -3.539) 12.124 22.695 ( 7.517 0.000 8.401) 11.273 23.590 ( 7.161 0.000 -5.433) 8.989 24.238 ( 3.450 0.000 3.568) 4.963 24.438 ( -0.882 -0.000 5.307) 5.380 24.488 ( -0.984 -0.000 -0.377) 1.054 25.740 ( -0.658 -0.000 -14.921) 14.935 ======================= Grid point 223 (116/186) ======================= q-point: (-0.50 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.313 ( -12.616 0.582 6.402) 14.160 3.657 ( -2.009 4.380 13.001) 13.865 3.860 ( 1.249 2.077 9.532) 9.835 3.982 ( -1.394 -1.960 13.461) 13.674 4.381 ( -11.893 23.676 14.114) 30.020 4.902 ( -1.791 -3.846 0.533) 4.276 4.973 ( 6.070 -3.086 -7.378) 10.040 5.034 ( -2.383 -9.945 1.091) 10.285 5.344 ( 7.121 -7.699 -5.297) 11.749 5.442 ( 6.675 -7.082 3.718) 10.418 6.035 ( 4.660 -0.833 4.332) 6.417 6.210 ( -7.290 -5.103 1.179) 8.976 6.214 ( 3.824 -2.673 3.151) 5.630 6.756 ( -14.154 4.322 -5.810) 15.898 6.928 ( 0.188 7.693 -5.990) 9.752 7.184 ( 6.110 -0.899 7.478) 9.698 7.518 ( -7.222 8.995 -2.253) 11.753 7.601 ( 5.769 8.825 4.614) 11.509 7.728 ( 0.252 3.335 5.184) 6.170 7.873 ( 1.603 -0.190 -22.941) 22.997 8.045 ( 9.932 -6.349 -8.483) 14.523 8.377 ( 6.112 10.136 -2.694) 12.139 8.713 ( -3.353 -3.910 2.362) 5.667 9.041 ( 5.521 -6.375 -3.074) 8.976 9.206 ( -2.529 -7.594 4.115) 9.000 9.875 ( 2.157 9.686 1.288) 10.007 10.095 ( -2.512 5.403 2.043) 6.299 10.149 ( 4.779 -8.435 -2.047) 9.909 10.445 ( 2.749 2.334 -2.507) 4.392 10.613 ( 0.384 -7.834 -4.591) 9.088 10.923 ( -8.540 1.832 -11.482) 14.426 10.972 ( 2.945 0.697 -9.983) 10.432 11.444 ( -4.052 -2.438 -4.358) 6.431 11.744 ( 3.571 3.823 -9.582) 10.918 12.014 ( 1.759 1.434 -9.241) 9.515 12.081 ( -6.638 -2.157 -2.845) 7.537 12.607 ( 5.678 6.581 5.819) 10.460 12.874 ( 1.228 2.460 -9.801) 10.179 12.900 ( -6.262 -3.889 13.704) 15.561 13.278 ( -3.781 -6.742 2.568) 8.145 13.745 ( 0.724 2.782 -8.329) 8.812 14.028 ( 0.182 -6.073 0.262) 6.082 14.429 ( 13.697 -0.514 12.926) 18.840 15.066 ( -8.723 0.362 9.735) 13.077 16.206 ( -5.471 -1.890 10.671) 12.140 16.692 ( 0.286 -1.516 -0.056) 1.544 17.138 ( 4.810 0.834 9.875) 11.016 17.771 ( 1.633 1.736 -2.881) 3.739 19.882 ( -1.950 -0.724 7.226) 7.520 20.202 ( 2.791 -1.326 13.720) 14.063 20.759 ( -12.422 1.456 -5.224) 13.554 21.530 ( 4.415 -0.051 -10.038) 10.966 22.119 ( -5.801 4.800 -0.355) 7.538 22.401 ( -7.143 -4.180 -3.706) 9.068 22.830 ( 8.127 -0.301 8.303) 11.622 23.652 ( 5.395 1.238 -5.815) 8.028 24.297 ( 4.591 0.401 3.476) 5.773 24.411 ( -0.772 2.725 3.538) 4.532 24.529 ( -0.128 -5.447 2.851) 6.149 25.658 ( -3.350 2.192 -15.746) 16.247 ======================= Grid point 224 (117/186) ======================= q-point: (-0.38 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.176 ( -10.722 0.913 9.763) 14.529 3.526 ( -2.582 14.561 14.832) 20.944 3.747 ( -9.212 5.110 8.996) 13.853 3.993 ( -10.955 9.841 18.202) 23.413 4.096 ( 2.175 -1.741 15.850) 16.093 4.897 ( -2.358 0.348 -4.717) 5.285 5.025 ( 0.574 -0.862 -8.176) 8.241 5.186 ( 4.391 -8.437 -0.930) 9.557 5.562 ( 4.376 -8.892 -1.515) 10.025 5.598 ( -0.626 -12.054 -1.601) 12.176 6.098 ( -2.319 -2.343 12.047) 12.490 6.210 ( -4.702 -5.011 3.233) 7.594 6.273 ( -1.617 -0.878 2.179) 2.852 6.505 ( -9.045 1.315 -1.740) 9.304 6.871 ( 3.239 3.394 -16.449) 17.105 7.276 ( 13.484 18.844 8.035) 24.525 7.347 ( 0.249 6.084 -1.317) 6.230 7.423 ( 2.329 6.525 -16.659) 18.042 7.709 ( 2.174 4.927 12.029) 13.179 7.940 ( 6.343 -5.050 -8.411) 11.682 8.280 ( 9.530 -5.770 1.042) 11.189 8.347 ( 5.731 6.672 -4.504) 9.882 8.577 ( -8.356 6.056 0.041) 10.320 9.159 ( 3.385 -5.777 -10.175) 12.180 9.354 ( 1.713 -7.811 -1.825) 8.202 9.741 ( -2.138 9.947 1.411) 10.271 9.996 ( -5.310 -0.906 1.527) 5.599 10.279 ( 0.266 -2.851 1.258) 3.127 10.438 ( -1.810 -0.053 -1.648) 2.449 10.697 ( -5.317 -9.370 -10.454) 15.012 10.794 ( 1.797 4.797 0.942) 5.209 10.994 ( 5.587 0.224 -7.128) 9.060 11.425 ( -2.733 -3.474 -4.307) 6.171 11.722 ( 4.460 4.004 -16.031) 17.115 11.972 ( -1.690 1.724 -14.984) 15.177 12.047 ( -2.654 -5.100 2.268) 6.181 12.561 ( 4.693 9.911 -2.284) 11.201 12.802 ( -6.486 -0.286 8.543) 10.729 12.986 ( 4.212 -6.374 0.836) 7.685 13.348 ( -2.170 -3.497 5.675) 7.011 13.701 ( 0.080 0.580 -3.625) 3.672 14.084 ( -3.543 -4.581 -0.496) 5.812 14.664 ( 14.824 -1.314 10.197) 18.040 14.976 ( -8.393 -0.858 7.876) 11.542 16.187 ( -6.817 -3.146 10.703) 13.073 16.731 ( 1.285 -2.534 0.068) 2.842 17.208 ( 5.433 2.251 9.202) 10.920 17.731 ( -0.580 3.851 -3.778) 5.426 19.901 ( 0.115 -0.591 8.868) 8.889 20.285 ( 0.281 -2.274 14.035) 14.221 20.593 ( -8.422 0.474 -4.558) 9.588 21.438 ( -10.019 2.372 -11.833) 15.685 22.119 ( 9.964 0.167 2.785) 10.347 22.373 ( -3.658 -3.260 -4.446) 6.617 22.941 ( 5.654 0.125 8.026) 9.818 23.655 ( 1.767 3.344 -6.461) 7.487 24.327 ( 0.598 3.097 3.675) 4.843 24.414 ( 3.948 -0.968 1.543) 4.348 24.622 ( 0.220 -5.769 4.554) 7.353 25.529 ( -4.479 2.505 -16.188) 16.982 ======================= Grid point 225 (118/186) ======================= q-point: (-0.25 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.040 ( -3.422 8.563 17.031) 19.368 3.338 ( 0.903 13.848 19.959) 24.310 3.625 ( -9.222 -1.887 10.602) 14.178 3.822 ( -11.122 1.092 19.380) 22.371 4.192 ( 1.695 -1.444 14.754) 14.921 4.790 ( -9.657 1.905 -6.432) 11.758 5.005 ( 5.485 4.789 -10.174) 12.511 5.336 ( 4.691 -4.409 -2.596) 6.941 5.601 ( -4.206 -2.262 -0.990) 4.877 5.819 ( -3.804 -14.613 -0.386) 15.105 6.019 ( -8.591 -0.906 0.466) 8.651 6.167 ( -5.462 2.873 -0.998) 6.252 6.339 ( 6.413 -1.615 14.351) 15.802 6.535 ( 1.420 -8.999 0.761) 9.142 6.775 ( -2.337 6.508 -16.547) 17.934 7.132 ( 9.899 13.187 -2.634) 16.698 7.306 ( 7.281 6.586 -2.422) 10.112 7.390 ( -2.602 1.586 -3.869) 4.925 7.821 ( 18.076 3.777 14.562) 23.517 8.049 ( -9.178 1.421 -8.541) 12.618 8.164 ( 2.893 2.279 -2.648) 4.536 8.363 ( 3.244 3.836 -12.164) 13.160 8.614 ( 8.366 -3.463 6.819) 11.335 9.261 ( 1.162 -8.105 -14.632) 16.768 9.406 ( 1.476 0.023 -5.222) 5.426 9.537 ( -6.634 9.977 0.814) 12.009 10.022 ( 0.331 -4.765 4.333) 6.449 10.200 ( -8.736 4.246 0.758) 9.743 10.403 ( -5.307 -2.176 -5.942) 8.259 10.674 ( -2.048 -1.118 -7.325) 7.687 10.846 ( 3.485 -2.110 -0.064) 4.075 11.111 ( 8.772 -5.278 -0.079) 10.238 11.448 ( -3.152 -3.858 1.492) 5.200 11.631 ( 0.817 5.314 -23.632) 24.236 11.904 ( 0.591 1.748 -12.425) 12.562 12.142 ( 2.136 -6.741 -3.079) 7.712 12.471 ( 3.480 7.800 0.311) 8.547 12.785 ( -2.757 -1.812 12.154) 12.594 13.137 ( 5.085 -3.648 1.604) 6.460 13.313 ( -4.970 0.415 -2.232) 5.464 13.723 ( 0.764 -1.431 5.538) 5.770 14.061 ( -5.879 -1.457 -0.215) 6.060 14.875 ( 9.612 -2.087 8.400) 12.935 14.917 ( -6.723 -2.404 6.360) 9.562 16.170 ( -6.658 -3.215 10.405) 12.764 16.791 ( 2.024 -2.713 -0.108) 3.386 17.250 ( 4.164 4.403 7.792) 9.871 17.635 ( -1.845 5.504 -4.228) 7.181 19.937 ( 1.447 0.705 10.206) 10.332 20.336 ( -2.267 -2.559 12.235) 12.703 20.511 ( -4.724 -1.423 -2.002) 5.325 21.244 ( -8.612 1.639 -8.018) 11.880 22.256 ( 2.379 -1.515 -1.075) 3.018 22.434 ( 10.798 -4.540 -2.756) 12.033 23.014 ( 2.971 0.050 7.637) 8.195 23.563 ( -3.914 5.422 -6.908) 9.614 24.285 ( -0.961 2.779 3.042) 4.231 24.503 ( 5.747 -1.162 0.280) 5.870 24.695 ( -1.644 -3.522 4.084) 5.638 25.420 ( -2.435 -0.096 -15.491) 15.681 ======================= Grid point 226 (119/186) ======================= q-point: (-0.12 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.009 ( 7.697 6.214 25.588) 27.434 3.263 ( 3.119 8.630 21.903) 23.748 3.592 ( -4.412 -1.642 11.139) 12.093 3.769 ( -9.430 -6.526 18.760) 21.987 4.256 ( 1.405 -0.190 13.697) 13.770 4.597 ( -12.751 0.600 -7.145) 14.629 4.990 ( 9.233 7.706 -11.117) 16.377 5.410 ( 5.802 2.725 -1.759) 6.647 5.553 ( -5.807 -1.167 -1.087) 6.022 5.695 ( -6.425 12.460 0.057) 14.019 6.026 ( -6.969 -0.269 -3.716) 7.903 6.142 ( -4.482 -13.473 -3.843) 14.710 6.402 ( 0.641 9.453 13.241) 16.282 6.637 ( 1.004 -5.501 -6.490) 8.567 6.752 ( 6.260 -9.274 -3.874) 11.841 7.176 ( 7.967 -0.681 -1.474) 8.131 7.289 ( -0.260 3.392 -0.011) 3.402 7.364 ( 4.435 1.974 2.375) 5.404 7.738 ( -9.357 8.107 -9.962) 15.891 8.041 ( 14.070 2.626 4.077) 14.882 8.264 ( 0.840 6.449 -3.062) 7.188 8.355 ( 7.103 -7.412 -8.095) 13.074 8.736 ( 0.867 -3.312 -0.575) 3.471 9.257 ( -9.319 -4.381 -9.212) 13.816 9.373 ( -2.364 3.494 1.272) 4.407 9.473 ( 13.031 1.912 -12.685) 18.285 10.008 ( -8.939 4.604 -0.481) 10.067 10.098 ( -1.403 -2.634 5.552) 6.304 10.335 ( -2.912 0.538 -5.468) 6.218 10.663 ( 0.477 -0.148 -2.810) 2.854 10.912 ( 2.803 -3.724 -4.861) 6.735 11.320 ( -0.192 -4.224 8.095) 9.133 11.383 ( 0.692 -0.346 -6.496) 6.542 11.588 ( 3.890 -1.462 -18.542) 19.002 11.865 ( 1.150 1.536 -11.099) 11.263 12.165 ( -3.160 -0.384 -15.430) 15.755 12.526 ( 8.959 -0.517 14.394) 16.962 12.816 ( -0.521 -0.526 11.911) 11.934 13.146 ( 1.549 6.855 4.529) 8.361 13.294 ( -3.381 -6.123 -10.724) 12.804 13.758 ( -0.627 -0.025 12.050) 12.067 13.989 ( -5.183 0.702 -0.055) 5.231 14.873 ( -8.975 -4.030 1.018) 9.890 15.017 ( 4.775 -1.024 11.503) 12.497 16.160 ( -4.278 -2.221 10.018) 11.117 16.852 ( 2.047 -1.998 -0.112) 2.862 17.204 ( -1.127 8.035 5.567) 9.840 17.546 ( 1.381 4.064 -3.064) 5.274 19.960 ( 1.659 2.352 9.851) 10.263 20.338 ( -9.262 -1.262 12.977) 15.993 20.512 ( 4.665 -2.495 -3.329) 6.250 21.173 ( -2.326 -3.320 -1.917) 4.484 22.249 ( -0.151 0.896 -4.534) 4.624 22.692 ( 12.776 -6.711 -2.405) 14.630 23.061 ( 0.937 -0.927 6.650) 6.779 23.379 ( -8.861 5.557 -6.261) 12.190 24.246 ( -1.105 1.936 2.718) 3.515 24.574 ( 4.750 1.126 -1.525) 5.114 24.681 ( -5.135 0.138 2.030) 5.523 25.418 ( 2.386 -4.819 -13.337) 14.380 ======================= Grid point 231 (120/186) ======================= q-point: (-0.50 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.115 ( -17.499 -0.000 8.650) 19.520 3.707 ( -5.392 -0.000 14.451) 15.424 3.927 ( -4.139 -0.000 12.031) 12.723 3.945 ( 3.385 0.000 7.043) 7.814 4.581 ( -8.490 -0.000 13.034) 15.555 4.612 ( -12.075 -0.000 5.393) 13.225 4.948 ( 0.052 0.000 -7.350) 7.350 5.044 ( 6.080 0.000 0.800) 6.132 5.390 ( 8.461 0.000 -6.316) 10.558 5.475 ( 2.237 0.000 5.887) 6.298 6.085 ( -0.323 -0.000 8.672) 8.678 6.086 ( -2.182 -0.000 2.392) 3.237 6.218 ( -2.640 -0.000 0.632) 2.715 6.565 ( -16.700 -0.000 -3.347) 17.032 6.951 ( 2.206 0.000 -19.825) 19.948 7.344 ( 12.687 0.000 10.837) 16.685 7.457 ( -2.989 -0.000 -10.092) 10.525 7.698 ( 3.238 0.000 -1.125) 3.428 7.783 ( 1.703 0.000 -18.054) 18.134 7.982 ( 12.468 0.000 4.631) 13.301 8.137 ( 13.749 0.000 -4.451) 14.452 8.573 ( 0.883 0.000 2.619) 2.764 8.659 ( 0.274 0.000 11.485) 11.488 9.005 ( 1.239 0.000 -8.520) 8.609 9.118 ( -1.383 -0.000 4.962) 5.151 9.972 ( -6.105 -0.000 -3.502) 7.039 9.998 ( -4.571 -0.000 -3.512) 5.764 10.181 ( 2.792 0.000 3.916) 4.809 10.455 ( -2.584 -0.000 -3.047) 3.995 10.545 ( 3.308 0.000 -7.208) 7.931 10.891 ( 1.696 0.000 1.174) 2.063 11.008 ( 4.195 0.000 -8.702) 9.661 11.347 ( -5.107 -0.000 -7.763) 9.292 11.777 ( 1.568 0.000 -7.684) 7.842 11.948 ( -9.622 -0.000 -0.957) 9.669 11.992 ( 0.879 0.000 -24.120) 24.136 12.769 ( 6.088 0.000 12.199) 13.634 12.777 ( -10.446 -0.000 7.097) 12.628 12.947 ( 8.079 0.000 -7.823) 11.246 13.207 ( 0.585 0.000 7.419) 7.442 13.739 ( -1.713 -0.000 -8.871) 9.035 13.973 ( -1.764 -0.000 0.193) 1.774 14.656 ( 15.650 0.000 12.281) 19.893 14.967 ( -9.603 -0.000 7.750) 12.340 16.145 ( -5.563 -0.000 10.711) 12.069 16.693 ( 1.266 0.000 0.491) 1.358 17.241 ( 6.062 0.000 10.437) 12.070 17.787 ( -0.086 -0.000 -3.292) 3.293 19.892 ( 1.079 0.000 9.115) 9.178 20.253 ( 0.663 0.000 15.448) 15.462 20.602 ( -10.303 -0.000 -6.590) 12.230 21.471 ( -8.921 -0.000 -12.772) 15.579 22.139 ( 3.778 0.000 1.738) 4.158 22.313 ( -0.112 -0.000 -3.533) 3.535 22.944 ( 5.996 0.000 8.054) 10.041 23.706 ( 3.658 0.000 -7.398) 8.253 24.374 ( 5.279 0.000 2.381) 5.792 24.443 ( -2.121 -0.000 -0.209) 2.131 24.490 ( 2.146 0.000 8.995) 9.247 25.563 ( -6.926 -0.000 -16.556) 17.946 ======================= Grid point 232 (121/186) ======================= q-point: (-0.38 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.952 ( -17.602 -6.549 12.021) 22.298 3.586 ( -14.845 1.978 14.678) 20.970 3.833 ( 1.929 10.848 11.009) 15.576 4.050 ( -2.345 1.706 11.201) 11.570 4.194 ( -3.726 15.344 14.534) 21.461 4.792 ( -4.190 -10.950 1.347) 11.801 4.906 ( -7.831 -6.886 -3.558) 11.018 5.171 ( 6.601 -5.705 -0.141) 8.725 5.450 ( 1.049 -1.236 -2.017) 2.588 5.530 ( 1.500 -3.538 -0.741) 3.913 6.039 ( -8.210 1.573 5.541) 10.029 6.137 ( -4.222 -4.330 10.560) 12.169 6.198 ( -2.050 -4.570 3.644) 6.194 6.408 ( -1.497 -0.186 -3.881) 4.163 6.928 ( 5.024 3.661 -20.476) 21.398 7.383 ( 1.987 1.342 -9.911) 10.197 7.450 ( 0.370 1.661 -21.103) 21.171 7.683 ( 6.444 12.886 -4.991) 15.247 7.875 ( 16.245 1.136 23.436) 28.538 8.076 ( 8.938 4.438 -4.614) 10.994 8.302 ( 5.705 -2.413 -8.610) 10.606 8.531 ( -6.686 9.410 1.343) 11.621 8.560 ( 0.512 1.732 9.826) 9.990 9.039 ( 0.027 -4.491 -8.360) 9.490 9.262 ( 3.948 -11.029 1.233) 11.779 9.821 ( -4.109 5.858 -1.547) 7.321 9.907 ( -7.944 0.198 -1.269) 8.047 10.240 ( 0.167 -2.948 1.496) 3.310 10.418 ( -1.590 2.355 -2.464) 3.761 10.574 ( 1.706 -1.623 -6.762) 7.160 10.914 ( 3.900 4.724 9.547) 11.343 11.056 ( 6.256 -0.289 -8.782) 10.786 11.286 ( -5.008 -4.522 -9.174) 11.388 11.763 ( -0.624 2.484 -11.237) 11.525 11.864 ( -5.166 -6.188 -3.528) 8.799 11.948 ( -0.457 -2.656 -21.378) 21.548 12.662 ( -8.485 0.733 -0.275) 8.521 12.819 ( 6.424 7.028 12.308) 15.561 13.049 ( 10.423 -0.075 -0.167) 10.424 13.298 ( 1.331 -4.309 5.420) 7.050 13.677 ( -3.097 0.139 -3.045) 4.346 13.966 ( -4.667 -4.105 -1.759) 6.459 14.847 ( 0.654 0.913 8.232) 8.308 14.889 ( 2.597 -1.187 10.137) 10.532 16.118 ( -3.237 -0.716 9.666) 10.219 16.726 ( 1.971 -1.486 0.400) 2.500 17.339 ( 6.474 1.721 9.787) 11.860 17.749 ( -2.031 2.235 -3.778) 4.836 19.952 ( 4.386 0.344 11.809) 12.601 20.289 ( -2.089 -0.786 15.813) 15.970 20.478 ( -6.387 -0.719 -5.953) 8.760 21.275 ( -13.718 0.582 -11.597) 17.973 22.231 ( 7.618 -0.395 1.110) 7.709 22.353 ( 6.383 -1.378 -3.643) 7.478 23.019 ( 2.746 0.145 7.421) 7.914 23.692 ( -0.173 3.050 -9.372) 9.857 24.385 ( -1.151 3.494 1.698) 4.052 24.456 ( 4.853 -1.561 1.202) 5.237 24.582 ( 2.258 -3.681 8.186) 9.255 25.414 ( -8.915 -0.180 -16.523) 18.776 ======================= Grid point 233 (122/186) ======================= q-point: (-0.25 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.909 ( -14.844 -12.508 14.398) 24.168 3.397 ( -14.250 0.835 17.241) 22.383 3.752 ( 3.536 10.147 13.866) 17.543 3.819 ( -6.554 13.858 22.757) 27.439 4.232 ( 3.906 -1.682 8.720) 9.701 4.663 ( -12.740 3.478 -5.472) 14.294 5.041 ( 1.082 -10.963 -1.570) 11.128 5.342 ( 6.093 -5.574 0.567) 8.278 5.491 ( -1.758 -4.852 0.313) 5.170 5.609 ( 2.235 -5.826 0.089) 6.241 5.860 ( -13.893 0.733 0.181) 13.913 6.115 ( -7.916 -3.610 1.452) 8.821 6.339 ( 3.094 -8.933 13.312) 16.327 6.475 ( 6.853 -0.807 -5.323) 8.715 6.840 ( 1.903 9.349 -18.385) 20.713 7.331 ( 1.810 5.985 -18.094) 19.144 7.370 ( -0.480 2.107 -6.054) 6.428 7.576 ( 8.933 12.252 3.996) 15.681 7.971 ( -8.501 5.515 -10.290) 14.442 8.171 ( 14.917 4.834 12.000) 19.745 8.305 ( 10.161 2.933 1.651) 10.704 8.409 ( 1.070 4.942 -3.815) 6.334 8.583 ( -5.179 -6.048 -3.566) 8.725 9.078 ( -3.520 -5.436 -7.597) 9.983 9.383 ( 0.602 -2.218 0.784) 2.429 9.684 ( 4.481 9.441 -5.091) 11.625 9.911 ( -4.800 -8.671 3.788) 10.610 10.209 ( -1.772 4.809 2.189) 5.573 10.354 ( -0.485 3.439 -0.147) 3.476 10.606 ( 0.678 -3.023 -8.786) 9.316 10.903 ( 0.738 3.850 7.655) 8.600 11.154 ( 8.292 -3.832 -3.461) 9.768 11.300 ( -4.152 -6.986 -6.582) 10.458 11.634 ( -3.203 4.385 -18.211) 19.003 11.864 ( -1.096 -1.435 -20.550) 20.629 12.057 ( 3.500 -11.917 0.381) 12.426 12.534 ( -6.147 2.409 -1.591) 6.792 12.850 ( 6.972 5.156 12.822) 15.479 13.190 ( 6.590 -1.045 0.697) 6.709 13.307 ( 0.802 3.589 -1.997) 4.184 13.687 ( -2.002 -4.360 7.452) 8.863 13.947 ( -5.616 -3.856 -2.077) 7.122 14.783 ( -7.574 -1.724 3.573) 8.550 15.015 ( 5.327 0.439 13.972) 14.960 16.126 ( 0.040 -0.218 8.271) 8.274 16.784 ( 2.483 -2.446 -0.193) 3.491 17.392 ( 4.481 4.979 7.732) 10.230 17.662 ( -2.600 3.619 -3.783) 5.845 20.036 ( 6.033 2.810 13.099) 14.692 20.297 ( -4.887 -1.197 15.409) 16.210 20.442 ( -0.166 -2.587 -4.171) 4.911 21.091 ( -10.969 -2.173 -8.159) 13.843 22.294 ( 4.841 2.162 -2.062) 5.689 22.526 ( 12.816 -4.922 -2.014) 13.875 23.051 ( -0.246 -0.044 6.681) 6.686 23.555 ( -6.939 6.475 -10.600) 14.228 24.326 ( -0.996 3.363 2.092) 4.084 24.557 ( 5.681 -2.343 0.459) 6.163 24.659 ( 0.061 -1.498 6.059) 6.242 25.289 ( -7.184 -3.775 -14.917) 16.982 ======================= Grid point 234 (123/186) ======================= q-point: (-0.12 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.966 ( -11.885 -14.206 16.205) 24.610 3.342 ( -6.461 -6.332 21.107) 22.964 3.634 ( -8.398 5.242 24.386) 26.319 3.742 ( 7.158 8.046 14.445) 18.018 4.321 ( 3.329 0.166 8.340) 8.981 4.448 ( -8.923 2.048 -1.499) 9.277 5.161 ( 7.091 0.607 -8.347) 10.969 5.411 ( -4.888 -2.177 -0.473) 5.371 5.560 ( 6.385 0.504 3.781) 7.438 5.712 ( -5.690 0.314 -0.005) 5.698 5.746 ( -6.157 -14.721 2.111) 16.096 6.068 ( -1.749 0.701 -1.111) 2.187 6.482 ( -3.372 3.354 -4.026) 6.231 6.543 ( 3.047 -7.645 2.672) 8.653 6.690 ( 1.772 2.042 -13.472) 13.741 7.231 ( -0.115 3.623 -6.462) 7.409 7.342 ( 0.724 4.355 -0.087) 4.416 7.593 ( 11.897 7.300 3.750) 14.454 7.723 ( -6.198 6.240 -10.324) 13.562 8.195 ( -3.028 3.047 -11.369) 12.154 8.301 ( -2.478 3.602 -0.114) 4.374 8.459 ( 0.174 2.981 4.330) 5.260 8.595 ( 5.514 -4.786 -8.538) 11.234 9.085 ( -2.375 -6.632 -2.166) 7.370 9.395 ( 1.016 2.409 2.964) 3.952 9.712 ( 15.831 5.719 -11.556) 20.417 9.873 ( -10.456 -2.103 -0.143) 10.667 10.184 ( 4.347 7.171 5.087) 9.808 10.321 ( 0.886 -0.970 3.960) 4.173 10.625 ( -0.733 -3.065 -7.549) 8.180 10.892 ( -0.090 -0.661 3.593) 3.654 11.255 ( -7.147 0.493 3.865) 8.140 11.373 ( 8.723 -8.179 -4.520) 12.784 11.534 ( 0.950 -1.445 -23.607) 23.670 11.810 ( -2.498 -1.942 -21.557) 21.788 12.195 ( 3.818 3.533 -3.063) 6.036 12.508 ( -3.491 -9.931 6.510) 12.377 12.899 ( 5.303 4.803 8.086) 10.797 13.167 ( -2.758 0.464 -6.198) 6.800 13.335 ( 8.038 5.360 4.862) 10.816 13.719 ( -5.979 -3.291 11.369) 13.260 13.944 ( -0.095 -2.206 -0.293) 2.228 14.715 ( -8.360 -1.996 0.599) 8.616 15.081 ( 0.557 0.155 15.275) 15.286 16.164 ( 2.862 0.365 7.588) 8.118 16.850 ( 2.452 -2.258 -0.665) 3.399 17.319 ( -2.419 9.523 4.276) 10.716 17.601 ( 1.345 2.263 -2.157) 3.403 20.079 ( 4.799 4.978 10.756) 12.787 20.247 ( -8.787 0.687 12.236) 15.080 20.551 ( 9.423 -4.474 0.485) 10.442 21.032 ( -5.820 -6.847 -3.172) 9.530 22.315 ( 6.149 3.536 -3.026) 7.712 22.741 ( 7.576 -4.325 -4.195) 9.680 23.051 ( -2.933 -0.777 5.440) 6.229 23.313 ( -10.111 5.345 -8.038) 13.979 24.280 ( -0.320 2.829 2.402) 3.725 24.634 ( -3.182 2.592 -0.037) 4.104 24.653 ( 4.281 -0.470 1.985) 4.742 25.289 ( -1.652 -9.275 -12.168) 15.389 ======================= Grid point 240 (124/186) ======================= q-point: (-0.38 -0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.680 ( -20.441 -0.000 16.859) 26.497 3.382 ( -22.466 -0.000 18.220) 28.926 4.006 ( 1.556 0.000 12.751) 12.846 4.037 ( 0.701 0.000 3.698) 3.764 4.444 ( -1.015 -0.000 10.404) 10.454 4.491 ( -6.888 -0.000 15.006) 16.512 4.736 ( -11.313 -0.000 -4.375) 12.129 5.195 ( 5.474 0.000 1.803) 5.763 5.480 ( 1.145 0.000 -0.557) 1.273 5.566 ( 9.546 0.000 -5.293) 10.915 5.928 ( -14.268 -0.000 -0.334) 14.272 5.974 ( -12.129 -0.000 3.393) 12.595 6.189 ( 0.436 0.000 20.764) 20.768 6.499 ( 13.835 0.000 -5.232) 14.791 7.007 ( 9.693 0.000 -17.932) 20.384 7.382 ( -2.245 -0.000 -10.310) 10.552 7.401 ( 2.985 0.000 -29.323) 29.475 7.801 ( 3.769 0.000 -5.296) 6.500 8.089 ( -10.340 -0.000 -18.177) 20.912 8.220 ( -6.269 -0.000 -9.478) 11.363 8.264 ( 24.591 0.000 26.585) 36.215 8.534 ( -8.947 -0.000 -0.988) 9.001 8.557 ( 3.511 0.000 9.055) 9.712 9.125 ( -6.146 -0.000 -1.187) 6.260 9.180 ( 14.552 0.000 3.689) 15.012 9.757 ( -9.221 -0.000 1.773) 9.389 9.842 ( -0.541 -0.000 -4.338) 4.372 10.228 ( 0.453 0.000 -0.585) 0.740 10.465 ( 4.805 0.000 -1.316) 4.982 10.579 ( 1.491 0.000 -6.508) 6.676 11.068 ( 3.989 0.000 15.111) 15.629 11.073 ( 3.340 0.000 -4.665) 5.737 11.193 ( 0.457 0.000 -12.061) 12.070 11.698 ( -7.857 -0.000 -3.008) 8.413 11.735 ( -2.713 -0.000 -6.412) 6.962 11.854 ( -1.141 -0.000 -29.999) 30.021 12.571 ( -5.626 -0.000 -2.055) 5.989 12.987 ( 5.625 0.000 13.892) 14.987 13.219 ( 13.351 0.000 -1.474) 13.432 13.310 ( 3.736 0.000 3.564) 5.163 13.615 ( -5.124 -0.000 2.035) 5.513 13.856 ( -6.088 -0.000 -3.701) 7.125 14.767 ( -7.736 -0.000 4.612) 9.007 15.023 ( 5.412 0.000 15.575) 16.489 16.129 ( 2.155 0.000 6.650) 6.990 16.744 ( 2.447 0.000 0.100) 2.449 17.465 ( 7.087 0.000 8.713) 11.231 17.717 ( -3.853 -0.000 -3.890) 5.475 20.085 ( 10.105 0.000 16.117) 19.023 20.283 ( -4.299 -0.000 16.369) 16.924 20.392 ( -3.124 -0.000 -6.112) 6.864 21.061 ( -14.437 -0.000 -10.863) 18.067 22.343 ( 8.676 0.000 1.179) 8.755 22.440 ( 10.029 0.000 -4.043) 10.814 23.051 ( -0.549 -0.000 6.483) 6.506 23.668 ( -3.800 -0.000 -13.214) 13.749 24.391 ( -1.517 -0.000 0.030) 1.517 24.497 ( 3.168 0.000 1.247) 3.404 24.628 ( 4.106 0.000 9.925) 10.741 25.234 ( -11.467 -0.000 -15.284) 19.108 ======================= Grid point 241 (125/186) ======================= q-point: (-0.25 -0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.541 ( -19.149 -11.057 20.563) 30.196 3.141 ( -24.832 -4.497 19.984) 32.190 3.935 ( -1.734 10.275 12.461) 16.244 4.001 ( -4.815 7.620 14.665) 17.214 4.305 ( -1.471 0.761 8.725) 8.880 4.514 ( -7.959 1.239 3.566) 8.810 4.834 ( 4.217 -16.614 7.120) 18.561 5.300 ( 3.138 -3.337 2.319) 5.135 5.519 ( 4.326 -1.614 0.820) 4.689 5.648 ( -0.118 2.918 -5.940) 6.619 5.737 ( -2.437 2.347 -1.103) 3.559 5.895 ( -9.531 -8.021 0.690) 12.476 6.293 ( 0.699 -6.145 19.254) 20.223 6.631 ( 11.326 4.976 -10.921) 16.502 7.011 ( 7.091 12.712 -14.870) 20.808 7.330 ( -1.432 0.114 -10.379) 10.478 7.364 ( 2.491 -1.328 -20.611) 20.803 7.789 ( -16.132 -0.011 -14.421) 21.638 7.812 ( 0.810 3.267 -4.207) 5.388 8.193 ( -2.309 -2.712 -11.872) 12.394 8.354 ( -10.087 3.183 -8.177) 13.369 8.572 ( 3.322 5.143 4.222) 7.437 8.649 ( 20.844 3.074 21.176) 29.872 8.967 ( -9.814 -0.058 -2.614) 10.156 9.410 ( 8.581 -2.149 5.443) 10.387 9.694 ( -8.183 -7.277 2.347) 11.199 9.854 ( 7.305 2.756 -5.185) 9.372 10.224 ( -1.321 -0.664 2.785) 3.153 10.493 ( 6.945 7.090 -2.678) 10.280 10.576 ( 1.732 -0.246 -9.150) 9.315 11.025 ( 0.237 9.194 14.461) 17.138 11.168 ( 0.180 -4.284 -6.000) 7.375 11.209 ( 7.678 -1.064 -5.264) 9.370 11.579 ( -6.107 2.323 -13.881) 15.342 11.752 ( -2.740 -2.632 -24.133) 24.431 11.861 ( -0.368 -17.980 0.620) 17.994 12.484 ( -4.813 2.289 -3.828) 6.562 13.058 ( 6.380 4.647 13.429) 15.577 13.269 ( 0.140 6.158 -5.259) 8.099 13.411 ( 10.435 -0.470 -0.067) 10.446 13.619 ( -1.564 -3.047 10.618) 11.157 13.807 ( -4.062 -5.352 -2.932) 7.330 14.685 ( -6.673 -0.240 3.272) 7.436 15.092 ( -0.346 0.265 18.049) 18.054 16.189 ( 5.503 0.944 4.508) 7.175 16.790 ( 3.015 -1.474 -0.764) 3.441 17.534 ( 3.440 5.013 4.847) 7.775 17.646 ( -2.932 0.451 -2.894) 4.145 20.240 ( 8.920 5.484 13.785) 17.311 20.254 ( -5.299 0.699 14.526) 15.478 20.422 ( 7.222 -5.103 1.348) 8.945 20.881 ( -11.382 -3.198 -8.495) 14.558 22.424 ( 8.003 3.747 -0.089) 8.837 22.609 ( 11.041 -4.367 -3.643) 12.419 23.040 ( -3.391 -0.136 5.536) 6.493 23.497 ( -11.124 5.675 -15.614) 19.994 24.357 ( -0.730 2.388 0.338) 2.520 24.570 ( 2.991 -4.384 1.452) 5.502 24.693 ( 2.454 1.261 6.879) 7.412 25.081 ( -9.585 -4.212 -11.836) 15.802 ======================= Grid point 242 (126/186) ======================= q-point: (-0.12 -0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.587 ( -14.752 -18.488 22.268) 32.485 3.002 ( -23.628 -14.264 20.286) 34.253 3.768 ( -5.482 9.729 22.760) 25.352 3.914 ( -0.088 4.797 10.672) 11.701 4.257 ( -11.665 -2.647 13.461) 18.008 4.544 ( 14.359 2.394 1.798) 14.668 5.110 ( 2.131 -12.175 1.545) 12.456 5.341 ( -1.680 -1.936 5.583) 6.143 5.496 ( -9.020 0.536 -2.314) 9.328 5.622 ( 1.553 -1.397 4.438) 4.905 5.757 ( 4.782 -1.314 -4.247) 6.530 5.971 ( 1.291 -7.733 -0.977) 7.901 6.452 ( 0.207 -9.018 10.687) 13.985 6.578 ( 4.576 9.779 -14.466) 18.051 6.821 ( 4.037 14.038 -16.090) 21.732 7.265 ( -0.290 4.148 -15.447) 15.997 7.397 ( 0.129 3.761 3.406) 5.075 7.553 ( -14.810 -8.011 -14.172) 22.008 7.845 ( 9.225 4.547 2.367) 10.554 8.097 ( -11.192 1.586 -17.594) 20.912 8.142 ( -10.170 1.641 -9.063) 13.721 8.508 ( 1.397 7.469 2.053) 7.871 8.760 ( 0.903 -0.058 -6.078) 6.145 9.040 ( 11.013 -2.444 17.033) 20.430 9.470 ( 2.447 3.556 1.927) 4.727 9.681 ( -10.191 -4.888 -2.107) 11.497 9.929 ( 11.968 1.737 -8.154) 14.586 10.284 ( 1.269 -6.254 8.967) 11.005 10.443 ( 6.419 10.750 -1.432) 12.602 10.581 ( 3.378 2.033 -7.918) 8.846 10.938 ( 0.577 5.410 11.414) 12.644 11.191 ( -2.617 -0.393 -0.997) 2.827 11.368 ( 6.497 -5.177 -3.511) 9.019 11.454 ( -0.507 -2.537 -22.120) 22.271 11.677 ( -3.736 -2.563 -24.292) 24.710 12.177 ( 2.642 -19.219 8.445) 21.158 12.360 ( -5.608 3.658 -5.283) 8.529 13.052 ( 0.205 9.156 -3.983) 9.987 13.178 ( 1.930 1.599 7.317) 7.734 13.535 ( 9.233 2.848 1.941) 9.855 13.600 ( -7.976 -0.826 8.419) 11.627 13.920 ( 5.825 -6.752 2.470) 9.253 14.609 ( -6.497 0.195 1.835) 6.754 15.112 ( -2.259 0.220 18.253) 18.393 16.260 ( 6.411 1.737 4.450) 7.995 16.854 ( 3.299 -1.952 -1.456) 4.101 17.411 ( -5.222 9.049 0.586) 10.464 17.637 ( 1.373 1.086 -1.414) 2.251 20.184 ( -7.860 1.356 12.030) 14.434 20.262 ( 6.243 6.667 6.538) 11.232 20.629 ( 6.798 -2.776 3.013) 7.937 20.887 ( 5.840 -8.045 2.247) 10.192 22.465 ( 7.848 4.634 -1.217) 9.195 22.730 ( -2.677 -0.437 -8.933) 9.335 22.995 ( -6.018 -0.266 4.308) 7.406 23.228 ( -8.045 2.358 -7.910) 11.526 24.321 ( 0.545 2.416 0.780) 2.597 24.627 ( -4.062 2.343 4.612) 6.577 24.716 ( 5.903 -0.785 -1.884) 6.246 25.078 ( -3.591 -11.163 -8.082) 14.242 ======================= Grid point 249 (127/186) ======================= q-point: (-0.25 -0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.271 ( -17.657 -0.000 27.033) 32.289 2.793 ( -29.358 -0.000 21.648) 36.476 3.972 ( -13.767 -0.000 16.877) 21.780 3.996 ( -5.672 -0.000 9.874) 11.387 4.151 ( -11.376 -0.000 19.661) 22.715 4.661 ( 12.075 0.000 1.663) 12.189 4.787 ( 6.955 0.000 6.425) 9.468 5.363 ( 5.084 0.000 1.335) 5.256 5.535 ( 1.061 0.000 1.566) 1.891 5.580 ( -5.208 -0.000 -1.706) 5.480 5.668 ( -10.227 -0.000 0.325) 10.233 5.909 ( 15.353 0.000 -7.166) 16.943 6.292 ( -1.253 -0.000 19.403) 19.443 6.776 ( 8.011 0.000 -15.834) 17.745 7.157 ( -10.878 -0.000 -7.750) 13.356 7.278 ( 3.822 0.000 -16.819) 17.248 7.318 ( 1.736 0.000 -28.322) 28.375 7.461 ( -7.423 -0.000 -5.403) 9.182 7.870 ( -0.281 -0.000 -0.005) 0.281 8.097 ( -4.548 -0.000 -12.704) 13.493 8.255 ( -8.804 -0.000 -17.005) 19.149 8.607 ( -3.566 -0.000 5.474) 6.533 8.785 ( -7.825 -0.000 -3.149) 8.435 9.039 ( 19.437 0.000 24.052) 30.924 9.503 ( -6.389 -0.000 1.759) 6.627 9.553 ( 4.385 0.000 3.415) 5.558 9.966 ( 8.373 0.000 -0.498) 8.387 10.187 ( -3.128 -0.000 -1.582) 3.505 10.565 ( 2.521 0.000 -9.694) 10.017 10.657 ( 9.814 0.000 -7.946) 12.627 11.147 ( 2.166 0.000 3.554) 4.162 11.174 ( 5.035 0.000 0.980) 5.129 11.333 ( 5.783 0.000 10.464) 11.956 11.477 ( -7.404 -0.000 -10.963) 13.229 11.637 ( -3.943 -0.000 -30.386) 30.641 11.648 ( -0.317 -0.000 2.510) 2.530 12.431 ( -5.107 -0.000 -3.383) 6.126 13.190 ( 4.422 0.000 13.849) 14.538 13.271 ( -5.651 -0.000 -6.873) 8.898 13.493 ( 1.444 0.000 -4.602) 4.824 13.680 ( 7.063 0.000 10.685) 12.808 13.737 ( 4.473 0.000 0.927) 4.568 14.616 ( -5.162 -0.000 3.098) 6.020 15.115 ( -2.921 -0.000 20.276) 20.485 16.292 ( 7.142 0.000 2.560) 7.587 16.821 ( 3.850 0.000 -1.764) 4.234 17.559 ( -6.531 -0.000 -3.716) 7.514 17.648 ( 3.450 0.000 1.418) 3.730 20.203 ( -7.219 -0.000 14.391) 16.100 20.384 ( 4.367 0.000 -4.128) 6.009 20.650 ( 26.795 0.000 23.691) 35.766 20.688 ( -9.968 -0.000 -8.564) 13.142 22.566 ( 7.667 0.000 2.683) 8.123 22.679 ( 6.027 0.000 -8.693) 10.578 22.990 ( -5.804 -0.000 4.561) 7.381 23.317 ( -15.977 -0.000 -17.958) 24.036 24.379 ( 1.044 0.000 -0.650) 1.230 24.546 ( -0.019 -0.000 1.260) 1.260 24.761 ( 2.366 0.000 7.286) 7.661 24.908 ( -7.161 -0.000 -7.080) 10.070 ======================= Grid point 250 (128/186) ======================= q-point: (-0.12 -0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.242 ( -12.063 -12.953 30.226) 35.027 2.541 ( -26.636 -9.645 24.311) 37.330 3.802 ( -11.888 3.645 28.791) 31.362 3.943 ( -4.766 -0.290 10.656) 11.677 4.111 ( -8.310 -2.867 17.191) 19.308 4.762 ( 10.874 2.540 -2.759) 11.503 4.974 ( 1.757 -9.848 1.174) 10.072 5.353 ( 0.138 4.139 0.893) 4.236 5.477 ( -0.917 2.583 1.988) 3.386 5.597 ( -2.777 -1.682 4.972) 5.938 5.691 ( 3.756 -8.013 0.140) 8.851 6.030 ( 7.278 3.655 -9.679) 12.649 6.355 ( -2.385 -6.403 12.107) 13.902 6.730 ( 4.078 6.691 -14.010) 16.053 7.002 ( 1.941 5.413 -12.788) 14.022 7.111 ( -17.808 -1.656 -15.053) 23.377 7.280 ( 0.164 -1.740 -22.070) 22.139 7.549 ( 10.272 5.733 4.397) 12.559 7.834 ( -12.861 -2.607 -6.227) 14.525 7.988 ( -1.991 0.818 -8.111) 8.392 8.087 ( -1.635 1.990 -12.737) 12.995 8.588 ( -5.715 -4.459 -0.240) 7.253 8.681 ( 1.355 7.865 -1.152) 8.064 9.295 ( 13.108 2.806 18.349) 22.724 9.431 ( -9.747 -6.118 -1.054) 11.556 9.587 ( 1.222 3.612 0.366) 3.831 10.059 ( 6.827 1.942 -3.910) 8.103 10.190 ( -1.082 -6.727 1.377) 6.951 10.574 ( 5.468 3.626 -5.766) 8.735 10.739 ( 8.935 2.674 -9.984) 13.663 11.098 ( -1.757 6.093 6.252) 8.905 11.216 ( 2.488 7.108 11.106) 13.418 11.354 ( -1.638 1.769 -17.007) 17.177 11.392 ( 5.767 -2.547 -2.516) 6.788 11.532 ( -1.722 -3.747 -23.725) 24.080 11.909 ( 2.229 -21.890 7.361) 23.201 12.332 ( -6.156 2.016 -2.832) 7.069 13.117 ( -5.463 7.559 -8.103) 12.355 13.262 ( 2.534 0.542 10.957) 11.259 13.455 ( -6.692 -2.556 2.212) 7.497 13.742 ( 7.211 5.731 2.480) 9.540 13.930 ( 9.485 -7.498 3.937) 12.716 14.563 ( -3.015 1.212 3.951) 5.116 15.130 ( -2.025 0.069 19.385) 19.490 16.380 ( 6.923 1.326 2.796) 7.583 16.878 ( 4.488 -1.008 -2.532) 5.250 17.425 ( -7.251 5.100 -2.522) 9.216 17.649 ( -2.081 0.875 -3.428) 4.104 20.131 ( -7.655 1.004 11.943) 14.221 20.428 ( 6.864 3.644 -1.179) 7.861 20.571 ( -5.373 -1.902 -5.617) 8.002 21.131 ( 33.373 -1.572 19.744) 38.808 22.538 ( -19.584 4.964 -19.202) 27.873 22.652 ( 3.491 2.303 2.082) 4.672 22.916 ( -7.058 -0.156 3.810) 8.022 23.153 ( 0.088 -2.331 -4.034) 4.659 24.373 ( 2.206 2.688 -0.756) 3.559 24.583 ( -3.532 -3.045 1.690) 4.960 24.779 ( 4.870 0.224 -0.750) 4.933 24.891 ( -2.868 -6.532 -0.318) 7.141 ======================= Grid point 258 (129/186) ======================= q-point: (-0.12 -0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.118 ( -4.926 -0.000 35.996) 36.331 2.232 ( -18.736 -0.000 31.212) 36.404 3.774 ( -8.021 -0.000 41.413) 42.182 3.863 ( -7.796 -0.000 9.893) 12.596 4.040 ( -6.679 -0.000 12.951) 14.572 4.830 ( -0.771 -0.000 -11.406) 11.433 4.915 ( -0.072 -0.000 0.728) 0.732 5.414 ( -7.972 -0.000 -2.249) 8.283 5.477 ( 12.234 0.000 -2.589) 12.505 5.578 ( -0.636 -0.000 7.423) 7.450 5.761 ( 10.961 0.000 5.902) 12.449 6.032 ( -8.336 -0.000 -16.914) 18.857 6.288 ( -4.497 -0.000 11.470) 12.320 6.802 ( 8.807 0.000 -7.756) 11.735 6.846 ( -12.344 -0.000 -0.370) 12.349 7.118 ( 7.724 0.000 -21.543) 22.886 7.198 ( -2.877 -0.000 -19.441) 19.653 7.630 ( -9.859 -0.000 -4.246) 10.734 7.694 ( -1.686 -0.000 -7.616) 7.801 7.964 ( 3.994 0.000 1.645) 4.320 8.069 ( 5.094 0.000 -17.337) 18.070 8.493 ( -3.513 -0.000 3.488) 4.951 8.811 ( 6.981 0.000 -0.418) 6.994 9.217 ( -12.721 -0.000 -2.182) 12.907 9.493 ( 5.546 0.000 15.556) 16.515 9.620 ( -1.102 -0.000 -0.631) 1.270 10.045 ( -5.180 -0.000 -8.046) 9.569 10.231 ( 10.715 0.000 5.644) 12.110 10.682 ( 6.734 0.000 -1.298) 6.858 10.785 ( 1.196 0.000 -17.301) 17.343 11.038 ( -6.549 -0.000 -8.487) 10.720 11.296 ( -1.346 -0.000 3.959) 4.181 11.343 ( -0.371 -0.000 -32.523) 32.525 11.464 ( 7.614 0.000 11.669) 13.933 11.587 ( 7.887 0.000 11.240) 13.731 11.775 ( 8.114 0.000 4.109) 9.095 12.236 ( -9.140 -0.000 -1.436) 9.253 13.088 ( -5.292 -0.000 -3.991) 6.628 13.233 ( -7.517 -0.000 -6.140) 9.706 13.419 ( 0.999 0.000 14.088) 14.123 13.896 ( 4.668 0.000 4.204) 6.282 13.953 ( 4.523 0.000 -2.677) 5.255 14.585 ( 2.757 0.000 7.748) 8.224 15.164 ( 0.140 0.000 17.311) 17.311 16.483 ( 6.359 0.000 2.766) 6.935 16.929 ( 5.264 0.000 -3.417) 6.276 17.364 ( -6.502 -0.000 -3.007) 7.164 17.557 ( -11.200 -0.000 -6.711) 13.057 20.067 ( -7.551 -0.000 10.729) 13.120 20.464 ( -3.230 -0.000 -6.683) 7.422 20.577 ( 10.234 0.000 -1.210) 10.306 21.665 ( 37.615 0.000 16.256) 40.978 22.122 ( -35.809 -0.000 -21.246) 41.638 22.727 ( -0.894 -0.000 2.944) 3.077 22.850 ( -2.217 -0.000 4.928) 5.403 23.170 ( 5.805 0.000 -0.645) 5.841 24.437 ( 3.169 0.000 -2.756) 4.200 24.503 ( -3.597 -0.000 0.355) 3.615 24.809 ( -0.976 -0.000 4.217) 4.328 24.862 ( 5.925 0.000 -0.971) 6.004 ======================= Grid point 259 (130/186) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.953 ( 6.826 0.000 29.645) 30.421 3.024 ( 6.602 0.000 28.778) 29.526 3.890 ( -4.246 -0.000 7.001) 8.188 3.980 ( -2.779 -0.000 1.487) 3.151 4.331 ( -4.742 -0.000 -17.608) 18.236 4.338 ( 2.441 0.000 -7.612) 7.994 4.884 ( -7.304 -0.000 4.576) 8.619 5.236 ( -9.026 -0.000 -14.226) 16.848 5.333 ( -6.401 -0.000 19.904) 20.908 5.721 ( 9.366 0.000 -4.863) 10.554 5.808 ( -2.144 -0.000 9.293) 9.537 6.109 ( 5.059 0.000 -1.142) 5.186 6.583 ( -13.373 -0.000 16.757) 21.439 6.640 ( -4.925 -0.000 11.057) 12.104 6.916 ( 13.879 0.000 -15.840) 21.060 6.951 ( 10.125 0.000 10.971) 14.929 7.166 ( -2.549 -0.000 3.060) 3.983 7.298 ( 12.200 0.000 -11.681) 16.891 7.694 ( 10.783 0.000 -9.668) 14.483 7.799 ( -10.868 -0.000 -8.205) 13.618 7.898 ( 8.811 0.000 -5.708) 10.498 8.472 ( -5.854 -0.000 -21.479) 22.263 8.887 ( -7.021 -0.000 6.814) 9.784 9.024 ( 8.447 0.000 0.083) 8.448 9.573 ( -0.773 -0.000 1.759) 1.922 9.641 ( -11.199 -0.000 5.694) 12.564 9.870 ( 11.815 0.000 1.832) 11.956 10.147 ( -14.165 -0.000 -15.235) 20.803 10.469 ( -0.053 -0.000 -5.631) 5.632 10.604 ( 0.822 0.000 -19.470) 19.487 10.850 ( -11.665 -0.000 8.724) 14.567 10.982 ( 15.143 0.000 0.937) 15.172 11.291 ( 6.134 0.000 -5.702) 8.375 11.481 ( -1.899 -0.000 -13.375) 13.510 12.155 ( 5.443 0.000 14.441) 15.433 12.179 ( -3.473 -0.000 11.566) 12.076 12.575 ( 13.378 0.000 17.268) 21.844 12.784 ( -8.242 -0.000 -8.465) 11.815 12.892 ( 1.585 0.000 0.366) 1.626 13.542 ( -10.682 -0.000 -15.309) 18.667 13.838 ( 1.166 0.000 8.370) 8.451 14.000 ( -0.967 -0.000 0.994) 1.387 15.056 ( 10.387 0.000 10.591) 14.835 15.306 ( -7.477 -0.000 -0.363) 7.485 16.664 ( -3.418 -0.000 4.554) 5.694 16.908 ( 0.731 0.000 -5.792) 5.838 17.070 ( -11.080 -0.000 3.332) 11.570 17.214 ( 3.482 0.000 -3.369) 4.845 20.098 ( -6.240 -0.000 7.719) 9.926 20.348 ( 5.438 0.000 -4.972) 7.368 20.946 ( 17.622 0.000 1.397) 17.677 20.986 ( -26.520 -0.000 -0.887) 26.535 22.513 ( -13.592 -0.000 0.347) 13.597 22.587 ( 21.651 0.000 -3.341) 21.907 23.094 ( 1.811 0.000 7.106) 7.333 23.280 ( 0.981 0.000 -1.852) 2.096 24.356 ( -5.097 -0.000 -0.866) 5.170 24.400 ( 1.819 0.000 -3.266) 3.738 24.815 ( -6.714 -0.000 4.605) 8.141 25.058 ( 12.980 0.000 -6.909) 14.704 ======================= Grid point 260 (131/186) ======================= q-point: ( 0.12 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.138 ( 11.315 -0.740 25.770) 28.155 3.246 ( 7.953 -6.472 22.106) 24.369 3.854 ( -4.269 0.935 7.260) 8.473 3.984 ( -0.925 -3.918 3.795) 5.532 4.273 ( 0.098 -3.073 -15.171) 15.480 4.389 ( 4.047 -3.648 -12.003) 13.182 4.800 ( -5.386 2.939 8.099) 10.161 5.108 ( -3.157 -0.135 -6.532) 7.256 5.360 ( -6.197 -6.173 16.220) 18.428 5.776 ( -3.794 1.365 4.179) 5.807 5.816 ( 0.709 -3.536 -1.923) 4.087 6.207 ( 6.708 -5.512 -5.676) 10.373 6.392 ( -14.406 1.067 5.947) 15.622 6.714 ( 4.131 -0.520 18.331) 18.798 6.919 ( 5.252 7.872 -3.221) 9.996 7.151 ( 4.954 -0.332 -0.557) 4.996 7.201 ( 10.606 -5.269 4.712) 12.746 7.449 ( 12.100 0.533 -5.618) 13.352 7.623 ( -2.727 4.253 -10.846) 11.965 7.795 ( 2.161 0.526 -15.797) 15.953 7.999 ( 8.090 1.242 -0.122) 8.186 8.334 ( -2.279 0.557 -23.878) 23.993 8.848 ( -5.094 -3.689 3.927) 7.415 9.120 ( 7.253 1.460 -0.085) 7.399 9.421 ( -12.079 7.630 5.234) 15.216 9.578 ( -1.148 1.060 4.264) 4.542 9.926 ( -11.634 -0.494 -11.894) 16.646 10.087 ( 10.238 -4.911 7.023) 13.352 10.422 ( -3.286 3.319 -3.251) 5.691 10.540 ( -4.681 -0.960 -11.955) 12.875 10.740 ( -4.495 -1.464 -5.891) 7.554 11.141 ( 5.465 -0.875 1.807) 5.822 11.359 ( 8.440 0.674 -4.143) 9.426 11.459 ( 0.087 -2.261 -12.768) 12.967 12.036 ( 1.245 12.016 12.800) 17.600 12.340 ( 0.303 0.734 -0.919) 1.214 12.542 ( -1.525 2.790 7.522) 8.167 12.859 ( 1.518 -10.877 -0.962) 11.024 13.000 ( 8.166 -1.446 16.835) 18.767 13.331 ( -12.308 1.825 -18.767) 22.517 13.880 ( 1.481 -0.834 8.308) 8.480 13.987 ( -2.897 -1.077 0.290) 3.104 15.150 ( -11.963 2.644 -3.182) 12.658 15.191 ( 7.445 1.675 9.618) 12.277 16.559 ( -10.518 1.983 7.378) 13.000 16.870 ( -1.593 0.658 -4.054) 4.405 17.035 ( -2.131 -3.559 5.553) 6.931 17.300 ( 7.624 -1.696 -2.638) 8.244 20.057 ( -3.169 -0.448 7.498) 8.152 20.428 ( 8.814 0.646 -4.301) 9.829 20.680 ( -20.358 -0.287 2.815) 20.554 21.184 ( 16.973 0.444 3.473) 17.330 22.315 ( -13.819 1.788 -2.511) 14.159 22.779 ( 15.934 5.760 -4.417) 17.510 23.130 ( -0.734 -2.444 5.639) 6.189 23.259 ( -4.617 -0.911 -3.276) 5.734 24.292 ( -4.321 0.168 0.406) 4.343 24.424 ( 2.654 -0.637 -1.916) 3.335 24.746 ( -7.081 -1.292 3.122) 7.846 25.206 ( 12.176 0.211 -9.510) 15.451 ======================= Grid point 261 (132/186) ======================= q-point: ( 0.25 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.385 ( 11.468 -4.098 20.556) 23.892 3.490 ( 8.234 -6.280 15.728) 18.831 3.790 ( -5.074 1.558 7.953) 9.562 4.066 ( 1.607 -4.951 5.248) 7.392 4.350 ( 4.687 -6.511 -8.899) 11.982 4.476 ( 6.281 -3.635 -12.599) 14.540 4.642 ( -8.376 9.679 6.622) 14.412 5.206 ( 9.136 -8.532 2.078) 12.673 5.398 ( -7.427 -7.662 11.193) 15.464 5.669 ( -7.725 3.559 2.163) 8.777 5.837 ( -6.738 -5.862 -0.299) 8.936 6.222 ( -9.746 0.861 5.506) 11.226 6.388 ( 6.820 -5.293 -9.524) 12.854 6.780 ( 1.351 1.816 5.226) 5.695 6.874 ( 5.182 5.262 -2.938) 7.949 7.268 ( 8.638 2.333 -4.823) 10.164 7.342 ( 2.843 -3.095 5.818) 7.177 7.443 ( 1.873 9.350 -9.974) 13.799 7.620 ( 6.055 3.743 8.919) 11.411 7.798 ( 5.662 -4.204 0.570) 7.075 8.000 ( -1.818 -1.802 -23.152) 23.293 8.329 ( 5.559 0.438 -8.887) 10.491 8.813 ( -8.763 0.179 -4.597) 9.898 9.171 ( 1.346 1.519 3.385) 3.946 9.217 ( -0.796 2.560 -0.547) 2.736 9.562 ( 1.589 3.923 7.329) 8.464 9.781 ( -8.710 -3.492 -10.277) 13.916 10.253 ( -8.538 4.194 1.706) 9.664 10.312 ( 4.116 -4.974 10.967) 12.726 10.510 ( 0.683 -3.269 -7.956) 8.628 10.750 ( 5.619 -0.894 -15.763) 16.759 11.174 ( -2.974 -3.525 0.770) 4.676 11.431 ( 0.268 0.810 -9.374) 9.412 11.488 ( 7.927 -0.514 -4.303) 9.034 11.928 ( 1.555 10.663 10.024) 14.717 12.103 ( -4.784 14.867 -9.353) 18.205 12.678 ( 0.152 -8.136 10.389) 13.197 12.984 ( 0.745 -7.663 -1.705) 7.886 13.099 ( -11.259 2.255 -17.101) 20.599 13.201 ( 11.037 -1.181 19.991) 22.866 13.933 ( -1.112 -1.388 1.929) 2.623 13.957 ( -1.982 -1.102 4.532) 5.068 14.914 ( -15.241 2.549 -4.957) 16.228 15.272 ( 5.703 2.444 9.104) 11.017 16.434 ( -6.839 1.973 10.230) 12.463 16.846 ( -1.407 -1.123 -3.429) 3.873 17.089 ( -0.902 -4.371 5.164) 6.825 17.418 ( 7.303 -1.393 -1.822) 7.655 20.068 ( 0.051 -1.481 7.595) 7.738 20.453 ( -11.154 -0.285 1.162) 11.218 20.558 ( 7.775 0.161 0.141) 7.778 21.345 ( 9.021 4.857 5.406) 11.584 22.134 ( -7.186 0.379 -5.736) 9.203 22.828 ( 6.944 7.137 -3.435) 10.533 23.173 ( -0.433 -3.115 2.129) 3.797 23.181 ( -7.207 -1.027 -2.717) 7.770 24.254 ( -2.419 -0.947 1.759) 3.137 24.478 ( 3.412 -1.454 -1.019) 3.846 24.682 ( -6.830 -1.886 2.505) 7.515 25.299 ( 8.579 2.640 -10.928) 14.142 ======================= Grid point 262 (133/186) ======================= q-point: ( 0.38 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.567 ( 0.339 2.973 15.486) 15.772 3.683 ( 3.510 -6.067 16.633) 18.050 3.796 ( 5.315 -3.810 5.247) 8.385 4.183 ( 4.023 -2.532 9.802) 10.894 4.334 ( -10.529 12.343 8.124) 18.144 4.500 ( 5.876 -0.865 -2.119) 6.306 4.618 ( 7.620 -9.070 -17.223) 20.904 5.441 ( -2.253 -2.922 0.192) 3.695 5.474 ( -4.997 -8.781 5.491) 11.499 5.586 ( 9.320 -6.036 6.512) 12.872 5.820 ( -7.517 -4.977 1.537) 9.145 6.152 ( -3.705 -2.211 5.687) 7.138 6.402 ( 1.424 8.736 -5.720) 10.539 6.715 ( -3.932 3.248 -5.478) 7.485 6.861 ( 1.522 8.287 -7.436) 11.238 7.178 ( -4.240 3.334 1.027) 5.491 7.321 ( 2.424 0.701 -8.285) 8.661 7.560 ( 2.992 -2.042 7.335) 8.181 7.591 ( 8.416 10.607 0.453) 13.547 7.852 ( -3.102 -4.645 -2.970) 6.326 8.120 ( 8.739 -9.272 -7.444) 14.756 8.367 ( 0.279 -3.487 -1.925) 3.993 8.545 ( -15.823 8.540 -11.384) 21.281 9.168 ( -1.268 -1.744 -0.601) 2.239 9.332 ( 13.357 -1.094 -2.074) 13.561 9.551 ( 3.182 3.863 7.941) 9.387 9.784 ( 0.516 -7.058 -3.879) 8.070 10.079 ( -10.196 0.244 3.147) 10.674 10.409 ( 0.124 -3.156 0.425) 3.187 10.625 ( 7.548 -2.774 4.287) 9.113 10.777 ( 3.670 0.730 -15.612) 16.055 11.208 ( -1.297 -4.942 2.468) 5.674 11.351 ( -5.191 3.042 -15.424) 16.556 11.475 ( -1.709 8.740 -6.240) 10.874 11.804 ( 4.375 11.031 2.407) 12.109 11.968 ( 3.035 0.497 2.335) 3.861 12.698 ( -6.478 -1.429 -10.156) 12.130 12.908 ( -8.023 2.894 -4.866) 9.819 13.144 ( 5.606 -7.420 9.389) 13.215 13.395 ( 9.377 -1.115 14.190) 17.045 13.860 ( -6.545 1.180 -3.030) 7.308 14.017 ( 2.170 -1.849 6.638) 7.225 14.695 ( -12.696 0.234 -4.164) 13.363 15.319 ( 2.843 1.703 8.177) 8.823 16.381 ( -1.704 1.447 10.271) 10.511 16.842 ( -0.766 -1.411 -3.309) 3.678 17.149 ( -1.795 -4.913 3.960) 6.560 17.510 ( 5.042 -0.717 -1.813) 5.406 20.135 ( 2.871 -2.552 7.140) 8.107 20.329 ( -10.603 -2.304 3.482) 11.395 20.694 ( 13.608 1.563 0.739) 13.717 21.266 ( -5.488 9.299 2.388) 11.059 22.143 ( 6.457 -2.985 -4.087) 8.204 22.742 ( -6.087 3.994 -4.782) 8.710 23.110 ( -5.167 -0.914 0.054) 5.247 23.214 ( 2.482 -0.392 0.043) 2.513 24.264 ( -0.777 -2.381 2.412) 3.477 24.514 ( -0.076 0.010 -1.528) 1.530 24.664 ( -2.298 -4.189 3.254) 5.780 25.298 ( 4.584 5.893 -10.654) 13.010 ======================= Grid point 263 (134/186) ======================= q-point: (-0.50 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.444 ( -6.232 10.972 19.069) 22.866 3.787 ( -8.498 6.382 10.615) 15.021 3.897 ( -3.629 -4.527 10.475) 11.974 4.048 ( 2.113 7.484 13.748) 15.795 4.332 ( 1.759 -5.734 2.789) 6.615 4.590 ( 11.383 3.645 -1.224) 12.015 4.818 ( 5.157 -12.388 -18.208) 22.618 5.354 ( -5.233 0.189 0.733) 5.287 5.567 ( -2.970 -8.976 4.615) 10.521 5.790 ( -4.465 -1.519 3.684) 5.984 5.901 ( 14.502 -4.152 2.183) 15.242 6.154 ( 4.036 14.649 0.686) 15.210 6.290 ( -1.156 -6.347 7.720) 10.061 6.550 ( -4.155 10.233 -10.048) 14.931 6.694 ( -3.521 4.529 -0.603) 5.768 7.166 ( -5.135 -5.440 -1.470) 7.624 7.242 ( -4.889 9.110 3.409) 10.886 7.448 ( -2.430 -0.199 -18.866) 19.023 7.763 ( 11.500 -1.409 3.258) 12.035 7.897 ( -1.980 -3.311 6.701) 7.733 8.066 ( -15.599 5.452 -5.846) 17.528 8.369 ( -1.687 -4.224 -2.608) 5.243 8.480 ( 8.063 -4.960 -10.229) 13.938 9.184 ( 0.038 -2.828 -1.689) 3.294 9.456 ( 2.408 -1.810 -5.809) 6.543 9.574 ( 2.832 1.905 7.745) 8.463 9.856 ( 1.467 1.864 -1.932) 3.059 10.138 ( 6.222 -12.725 4.343) 14.816 10.458 ( 1.211 -2.946 -0.690) 3.259 10.671 ( 3.053 7.027 -0.403) 7.672 10.802 ( 1.705 -1.805 -6.295) 6.767 11.108 ( -7.289 5.958 -15.583) 18.206 11.280 ( 1.263 -0.876 2.274) 2.744 11.329 ( -2.768 2.929 -9.958) 10.743 11.751 ( 6.388 9.621 6.882) 13.444 12.070 ( 2.529 -5.970 -0.116) 6.484 12.577 ( -7.426 -1.261 -18.693) 20.154 12.782 ( -2.775 4.751 5.049) 7.468 13.346 ( 5.994 -5.806 12.448) 14.987 13.535 ( 5.301 -0.825 8.326) 9.904 13.729 ( -7.599 2.771 -3.557) 8.836 14.086 ( 4.400 0.053 3.680) 5.736 14.568 ( -7.201 -1.713 -1.661) 7.586 15.343 ( -0.368 -0.132 7.735) 7.745 16.393 ( 1.956 0.584 8.671) 8.908 16.847 ( 0.810 -0.361 -3.589) 3.697 17.194 ( -3.525 -5.349 2.209) 6.776 17.558 ( 2.114 -0.226 -2.616) 3.371 20.239 ( 4.250 -2.793 5.011) 7.140 20.257 ( -7.552 -3.140 4.075) 9.138 20.829 ( 6.195 4.703 3.208) 8.413 21.084 ( 1.574 4.189 -0.387) 4.492 22.280 ( 4.610 -2.964 -3.499) 6.502 22.574 ( -9.742 0.457 -3.810) 10.470 23.057 ( -5.992 -0.938 2.665) 6.625 23.248 ( 5.808 3.046 -1.051) 6.642 24.299 ( 0.393 -1.642 1.891) 2.535 24.495 ( -3.476 -2.688 -1.187) 4.551 24.730 ( 2.086 -2.958 2.544) 4.424 25.212 ( 1.503 8.144 -8.423) 11.812 ======================= Grid point 264 (135/186) ======================= q-point: (-0.38 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.226 ( -7.221 15.024 23.851) 29.099 3.404 ( -17.836 16.407 20.006) 31.425 3.971 ( -2.872 -5.194 8.667) 10.505 4.079 ( 2.457 2.027 5.870) 6.678 4.397 ( -0.566 -1.607 2.224) 2.802 4.670 ( 7.572 2.801 -8.117) 11.449 4.962 ( -1.488 -9.030 -12.794) 15.730 5.358 ( 2.193 -2.359 0.671) 3.289 5.592 ( -2.114 1.094 0.583) 2.451 5.760 ( -2.112 4.032 12.392) 13.201 5.977 ( 1.666 10.772 9.269) 14.308 6.068 ( 7.141 1.534 -11.368) 13.512 6.309 ( -0.012 2.898 7.551) 8.088 6.545 ( 6.568 -4.926 -6.465) 10.450 6.654 ( -1.396 -3.323 2.895) 4.623 7.040 ( -6.590 6.072 0.004) 8.961 7.143 ( -4.662 1.126 -3.624) 6.011 7.353 ( -5.805 -0.320 -10.212) 11.751 7.715 ( -14.633 -4.402 -0.086) 15.281 7.907 ( -1.104 3.613 -3.785) 5.348 8.079 ( 15.127 -1.864 7.916) 17.175 8.435 ( 0.587 -7.330 -1.002) 7.421 8.530 ( -1.710 1.212 -11.830) 12.015 9.261 ( 0.602 -8.337 -1.623) 8.515 9.426 ( -6.920 -0.531 -6.684) 9.636 9.608 ( 0.280 -1.832 9.387) 9.568 9.847 ( 4.521 2.948 -8.845) 10.362 10.376 ( 4.065 -5.247 -2.281) 7.018 10.468 ( 1.357 5.494 -4.617) 7.304 10.643 ( 5.960 1.340 8.565) 10.520 10.771 ( 2.766 2.015 -21.409) 21.680 11.048 ( -4.844 -4.029 -5.459) 8.336 11.214 ( 2.626 0.916 1.884) 3.359 11.346 ( 1.198 -1.774 -2.108) 3.004 11.725 ( 4.665 7.160 8.451) 12.019 12.144 ( -1.965 -3.765 0.362) 4.262 12.473 ( -3.640 -0.242 -12.671) 13.186 12.745 ( 1.364 1.495 5.125) 5.510 13.458 ( -1.899 4.124 2.911) 5.394 13.579 ( 1.021 -3.389 3.525) 4.995 13.649 ( -0.951 -1.735 4.149) 4.597 14.133 ( 4.563 3.096 -0.506) 5.537 14.555 ( 0.665 -2.770 2.713) 3.934 15.355 ( -2.732 -2.004 7.359) 8.102 16.452 ( 3.951 -0.582 6.599) 7.714 16.855 ( 2.681 1.052 -4.186) 5.081 17.214 ( -5.326 -5.180 0.325) 7.437 17.554 ( -1.590 0.390 -3.912) 4.241 20.220 ( -6.533 -3.616 4.547) 8.742 20.350 ( 5.400 -1.742 1.587) 5.892 20.683 ( -6.270 7.949 0.110) 10.125 21.296 ( 20.630 -5.617 3.421) 21.653 22.167 ( -19.366 0.240 -7.684) 20.836 22.599 ( 6.390 -3.704 2.563) 7.817 22.991 ( -6.636 -0.545 3.857) 7.695 23.271 ( 6.981 5.435 -0.968) 8.900 24.321 ( 1.256 0.038 -0.306) 1.293 24.506 ( -4.700 -5.895 0.039) 7.540 24.791 ( 4.617 0.978 -0.636) 4.762 25.088 ( -0.809 7.296 -3.216) 8.014 ======================= Grid point 265 (136/186) ======================= q-point: (-0.25 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.961 ( -10.882 12.164 28.438) 32.788 3.097 ( -5.488 13.967 27.269) 31.126 3.994 ( -3.869 -1.545 6.130) 7.412 4.063 ( -1.475 2.010 2.681) 3.661 4.389 ( -1.250 1.168 1.266) 2.128 4.628 ( -2.011 4.018 -15.095) 15.749 4.982 ( -4.814 -3.539 -2.377) 6.431 5.408 ( -0.021 -0.889 -1.050) 1.375 5.555 ( 0.353 1.113 -8.118) 8.201 5.680 ( -2.188 6.838 12.817) 14.691 5.880 ( -2.737 6.213 13.763) 15.347 6.029 ( 4.916 7.369 -5.121) 10.232 6.469 ( 6.752 -11.740 -0.495) 13.552 6.636 ( 10.231 -1.052 -9.962) 14.319 6.677 ( -2.641 2.527 13.774) 14.251 6.930 ( -7.502 -0.693 3.389) 8.261 7.036 ( 1.637 6.226 -3.962) 7.559 7.334 ( -3.020 -6.258 -6.644) 9.613 7.670 ( -5.951 -7.394 0.945) 9.539 7.763 ( -4.142 7.448 -9.125) 12.486 8.220 ( 2.711 8.902 -0.743) 9.335 8.463 ( -0.206 -4.634 -1.111) 4.770 8.591 ( 4.716 -10.056 -1.539) 11.213 9.274 ( -9.167 3.699 -5.632) 11.378 9.406 ( 0.972 -9.882 -1.721) 10.077 9.678 ( -1.742 -5.075 8.666) 10.192 9.816 ( 2.530 3.487 -15.233) 15.830 10.387 ( 2.421 1.982 1.575) 3.504 10.461 ( 5.144 2.184 -10.792) 12.153 10.665 ( 1.445 3.094 -12.981) 13.423 10.787 ( -0.037 -2.846 -5.283) 6.001 10.951 ( 1.321 4.732 -5.405) 7.304 11.295 ( -5.983 -3.735 1.870) 7.297 11.461 ( 11.671 -3.810 0.299) 12.281 11.735 ( 1.804 -1.951 9.851) 10.203 12.164 ( 1.319 0.191 11.050) 11.130 12.422 ( -0.346 1.934 -3.714) 4.201 12.767 ( 0.003 -1.512 1.068) 1.852 13.274 ( -6.511 8.739 -6.669) 12.776 13.675 ( -1.039 -1.659 2.478) 3.158 13.702 ( 1.882 -5.871 6.001) 8.604 14.102 ( 0.656 5.032 -2.696) 5.746 14.676 ( 8.978 -2.981 6.796) 11.648 15.364 ( -3.721 -2.792 6.168) 7.725 16.539 ( 4.666 -1.611 5.199) 7.169 16.867 ( 3.977 1.661 -5.218) 6.768 17.202 ( -6.458 -4.345 -0.951) 7.842 17.477 ( -6.395 2.025 -4.941) 8.332 20.203 ( -5.960 -3.249 5.742) 8.891 20.385 ( -2.445 1.507 -2.427) 3.760 20.589 ( 7.413 3.131 0.237) 8.050 21.639 ( -0.089 -9.601 -7.332) 12.081 21.907 ( -1.300 1.907 3.861) 4.499 22.713 ( -1.918 -4.328 2.212) 5.225 22.951 ( 0.188 -0.157 6.007) 6.013 23.273 ( 6.168 6.003 -0.751) 8.640 24.341 ( 2.065 -0.579 -2.325) 3.163 24.501 ( -6.104 -2.695 -0.570) 6.697 24.836 ( 8.343 2.832 -4.077) 9.708 24.985 ( -3.460 3.716 3.236) 6.021 ======================= Grid point 266 (137/186) ======================= q-point: (-0.12 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.841 ( -2.045 2.661 32.108) 32.283 2.975 ( 1.832 10.142 29.727) 31.462 3.947 ( -5.427 0.846 6.113) 8.218 4.020 ( -2.262 1.055 0.968) 2.677 4.351 ( -0.343 1.938 -2.483) 3.169 4.475 ( -5.747 3.379 -17.100) 18.354 4.947 ( -5.636 -1.429 3.491) 6.782 5.349 ( -9.901 -3.130 -5.916) 11.951 5.487 ( -8.466 6.661 3.097) 11.209 5.619 ( 9.755 4.135 -1.260) 10.669 5.815 ( -2.532 1.480 11.911) 12.266 6.048 ( 7.446 2.764 0.683) 7.972 6.620 ( -4.176 2.698 19.716) 20.333 6.686 ( 8.586 -7.378 -4.888) 12.331 6.813 ( -15.772 -2.169 4.569) 16.563 6.848 ( 15.582 -0.455 -7.374) 17.245 7.030 ( 10.005 1.912 3.669) 10.826 7.337 ( -5.319 -2.129 -10.268) 11.758 7.620 ( 5.349 5.905 -5.753) 9.827 7.768 ( 2.488 -7.368 -4.886) 9.184 8.017 ( -9.260 6.745 -6.370) 13.108 8.534 ( 0.373 -2.317 -9.102) 9.399 8.809 ( 5.341 -9.618 2.603) 11.305 9.078 ( -6.034 7.504 -1.557) 9.754 9.530 ( -0.269 -6.582 0.213) 6.591 9.715 ( -5.822 -3.734 6.408) 9.429 9.783 ( 5.517 2.714 -9.750) 11.527 10.353 ( -7.618 1.482 -13.717) 15.760 10.460 ( 1.145 -0.802 -0.756) 1.589 10.626 ( 2.797 0.573 -18.032) 18.257 10.801 ( 7.960 0.283 -4.269) 9.037 10.950 ( 0.604 2.977 5.757) 6.509 11.255 ( -2.195 -1.495 -3.452) 4.355 11.539 ( 2.082 2.348 -9.965) 10.448 11.924 ( 2.977 -12.460 13.599) 18.683 12.248 ( 4.064 2.436 18.413) 19.013 12.389 ( 6.011 4.694 9.202) 11.952 12.792 ( -2.644 -5.330 -3.227) 6.768 13.047 ( -5.240 9.654 -8.618) 13.961 13.661 ( -5.690 -2.316 -6.421) 8.887 13.795 ( 0.907 -2.385 6.511) 6.993 14.029 ( -0.307 3.792 -0.546) 3.843 14.872 ( 11.607 -1.972 9.352) 15.036 15.360 ( -4.558 -2.145 3.528) 6.150 16.632 ( 3.334 -1.626 4.912) 6.156 16.888 ( 3.933 0.675 -6.341) 7.492 17.171 ( -6.855 -3.954 -0.860) 7.960 17.308 ( -9.213 4.840 -4.194) 11.220 20.166 ( -7.568 -1.197 8.115) 11.161 20.324 ( 0.659 1.161 -5.391) 5.554 20.728 ( 14.646 -0.003 0.266) 14.648 21.366 ( -29.434 -0.407 -6.436) 30.132 22.236 ( 25.991 -4.929 2.099) 26.537 22.661 ( -11.339 -2.016 1.469) 11.611 23.027 ( 5.161 -0.598 7.367) 9.015 23.269 ( 4.384 3.672 -0.987) 5.803 24.376 ( 2.127 -1.102 -3.493) 4.236 24.432 ( -5.550 0.418 -1.448) 5.751 24.898 ( -5.528 1.942 5.296) 7.898 24.923 ( 10.774 1.082 -4.860) 11.869 ======================= Grid point 268 (138/186) ======================= q-point: ( 0.12 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.351 ( 12.237 0.000 14.927) 19.302 3.364 ( 10.038 0.000 19.004) 21.492 3.856 ( -2.089 -0.000 7.343) 7.634 3.927 ( -2.061 -0.000 3.623) 4.168 4.227 ( 3.419 0.000 -16.390) 16.742 4.425 ( 9.023 0.000 -8.069) 12.104 4.846 ( 3.328 0.000 15.132) 15.494 5.056 ( -1.714 -0.000 -3.304) 3.722 5.288 ( -5.864 -0.000 17.527) 18.482 5.746 ( -4.526 -0.000 0.170) 4.529 5.748 ( -6.455 -0.000 0.737) 6.497 6.221 ( 5.747 0.000 -8.468) 10.234 6.247 ( -10.527 -0.000 3.805) 11.194 6.850 ( 8.448 0.000 18.576) 20.406 6.918 ( -5.996 -0.000 -10.252) 11.876 7.295 ( 11.220 0.000 -13.181) 17.310 7.323 ( 10.079 0.000 26.950) 28.773 7.470 ( 1.391 0.000 -5.376) 5.553 7.700 ( 8.495 0.000 -15.101) 17.326 7.793 ( 3.520 0.000 -24.315) 24.569 8.156 ( 7.094 0.000 0.739) 7.133 8.243 ( 0.902 0.000 -17.685) 17.708 8.706 ( -10.313 -0.000 2.788) 10.683 9.260 ( 1.555 0.000 3.609) 3.930 9.292 ( -8.033 -0.000 0.687) 8.062 9.613 ( 2.206 0.000 8.347) 8.634 9.740 ( -9.390 -0.000 -12.374) 15.534 10.198 ( 5.402 0.000 14.434) 15.412 10.387 ( -11.171 -0.000 -1.786) 11.313 10.429 ( -0.290 -0.000 -5.850) 5.858 10.692 ( 5.043 0.000 -18.883) 19.545 11.114 ( -6.311 -0.000 -3.811) 7.372 11.439 ( 5.624 0.000 -5.894) 8.147 11.512 ( 9.874 0.000 -6.503) 11.823 12.190 ( -0.496 -0.000 11.755) 11.765 12.360 ( 5.321 0.000 9.975) 11.305 12.520 ( -10.478 -0.000 1.498) 10.585 12.747 ( 2.399 0.000 -7.189) 7.578 13.124 ( -12.723 -0.000 -22.597) 25.933 13.200 ( 12.484 0.000 22.522) 25.751 13.907 ( 1.055 0.000 6.551) 6.636 13.938 ( -4.025 -0.000 1.008) 4.149 14.954 ( -18.084 -0.000 -5.021) 18.768 15.312 ( 5.150 0.000 9.957) 11.209 16.465 ( -8.191 -0.000 10.432) 13.264 16.811 ( -4.299 -0.000 -4.710) 6.377 17.037 ( 1.909 0.000 7.291) 7.536 17.401 ( 9.191 0.000 -1.457) 9.306 20.048 ( -0.398 -0.000 7.735) 7.745 20.444 ( -16.153 -0.000 3.622) 16.554 20.564 ( 12.505 0.000 -4.084) 13.155 21.413 ( 13.296 0.000 6.935) 14.996 22.148 ( -10.819 -0.000 -5.485) 12.130 22.998 ( 11.768 0.000 -6.862) 13.622 23.065 ( -6.367 -0.000 4.194) 7.624 23.163 ( -7.414 -0.000 -3.426) 8.167 24.249 ( -2.770 -0.000 1.673) 3.236 24.445 ( 2.223 0.000 -0.787) 2.358 24.658 ( -6.155 -0.000 3.054) 6.871 25.335 ( 10.663 0.000 -11.657) 15.798 ======================= Grid point 269 (139/186) ======================= q-point: ( 0.25 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.524 ( 9.969 -1.088 10.160) 14.275 3.584 ( 11.061 -3.711 12.172) 16.860 3.791 ( -3.501 3.672 6.796) 8.481 3.992 ( -0.470 -7.655 3.719) 8.523 4.293 ( 6.529 -5.542 -15.467) 17.680 4.570 ( 14.016 -0.293 -3.163) 14.371 4.797 ( -0.012 15.726 12.522) 20.103 5.192 ( 7.600 -11.550 7.584) 15.769 5.268 ( -6.266 -3.766 14.068) 15.854 5.627 ( -8.851 3.307 0.603) 9.468 5.680 ( -6.048 -2.201 0.689) 6.473 6.141 ( -5.873 0.532 3.369) 6.792 6.337 ( 4.861 -8.088 -8.382) 12.622 6.781 ( -5.421 2.640 -8.861) 10.718 6.990 ( 5.920 1.661 5.335) 8.141 7.334 ( 3.622 1.850 -13.728) 14.318 7.471 ( 10.962 0.701 12.136) 16.369 7.532 ( -1.990 7.253 -14.698) 16.511 7.679 ( 4.488 -1.606 14.404) 15.172 7.874 ( 3.808 -6.647 -24.995) 26.143 8.041 ( 6.772 14.177 2.530) 15.914 8.319 ( -1.412 -2.246 -9.887) 10.236 8.622 ( -10.374 -4.131 -2.384) 11.418 9.075 ( -11.547 -2.072 5.012) 12.758 9.395 ( 10.986 3.579 1.931) 11.715 9.614 ( -2.268 0.940 -3.771) 4.499 9.681 ( 2.443 -1.031 4.240) 5.001 10.197 ( -8.700 5.985 0.427) 10.568 10.290 ( -0.629 -3.559 3.860) 5.288 10.459 ( 2.480 -5.173 -2.664) 6.325 10.783 ( 9.082 -3.059 -16.785) 19.328 11.033 ( -6.821 -4.258 -5.364) 9.666 11.462 ( 1.949 2.894 -7.666) 8.423 11.596 ( 6.818 2.238 -3.997) 8.214 12.115 ( -0.646 10.548 8.480) 13.549 12.246 ( -3.592 13.767 -0.523) 14.237 12.559 ( -1.640 -9.034 9.133) 12.951 12.871 ( 2.702 -10.478 -0.504) 10.832 12.910 ( -9.796 -0.453 -21.582) 23.706 13.397 ( 9.975 0.439 18.133) 20.700 13.876 ( -5.594 0.304 0.177) 5.605 13.950 ( 1.049 -1.966 5.421) 5.861 14.697 ( -17.937 -0.050 -3.441) 18.265 15.374 ( 2.253 1.427 9.029) 9.415 16.412 ( -3.250 0.633 11.167) 11.647 16.763 ( -3.801 -2.456 -4.483) 6.370 17.087 ( 1.885 -0.507 7.538) 7.786 17.509 ( 7.647 0.278 -1.095) 7.730 20.086 ( 2.369 -0.867 8.341) 8.715 20.279 ( -11.912 -1.044 4.097) 12.640 20.728 ( 14.752 0.679 -4.006) 15.302 21.470 ( -4.919 4.275 5.112) 8.282 22.088 ( 5.024 -0.990 -4.859) 7.059 22.888 ( -9.694 6.099 -2.816) 11.795 23.046 ( -9.568 -4.268 0.244) 10.480 23.181 ( 8.745 -1.039 -4.421) 9.854 24.228 ( -1.043 -0.014 2.502) 2.711 24.492 ( 2.530 -2.509 0.465) 3.594 24.592 ( -5.338 0.135 2.993) 6.121 25.410 ( 7.306 2.024 -12.879) 14.945 ======================= Grid point 270 (140/186) ======================= q-point: ( 0.38 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.668 ( -2.116 6.120 15.041) 16.376 3.685 ( 5.667 -3.714 7.557) 10.150 3.828 ( 5.756 -4.256 3.748) 8.081 4.120 ( 0.904 -8.672 2.899) 9.188 4.453 ( 6.955 -8.520 -17.254) 20.461 4.540 ( -3.491 19.783 15.910) 25.626 4.746 ( 15.383 3.487 -1.124) 15.813 5.276 ( -6.296 -7.978 11.201) 15.124 5.394 ( -5.216 0.522 -2.399) 5.765 5.584 ( -0.570 -10.261 6.975) 12.420 5.718 ( 8.111 -6.500 4.549) 11.346 6.113 ( 0.058 -1.393 5.563) 5.735 6.460 ( 1.645 -3.228 -7.022) 7.902 6.673 ( -3.253 1.134 -6.914) 7.725 6.965 ( 0.892 8.638 -8.405) 12.085 7.216 ( -7.236 12.028 -3.948) 14.581 7.351 ( 2.472 3.063 -13.440) 14.004 7.601 ( 0.353 2.484 -3.381) 4.210 7.764 ( 0.722 -0.330 2.044) 2.193 7.852 ( 5.035 4.450 17.237) 18.501 8.052 ( -4.604 -3.196 -2.237) 6.034 8.300 ( -2.889 -3.322 -10.884) 11.741 8.463 ( -1.415 4.697 -6.536) 8.172 9.097 ( -1.565 -5.857 2.566) 6.583 9.440 ( 0.342 1.068 0.524) 1.238 9.665 ( 7.864 -0.121 6.446) 10.169 9.781 ( 10.377 -3.227 -0.377) 10.874 10.000 ( -6.511 5.309 -2.094) 8.658 10.339 ( -0.500 -4.841 -1.723) 5.163 10.608 ( 3.388 -8.448 1.506) 9.226 10.822 ( 1.928 2.734 -10.777) 11.285 11.074 ( -1.691 -9.932 -10.609) 14.630 11.362 ( -1.553 8.105 -8.297) 11.702 11.561 ( -1.185 7.935 -3.520) 8.761 11.965 ( 0.294 6.640 -2.390) 7.063 12.104 ( 3.900 9.612 10.902) 15.048 12.579 ( -6.310 -0.316 -8.699) 10.751 12.764 ( -6.829 -4.116 -10.960) 13.553 13.121 ( 6.732 -10.340 11.231) 16.685 13.525 ( 4.306 -0.156 10.090) 10.972 13.780 ( -7.386 1.033 -1.358) 7.580 14.020 ( 2.287 -3.494 3.943) 5.744 14.515 ( -10.608 -1.880 0.136) 10.774 15.378 ( -1.007 1.989 7.914) 8.222 16.412 ( 0.105 0.518 9.770) 9.785 16.759 ( -2.659 -4.340 -4.031) 6.493 17.130 ( 1.074 -0.104 7.320) 7.399 17.578 ( 5.060 1.275 -1.760) 5.507 20.172 ( 2.260 -2.155 8.477) 9.034 20.181 ( -6.191 -1.757 4.565) 7.891 20.904 ( 15.349 1.249 -3.286) 15.746 21.251 ( -13.797 6.102 -1.520) 15.162 22.222 ( 9.800 -1.217 -1.157) 9.943 22.649 ( -12.236 4.765 -2.795) 13.425 22.989 ( -8.894 -4.292 2.238) 10.126 23.290 ( 8.461 0.276 -4.297) 9.494 24.239 ( 0.484 -1.255 2.646) 2.968 24.515 ( -3.145 2.363 2.795) 4.825 24.591 ( 1.362 -5.752 1.673) 6.144 25.402 ( 3.748 4.833 -12.954) 14.326 ======================= Grid point 271 (141/186) ======================= q-point: (-0.50 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.562 ( -4.625 8.273 18.841) 21.090 3.788 ( -3.235 2.843 4.408) 6.162 3.852 ( -2.779 1.066 8.977) 9.457 4.224 ( 0.805 3.184 6.642) 7.410 4.308 ( 0.387 4.009 12.687) 13.311 4.635 ( 4.810 -8.926 -18.191) 20.827 4.840 ( 10.511 5.394 -7.011) 13.738 5.286 ( -5.583 -3.434 5.366) 8.472 5.434 ( 3.440 -8.754 4.200) 10.301 5.684 ( -2.158 -7.937 3.909) 9.107 5.994 ( 9.855 -5.907 0.421) 11.498 6.259 ( 8.629 -7.648 10.567) 15.640 6.394 ( 0.982 9.185 -8.902) 12.828 6.622 ( 1.448 6.782 -1.034) 7.011 6.724 ( -6.232 11.804 -7.387) 15.256 7.053 ( -6.954 -0.554 4.940) 8.548 7.289 ( -3.437 1.191 -8.403) 9.157 7.359 ( -9.100 11.265 -8.817) 16.954 7.799 ( -12.094 4.649 3.115) 13.326 7.952 ( 14.762 -1.739 4.954) 15.668 7.981 ( -2.129 -1.507 1.990) 3.280 8.242 ( -4.842 -6.185 -2.107) 8.133 8.552 ( 10.532 0.523 -8.274) 13.403 9.122 ( -3.574 -2.420 -0.475) 4.342 9.412 ( -2.762 -0.274 -3.691) 4.618 9.678 ( -0.190 6.704 4.356) 7.997 9.899 ( 3.678 0.143 -4.061) 5.481 10.110 ( 12.853 -10.885 5.125) 17.605 10.409 ( 1.111 -4.955 -2.257) 5.557 10.726 ( 0.944 -4.583 -10.447) 11.447 10.793 ( 1.992 1.935 7.824) 8.302 11.032 ( -9.716 1.971 -19.285) 21.684 11.270 ( 2.629 0.555 -7.663) 8.120 11.406 ( 0.199 8.899 -0.439) 8.912 11.913 ( 0.388 3.622 -2.207) 4.259 12.101 ( 5.430 3.663 8.878) 11.033 12.434 ( -7.307 1.322 -16.049) 17.684 12.764 ( -0.902 -3.773 0.667) 3.936 13.349 ( 3.414 -6.644 14.933) 16.697 13.577 ( -0.020 -2.843 2.367) 3.699 13.651 ( -7.578 2.619 -3.076) 8.588 14.122 ( 3.836 -3.583 0.310) 5.258 14.476 ( -1.214 -2.518 5.114) 5.828 15.339 ( -4.012 0.988 6.638) 7.819 16.443 ( 1.737 -0.164 7.717) 7.912 16.790 ( -1.474 -5.028 -3.778) 6.460 17.152 ( 0.234 0.651 6.620) 6.656 17.595 ( 2.206 2.276 -3.089) 4.426 20.131 ( -6.130 -2.767 5.027) 8.397 20.291 ( 5.854 -2.078 7.328) 9.607 20.909 ( -8.964 7.623 -1.766) 11.899 21.169 ( 12.097 -3.152 -5.059) 13.486 22.217 ( -10.993 2.887 -3.638) 11.934 22.540 ( 3.074 -0.267 1.889) 3.617 22.946 ( -6.541 -3.054 3.895) 8.203 23.370 ( 7.388 1.688 -3.762) 8.461 24.287 ( 1.719 -2.387 2.342) 3.760 24.444 ( -3.509 1.827 2.132) 4.494 24.705 ( 2.379 -5.594 2.541) 6.589 25.315 ( 1.129 7.230 -12.023) 14.075 ======================= Grid point 272 (142/186) ======================= q-point: (-0.38 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.380 ( -9.628 14.330 20.288) 26.639 3.508 ( -8.376 14.751 20.101) 26.302 3.918 ( 0.541 -3.094 6.806) 7.495 4.160 ( -1.472 5.351 8.600) 10.235 4.364 ( -0.119 -3.049 1.897) 3.593 4.699 ( -0.685 -2.547 -16.590) 16.799 4.873 ( 4.923 0.795 -9.902) 11.087 5.314 ( -3.830 -5.242 0.679) 6.527 5.601 ( 6.864 -2.609 3.055) 7.953 5.808 ( 4.488 -4.175 4.536) 7.626 6.110 ( 1.880 0.957 4.520) 4.988 6.174 ( -1.629 11.973 -1.932) 12.237 6.457 ( 2.675 13.277 3.908) 14.096 6.552 ( 7.381 -6.402 -8.174) 12.739 6.615 ( 1.026 -2.660 0.159) 2.856 6.981 ( -13.569 -1.978 6.710) 15.266 7.102 ( -1.421 8.383 2.325) 8.815 7.294 ( 1.284 -5.793 -3.786) 7.039 7.527 ( -10.738 6.459 -3.679) 13.060 7.965 ( 2.158 4.012 -6.635) 8.048 8.250 ( 12.979 -6.066 10.359) 17.679 8.306 ( 0.150 -8.047 -1.530) 8.193 8.527 ( -4.530 6.693 -7.785) 11.222 9.126 ( -3.232 -7.209 -1.473) 8.036 9.361 ( -1.662 1.729 -6.126) 6.579 9.600 ( -2.289 1.650 2.703) 3.907 9.925 ( 4.130 3.089 -7.363) 8.989 10.351 ( 3.548 -4.816 -0.412) 5.997 10.474 ( 0.082 -3.257 -4.693) 5.713 10.761 ( 2.078 2.056 -17.049) 17.298 10.790 ( 1.048 4.273 11.710) 12.509 10.917 ( -1.260 -7.371 -5.385) 9.215 11.236 ( -1.045 1.542 -9.184) 9.371 11.396 ( 7.204 0.748 2.192) 7.567 11.830 ( -3.024 4.654 -4.492) 7.141 12.171 ( 6.921 1.735 11.931) 13.902 12.310 ( -7.268 -3.678 -16.754) 18.630 12.829 ( 4.018 0.052 7.525) 8.530 13.433 ( -6.798 -3.129 5.581) 9.336 13.508 ( -6.170 0.769 -4.456) 7.650 13.661 ( 4.630 -2.716 6.339) 8.306 14.179 ( 0.446 -0.232 -3.462) 3.498 14.579 ( 7.705 -3.407 8.426) 11.915 15.292 ( -5.678 -1.536 5.019) 7.733 16.497 ( 2.257 -1.339 6.188) 6.721 16.832 ( -1.349 -4.580 -4.188) 6.351 17.152 ( -0.018 1.492 5.613) 5.808 17.554 ( -0.971 3.460 -4.521) 5.776 20.117 ( -4.315 -2.807 5.826) 7.774 20.394 ( 3.070 -0.640 2.840) 4.231 20.707 ( -4.309 4.672 -0.361) 6.365 21.385 ( 6.844 -7.116 -7.398) 12.337 21.996 ( -7.871 4.250 1.382) 9.052 22.601 ( -1.900 -3.436 0.397) 3.946 22.942 ( 0.691 -0.759 6.727) 6.804 23.411 ( 5.321 3.252 -3.282) 7.047 24.347 ( 2.715 -0.453 0.619) 2.821 24.395 ( -3.712 -1.589 2.013) 4.512 24.812 ( 2.394 -4.230 2.451) 5.444 25.184 ( 0.132 8.293 -10.075) 13.050 ======================= Grid point 273 (143/186) ======================= q-point: (-0.25 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.091 ( -6.946 13.968 26.509) 30.758 3.326 ( -0.947 13.134 25.186) 28.420 3.956 ( -2.407 -1.072 6.421) 6.940 4.080 ( -3.168 3.487 5.315) 7.102 4.378 ( -0.830 -0.188 -2.599) 2.735 4.628 ( -1.861 3.960 -17.487) 18.026 4.881 ( -2.134 -1.113 -1.123) 2.656 5.281 ( -7.771 -2.975 -10.932) 13.739 5.720 ( 10.667 2.744 2.611) 11.319 5.784 ( -3.112 10.776 10.648) 15.466 5.953 ( -6.107 10.014 7.705) 14.033 6.184 ( 8.471 1.837 -13.839) 16.330 6.426 ( 4.580 -4.091 10.625) 12.272 6.664 ( 0.651 -3.394 4.876) 5.977 6.737 ( -1.904 -6.259 -3.499) 7.419 6.814 ( -1.795 3.602 7.994) 8.950 7.065 ( -0.016 0.261 2.303) 2.318 7.355 ( 6.318 5.643 -4.669) 9.673 7.492 ( 1.723 -10.739 -1.881) 11.038 7.875 ( 3.475 9.290 -7.930) 12.699 8.212 ( -14.604 5.708 -10.385) 18.807 8.397 ( -2.700 -5.692 -4.351) 7.656 8.576 ( 11.805 -6.406 9.997) 16.743 9.210 ( -0.900 -5.546 -8.984) 10.597 9.303 ( -1.316 -0.153 2.091) 2.476 9.584 ( -3.817 -3.182 2.500) 5.563 9.897 ( 4.970 4.683 -8.340) 10.779 10.381 ( -1.126 -0.305 -4.066) 4.230 10.441 ( -7.152 -0.701 -8.966) 11.491 10.670 ( -1.178 1.640 -18.635) 18.745 10.805 ( 1.628 1.390 11.832) 12.024 11.050 ( 9.097 -0.737 -2.324) 9.418 11.190 ( -2.695 -0.828 -4.484) 5.296 11.560 ( 10.514 -5.126 2.732) 12.012 11.706 ( -4.944 2.413 -5.124) 7.518 12.262 ( -3.593 -7.115 -11.166) 13.718 12.299 ( 6.737 0.205 14.554) 16.039 12.875 ( 4.257 4.868 11.757) 13.418 13.278 ( -7.423 6.527 -4.719) 10.953 13.497 ( -7.314 -8.301 -6.028) 12.599 13.768 ( 4.670 -0.427 10.287) 11.306 14.134 ( -2.329 2.626 -3.644) 5.060 14.783 ( 11.459 -3.800 8.885) 14.989 15.263 ( -6.336 -3.946 2.687) 7.933 16.565 ( 1.087 -2.735 5.824) 6.526 16.855 ( -2.246 -3.684 -5.020) 6.619 17.142 ( 0.681 2.350 4.703) 5.301 17.449 ( -3.889 5.213 -5.378) 8.440 20.117 ( -3.799 -2.006 7.166) 8.355 20.371 ( -2.034 1.922 -3.725) 4.659 20.721 ( 7.835 -0.663 4.253) 8.939 21.339 ( -18.648 -1.525 -9.092) 20.802 22.080 ( 18.148 -4.014 4.898) 19.221 22.570 ( -9.921 -4.009 -1.145) 10.761 23.015 ( 5.769 -0.130 8.303) 10.111 23.398 ( 2.157 4.324 -3.036) 5.707 24.354 ( -0.600 -0.185 -0.428) 0.760 24.406 ( -0.790 -1.577 0.217) 1.777 24.888 ( -0.156 -2.601 2.843) 3.856 25.063 ( 3.331 7.225 -8.534) 11.668 ======================= Grid point 274 (144/186) ======================= q-point: (-0.12 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.002 ( 4.469 6.441 30.196) 31.197 3.234 ( 3.580 10.832 24.755) 27.257 3.910 ( -5.926 0.972 7.029) 9.245 4.028 ( -0.721 2.527 3.733) 4.565 4.343 ( -0.787 1.731 -7.376) 7.617 4.482 ( -0.325 7.020 -17.083) 18.472 4.843 ( -7.244 -1.907 4.442) 8.708 5.182 ( -5.668 -0.816 -11.825) 13.139 5.552 ( -8.247 12.055 12.401) 19.161 5.803 ( -0.849 -0.350 7.252) 7.310 5.827 ( 5.651 7.336 -0.784) 9.293 6.203 ( 8.110 5.841 -5.621) 11.467 6.559 ( -16.632 -3.591 5.192) 17.789 6.639 ( 3.458 -4.158 6.625) 8.552 6.725 ( 3.963 -1.668 13.325) 14.001 7.027 ( 16.669 -3.801 -6.301) 18.221 7.097 ( 3.180 -2.035 5.563) 6.723 7.367 ( 7.370 5.318 -8.681) 12.568 7.593 ( -1.763 -5.804 -7.583) 9.711 7.876 ( 12.931 3.693 -1.136) 13.496 7.929 ( -11.794 4.534 -8.279) 15.105 8.399 ( -5.173 -5.411 -19.747) 21.119 8.801 ( 6.341 -5.051 8.572) 11.799 9.139 ( -0.483 6.515 -5.775) 8.720 9.382 ( -4.516 -9.902 4.576) 11.806 9.583 ( -5.337 -4.159 1.775) 6.995 9.926 ( 9.291 3.065 0.538) 9.799 10.221 ( -11.286 4.000 -15.158) 19.317 10.415 ( -1.641 -3.156 -1.668) 3.929 10.606 ( -0.076 0.270 -18.215) 18.218 10.822 ( -5.437 -0.972 10.929) 12.245 11.079 ( 7.680 5.635 -6.114) 11.319 11.247 ( 6.913 -2.009 -1.152) 7.291 11.568 ( -2.367 4.210 -12.765) 13.649 11.812 ( 3.354 -11.309 10.584) 15.848 12.299 ( -4.663 -10.268 -12.381) 16.747 12.451 ( 9.666 2.059 21.345) 23.521 12.873 ( 4.923 7.347 15.730) 18.046 13.083 ( -5.047 7.184 -6.444) 10.891 13.465 ( -9.661 -5.493 -12.848) 16.987 13.841 ( 2.874 0.556 10.135) 10.549 14.052 ( -2.775 2.713 -1.896) 4.319 15.004 ( 10.755 -3.241 9.708) 14.847 15.236 ( -7.951 -4.439 -0.575) 9.124 16.608 ( -4.662 -3.481 6.138) 8.458 16.862 ( -1.096 -2.712 -4.592) 5.444 17.119 ( -0.946 3.593 4.403) 5.761 17.310 ( -1.094 5.601 -4.926) 7.538 20.095 ( -4.693 -0.164 7.856) 9.152 20.350 ( 3.681 0.217 -4.873) 6.111 20.859 ( -0.347 -3.682 6.188) 7.209 21.073 ( -8.448 3.462 -5.118) 10.466 22.420 ( 6.554 -6.808 1.049) 9.509 22.489 ( 0.821 -4.175 -2.614) 4.994 23.107 ( 4.242 0.270 7.793) 8.877 23.338 ( -1.400 3.559 -3.126) 4.940 24.340 ( -4.058 -1.400 0.314) 4.304 24.408 ( 2.095 1.171 -2.690) 3.605 24.851 ( -6.602 1.358 3.355) 7.529 25.081 ( 11.015 1.795 -8.146) 13.817 ======================= Grid point 277 (145/186) ======================= q-point: ( 0.25 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.654 ( 8.661 0.000 -0.214) 8.664 3.723 ( 6.384 0.000 11.394) 13.061 3.821 ( 0.683 0.000 11.074) 11.096 3.915 ( 0.379 0.000 1.349) 1.401 4.314 ( 9.084 0.000 -17.661) 19.860 4.785 ( 17.910 0.000 2.784) 18.125 5.043 ( -1.403 -0.000 1.839) 2.313 5.128 ( 5.691 0.000 17.901) 18.784 5.185 ( -7.823 -0.000 15.869) 17.693 5.510 ( -11.125 -0.000 7.359) 13.339 5.649 ( 2.299 0.000 -3.838) 4.474 6.106 ( -1.127 -0.000 3.476) 3.654 6.306 ( 3.344 0.000 -6.363) 7.188 6.693 ( -5.444 -0.000 -13.772) 14.809 7.088 ( 4.029 0.000 2.180) 4.581 7.349 ( 2.955 0.000 -19.290) 19.515 7.557 ( 4.352 0.000 -2.452) 4.995 7.597 ( -0.278 -0.000 -19.827) 19.829 7.739 ( 0.430 0.000 23.006) 23.010 7.848 ( 3.738 0.000 -5.771) 6.876 8.135 ( -8.180 -0.000 1.417) 8.302 8.218 ( -5.954 -0.000 -9.455) 11.174 8.598 ( 9.974 0.000 2.615) 10.311 8.904 ( -9.799 -0.000 9.162) 13.415 9.468 ( -4.239 -0.000 4.632) 6.279 9.677 ( 12.414 0.000 -6.139) 13.849 9.726 ( 3.839 0.000 4.141) 5.647 10.186 ( -3.906 -0.000 -0.677) 3.964 10.265 ( 1.254 0.000 -1.330) 1.828 10.419 ( 1.594 0.000 -5.055) 5.301 10.831 ( 6.760 0.000 -10.815) 12.754 10.903 ( -5.357 -0.000 -6.906) 8.741 11.485 ( 0.275 0.000 -6.898) 6.904 11.668 ( 2.984 0.000 -5.504) 6.261 12.209 ( -12.234 -0.000 1.556) 12.332 12.223 ( -1.381 -0.000 1.736) 2.218 12.573 ( 5.097 0.000 13.126) 14.081 12.741 ( -6.475 -0.000 -22.014) 22.946 12.839 ( 7.737 0.000 2.399) 8.100 13.522 ( 1.938 0.000 10.685) 10.859 13.796 ( -7.232 -0.000 1.079) 7.312 13.959 ( 1.193 0.000 2.873) 3.111 14.484 ( -11.964 -0.000 1.926) 12.118 15.412 ( -1.254 -0.000 8.256) 8.351 16.418 ( -1.081 -0.000 11.156) 11.208 16.690 ( -2.668 -0.000 -4.756) 5.453 17.134 ( 2.348 0.000 8.731) 9.041 17.601 ( 6.116 0.000 -1.154) 6.224 20.136 ( -2.968 -0.000 8.001) 8.534 20.159 ( -1.160 -0.000 6.017) 6.127 20.920 ( 15.681 0.000 -5.954) 16.773 21.347 ( -16.913 -0.000 -1.433) 16.974 22.207 ( 11.996 0.000 -0.016) 11.996 22.796 ( -14.043 -0.000 -4.508) 14.749 22.848 ( -9.282 -0.000 3.658) 9.976 23.290 ( 9.532 0.000 -5.413) 10.962 24.235 ( 0.596 0.000 3.225) 3.280 24.489 ( 0.896 0.000 0.334) 0.956 24.557 ( -2.723 -0.000 4.659) 5.396 25.470 ( 4.535 0.000 -14.304) 15.005 ======================= Grid point 278 (146/186) ======================= q-point: ( 0.38 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.685 ( -5.439 1.833 11.667) 13.002 3.778 ( 5.427 -1.515 -4.199) 7.027 3.880 ( 4.055 2.419 10.544) 11.553 4.045 ( 4.647 -7.473 6.618) 11.011 4.436 ( 12.197 -3.768 -20.297) 23.978 4.810 ( -5.163 19.566 11.390) 23.221 4.988 ( 12.178 2.734 0.115) 12.482 5.128 ( -8.278 -3.579 12.408) 15.339 5.319 ( -0.082 -6.241 2.870) 6.869 5.427 ( -6.097 -6.079 10.364) 13.474 5.783 ( 12.544 -5.469 1.253) 13.742 6.144 ( 4.795 -0.970 7.673) 9.100 6.370 ( -0.309 -6.204 -6.043) 8.666 6.604 ( -3.833 -1.511 -10.908) 11.661 7.079 ( 2.910 6.189 -9.465) 11.677 7.268 ( -4.888 9.321 -14.500) 17.917 7.402 ( -4.255 8.154 -14.606) 17.260 7.612 ( 0.141 1.677 -5.450) 5.704 7.776 ( 1.600 -2.829 7.924) 8.565 7.848 ( -13.018 -5.814 2.927) 14.555 8.033 ( 0.936 4.005 17.640) 18.113 8.181 ( -0.479 0.965 -8.981) 9.046 8.647 ( 11.322 8.271 1.943) 14.155 8.985 ( -0.153 -9.714 9.478) 13.573 9.406 ( -5.710 -0.094 3.846) 6.885 9.779 ( 6.741 0.523 2.512) 7.213 9.869 ( 10.454 -3.551 -5.589) 12.375 10.056 ( -1.132 8.100 -5.812) 10.034 10.296 ( 2.904 -1.470 -1.538) 3.600 10.518 ( 1.835 -8.893 -4.797) 10.269 10.834 ( -0.589 0.333 -5.427) 5.469 10.902 ( -1.492 -5.126 -8.193) 9.779 11.420 ( -1.948 4.867 -7.777) 9.379 11.638 ( -0.550 5.094 -4.007) 6.504 11.995 ( -6.331 5.012 -4.991) 9.492 12.233 ( -4.154 -2.310 2.206) 5.240 12.558 ( 1.663 9.188 1.008) 9.392 12.651 ( 0.623 -0.385 -10.335) 10.360 13.098 ( 9.889 -11.776 11.217) 19.034 13.484 ( -11.001 -2.229 1.600) 11.338 13.706 ( -5.244 1.146 -1.382) 5.542 14.003 ( 1.598 -3.276 1.168) 3.827 14.428 ( -0.117 -0.855 8.398) 8.442 15.381 ( -4.996 1.217 6.903) 8.608 16.435 ( -0.638 -0.340 10.062) 10.088 16.672 ( -1.181 -2.392 -4.177) 4.956 17.184 ( 2.653 0.867 9.162) 9.578 17.654 ( 3.938 1.390 -2.149) 4.697 20.073 ( -5.780 -1.195 5.355) 7.969 20.251 ( 6.137 -0.736 10.274) 11.990 21.068 ( -8.616 3.103 -3.849) 9.933 21.117 ( 5.341 -0.739 -9.485) 10.910 22.295 ( -0.900 1.945 -0.656) 2.241 22.581 ( -8.554 2.527 -1.260) 9.008 22.827 ( -2.899 -4.364 5.972) 7.945 23.390 ( 8.015 0.200 -5.681) 9.826 24.257 ( 2.048 0.193 3.092) 3.714 24.501 ( -2.353 0.307 2.212) 3.244 24.560 ( 1.461 -2.657 4.305) 5.266 25.454 ( 1.411 2.530 -14.861) 15.140 ======================= Grid point 279 (147/186) ======================= q-point: (-0.50 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.607 ( -7.228 2.195 15.745) 17.463 3.811 ( -2.127 3.877 4.198) 6.097 3.892 ( 1.928 2.244 4.573) 5.446 4.192 ( 1.153 -5.819 4.242) 7.293 4.491 ( -6.424 16.579 15.215) 23.402 4.599 ( 10.516 -2.145 -17.213) 20.284 4.994 ( 2.999 5.314 -9.114) 10.968 5.132 ( -6.941 -7.091 7.178) 12.247 5.438 ( 6.824 -6.168 7.920) 12.138 5.569 ( 3.245 -9.407 7.505) 12.464 6.022 ( 9.384 -6.509 -1.684) 11.544 6.296 ( 5.272 -4.832 6.841) 9.897 6.392 ( -0.396 -2.696 -13.493) 13.765 6.588 ( -5.971 -4.895 0.982) 7.783 6.909 ( -5.181 16.000 -9.047) 19.097 7.003 ( -4.428 7.312 -7.310) 11.247 7.222 ( -2.917 3.877 -7.207) 8.688 7.492 ( -1.239 13.818 3.081) 14.211 7.707 ( -7.398 0.477 -0.657) 7.442 7.939 ( 3.764 -6.155 -4.127) 8.312 8.106 ( -5.210 -3.487 11.801) 13.363 8.157 ( 14.165 2.678 7.139) 16.087 8.698 ( 5.740 5.281 -1.942) 8.037 9.048 ( -3.495 -0.414 2.043) 4.070 9.364 ( -2.775 -1.575 0.830) 3.297 9.763 ( -2.242 7.689 -5.326) 9.618 9.936 ( 5.120 -1.963 -4.133) 6.866 10.165 ( 10.944 -6.340 3.929) 13.244 10.364 ( 2.539 -3.128 -2.707) 4.854 10.630 ( 0.632 -8.336 -9.244) 12.464 10.814 ( -3.854 -1.280 -10.714) 11.457 10.893 ( -1.832 0.511 5.646) 5.958 11.295 ( -1.947 4.373 -12.579) 13.459 11.538 ( 2.063 6.957 -0.606) 7.282 11.882 ( -4.253 0.349 -10.993) 11.793 12.204 ( -5.573 -2.232 0.670) 6.041 12.427 ( 2.948 11.818 0.332) 12.184 12.723 ( 6.069 -4.532 -1.339) 7.692 13.297 ( -8.828 -3.767 11.787) 15.200 13.459 ( 0.723 -10.177 1.799) 10.360 13.610 ( -3.335 2.098 -6.020) 7.195 14.088 ( 1.119 -5.241 -1.550) 5.579 14.517 ( 7.560 -0.869 10.995) 13.372 15.292 ( -7.790 1.088 5.002) 9.321 16.460 ( -1.113 -1.384 8.926) 9.101 16.697 ( -0.561 -3.775 -3.433) 5.134 17.221 ( 3.193 2.388 8.656) 9.530 17.652 ( 1.669 3.053 -3.664) 5.053 20.050 ( -3.212 -1.810 6.199) 7.213 20.370 ( 5.911 -0.774 9.713) 11.396 20.815 ( -13.672 2.642 -4.846) 14.744 21.262 ( 9.432 -2.063 -11.003) 14.638 22.137 ( -8.682 5.592 0.426) 10.336 22.512 ( -6.536 -3.361 -1.347) 7.472 22.907 ( 4.985 -1.452 8.989) 10.380 23.460 ( 5.816 0.793 -5.947) 8.356 24.302 ( 3.111 -0.732 2.673) 4.167 24.449 ( -2.396 2.678 3.086) 4.737 24.660 ( 2.135 -5.577 4.318) 7.369 25.369 ( -0.958 4.558 -14.638) 15.361 ======================= Grid point 280 (148/186) ======================= q-point: (-0.38 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.477 ( -8.536 9.022 17.514) 21.470 3.660 ( -3.706 10.932 18.585) 21.878 3.903 ( -1.404 -1.105 2.788) 3.311 4.216 ( -3.896 4.431 5.403) 8.000 4.333 ( -1.575 -0.241 7.409) 7.578 4.669 ( 5.668 1.738 -12.785) 14.092 4.938 ( -0.152 3.416 -6.263) 7.136 5.157 ( -4.030 -5.754 -4.264) 8.218 5.656 ( 6.450 -6.079 6.544) 11.017 5.778 ( 5.753 -10.760 5.692) 13.464 6.183 ( 4.241 1.090 2.494) 5.039 6.246 ( -3.424 5.621 -6.049) 8.939 6.500 ( 2.264 -6.551 -6.787) 9.701 6.569 ( -2.452 -4.160 -2.307) 5.351 6.617 ( -10.287 6.788 0.713) 12.345 6.839 ( -3.361 3.714 -8.573) 9.929 7.237 ( 4.686 4.864 5.700) 8.838 7.331 ( 6.201 8.108 8.384) 13.209 7.596 ( 2.588 9.035 3.360) 9.981 8.002 ( 3.685 -1.210 -14.081) 14.606 8.137 ( -4.078 -5.239 4.627) 8.092 8.393 ( 8.195 -3.777 9.345) 12.990 8.551 ( -6.103 9.683 -0.648) 11.464 9.020 ( -0.330 -2.633 -5.116) 5.763 9.366 ( 0.427 0.180 -1.384) 1.459 9.626 ( -1.604 5.628 -4.067) 7.126 9.994 ( 3.369 0.986 -3.879) 5.232 10.333 ( 1.839 -3.056 1.865) 4.024 10.399 ( -2.564 -1.759 -7.038) 7.694 10.683 ( -8.798 -2.274 -13.898) 16.605 10.788 ( 4.711 -7.131 -0.049) 8.547 10.922 ( 5.010 0.865 10.831) 11.965 11.207 ( -0.503 0.322 -15.687) 15.698 11.531 ( 7.109 3.246 3.048) 8.389 11.788 ( -4.783 1.020 -12.793) 13.696 12.122 ( -9.441 -2.285 -11.910) 15.368 12.388 ( 9.476 6.885 14.100) 18.331 12.885 ( 7.527 -3.700 4.324) 9.436 13.237 ( -11.587 -7.698 3.237) 14.282 13.430 ( -8.042 2.758 -5.905) 10.351 13.703 ( 7.078 -4.823 6.394) 10.689 14.138 ( -1.863 -2.804 -3.383) 4.773 14.692 ( 11.662 -2.061 10.075) 15.548 15.190 ( -8.672 -0.907 2.685) 9.123 16.487 ( -2.751 -2.787 8.843) 9.672 16.737 ( -0.303 -3.827 -3.557) 5.233 17.243 ( 3.856 3.884 7.400) 9.204 17.593 ( -0.641 4.805 -5.096) 7.033 20.065 ( -1.166 -1.623 7.427) 7.691 20.423 ( -0.820 1.758 1.084) 2.222 20.686 ( -2.533 -1.735 3.926) 4.984 21.298 ( -4.751 -1.067 -12.703) 13.604 22.054 ( 6.205 1.766 4.093) 7.640 22.456 ( -9.431 -4.108 -2.629) 10.617 23.016 ( 6.338 0.082 9.496) 11.417 23.482 ( 2.348 1.838 -6.244) 6.919 24.357 ( 0.948 -0.366 2.988) 3.156 24.398 ( 0.739 1.827 1.269) 2.344 24.773 ( 1.262 -5.146 4.793) 7.145 25.245 ( -1.372 5.190 -13.713) 14.727 ======================= Grid point 281 (149/186) ======================= q-point: (-0.25 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.288 ( -1.543 12.032 23.867) 26.773 3.541 ( -0.161 10.399 21.899) 24.243 3.893 ( -5.951 -2.588 4.771) 8.054 4.112 ( -2.771 4.135 7.444) 8.955 4.360 ( 0.382 -1.486 -0.946) 1.803 4.646 ( 3.416 5.348 -13.723) 15.119 4.835 ( -9.456 1.082 0.784) 9.550 5.173 ( 2.958 -0.620 -11.625) 12.012 5.749 ( -2.980 -2.198 7.931) 8.753 5.920 ( -6.269 8.105 3.590) 10.857 6.080 ( 3.254 1.455 0.137) 3.568 6.183 ( 1.101 -0.489 -8.006) 8.096 6.506 ( -1.043 3.916 -2.322) 4.671 6.540 ( -6.931 -4.116 7.851) 11.252 6.633 ( 3.056 -7.276 1.837) 8.103 6.880 ( 10.039 -4.976 -4.616) 12.117 7.184 ( 4.923 7.754 7.033) 11.568 7.356 ( -0.237 0.764 -2.919) 3.026 7.658 ( 17.354 6.532 9.564) 20.864 8.019 ( 4.532 3.428 -7.293) 9.245 8.054 ( -12.247 4.649 -10.452) 16.759 8.242 ( -8.457 -2.191 -4.164) 9.677 8.674 ( 8.550 -4.059 8.422) 12.669 9.077 ( 0.583 -6.602 -9.925) 11.935 9.341 ( -0.799 3.263 1.431) 3.652 9.535 ( -3.066 2.452 -0.458) 3.952 10.012 ( 5.624 2.698 -0.901) 6.302 10.285 ( -9.507 -0.202 -12.462) 15.676 10.349 ( -2.603 -0.202 0.615) 2.682 10.603 ( -2.478 -1.075 -12.975) 13.253 10.841 ( -2.879 1.477 8.251) 8.863 11.116 ( 10.507 -7.880 1.901) 13.271 11.197 ( 4.057 0.810 -10.023) 10.844 11.614 ( 2.483 -1.122 7.384) 7.871 11.673 ( -1.771 1.971 -13.831) 14.082 12.025 ( -7.036 -5.368 -16.283) 18.532 12.512 ( 11.118 1.910 19.994) 22.956 13.002 ( 4.320 0.869 10.518) 11.403 13.236 ( -6.348 -5.013 0.482) 8.103 13.258 ( -8.822 0.045 -12.706) 15.469 13.844 ( 4.798 -1.394 9.167) 10.440 14.103 ( -4.292 0.247 -3.617) 5.618 14.909 ( 11.922 -3.023 8.615) 15.017 15.111 ( -8.837 -3.461 -0.050) 9.491 16.500 ( -6.181 -3.843 9.286) 11.798 16.780 ( 1.237 -2.954 -3.669) 4.870 17.247 ( 3.428 5.024 5.975) 8.526 17.482 ( -1.808 6.249 -5.828) 8.734 20.089 ( -0.835 -0.239 8.490) 8.534 20.366 ( -0.484 1.040 -4.588) 4.729 20.752 ( -1.608 -3.992 10.508) 11.355 21.153 ( -7.011 2.081 -9.598) 12.067 22.242 ( 13.094 -4.625 3.070) 14.222 22.379 ( -7.202 -3.640 -4.096) 9.050 23.110 ( 4.760 0.160 9.043) 10.221 23.434 ( -2.292 2.926 -6.384) 7.387 24.331 ( -2.166 1.176 3.062) 3.931 24.435 ( 3.819 0.450 -1.332) 4.069 24.837 ( -2.498 -2.396 4.469) 5.652 25.153 ( 2.487 2.870 -12.035) 12.620 ======================= Grid point 282 (150/186) ======================= q-point: (-0.12 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.263 ( 8.610 7.501 26.490) 28.847 3.476 ( 3.809 9.100 19.622) 21.962 3.840 ( -7.468 -0.906 7.320) 10.496 4.077 ( 0.669 2.090 6.291) 6.662 4.370 ( 1.759 1.257 -3.179) 3.844 4.551 ( 3.123 7.862 -16.513) 18.554 4.695 ( -12.596 -2.557 2.104) 13.024 5.193 ( 7.227 4.373 -5.776) 10.233 5.631 ( -9.290 12.260 7.454) 17.093 5.727 ( -8.184 -1.596 6.073) 10.316 5.992 ( -1.532 7.777 -2.716) 8.379 6.310 ( -1.723 -7.454 -4.178) 8.717 6.367 ( -3.070 3.471 -1.798) 4.971 6.665 ( 7.845 -3.639 6.730) 10.958 6.749 ( 2.466 -3.763 5.778) 7.324 7.113 ( 10.184 -6.035 -2.751) 12.154 7.228 ( 11.454 1.181 7.092) 13.523 7.359 ( -0.903 -5.219 -11.963) 13.083 7.637 ( -3.406 10.745 5.149) 12.392 7.857 ( -0.279 4.529 -3.107) 5.499 8.062 ( 4.998 2.163 -8.429) 10.035 8.237 ( 3.678 -4.233 -13.687) 14.791 8.815 ( 1.006 -4.822 4.777) 6.862 9.128 ( -0.549 -3.990 -13.101) 13.706 9.273 ( -3.888 2.643 5.921) 7.561 9.497 ( -1.941 -2.311 3.413) 4.556 9.976 ( -7.984 3.009 -6.425) 10.680 10.219 ( 8.188 2.787 -1.379) 8.759 10.321 ( -6.164 -3.383 3.348) 7.787 10.559 ( -0.581 0.182 -13.453) 13.467 10.777 ( -2.968 2.097 -0.308) 3.647 11.204 ( 3.961 3.238 -2.832) 5.848 11.343 ( 9.824 -3.408 0.495) 10.410 11.533 ( -4.287 2.453 -10.225) 11.356 11.754 ( 2.510 -7.186 4.693) 8.943 12.017 ( -5.688 -10.741 -13.856) 18.431 12.673 ( 8.587 3.110 18.678) 20.791 13.052 ( 2.456 1.198 13.327) 13.604 13.094 ( -2.200 5.112 -5.872) 8.091 13.232 ( -7.465 -4.342 -9.610) 12.920 13.917 ( 2.890 1.083 9.082) 9.592 14.023 ( -4.797 0.924 -2.641) 5.554 15.040 ( -10.856 -4.474 -3.173) 12.163 15.114 ( 9.410 -2.949 8.646) 13.115 16.476 ( -8.583 -3.405 9.432) 13.200 16.832 ( 2.195 -1.988 -2.708) 4.013 17.194 ( -1.602 6.870 3.974) 8.097 17.390 ( 3.310 4.524 -3.973) 6.870 20.082 ( -1.540 1.408 7.863) 8.135 20.398 ( 6.343 -1.290 -4.205) 7.719 20.687 ( -15.219 -0.060 6.923) 16.720 21.154 ( 9.230 -1.792 -0.280) 9.406 22.246 ( -10.177 -2.377 -3.784) 11.115 22.576 ( 15.202 -7.332 -1.485) 16.943 23.174 ( 1.985 0.404 7.664) 7.927 23.317 ( -6.461 2.907 -6.012) 9.291 24.296 ( -2.462 0.840 2.393) 3.535 24.460 ( 3.450 1.643 -2.673) 4.664 24.789 ( -6.482 1.192 3.021) 7.250 25.187 ( 7.493 -1.266 -10.043) 12.594 ======================= Grid point 286 (151/186) ======================= q-point: ( 0.38 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.614 ( -9.805 -0.000 10.489) 14.358 3.832 ( 4.903 0.000 1.827) 5.232 3.964 ( 3.705 0.000 -5.188) 6.375 4.067 ( 1.215 0.000 14.827) 14.877 4.575 ( 18.813 0.000 -17.245) 25.521 4.937 ( -6.716 -0.000 2.690) 7.235 4.976 ( -7.577 -0.000 3.395) 8.303 5.042 ( -8.783 -0.000 12.376) 15.175 5.343 ( -3.678 -0.000 10.606) 11.225 5.371 ( 14.024 0.000 8.155) 16.223 5.906 ( 12.247 0.000 -1.352) 12.321 6.231 ( 5.012 0.000 8.518) 9.883 6.281 ( -4.503 -0.000 -2.160) 4.995 6.506 ( -3.190 -0.000 -16.064) 16.378 7.149 ( 5.020 0.000 -23.761) 24.285 7.208 ( -14.841 -0.000 -10.273) 18.050 7.335 ( -6.475 -0.000 -5.016) 8.191 7.621 ( 1.193 0.000 -3.593) 3.786 7.631 ( -10.121 -0.000 -1.139) 10.185 7.826 ( 10.805 0.000 1.380) 10.893 8.071 ( -3.438 -0.000 25.787) 26.015 8.319 ( 13.351 0.000 -4.481) 14.083 8.882 ( -0.410 -0.000 20.813) 20.817 8.909 ( 7.198 0.000 0.618) 7.224 9.331 ( -6.742 -0.000 4.912) 8.341 9.868 ( 5.814 0.000 -4.129) 7.131 9.946 ( 6.681 0.000 -2.600) 7.169 10.061 ( -1.547 -0.000 -17.330) 17.399 10.349 ( 3.710 0.000 -3.220) 4.913 10.431 ( 0.301 0.000 -4.242) 4.253 10.812 ( 1.121 0.000 -6.997) 7.086 10.877 ( 1.356 0.000 4.739) 4.929 11.390 ( -5.175 -0.000 -7.629) 9.219 11.655 ( -0.291 -0.000 -6.335) 6.341 11.918 ( -9.182 -0.000 -3.299) 9.756 12.094 ( -6.428 -0.000 -8.296) 10.495 12.622 ( 4.461 0.000 -12.905) 13.655 12.786 ( 6.131 0.000 12.713) 14.114 13.162 ( 11.812 0.000 8.741) 14.695 13.254 ( -18.636 -0.000 1.176) 18.673 13.653 ( -3.688 -0.000 -4.801) 6.054 13.988 ( 0.164 0.000 -0.737) 0.755 14.510 ( 8.325 0.000 11.914) 14.534 15.314 ( -8.686 -0.000 5.244) 10.146 16.435 ( -2.704 -0.000 10.523) 10.865 16.645 ( 0.845 0.000 -3.853) 3.944 17.257 ( 3.834 0.000 9.784) 10.509 17.699 ( 2.309 0.000 -3.223) 3.965 20.024 ( -2.686 -0.000 6.382) 6.924 20.359 ( 6.657 0.000 12.409) 14.081 20.851 ( -16.861 -0.000 -7.664) 18.521 21.239 ( 9.847 0.000 -12.099) 15.600 22.252 ( -7.572 -0.000 0.195) 7.574 22.433 ( -11.138 -0.000 -2.529) 11.421 22.883 ( 8.392 0.000 10.733) 13.624 23.471 ( 6.367 0.000 -6.682) 9.230 24.302 ( 3.191 0.000 2.917) 4.323 24.487 ( -1.146 -0.000 0.242) 1.171 24.570 ( 1.318 0.000 8.015) 8.122 25.432 ( -1.587 -0.000 -15.901) 15.980 ======================= Grid point 287 (152/186) ======================= q-point: (-0.50 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.519 ( -11.015 -1.893 14.070) 17.969 3.870 ( 1.208 2.961 5.160) 6.071 3.958 ( 0.783 3.908 0.042) 3.986 4.129 ( -0.469 -5.176 3.532) 6.284 4.651 ( -8.987 16.177 11.657) 21.871 4.757 ( 13.818 4.081 -9.402) 17.205 4.974 ( -7.993 -3.348 6.599) 10.892 5.006 ( 0.148 -4.380 -4.434) 6.234 5.407 ( 2.256 -7.200 10.465) 12.902 5.574 ( 6.347 -4.813 7.255) 10.774 6.084 ( 11.455 -3.124 0.530) 11.885 6.235 ( -5.555 -3.791 -2.203) 7.077 6.307 ( -1.209 -5.041 1.967) 5.545 6.449 ( -2.846 -2.123 -13.947) 14.392 6.875 ( -18.712 8.776 -2.593) 20.829 7.011 ( -4.547 4.565 -31.856) 32.502 7.383 ( 13.805 4.765 7.482) 16.410 7.524 ( -7.654 -0.149 4.502) 8.881 7.703 ( 7.796 -3.421 -9.776) 12.963 7.974 ( 10.402 2.802 -2.640) 11.091 8.083 ( -2.602 0.478 22.480) 22.635 8.444 ( 15.683 7.057 7.580) 18.794 8.802 ( -4.819 8.214 4.938) 10.728 9.013 ( -2.694 -2.450 1.756) 4.043 9.294 ( -2.777 -3.921 5.106) 7.011 9.829 ( -0.825 8.874 -9.710) 13.180 9.944 ( 2.111 -1.902 -7.056) 7.607 10.164 ( 3.901 -10.847 -4.533) 12.387 10.379 ( 2.978 0.444 -2.643) 4.006 10.458 ( -2.420 -5.722 -8.253) 10.330 10.800 ( 3.243 3.429 -5.857) 7.522 10.946 ( 4.083 -0.276 12.286) 12.950 11.261 ( -6.520 2.745 -12.196) 14.099 11.625 ( 1.731 1.980 -3.786) 4.610 11.794 ( -5.940 0.513 -8.821) 10.647 12.020 ( -8.745 -4.577 -7.086) 12.150 12.652 ( 7.515 6.133 -3.998) 10.492 12.827 ( 7.845 4.566 7.026) 11.478 13.060 ( -15.738 -5.219 1.594) 16.657 13.383 ( 2.495 -7.110 8.192) 11.130 13.601 ( 1.662 0.344 -4.556) 4.862 14.009 ( -1.488 -4.420 -2.844) 5.463 14.675 ( 12.257 0.220 11.270) 16.652 15.192 ( -10.559 0.433 3.144) 11.026 16.423 ( -4.505 -1.378 10.833) 11.813 16.664 ( 1.763 -1.291 -3.189) 3.866 17.325 ( 4.629 1.655 9.092) 10.335 17.694 ( 0.580 2.039 -4.651) 5.111 20.032 ( 0.446 -0.628 7.901) 7.938 20.466 ( 4.106 1.037 11.483) 12.239 20.640 ( -11.733 -1.206 -5.549) 13.035 21.281 ( 0.571 -0.230 -14.681) 14.693 22.141 ( -1.964 3.510 2.217) 4.593 22.341 ( -7.693 -3.701 -2.347) 8.853 23.019 ( 7.409 0.094 10.729) 13.039 23.517 ( 3.793 0.687 -7.814) 8.713 24.353 ( 3.958 0.159 2.271) 4.566 24.457 ( -1.986 1.437 1.175) 2.718 24.643 ( 2.820 -3.113 8.475) 9.458 25.341 ( -4.075 1.700 -16.000) 16.598 ======================= Grid point 288 (153/186) ======================= q-point: (-0.38 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.453 ( -9.746 -2.426 17.143) 19.869 3.806 ( -1.211 7.750 12.880) 15.081 3.887 ( -3.151 4.169 3.610) 6.351 4.197 ( -0.376 -2.785 -1.489) 3.180 4.385 ( -5.510 9.791 15.339) 19.013 4.805 ( 7.260 4.789 -5.773) 10.438 4.867 ( -10.210 1.317 -2.481) 10.589 5.122 ( 8.374 -3.255 -5.695) 10.637 5.619 ( 3.834 -10.950 7.352) 13.735 5.685 ( -3.301 -6.960 8.695) 11.617 6.181 ( -5.596 1.477 -8.741) 10.483 6.275 ( 5.724 -2.864 1.576) 6.592 6.346 ( -10.744 -8.423 4.991) 14.536 6.417 ( -1.857 -4.347 -5.374) 7.157 6.593 ( -2.813 4.932 -6.883) 8.922 6.874 ( 4.835 3.163 -22.847) 23.567 7.419 ( -0.145 4.233 4.754) 6.367 7.503 ( 4.340 6.588 9.052) 12.007 7.808 ( 8.884 2.220 -3.400) 9.768 8.037 ( 10.230 0.970 -9.492) 13.989 8.106 ( 2.513 2.998 15.376) 15.866 8.451 ( -8.907 13.758 3.048) 16.670 8.652 ( 4.947 2.742 6.926) 8.942 8.979 ( -1.392 -1.531 -7.618) 7.894 9.350 ( -0.395 -2.684 2.227) 3.510 9.686 ( -0.953 7.044 -7.140) 10.076 10.001 ( 1.549 -4.316 0.923) 4.678 10.270 ( -5.684 -2.791 -8.611) 10.688 10.370 ( 0.216 0.597 0.474) 0.793 10.504 ( -0.997 -5.694 -6.524) 8.717 10.818 ( 6.522 0.670 -1.970) 6.846 11.006 ( 1.786 0.939 5.110) 5.494 11.152 ( -0.662 -1.327 -10.867) 10.968 11.640 ( 2.081 0.782 0.507) 2.280 11.695 ( -5.401 0.158 -11.271) 12.499 11.960 ( -4.157 -3.039 -9.334) 10.660 12.624 ( 4.799 6.914 8.012) 11.620 12.954 ( 3.642 -7.295 -4.375) 9.253 12.996 ( -2.477 -1.779 10.007) 10.461 13.352 ( -6.871 2.187 -5.657) 9.165 13.734 ( 6.224 -5.774 7.337) 11.221 14.035 ( -4.157 -4.921 -4.684) 7.964 14.867 ( 13.018 0.139 9.527) 16.132 15.061 ( -9.724 -0.545 0.847) 9.776 16.409 ( -6.050 -2.434 11.241) 12.996 16.707 ( 2.302 -2.060 -2.974) 4.288 17.372 ( 4.749 3.494 7.481) 9.525 17.634 ( -1.074 4.184 -5.873) 7.291 20.085 ( 3.026 -0.075 9.567) 10.035 20.410 ( -5.055 2.053 -4.661) 7.175 20.639 ( -0.625 -3.844 12.459) 13.053 21.188 ( -7.441 0.561 -13.421) 15.356 22.174 ( 8.347 -0.591 2.787) 8.820 22.294 ( -4.751 -2.405 -3.618) 6.438 23.118 ( 4.437 0.337 9.700) 10.672 23.502 ( -0.393 1.987 -8.894) 9.121 24.389 ( -0.134 2.214 2.550) 3.380 24.432 ( 2.639 -0.342 0.304) 2.678 24.747 ( 2.039 -3.297 8.284) 9.146 25.218 ( -4.540 1.573 -15.074) 15.822 ======================= Grid point 289 (154/186) ======================= q-point: (-0.25 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.425 ( -3.676 -0.345 20.178) 20.513 3.728 ( 0.247 7.774 19.190) 20.707 3.806 ( -3.351 2.036 6.205) 7.340 4.142 ( -4.386 3.613 8.700) 10.391 4.351 ( 1.365 -1.146 3.366) 3.809 4.669 ( -14.471 1.307 -3.542) 14.956 4.799 ( 7.611 7.924 -10.576) 15.250 5.266 ( 11.720 -0.115 -4.305) 12.486 5.667 ( -6.578 -2.211 7.519) 10.232 5.876 ( -1.449 -11.371 7.402) 13.645 5.992 ( -8.953 3.056 -6.733) 11.611 6.136 ( -12.367 1.614 -0.766) 12.496 6.474 ( 3.414 -7.502 -3.248) 8.859 6.497 ( -0.653 0.601 -4.793) 4.874 6.584 ( 3.863 -6.307 2.182) 7.711 6.958 ( 13.802 -1.748 -9.195) 16.676 7.390 ( 5.088 6.009 6.755) 10.374 7.402 ( -3.694 7.367 3.114) 8.810 7.845 ( -6.685 -0.491 -8.419) 10.761 8.026 ( 1.844 5.562 -5.286) 7.892 8.128 ( 1.705 10.855 -4.595) 11.910 8.267 ( 15.837 4.944 11.175) 20.003 8.678 ( -4.075 -2.877 0.629) 5.028 9.012 ( 2.834 -3.263 -9.615) 10.542 9.351 ( -0.989 0.935 0.735) 1.547 9.551 ( -4.119 5.847 0.022) 7.153 10.100 ( -0.231 5.222 -3.065) 6.060 10.143 ( -2.514 -6.356 -0.475) 6.852 10.349 ( -0.826 3.669 2.783) 4.679 10.534 ( -0.238 -2.497 -7.493) 7.902 10.838 ( -1.243 1.521 -3.753) 4.236 11.110 ( 7.296 -8.943 -6.380) 13.187 11.225 ( 5.157 -3.941 1.318) 6.623 11.568 ( -9.386 1.643 0.768) 9.560 11.618 ( -3.623 -1.796 -14.227) 14.790 11.968 ( 6.215 2.662 -7.759) 10.292 12.675 ( 3.611 -2.680 13.713) 14.432 12.975 ( -6.666 -4.692 -0.113) 8.153 13.110 ( 4.482 0.284 -0.408) 4.509 13.239 ( 0.403 1.797 -0.726) 1.979 13.886 ( 3.480 -3.797 9.009) 10.377 14.007 ( -6.216 -2.731 -5.220) 8.564 14.938 ( -8.795 -2.231 -0.864) 9.115 15.069 ( 10.711 -0.131 7.389) 13.013 16.389 ( -6.595 -2.582 11.286) 13.325 16.766 ( 2.737 -2.561 -2.733) 4.639 17.377 ( 2.473 5.714 5.142) 8.075 17.533 ( -0.765 5.186 -5.820) 7.833 20.134 ( 2.154 2.199 9.103) 9.609 20.364 ( 2.110 -1.071 -4.393) 4.990 20.668 ( -7.724 -1.316 12.588) 14.827 21.089 ( -2.598 -2.497 -7.083) 7.947 22.212 ( -3.614 0.005 -3.342) 4.923 22.404 ( 13.530 -4.837 -0.276) 14.371 23.175 ( 1.482 0.023 8.510) 8.638 23.403 ( -5.678 3.158 -9.194) 11.258 24.344 ( -1.588 2.317 2.622) 3.842 24.490 ( 4.391 0.121 -1.637) 4.688 24.798 ( -2.060 -0.417 6.507) 6.838 25.141 ( -0.739 -1.713 -12.276) 12.417 ======================= Grid point 290 (155/186) ======================= q-point: (-0.12 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.479 ( 1.385 -1.519 20.132) 20.237 3.687 ( 3.281 7.906 18.951) 20.794 3.781 ( 0.303 1.697 8.428) 8.602 4.106 ( -2.346 -2.008 12.922) 13.286 4.379 ( -0.654 0.640 -1.113) 1.441 4.486 ( -10.038 -2.350 -1.884) 10.481 4.728 ( 7.007 11.191 -14.959) 19.952 5.398 ( 12.385 3.412 -0.560) 12.858 5.606 ( -7.454 -0.539 6.558) 9.943 5.701 ( -6.989 11.490 0.773) 13.471 5.970 ( -9.213 1.677 0.051) 9.364 6.127 ( -2.067 -13.559 1.382) 13.785 6.373 ( -2.596 5.099 -4.496) 7.277 6.653 ( 1.055 -10.233 -2.220) 10.524 6.729 ( 2.019 -7.134 0.559) 7.435 7.154 ( 10.247 -0.987 -2.098) 10.506 7.303 ( -1.861 -0.214 0.547) 1.951 7.415 ( 8.548 3.446 -0.718) 9.244 7.623 ( -10.124 4.297 1.017) 11.045 7.973 ( -2.437 3.289 -11.841) 12.529 8.109 ( 12.147 6.697 -4.789) 14.675 8.381 ( 9.068 6.459 4.084) 11.858 8.643 ( -12.803 -8.146 -6.980) 16.704 9.097 ( 6.600 -3.731 -3.633) 8.407 9.308 ( 1.493 5.468 -4.143) 7.021 9.474 ( -0.681 -0.263 6.950) 6.988 9.928 ( -5.467 5.830 -6.796) 10.491 10.202 ( -8.047 0.214 6.004) 10.042 10.364 ( 8.288 -0.515 5.833) 10.148 10.546 ( 3.179 -0.692 -9.058) 9.624 10.793 ( 0.766 2.111 -6.039) 6.443 11.265 ( 2.274 -0.380 -4.149) 4.746 11.346 ( 0.795 -5.977 -1.555) 6.227 11.456 ( -5.941 -2.386 -4.379) 7.757 11.609 ( -0.667 -9.566 -8.463) 12.790 11.966 ( 4.803 5.561 -2.837) 7.877 12.793 ( 0.451 0.059 7.172) 7.187 12.916 ( -9.572 -8.580 -9.096) 15.747 13.125 ( 4.668 3.296 6.202) 8.433 13.295 ( 7.176 3.064 8.299) 11.391 13.936 ( -6.695 -1.588 -3.856) 7.888 13.978 ( 2.442 -0.713 7.847) 8.249 14.838 ( -10.707 -2.365 -3.860) 11.625 15.216 ( 7.301 -0.847 7.876) 10.773 16.372 ( -4.880 -2.103 10.889) 12.116 16.828 ( 2.120 -2.143 -2.380) 3.841 17.278 ( -2.859 8.078 1.573) 8.712 17.484 ( 3.669 3.188 -2.524) 5.477 20.131 ( 1.249 3.000 6.824) 7.558 20.439 ( 2.025 -1.223 -2.787) 3.656 20.571 ( -4.351 1.009 9.131) 10.165 21.159 ( 0.758 -7.805 1.060) 7.913 22.155 ( -0.350 2.036 -4.915) 5.331 22.646 ( 10.093 -5.757 -2.051) 11.799 23.194 ( -2.628 -0.072 5.569) 6.159 23.245 ( -6.709 2.574 -6.249) 9.523 24.302 ( -1.274 2.033 2.705) 3.615 24.519 ( 2.948 1.690 -3.578) 4.934 24.746 ( -4.651 2.162 4.328) 6.711 25.188 ( 3.492 -5.097 -9.554) 11.378 ======================= Grid point 295 (156/186) ======================= q-point: (-0.50 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.375 ( -13.603 -0.000 16.947) 21.731 3.903 ( -2.077 -0.000 3.149) 3.772 4.035 ( 3.516 0.000 0.298) 3.528 4.063 ( -2.022 -0.000 4.288) 4.741 4.751 ( -5.596 -0.000 7.246) 9.155 4.820 ( -5.550 -0.000 6.518) 8.561 4.854 ( -7.804 -0.000 2.672) 8.248 5.022 ( 13.338 0.000 -2.740) 13.616 5.416 ( 3.651 0.000 9.115) 9.819 5.582 ( -1.828 -0.000 4.967) 5.293 6.138 ( -2.623 -0.000 0.621) 2.696 6.197 ( 0.377 0.000 -2.838) 2.863 6.262 ( 6.960 0.000 4.650) 8.371 6.360 ( -5.655 -0.000 -14.522) 15.585 6.711 ( -10.860 -0.000 -4.239) 11.657 6.918 ( -0.997 -0.000 -28.029) 28.047 7.433 ( -4.207 -0.000 1.922) 4.625 7.624 ( 8.529 0.000 8.273) 11.882 7.737 ( 7.703 0.000 -15.742) 17.525 8.144 ( 8.268 0.000 -6.540) 10.542 8.176 ( 8.792 0.000 26.749) 28.157 8.705 ( 5.707 0.000 8.598) 10.320 8.859 ( 1.126 0.000 -6.408) 6.506 8.863 ( -10.295 -0.000 7.856) 12.950 9.238 ( -2.063 -0.000 8.577) 8.822 9.905 ( -1.361 -0.000 -2.946) 3.245 9.929 ( -6.168 -0.000 -3.245) 6.970 10.005 ( 5.025 0.000 -19.339) 19.981 10.399 ( -0.475 -0.000 -2.397) 2.443 10.437 ( 5.131 0.000 -4.642) 6.919 10.884 ( 5.944 0.000 -2.824) 6.580 11.041 ( 2.087 0.000 6.746) 7.062 11.164 ( -3.552 -0.000 -4.058) 5.393 11.622 ( -0.419 -0.000 -8.579) 8.590 11.701 ( -6.099 -0.000 -4.752) 7.731 11.871 ( -6.195 -0.000 -6.669) 9.102 12.780 ( -14.798 -0.000 -3.627) 15.237 12.805 ( 12.096 0.000 -5.535) 13.302 13.029 ( 7.659 0.000 12.640) 14.779 13.351 ( -2.520 -0.000 2.425) 3.497 13.641 ( 4.807 0.000 1.798) 5.132 13.927 ( -4.295 -0.000 -4.924) 6.534 14.880 ( 14.365 0.000 9.709) 17.339 15.056 ( -11.154 -0.000 1.313) 11.231 16.374 ( -5.594 -0.000 11.755) 13.018 16.676 ( 2.266 0.000 -2.638) 3.478 17.423 ( 5.165 0.000 8.129) 9.631 17.695 ( -0.770 -0.000 -5.807) 5.858 20.084 ( 4.662 0.000 10.153) 11.172 20.456 ( -9.838 -0.000 -8.212) 12.815 20.568 ( 2.781 0.000 16.309) 16.544 21.194 ( -7.804 -0.000 -15.062) 16.964 22.176 ( 3.372 0.000 1.889) 3.865 22.254 ( -0.819 -0.000 -2.500) 2.631 23.124 ( 4.304 0.000 10.028) 10.913 23.534 ( 1.017 0.000 -9.850) 9.902 24.410 ( 3.913 0.000 1.403) 4.157 24.440 ( -2.194 -0.000 -0.193) 2.202 24.693 ( 3.974 0.000 11.554) 12.219 25.240 ( -6.802 -0.000 -16.001) 17.387 ======================= Grid point 296 (157/186) ======================= q-point: (-0.38 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.274 ( -13.998 -5.372 19.604) 24.680 3.838 ( -7.379 1.745 9.835) 12.419 3.985 ( 1.519 6.349 4.958) 8.198 4.146 ( 1.517 -4.606 -2.039) 5.261 4.527 ( -5.048 14.651 16.573) 22.690 4.729 ( -9.945 1.979 -3.671) 10.784 4.899 ( 1.715 -4.966 -0.197) 5.257 5.188 ( 9.347 -3.359 0.571) 9.948 5.517 ( 0.325 -6.357 9.373) 11.330 5.585 ( -2.726 -3.649 6.163) 7.663 6.101 ( -15.165 0.738 -1.766) 15.286 6.125 ( -3.551 -1.122 -4.181) 5.599 6.253 ( -1.197 -3.672 -10.911) 11.575 6.424 ( 9.549 -0.880 7.035) 11.893 6.647 ( 5.307 3.993 -6.785) 9.495 6.906 ( 6.294 -3.226 -17.396) 18.779 7.407 ( -3.826 -1.281 7.029) 8.105 7.628 ( 1.182 5.964 -1.844) 6.353 7.815 ( 0.821 -4.338 -15.755) 16.362 8.099 ( -3.972 4.813 -11.982) 13.510 8.418 ( 19.992 3.600 24.628) 31.924 8.565 ( -3.796 11.783 -0.184) 12.380 8.683 ( -12.070 1.987 1.388) 12.311 8.984 ( 8.877 3.713 2.263) 9.885 9.304 ( 1.241 -6.131 4.158) 7.511 9.749 ( -3.548 8.193 -6.068) 10.795 9.909 ( -3.659 -6.757 1.185) 7.775 10.128 ( 1.825 -7.989 -11.099) 13.796 10.384 ( 0.595 1.072 -1.228) 1.735 10.489 ( 3.530 0.195 -3.019) 4.649 10.915 ( -1.627 3.509 -11.150) 11.802 10.980 ( 2.695 -1.260 -6.212) 6.887 11.200 ( 4.854 4.445 13.649) 15.153 11.581 ( -4.003 -1.273 -14.045) 14.659 11.615 ( -6.643 0.674 -1.409) 6.825 11.877 ( 2.415 -8.477 -0.788) 8.850 12.609 ( -10.434 -0.620 -2.826) 10.828 12.952 ( 10.985 1.519 -0.784) 11.117 13.142 ( 9.152 2.083 11.230) 14.636 13.290 ( -4.418 1.483 -5.976) 7.578 13.742 ( 3.610 -4.453 8.277) 10.068 13.879 ( -6.453 -4.767 -7.015) 10.657 14.917 ( -9.629 0.144 -0.167) 9.632 15.083 ( 13.035 0.556 8.155) 15.386 16.339 ( -5.109 -0.908 11.925) 13.006 16.708 ( 2.236 -1.248 -2.629) 3.670 17.492 ( 4.747 2.255 6.128) 8.073 17.645 ( -2.066 2.258 -6.635) 7.307 20.192 ( 7.882 1.496 11.782) 14.254 20.340 ( -3.998 -0.561 -6.452) 7.611 20.628 ( -2.086 -1.070 16.854) 17.017 21.034 ( -10.705 -1.137 -12.656) 16.615 22.236 ( 3.596 1.499 -1.135) 4.057 22.301 ( 8.682 -2.671 -1.061) 9.145 23.178 ( 0.827 0.120 8.641) 8.681 23.481 ( -3.502 1.889 -11.734) 12.391 24.401 ( -2.221 1.333 -0.004) 2.591 24.470 ( 4.023 -0.996 0.300) 4.155 24.780 ( 3.105 -0.544 11.611) 12.031 25.107 ( -7.256 -0.609 -14.425) 16.159 ======================= Grid point 297 (158/186) ======================= q-point: (-0.25 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.265 ( -12.235 -10.449 20.284) 25.890 3.755 ( -8.727 -1.562 18.489) 20.505 3.940 ( 3.116 6.330 5.717) 9.081 4.157 ( -2.879 3.309 2.984) 5.305 4.389 ( 0.064 4.057 13.108) 13.722 4.538 ( -8.629 4.481 -6.630) 11.769 4.964 ( 7.035 3.112 -6.492) 10.066 5.366 ( 7.452 -4.728 0.791) 8.861 5.600 ( -1.049 -2.307 9.948) 10.266 5.680 ( -1.412 -11.526 6.743) 13.428 5.863 ( -14.432 1.129 -0.567) 14.488 6.046 ( -4.741 1.722 -8.009) 9.465 6.323 ( -0.563 -7.697 -5.994) 9.772 6.543 ( 5.115 1.099 2.154) 5.657 6.636 ( 4.957 4.610 -3.259) 7.513 7.064 ( 8.614 -5.412 -3.301) 10.695 7.358 ( -6.372 0.140 4.614) 7.868 7.595 ( 8.759 6.370 -0.759) 10.856 7.682 ( -14.171 0.695 -17.674) 22.665 8.015 ( 0.014 0.164 -12.902) 12.903 8.399 ( 6.208 13.707 2.305) 15.223 8.470 ( -16.369 -2.412 -6.982) 17.959 8.648 ( 13.057 9.035 13.313) 20.721 9.007 ( 3.679 -0.433 2.841) 4.668 9.411 ( 7.885 0.467 0.418) 7.910 9.584 ( -3.210 7.397 -4.731) 9.349 9.955 ( -8.624 -6.787 -0.356) 10.980 10.213 ( 6.750 0.050 -0.341) 6.759 10.398 ( 1.119 -1.276 3.111) 3.544 10.496 ( -0.154 0.557 -0.928) 1.093 10.808 ( -1.091 0.121 -21.967) 21.995 11.077 ( 5.970 -2.186 -3.597) 7.304 11.247 ( 3.033 -2.130 12.119) 12.673 11.481 ( -8.717 2.446 -1.303) 9.147 11.510 ( -3.244 -0.506 -13.937) 14.319 12.087 ( 9.918 -4.019 0.930) 10.741 12.524 ( -9.600 -8.121 0.863) 12.604 12.971 ( 0.161 6.966 -5.867) 9.109 13.206 ( 4.327 2.931 7.154) 8.859 13.314 ( 9.694 -1.185 3.273) 10.300 13.840 ( -7.237 -4.994 -4.911) 10.071 13.879 ( 1.999 -5.861 6.416) 8.917 14.799 ( -8.573 -0.435 -2.012) 8.816 15.233 ( 8.954 1.503 7.865) 12.012 16.327 ( -3.107 -1.029 11.285) 11.750 16.756 ( 2.253 -2.434 -2.865) 4.382 17.484 ( -0.407 6.018 0.782) 6.082 17.574 ( 0.597 2.645 -3.659) 4.555 20.223 ( 1.414 3.114 2.376) 4.164 20.405 ( 8.975 -0.843 3.690) 9.740 20.600 ( -7.020 1.003 13.483) 15.234 20.947 ( -6.511 -6.673 -5.103) 10.629 22.242 ( 4.906 3.912 -3.191) 7.040 22.499 ( 11.396 -4.964 -0.774) 12.455 23.188 ( -2.255 -0.150 7.104) 7.455 23.331 ( -8.635 3.350 -11.627) 14.865 24.352 ( -1.936 1.534 0.392) 2.500 24.542 ( 4.811 -0.866 -1.516) 5.119 24.802 ( -2.560 2.233 6.694) 7.506 25.044 ( -2.351 -4.586 -8.384) 9.841 ======================= Grid point 298 (159/186) ======================= q-point: (-0.12 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.335 ( -9.566 -12.281 19.601) 25.031 3.761 ( -9.368 -8.015 20.966) 24.322 3.923 ( 5.030 4.795 4.916) 8.512 4.042 ( -6.548 5.071 13.070) 15.473 4.393 ( -0.910 5.014 -2.822) 5.825 4.436 ( 5.150 -1.830 2.830) 6.155 4.945 ( 7.485 10.242 -13.328) 18.400 5.425 ( -4.889 -0.633 0.677) 4.976 5.668 ( 1.636 1.761 6.927) 7.332 5.733 ( 0.488 -3.325 0.877) 3.474 5.855 ( -3.717 -6.771 9.594) 12.317 5.961 ( 1.881 -1.837 -8.726) 9.113 6.381 ( -6.652 -4.558 3.689) 8.867 6.506 ( 1.014 2.346 -7.987) 8.386 6.669 ( 0.701 -1.969 2.127) 2.982 7.174 ( -4.443 -7.724 3.788) 9.682 7.330 ( 0.985 7.296 -2.773) 7.867 7.459 ( -1.913 -1.095 -15.016) 15.177 7.674 ( 8.566 3.965 2.374) 9.733 7.955 ( -1.632 2.012 -8.390) 8.781 8.246 ( -18.086 -3.637 -6.181) 19.456 8.389 ( 6.957 4.893 -2.812) 8.958 8.567 ( -1.218 9.281 -3.179) 9.885 9.154 ( 8.296 -1.019 8.067) 11.616 9.450 ( 4.228 6.609 -8.158) 11.319 9.513 ( 6.429 0.994 2.310) 6.904 9.875 ( -8.117 -1.200 0.171) 8.207 10.236 ( 2.888 8.039 2.029) 8.779 10.455 ( 3.821 1.739 5.592) 6.992 10.530 ( 1.194 -7.227 -1.012) 7.395 10.786 ( 2.112 -2.367 -17.008) 17.301 11.141 ( -2.141 -5.067 -7.564) 9.353 11.305 ( -4.987 1.499 -1.406) 5.394 11.382 ( -1.686 0.046 -2.531) 3.042 11.518 ( 5.187 -7.346 0.288) 8.998 12.141 ( 4.989 8.369 -1.562) 9.867 12.619 ( -6.246 -15.528 0.745) 16.754 12.805 ( -4.222 6.383 -9.948) 12.551 13.281 ( 7.337 2.621 12.663) 14.868 13.449 ( 8.484 1.477 6.217) 10.621 13.790 ( -7.567 -3.876 -5.047) 9.887 13.997 ( 2.979 -3.759 6.195) 7.835 14.689 ( -8.224 -0.030 -3.230) 8.835 15.313 ( 3.769 1.338 8.027) 8.968 16.346 ( -0.137 -0.852 10.095) 10.132 16.814 ( 2.008 -2.568 -3.018) 4.442 17.345 ( -4.079 7.715 -1.453) 8.847 17.556 ( 2.176 2.379 -1.830) 3.707 20.216 ( 3.110 2.756 2.824) 5.024 20.401 ( -7.529 3.133 2.801) 8.622 20.653 ( 10.344 -1.143 9.557) 14.129 20.999 ( -3.506 -9.283 0.292) 9.927 22.252 ( 7.490 4.712 -3.278) 9.437 22.657 ( 1.358 -2.733 -4.113) 5.121 23.131 ( -6.621 0.954 -1.712) 6.905 23.198 ( -2.925 -0.878 0.628) 3.118 24.316 ( -0.952 1.090 1.086) 1.809 24.574 ( 1.898 3.557 -3.691) 5.466 24.739 ( -2.529 0.841 3.867) 4.697 25.106 ( 0.751 -6.900 -5.427) 8.810 ======================= Grid point 304 (160/186) ======================= q-point: (-0.38 -0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.086 ( -15.762 -0.000 23.277) 28.112 3.725 ( -16.023 -0.000 16.591) 23.065 4.071 ( 1.631 0.000 -0.376) 1.674 4.110 ( 0.804 0.000 -2.094) 2.243 4.609 ( -9.015 -0.000 -7.619) 11.804 4.710 ( -1.522 -0.000 14.844) 14.922 4.788 ( 0.775 0.000 11.912) 11.937 5.269 ( 7.145 0.000 3.016) 7.755 5.544 ( 4.078 0.000 3.848) 5.606 5.556 ( 1.112 0.000 8.445) 8.518 5.911 ( -15.893 -0.000 -1.474) 15.961 5.981 ( -10.310 -0.000 -2.806) 10.685 6.273 ( 9.158 0.000 -14.111) 16.822 6.563 ( 7.797 0.000 8.004) 11.174 6.829 ( 14.931 0.000 -2.232) 15.097 6.871 ( 2.990 0.000 -13.931) 14.248 7.321 ( -10.690 -0.000 7.031) 12.795 7.649 ( -13.613 -0.000 -21.504) 25.451 7.736 ( 7.999 0.000 -3.307) 8.656 8.011 ( -4.706 -0.000 -12.103) 12.986 8.454 ( -17.380 -0.000 -4.665) 17.995 8.637 ( 1.980 0.000 -1.874) 2.726 8.784 ( 16.639 0.000 18.783) 25.093 9.158 ( -6.576 -0.000 8.905) 11.069 9.291 ( 15.966 0.000 5.113) 16.765 9.781 ( -6.984 -0.000 -0.371) 6.994 9.787 ( -0.108 -0.000 -1.149) 1.154 10.051 ( 1.920 0.000 -16.339) 16.452 10.408 ( 2.540 0.000 -4.361) 5.047 10.533 ( 2.149 0.000 0.088) 2.151 10.815 ( -3.829 -0.000 -21.294) 21.636 11.069 ( 7.319 0.000 4.811) 8.758 11.386 ( 6.660 0.000 13.281) 14.857 11.463 ( -6.369 -0.000 -14.900) 16.205 11.569 ( -2.510 -0.000 2.817) 3.773 11.775 ( -1.920 -0.000 3.933) 4.377 12.489 ( -6.111 -0.000 -4.510) 7.595 13.135 ( 12.445 0.000 0.142) 12.446 13.232 ( -3.605 -0.000 -8.528) 9.258 13.302 ( 8.792 0.000 10.920) 14.020 13.732 ( -6.453 -0.000 -8.855) 10.957 13.763 ( 1.776 0.000 9.568) 9.732 14.797 ( -8.288 -0.000 -1.569) 8.435 15.260 ( 9.572 0.000 8.299) 12.669 16.314 ( -2.201 -0.000 11.168) 11.383 16.718 ( 1.930 0.000 -3.072) 3.628 17.581 ( 4.085 0.000 3.743) 5.541 17.607 ( -3.447 -0.000 -7.168) 7.954 20.272 ( -1.603 -0.000 -6.157) 6.362 20.397 ( 15.246 0.000 15.014) 21.398 20.620 ( -5.250 -0.000 17.538) 18.307 20.837 ( -12.105 -0.000 -11.767) 16.882 22.361 ( 8.868 0.000 -3.924) 9.697 22.366 ( 9.191 0.000 1.218) 9.271 23.187 ( -2.502 -0.000 7.254) 7.673 23.390 ( -8.082 -0.000 -14.462) 16.567 24.382 ( -1.831 -0.000 -1.021) 2.096 24.503 ( 2.739 0.000 -0.246) 2.750 24.854 ( 3.016 0.000 12.829) 13.179 24.964 ( -7.718 -0.000 -12.198) 14.435 ======================= Grid point 305 (161/186) ======================= q-point: (-0.25 -0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.005 ( -14.179 -8.135 25.261) 30.089 3.544 ( -22.033 -4.526 21.316) 30.989 4.043 ( 1.365 3.822 0.068) 4.059 4.134 ( -1.478 -1.740 -2.976) 3.751 4.478 ( -5.283 2.077 -0.719) 5.722 4.590 ( 2.714 11.928 11.859) 17.038 4.984 ( 3.300 -9.468 5.614) 11.491 5.395 ( 6.920 -2.274 3.214) 7.962 5.552 ( -4.997 0.350 -1.000) 5.108 5.639 ( 2.784 -2.556 9.547) 10.268 5.751 ( -2.448 0.831 3.032) 3.985 5.901 ( -8.109 -6.433 -1.220) 10.422 6.332 ( 7.233 3.811 -12.359) 14.819 6.642 ( 3.147 2.221 6.339) 7.418 6.800 ( 5.925 8.577 -10.091) 14.508 6.996 ( -6.312 -4.047 0.287) 7.503 7.265 ( -4.761 -10.088 -6.647) 12.986 7.432 ( -7.838 -0.730 -8.835) 11.834 7.797 ( 8.840 5.523 -1.710) 10.563 7.979 ( -0.978 -1.301 -8.585) 8.738 8.199 ( -17.295 0.450 -7.649) 18.916 8.614 ( 2.433 5.749 -1.830) 6.506 8.797 ( -8.393 7.062 -2.861) 11.336 9.202 ( 15.360 4.526 21.697) 26.967 9.498 ( 6.528 -1.766 3.428) 7.582 9.694 ( 0.756 6.077 -10.314) 11.995 9.757 ( -4.325 -2.613 1.999) 5.434 10.135 ( -0.408 -13.894 -11.512) 18.049 10.417 ( 2.785 2.494 -4.683) 5.992 10.540 ( 1.171 1.444 5.087) 5.416 10.754 ( 3.195 -0.111 -26.525) 26.717 11.176 ( 5.662 -0.465 2.021) 6.030 11.308 ( -3.574 6.677 -3.361) 8.286 11.424 ( 1.341 3.585 7.786) 8.676 11.480 ( -3.038 3.675 1.380) 4.964 12.002 ( 3.030 -21.063 9.217) 23.190 12.393 ( -4.425 3.071 -4.089) 6.763 13.063 ( -2.396 10.245 -10.856) 15.118 13.305 ( 5.205 -2.174 4.902) 7.474 13.443 ( 8.538 -1.101 5.519) 10.226 13.681 ( -2.284 -2.549 -6.117) 7.009 13.848 ( 2.451 -4.960 8.299) 9.974 14.695 ( -6.503 0.274 -2.402) 6.938 15.361 ( 4.053 1.290 8.909) 9.872 16.335 ( 1.275 -0.043 9.580) 9.664 16.746 ( 2.120 -1.612 -3.851) 4.683 17.513 ( -4.325 3.427 -6.062) 8.197 17.617 ( 1.756 1.450 0.080) 2.279 20.260 ( 2.431 0.470 -3.983) 4.690 20.524 ( -6.613 5.172 7.771) 11.440 20.638 ( 6.552 0.363 12.071) 13.739 20.761 ( 2.294 -7.568 1.262) 8.008 22.399 ( 8.384 5.587 -2.758) 10.446 22.555 ( 8.073 -4.724 -1.347) 9.450 23.152 ( -5.507 0.146 5.170) 7.555 23.207 ( -10.867 1.381 -12.610) 16.704 24.348 ( -1.230 1.338 -1.218) 2.188 24.562 ( 3.105 -3.771 -1.333) 5.063 24.807 ( -5.016 4.396 -2.196) 7.022 24.955 ( 0.101 -4.112 4.731) 6.269 ======================= Grid point 306 (162/186) ======================= q-point: (-0.12 -0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.067 ( -10.175 -13.925 25.142) 30.489 3.418 ( -22.506 -11.867 21.787) 33.496 4.027 ( 2.340 1.992 2.821) 4.172 4.080 ( -4.312 3.669 4.705) 7.362 4.420 ( -1.841 0.675 1.814) 2.671 4.567 ( 8.369 3.935 2.007) 9.463 5.081 ( 1.243 1.578 -5.489) 5.845 5.403 ( -2.278 4.069 -3.866) 6.058 5.539 ( -1.087 -6.634 7.180) 9.836 5.743 ( -3.231 -1.273 6.104) 7.023 5.792 ( 3.906 -7.417 10.225) 13.222 5.956 ( 3.059 -5.755 -4.629) 7.994 6.306 ( 3.073 4.478 -4.329) 6.945 6.593 ( 0.248 5.691 -6.580) 8.703 6.719 ( -1.432 5.117 7.811) 9.447 7.012 ( -1.778 -6.844 -1.797) 7.296 7.194 ( -13.640 -7.886 -16.711) 22.967 7.466 ( 1.920 3.170 -2.531) 4.489 7.847 ( 7.194 2.855 0.769) 7.778 7.931 ( -1.823 -1.371 -1.231) 2.592 7.993 ( -11.135 1.378 -4.630) 12.138 8.539 ( 0.030 8.118 -0.438) 8.129 8.595 ( -3.892 3.044 -9.339) 10.566 9.335 ( 7.829 7.539 6.705) 12.770 9.508 ( -1.125 1.991 2.495) 3.384 9.629 ( -1.125 2.821 -3.034) 4.293 9.768 ( 3.091 -2.430 -4.242) 5.784 10.320 ( 0.530 -14.211 -7.403) 16.032 10.400 ( 2.393 3.013 -2.760) 4.735 10.568 ( 4.998 2.681 6.252) 8.441 10.754 ( 5.207 -0.594 -24.256) 24.815 11.171 ( -4.732 0.961 -8.433) 9.717 11.197 ( 1.116 4.547 2.646) 5.378 11.392 ( -1.852 3.204 2.604) 4.525 11.528 ( 6.750 -4.571 11.211) 13.862 12.265 ( -4.941 4.811 -3.212) 7.608 12.343 ( 2.958 -16.697 6.735) 18.246 12.847 ( -3.074 9.813 -11.544) 15.460 13.395 ( 1.914 -2.532 6.732) 7.443 13.553 ( 3.432 -1.458 2.063) 4.261 13.678 ( 0.450 1.405 0.823) 1.689 13.994 ( 5.230 -5.798 4.193) 8.863 14.609 ( -4.187 1.195 -1.760) 4.697 15.383 ( -0.067 2.012 8.833) 9.060 16.389 ( 3.553 0.267 8.056) 8.808 16.798 ( 2.687 -2.591 -4.245) 5.653 17.372 ( -5.258 5.684 -4.008) 8.719 17.593 ( -0.703 1.963 -2.472) 3.234 20.296 ( 5.131 0.983 -1.113) 5.342 20.363 ( -7.971 4.527 3.823) 9.932 20.663 ( -6.579 -6.219 3.198) 9.602 21.034 ( 21.254 -0.202 9.590) 23.319 22.386 ( -1.295 4.377 -7.068) 8.414 22.606 ( -2.006 1.854 -2.301) 3.571 23.065 ( -4.482 -0.135 1.084) 4.614 23.138 ( -0.614 -3.841 -0.254) 3.899 24.319 ( -0.080 0.808 -0.933) 1.237 24.652 ( 0.460 6.044 -2.767) 6.663 24.688 ( -1.010 -5.517 -1.072) 5.710 25.021 ( -0.604 -4.371 2.991) 5.331 ======================= Grid point 313 (163/186) ======================= q-point: (-0.25 -0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.836 ( -12.094 -0.000 29.186) 31.592 3.243 ( -25.390 -0.000 24.054) 34.975 4.075 ( -1.107 -0.000 -3.177) 3.364 4.094 ( -0.881 -0.000 -0.151) 0.894 4.419 ( -4.599 -0.000 1.350) 4.793 4.746 ( -1.945 -0.000 5.747) 6.067 4.937 ( 3.849 0.000 8.710) 9.523 5.433 ( -4.615 -0.000 2.403) 5.203 5.544 ( 8.286 0.000 -2.646) 8.698 5.690 ( 1.666 0.000 14.358) 14.454 5.714 ( -7.848 -0.000 3.026) 8.411 5.835 ( 7.112 0.000 -1.137) 7.202 6.462 ( 9.443 0.000 -10.579) 14.180 6.696 ( -0.573 -0.000 8.845) 8.864 6.809 ( -13.160 -0.000 -24.484) 27.797 6.845 ( -6.028 -0.000 -3.292) 6.869 7.036 ( -4.229 -0.000 -3.421) 5.439 7.510 ( 12.443 0.000 4.130) 13.111 7.914 ( -0.826 -0.000 -5.936) 5.993 7.925 ( -1.474 -0.000 2.488) 2.892 7.972 ( -13.253 -0.000 -9.612) 16.372 8.629 ( -2.902 -0.000 -3.341) 4.426 8.728 ( -6.514 -0.000 -3.057) 7.195 9.510 ( 14.357 0.000 23.530) 27.564 9.532 ( -9.464 -0.000 1.527) 9.586 9.586 ( 1.712 0.000 -0.161) 1.719 9.894 ( -3.409 -0.000 -25.979) 26.202 9.932 ( 11.418 0.000 -3.296) 11.884 10.460 ( 3.154 0.000 -10.282) 10.754 10.574 ( 1.826 0.000 3.922) 4.326 10.755 ( 6.239 0.000 -23.226) 24.049 11.114 ( -8.226 -0.000 -11.226) 13.917 11.374 ( 6.579 0.000 2.702) 7.113 11.446 ( -2.855 -0.000 3.410) 4.447 11.704 ( 5.379 0.000 19.412) 20.143 11.792 ( 1.910 0.000 12.968) 13.108 12.370 ( -3.107 -0.000 -2.176) 3.793 13.095 ( -3.386 -0.000 -10.817) 11.334 13.257 ( -3.858 -0.000 -8.995) 9.787 13.523 ( 4.395 0.000 9.397) 10.374 13.745 ( 9.924 0.000 -0.126) 9.925 13.862 ( 2.990 0.000 7.451) 8.028 14.628 ( -3.062 -0.000 -1.844) 3.575 15.416 ( -0.251 -0.000 9.786) 9.790 16.396 ( 4.397 0.000 7.691) 8.859 16.754 ( 2.760 0.000 -5.153) 5.845 17.456 ( -5.287 -0.000 -6.680) 8.520 17.631 ( -1.494 -0.000 -2.080) 2.561 20.306 ( 5.870 0.000 -3.852) 7.021 20.489 ( -10.071 -0.000 14.288) 17.481 20.515 ( -8.015 -0.000 -9.044) 12.084 21.036 ( 27.354 0.000 15.442) 31.412 22.471 ( -6.677 -0.000 -11.478) 13.279 22.629 ( 9.556 0.000 3.650) 10.229 23.059 ( -5.117 -0.000 -8.873) 10.243 23.084 ( -7.220 -0.000 4.988) 8.775 24.350 ( 0.293 0.000 -2.173) 2.193 24.537 ( -0.018 -0.000 -1.455) 1.456 24.783 ( -2.054 -0.000 -6.118) 6.453 24.950 ( -0.528 -0.000 11.371) 11.383 ======================= Grid point 314 (164/186) ======================= q-point: (-0.12 -0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.848 ( -7.778 -8.971 30.130) 32.385 3.051 ( -20.316 -7.285 26.618) 34.269 4.054 ( -0.702 0.108 0.602) 0.931 4.061 ( -4.047 0.729 2.161) 4.645 4.385 ( -2.748 -1.462 2.804) 4.189 4.670 ( -1.643 2.952 -5.409) 6.378 5.026 ( -1.922 -4.173 3.185) 5.590 5.390 ( -0.066 0.868 1.788) 1.989 5.618 ( 2.733 1.630 6.238) 7.002 5.640 ( -4.617 -0.307 -3.286) 5.675 5.781 ( 1.579 -3.318 12.741) 13.260 5.911 ( 1.900 -4.418 -3.415) 5.898 6.491 ( 10.491 6.887 -5.429) 13.674 6.621 ( -1.093 3.961 -13.171) 13.797 6.696 ( -7.844 -1.273 15.638) 17.541 6.863 ( -0.857 -11.614 -9.539) 15.054 7.018 ( 1.293 1.407 -3.538) 4.021 7.527 ( -3.769 8.038 -6.524) 11.017 7.779 ( -11.930 -4.099 -4.866) 13.520 7.874 ( -7.275 3.213 -0.457) 7.966 7.998 ( 9.733 -5.721 4.103) 12.012 8.553 ( -4.378 2.224 -3.546) 6.057 8.657 ( 3.930 6.762 -2.708) 8.277 9.390 ( -13.378 -2.818 -0.921) 13.702 9.530 ( 1.400 8.579 -2.844) 9.146 9.689 ( 4.443 2.197 13.876) 14.735 9.801 ( 2.394 -0.088 -18.823) 18.974 10.181 ( 11.330 -9.183 -1.441) 14.655 10.451 ( 2.363 1.427 -11.754) 12.074 10.624 ( 3.352 -2.017 -7.189) 8.185 10.795 ( 7.048 1.237 -10.957) 13.087 10.980 ( -9.937 -3.077 -12.869) 16.547 11.382 ( -1.065 2.192 1.688) 2.965 11.437 ( 2.932 5.831 2.444) 6.969 11.667 ( 8.454 7.505 21.895) 24.641 12.091 ( 0.702 -13.744 11.367) 17.850 12.325 ( -0.889 -1.440 2.223) 2.794 12.920 ( -3.506 10.129 -11.413) 15.657 13.249 ( -6.063 -8.871 -8.996) 14.014 13.607 ( 3.946 -0.424 10.436) 11.165 13.789 ( 3.427 6.082 0.734) 7.020 13.986 ( 4.606 -6.260 1.925) 8.006 14.615 ( 2.907 1.289 1.588) 3.555 15.412 ( -2.240 1.329 8.916) 9.288 16.475 ( 5.381 0.759 6.438) 8.425 16.797 ( 3.953 -1.793 -5.759) 7.212 17.348 ( -5.801 2.939 -5.146) 8.292 17.567 ( -5.643 0.796 -4.105) 7.024 20.332 ( -7.761 4.293 4.400) 9.901 20.379 ( 4.958 0.434 -2.279) 5.473 20.487 ( -3.718 -5.829 -0.131) 6.915 21.431 ( 29.606 2.953 10.517) 31.557 22.202 ( -24.710 1.806 -13.338) 28.138 22.721 ( 7.069 4.012 4.175) 9.138 22.996 ( -7.084 0.035 4.203) 8.237 23.104 ( 6.215 -5.039 -1.527) 8.146 24.340 ( 1.348 1.577 -2.406) 3.177 24.568 ( -3.264 -4.952 -2.407) 6.400 24.740 ( 3.632 2.907 -3.289) 5.698 24.974 ( -2.382 -2.143 7.984) 8.603 ======================= Grid point 322 (165/186) ======================= q-point: (-0.12 -0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.799 ( -2.054 -0.000 32.249) 32.314 2.852 ( -12.148 -0.000 30.811) 33.120 4.006 ( -5.884 -0.000 4.200) 7.229 4.037 ( -1.469 -0.000 -0.661) 1.611 4.345 ( -1.762 -0.000 1.102) 2.079 4.590 ( -7.676 -0.000 -12.645) 14.792 4.988 ( -2.253 -0.000 6.198) 6.595 5.460 ( 7.997 0.000 0.697) 8.027 5.508 ( -10.923 -0.000 12.213) 16.385 5.615 ( -9.511 -0.000 -20.171) 22.301 5.790 ( -0.875 -0.000 13.128) 13.157 5.923 ( 7.472 0.000 2.297) 7.817 6.619 ( -7.369 -0.000 23.585) 24.710 6.632 ( 12.526 0.000 -15.110) 19.627 6.742 ( 3.254 0.000 -7.668) 8.330 6.808 ( 14.110 0.000 0.177) 14.111 7.006 ( -6.682 -0.000 0.241) 6.686 7.506 ( -8.920 -0.000 -10.254) 13.591 7.562 ( -6.153 -0.000 -4.482) 7.613 7.842 ( -2.149 -0.000 -3.852) 4.411 8.023 ( 0.400 0.000 1.690) 1.736 8.540 ( 0.649 0.000 -1.188) 1.354 8.798 ( 8.698 0.000 -1.269) 8.790 9.168 ( -14.722 -0.000 -2.402) 14.917 9.582 ( -0.283 -0.000 -4.136) 4.146 9.753 ( 1.235 0.000 -17.417) 17.461 9.777 ( -1.171 -0.000 12.057) 12.114 10.328 ( 14.923 0.000 4.277) 15.524 10.440 ( -0.056 -0.000 -15.770) 15.770 10.622 ( 3.670 0.000 -15.948) 16.365 10.802 ( -6.648 -0.000 -13.862) 15.374 10.885 ( 6.054 0.000 0.879) 6.118 11.329 ( -6.568 -0.000 1.827) 6.817 11.518 ( 3.232 0.000 -5.208) 6.129 11.937 ( 5.264 0.000 17.761) 18.525 12.082 ( 12.042 0.000 24.707) 27.486 12.269 ( -4.551 -0.000 4.118) 6.137 12.957 ( -2.972 -0.000 -9.052) 9.527 13.035 ( -7.081 -0.000 -12.677) 14.521 13.670 ( 2.222 0.000 8.900) 9.173 13.863 ( -1.968 -0.000 -5.509) 5.850 13.970 ( 2.591 0.000 2.719) 3.755 14.722 ( 9.712 0.000 6.338) 11.597 15.408 ( -2.999 -0.000 7.135) 7.739 16.569 ( 5.461 0.000 5.797) 7.964 16.828 ( 5.296 0.000 -6.833) 8.645 17.285 ( -5.061 -0.000 -4.985) 7.104 17.444 ( -11.837 -0.000 -4.408) 12.631 20.276 ( -10.186 -0.000 10.094) 14.340 20.333 ( -1.804 -0.000 -6.772) 7.008 20.547 ( 12.586 0.000 -1.839) 12.720 21.788 ( -22.577 -0.000 -13.375) 26.241 21.897 ( 21.944 0.000 8.482) 23.526 22.792 ( -5.420 -0.000 3.802) 6.620 22.959 ( 2.127 0.000 6.012) 6.377 23.157 ( 7.607 0.000 -0.885) 7.659 24.372 ( 1.941 0.000 -3.692) 4.171 24.483 ( -3.460 -0.000 -1.866) 3.931 24.813 ( 6.429 0.000 -3.654) 7.395 24.933 ( -4.369 -0.000 8.155) 9.252 ======================= Grid point 323 (166/186) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 93 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.343 ( 0.266 0.000 -3.174) 3.185 3.343 ( -0.266 -0.000 3.174) 3.185 3.963 ( 0.879 0.000 -0.583) 1.054 3.963 ( -0.879 -0.000 0.583) 1.054 4.146 ( 3.847 0.000 -4.611) 6.005 4.146 ( -3.847 -0.000 4.611) 6.005 5.008 ( -0.253 -0.000 -8.792) 8.795 5.008 ( 0.253 0.000 8.792) 8.795 5.608 ( 6.823 0.000 -8.091) 10.584 5.608 ( -6.823 -0.000 8.091) 10.584 6.011 ( 5.180 0.000 -9.144) 10.509 6.011 ( -5.180 -0.000 9.144) 10.509 6.686 ( 13.000 0.000 -6.011) 14.323 6.686 ( -13.000 -0.000 6.011) 14.323 6.949 ( -0.162 -0.000 -16.014) 16.015 6.949 ( 0.162 0.000 16.014) 16.015 7.355 ( -0.453 -0.000 -0.583) 0.739 7.355 ( 0.453 0.000 0.583) 0.738 7.562 ( -10.831 -0.000 -14.340) 17.970 7.562 ( 10.831 0.000 14.340) 17.970 7.995 ( -8.739 -0.000 -16.736) 18.880 7.995 ( 8.739 0.000 16.736) 18.880 8.994 ( 8.406 0.000 -3.438) 9.082 8.994 ( -8.406 -0.000 3.438) 9.082 9.654 ( -5.269 -0.000 -4.544) 6.958 9.654 ( 5.269 0.000 4.544) 6.958 9.945 ( -20.517 -0.000 -5.330) 21.198 9.945 ( 20.517 0.000 5.330) 21.198 10.394 ( -1.021 -0.000 -1.477) 1.796 10.394 ( 1.021 0.000 1.477) 1.796 10.994 ( -19.827 -0.000 2.670) 20.006 10.994 ( 19.827 0.000 -2.670) 20.006 11.264 ( -7.204 -0.000 -5.714) 9.195 11.264 ( 7.204 0.000 5.714) 9.195 12.331 ( -3.120 -0.000 -0.068) 3.121 12.331 ( 3.120 0.000 0.068) 3.121 12.657 ( -2.360 -0.000 -1.504) 2.799 12.657 ( 2.360 0.000 1.504) 2.799 13.174 ( -14.244 -0.000 -20.664) 25.097 13.174 ( 14.244 0.000 20.664) 25.097 13.970 ( -0.982 -0.000 -4.224) 4.337 13.970 ( 0.982 0.000 4.224) 4.337 15.231 ( -10.469 -0.000 -6.816) 12.493 15.231 ( 10.469 0.000 6.816) 12.493 16.780 ( 2.568 0.000 -6.755) 7.226 16.780 ( -2.568 -0.000 6.755) 7.226 17.142 ( 5.669 0.000 -3.806) 6.829 17.142 ( -5.669 -0.000 3.806) 6.829 20.237 ( 6.377 0.000 -6.389) 9.027 20.237 ( -6.377 -0.000 6.389) 9.027 20.968 ( -21.376 -0.000 -0.951) 21.397 20.968 ( 21.376 0.000 0.951) 21.397 22.535 ( -17.208 -0.000 1.880) 17.311 22.535 ( 17.208 0.000 -1.880) 17.311 23.215 ( -0.538 -0.000 -4.858) 4.888 23.215 ( 0.538 0.000 4.858) 4.888 24.356 ( -3.463 -0.000 1.076) 3.627 24.356 ( 3.463 0.000 -1.076) 3.627 24.925 ( 9.566 0.000 -6.364) 11.490 24.925 ( -9.566 -0.000 6.364) 11.490 ======================= Grid point 325 (167/186) ======================= q-point: ( 0.12 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.348 ( 2.175 -2.784 -14.240) 14.671 3.389 ( 2.503 -5.443 -7.473) 9.578 3.970 ( -1.517 -1.527 4.831) 5.288 4.014 ( 2.152 -4.096 -0.019) 4.627 4.166 ( 0.223 -3.692 9.320) 10.027 4.235 ( 8.496 -1.207 1.247) 8.671 4.963 ( -0.958 5.440 3.039) 6.304 5.086 ( 7.613 -1.744 9.411) 12.229 5.555 ( -7.300 -2.622 3.385) 8.463 5.721 ( 6.134 -5.941 -7.335) 11.258 5.940 ( -9.111 0.366 9.357) 13.065 6.053 ( 3.834 -2.356 -10.064) 11.024 6.517 ( -13.777 0.113 7.851) 15.857 6.764 ( 0.275 0.175 -6.309) 6.317 6.914 ( 2.761 6.689 0.838) 7.285 7.033 ( 6.273 -1.398 -5.579) 8.510 7.270 ( 1.773 3.057 -10.608) 11.181 7.346 ( 1.359 -0.903 -17.262) 17.339 7.492 ( -3.081 -3.575 -1.560) 4.971 7.799 ( 8.258 -3.147 11.731) 14.687 7.859 ( 0.411 2.932 -4.203) 5.140 8.161 ( 9.715 -0.551 15.683) 18.457 8.878 ( -9.470 1.151 -1.327) 9.631 9.089 ( 8.187 0.693 -2.045) 8.467 9.521 ( -9.993 5.148 2.741) 11.571 9.706 ( -1.127 1.642 2.203) 2.970 9.723 ( -6.313 -0.328 -0.166) 6.324 10.222 ( 17.414 -0.649 1.041) 17.457 10.379 ( -1.122 -0.804 3.169) 3.457 10.410 ( 0.113 -0.746 3.543) 3.623 10.737 ( -20.004 -1.525 1.803) 20.143 11.164 ( -8.353 -2.702 -8.282) 12.069 11.211 ( 15.571 1.449 -2.880) 15.901 11.368 ( 4.185 -1.711 5.371) 7.021 12.161 ( -3.216 13.472 -10.207) 17.205 12.293 ( 2.896 9.738 9.231) 13.727 12.654 ( -4.478 -3.618 -11.756) 13.090 12.818 ( 4.611 -11.430 9.498) 15.560 12.958 ( -12.779 -3.187 -15.513) 20.350 13.390 ( 11.921 0.982 18.117) 21.709 13.937 ( -2.551 0.186 -4.996) 5.613 13.998 ( 0.603 -1.662 3.178) 3.636 15.037 ( -13.617 2.290 -7.387) 15.660 15.343 ( 7.391 2.307 4.876) 9.150 16.699 ( -6.711 2.904 3.472) 8.095 16.785 ( -1.436 -1.853 -1.180) 2.624 17.132 ( 0.225 -0.978 3.745) 3.877 17.265 ( 9.765 -2.112 -0.285) 9.995 20.194 ( -2.735 -0.114 6.181) 6.760 20.324 ( 9.254 0.240 -6.061) 11.064 20.719 ( -17.543 -1.065 1.188) 17.615 21.261 ( 22.437 1.010 4.487) 22.904 22.273 ( -19.077 2.976 -1.879) 19.399 22.705 ( 13.835 3.658 -3.012) 14.624 23.160 ( -5.702 0.095 -5.601) 7.993 23.228 ( -2.739 -3.116 3.039) 5.142 24.317 ( -2.824 0.250 2.235) 3.610 24.409 ( 4.277 -0.704 0.436) 4.357 24.825 ( -8.766 -0.786 4.701) 9.978 25.033 ( 8.803 -0.269 -7.993) 11.893 ======================= Grid point 326 (168/186) ======================= q-point: ( 0.25 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.442 ( 7.025 -7.669 -16.930) 19.869 3.518 ( 5.475 -8.895 -12.129) 16.007 3.979 ( -2.186 -0.936 7.982) 8.329 4.109 ( 1.480 -6.001 -2.035) 6.507 4.276 ( 1.900 -5.559 7.512) 9.536 4.382 ( 10.579 -0.109 5.002) 11.702 4.842 ( -2.913 10.635 11.078) 15.630 5.291 ( 12.675 -4.006 6.450) 14.775 5.509 ( -7.349 -4.362 0.718) 8.576 5.811 ( -7.769 -0.738 9.660) 12.418 5.848 ( -3.682 -5.339 0.318) 6.494 6.156 ( 7.329 -5.240 -13.388) 16.137 6.384 ( -10.458 -0.735 10.486) 14.828 6.661 ( -6.367 3.791 -11.900) 14.018 6.843 ( 1.055 6.230 -0.810) 6.371 7.071 ( 2.218 -1.520 -12.082) 12.377 7.268 ( 4.800 6.419 -1.087) 8.088 7.344 ( 0.502 -4.622 -26.480) 26.885 7.579 ( 4.799 -3.222 3.542) 6.779 7.744 ( 7.771 5.805 -3.084) 10.178 8.072 ( 9.022 -4.464 17.779) 20.431 8.309 ( 3.266 -2.646 8.542) 9.520 8.673 ( -13.644 5.881 -8.212) 16.976 9.194 ( 11.269 1.908 2.416) 11.682 9.329 ( -8.627 4.422 6.707) 11.789 9.635 ( -5.629 -4.970 -0.439) 7.522 9.733 ( 5.073 5.832 5.128) 9.276 10.301 ( -4.155 0.206 1.045) 4.289 10.374 ( -5.064 -2.001 4.324) 6.954 10.511 ( 8.422 0.278 -1.410) 8.543 10.636 ( -2.358 -7.840 8.897) 12.091 11.076 ( -8.015 -3.324 -11.261) 14.216 11.324 ( 6.557 2.762 -0.933) 7.176 11.436 ( 1.175 -0.172 0.295) 1.223 11.895 ( -1.651 13.529 -7.839) 15.723 12.217 ( 3.426 10.379 13.540) 17.401 12.529 ( -8.841 1.148 -20.927) 22.747 12.880 ( -8.027 -6.995 -7.067) 12.779 13.087 ( 6.863 -11.323 10.686) 17.015 13.536 ( 8.815 2.806 12.795) 15.789 13.867 ( -4.558 1.252 -6.249) 7.835 14.049 ( 0.619 -3.162 3.067) 4.448 14.802 ( -13.516 2.531 -6.134) 15.057 15.394 ( 5.291 3.162 2.811) 6.774 16.589 ( -5.024 2.405 3.137) 6.393 16.789 ( -2.534 -2.656 -0.005) 3.671 17.169 ( 1.960 -0.603 2.784) 3.458 17.409 ( 7.493 -1.475 1.453) 7.774 20.198 ( 0.851 -0.129 5.095) 5.168 20.411 ( 4.193 1.265 -3.840) 5.825 20.581 ( -5.971 -3.887 1.141) 7.215 21.474 ( 10.409 6.755 7.820) 14.668 22.019 ( -8.727 0.156 -6.045) 10.617 22.763 ( 5.163 5.853 -2.942) 8.341 23.072 ( -3.777 -0.411 -6.040) 7.136 23.242 ( -4.857 -4.708 2.529) 7.222 24.294 ( -1.823 -0.738 2.297) 3.024 24.480 ( 4.933 0.252 1.058) 5.051 24.748 ( -7.572 -2.468 4.143) 8.977 25.107 ( 6.180 0.993 -8.391) 10.469 ======================= Grid point 327 (169/186) ======================= q-point: ( 0.38 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.605 ( 3.850 -7.931 -11.821) 14.747 3.731 ( 11.627 -9.064 -10.308) 17.989 3.978 ( -1.847 0.260 8.302) 8.509 4.198 ( -0.714 -6.738 -5.759) 8.893 4.377 ( 2.270 -3.660 -0.777) 4.377 4.511 ( 6.972 0.780 4.985) 8.606 4.653 ( -4.510 13.766 17.416) 22.653 5.393 ( -3.337 -0.216 -2.756) 4.333 5.577 ( 3.097 -6.112 3.359) 7.631 5.770 ( -0.010 -1.985 10.410) 10.597 5.900 ( -4.028 -6.660 2.542) 8.188 6.240 ( -0.534 -1.832 -6.239) 6.524 6.318 ( -2.303 1.408 2.720) 3.832 6.528 ( -1.256 1.288 -5.953) 6.219 6.745 ( -2.243 6.131 -6.214) 9.013 7.111 ( 0.307 -5.804 -8.640) 10.413 7.215 ( 2.302 6.424 1.619) 7.013 7.331 ( -1.489 -1.646 -17.566) 17.705 7.653 ( 12.753 3.537 5.143) 14.199 7.892 ( 9.812 -2.484 0.463) 10.132 8.213 ( -7.389 -2.044 2.944) 8.212 8.333 ( -2.961 1.391 0.586) 3.324 8.391 ( -6.141 3.511 1.702) 7.276 9.211 ( -4.137 2.450 3.641) 6.031 9.315 ( 9.951 3.285 2.274) 10.723 9.697 ( 2.197 1.703 3.145) 4.198 9.747 ( 3.962 -5.260 0.429) 6.599 10.213 ( -8.972 -2.566 10.151) 13.789 10.405 ( -0.453 -5.077 3.860) 6.394 10.543 ( 1.956 1.888 -5.228) 5.893 10.804 ( 4.363 -5.627 6.460) 9.614 10.986 ( -5.097 1.534 -12.117) 13.234 11.295 ( -8.259 1.971 -0.671) 8.517 11.351 ( 3.007 7.372 -4.534) 9.163 11.812 ( 4.618 1.607 -0.373) 4.904 12.177 ( 4.083 6.748 14.799) 16.769 12.350 ( -7.456 1.384 -18.429) 19.929 12.853 ( -5.663 -3.646 -3.990) 7.828 13.348 ( 7.397 -8.652 9.559) 14.864 13.613 ( 5.450 2.536 6.274) 8.689 13.751 ( -6.200 2.896 -7.430) 10.101 14.102 ( -0.196 -2.423 2.454) 3.455 14.617 ( -8.255 1.091 -3.601) 9.072 15.414 ( 3.022 2.266 1.197) 3.963 16.522 ( -2.347 1.239 1.910) 3.270 16.792 ( -1.897 -1.855 0.145) 2.657 17.204 ( 1.456 -0.205 1.563) 2.146 17.499 ( 3.700 -0.512 1.170) 3.914 20.238 ( 3.776 0.482 2.787) 4.718 20.360 ( -6.696 -0.707 0.181) 6.735 20.695 ( 10.236 -4.412 -0.650) 11.165 21.311 ( -12.485 9.744 1.513) 15.909 22.095 ( 12.218 -2.823 -0.080) 12.540 22.659 ( -7.111 4.138 -3.624) 8.990 23.066 ( 3.299 0.489 -3.562) 4.879 23.243 ( -4.863 -3.681 1.873) 6.380 24.302 ( -0.735 -1.895 1.475) 2.512 24.503 ( 2.331 3.550 0.127) 4.248 24.738 ( -3.616 -4.865 4.000) 7.263 25.126 ( 3.008 1.959 -6.254) 7.211 ======================= Grid point 328 (170/186) ======================= q-point: (-0.50 0.00 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.675 ( 0.000 -0.000 -0.000) 0.000 3.904 ( 0.000 -0.000 -0.000) 0.000 3.969 ( -0.000 0.000 0.000) 0.000 4.234 ( 0.000 -0.000 -0.000) 0.000 4.436 ( -0.000 0.000 0.000) 0.000 4.498 ( 0.000 -0.000 -0.000) 0.000 4.555 ( 0.000 -0.000 -0.000) 0.000 5.354 ( -0.000 -0.000 -0.000) 0.000 5.634 ( -0.000 0.000 0.000) 0.000 5.876 ( -0.000 -0.000 0.000) 0.000 5.892 ( 0.000 -0.000 -0.000) 0.000 6.237 ( 0.000 0.000 0.000) 0.000 6.268 ( -0.000 -0.000 -0.000) 0.000 6.575 ( 0.000 -0.000 -0.000) 0.000 6.615 ( 0.000 -0.000 0.000) 0.000 7.168 ( 0.000 -0.000 -0.000) 0.000 7.178 ( 0.000 -0.000 0.000) 0.000 7.293 ( 0.000 -0.000 -0.000) 0.000 7.871 ( -0.000 0.000 -0.000) 0.000 7.892 ( 0.000 -0.000 0.000) 0.000 8.028 ( -0.000 -0.000 -0.000) 0.000 8.350 ( -0.000 -0.000 -0.000) 0.000 8.366 ( 0.000 -0.000 -0.000) 0.000 9.171 ( 0.000 -0.000 -0.000) 0.000 9.358 ( 0.000 -0.000 -0.000) 0.000 9.685 ( 0.000 -0.000 -0.000) 0.000 9.845 ( 0.000 -0.000 -0.000) 0.000 10.209 ( 0.000 -0.000 -0.000) 0.000 10.489 ( -0.000 -0.000 0.000) 0.000 10.509 ( 0.000 0.000 -0.000) 0.000 10.846 ( 0.000 0.000 0.000) 0.000 10.898 ( -0.000 -0.000 -0.000) 0.000 11.221 ( -0.000 -0.000 -0.000) 0.000 11.319 ( 0.000 -0.000 -0.000) 0.000 11.845 ( -0.000 -0.000 -0.000) 0.000 12.207 ( 0.000 0.000 0.000) 0.000 12.234 ( -0.000 -0.000 -0.000) 0.000 12.832 ( 0.000 -0.000 -0.000) 0.000 13.530 ( -0.000 0.000 -0.000) 0.000 13.620 ( 0.000 -0.000 -0.000) 0.000 13.639 ( 0.000 -0.000 -0.000) 0.000 14.119 ( 0.000 -0.000 -0.000) 0.000 14.551 ( 0.000 -0.000 -0.000) 0.000 15.418 ( 0.000 -0.000 -0.000) 0.000 16.501 ( 0.000 -0.000 -0.000) 0.000 16.793 ( 0.000 -0.000 -0.000) 0.000 17.217 ( 0.000 -0.000 -0.000) 0.000 17.528 ( 0.000 -0.000 -0.000) 0.000 20.290 ( 0.000 -0.000 -0.000) 0.000 20.295 ( 0.000 -0.000 -0.000) 0.000 20.865 ( 0.000 -0.000 -0.000) 0.000 21.080 ( -0.000 0.000 -0.000) 0.000 22.240 ( 0.000 -0.000 -0.000) 0.000 22.539 ( -0.000 -0.000 -0.000) 0.000 23.086 ( 0.000 -0.000 -0.000) 0.000 23.236 ( 0.000 -0.000 -0.000) 0.000 24.318 ( 0.000 -0.000 -0.000) 0.000 24.483 ( -0.000 -0.000 -0.000) 0.000 24.764 ( 0.000 -0.000 -0.000) 0.000 25.119 ( 0.000 -0.000 -0.000) 0.000 ======================= Grid point 334 (171/186) ======================= q-point: ( 0.12 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.324 ( 2.692 0.000 -18.195) 18.393 3.379 ( 9.411 0.000 -19.063) 21.259 3.963 ( -1.061 -0.000 4.828) 4.943 4.003 ( 0.672 0.000 4.453) 4.503 4.177 ( 1.668 0.000 11.023) 11.148 4.389 ( 13.959 0.000 5.406) 14.969 5.039 ( 2.440 0.000 0.106) 2.442 5.200 ( 8.725 0.000 20.228) 22.029 5.480 ( -4.263 -0.000 1.542) 4.533 5.723 ( 3.316 0.000 -5.754) 6.641 5.835 ( -10.915 -0.000 8.848) 14.051 6.034 ( 2.168 0.000 -10.750) 10.966 6.368 ( -11.578 -0.000 9.342) 14.877 6.705 ( -5.660 -0.000 -6.808) 8.854 6.989 ( -4.619 -0.000 -7.550) 8.851 7.086 ( 5.571 0.000 -8.770) 10.390 7.234 ( 5.618 0.000 -31.230) 31.731 7.365 ( 6.317 0.000 -2.170) 6.679 7.463 ( 2.060 0.000 3.721) 4.253 7.920 ( 10.115 0.000 -10.939) 14.899 7.960 ( 8.586 0.000 13.717) 16.182 8.295 ( 4.621 0.000 18.558) 19.125 8.759 ( -10.521 -0.000 2.523) 10.819 9.197 ( 8.250 0.000 -5.922) 10.156 9.392 ( -11.445 -0.000 9.139) 14.646 9.616 ( -2.804 -0.000 -0.663) 2.881 9.827 ( 3.962 0.000 9.042) 9.872 10.306 ( -1.758 -0.000 -2.743) 3.259 10.400 ( -1.029 -0.000 4.078) 4.205 10.424 ( -12.095 -0.000 -7.415) 14.187 10.517 ( 6.392 0.000 14.586) 15.925 11.007 ( -9.397 -0.000 -6.773) 11.583 11.395 ( 11.767 0.000 -4.924) 12.756 11.413 ( 2.379 0.000 3.220) 4.004 12.223 ( -3.323 -0.000 -9.461) 10.027 12.362 ( -0.574 -0.000 -4.578) 4.614 12.574 ( -7.208 -0.000 -18.315) 19.682 12.771 ( -5.245 -0.000 4.138) 6.681 12.781 ( 4.864 0.000 10.918) 11.952 13.577 ( 8.453 0.000 15.030) 17.244 13.895 ( -2.839 -0.000 -5.037) 5.782 13.986 ( -0.691 -0.000 1.423) 1.582 14.843 ( -15.400 -0.000 -6.008) 16.531 15.445 ( 4.580 0.000 2.968) 5.458 16.665 ( -5.975 -0.000 9.569) 11.281 16.697 ( -4.275 -0.000 -6.648) 7.904 17.172 ( 3.274 0.000 6.391) 7.181 17.392 ( 10.472 0.000 0.885) 10.509 20.196 ( 0.582 0.000 7.240) 7.263 20.451 ( 12.075 0.000 -7.454) 14.191 20.504 ( -14.543 -0.000 2.564) 14.768 21.569 ( 17.788 0.000 9.231) 20.041 22.036 ( -16.200 -0.000 -6.058) 17.296 22.880 ( 8.906 0.000 -5.188) 10.306 23.075 ( -5.354 -0.000 -5.424) 7.621 23.128 ( -7.807 -0.000 2.220) 8.117 24.300 ( -1.685 -0.000 3.361) 3.759 24.449 ( 3.106 0.000 1.180) 3.323 24.732 ( -6.375 -0.000 4.226) 7.648 25.117 ( 7.605 0.000 -10.367) 12.857 ======================= Grid point 335 (172/186) ======================= q-point: ( 0.25 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.371 ( 5.838 -5.929 -21.109) 22.690 3.529 ( 16.127 -4.193 -18.939) 25.226 3.963 ( -2.180 -1.069 8.190) 8.543 4.039 ( -0.816 -3.221 2.625) 4.234 4.254 ( 1.544 -3.322 10.517) 11.137 4.582 ( 14.861 2.691 3.342) 15.468 5.008 ( 0.978 7.820 6.449) 10.183 5.391 ( 5.497 -1.363 11.218) 12.566 5.426 ( -1.338 -0.743 1.457) 2.113 5.718 ( -8.331 -0.590 10.305) 13.264 5.746 ( -2.882 -3.241 2.439) 4.976 6.103 ( 4.339 -6.609 -15.845) 17.708 6.283 ( -5.993 -0.834 11.204) 12.734 6.612 ( -3.419 0.680 -5.037) 6.125 6.852 ( -5.971 1.990 -15.909) 17.109 7.071 ( -1.160 2.302 -9.234) 9.587 7.258 ( 6.982 -1.334 -27.014) 27.934 7.409 ( 4.851 4.985 1.441) 7.103 7.626 ( 11.358 -4.650 5.792) 13.571 7.976 ( 8.688 4.667 -4.893) 11.009 8.083 ( -1.212 -4.507 -1.805) 5.004 8.360 ( 1.877 2.170 18.857) 19.074 8.593 ( -8.492 6.554 0.807) 10.757 9.268 ( -4.623 -2.830 16.342) 17.217 9.397 ( 14.077 1.694 -0.670) 14.194 9.565 ( -2.837 1.299 1.980) 3.695 9.856 ( 0.921 2.302 5.005) 5.586 10.163 ( -15.855 0.556 -3.688) 16.288 10.302 ( -1.284 -2.079 3.034) 3.896 10.449 ( -0.569 -5.665 0.392) 5.707 10.723 ( 11.300 -2.032 9.839) 15.120 10.894 ( -8.064 -3.223 -7.784) 11.662 11.395 ( -0.749 4.442 -0.222) 4.510 11.504 ( 5.922 0.864 -4.678) 7.596 12.017 ( -4.808 12.381 -12.129) 17.987 12.355 ( -2.531 -1.167 0.842) 2.911 12.415 ( -4.483 1.631 -19.729) 20.298 12.715 ( -2.220 1.598 6.791) 7.322 13.029 ( 6.942 -13.105 12.031) 19.097 13.668 ( 2.011 0.828 7.934) 8.227 13.820 ( -4.435 2.385 -4.980) 7.082 14.004 ( -0.774 -3.410 0.435) 3.524 14.644 ( -11.314 0.619 -1.827) 11.478 15.482 ( 2.156 1.707 1.462) 3.114 16.578 ( -3.342 2.885 0.975) 4.522 16.685 ( -3.925 -4.542 1.160) 6.114 17.229 ( 3.609 0.925 6.798) 7.752 17.509 ( 7.196 0.657 1.439) 7.368 20.242 ( 3.602 0.008 7.314) 8.153 20.348 ( -10.188 -0.271 2.951) 10.610 20.608 ( 12.799 -1.591 -7.852) 15.100 21.535 ( -18.231 4.884 0.030) 18.874 22.046 ( 16.330 -0.741 2.071) 16.478 22.809 ( -8.414 5.746 -4.555) 11.161 23.058 ( -4.452 -2.478 -0.326) 5.105 23.102 ( 3.244 -3.632 -2.870) 5.652 24.285 ( -0.719 0.670 3.052) 3.206 24.519 ( 3.064 -3.812 2.183) 5.356 24.664 ( -4.576 1.564 4.089) 6.333 25.169 ( 4.970 0.751 -11.396) 12.456 ======================= Grid point 336 (173/186) ======================= q-point: ( 0.38 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.514 ( 6.869 -8.341 -18.369) 21.311 3.801 ( 18.920 -5.603 -12.946) 23.600 3.976 ( -2.502 -1.375 12.109) 12.441 4.073 ( -2.097 -4.753 -4.670) 6.985 4.330 ( -1.408 -3.082 6.953) 7.735 4.659 ( 7.120 7.398 -4.410) 11.175 4.883 ( -1.216 13.863 13.510) 19.396 5.358 ( -0.278 0.496 0.152) 0.589 5.501 ( -4.328 -5.449 9.621) 11.874 5.766 ( -1.313 -6.518 7.251) 9.838 5.789 ( 3.266 -4.682 3.569) 6.732 6.147 ( -2.246 -2.589 -16.799) 17.145 6.295 ( 0.620 -3.083 4.896) 5.819 6.592 ( 5.260 4.005 -8.198) 10.531 6.752 ( -4.992 0.356 -3.171) 5.925 7.002 ( -1.083 -2.417 -5.688) 6.274 7.313 ( 6.956 0.481 -15.402) 16.907 7.360 ( 0.577 7.874 2.220) 8.202 7.819 ( 9.995 -2.145 6.113) 11.911 7.968 ( -6.413 0.392 -8.056) 10.304 8.034 ( -6.137 0.367 -4.725) 7.754 8.390 ( 0.567 3.010 14.877) 15.189 8.452 ( 5.173 7.671 5.434) 10.730 9.237 ( -1.610 3.766 11.442) 12.153 9.449 ( -1.462 5.273 1.857) 5.778 9.682 ( 6.563 -5.534 -2.608) 8.972 9.819 ( 2.490 3.272 -3.531) 5.419 10.067 ( -5.031 -8.656 11.988) 15.619 10.346 ( 0.302 -3.838 3.995) 5.548 10.504 ( -1.475 -3.555 -4.112) 5.632 10.778 ( -4.188 -0.739 -8.255) 9.286 10.952 ( 5.339 -4.236 7.665) 10.257 11.267 ( -4.805 6.784 -3.243) 8.923 11.474 ( 1.415 7.179 -4.971) 8.846 11.818 ( -4.322 2.155 -12.359) 13.269 12.305 ( -1.519 4.703 -7.502) 8.984 12.351 ( 2.831 2.352 6.011) 7.049 12.698 ( -3.446 -3.809 1.484) 5.346 13.332 ( 8.238 -11.373 9.066) 16.715 13.652 ( -4.996 0.082 1.799) 5.311 13.693 ( -6.610 3.194 -6.042) 9.508 14.048 ( -0.763 -4.249 -0.902) 4.410 14.554 ( -1.768 0.171 3.203) 3.663 15.462 ( -1.017 2.361 0.430) 2.606 16.518 ( -1.097 1.291 -2.066) 2.672 16.712 ( -2.454 -4.491 2.204) 5.572 17.267 ( 3.081 2.388 6.431) 7.520 17.562 ( 3.378 1.942 0.383) 3.915 20.253 ( -6.839 -1.362 3.038) 7.606 20.322 ( 5.790 0.790 6.071) 8.426 20.790 ( 12.805 -3.009 -7.654) 15.219 21.188 ( -19.960 4.772 -5.419) 21.226 22.255 ( 9.631 1.034 4.713) 10.772 22.607 ( -6.832 4.341 -1.436) 8.221 23.034 ( -6.021 -4.037 2.339) 7.617 23.202 ( 6.811 -1.350 -4.516) 8.283 24.288 ( 0.555 -0.479 2.165) 2.286 24.583 ( -2.238 4.423 3.835) 6.267 24.638 ( 1.972 -6.544 2.997) 7.463 25.167 ( 1.864 2.007 -10.499) 10.850 ======================= Grid point 337 (174/186) ======================= q-point: ( 0.50 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.656 ( 4.826 -4.685 -10.226) 12.240 3.939 ( -1.373 4.185 1.431) 4.631 3.988 ( -1.277 0.696 11.734) 11.824 4.197 ( 9.999 -10.610 -16.899) 22.319 4.313 ( -5.768 0.040 1.911) 6.076 4.586 ( 1.422 7.421 -2.304) 7.900 4.681 ( -2.435 12.015 5.054) 13.261 5.386 ( 1.864 -0.577 4.195) 4.626 5.587 ( 0.339 -6.070 10.229) 11.899 5.784 ( -4.566 -1.528 1.102) 4.939 5.950 ( 7.728 -4.482 -5.450) 10.465 6.134 ( 0.990 -4.984 -15.064) 15.898 6.340 ( 0.190 0.082 2.150) 2.160 6.603 ( 1.175 3.211 -8.105) 8.796 6.627 ( -0.449 1.723 0.401) 1.825 7.137 ( 3.073 -8.409 11.235) 14.366 7.222 ( -4.282 7.548 6.109) 10.613 7.320 ( 2.518 3.863 -4.754) 6.623 7.767 ( -9.648 7.160 -5.406) 13.175 7.907 ( -9.192 -3.585 -3.156) 10.359 8.094 ( 18.731 -3.208 8.196) 20.696 8.343 ( -4.900 3.137 4.281) 7.223 8.489 ( 8.731 6.035 2.540) 10.913 9.208 ( -0.371 2.423 8.651) 8.991 9.316 ( -7.654 3.356 -4.969) 9.723 9.645 ( -4.391 0.393 -5.973) 7.423 9.880 ( 3.222 1.226 -0.314) 3.461 10.230 ( 5.060 -3.321 4.738) 7.687 10.431 ( -1.178 -4.301 6.761) 8.099 10.532 ( 2.578 -1.301 -6.285) 6.916 10.705 ( -4.236 -6.195 -9.924) 12.442 11.024 ( 2.865 5.270 8.806) 10.654 11.178 ( -1.510 -2.787 1.335) 3.440 11.394 ( 2.981 5.773 -1.522) 6.673 11.733 ( -6.753 -3.491 -13.404) 15.410 12.182 ( -4.131 5.227 -7.103) 9.738 12.398 ( 7.626 4.333 16.792) 18.945 12.769 ( 1.524 -7.967 -0.913) 8.163 13.508 ( -5.197 2.080 -8.915) 10.527 13.557 ( -8.991 -1.539 -3.671) 9.832 13.622 ( 5.049 -5.739 10.176) 12.727 14.094 ( 0.122 -3.120 -3.112) 4.408 14.595 ( 5.593 -0.340 6.000) 8.210 15.398 ( -4.578 1.246 -0.646) 4.789 16.504 ( 1.419 -0.059 -3.719) 3.981 16.751 ( -1.598 -3.935 1.715) 4.581 17.273 ( 2.382 3.878 5.400) 7.062 17.549 ( 0.058 2.798 -1.196) 3.043 20.209 ( -4.142 -1.460 2.708) 5.159 20.395 ( 5.894 1.787 3.023) 6.861 20.829 ( -9.527 4.552 -6.759) 12.536 21.056 ( 6.449 -7.693 -5.307) 11.355 22.200 ( -8.842 4.516 1.490) 10.040 22.587 ( 2.662 -1.283 2.919) 4.154 23.034 ( -1.315 -1.882 5.099) 5.592 23.284 ( 5.742 -0.141 -4.925) 7.566 24.319 ( 1.545 -1.016 0.791) 2.012 24.501 ( -2.595 3.457 3.503) 5.563 24.756 ( 3.217 -3.775 2.003) 5.349 25.121 ( -0.869 1.866 -6.711) 7.019 ======================= Grid point 338 (175/186) ======================= q-point: (-0.38 0.12 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.665 ( -3.394 5.334 5.738) 8.538 3.788 ( -4.323 8.969 2.906) 10.372 3.995 ( 1.966 0.594 -0.082) 2.055 4.209 ( -8.149 -1.806 -5.457) 9.972 4.357 ( 2.085 1.649 -0.684) 2.745 4.480 ( -3.477 6.352 3.975) 8.261 4.630 ( 10.406 -1.173 -13.280) 16.913 5.356 ( -11.804 0.282 3.026) 12.189 5.666 ( 8.509 3.643 1.773) 9.424 5.797 ( 5.972 -1.834 -6.591) 9.081 6.022 ( 3.397 4.201 -4.199) 6.842 6.191 ( -1.442 -3.409 -5.062) 6.271 6.374 ( 6.149 -1.242 -0.979) 6.349 6.556 ( 1.719 -2.359 1.848) 3.454 6.688 ( -2.224 -4.511 5.486) 7.443 7.086 ( -9.349 -2.969 4.341) 10.727 7.222 ( 0.626 7.449 8.212) 11.105 7.374 ( 1.857 -6.863 4.634) 8.486 7.559 ( 0.314 10.205 9.208) 13.749 7.824 ( -4.489 1.030 -5.057) 6.839 8.193 ( -8.734 4.043 -8.055) 12.550 8.436 ( 0.845 2.396 -1.558) 2.980 8.467 ( 14.659 -2.712 9.307) 17.574 9.114 ( -12.209 -2.460 -1.685) 12.568 9.273 ( 6.468 1.141 -1.330) 6.701 9.598 ( -3.632 -2.217 -3.706) 5.643 9.837 ( 1.740 6.828 -0.007) 7.046 10.318 ( 6.233 0.476 -2.482) 6.726 10.428 ( -8.168 -3.434 -0.770) 8.894 10.466 ( -0.264 4.654 -7.461) 8.798 10.799 ( 0.585 -2.060 -5.848) 6.227 11.085 ( 7.840 -2.135 14.876) 16.951 11.219 ( -5.263 -4.982 6.653) 9.837 11.410 ( 8.917 1.572 -1.109) 9.122 11.669 ( -7.003 -4.877 -8.721) 12.201 12.041 ( -6.232 0.730 -9.548) 11.425 12.523 ( 10.519 1.392 20.132) 22.757 12.919 ( 5.515 -5.345 0.916) 7.735 13.324 ( -8.188 5.584 -10.647) 14.546 13.450 ( -10.201 -2.956 -5.725) 12.065 13.808 ( 6.850 -3.628 7.931) 11.090 14.104 ( -1.021 -0.168 -4.625) 4.740 14.731 ( 10.244 -2.000 6.807) 12.461 15.317 ( -7.160 -1.441 -2.186) 7.624 16.540 ( 4.169 -1.199 -4.077) 5.954 16.780 ( -2.197 -3.034 0.798) 3.830 17.251 ( 2.218 4.906 3.952) 6.679 17.481 ( -3.001 3.543 -2.362) 5.209 20.193 ( -1.368 -0.652 1.035) 1.836 20.408 ( -2.498 1.383 0.066) 2.856 20.688 ( 1.977 3.275 -2.680) 4.671 21.235 ( -0.391 -9.156 -6.596) 11.292 22.061 ( -1.111 3.074 4.486) 5.551 22.615 ( -6.430 -4.592 1.113) 7.979 23.086 ( 5.265 0.520 7.726) 9.363 23.324 ( 3.370 1.139 -5.460) 6.517 24.342 ( 1.856 1.301 -1.162) 2.547 24.449 ( -2.726 0.275 3.276) 4.270 24.826 ( 4.690 0.819 -2.337) 5.303 25.074 ( -3.494 -0.401 0.577) 3.564 ======================= Grid point 339 (176/186) ======================= q-point: (-0.25 0.12 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.522 ( -2.979 8.658 13.173) 16.043 3.609 ( -4.116 9.210 -1.287) 10.170 4.021 ( 4.260 1.062 -5.562) 7.086 4.126 ( -5.184 1.141 0.590) 5.341 4.292 ( -2.052 4.853 4.170) 6.720 4.343 ( -2.991 6.552 -7.107) 10.118 4.804 ( 11.015 -4.118 -7.006) 13.688 5.140 ( -15.196 1.987 -1.619) 15.411 5.728 ( 12.049 8.068 -2.310) 14.683 5.906 ( 8.695 0.488 -7.650) 11.592 5.944 ( -1.592 5.438 0.009) 5.666 6.118 ( -9.595 1.867 9.419) 13.575 6.497 ( 10.681 -1.654 -8.022) 13.460 6.710 ( -5.790 -5.327 -0.302) 7.874 6.720 ( 8.298 -6.541 9.137) 13.969 7.047 ( -13.713 -6.496 4.195) 15.743 7.158 ( 3.395 3.655 8.453) 9.815 7.331 ( -7.694 0.034 -1.261) 7.797 7.661 ( 9.585 3.902 20.962) 23.378 7.764 ( 8.149 3.295 -2.613) 9.170 7.968 ( -10.572 5.549 -14.454) 18.747 8.219 ( -14.829 3.858 -8.719) 17.630 8.786 ( 12.118 -5.823 9.804) 16.640 9.038 ( -6.283 -3.705 -6.188) 9.565 9.373 ( 7.959 -2.110 0.130) 8.235 9.574 ( -6.027 -3.949 -3.547) 8.031 9.829 ( 11.275 4.973 3.317) 12.762 10.255 ( -14.436 1.334 -2.898) 14.784 10.389 ( -0.356 -0.824 -0.536) 1.045 10.419 ( 0.626 0.650 -6.080) 6.146 10.832 ( 12.161 3.865 -4.772) 13.624 11.166 ( -12.132 -1.922 4.132) 12.960 11.235 ( 7.267 0.849 14.006) 15.802 11.445 ( -2.092 2.471 -9.027) 9.590 11.765 ( 5.182 -12.109 7.399) 15.107 11.988 ( -5.937 -8.370 -11.803) 15.640 12.711 ( 11.326 0.526 20.069) 23.051 13.025 ( 1.022 0.059 -3.642) 3.783 13.116 ( -2.568 6.922 -2.906) 7.935 13.341 ( -9.758 -2.276 -10.495) 14.510 13.931 ( 4.870 -0.630 6.247) 7.946 14.055 ( -2.420 1.693 -4.826) 5.658 14.939 ( 12.069 -3.891 6.791) 14.385 15.244 ( -8.707 -3.806 -4.216) 10.396 16.626 ( 6.522 -2.257 -3.098) 7.565 16.778 ( -4.149 -2.306 0.333) 4.758 17.221 ( 3.226 5.233 2.371) 6.589 17.362 ( -5.643 4.479 -2.457) 7.612 20.198 ( 1.919 0.117 -1.804) 2.636 20.320 ( -7.448 0.291 1.554) 7.614 20.765 ( 13.877 1.778 -0.558) 14.001 21.196 ( -15.944 -3.709 -4.942) 17.100 22.168 ( 14.035 -3.148 4.152) 14.971 22.560 ( -12.880 -5.710 0.150) 14.090 23.178 ( 6.649 1.012 7.923) 10.392 23.310 ( 0.072 2.032 -5.903) 6.244 24.339 ( 2.562 1.877 -1.578) 3.547 24.416 ( -3.801 -0.049 1.361) 4.038 24.870 ( 7.239 1.888 -4.833) 8.907 25.029 ( -6.374 -0.643 5.444) 8.407 ======================= Grid point 340 (177/186) ======================= q-point: (-0.12 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.441 ( -1.503 6.636 -8.928) 11.225 3.441 ( 1.503 6.636 8.929) 11.225 4.036 ( 3.144 3.445 -4.068) 6.189 4.036 ( -3.144 3.445 4.068) 6.189 4.218 ( 0.971 4.901 -5.752) 7.619 4.218 ( -0.971 4.901 5.752) 7.619 4.968 ( -1.706 -1.678 -8.262) 8.601 4.968 ( 1.706 -1.678 8.262) 8.601 5.740 ( 6.273 8.438 -5.834) 12.024 5.740 ( -6.273 8.438 5.834) 12.024 6.020 ( 7.646 -0.008 -11.245) 13.598 6.020 ( -7.646 -0.008 11.245) 13.598 6.656 ( -0.759 -2.279 -3.686) 4.400 6.656 ( 0.759 -2.279 3.686) 4.400 6.930 ( -3.562 -1.937 -7.066) 8.146 6.930 ( 3.562 -1.937 7.066) 8.146 7.255 ( -5.035 -3.837 -7.940) 10.155 7.255 ( 5.035 -3.837 7.940) 10.155 7.701 ( -9.298 6.973 -18.085) 21.497 7.701 ( 9.298 6.973 18.085) 21.497 7.969 ( -13.002 -0.617 -13.925) 19.061 7.969 ( 13.002 -0.617 13.925) 19.061 8.977 ( -4.369 -1.674 -8.916) 10.069 8.977 ( 4.369 -1.674 8.916) 10.069 9.541 ( -3.807 -5.899 -6.954) 9.881 9.541 ( 3.807 -5.899 6.954) 9.881 9.992 ( -17.223 2.587 -6.477) 18.582 9.992 ( 17.223 2.587 6.477) 18.582 10.401 ( -0.848 0.191 -2.795) 2.927 10.401 ( 0.848 0.191 2.795) 2.927 10.990 ( -8.705 0.539 -1.095) 8.790 10.990 ( 8.705 0.539 1.095) 8.790 11.322 ( -5.740 3.025 -9.815) 11.766 11.322 ( 5.740 3.025 9.815) 11.766 12.046 ( -4.295 -13.349 -12.638) 18.878 12.046 ( 4.295 -13.349 12.638) 18.878 12.844 ( -6.148 6.184 -16.721) 18.858 12.844 ( 6.148 6.184 16.721) 18.858 13.187 ( -11.016 0.901 -15.098) 18.711 13.187 ( 11.016 0.901 15.098) 18.711 13.988 ( -2.405 1.112 -4.999) 5.658 13.988 ( 2.405 1.112 4.999) 5.658 15.165 ( -10.616 -4.125 -6.310) 13.020 15.165 ( 10.616 -4.125 6.310) 13.020 16.743 ( 0.400 -2.302 -6.678) 7.075 16.743 ( -0.400 -2.302 6.678) 7.075 17.212 ( -2.161 4.529 -4.594) 6.803 17.212 ( 2.161 4.529 4.594) 6.803 20.238 ( 3.484 0.090 -6.348) 7.242 20.238 ( -3.484 0.090 6.348) 7.242 20.971 ( -15.745 0.039 -3.853) 16.210 20.971 ( 15.745 0.039 3.853) 16.210 22.446 ( -15.670 -5.253 -0.716) 16.542 22.446 ( 15.670 -5.253 0.716) 16.542 23.246 ( -3.165 1.672 -6.088) 7.062 23.246 ( 3.165 1.672 6.088) 7.062 24.361 ( -0.684 0.574 -1.294) 1.572 24.361 ( 0.684 0.574 1.294) 1.572 24.943 ( 8.356 0.884 -5.865) 10.247 24.943 ( -8.356 0.884 5.865) 10.247 ======================= Grid point 344 (178/186) ======================= q-point: ( 0.25 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.370 ( 9.199 0.000 -23.686) 25.410 3.706 ( 22.326 0.000 -20.594) 30.374 3.933 ( -3.539 -0.000 8.899) 9.577 4.021 ( -1.248 -0.000 6.380) 6.501 4.275 ( 0.815 0.000 11.388) 11.417 4.821 ( 15.325 0.000 -0.748) 15.343 5.053 ( -2.045 -0.000 -2.171) 2.983 5.413 ( -6.923 -0.000 11.063) 13.051 5.423 ( -0.269 -0.000 3.730) 3.739 5.668 ( -5.709 -0.000 6.998) 9.032 5.699 ( 1.894 0.000 10.909) 11.073 6.057 ( 2.898 0.000 -19.043) 19.262 6.292 ( 2.269 0.000 14.627) 14.802 6.560 ( -2.523 -0.000 2.492) 3.547 6.735 ( -3.760 -0.000 -23.412) 23.712 7.039 ( -1.758 -0.000 -10.379) 10.527 7.331 ( 13.300 0.000 -23.163) 26.709 7.492 ( -1.913 -0.000 5.279) 5.615 7.793 ( 15.919 0.000 4.096) 16.438 7.902 ( -10.955 -0.000 -3.538) 11.512 8.047 ( -5.619 -0.000 -6.696) 8.742 8.446 ( 1.001 0.000 17.250) 17.279 8.662 ( 7.790 0.000 3.520) 8.548 9.278 ( 0.404 0.000 29.900) 29.903 9.543 ( -4.439 -0.000 2.654) 5.171 9.589 ( 14.790 0.000 -2.693) 15.033 9.829 ( -5.313 -0.000 5.108) 7.370 9.957 ( -12.016 -0.000 -19.246) 22.689 10.303 ( 1.065 0.000 5.157) 5.266 10.413 ( 0.304 0.000 5.786) 5.794 10.758 ( -5.958 -0.000 -7.630) 9.681 10.865 ( 8.894 0.000 10.958) 14.114 11.417 ( -2.767 -0.000 -1.456) 3.127 11.550 ( 2.763 0.000 -6.186) 6.775 12.057 ( -4.866 -0.000 -15.322) 16.076 12.112 ( -11.020 -0.000 -14.431) 18.157 12.390 ( 0.719 0.000 -7.479) 7.513 12.854 ( 3.343 0.000 13.485) 13.893 13.021 ( 8.736 0.000 12.978) 15.644 13.647 ( -6.443 -0.000 0.483) 6.461 13.756 ( -8.086 -0.000 -3.017) 8.630 13.962 ( -0.640 -0.000 -2.569) 2.648 14.557 ( -2.374 -0.000 4.622) 5.196 15.503 ( -1.291 -0.000 0.540) 1.399 16.561 ( -2.461 -0.000 -8.107) 8.472 16.617 ( -1.800 -0.000 8.763) 8.946 17.305 ( 3.766 0.000 8.426) 9.229 17.597 ( 4.471 0.000 0.903) 4.561 20.231 ( -7.386 -0.000 3.925) 8.364 20.334 ( 6.199 0.000 9.409) 11.268 20.746 ( 13.111 0.000 -11.405) 17.377 21.262 ( -23.689 -0.000 -7.669) 24.900 22.277 ( 13.047 0.000 7.225) 14.913 22.708 ( -11.906 -0.000 -4.338) 12.672 22.930 ( -4.394 -0.000 4.947) 6.617 23.186 ( 8.539 0.000 -5.260) 10.029 24.298 ( 0.404 0.000 3.055) 3.082 24.507 ( 0.616 0.000 1.392) 1.522 24.663 ( -0.768 -0.000 5.948) 5.998 25.195 ( 2.717 0.000 -13.405) 13.677 ======================= Grid point 345 (179/186) ======================= q-point: ( 0.38 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.483 ( 10.630 -4.856 -21.954) 24.871 3.909 ( -2.402 -3.654 3.893) 5.854 3.990 ( 16.566 -0.474 -8.464) 18.609 4.027 ( 2.493 -1.311 0.199) 2.823 4.313 ( -0.388 -0.283 12.086) 12.095 4.849 ( 3.655 10.449 -10.193) 15.048 5.002 ( -4.779 5.039 3.624) 7.833 5.340 ( -6.604 -2.536 6.694) 9.739 5.452 ( 4.464 -0.423 10.250) 11.188 5.667 ( -3.587 -5.283 10.262) 12.087 5.793 ( 6.004 -3.594 0.815) 7.045 6.052 ( 0.393 -2.278 -19.238) 19.376 6.302 ( -1.622 1.379 0.681) 2.236 6.603 ( -5.805 -5.844 -1.875) 8.448 6.705 ( 7.754 1.776 -2.273) 8.273 6.992 ( 0.101 0.109 -5.366) 5.368 7.397 ( -4.100 2.683 -4.601) 6.722 7.450 ( 10.927 3.957 -9.796) 15.199 7.772 ( -9.047 -0.525 -2.576) 9.422 7.872 ( -8.780 -1.943 2.768) 9.409 8.075 ( 15.063 -0.076 3.344) 15.430 8.461 ( -2.087 2.910 14.344) 14.784 8.732 ( 11.544 9.909 4.283) 15.804 9.322 ( -1.919 4.238 23.693) 24.146 9.447 ( -6.256 4.276 -0.864) 7.627 9.680 ( -3.741 3.185 -14.132) 14.962 9.834 ( 1.250 -4.038 -2.592) 4.958 9.926 ( 6.632 -14.443 2.709) 16.122 10.335 ( 1.132 -1.505 4.056) 4.472 10.441 ( -1.400 -1.372 3.155) 3.714 10.685 ( -2.853 0.184 -8.463) 8.933 11.018 ( 6.991 -2.409 13.448) 15.347 11.299 ( -5.879 6.622 -5.126) 10.232 11.542 ( 0.306 2.067 -5.273) 5.672 11.773 ( -6.102 9.287 -16.826) 20.164 12.172 ( -8.182 -13.879 -6.697) 17.448 12.384 ( 4.980 1.459 -5.128) 7.296 12.819 ( 4.528 11.273 13.122) 17.882 13.281 ( 5.505 -12.267 6.000) 14.724 13.536 ( -9.799 -1.484 3.525) 10.519 13.618 ( -7.824 2.367 -5.969) 10.122 13.975 ( -0.439 -3.757 -4.090) 5.571 14.595 ( 5.047 0.132 7.461) 9.009 15.448 ( -5.598 1.433 -0.262) 5.784 16.517 ( 0.373 0.796 -6.900) 6.956 16.641 ( -1.604 -2.968 5.883) 6.782 17.362 ( 3.562 1.848 8.711) 9.591 17.623 ( 1.543 1.799 -0.798) 2.501 20.172 ( -4.172 -0.865 4.804) 6.422 20.445 ( 7.910 1.301 9.165) 12.176 20.888 ( 11.058 -2.003 -12.999) 17.183 20.937 ( -20.254 0.815 -9.667) 22.457 22.329 ( -4.498 3.825 3.517) 6.872 22.555 ( -8.143 -1.345 -1.005) 8.314 22.979 ( 5.351 -1.369 9.493) 10.983 23.274 ( 6.785 -0.209 -6.055) 9.096 24.312 ( 1.749 0.631 2.373) 3.015 24.533 ( -2.190 -2.564 1.526) 3.701 24.680 ( 3.115 0.504 7.160) 7.825 25.171 ( -0.040 1.082 -13.579) 13.622 ======================= Grid point 346 (180/186) ======================= q-point: ( 0.50 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.640 ( 8.464 -4.986 -15.618) 18.451 3.910 ( -6.091 -2.373 6.764) 9.407 4.008 ( -0.878 1.078 8.556) 8.669 4.157 ( 1.148 -0.145 -14.700) 14.746 4.386 ( 12.506 1.841 4.861) 13.543 4.714 ( 2.821 8.723 -9.855) 13.459 4.795 ( -6.759 10.783 5.919) 14.036 5.308 ( -9.902 -3.375 7.607) 12.935 5.614 ( 8.151 -4.991 10.052) 13.870 5.736 ( 1.601 -3.598 2.633) 4.737 5.956 ( 9.163 -5.795 -5.583) 12.195 6.069 ( 3.362 -3.554 -12.268) 13.208 6.278 ( -3.048 -4.152 -5.937) 7.860 6.585 ( -4.691 -3.734 -0.675) 6.034 6.641 ( -3.355 6.592 -9.470) 12.016 7.015 ( -11.887 -3.417 7.327) 14.375 7.358 ( 9.041 3.623 12.080) 15.518 7.469 ( 7.740 7.959 -3.207) 11.556 7.700 ( -3.842 -4.937 -11.851) 13.401 7.804 ( -3.163 3.033 7.443) 8.638 8.310 ( 12.976 -0.298 8.715) 15.634 8.370 ( -0.311 6.888 7.104) 9.899 8.710 ( 4.056 10.231 1.490) 11.105 9.156 ( -15.576 5.849 1.220) 16.683 9.348 ( 3.358 4.311 0.761) 5.517 9.577 ( -3.243 -0.336 -6.395) 7.178 9.925 ( 3.322 -2.228 0.936) 4.108 10.219 ( 3.125 -9.243 0.451) 9.768 10.415 ( -0.828 0.584 8.475) 8.535 10.460 ( 2.206 -12.039 -3.271) 12.669 10.609 ( -0.412 4.260 -8.006) 9.079 11.109 ( -5.236 4.323 -5.391) 8.670 11.160 ( 3.790 -0.722 15.551) 16.023 11.510 ( 3.399 3.064 -2.818) 5.374 11.595 ( -3.644 2.015 -16.017) 16.549 12.121 ( -11.311 -0.455 -3.651) 11.894 12.525 ( 9.191 -5.799 2.775) 11.216 12.789 ( 6.117 5.022 8.391) 11.535 13.326 ( -12.823 -5.547 -3.757) 14.468 13.450 ( -8.437 2.948 -8.804) 12.545 13.649 ( 8.467 -7.137 11.671) 16.089 14.021 ( -0.905 -5.012 -5.474) 7.477 14.704 ( 8.777 -0.097 7.491) 11.540 15.325 ( -9.194 1.442 -1.568) 9.438 16.520 ( 3.128 -0.237 -6.243) 6.987 16.675 ( -2.532 -3.648 4.212) 6.121 17.387 ( 3.371 3.935 7.894) 9.442 17.586 ( -0.803 3.408 -2.801) 4.483 20.166 ( -0.994 -1.048 5.316) 5.508 20.490 ( -0.927 4.184 0.257) 4.294 20.732 ( -4.473 -0.817 -2.331) 5.110 21.021 ( 5.113 -5.235 -11.884) 13.956 22.177 ( -5.708 4.929 3.094) 8.152 22.495 ( -9.303 -4.339 -0.338) 10.271 23.103 ( 8.060 0.724 10.859) 13.543 23.332 ( 4.083 -0.059 -6.948) 8.059 24.342 ( 2.705 -0.027 1.335) 3.017 24.504 ( -3.459 1.254 2.396) 4.391 24.774 ( 4.914 -2.535 6.688) 8.677 25.104 ( -2.343 1.568 -11.524) 11.863 ======================= Grid point 347 (181/186) ======================= q-point: (-0.38 0.25 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.718 ( 2.307 2.298 -0.423) 3.283 3.827 ( -4.777 4.369 -2.981) 7.127 4.023 ( -0.982 -0.526 13.674) 13.720 4.083 ( -2.042 -0.392 -13.714) 13.870 4.460 ( 5.521 6.218 -5.972) 10.237 4.555 ( -6.167 9.610 11.544) 16.237 4.767 ( 14.630 1.193 -10.061) 17.796 5.172 ( -16.514 -0.019 4.587) 17.139 5.806 ( 6.192 -4.934 7.925) 11.202 5.838 ( 8.053 -2.209 -4.804) 9.633 6.085 ( 3.710 0.819 -8.325) 9.151 6.134 ( 0.311 -1.963 -3.197) 3.765 6.378 ( 6.999 -9.143 0.015) 11.515 6.535 ( 1.207 -0.014 -5.973) 6.094 6.580 ( -6.155 -4.578 1.733) 7.864 6.830 ( -19.842 -4.089 5.212) 20.919 7.409 ( 4.135 10.264 5.070) 12.172 7.455 ( 4.098 7.303 3.480) 9.069 7.763 ( 10.468 0.074 2.574) 10.780 7.787 ( 2.440 -1.796 4.599) 5.507 8.148 ( -6.325 9.794 -1.387) 11.741 8.438 ( -13.928 10.629 -5.575) 18.385 8.641 ( 13.879 -1.863 7.164) 15.730 8.945 ( -8.879 -0.391 -3.221) 9.453 9.387 ( 7.328 1.377 0.896) 7.510 9.536 ( -3.239 0.017 -1.576) 3.602 9.968 ( 6.084 3.586 2.834) 7.610 10.255 ( -9.489 -2.428 -6.830) 11.941 10.388 ( 1.390 1.594 3.530) 4.115 10.473 ( -3.731 1.992 -6.976) 8.158 10.766 ( 10.093 -9.058 0.865) 13.589 11.029 ( -7.317 -5.473 -1.528) 9.265 11.247 ( 4.652 1.280 18.004) 18.639 11.466 ( -4.769 -0.423 -14.885) 15.636 11.602 ( 10.495 0.671 0.521) 10.530 11.938 ( -11.645 2.207 -4.836) 12.801 12.720 ( 9.731 -0.938 16.711) 19.361 12.891 ( 5.235 -5.878 -4.907) 9.275 13.222 ( -8.961 -1.291 -4.501) 10.110 13.283 ( -8.432 0.615 -6.102) 10.426 13.866 ( 7.338 -4.551 8.597) 12.185 14.042 ( -2.980 -3.205 -6.503) 7.839 14.861 ( 10.961 -1.353 6.643) 12.888 15.179 ( -10.675 -0.499 -3.445) 11.228 16.573 ( 5.247 -1.490 -5.011) 7.407 16.689 ( -4.432 -3.434 3.206) 6.459 17.382 ( 3.566 5.481 6.237) 9.036 17.497 ( -2.809 4.749 -4.147) 6.902 20.195 ( 1.925 -0.318 4.763) 5.147 20.355 ( -7.491 2.194 -5.251) 9.407 20.795 ( 9.244 0.052 3.116) 9.755 21.069 ( -6.047 -4.728 -8.310) 11.313 22.136 ( 5.605 0.810 4.153) 7.023 22.416 ( -11.903 -4.447 -1.363) 12.779 23.210 ( 6.572 1.304 10.008) 12.044 23.341 ( 0.327 0.514 -7.938) 7.961 24.379 ( 2.722 0.426 -0.737) 2.852 24.443 ( -2.891 1.945 2.886) 4.524 24.880 ( 4.762 -1.354 3.948) 6.333 25.023 ( -3.863 0.603 -6.163) 7.298 ======================= Grid point 348 (182/186) ======================= q-point: (-0.25 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.669 ( -1.137 8.218 -11.589) 14.253 3.669 ( 1.137 8.218 11.589) 14.253 4.064 ( 2.140 -1.359 -12.561) 12.814 4.064 ( -2.140 -1.359 12.561) 12.814 4.395 ( 2.060 7.387 -9.441) 12.163 4.395 ( -2.060 7.387 9.441) 12.163 4.952 ( -1.580 0.415 -7.957) 8.123 4.952 ( 1.580 0.415 7.957) 8.123 5.928 ( -1.760 -1.374 -8.779) 9.059 5.928 ( 1.760 -1.374 8.779) 9.059 6.050 ( -4.520 6.005 -4.444) 8.732 6.050 ( 4.520 6.005 4.444) 8.732 6.560 ( 2.846 -4.030 -4.068) 6.394 6.560 ( -2.846 -4.030 4.068) 6.394 6.732 ( -4.631 -11.187 -7.572) 14.280 6.732 ( 4.631 -11.187 7.572) 14.280 7.321 ( -3.411 8.958 -3.921) 10.357 7.321 ( 3.411 8.958 3.921) 10.357 7.871 ( -6.592 1.076 -7.985) 10.410 7.871 ( 6.592 1.076 7.985) 10.410 8.034 ( -15.558 8.551 -10.855) 20.809 8.034 ( 15.558 8.551 10.855) 20.809 8.866 ( -5.771 -4.842 -10.797) 13.165 8.866 ( 5.771 -4.842 10.797) 13.165 9.466 ( -1.779 0.506 -7.057) 7.296 9.466 ( 1.779 0.506 7.057) 7.296 10.063 ( -12.702 2.522 -6.869) 14.659 10.063 ( 12.702 2.522 6.869) 14.659 10.408 ( -0.570 0.768 -5.696) 5.776 10.408 ( 0.570 0.768 5.696) 5.776 10.985 ( 0.973 -3.420 -5.635) 6.663 10.985 ( -0.973 -3.420 5.635) 6.663 11.363 ( -6.309 -0.554 -15.696) 16.926 11.363 ( 6.309 -0.554 15.696) 16.926 11.776 ( -7.896 -3.407 -9.303) 12.669 11.776 ( 7.896 -3.407 9.303) 12.669 12.905 ( -8.788 -1.262 -18.649) 20.654 12.905 ( 8.788 -1.262 18.649) 20.654 13.193 ( -4.375 -0.844 -4.964) 6.670 13.193 ( 4.375 -0.844 4.964) 6.670 14.002 ( -4.704 -0.982 -6.674) 8.224 14.002 ( 4.704 -0.982 6.674) 8.224 15.052 ( -10.931 -3.003 -5.549) 12.621 15.052 ( 10.931 -3.003 5.549) 12.621 16.669 ( 2.041 -2.723 -7.163) 7.930 16.669 ( -2.041 -2.723 7.163) 7.930 17.364 ( -3.005 5.831 -5.922) 8.837 17.364 ( 3.005 5.831 5.922) 8.837 20.246 ( -1.355 0.536 -7.093) 7.241 20.246 ( 1.355 0.536 7.093) 7.241 20.958 ( -7.429 -1.100 -9.498) 12.108 20.958 ( 7.429 -1.100 9.498) 12.108 22.305 ( -12.842 -4.106 -3.117) 13.838 22.305 ( 12.842 -4.106 3.117) 13.838 23.285 ( -3.866 1.102 -8.500) 9.403 23.285 ( 3.866 1.102 8.500) 9.403 24.392 ( 2.381 1.476 -2.839) 3.988 24.392 ( -2.381 1.476 2.839) 3.988 24.956 ( 1.242 -0.021 -7.711) 7.810 24.956 ( -1.242 -0.021 7.711) 7.810 ======================= Grid point 354 (183/186) ======================= q-point: ( 0.38 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.545 ( 11.915 0.000 -22.013) 25.031 3.845 ( -5.453 -0.000 9.649) 11.083 4.024 ( 0.024 0.000 4.288) 4.288 4.152 ( 6.072 0.000 -11.535) 13.036 4.424 ( 15.109 0.000 8.900) 17.535 4.938 ( -3.660 -0.000 -3.400) 4.996 4.947 ( -3.112 -0.000 -7.672) 8.279 5.231 ( -8.145 -0.000 6.576) 10.468 5.555 ( 5.480 0.000 8.037) 9.727 5.599 ( -2.648 -0.000 11.471) 11.772 5.890 ( 12.844 0.000 -0.002) 12.844 6.007 ( 1.761 0.000 -14.412) 14.520 6.231 ( -6.680 -0.000 -10.513) 12.456 6.491 ( -6.802 -0.000 6.170) 9.183 6.786 ( -2.888 -0.000 -0.120) 2.891 6.934 ( -4.417 -0.000 -12.515) 13.272 7.380 ( 5.274 0.000 4.723) 7.080 7.626 ( -2.555 -0.000 -11.888) 12.159 7.670 ( 5.879 0.000 -2.452) 6.370 7.758 ( -1.880 -0.000 12.378) 12.520 8.338 ( 20.439 0.000 5.621) 21.198 8.481 ( -3.313 -0.000 14.227) 14.607 8.920 ( 2.414 0.000 -0.269) 2.429 9.305 ( -12.101 -0.000 8.768) 14.944 9.494 ( 0.202 0.000 21.714) 21.714 9.575 ( -5.237 -0.000 -27.474) 27.969 9.798 ( 2.550 0.000 -2.333) 3.457 9.897 ( 6.684 0.000 -1.645) 6.883 10.335 ( 0.315 0.000 2.014) 2.038 10.432 ( -2.026 -0.000 5.429) 5.795 10.692 ( 4.411 0.000 -4.485) 6.291 11.132 ( 7.494 0.000 15.116) 16.872 11.229 ( -9.347 -0.000 -7.054) 11.710 11.532 ( -0.775 -0.000 -5.896) 5.947 11.834 ( -5.328 -0.000 -16.561) 17.397 11.855 ( -6.056 -0.000 -3.750) 7.123 12.459 ( 7.215 0.000 -2.920) 7.784 13.030 ( 5.449 0.000 11.649) 12.860 13.140 ( -11.491 -0.000 -1.510) 11.590 13.463 ( -2.664 -0.000 3.810) 4.649 13.553 ( -0.037 -0.000 0.836) 0.837 13.922 ( -1.433 -0.000 -5.984) 6.153 14.706 ( 8.680 0.000 7.556) 11.508 15.353 ( -10.032 -0.000 -1.299) 10.116 16.520 ( 2.548 0.000 -8.861) 9.220 16.615 ( -1.997 -0.000 7.392) 7.657 17.444 ( 3.545 0.000 9.101) 9.766 17.639 ( -0.447 -0.000 -2.755) 2.791 20.149 ( -0.511 -0.000 6.340) 6.361 20.601 ( 9.478 0.000 12.206) 15.453 20.661 ( -17.223 -0.000 -11.612) 20.772 20.956 ( 6.631 0.000 -16.193) 17.498 22.290 ( -7.419 -0.000 3.138) 8.055 22.393 ( -10.171 -0.000 -1.587) 10.294 23.117 ( 9.346 0.000 13.019) 16.026 23.332 ( 4.620 0.000 -7.353) 8.684 24.351 ( 2.499 0.000 2.063) 3.241 24.495 ( -1.751 -0.000 0.511) 1.824 24.748 ( 4.059 0.000 9.979) 10.773 25.127 ( -2.397 -0.000 -14.881) 15.072 ======================= Grid point 355 (184/186) ======================= q-point: ( 0.50 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.664 ( 10.016 -2.880 -18.048) 20.841 3.810 ( -7.007 -2.342 11.989) 14.082 4.038 ( 1.393 0.833 3.640) 3.986 4.129 ( -3.238 1.161 -4.499) 5.663 4.641 ( 15.802 4.982 -0.615) 16.580 4.835 ( -5.884 8.044 5.873) 11.568 4.853 ( 4.809 4.056 -10.587) 12.315 5.140 ( -12.287 -1.787 6.608) 14.065 5.634 ( 3.205 -4.580 7.277) 9.176 5.690 ( 1.769 -7.210 0.475) 7.439 6.019 ( 4.844 -1.230 -7.400) 8.929 6.080 ( 5.858 -1.689 0.214) 6.100 6.174 ( 3.600 -3.773 -7.019) 8.745 6.431 ( -8.717 -4.115 3.260) 10.175 6.645 ( -4.545 4.839 -6.976) 9.631 6.815 ( -14.287 -0.324 -1.935) 14.421 7.504 ( 3.927 -1.940 9.090) 10.091 7.539 ( -2.243 -2.237 -4.528) 5.526 7.751 ( 12.622 5.534 0.690) 13.799 7.845 ( 4.157 0.492 2.997) 5.148 8.440 ( 0.409 6.981 12.520) 14.341 8.602 ( 17.920 2.514 6.090) 19.093 8.784 ( -11.533 6.876 -7.141) 15.208 9.068 ( -13.511 7.309 -2.569) 15.574 9.464 ( 4.113 4.798 -1.252) 6.443 9.537 ( -1.297 0.578 1.612) 2.148 9.903 ( 4.119 -7.281 0.999) 8.424 10.042 ( -2.575 -12.679 -4.406) 13.667 10.367 ( 1.221 -2.766 -0.368) 3.046 10.412 ( -2.389 -0.431 3.827) 4.532 10.740 ( 9.025 4.535 1.448) 10.203 11.042 ( -10.404 4.057 -7.930) 13.696 11.271 ( 6.505 0.372 16.671) 17.899 11.486 ( -3.580 1.382 -11.749) 12.359 11.666 ( 4.551 4.048 -4.822) 7.769 11.888 ( -10.576 -7.659 -3.545) 13.531 12.593 ( 11.674 -3.093 -1.328) 12.149 12.919 ( -8.939 3.261 1.892) 9.702 13.139 ( 0.542 -1.243 7.698) 7.817 13.356 ( -8.125 2.349 -9.031) 12.373 13.699 ( 8.797 -5.474 10.511) 14.759 13.908 ( -3.440 -4.509 -7.302) 9.245 14.851 ( 11.023 0.163 6.367) 12.731 15.193 ( -12.329 0.724 -2.931) 12.694 16.545 ( 4.042 -0.455 -7.682) 8.692 16.613 ( -3.250 -1.656 6.552) 7.499 17.495 ( 3.298 2.219 8.119) 9.039 17.599 ( -1.923 2.110 -4.867) 5.643 20.187 ( 3.218 -0.188 7.630) 8.283 20.423 ( -11.308 1.993 -9.917) 15.172 20.766 ( 8.106 -1.474 12.125) 14.659 20.974 ( -0.107 -1.672 -15.789) 15.878 22.192 ( -1.788 2.665 2.730) 4.214 22.307 ( -8.575 -3.323 -1.145) 9.267 23.244 ( 6.074 0.854 11.977) 13.457 23.352 ( 1.511 0.264 -8.751) 8.884 24.388 ( 3.067 0.374 1.241) 3.329 24.470 ( -2.908 -0.141 0.282) 2.925 24.843 ( 5.476 -0.691 11.400) 12.666 25.043 ( -4.278 0.439 -13.967) 14.614 ======================= Grid point 356 (185/186) ======================= q-point: (-0.38 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.775 ( 5.273 -1.494 -12.999) 14.107 3.775 ( -5.273 -1.494 12.999) 14.107 4.054 ( -0.426 1.631 -10.345) 10.481 4.054 ( 0.426 1.631 10.345) 10.481 4.635 ( 6.731 9.781 -10.035) 15.546 4.635 ( -6.731 9.781 10.035) 15.546 4.972 ( 5.183 0.666 -6.926) 8.676 4.972 ( -5.183 0.666 6.926) 8.676 5.788 ( -1.886 -7.310 -6.678) 10.079 5.788 ( 1.886 -7.310 6.678) 10.079 6.097 ( 4.207 -2.707 -11.358) 12.411 6.097 ( -4.207 -2.707 11.358) 12.411 6.386 ( -10.763 -7.168 -0.505) 12.941 6.386 ( 10.763 -7.168 0.505) 12.941 6.610 ( 10.544 2.707 -6.333) 12.594 6.610 ( -10.544 2.707 6.333) 12.594 7.548 ( 0.322 1.609 -6.807) 7.002 7.548 ( -0.322 1.609 6.807) 7.002 7.825 ( 1.671 1.484 -9.632) 9.888 7.825 ( -1.671 1.484 9.632) 9.888 8.391 ( -12.710 13.601 -9.859) 21.066 8.391 ( 12.710 13.601 9.859) 21.066 8.824 ( -8.466 2.145 -9.040) 12.570 8.824 ( 8.466 2.145 9.040) 12.570 9.487 ( 1.684 1.039 -10.974) 11.151 9.487 ( -1.684 1.039 10.974) 11.151 10.077 ( -7.508 -4.345 -7.395) 11.399 10.077 ( 7.508 -4.345 7.395) 11.399 10.416 ( -0.515 -1.875 -3.022) 3.593 10.416 ( 0.515 -1.875 3.022) 3.593 10.848 ( -9.942 -0.363 -6.291) 11.771 10.848 ( 9.942 -0.363 6.291) 11.771 11.368 ( -4.609 1.238 -16.817) 17.481 11.368 ( 4.609 1.238 16.817) 17.481 11.776 ( -6.978 -0.262 -7.346) 10.135 11.776 ( 6.978 -0.262 7.346) 10.135 12.808 ( -4.588 -4.416 -8.940) 10.976 12.808 ( 4.588 -4.416 8.940) 10.976 13.194 ( -5.660 1.906 -9.432) 11.163 13.194 ( 5.660 1.906 9.432) 11.163 13.903 ( -5.931 -5.681 -8.379) 11.733 13.903 ( 5.931 -5.681 8.379) 11.733 15.016 ( -11.787 0.048 -5.171) 12.871 15.016 ( 11.787 0.048 5.171) 12.871 16.602 ( 3.746 -1.899 -7.733) 8.800 16.602 ( -3.746 -1.899 7.733) 8.800 17.509 ( -2.794 4.050 -6.639) 8.263 17.509 ( 2.794 4.050 6.639) 8.263 20.266 ( -5.728 0.819 -8.645) 10.403 20.266 ( 5.728 0.819 8.645) 10.403 20.915 ( -4.999 -1.688 -14.150) 15.102 20.915 ( 4.999 -1.688 14.150) 15.102 22.230 ( -7.440 -1.426 -2.842) 8.091 22.230 ( 7.440 -1.426 2.842) 8.091 23.314 ( -2.633 0.938 -10.000) 10.383 23.314 ( 2.633 0.938 10.000) 10.383 24.425 ( -1.826 0.643 -0.592) 2.025 24.425 ( 1.826 0.643 0.592) 2.025 24.949 ( -3.918 -0.324 -12.065) 12.689 24.949 ( 3.918 -0.324 12.065) 12.689 ======================= Grid point 365 (186/186) ======================= q-point: (-0.50 -0.50 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 Number of triplets: 93 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.725 ( 8.908 0.000 -16.711) 18.937 3.725 ( -8.908 -0.000 16.711) 18.937 4.084 ( -3.377 -0.000 -2.209) 4.036 4.084 ( 3.377 0.000 2.209) 4.036 4.835 ( -4.292 -0.000 -0.874) 4.380 4.835 ( 4.292 0.000 0.874) 4.380 4.972 ( -12.605 -0.000 3.246) 13.017 4.972 ( 12.605 0.000 -3.246) 13.017 5.633 ( -0.178 -0.000 -5.482) 5.485 5.633 ( 0.178 0.000 5.482) 5.485 6.043 ( -3.060 -0.000 -2.042) 3.679 6.043 ( 3.060 0.000 2.042) 3.679 6.288 ( -10.825 -0.000 1.430) 10.919 6.288 ( 10.825 0.000 -1.430) 10.919 6.667 ( -6.281 -0.000 0.497) 6.301 6.667 ( 6.281 0.000 -0.497) 6.301 7.504 ( 1.599 0.000 -7.116) 7.294 7.504 ( -1.599 -0.000 7.116) 7.294 7.896 ( 3.001 0.000 -16.080) 16.357 7.896 ( -3.001 -0.000 16.080) 16.357 8.613 ( -12.331 -0.000 -15.737) 19.993 8.613 ( 12.331 0.000 15.737) 19.993 8.898 ( -18.730 -0.000 -4.382) 19.236 8.898 ( 18.730 0.000 4.382) 19.236 9.546 ( 6.000 0.000 -22.700) 23.480 9.546 ( -6.000 -0.000 22.700) 23.480 9.887 ( -4.099 -0.000 -0.606) 4.144 9.887 ( 4.099 0.000 0.606) 4.144 10.378 ( -2.595 -0.000 0.781) 2.710 10.378 ( 2.595 0.000 -0.781) 2.710 10.916 ( -10.703 -0.000 -6.002) 12.271 10.916 ( 10.703 0.000 6.002) 12.271 11.407 ( -6.450 -0.000 -14.135) 15.537 11.407 ( 6.450 0.000 14.135) 15.537 11.728 ( 3.044 0.000 -5.900) 6.639 11.728 ( -3.044 -0.000 5.900) 6.639 12.740 ( -14.524 -0.000 0.612) 14.537 12.740 ( 14.524 0.000 -0.612) 14.537 13.253 ( -7.458 -0.000 -9.556) 12.122 13.253 ( 7.458 0.000 9.556) 12.122 13.785 ( -6.792 -0.000 -9.024) 11.295 13.785 ( 6.792 0.000 9.024) 11.295 15.022 ( -12.712 -0.000 -4.627) 13.528 15.022 ( 12.712 0.000 4.627) 13.528 16.574 ( 3.903 0.000 -7.931) 8.839 16.574 ( -3.903 -0.000 7.931) 8.839 17.569 ( -2.752 -0.000 -6.881) 7.411 17.569 ( 2.752 0.000 6.881) 7.411 20.280 ( -7.860 -0.000 -9.623) 12.425 20.280 ( 7.860 0.000 9.623) 12.425 20.887 ( -5.420 -0.000 -16.055) 16.945 20.887 ( 5.420 0.000 16.055) 16.945 22.212 ( -2.052 -0.000 -1.880) 2.783 22.212 ( 2.052 0.000 1.880) 2.783 23.329 ( -1.859 -0.000 -10.669) 10.830 23.329 ( 1.859 0.000 10.669) 10.830 24.431 ( -2.847 -0.000 -0.747) 2.944 24.431 ( 2.847 0.000 0.747) 2.944 24.944 ( -5.575 -0.000 -13.931) 15.005 24.944 ( 5.575 0.000 13.931) 15.005 =================== 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 3/38400 10.0 1023.419 1858.932 817.979 0.000 243.460 -0.000 3/38400 20.0 1002.574 1157.832 971.526 0.000 245.167 -0.000 3/38400 30.0 521.515 551.730 590.670 0.000 134.471 -0.000 3/38400 40.0 296.096 305.906 363.306 0.000 78.022 -0.000 3/38400 50.0 182.785 185.598 237.370 0.000 48.150 -0.000 3/38400 60.0 122.011 121.687 165.605 0.000 31.535 -0.000 3/38400 70.0 87.173 85.406 122.225 0.000 21.846 -0.000 3/38400 80.0 65.836 63.446 94.435 0.000 15.917 -0.000 3/38400 90.0 51.963 49.349 75.714 0.000 12.116 -0.000 3/38400 100.0 42.465 39.824 62.551 0.000 9.569 -0.000 3/38400 110.0 35.673 33.098 52.953 0.000 7.795 -0.000 3/38400 120.0 30.637 28.168 45.734 0.000 6.514 -0.000 3/38400 130.0 26.786 24.438 40.155 0.000 5.561 -0.000 3/38400 140.0 23.765 21.538 35.743 0.000 4.832 -0.000 3/38400 150.0 21.342 19.232 32.180 0.000 4.262 -0.000 3/38400 160.0 19.362 17.361 29.254 0.000 3.805 -0.000 3/38400 170.0 17.717 15.816 26.812 0.000 3.434 -0.000 3/38400 180.0 16.331 14.522 24.747 0.000 3.126 -0.000 3/38400 190.0 15.149 13.424 22.979 0.000 2.868 -0.000 3/38400 200.0 14.130 12.482 21.451 0.000 2.649 -0.000 3/38400 210.0 13.243 11.664 20.117 0.000 2.461 -0.000 3/38400 220.0 12.463 10.949 18.942 0.000 2.298 -0.000 3/38400 230.0 11.774 10.319 17.901 0.000 2.156 -0.000 3/38400 240.0 11.160 9.759 16.971 0.000 2.030 -0.000 3/38400 250.0 10.609 9.258 16.136 0.000 1.919 -0.000 3/38400 260.0 10.112 8.807 15.382 0.000 1.819 -0.000 3/38400 270.0 9.662 8.400 14.698 0.000 1.730 -0.000 3/38400 280.0 9.252 8.030 14.074 0.000 1.649 -0.000 3/38400 290.0 8.877 7.693 13.503 0.000 1.576 -0.000 3/38400 300.0 8.533 7.383 12.978 0.000 1.509 -0.000 3/38400 310.0 8.216 7.099 12.494 0.000 1.447 -0.000 3/38400 320.0 7.922 6.836 12.046 0.000 1.391 -0.000 3/38400 330.0 7.650 6.593 11.631 0.000 1.339 -0.000 3/38400 340.0 7.397 6.368 11.244 0.000 1.291 -0.000 3/38400 350.0 7.160 6.157 10.883 0.000 1.247 -0.000 3/38400 360.0 6.939 5.961 10.545 0.000 1.205 -0.000 3/38400 370.0 6.732 5.778 10.229 0.000 1.167 -0.000 3/38400 380.0 6.538 5.605 9.931 0.000 1.130 -0.000 3/38400 390.0 6.354 5.443 9.651 0.000 1.096 -0.000 3/38400 400.0 6.182 5.291 9.387 0.000 1.065 -0.000 3/38400 410.0 6.018 5.147 9.138 0.000 1.035 -0.000 3/38400 420.0 5.864 5.011 8.902 0.000 1.006 -0.000 3/38400 430.0 5.717 4.882 8.678 0.000 0.980 -0.000 3/38400 440.0 5.578 4.760 8.465 0.000 0.954 -0.000 3/38400 450.0 5.446 4.645 8.263 0.000 0.931 -0.000 3/38400 460.0 5.320 4.534 8.071 0.000 0.908 -0.000 3/38400 470.0 5.200 4.429 7.888 0.000 0.886 -0.000 3/38400 480.0 5.086 4.329 7.713 0.000 0.866 -0.000 3/38400 490.0 4.976 4.234 7.546 0.000 0.846 -0.000 3/38400 500.0 4.871 4.143 7.386 0.000 0.827 -0.000 3/38400 510.0 4.771 4.056 7.233 0.000 0.809 -0.000 3/38400 520.0 4.675 3.972 7.087 0.000 0.792 -0.000 3/38400 530.0 4.583 3.892 6.946 0.000 0.776 -0.000 3/38400 540.0 4.494 3.815 6.811 0.000 0.760 -0.000 3/38400 550.0 4.409 3.741 6.681 0.000 0.745 -0.000 3/38400 560.0 4.327 3.671 6.557 0.000 0.731 -0.000 3/38400 570.0 4.249 3.602 6.437 0.000 0.717 -0.000 3/38400 580.0 4.173 3.537 6.321 0.000 0.704 -0.000 3/38400 590.0 4.100 3.474 6.209 0.000 0.691 -0.000 3/38400 600.0 4.029 3.413 6.102 0.000 0.679 -0.000 3/38400 610.0 3.961 3.354 5.998 0.000 0.667 -0.000 3/38400 620.0 3.895 3.297 5.898 0.000 0.655 -0.000 3/38400 630.0 3.831 3.242 5.801 0.000 0.644 -0.000 3/38400 640.0 3.770 3.189 5.707 0.000 0.633 -0.000 3/38400 650.0 3.710 3.138 5.617 0.000 0.623 -0.000 3/38400 660.0 3.653 3.088 5.529 0.000 0.613 -0.000 3/38400 670.0 3.597 3.040 5.444 0.000 0.603 -0.000 3/38400 680.0 3.543 2.994 5.362 0.000 0.594 -0.000 3/38400 690.0 3.490 2.949 5.282 0.000 0.585 -0.000 3/38400 700.0 3.439 2.905 5.204 0.000 0.576 -0.000 3/38400 710.0 3.390 2.863 5.129 0.000 0.568 -0.000 3/38400 720.0 3.341 2.822 5.056 0.000 0.559 -0.000 3/38400 730.0 3.295 2.782 4.985 0.000 0.551 -0.000 3/38400 740.0 3.249 2.743 4.916 0.000 0.543 -0.000 3/38400 750.0 3.205 2.705 4.849 0.000 0.536 -0.000 3/38400 760.0 3.162 2.668 4.784 0.000 0.529 -0.000 3/38400 770.0 3.121 2.633 4.720 0.000 0.521 -0.000 3/38400 780.0 3.080 2.598 4.659 0.000 0.514 -0.000 3/38400 790.0 3.040 2.564 4.598 0.000 0.508 -0.000 3/38400 800.0 3.002 2.531 4.540 0.000 0.501 -0.000 3/38400 810.0 2.964 2.499 4.483 0.000 0.495 -0.000 3/38400 820.0 2.927 2.468 4.427 0.000 0.488 -0.000 3/38400 830.0 2.892 2.437 4.373 0.000 0.482 -0.000 3/38400 840.0 2.857 2.407 4.320 0.000 0.476 -0.000 3/38400 850.0 2.823 2.378 4.268 0.000 0.470 -0.000 3/38400 860.0 2.789 2.350 4.218 0.000 0.465 -0.000 3/38400 870.0 2.757 2.322 4.169 0.000 0.459 -0.000 3/38400 880.0 2.725 2.295 4.120 0.000 0.454 -0.000 3/38400 890.0 2.694 2.269 4.074 0.000 0.449 -0.000 3/38400 900.0 2.664 2.243 4.028 0.000 0.443 -0.000 3/38400 910.0 2.634 2.218 3.983 0.000 0.438 -0.000 3/38400 920.0 2.606 2.194 3.939 0.000 0.434 -0.000 3/38400 930.0 2.577 2.169 3.896 0.000 0.429 -0.000 3/38400 940.0 2.550 2.146 3.854 0.000 0.424 -0.000 3/38400 950.0 2.522 2.123 3.813 0.000 0.419 -0.000 3/38400 960.0 2.496 2.100 3.773 0.000 0.415 -0.000 3/38400 970.0 2.470 2.078 3.733 0.000 0.411 -0.000 3/38400 980.0 2.445 2.057 3.695 0.000 0.406 -0.000 3/38400 990.0 2.420 2.036 3.657 0.000 0.402 -0.000 3/38400 1000.0 2.395 2.015 3.620 0.000 0.398 -0.000 3/38400 Thermal conductivity related properties were written into "kappa-m8810.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 20:32:53]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|