----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 09:24:49]------------------------- 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 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R3m (160) Number of symmetry operations in supercell: 18 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.852535206612510 1.646911969410614 4.700210186666661 b -2.852535206612504 1.646911969410614 4.700210186666661 c 0.000000000000003 -3.293823938821233 4.700210186666661 Atomic positions (fractional): *1 Al 0.50980035882221 0.99664888000010 0.99664888000010 26.982 2 Al 0.99664888000010 0.99664888000010 0.50980035882221 26.982 3 Al 0.99664888000010 0.50980035882221 0.99664888000010 26.982 *4 Al 0.38011739934220 0.38011739934220 0.38011739934220 26.982 *5 Mg 0.62184101843949 0.62184101843949 0.62184101843949 24.305 *6 Mg 0.99856966662448 0.99856966662449 0.99856966662448 24.305 *7 O 0.75260298909370 0.75260298909371 0.21222141310797 15.999 8 O 0.21222141310797 0.75260298909371 0.75260298909370 15.999 9 O 0.75260298909370 0.21222141310798 0.75260298909370 15.999 *10 O 0.76002564682862 0.76002564682863 0.76002564682862 15.999 *11 O 0.24577408312520 0.24577408312521 0.24577408312520 15.999 *12 O 0.25105823553652 0.77103030111581 0.25105823553652 15.999 13 O 0.77103030111580 0.25105823553652 0.25105823553652 15.999 14 O 0.25105823553652 0.25105823553652 0.77103030111580 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.705070413225014 0.000000000000000 0.000000000000000 b -2.852535206612507 4.940735908231847 0.000000000000000 c 0.000000000000000 0.000000000000000 14.100630559999999 Atomic positions (fractional): *1 Al 0.67543431921474 0.83771715960737 0.83436603960747 26.982 > 1 2 Al 0.16228284039263 0.32456568078526 0.83436603960747 26.982 > 2 3 Al 0.16228284039263 0.83771715960737 0.83436603960747 26.982 > 3 *4 Al 0.66666666666667 0.33333333333333 0.71345073267554 26.982 > 4 5 Al 0.34210098588140 0.17105049294070 0.16769937294080 26.982 > 1 6 Al 0.82894950705930 0.65789901411860 0.16769937294080 26.982 > 2 7 Al 0.82894950705930 0.17105049294070 0.16769937294080 26.982 > 3 8 Al 0.33333333333333 0.66666666666667 0.04678406600887 26.982 > 4 9 Al 0.00876765254807 0.50438382627403 0.50103270627414 26.982 > 1 10 Al 0.49561617372597 0.99123234745193 0.50103270627414 26.982 > 2 11 Al 0.49561617372597 0.50438382627403 0.50103270627414 26.982 > 3 12 Al 0.00000000000000 0.00000000000000 0.38011739934220 26.982 > 4 *13 Mg 0.66666666666667 0.33333333333333 0.95517435177282 24.305 > 5 *14 Mg 0.00000000000000 0.00000000000000 0.99856966662448 24.305 > 6 15 Mg 0.33333333333333 0.66666666666667 0.28850768510615 24.305 > 5 16 Mg 0.66666666666667 0.33333333333333 0.33190299995782 24.305 > 6 17 Mg 0.00000000000000 0.00000000000000 0.62184101843949 24.305 > 5 18 Mg 0.33333333333333 0.66666666666667 0.66523633329115 24.305 > 6 *19 O 0.84679385866191 0.69358771732382 0.90580913043179 15.999 > 7 20 O 0.30641228267618 0.15320614133809 0.90580913043179 15.999 > 8 21 O 0.84679385866191 0.15320614133809 0.90580913043179 15.999 > 9 *22 O 0.00000000000000 0.00000000000000 0.76002564682862 15.999 > 10 *23 O 0.33333333333333 0.66666666666667 0.91244074979187 15.999 > 11 *24 O 0.49334264480691 0.50665735519309 0.75771559072962 15.999 > 12 25 O 0.01331471038619 0.50665735519309 0.75771559072962 15.999 > 13 26 O 0.49334264480691 0.98668528961381 0.75771559072962 15.999 > 14 27 O 0.51346052532858 0.02692105065715 0.23914246376513 15.999 > 7 28 O 0.97307894934285 0.48653947467142 0.23914246376513 15.999 > 8 29 O 0.51346052532858 0.48653947467142 0.23914246376513 15.999 > 9 30 O 0.66666666666667 0.33333333333333 0.09335898016196 15.999 > 10 31 O 0.00000000000000 0.00000000000000 0.24577408312520 15.999 > 11 32 O 0.16000931147357 0.83999068852643 0.09104892406295 15.999 > 12 33 O 0.67998137705286 0.83999068852643 0.09104892406295 15.999 > 13 34 O 0.16000931147357 0.32001862294714 0.09104892406295 15.999 > 14 35 O 0.18012719199524 0.36025438399048 0.57247579709846 15.999 > 7 36 O 0.63974561600951 0.81987280800476 0.57247579709846 15.999 > 8 37 O 0.18012719199524 0.81987280800476 0.57247579709846 15.999 > 9 38 O 0.33333333333333 0.66666666666667 0.42669231349529 15.999 > 10 39 O 0.66666666666667 0.33333333333333 0.57910741645854 15.999 > 11 40 O 0.82667597814024 0.17332402185976 0.42438225739628 15.999 > 12 41 O 0.34664804371952 0.17332402185976 0.42438225739628 15.999 > 13 42 O 0.82667597814024 0.65335195628048 0.42438225739628 15.999 > 14 -------------------------------- super cell -------------------------------- Lattice vectors: a 5.705070413225014 0.000000000000000 0.000000000000000 b -2.852535206612507 4.940735908231847 0.000000000000000 c 0.000000000000000 0.000000000000000 14.100630559999999 Atomic positions (fractional): *1 Al 0.67543431921474 0.83771715960737 0.83436603960747 26.982 > 1 2 Al 0.16228284039263 0.32456568078526 0.83436603960747 26.982 > 2 3 Al 0.16228284039263 0.83771715960737 0.83436603960747 26.982 > 3 *4 Al 0.66666666666667 0.33333333333333 0.71345073267554 26.982 > 4 5 Al 0.34210098588140 0.17105049294070 0.16769937294080 26.982 > 1 6 Al 0.82894950705930 0.65789901411860 0.16769937294080 26.982 > 2 7 Al 0.82894950705930 0.17105049294070 0.16769937294080 26.982 > 3 8 Al 0.33333333333333 0.66666666666667 0.04678406600887 26.982 > 4 9 Al 0.00876765254807 0.50438382627403 0.50103270627414 26.982 > 1 10 Al 0.49561617372597 0.99123234745193 0.50103270627414 26.982 > 2 11 Al 0.49561617372597 0.50438382627403 0.50103270627414 26.982 > 3 12 Al 0.00000000000000 0.00000000000000 0.38011739934220 26.982 > 4 *13 Mg 0.66666666666667 0.33333333333333 0.95517435177282 24.305 > 5 *14 Mg 0.00000000000000 0.00000000000000 0.99856966662448 24.305 > 6 15 Mg 0.33333333333333 0.66666666666667 0.28850768510615 24.305 > 5 16 Mg 0.66666666666667 0.33333333333333 0.33190299995782 24.305 > 6 17 Mg 0.00000000000000 0.00000000000000 0.62184101843949 24.305 > 5 18 Mg 0.33333333333333 0.66666666666667 0.66523633329115 24.305 > 6 *19 O 0.84679385866191 0.69358771732382 0.90580913043179 15.999 > 7 20 O 0.30641228267618 0.15320614133809 0.90580913043179 15.999 > 8 21 O 0.84679385866191 0.15320614133809 0.90580913043179 15.999 > 9 *22 O 0.00000000000000 0.00000000000000 0.76002564682862 15.999 > 10 *23 O 0.33333333333333 0.66666666666667 0.91244074979187 15.999 > 11 *24 O 0.49334264480691 0.50665735519309 0.75771559072962 15.999 > 12 25 O 0.01331471038619 0.50665735519309 0.75771559072962 15.999 > 13 26 O 0.49334264480691 0.98668528961381 0.75771559072962 15.999 > 14 27 O 0.51346052532858 0.02692105065715 0.23914246376513 15.999 > 7 28 O 0.97307894934285 0.48653947467142 0.23914246376513 15.999 > 8 29 O 0.51346052532858 0.48653947467142 0.23914246376513 15.999 > 9 30 O 0.66666666666667 0.33333333333333 0.09335898016196 15.999 > 10 31 O 0.00000000000000 0.00000000000000 0.24577408312520 15.999 > 11 32 O 0.16000931147357 0.83999068852643 0.09104892406295 15.999 > 12 33 O 0.67998137705286 0.83999068852643 0.09104892406295 15.999 > 13 34 O 0.16000931147357 0.32001862294714 0.09104892406295 15.999 > 14 35 O 0.18012719199524 0.36025438399048 0.57247579709846 15.999 > 7 36 O 0.63974561600951 0.81987280800476 0.57247579709846 15.999 > 8 37 O 0.18012719199524 0.81987280800476 0.57247579709846 15.999 > 9 38 O 0.33333333333333 0.66666666666667 0.42669231349529 15.999 > 10 39 O 0.66666666666667 0.33333333333333 0.57910741645854 15.999 > 11 40 O 0.82667597814024 0.17332402185976 0.42438225739628 15.999 > 12 41 O 0.34664804371952 0.17332402185976 0.42438225739628 15.999 > 13 42 O 0.82667597814024 0.65335195628048 0.42438225739628 15.999 > 14 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.1708565 0.0000000 0.0000000 -0.0000000 3.1708565 0.0000000 0.0000000 0.0000000 3.1549487 -------------------------- Born effective charges -------------------------- 1 Al 3.0468966 0.1138290 0.0798429 0.1138290 2.9154581 0.0460973 0.0797465 0.0460417 2.5731382 2 Al 2.8497389 0.0000000 0.0000000 -0.0000000 3.1126158 -0.0921947 0.0000000 -0.0920833 2.5731382 3 Al 3.0468966 -0.1138290 -0.0798429 -0.1138290 2.9154581 0.0460973 -0.0797465 0.0460417 2.5731382 4 Al 2.7933025 -0.0000000 0.0000000 -0.0000000 2.7933025 0.0000000 0.0000000 0.0000000 3.0347303 5 Mg 1.9534965 0.0000000 0.0000000 -0.0000000 1.9534965 0.0000000 0.0000000 0.0000000 2.0730741 6 Mg 1.7921859 0.0000000 0.0000000 -0.0000000 1.7921859 0.0000000 0.0000000 0.0000000 2.1662687 7 O -1.9480706 -0.0000000 -0.0000000 0.0000000 -1.8413663 0.1080909 0.0000000 0.1295325 -1.7774627 8 O -1.8680424 0.0462043 -0.0936095 0.0462043 -1.9213946 -0.0540455 -0.1121785 -0.0647663 -1.7774627 9 O -1.8680424 -0.0462043 0.0936095 -0.0462043 -1.9213946 -0.0540455 0.1121785 -0.0647663 -1.7774627 10 O -1.9056150 -0.0000000 0.0000000 -0.0000000 -1.9056150 0.0000000 0.0000000 0.0000000 -1.9177861 11 O -1.8605619 -0.0000000 0.0000000 -0.0000000 -1.8605619 0.0000000 0.0000000 0.0000000 -2.3093627 12 O -2.0526625 0.0726323 0.2148956 0.0726323 -1.9687939 -0.1240700 0.2327100 -0.1343552 -1.8113170 13 O -2.0526625 -0.0726323 -0.2148956 -0.0726323 -1.9687939 -0.1240700 -0.2327100 -0.1343552 -1.8113170 14 O -1.9268596 -0.0000000 -0.0000000 -0.0000000 -2.0945968 0.2481400 0.0000000 0.2687104 -1.8113170 ---------------------------------------------------------------------------- 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: 126/126 Permutation basis: 3381/3381 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 503 Number of blocks in projector: 374 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 3 --- Eigsh_solver_block: 1 / 3 --- Block_size: 217 Use standard eigh solver. --- Eigsh_solver_block: 2 / 3 --- Block_size: 171 Use standard eigh solver. --- Eigsh_solver_block: 3 / 3 --- Block_size: 115 Use standard eigh solver. Tree of FC basis block matrices: - (503, 478), data: False |-- (115, 107), data: True |-- (171, 165), data: True |-- (217, 206), data: True ----- Solver_atoms: 1 -- 42 / 42 Time (Solver_compr_matrix_reshape): 0.001 Solver_block: 100 / 320 - Time: 0.158 Solver_block: 200 / 320 - Time: 0.166 Solver_block: 300 / 320 - Time: 0.147 Solver_block: 320 / 320 - Time: 0.044 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 0.533 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (zz) 0.00000000 (zz) Permutation basis: 126/126 Permutation basis: 3381/3381 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 503 Number of blocks in projector: 374 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 3 --- Eigsh_solver_block: 1 / 3 --- Block_size: 217 Use standard eigh solver. --- Eigsh_solver_block: 2 / 3 --- Block_size: 171 Use standard eigh solver. --- Eigsh_solver_block: 3 / 3 --- Block_size: 115 Use standard eigh solver. Tree of FC basis block matrices: - (503, 478), data: False |-- (115, 107), data: True |-- (171, 165), data: True |-- (217, 206), data: True Max drift after symmetrization by symfc projector: 0.00000000 (zz) 0.00000000 (zz) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 09:24:55]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 09:24:56]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 1 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R3m (160) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.852535206612510 1.646911969410614 4.700210186666661 b -2.852535206612504 1.646911969410614 4.700210186666661 c 0.000000000000003 -3.293823938821233 4.700210186666661 Atomic positions (fractional): 1 Al 0.50980035882221 0.99664888000010 0.99664888000010 26.982 2 Al 0.99664888000010 0.99664888000010 0.50980035882221 26.982 3 Al 0.99664888000010 0.50980035882221 0.99664888000010 26.982 4 Al 0.38011739934220 0.38011739934220 0.38011739934220 26.982 5 Mg 0.62184101843949 0.62184101843949 0.62184101843949 24.305 6 Mg 0.99856966662448 0.99856966662449 0.99856966662448 24.305 7 O 0.75260298909370 0.75260298909371 0.21222141310797 15.999 8 O 0.21222141310797 0.75260298909371 0.75260298909370 15.999 9 O 0.75260298909370 0.21222141310798 0.75260298909370 15.999 10 O 0.76002564682862 0.76002564682863 0.76002564682862 15.999 11 O 0.24577408312520 0.24577408312521 0.24577408312520 15.999 12 O 0.25105823553652 0.77103030111581 0.25105823553652 15.999 13 O 0.77103030111580 0.25105823553652 0.25105823553652 15.999 14 O 0.25105823553652 0.25105823553652 0.77103030111580 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 5.705070413225014 0.000000000000000 0.000000000000000 b -2.852535206612507 4.940735908231847 0.000000000000000 c 0.000000000000000 0.000000000000000 14.100630559999999 Atomic positions (fractional): 1 Al 0.67543431921474 0.83771715960737 0.83436603960747 26.982 > 1 2 Al 0.16228284039263 0.32456568078526 0.83436603960747 26.982 > 2 3 Al 0.16228284039263 0.83771715960737 0.83436603960747 26.982 > 3 4 Al 0.66666666666667 0.33333333333333 0.71345073267554 26.982 > 4 5 Al 0.34210098588140 0.17105049294070 0.16769937294080 26.982 > 1 6 Al 0.82894950705930 0.65789901411860 0.16769937294080 26.982 > 2 7 Al 0.82894950705930 0.17105049294070 0.16769937294080 26.982 > 3 8 Al 0.33333333333333 0.66666666666667 0.04678406600887 26.982 > 4 9 Al 0.00876765254807 0.50438382627403 0.50103270627414 26.982 > 1 10 Al 0.49561617372597 0.99123234745193 0.50103270627414 26.982 > 2 11 Al 0.49561617372597 0.50438382627403 0.50103270627414 26.982 > 3 12 Al 0.00000000000000 0.00000000000000 0.38011739934220 26.982 > 4 13 Mg 0.66666666666667 0.33333333333333 0.95517435177282 24.305 > 13 14 Mg 0.00000000000000 0.00000000000000 0.99856966662448 24.305 > 14 15 Mg 0.33333333333333 0.66666666666667 0.28850768510615 24.305 > 13 16 Mg 0.66666666666667 0.33333333333333 0.33190299995782 24.305 > 14 17 Mg 0.00000000000000 0.00000000000000 0.62184101843949 24.305 > 13 18 Mg 0.33333333333333 0.66666666666667 0.66523633329115 24.305 > 14 19 O 0.84679385866191 0.69358771732382 0.90580913043179 15.999 > 19 20 O 0.30641228267618 0.15320614133809 0.90580913043179 15.999 > 20 21 O 0.84679385866191 0.15320614133809 0.90580913043179 15.999 > 21 22 O 0.00000000000000 0.00000000000000 0.76002564682862 15.999 > 22 23 O 0.33333333333333 0.66666666666667 0.91244074979187 15.999 > 23 24 O 0.49334264480691 0.50665735519309 0.75771559072962 15.999 > 24 25 O 0.01331471038619 0.50665735519309 0.75771559072962 15.999 > 25 26 O 0.49334264480691 0.98668528961381 0.75771559072962 15.999 > 26 27 O 0.51346052532858 0.02692105065715 0.23914246376513 15.999 > 19 28 O 0.97307894934285 0.48653947467142 0.23914246376513 15.999 > 20 29 O 0.51346052532858 0.48653947467142 0.23914246376513 15.999 > 21 30 O 0.66666666666667 0.33333333333333 0.09335898016196 15.999 > 22 31 O 0.00000000000000 0.00000000000000 0.24577408312520 15.999 > 23 32 O 0.16000931147357 0.83999068852643 0.09104892406295 15.999 > 24 33 O 0.67998137705286 0.83999068852643 0.09104892406295 15.999 > 25 34 O 0.16000931147357 0.32001862294714 0.09104892406295 15.999 > 26 35 O 0.18012719199524 0.36025438399048 0.57247579709846 15.999 > 19 36 O 0.63974561600951 0.81987280800476 0.57247579709846 15.999 > 20 37 O 0.18012719199524 0.81987280800476 0.57247579709846 15.999 > 21 38 O 0.33333333333333 0.66666666666667 0.42669231349529 15.999 > 22 39 O 0.66666666666667 0.33333333333333 0.57910741645854 15.999 > 23 40 O 0.82667597814024 0.17332402185976 0.42438225739628 15.999 > 24 41 O 0.34664804371952 0.17332402185976 0.42438225739628 15.999 > 25 42 O 0.82667597814024 0.65335195628048 0.42438225739628 15.999 > 26 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.1708565 0.0000000 0.0000000 -0.0000000 3.1708565 0.0000000 0.0000000 0.0000000 3.1549487 -------------------------- Born effective charges -------------------------- 1 Al 3.0468966 0.1138290 0.0798429 0.1138290 2.9154581 0.0460973 0.0797465 0.0460417 2.5731382 2 Al 2.8497389 0.0000000 0.0000000 -0.0000000 3.1126158 -0.0921947 0.0000000 -0.0920833 2.5731382 3 Al 3.0468966 -0.1138290 -0.0798429 -0.1138290 2.9154581 0.0460973 -0.0797465 0.0460417 2.5731382 4 Al 2.7933025 -0.0000000 0.0000000 -0.0000000 2.7933025 0.0000000 0.0000000 0.0000000 3.0347303 5 Mg 1.9534965 0.0000000 0.0000000 -0.0000000 1.9534965 0.0000000 0.0000000 0.0000000 2.0730741 6 Mg 1.7921859 0.0000000 0.0000000 -0.0000000 1.7921859 0.0000000 0.0000000 0.0000000 2.1662687 7 O -1.9480706 -0.0000000 -0.0000000 0.0000000 -1.8413663 0.1080909 0.0000000 0.1295325 -1.7774627 8 O -1.8680424 0.0462043 -0.0936095 0.0462043 -1.9213946 -0.0540455 -0.1121785 -0.0647663 -1.7774627 9 O -1.8680424 -0.0462043 0.0936095 -0.0462043 -1.9213946 -0.0540455 0.1121785 -0.0647663 -1.7774627 10 O -1.9056150 -0.0000000 0.0000000 -0.0000000 -1.9056150 0.0000000 0.0000000 0.0000000 -1.9177861 11 O -1.8605619 -0.0000000 0.0000000 -0.0000000 -1.8605619 0.0000000 0.0000000 0.0000000 -2.3093627 12 O -2.0526625 0.0726323 0.2148956 0.0726323 -1.9687939 -0.1240700 0.2327100 -0.1343552 -1.8113170 13 O -2.0526625 -0.0726323 -0.2148956 -0.0726323 -1.9687939 -0.1240700 -0.2327100 -0.1343552 -1.8113170 14 O -1.9268596 -0.0000000 -0.0000000 -0.0000000 -2.0945968 0.2481400 0.0000000 0.2687104 -1.8113170 ---------------------------------------------------------------------------- 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 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 4, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 13, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 14, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 19, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [-0.0050 0.0087 0.0000] [ 0.0050 -0.0087 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 22, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 23, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 24, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000000 (yyy) -0.00000000 (yyy) -0.00000000 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (xx) 0.00000000 (xx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 09:25:00]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 09:25:01]------------------------- 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 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R3m (160) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.852535206612510 1.646911969410614 4.700210186666661 b -2.852535206612504 1.646911969410614 4.700210186666661 c 0.000000000000003 -3.293823938821233 4.700210186666661 Atomic positions (fractional): 1 Al 0.50980035882221 0.99664888000010 0.99664888000010 26.982 2 Al 0.99664888000010 0.99664888000010 0.50980035882221 26.982 3 Al 0.99664888000010 0.50980035882221 0.99664888000010 26.982 4 Al 0.38011739934220 0.38011739934220 0.38011739934220 26.982 5 Mg 0.62184101843949 0.62184101843949 0.62184101843949 24.305 6 Mg 0.99856966662448 0.99856966662449 0.99856966662448 24.305 7 O 0.75260298909370 0.75260298909371 0.21222141310797 15.999 8 O 0.21222141310797 0.75260298909371 0.75260298909370 15.999 9 O 0.75260298909370 0.21222141310798 0.75260298909370 15.999 10 O 0.76002564682862 0.76002564682863 0.76002564682862 15.999 11 O 0.24577408312520 0.24577408312521 0.24577408312520 15.999 12 O 0.25105823553652 0.77103030111581 0.25105823553652 15.999 13 O 0.77103030111580 0.25105823553652 0.25105823553652 15.999 14 O 0.25105823553652 0.25105823553652 0.77103030111580 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 5.705070413225014 0.000000000000000 0.000000000000000 b -2.852535206612507 4.940735908231847 0.000000000000000 c 0.000000000000000 0.000000000000000 14.100630559999999 Atomic positions (fractional): 1 Al 0.67543431921474 0.83771715960737 0.83436603960747 26.982 > 1 2 Al 0.16228284039263 0.32456568078526 0.83436603960747 26.982 > 2 3 Al 0.16228284039263 0.83771715960737 0.83436603960747 26.982 > 3 4 Al 0.66666666666667 0.33333333333333 0.71345073267554 26.982 > 4 5 Al 0.34210098588140 0.17105049294070 0.16769937294080 26.982 > 1 6 Al 0.82894950705930 0.65789901411860 0.16769937294080 26.982 > 2 7 Al 0.82894950705930 0.17105049294070 0.16769937294080 26.982 > 3 8 Al 0.33333333333333 0.66666666666667 0.04678406600887 26.982 > 4 9 Al 0.00876765254807 0.50438382627403 0.50103270627414 26.982 > 1 10 Al 0.49561617372597 0.99123234745193 0.50103270627414 26.982 > 2 11 Al 0.49561617372597 0.50438382627403 0.50103270627414 26.982 > 3 12 Al 0.00000000000000 0.00000000000000 0.38011739934220 26.982 > 4 13 Mg 0.66666666666667 0.33333333333333 0.95517435177282 24.305 > 13 14 Mg 0.00000000000000 0.00000000000000 0.99856966662448 24.305 > 14 15 Mg 0.33333333333333 0.66666666666667 0.28850768510615 24.305 > 13 16 Mg 0.66666666666667 0.33333333333333 0.33190299995782 24.305 > 14 17 Mg 0.00000000000000 0.00000000000000 0.62184101843949 24.305 > 13 18 Mg 0.33333333333333 0.66666666666667 0.66523633329115 24.305 > 14 19 O 0.84679385866191 0.69358771732382 0.90580913043179 15.999 > 19 20 O 0.30641228267618 0.15320614133809 0.90580913043179 15.999 > 20 21 O 0.84679385866191 0.15320614133809 0.90580913043179 15.999 > 21 22 O 0.00000000000000 0.00000000000000 0.76002564682862 15.999 > 22 23 O 0.33333333333333 0.66666666666667 0.91244074979187 15.999 > 23 24 O 0.49334264480691 0.50665735519309 0.75771559072962 15.999 > 24 25 O 0.01331471038619 0.50665735519309 0.75771559072962 15.999 > 25 26 O 0.49334264480691 0.98668528961381 0.75771559072962 15.999 > 26 27 O 0.51346052532858 0.02692105065715 0.23914246376513 15.999 > 19 28 O 0.97307894934285 0.48653947467142 0.23914246376513 15.999 > 20 29 O 0.51346052532858 0.48653947467142 0.23914246376513 15.999 > 21 30 O 0.66666666666667 0.33333333333333 0.09335898016196 15.999 > 22 31 O 0.00000000000000 0.00000000000000 0.24577408312520 15.999 > 23 32 O 0.16000931147357 0.83999068852643 0.09104892406295 15.999 > 24 33 O 0.67998137705286 0.83999068852643 0.09104892406295 15.999 > 25 34 O 0.16000931147357 0.32001862294714 0.09104892406295 15.999 > 26 35 O 0.18012719199524 0.36025438399048 0.57247579709846 15.999 > 19 36 O 0.63974561600951 0.81987280800476 0.57247579709846 15.999 > 20 37 O 0.18012719199524 0.81987280800476 0.57247579709846 15.999 > 21 38 O 0.33333333333333 0.66666666666667 0.42669231349529 15.999 > 22 39 O 0.66666666666667 0.33333333333333 0.57910741645854 15.999 > 23 40 O 0.82667597814024 0.17332402185976 0.42438225739628 15.999 > 24 41 O 0.34664804371952 0.17332402185976 0.42438225739628 15.999 > 25 42 O 0.82667597814024 0.65335195628048 0.42438225739628 15.999 > 26 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.1708565 0.0000000 0.0000000 -0.0000000 3.1708565 0.0000000 0.0000000 0.0000000 3.1549487 -------------------------- Born effective charges -------------------------- 1 Al 3.0468966 0.1138290 0.0798429 0.1138290 2.9154581 0.0460973 0.0797465 0.0460417 2.5731382 2 Al 2.8497389 0.0000000 0.0000000 -0.0000000 3.1126158 -0.0921947 0.0000000 -0.0920833 2.5731382 3 Al 3.0468966 -0.1138290 -0.0798429 -0.1138290 2.9154581 0.0460973 -0.0797465 0.0460417 2.5731382 4 Al 2.7933025 -0.0000000 0.0000000 -0.0000000 2.7933025 0.0000000 0.0000000 0.0000000 3.0347303 5 Mg 1.9534965 0.0000000 0.0000000 -0.0000000 1.9534965 0.0000000 0.0000000 0.0000000 2.0730741 6 Mg 1.7921859 0.0000000 0.0000000 -0.0000000 1.7921859 0.0000000 0.0000000 0.0000000 2.1662687 7 O -1.9480706 -0.0000000 -0.0000000 0.0000000 -1.8413663 0.1080909 0.0000000 0.1295325 -1.7774627 8 O -1.8680424 0.0462043 -0.0936095 0.0462043 -1.9213946 -0.0540455 -0.1121785 -0.0647663 -1.7774627 9 O -1.8680424 -0.0462043 0.0936095 -0.0462043 -1.9213946 -0.0540455 0.1121785 -0.0647663 -1.7774627 10 O -1.9056150 -0.0000000 0.0000000 -0.0000000 -1.9056150 0.0000000 0.0000000 0.0000000 -1.9177861 11 O -1.8605619 -0.0000000 0.0000000 -0.0000000 -1.8605619 0.0000000 0.0000000 0.0000000 -2.3093627 12 O -2.0526625 0.0726323 0.2148956 0.0726323 -1.9687939 -0.1240700 0.2327100 -0.1343552 -1.8113170 13 O -2.0526625 -0.0726323 -0.2148956 -0.0726323 -1.9687939 -0.1240700 -0.2327100 -0.1343552 -1.8113170 14 O -1.9268596 -0.0000000 -0.0000000 -0.0000000 -2.0945968 0.2481400 0.0000000 0.2687104 -1.8113170 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (yyy) -0.00000000 (yyy) -0.00000000 (yyy) Max drift of fc2: 0.00000000 (zz) 0.00000000 (zz) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 11 11 11 ] 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: 0.81, Number of G-points: 307, Lambda: 0.15 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/146) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 146 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 6.656 ( 0.000 0.000 -0.000) 0.000 6.656 ( 0.000 0.000 -0.000) 0.000 6.951 ( 0.000 -0.000 0.000) 0.000 8.759 ( 0.000 0.000 -0.000) 0.000 8.949 ( 0.000 -0.000 -0.000) 0.000 8.949 ( 0.000 0.000 0.000) 0.000 9.078 ( 0.000 -0.000 -0.000) 0.000 9.339 ( -0.000 -0.000 -0.000) 0.000 9.339 ( 0.000 -0.000 -0.000) 0.000 10.020 ( 0.000 -0.000 -0.000) 0.000 10.020 ( 0.000 0.000 0.000) 0.000 10.817 ( 0.000 -0.000 -0.000) 0.000 11.058 ( 0.000 -0.000 0.000) 0.000 11.058 ( 0.000 -0.000 -0.000) 0.000 12.028 ( 0.000 -0.000 0.000) 0.000 12.028 ( 0.000 -0.000 0.000) 0.000 13.472 ( 0.000 -0.000 0.000) 0.000 13.472 ( 0.000 0.000 -0.000) 0.000 14.280 ( -0.000 -0.000 -0.000) 0.000 14.280 ( 0.000 0.000 0.000) 0.000 14.340 ( 0.000 0.000 0.000) 0.000 15.376 ( -0.000 -0.000 0.000) 0.000 15.408 ( 0.000 0.000 -0.000) 0.000 16.439 ( 0.000 -0.000 -0.000) 0.000 16.439 ( 0.000 -0.000 0.000) 0.000 16.480 ( -0.000 0.000 0.000) 0.000 17.669 ( -0.000 -0.000 -0.000) 0.000 17.669 ( 0.000 -0.000 0.000) 0.000 17.888 ( 0.000 0.000 -0.000) 0.000 18.043 ( 0.000 -0.000 0.000) 0.000 18.043 ( 0.000 0.000 0.000) 0.000 18.804 ( 0.000 0.000 -0.000) 0.000 18.804 ( 0.000 0.000 0.000) 0.000 19.145 ( -0.000 0.000 -0.000) 0.000 19.750 ( 0.000 -0.000 0.000) 0.000 21.011 ( 0.000 -0.000 -0.000) 0.000 21.011 ( 0.000 0.000 0.000) 0.000 21.052 ( 0.000 -0.000 0.000) 0.000 22.850 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/146) ======================= q-point: ( 0.09 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.704 ( 23.380 13.498 34.677) 43.947 0.878 ( 42.084 24.297 -2.794) 48.675 1.930 ( 77.965 45.013 39.312) 98.235 6.621 ( -2.603 -1.503 -1.566) 3.389 6.726 ( 1.264 0.730 2.298) 2.723 6.952 ( -0.667 -0.385 -0.024) 0.770 8.705 ( -8.006 -4.622 4.880) 10.453 8.886 ( -4.039 -2.332 -1.922) 5.045 9.034 ( -6.047 -3.491 13.044) 14.795 9.087 ( 2.651 1.531 -1.342) 3.342 9.352 ( 2.371 1.369 -3.639) 4.553 9.530 ( 13.112 7.570 4.341) 15.751 10.119 ( 8.229 4.751 0.249) 9.505 10.245 ( 19.124 11.041 -1.652) 22.144 10.847 ( 2.574 1.486 0.393) 2.998 11.066 ( 0.335 0.194 1.233) 1.293 11.155 ( 5.913 3.414 10.489) 12.515 12.096 ( 4.372 2.524 5.694) 7.610 12.372 ( 10.546 6.089 -9.645) 15.534 13.493 ( 0.698 0.403 4.048) 4.128 13.818 ( 3.099 1.789 -11.171) 11.730 14.254 ( -1.898 -1.096 -1.840) 2.862 14.324 ( 1.148 0.663 -5.292) 5.456 15.363 ( 0.339 0.196 -9.733) 9.741 15.390 ( 1.423 0.822 -0.584) 1.744 16.058 ( -24.334 -14.049 1.784) 28.155 16.380 ( -5.539 -3.198 0.314) 6.404 16.408 ( -3.182 -1.837 -11.036) 11.632 16.793 ( -6.013 -3.472 7.697) 10.366 17.571 ( -8.512 -4.914 -2.234) 10.079 17.650 ( -4.761 -2.749 1.614) 5.730 17.906 ( -4.680 -2.702 8.468) 10.045 18.004 ( -2.499 -1.443 -1.938) 3.476 18.115 ( -1.754 -1.013 14.453) 14.594 18.848 ( 4.368 2.522 -2.347) 5.563 19.155 ( 5.109 2.950 -14.517) 15.670 19.718 ( 3.250 1.876 -3.899) 5.412 20.566 ( -11.405 -6.585 8.589) 15.723 21.001 ( -0.710 -0.410 -0.859) 1.188 21.286 ( 15.329 8.850 2.956) 17.946 22.848 ( 2.079 1.200 -2.165) 3.233 25.089 ( -0.809 -0.467 -11.475) 11.513 ======================= Grid point 2 (3/146) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.446 ( 26.083 15.059 32.442) 44.267 1.749 ( 41.329 23.861 -2.038) 47.766 3.796 ( 73.617 42.503 37.408) 92.873 6.528 ( -5.060 -2.921 -2.904) 6.525 6.717 ( -3.972 -2.293 -0.847) 4.664 6.880 ( -6.525 -3.767 -0.379) 7.544 8.587 ( -5.749 -3.319 9.794) 11.832 8.813 ( -0.194 -0.112 -3.853) 3.860 9.042 ( -2.275 -1.314 17.496) 17.692 9.216 ( 10.226 5.904 -0.850) 11.839 9.400 ( 4.306 2.486 -2.829) 5.721 9.891 ( 17.328 10.004 4.043) 20.412 10.326 ( 10.282 5.936 0.250) 11.876 10.719 ( 24.501 14.146 -2.354) 28.389 10.930 ( 5.398 3.116 -0.730) 6.275 11.101 ( 2.235 1.290 3.726) 4.532 11.432 ( 10.909 6.298 17.640) 21.675 12.275 ( 7.852 4.533 8.817) 12.647 12.567 ( 12.582 7.264 -10.727) 18.059 13.551 ( 0.874 0.505 8.437) 8.497 13.811 ( 1.109 0.640 -4.222) 4.412 14.175 ( -3.835 -2.214 -3.724) 5.786 14.300 ( -0.202 -0.117 -6.178) 6.183 15.135 ( -21.627 -12.487 -14.259) 28.757 15.425 ( 2.281 1.317 -1.330) 2.951 15.554 ( -14.966 -8.641 0.816) 17.301 16.218 ( -9.609 -5.548 0.781) 11.123 16.235 ( -4.194 -2.421 -15.398) 16.141 16.677 ( -7.576 -4.374 0.038) 8.748 17.299 ( -14.274 -8.241 -4.431) 17.068 17.526 ( -8.381 -4.839 5.170) 10.972 17.832 ( -7.613 -4.396 8.579) 12.283 17.928 ( -2.754 -1.590 -3.956) 5.076 18.130 ( -3.961 -2.287 8.377) 9.545 18.937 ( 5.353 3.091 -3.540) 7.123 19.156 ( 5.080 2.933 -17.425) 18.385 19.772 ( -0.934 -0.539 9.946) 10.004 20.441 ( -4.097 -2.365 4.292) 6.387 20.970 ( -1.501 -0.867 -1.424) 2.243 21.655 ( 16.646 9.611 4.535) 19.749 22.892 ( 1.974 1.140 2.088) 3.091 24.957 ( -5.135 -2.965 -9.735) 11.399 ======================= Grid point 3 (4/146) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.219 ( 27.490 15.871 28.963) 42.970 2.600 ( 39.460 22.782 -1.064) 45.577 5.460 ( 56.815 32.802 29.198) 71.808 6.336 ( -12.410 -7.165 -3.405) 14.729 6.565 ( -3.524 -2.035 -3.546) 5.397 6.696 ( -8.562 -4.943 -0.934) 9.930 8.592 ( -1.425 -0.823 11.204) 11.324 8.826 ( 3.235 1.868 -4.463) 5.820 9.190 ( 4.835 2.792 21.776) 22.481 9.494 ( 14.763 8.523 2.906) 17.292 9.500 ( 6.037 3.486 -0.842) 7.022 10.273 ( 15.434 8.911 2.438) 17.988 10.546 ( 9.811 5.664 1.587) 11.439 11.062 ( 7.424 4.286 -1.729) 8.745 11.087 ( 9.679 5.588 -1.835) 11.326 11.343 ( 19.476 11.244 3.603) 22.776 11.800 ( 11.951 6.900 17.080) 21.959 12.540 ( 11.349 6.552 10.335) 16.690 12.690 ( 4.748 2.742 -14.626) 15.620 13.631 ( 0.201 0.116 11.843) 11.845 13.822 ( 2.041 1.179 -3.030) 3.839 14.043 ( -5.754 -3.322 -5.382) 8.550 14.192 ( -9.272 -5.353 -14.982) 18.414 14.409 ( -28.773 -16.612 -4.156) 33.483 15.383 ( -6.062 -3.500 0.263) 7.004 15.454 ( 1.062 0.613 -2.610) 2.884 16.004 ( -10.636 -6.141 1.291) 12.349 16.055 ( -2.680 -1.547 -17.655) 17.924 16.485 ( -8.747 -5.050 -2.080) 10.312 16.949 ( -14.504 -8.374 -5.435) 17.607 17.390 ( -7.342 -4.239 6.221) 10.515 17.692 ( -9.999 -5.773 6.633) 13.315 17.836 ( -3.047 -1.759 -5.327) 6.383 18.065 ( -5.733 -3.310 4.924) 8.251 19.020 ( 4.530 2.616 -3.581) 6.339 19.181 ( 6.903 3.986 -12.438) 14.773 19.779 ( -5.179 -2.990 12.524) 13.878 20.417 ( -0.768 -0.443 0.561) 1.049 20.922 ( -2.069 -1.194 -1.497) 2.819 22.042 ( 16.403 9.470 5.746) 19.793 22.956 ( 2.158 1.246 3.830) 4.570 24.754 ( -7.743 -4.471 -9.814) 13.276 ======================= Grid point 4 (5/146) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.957 ( 25.018 14.444 23.367) 37.155 3.395 ( 34.975 20.193 -0.112) 40.385 5.866 ( -12.355 -7.133 -9.631) 17.213 5.943 ( -21.381 -12.344 -2.683) 24.834 6.558 ( -3.875 -2.237 -1.232) 4.641 7.229 ( 46.530 26.864 25.260) 59.370 8.633 ( -0.062 -0.036 6.431) 6.431 8.867 ( 2.687 1.551 -3.474) 4.658 9.500 ( 10.427 6.020 17.606) 21.329 9.624 ( 5.157 2.977 0.195) 5.958 9.872 ( 16.993 9.811 11.520) 22.754 10.527 ( 7.550 4.359 -0.845) 8.758 10.757 ( 8.405 4.853 2.481) 10.017 11.205 ( 6.677 3.855 -2.045) 7.977 11.295 ( 10.387 5.997 3.336) 12.449 11.706 ( 9.703 5.602 -8.125) 13.840 12.111 ( 8.270 4.775 10.334) 14.071 12.549 ( -7.330 -4.232 -11.324) 14.138 12.887 ( 14.074 8.126 11.554) 19.940 13.486 ( -25.190 -14.543 -18.747) 34.604 13.701 ( -0.644 -0.372 10.460) 10.486 13.866 ( -7.359 -4.249 -5.389) 10.062 13.929 ( 2.784 1.607 -0.126) 3.217 14.168 ( -5.680 -3.279 0.483) 6.577 15.257 ( -6.137 -3.543 1.941) 7.348 15.420 ( -2.185 -1.262 -3.539) 4.346 15.799 ( -8.958 -5.172 0.136) 10.344 15.880 ( -3.192 -1.843 -16.945) 17.341 16.337 ( -3.796 -2.192 -0.392) 4.401 16.665 ( -8.496 -4.905 -3.233) 10.329 17.305 ( -4.307 -2.486 5.035) 7.077 17.520 ( -7.739 -4.468 2.341) 9.237 17.736 ( -2.909 -1.680 -5.096) 6.104 17.965 ( -6.164 -3.559 4.120) 8.224 19.080 ( 2.979 1.720 -2.651) 4.342 19.288 ( 8.757 5.056 -7.902) 12.833 19.731 ( -6.146 -3.548 11.466) 13.484 20.382 ( -2.267 -1.309 -1.901) 3.235 20.869 ( -1.889 -1.090 -1.086) 2.436 22.404 ( 13.537 7.816 5.104) 16.444 23.028 ( 2.077 1.199 4.253) 4.882 24.519 ( -8.146 -4.703 -8.667) 12.790 ======================= Grid point 5 (6/146) ======================= q-point: ( 0.45 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.500 ( 12.502 7.218 10.909) 18.095 4.014 ( 19.513 11.266 0.337) 22.534 5.496 ( -15.392 -8.886 -1.280) 17.819 5.518 ( -9.700 -5.601 -7.258) 13.347 6.502 ( -1.093 -0.631 -0.538) 1.372 8.102 ( 18.337 10.587 11.212) 23.959 8.687 ( 2.212 1.277 3.031) 3.964 8.890 ( 0.923 0.533 -1.284) 1.669 9.702 ( 1.881 1.086 0.177) 2.180 9.761 ( 5.425 3.132 5.247) 8.171 10.373 ( 17.137 9.894 12.802) 23.568 10.649 ( 9.199 5.311 4.954) 11.720 10.905 ( 3.561 2.056 1.304) 4.313 11.300 ( 2.789 1.610 -1.045) 3.385 11.335 ( -22.227 -12.833 -17.873) 31.276 11.571 ( 3.310 1.911 -1.313) 4.042 12.275 ( 2.980 1.721 3.237) 4.725 12.500 ( 3.958 2.285 2.103) 5.031 12.997 ( -10.727 -6.193 -10.025) 15.935 13.225 ( 9.416 5.437 7.738) 13.345 13.671 ( -4.706 -2.717 -7.602) 9.345 13.743 ( -1.910 -1.103 7.377) 7.700 13.964 ( -0.068 -0.039 -0.526) 0.531 14.096 ( -1.082 -0.625 0.488) 1.341 15.171 ( -2.606 -1.505 1.521) 3.372 15.352 ( -1.608 -0.928 -1.701) 2.518 15.641 ( -4.513 -2.605 -0.967) 5.300 15.739 ( -1.736 -1.002 -7.199) 7.473 16.300 ( -0.348 -0.201 0.027) 0.403 16.552 ( -1.811 -1.045 -0.409) 2.130 17.253 ( -2.465 -1.423 1.831) 3.385 17.434 ( -1.258 -0.726 0.194) 1.465 17.663 ( -1.319 -0.761 -2.242) 2.710 17.877 ( -3.226 -1.863 1.934) 4.197 19.111 ( 1.040 0.600 -0.981) 1.551 19.411 ( 5.273 3.044 -4.240) 7.419 19.682 ( -3.533 -2.040 6.482) 7.659 20.318 ( -1.766 -1.020 -1.496) 2.529 20.835 ( -0.774 -0.447 -0.388) 0.975 22.639 ( 5.501 3.176 1.917) 6.635 23.090 ( 1.233 0.712 2.412) 2.801 24.336 ( -4.026 -2.324 -3.957) 6.105 ======================= Grid point 12 (7/146) ======================= q-point: ( 0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.278 ( -0.000 46.097 32.175) 56.216 1.332 ( -0.000 45.818 36.720) 58.717 1.855 ( -0.000 60.849 55.632) 82.447 6.654 ( 0.000 -2.052 -2.898) 3.550 6.725 ( -0.000 1.113 8.485) 8.557 6.958 ( -0.000 -0.009 0.626) 0.626 8.731 ( -0.000 -7.445 5.023) 8.981 8.874 ( 0.000 -2.692 -3.177) 4.165 8.912 ( -0.000 -14.306 -0.399) 14.311 9.222 ( -0.000 2.424 9.635) 9.935 9.440 ( -0.000 3.759 5.766) 6.883 9.479 ( 0.000 13.450 2.740) 13.726 10.090 ( 0.000 9.484 -3.128) 9.986 10.283 ( 0.000 21.257 1.179) 21.290 10.858 ( -0.000 3.228 1.294) 3.478 11.116 ( -0.000 1.874 7.027) 7.273 11.230 ( -0.000 6.384 16.321) 17.525 12.033 ( 0.000 0.799 -0.512) 0.949 12.443 ( 0.000 21.856 -1.242) 21.892 13.436 ( 0.000 -2.477 -2.081) 3.235 13.733 ( 0.000 6.803 -9.551) 11.726 14.285 ( 0.000 1.678 -5.871) 6.106 14.306 ( -0.000 0.176 3.486) 3.490 15.314 ( 0.000 3.810 -11.379) 12.000 15.384 ( 0.000 1.653 -1.136) 2.006 16.189 ( -0.000 -19.013 0.765) 19.028 16.286 ( 0.000 -9.169 -8.791) 12.702 16.292 ( 0.000 -4.202 -19.253) 19.706 16.904 ( -0.000 -12.980 14.007) 19.096 17.526 ( -0.000 -15.529 -3.309) 15.877 17.585 ( -0.000 -7.848 -0.849) 7.893 17.938 ( -0.000 -9.047 1.318) 9.143 18.037 ( -0.000 -1.932 1.323) 2.342 18.174 ( -0.000 -0.355 18.937) 18.940 18.903 ( -0.000 7.567 3.101) 8.178 19.052 ( 0.000 5.741 -20.649) 21.432 19.695 ( 0.000 10.573 -1.314) 10.655 20.640 ( -0.000 -16.220 10.184) 19.152 21.001 ( 0.000 -0.595 -0.892) 1.072 21.290 ( 0.000 16.963 3.161) 17.255 22.827 ( 0.000 4.385 -2.247) 4.927 24.977 ( 0.000 0.358 -15.204) 15.208 ======================= Grid point 13 (8/146) ======================= q-point: ( 0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.682 ( -12.293 30.973 55.576) 64.801 1.980 ( 6.031 57.093 12.521) 58.760 3.404 ( 60.134 49.889 46.788) 91.072 6.567 ( -3.939 -3.986 -2.476) 6.127 6.774 ( -3.385 -0.572 6.303) 7.178 6.945 ( -2.897 -0.952 1.657) 3.471 8.683 ( -3.901 -4.114 4.662) 7.340 8.721 ( -2.129 -8.235 2.395) 8.837 8.989 ( 11.579 -1.156 -1.502) 11.733 9.278 ( -2.775 5.794 11.721) 13.366 9.553 ( -6.912 15.410 1.968) 17.003 9.676 ( 17.222 2.442 5.077) 18.120 10.268 ( 9.174 10.602 -1.760) 14.130 10.569 ( 10.118 21.540 0.281) 23.799 10.926 ( 3.011 6.391 0.281) 7.070 11.174 ( -2.323 3.476 11.253) 12.005 11.482 ( 6.748 9.421 20.422) 23.481 12.128 ( 10.385 -1.049 0.560) 10.453 12.629 ( -2.384 22.812 -0.250) 22.938 13.486 ( 9.183 -4.164 -0.129) 10.084 13.735 ( 0.853 0.591 -4.559) 4.675 14.234 ( -3.912 1.535 -4.479) 6.142 14.300 ( -2.839 -0.435 1.957) 3.476 15.209 ( -7.687 -2.847 -13.672) 15.941 15.403 ( 1.128 2.106 -1.711) 2.939 15.749 ( -21.914 -15.256 -3.020) 26.871 16.108 ( -0.674 -4.883 -21.101) 21.669 16.168 ( 0.072 -14.649 -5.325) 15.587 16.781 ( -6.099 -9.180 1.953) 11.193 17.298 ( -5.723 -17.715 -2.357) 18.765 17.514 ( 0.606 -10.906 1.297) 11.000 17.822 ( -3.596 -7.085 -0.002) 7.945 18.005 ( -3.496 -2.791 7.263) 8.530 18.382 ( 1.569 7.131 8.948) 11.549 18.800 ( -6.174 0.044 -5.428) 8.221 19.079 ( 2.991 8.544 -12.827) 15.699 19.824 ( 3.089 3.850 6.839) 8.434 20.515 ( -4.921 -8.510 6.507) 11.789 20.966 ( -1.443 -1.423 -1.543) 2.547 21.574 ( 11.088 14.935 4.513) 19.140 22.877 ( 2.402 1.340 1.537) 3.150 24.870 ( 0.193 -5.300 -14.214) 15.171 ======================= Grid point 14 (9/146) ======================= q-point: ( 0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.253 ( 7.769 24.037 49.535) 55.605 2.691 ( 10.532 52.430 9.415) 54.299 5.055 ( 57.875 36.848 36.525) 77.726 6.431 ( -5.898 -4.116 -2.454) 7.599 6.663 ( -10.973 -2.009 3.417) 11.667 6.849 ( -10.345 0.361 2.776) 10.717 8.616 ( 0.787 -6.024 3.103) 6.822 8.733 ( 3.365 -1.961 5.957) 7.118 9.184 ( 10.033 6.054 -2.069) 11.899 9.420 ( 2.946 7.107 12.967) 15.078 9.641 ( -1.132 14.346 7.202) 16.093 10.035 ( 20.571 1.947 3.123) 20.897 10.503 ( 8.400 10.075 1.158) 13.169 10.885 ( 9.536 7.405 -1.008) 12.116 11.096 ( 6.177 12.347 -1.090) 13.849 11.321 ( 5.272 12.588 12.432) 18.461 11.834 ( 8.439 10.158 18.619) 22.827 12.324 ( 14.636 -2.209 1.132) 14.845 12.755 ( -3.221 15.771 -3.532) 16.480 13.605 ( 8.974 -3.400 -1.576) 9.725 13.715 ( 1.331 -3.122 -2.069) 3.975 14.128 ( -8.109 0.525 -2.447) 8.487 14.225 ( -5.954 -2.010 -2.492) 6.761 14.723 ( -29.108 -12.723 -7.915) 32.739 15.403 ( -3.231 -3.390 -4.326) 6.376 15.447 ( -2.020 1.266 -4.165) 4.799 15.923 ( -1.602 -8.003 -14.719) 16.830 15.966 ( -1.634 -13.656 -6.851) 15.366 16.579 ( -6.980 -9.903 -5.487) 13.300 17.022 ( -10.019 -10.760 -0.746) 14.721 17.420 ( -1.332 -9.792 2.169) 10.117 17.699 ( -2.792 -7.359 -1.856) 8.086 17.931 ( -8.957 -4.130 9.049) 13.386 18.375 ( -16.417 12.809 3.241) 21.074 18.782 ( 10.798 -6.963 -5.246) 13.878 19.128 ( 2.961 8.704 -8.478) 12.506 19.902 ( -2.424 -1.576 10.821) 11.201 20.443 ( -1.895 -2.065 1.835) 3.350 20.917 ( -1.051 -2.215 -1.980) 3.151 21.936 ( 14.044 12.438 5.460) 19.539 22.939 ( 2.954 -0.470 3.106) 4.312 24.699 ( -2.508 -7.697 -13.924) 16.106 ======================= Grid point 15 (10/146) ======================= q-point: ( 0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.950 ( 15.012 19.800 42.897) 49.573 3.385 ( 13.141 45.645 5.819) 47.854 5.833 ( -1.178 -11.471 0.140) 11.532 6.266 ( -19.322 -0.161 2.114) 19.438 6.670 ( -8.291 1.803 3.156) 9.052 6.971 ( 34.146 28.946 24.863) 51.205 8.620 ( 1.674 -6.126 6.408) 9.022 8.839 ( 5.718 4.092 -0.040) 7.032 9.383 ( 10.866 8.015 -5.129) 14.444 9.618 ( 4.147 8.575 2.777) 9.921 9.901 ( 7.994 7.512 24.315) 26.675 10.361 ( 15.392 0.962 1.263) 15.473 10.729 ( 6.914 9.447 1.958) 11.869 11.037 ( 8.263 -0.459 -0.348) 8.283 11.299 ( 6.388 11.392 2.055) 13.222 11.648 ( 6.519 14.262 2.247) 15.841 12.127 ( 6.009 7.225 10.156) 13.836 12.480 ( 4.008 -1.812 -5.399) 6.964 12.835 ( 5.824 5.273 4.363) 8.987 13.521 ( -10.231 -10.656 -16.950) 22.484 13.713 ( 2.165 -5.711 0.244) 6.112 13.907 ( -8.809 -3.261 -2.799) 9.801 14.086 ( -9.416 6.116 2.388) 11.479 14.287 ( -13.188 -4.185 5.117) 14.752 15.274 ( -2.385 -4.065 -7.193) 8.600 15.420 ( -2.050 -0.812 -3.716) 4.321 15.701 ( -2.521 -14.521 -5.208) 15.631 15.836 ( 0.602 -2.446 -12.091) 12.350 16.325 ( -5.594 -13.270 -5.225) 15.319 16.815 ( -9.437 1.137 0.917) 9.550 17.331 ( -1.250 -7.586 1.362) 7.808 17.573 ( -4.014 -5.759 -1.774) 7.241 17.774 ( -11.078 -3.723 7.191) 13.722 18.240 ( -15.124 10.840 1.889) 18.703 18.869 ( 11.316 -7.943 -3.711) 14.315 19.236 ( 4.809 10.131 -4.966) 12.265 19.873 ( -5.810 -4.276 11.228) 13.346 20.401 ( -2.518 -1.458 -1.438) 3.245 20.870 ( -0.871 -1.838 -1.824) 2.732 22.306 ( 14.103 10.484 5.318) 18.360 22.996 ( 3.250 -2.195 2.374) 4.584 24.485 ( -3.837 -8.127 -12.425) 15.335 ======================= Grid point 16 (11/146) ======================= q-point: ( 0.45 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.561 ( 7.608 14.161 30.965) 34.889 3.994 ( 11.614 34.804 3.892) 36.896 5.511 ( -12.531 -14.189 -1.051) 18.959 5.904 ( -26.026 3.000 3.582) 26.442 6.582 ( -6.694 2.933 3.676) 8.181 7.908 ( 27.691 13.727 12.210) 33.231 8.625 ( 1.867 -6.900 4.992) 8.719 8.970 ( 0.704 12.194 0.075) 12.214 9.631 ( 13.360 6.561 -2.962) 15.176 9.718 ( 1.162 5.217 -4.237) 6.820 10.295 ( 13.959 3.959 18.803) 23.751 10.567 ( 9.583 2.327 8.236) 12.848 10.896 ( 2.967 6.613 0.240) 7.252 11.143 ( 7.391 -6.391 -3.499) 10.378 11.478 ( -5.588 3.286 -5.413) 8.446 11.612 ( -7.948 1.385 -0.931) 8.121 12.299 ( 2.706 5.782 3.835) 7.448 12.479 ( 2.441 3.339 0.912) 4.236 12.927 ( -0.754 -11.059 -8.937) 14.239 13.246 ( 0.669 6.291 3.562) 7.260 13.636 ( -2.439 -2.716 -8.989) 9.702 13.833 ( -2.127 -3.259 3.332) 5.123 14.040 ( -6.711 1.862 6.492) 9.521 14.159 ( -5.329 2.088 1.976) 6.055 15.165 ( -0.788 -2.863 -8.767) 9.256 15.330 ( -1.133 -6.331 -0.541) 6.454 15.553 ( 0.060 -7.703 -2.763) 8.184 15.753 ( -1.112 1.980 -10.607) 10.847 16.151 ( 2.115 -13.616 0.696) 13.797 16.749 ( -6.748 9.023 1.105) 11.321 17.250 ( 0.018 -7.844 -1.555) 7.997 17.452 ( -4.963 -3.194 1.894) 6.199 17.660 ( -5.504 0.122 4.579) 7.161 18.123 ( -13.262 10.988 1.474) 17.286 18.938 ( 9.934 -10.137 -1.697) 14.294 19.379 ( 4.004 10.206 -3.700) 11.570 19.805 ( -6.311 -3.426 8.987) 11.504 20.323 ( -2.274 -2.893 -1.639) 4.028 20.836 ( -0.505 -0.695 -1.264) 1.528 22.613 ( 8.381 8.378 3.928) 12.485 23.022 ( 3.433 -5.214 -1.337) 6.384 24.300 ( -1.403 -6.229 -7.790) 10.072 ======================= Grid point 17 (12/146) ======================= q-point: (-0.45 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.662 ( -17.014 -3.548 3.168) 17.666 4.345 ( -11.022 19.034 9.890) 24.116 5.368 ( 3.176 0.472 9.048) 9.601 5.704 ( -8.365 13.453 9.274) 18.356 6.558 ( -3.561 3.626 4.423) 6.738 8.119 ( -3.421 -8.231 -11.323) 14.411 8.604 ( 1.920 -8.992 0.469) 9.207 9.043 ( -7.220 12.106 0.845) 14.121 9.674 ( -0.452 -3.516 -13.881) 14.326 9.784 ( -2.186 4.834 -0.306) 5.314 10.447 ( -4.885 -6.318 0.045) 7.987 10.703 ( -14.252 -12.482 -8.624) 20.816 10.937 ( -0.176 2.382 -0.647) 2.474 11.154 ( 17.753 4.283 14.541) 23.344 11.350 ( 4.166 5.479 7.365) 10.080 11.659 ( -3.416 2.532 3.788) 5.694 12.341 ( -5.303 3.991 -1.343) 6.771 12.518 ( -1.773 -1.342 -2.466) 3.320 12.873 ( 10.467 -1.979 3.309) 11.154 13.287 ( -6.350 -2.459 -6.991) 9.759 13.602 ( 5.349 6.882 -5.585) 10.352 13.773 ( -3.398 -3.859 6.047) 7.938 14.013 ( -0.623 -1.217 5.257) 5.432 14.134 ( -4.734 5.805 -0.121) 7.492 15.093 ( 2.894 -1.144 -11.041) 11.472 15.311 ( 3.780 -4.486 3.639) 6.903 15.523 ( 3.672 -3.398 0.390) 5.018 15.766 ( 4.629 5.808 -1.949) 7.679 16.126 ( 6.610 -11.731 3.711) 13.967 16.739 ( -6.904 10.688 -0.337) 12.729 17.192 ( 3.431 -5.198 -4.032) 7.420 17.405 ( -0.346 -2.179 4.162) 4.711 17.635 ( -2.703 1.259 3.809) 4.838 18.061 ( -9.163 14.457 0.513) 17.124 18.976 ( 8.142 -12.129 0.427) 14.615 19.477 ( 0.420 6.681 -2.351) 7.095 19.711 ( -6.893 -1.795 2.089) 7.423 20.303 ( 2.141 -0.372 2.260) 3.136 20.828 ( 0.502 0.301 -0.563) 0.812 22.722 ( -5.024 3.027 0.937) 5.940 22.997 ( 4.626 -6.822 -6.439) 10.459 24.268 ( 5.919 -2.028 -0.268) 6.263 ======================= Grid point 18 (13/146) ======================= q-point: (-0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.127 ( -30.326 -17.116 -9.767) 36.167 4.065 ( -43.173 11.035 9.808) 45.627 5.696 ( 16.682 7.555 14.081) 23.100 5.955 ( 8.105 17.158 10.489) 21.682 6.590 ( -0.849 4.645 4.524) 6.539 7.532 ( -36.058 -20.517 -24.730) 48.298 8.544 ( 1.628 -7.669 -2.595) 8.258 8.968 ( -9.714 0.822 -1.921) 9.936 9.434 ( -6.715 -5.150 -24.258) 25.692 9.694 ( -8.801 -0.052 -1.925) 9.009 10.077 ( -17.442 -4.874 0.958) 18.136 10.549 ( -3.101 -8.108 0.520) 8.697 10.856 ( -7.807 0.708 -3.839) 8.729 11.183 ( -2.466 -11.102 2.179) 11.579 11.502 ( -12.461 2.708 3.044) 13.110 11.865 ( 2.339 4.142 15.288) 16.011 12.191 ( -11.570 -0.295 -6.522) 13.284 12.497 ( 7.061 2.698 3.966) 8.536 12.933 ( -8.485 -7.891 -8.648) 14.459 13.276 ( 18.956 4.537 5.275) 20.192 13.660 ( 1.753 3.809 -5.944) 7.274 13.847 ( 4.504 5.412 5.118) 8.705 14.032 ( -3.828 2.383 2.996) 5.413 14.133 ( 2.000 2.505 3.168) 4.507 15.112 ( 9.126 0.112 -10.764) 14.113 15.401 ( 6.023 -0.080 4.511) 7.525 15.593 ( 7.991 -4.377 0.506) 9.125 15.940 ( 5.903 5.133 6.751) 10.333 16.212 ( 11.690 -4.849 6.148) 14.070 16.736 ( -3.671 9.453 -0.147) 10.142 17.204 ( 5.189 -2.068 -5.528) 7.858 17.447 ( 3.567 1.649 1.272) 4.131 17.647 ( 2.248 -2.068 3.529) 4.667 18.107 ( -4.635 17.667 0.460) 18.271 18.979 ( 5.773 -13.470 2.326) 14.838 19.456 ( -7.279 0.475 2.143) 7.603 19.639 ( 0.797 2.185 -5.787) 6.237 20.384 ( 2.375 2.930 3.951) 5.462 20.850 ( 1.847 0.551 0.107) 1.930 22.534 ( -13.612 -4.813 -4.679) 15.178 22.973 ( 2.293 -3.400 -5.176) 6.604 24.426 ( 11.540 0.782 4.344) 12.355 ======================= Grid point 19 (14/146) ======================= q-point: (-0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.356 ( -33.725 -21.160 -12.122) 41.618 3.447 ( -54.426 13.264 10.478) 56.990 5.789 ( -29.701 -20.545 -9.091) 37.241 6.282 ( 9.661 13.068 3.593) 16.644 6.638 ( -8.161 -1.741 0.738) 8.377 6.714 ( -7.543 5.296 0.552) 9.233 8.485 ( 1.882 -4.042 -7.216) 8.482 8.737 ( -2.571 -13.907 -11.874) 18.466 9.184 ( -6.040 0.929 -14.022) 15.296 9.546 ( -10.498 1.644 3.178) 11.091 9.832 ( -17.746 4.949 2.919) 18.653 10.330 ( -9.663 -15.041 -2.825) 18.100 10.679 ( -10.602 -0.739 -3.268) 11.119 11.054 ( -3.141 -8.628 2.648) 9.556 11.322 ( -14.355 1.380 5.056) 15.282 11.646 ( -24.640 -4.315 1.047) 25.037 11.881 ( -16.871 -2.874 -13.332) 21.694 12.520 ( -7.307 -11.509 -4.332) 14.305 12.878 ( 0.777 6.828 10.278) 12.364 13.502 ( 6.082 -2.675 -9.578) 11.657 13.850 ( -5.751 -0.337 0.308) 5.769 13.936 ( 17.421 5.753 6.355) 19.416 14.169 ( 13.590 11.225 1.175) 17.665 14.290 ( 9.012 8.202 14.284) 18.776 15.235 ( 12.731 0.395 -8.388) 15.251 15.493 ( -0.484 1.800 3.010) 3.540 15.710 ( 15.639 -7.879 -2.178) 17.646 16.087 ( 4.827 0.114 7.794) 9.169 16.485 ( 10.868 7.926 9.463) 16.446 16.828 ( 6.969 4.572 2.320) 8.652 17.240 ( 6.710 -0.386 -7.550) 10.108 17.556 ( 7.281 3.528 -3.514) 8.821 17.714 ( 6.637 -4.027 2.646) 8.201 18.223 ( -3.620 19.480 1.145) 19.846 18.939 ( 3.332 -14.989 3.294) 15.704 19.358 ( -6.286 -0.107 5.347) 8.253 19.665 ( 3.612 3.199 -7.921) 9.275 20.441 ( -1.475 2.720 1.889) 3.625 20.894 ( 2.816 0.080 0.569) 2.874 22.202 ( -16.521 -6.048 -5.249) 18.359 22.935 ( -0.243 -2.038 -3.480) 4.041 24.663 ( 12.353 1.188 5.014) 13.385 ======================= Grid point 20 (15/146) ======================= q-point: (-0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.550 ( -34.058 -18.612 -10.155) 40.118 2.739 ( -59.196 15.006 10.597) 61.981 4.460 ( -74.582 -27.427 -22.505) 82.591 6.518 ( 5.234 4.498 5.052) 8.553 6.685 ( 3.205 1.685 3.083) 4.756 6.835 ( 5.035 5.599 1.048) 7.603 8.463 ( 4.572 2.268 -9.045) 10.386 8.596 ( 8.292 -13.025 -4.494) 16.081 9.052 ( -3.328 0.351 -6.033) 6.899 9.390 ( -16.321 2.408 4.454) 17.088 9.652 ( -13.990 10.943 1.648) 17.838 9.969 ( -12.987 -17.050 -3.732) 21.755 10.486 ( -11.083 -0.440 -0.952) 11.132 10.924 ( -10.252 -6.770 2.727) 12.585 11.125 ( -15.932 -0.640 -0.768) 15.963 11.240 ( -18.672 0.476 7.721) 20.210 11.481 ( -15.389 -3.552 -16.236) 22.651 12.279 ( -7.486 -6.343 -4.079) 10.626 12.869 ( -14.609 2.182 8.018) 16.807 13.477 ( 1.715 -1.805 -6.768) 7.211 13.788 ( 0.739 -1.289 -0.755) 1.667 14.150 ( 5.987 1.981 2.037) 6.627 14.331 ( 2.740 0.424 3.911) 4.794 14.950 ( 30.613 17.075 15.194) 38.204 15.379 ( 10.277 -0.331 -5.734) 11.773 15.480 ( -2.088 0.777 0.472) 2.277 15.909 ( 19.830 -7.034 -3.533) 21.335 16.229 ( 6.994 1.163 5.080) 8.722 16.707 ( 0.717 7.697 5.814) 9.672 17.085 ( 18.859 -0.318 4.309) 19.348 17.328 ( 10.320 0.223 -7.467) 12.740 17.681 ( 8.131 1.701 -3.744) 9.112 17.801 ( 6.884 -3.055 0.183) 7.533 18.333 ( -6.799 18.425 0.451) 19.645 18.860 ( 2.568 -14.973 2.837) 15.454 19.338 ( -3.416 1.627 8.035) 8.881 19.691 ( 2.788 1.942 -7.289) 8.042 20.422 ( -2.286 1.027 -0.809) 2.633 20.942 ( 2.799 -0.334 0.564) 2.874 21.852 ( -18.004 -3.852 -2.829) 18.628 22.892 ( -1.036 -0.991 -1.703) 2.226 24.885 ( 10.512 0.615 3.624) 11.136 ======================= Grid point 21 (16/146) ======================= q-point: (-0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.869 ( -32.182 0.000 0.000) 32.182 1.929 ( -59.755 0.000 0.000) 59.755 2.904 ( -87.478 0.000 0.000) 87.478 6.615 ( 2.366 -0.000 -0.000) 2.366 6.713 ( 0.132 -0.000 -0.000) 0.132 6.931 ( 3.054 -0.000 -0.000) 3.054 8.564 ( 8.806 -0.000 -0.000) 8.806 8.698 ( 12.970 -0.000 -0.000) 12.970 9.007 ( -0.325 0.000 0.000) 0.325 9.168 ( -11.910 0.000 0.000) 11.910 9.582 ( -10.952 0.000 0.000) 10.952 9.604 ( -12.974 0.000 0.000) 12.974 10.294 ( -12.785 0.000 0.000) 12.785 10.569 ( -25.239 0.000 0.000) 25.239 10.925 ( -8.062 0.000 0.000) 8.062 11.126 ( -5.449 0.000 0.000) 5.449 11.197 ( -8.781 0.000 0.000) 8.781 12.128 ( -5.825 0.000 0.000) 5.825 12.629 ( -17.518 0.000 0.000) 17.518 13.463 ( 0.714 -0.000 -0.000) 0.714 13.817 ( 2.798 -0.000 -0.000) 2.798 14.237 ( 3.069 -0.000 -0.000) 3.069 14.362 ( -0.507 0.000 0.000) 0.507 15.376 ( 4.529 -0.000 -0.000) 4.529 15.417 ( -1.900 0.000 0.000) 1.900 15.710 ( 28.728 -0.000 -0.000) 28.728 16.167 ( 17.759 -0.000 -0.000) 17.759 16.369 ( 6.608 -0.000 -0.000) 6.608 16.761 ( 0.654 -0.000 -0.000) 0.654 17.403 ( 17.341 -0.000 -0.000) 17.341 17.469 ( 10.757 -0.000 -0.000) 10.757 17.798 ( 7.263 -0.000 -0.000) 7.263 17.879 ( 5.140 -0.000 -0.000) 5.140 18.283 ( -11.040 0.000 0.000) 11.040 18.832 ( 1.998 -0.000 -0.000) 1.998 19.314 ( -6.157 0.000 0.000) 6.157 19.711 ( 2.108 -0.000 -0.000) 2.108 20.432 ( 4.543 -0.000 -0.000) 4.543 20.981 ( 1.970 -0.000 -0.000) 1.970 21.528 ( -18.991 0.000 0.000) 18.991 22.866 ( -0.928 0.000 0.000) 0.928 25.046 ( 7.476 -0.000 -0.000) 7.476 ======================= Grid point 24 (17/146) ======================= q-point: ( 0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.508 ( -0.000 44.642 28.279) 52.845 2.616 ( -0.000 43.462 34.190) 55.299 3.650 ( -0.000 56.424 53.910) 78.038 6.526 ( 0.000 -5.957 -3.996) 7.173 6.840 ( -0.000 -3.761 5.676) 6.809 6.998 ( -0.000 2.141 8.252) 8.525 8.704 ( -0.000 -5.997 3.372) 6.880 8.790 ( -0.000 2.045 8.450) 8.694 8.842 ( 0.000 4.052 -2.955) 5.015 9.427 ( -0.000 6.550 8.027) 10.360 9.553 ( -0.000 -1.072 6.860) 6.943 9.786 ( -0.000 12.800 5.501) 13.932 10.261 ( 0.000 13.246 -4.087) 13.862 10.733 ( 0.000 25.346 1.302) 25.380 10.941 ( 0.000 4.962 -1.238) 5.114 11.345 ( -0.000 7.583 15.825) 17.548 11.661 ( -0.000 9.846 24.662) 26.554 12.046 ( 0.000 2.028 -1.155) 2.334 12.897 ( 0.000 24.542 -0.405) 24.545 13.328 ( 0.000 -4.626 -4.494) 6.450 13.708 ( -0.000 -3.798 -1.060) 3.943 14.242 ( 0.000 1.803 -4.241) 4.608 14.355 ( -0.000 -1.382 4.498) 4.705 15.147 ( 0.000 -4.905 -14.842) 15.632 15.405 ( 0.000 2.918 -2.288) 3.709 15.796 ( -0.000 -21.464 -0.681) 21.475 15.937 ( 0.000 -1.229 -23.079) 23.112 15.949 ( 0.000 -11.881 -10.010) 15.535 16.623 ( -0.000 -24.619 -7.562) 25.755 17.252 ( -0.000 -10.334 6.988) 12.475 17.381 ( -0.000 -12.776 -0.929) 12.810 17.818 ( -0.000 -6.564 1.726) 6.788 18.002 ( -0.000 -2.479 -0.160) 2.484 18.442 ( -0.000 5.340 12.595) 13.680 18.867 ( 0.000 3.598 -17.810) 18.170 19.117 ( -0.000 9.284 4.440) 10.291 19.856 ( -0.000 3.379 3.820) 5.100 20.495 ( -0.000 -11.365 6.240) 12.965 20.961 ( 0.000 -1.862 -1.943) 2.691 21.656 ( 0.000 15.947 4.840) 16.665 22.875 ( -0.000 0.352 1.950) 1.982 24.714 ( 0.000 -6.969 -15.015) 16.554 ======================= Grid point 25 (18/146) ======================= q-point: ( 0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.977 ( -13.810 34.183 47.391) 60.042 3.165 ( 0.679 52.831 13.882) 54.629 4.863 ( 39.661 41.159 43.330) 71.725 6.438 ( -2.020 -2.889 -1.380) 3.786 6.797 ( -2.617 -5.590 4.150) 7.438 7.040 ( -6.898 4.535 9.668) 12.713 8.626 ( -5.953 -0.332 3.386) 6.857 8.771 ( -3.708 1.260 4.658) 6.085 9.075 ( 12.475 7.458 3.725) 15.004 9.517 ( 1.039 7.297 5.245) 9.046 9.753 ( 16.537 -0.125 3.856) 16.982 9.873 ( -5.090 11.191 9.519) 15.549 10.448 ( 9.086 10.025 -0.087) 13.530 10.929 ( -0.417 14.036 -0.546) 14.053 11.088 ( 7.767 14.437 -1.405) 16.454 11.515 ( -1.586 12.032 17.444) 21.251 11.948 ( 4.012 9.573 18.858) 21.526 12.144 ( 9.329 2.731 3.176) 10.226 12.967 ( -9.427 12.204 -4.803) 16.152 13.384 ( 11.040 0.689 -7.701) 13.478 13.646 ( 0.867 -8.226 -2.070) 8.527 14.209 ( -3.911 0.125 -2.773) 4.796 14.312 ( -5.582 -2.393 2.627) 6.617 14.897 ( -11.960 -11.389 -9.697) 19.151 15.404 ( -3.194 -1.078 -4.175) 5.366 15.485 ( -8.091 -4.979 -7.141) 11.885 15.771 ( -0.315 -12.598 -6.452) 14.158 15.819 ( -0.633 -4.689 -13.293) 14.110 16.373 ( 4.188 -22.541 -10.899) 25.385 17.105 ( -8.906 -8.087 3.048) 12.410 17.322 ( 2.832 -10.708 1.984) 11.252 17.723 ( -5.197 -3.131 1.175) 6.181 17.997 ( 0.565 -4.984 3.099) 5.896 18.579 ( 2.789 3.957 2.671) 5.528 18.758 ( -8.462 6.876 -5.195) 12.078 19.157 ( -4.236 7.265 0.338) 8.416 19.939 ( 3.285 -0.624 4.821) 5.867 20.432 ( 0.078 -7.580 3.359) 8.291 20.905 ( -1.993 -2.594 -2.413) 4.065 21.897 ( 8.880 11.913 4.877) 15.639 22.904 ( 2.198 -1.435 2.418) 3.569 24.544 ( -0.299 -8.538 -15.251) 17.481 ======================= Grid point 26 (19/146) ======================= q-point: ( 0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.432 ( -4.955 31.661 45.761) 55.866 3.749 ( 3.531 48.317 10.507) 49.572 5.718 ( 9.888 -2.943 10.810) 14.943 6.481 ( -2.595 2.940 5.780) 6.985 6.818 ( 0.598 10.303 10.808) 14.944 7.075 ( 2.241 16.153 18.907) 24.968 8.604 ( -0.359 1.069 4.295) 4.440 8.775 ( 1.996 0.325 2.516) 3.228 9.327 ( 6.912 10.323 -1.802) 12.554 9.649 ( 3.030 8.500 -1.149) 9.097 9.967 ( 6.959 4.969 5.788) 10.326 10.139 ( 16.466 2.181 16.812) 23.633 10.681 ( 8.801 5.655 4.106) 11.238 11.028 ( -0.304 9.772 -2.627) 10.124 11.305 ( 5.854 11.529 -0.456) 12.938 11.748 ( 2.088 12.139 9.354) 15.467 12.150 ( 4.747 6.954 4.301) 9.454 12.407 ( 8.340 5.523 10.147) 14.248 12.848 ( -5.209 -1.469 -4.780) 7.220 13.463 ( 1.686 2.982 -12.323) 12.790 13.566 ( 3.395 -11.608 -3.434) 12.572 13.994 ( -11.849 -9.560 -4.021) 15.747 14.250 ( -3.975 4.394 0.307) 5.933 14.540 ( -16.221 -6.133 2.373) 17.503 15.197 ( -4.059 -7.723 -9.367) 12.801 15.418 ( -2.102 -2.721 -4.101) 5.351 15.615 ( -2.030 -10.331 1.702) 10.665 15.716 ( 0.625 1.080 -13.458) 13.516 16.183 ( 1.216 -14.869 -8.352) 17.098 16.923 ( -5.943 -6.227 0.074) 8.608 17.250 ( -0.291 -11.993 1.131) 12.049 17.656 ( -6.083 5.910 1.960) 8.705 17.938 ( -5.205 -5.975 6.598) 10.311 18.548 ( -9.307 4.908 -6.009) 12.117 18.719 ( -2.764 4.953 3.714) 6.780 19.218 ( 4.291 7.110 -0.322) 8.311 19.958 ( -2.290 -5.018 7.131) 9.015 20.394 ( -0.235 -4.458 -0.898) 4.554 20.842 ( -0.357 -2.703 -2.433) 3.654 22.195 ( 13.823 6.875 3.643) 15.862 22.942 ( 2.326 -1.717 2.015) 3.524 24.354 ( -1.243 -9.019 -14.061) 16.751 ======================= Grid point 27 (20/146) ======================= q-point: ( 0.45 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.915 ( -2.384 22.772 32.160) 39.478 4.292 ( 3.223 42.540 12.758) 44.529 5.597 ( -10.362 -10.522 4.154) 15.341 6.325 ( -17.685 0.433 5.775) 18.609 6.808 ( -11.325 5.643 6.628) 14.284 7.715 ( 20.145 14.030 14.795) 28.663 8.612 ( -2.757 -4.008 6.053) 7.766 8.990 ( 14.211 13.984 3.314) 20.212 9.491 ( 6.914 10.006 -7.459) 14.268 9.729 ( 1.671 6.675 -3.723) 7.823 10.187 ( 11.647 0.895 4.378) 12.474 10.525 ( 12.359 2.540 21.870) 25.249 10.873 ( 7.188 1.215 3.480) 8.078 11.046 ( -2.345 5.592 -5.690) 8.316 11.495 ( 4.862 7.317 -3.328) 9.394 11.777 ( -9.075 -0.600 2.583) 9.454 12.317 ( 3.701 7.250 2.384) 8.482 12.518 ( -1.683 4.587 0.493) 4.911 12.776 ( 2.391 -7.890 -4.517) 9.401 13.341 ( -6.021 1.323 0.819) 6.218 13.522 ( 5.048 -9.237 -7.526) 12.940 13.796 ( -1.040 -5.239 -2.283) 5.809 14.242 ( -4.577 3.952 0.839) 6.106 14.305 ( -11.539 0.333 3.178) 11.973 15.040 ( 0.450 -8.039 -7.661) 11.114 15.297 ( -2.980 -7.357 -0.504) 7.954 15.525 ( -2.574 -0.899 -2.909) 3.987 15.679 ( 1.461 1.668 -9.627) 9.879 16.052 ( -0.555 -7.672 -0.127) 7.693 16.823 ( -0.284 -3.633 -1.279) 3.862 17.121 ( 0.201 -14.454 -1.516) 14.534 17.616 ( -9.946 5.589 5.229) 12.550 17.859 ( -7.924 5.424 6.284) 11.476 18.409 ( -9.698 7.043 -3.923) 12.612 18.741 ( 1.332 -2.778 2.085) 3.721 19.386 ( 5.632 8.860 0.901) 10.537 19.898 ( -3.937 -5.257 6.358) 9.141 20.310 ( -2.259 -5.808 -2.073) 6.568 20.815 ( 0.807 -1.309 -1.913) 2.454 22.490 ( 16.040 0.885 0.503) 16.072 22.959 ( -0.838 0.087 0.639) 1.057 24.180 ( 0.243 -8.165 -10.220) 13.083 ======================= Grid point 28 (21/146) ======================= q-point: ( 0.55 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.992 ( -20.126 2.546 4.974) 20.887 4.804 ( -1.762 36.108 21.847) 42.240 5.474 ( -4.251 2.489 12.432) 13.372 6.096 ( -17.923 6.252 10.156) 21.529 6.736 ( -8.884 5.456 6.660) 12.371 7.932 ( 4.803 -9.882 -11.062) 15.591 8.539 ( -2.568 -6.366 1.494) 7.025 9.279 ( -2.469 15.352 3.545) 15.948 9.524 ( 0.868 -2.600 -17.552) 17.765 9.877 ( 2.232 10.446 3.383) 11.204 10.402 ( 8.398 1.240 4.292) 9.512 10.767 ( -12.589 -11.915 -4.889) 18.009 10.892 ( 10.505 1.944 7.589) 13.105 11.088 ( 4.995 7.032 5.145) 10.043 11.419 ( -3.809 1.006 3.203) 5.078 11.754 ( -1.840 3.330 5.843) 6.972 12.418 ( 2.168 2.918 -0.786) 3.719 12.535 ( -2.937 4.059 -3.551) 6.141 12.716 ( 5.171 -3.580 -0.153) 6.291 13.293 ( -4.460 -6.591 -2.058) 8.220 13.494 ( 7.793 -4.655 -4.924) 10.327 13.787 ( 3.694 -0.666 -1.058) 3.900 14.104 ( -10.558 -0.529 4.997) 11.693 14.274 ( -3.106 6.179 -1.395) 7.055 14.955 ( 1.062 -3.316 -7.884) 8.619 15.234 ( 1.840 -5.740 3.261) 6.854 15.502 ( 0.194 1.903 0.383) 1.951 15.686 ( 5.253 4.666 -6.987) 9.908 16.015 ( 0.939 -5.227 4.233) 6.791 16.808 ( 1.725 -2.840 -1.693) 3.729 17.004 ( 4.449 -11.958 -4.065) 13.391 17.544 ( -8.250 2.847 9.407) 12.832 17.830 ( -10.650 11.521 1.355) 15.748 18.334 ( -7.901 11.068 -1.300) 13.661 18.743 ( 4.969 -9.773 1.892) 11.125 19.521 ( 0.911 6.419 0.909) 6.547 19.806 ( -6.275 -4.206 0.656) 7.582 20.266 ( 3.455 -2.277 2.985) 5.102 20.812 ( 0.925 -0.157 -1.343) 1.638 22.684 ( 12.697 -8.843 -5.244) 16.337 22.919 ( -6.577 5.365 -0.045) 8.488 24.118 ( 6.458 -5.339 -3.837) 9.216 ======================= Grid point 29 (22/146) ======================= q-point: (-0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.490 ( -34.726 -8.835 -4.307) 36.090 4.934 ( -33.283 21.094 15.363) 42.294 5.694 ( 9.051 13.882 16.257) 23.215 6.105 ( -1.219 9.684 14.461) 17.446 6.714 ( -4.938 4.718 5.883) 9.014 7.595 ( -13.968 -18.210 -25.576) 34.363 8.453 ( -0.991 -6.204 -0.895) 6.346 9.186 ( -19.667 -2.250 -6.393) 20.802 9.340 ( -4.216 -2.537 -13.684) 14.542 9.892 ( -10.105 7.748 0.748) 12.755 10.288 ( -12.687 -2.624 -2.493) 13.193 10.526 ( -3.347 -7.297 3.473) 8.747 10.949 ( -4.093 2.678 -3.995) 6.315 11.147 ( -2.700 -8.205 3.214) 9.216 11.706 ( -3.572 1.710 4.908) 6.307 11.860 ( 17.127 11.875 18.903) 28.137 12.341 ( -8.835 -0.921 -3.771) 9.650 12.489 ( -2.107 4.701 -2.930) 5.926 12.879 ( 6.106 -2.925 -0.746) 6.811 13.107 ( 1.618 -4.233 -3.842) 5.941 13.556 ( 8.621 -4.951 -3.648) 10.590 13.856 ( 2.760 5.854 -2.678) 7.004 14.054 ( 0.945 -2.379 8.924) 9.284 14.250 ( -5.947 5.930 -1.795) 8.588 14.904 ( 3.225 -2.801 -8.020) 9.087 15.281 ( 7.195 -3.244 2.535) 8.290 15.556 ( 0.921 3.260 2.428) 4.168 15.873 ( 11.857 8.323 -1.678) 14.584 16.039 ( 6.082 -6.432 6.477) 10.969 16.782 ( 2.194 -3.139 -3.138) 4.951 17.021 ( 8.764 -5.039 -2.862) 10.507 17.532 ( -5.951 4.886 8.631) 11.567 17.737 ( -9.386 5.185 -1.433) 10.818 18.343 ( -5.154 14.593 -0.221) 15.478 18.750 ( 7.025 -12.707 1.964) 14.652 19.542 ( -3.504 0.816 -0.806) 3.687 19.657 ( -4.719 -2.354 -1.707) 5.543 20.394 ( 5.307 3.959 5.931) 8.889 20.823 ( 1.452 -0.036 -0.908) 1.713 22.610 ( -3.944 -9.849 -7.772) 13.152 22.902 ( -1.260 3.477 -0.596) 3.746 24.237 ( 12.970 -1.971 0.806) 13.144 ======================= Grid point 30 (23/146) ======================= q-point: (-0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.768 ( -40.266 -8.627 -4.279) 41.402 4.490 ( -48.783 13.115 9.855) 51.467 5.975 ( -6.400 0.857 9.027) 11.099 6.275 ( 4.469 5.440 3.567) 7.892 6.723 ( -3.086 1.818 3.042) 4.699 6.984 ( -21.827 -4.897 -12.579) 25.664 8.384 ( 0.180 -4.734 -2.280) 5.258 8.699 ( -18.691 -8.312 -11.473) 23.454 9.174 ( -4.394 -3.717 -6.003) 8.316 9.840 ( -10.928 13.011 5.063) 17.730 10.130 ( -10.432 3.077 -0.961) 10.918 10.326 ( -11.023 -12.928 -0.416) 16.995 10.815 ( -9.981 -0.416 -3.130) 10.469 11.049 ( -2.265 -5.029 2.119) 5.908 11.582 ( -12.486 0.225 3.364) 12.934 11.968 ( -15.307 0.075 0.294) 15.310 12.123 ( -20.190 0.063 -2.250) 20.315 12.531 ( -5.036 -4.446 -0.478) 6.735 12.871 ( 11.177 4.506 3.323) 12.501 13.289 ( 11.884 -1.164 -3.198) 12.362 13.737 ( 17.561 3.330 2.673) 18.072 13.970 ( 4.680 5.920 -3.482) 8.311 14.069 ( -3.221 -3.179 4.686) 6.515 14.265 ( 7.534 4.226 3.298) 9.247 14.937 ( 10.947 -3.614 -6.446) 13.208 15.430 ( 11.109 -0.710 1.180) 11.194 15.575 ( -2.149 0.713 0.715) 2.374 16.033 ( 4.608 0.419 1.479) 4.857 16.294 ( 21.089 1.485 5.458) 21.835 16.820 ( 4.676 1.380 -0.924) 4.962 17.094 ( 5.548 -2.464 -1.881) 6.356 17.526 ( -2.887 4.411 -0.526) 5.298 17.667 ( -1.219 -0.774 1.952) 2.428 18.438 ( -1.100 16.293 0.400) 16.335 18.737 ( 5.161 -14.437 1.213) 15.380 19.440 ( -4.487 -2.006 -0.433) 4.934 19.627 ( 0.339 1.234 -1.412) 1.906 20.512 ( -0.062 3.719 3.385) 5.029 20.847 ( 2.566 -0.520 -0.439) 2.655 22.363 ( -12.471 -4.381 -4.192) 13.866 22.901 ( 0.079 -0.266 -1.330) 1.358 24.466 ( 14.968 -0.332 1.595) 15.057 ======================= Grid point 31 (24/146) ======================= q-point: (-0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.052 ( -40.819 0.000 0.000) 40.819 3.767 ( -54.541 0.000 0.000) 54.541 5.357 ( -59.093 0.000 0.000) 59.093 6.444 ( 9.079 -0.000 -0.000) 9.079 6.693 ( -0.860 0.000 0.000) 0.860 6.833 ( -0.966 0.000 0.000) 0.966 8.370 ( 3.466 -0.000 -0.000) 3.466 8.454 ( -2.465 0.000 0.000) 2.465 9.076 ( -3.300 0.000 0.000) 3.300 9.728 ( -17.252 0.000 0.000) 17.252 9.989 ( -15.039 0.000 0.000) 15.039 9.999 ( -10.468 0.000 0.000) 10.468 10.639 ( -9.822 0.000 0.000) 9.822 10.998 ( -3.008 0.000 0.000) 3.008 11.379 ( -14.820 0.000 0.000) 14.820 11.649 ( -22.918 0.000 0.000) 22.918 11.713 ( -25.229 0.000 0.000) 25.229 12.366 ( -8.677 0.000 0.000) 8.677 13.047 ( 0.102 -0.000 -0.000) 0.102 13.387 ( 5.332 -0.000 -0.000) 5.332 13.838 ( -8.679 0.000 0.000) 8.679 14.031 ( 11.225 -0.000 -0.000) 11.225 14.236 ( 11.072 -0.000 -0.000) 11.072 14.613 ( 28.088 -0.000 -0.000) 28.088 15.108 ( 15.869 -0.000 -0.000) 15.869 15.531 ( -3.144 0.000 0.000) 3.144 15.612 ( 12.160 -0.000 -0.000) 12.160 16.129 ( 6.972 -0.000 -0.000) 6.972 16.672 ( 18.858 -0.000 -0.000) 18.858 16.878 ( 2.412 -0.000 -0.000) 2.412 17.159 ( 7.145 -0.000 -0.000) 7.145 17.563 ( 5.499 -0.000 -0.000) 5.499 17.697 ( 4.340 -0.000 -0.000) 4.340 18.535 ( -3.450 0.000 0.000) 3.450 18.706 ( 4.776 -0.000 -0.000) 4.776 19.391 ( -1.161 0.000 0.000) 1.161 19.643 ( 1.622 -0.000 -0.000) 1.622 20.494 ( -4.684 0.000 0.000) 4.684 20.892 ( 3.299 -0.000 -0.000) 3.299 22.100 ( -16.151 0.000 0.000) 16.151 22.892 ( -0.333 0.000 0.000) 0.333 24.703 ( 13.669 -0.000 -0.000) 13.669 ======================= Grid point 36 (25/146) ======================= q-point: ( 0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.619 ( -0.000 40.838 20.428) 45.662 3.790 ( -0.000 38.947 29.244) 48.704 5.206 ( -0.000 34.884 44.376) 56.445 6.477 ( -0.000 8.944 6.620) 11.128 6.727 ( -0.000 -11.800 2.721) 12.109 7.233 ( -0.000 7.542 10.638) 13.041 8.768 ( -0.000 3.725 9.026) 9.765 8.931 ( 0.000 8.204 -2.209) 8.496 8.986 ( -0.000 6.487 5.430) 8.460 9.567 ( -0.000 -6.183 5.447) 8.240 9.647 ( 0.000 10.186 2.787) 10.560 10.095 ( -0.000 8.326 12.698) 15.185 10.451 ( 0.000 11.285 -1.481) 11.381 11.001 ( 0.000 4.491 -2.894) 5.343 11.209 ( 0.000 23.807 -1.296) 23.843 11.753 ( -0.000 9.686 16.647) 19.260 12.110 ( 0.000 7.865 0.898) 7.916 12.144 ( -0.000 6.853 22.625) 23.640 13.150 ( 0.000 -6.262 -7.483) 9.757 13.183 ( 0.000 7.939 -9.013) 12.011 13.533 ( 0.000 -5.316 -6.494) 8.393 14.219 ( 0.000 -1.596 -4.788) 5.047 14.337 ( -0.000 -5.247 1.535) 5.467 14.803 ( 0.000 -15.534 -5.254) 16.398 15.410 ( 0.000 -10.044 -12.424) 15.976 15.420 ( 0.000 1.755 -3.598) 4.003 15.681 ( 0.000 -5.560 -3.187) 6.409 15.733 ( 0.000 0.048 -8.404) 8.404 16.040 ( 0.000 -20.571 -7.461) 21.882 17.101 ( -0.000 -15.466 -1.738) 15.563 17.211 ( -0.000 -7.227 3.594) 8.071 17.774 ( -0.000 0.844 4.888) 4.961 17.956 ( 0.000 -1.448 -0.804) 1.657 18.626 ( 0.000 6.949 -1.612) 7.134 18.839 ( -0.000 5.482 2.243) 5.923 19.331 ( -0.000 7.716 3.818) 8.609 19.885 ( 0.000 -1.894 -1.878) 2.667 20.366 ( -0.000 -10.368 4.248) 11.205 20.881 ( 0.000 -3.455 -2.851) 4.480 21.940 ( -0.000 6.264 3.770) 7.311 22.889 ( -0.000 -0.609 2.432) 2.507 24.372 ( 0.000 -8.124 -14.901) 16.971 ======================= Grid point 37 (26/146) ======================= q-point: ( 0.36 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.053 ( -4.496 33.492 20.205) 39.372 4.284 ( -2.327 40.972 24.028) 47.555 5.676 ( 4.384 0.204 18.666) 19.175 6.559 ( -3.667 -4.532 5.480) 8.001 6.954 ( 12.781 24.635 22.008) 35.420 7.322 ( -3.415 11.096 13.494) 17.801 8.752 ( -9.156 6.551 1.478) 11.355 8.865 ( -7.950 3.581 6.076) 10.628 9.256 ( 11.925 8.349 -0.353) 14.562 9.614 ( 7.072 -2.775 1.207) 7.692 9.845 ( 9.678 10.943 -1.297) 14.666 10.209 ( -1.436 4.976 18.576) 19.284 10.635 ( 8.206 7.199 4.543) 11.823 11.057 ( 3.746 5.728 -3.899) 7.877 11.365 ( -0.472 14.442 -7.341) 16.208 11.887 ( -1.410 3.784 9.123) 9.976 12.226 ( 0.281 12.627 7.431) 14.654 12.409 ( 8.093 4.733 14.768) 17.493 12.900 ( -10.152 -6.056 -8.237) 14.408 13.233 ( 9.979 -11.186 -9.979) 18.008 13.500 ( -0.407 5.911 -7.339) 9.432 14.058 ( -9.943 -8.578 -4.331) 13.828 14.289 ( -0.195 -1.667 -2.764) 3.233 14.601 ( -3.434 -15.348 -0.659) 15.741 15.179 ( -7.729 -6.280 -11.853) 15.481 15.376 ( -1.712 -4.403 -3.854) 6.097 15.615 ( -2.062 0.227 3.047) 3.686 15.687 ( -2.040 0.204 -4.016) 4.509 15.950 ( 7.233 -7.382 -5.860) 11.881 16.900 ( -4.084 -13.235 -2.681) 14.107 17.138 ( 0.297 -14.398 -0.020) 14.401 17.851 ( -2.925 11.891 6.913) 14.062 17.935 ( -0.314 -2.127 0.940) 2.346 18.658 ( -4.213 7.466 -1.699) 8.739 18.910 ( -2.736 5.922 5.258) 8.379 19.299 ( -7.917 6.110 1.253) 10.079 19.919 ( 5.499 -4.038 -0.717) 6.860 20.311 ( 1.975 -9.373 1.789) 9.744 20.811 ( -1.423 -3.540 -2.854) 4.765 22.043 ( 8.766 -2.775 0.525) 9.210 22.932 ( 1.622 2.999 3.406) 4.820 24.201 ( -0.811 -7.834 -13.561) 15.682 ======================= Grid point 38 (27/146) ======================= q-point: ( 0.45 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.354 ( -5.844 23.575 12.389) 27.266 4.795 ( 0.015 39.730 24.813) 46.842 5.692 ( -5.370 -6.040 11.110) 13.738 6.479 ( -2.531 -7.271 2.674) 8.150 7.113 ( -13.672 8.759 7.054) 17.703 7.771 ( 5.680 15.289 21.668) 27.120 8.724 ( -7.096 -0.309 6.533) 9.651 8.919 ( 10.681 16.883 4.034) 20.382 9.444 ( 5.337 7.806 -8.109) 12.457 9.709 ( 5.632 2.905 -1.538) 6.521 10.068 ( 8.115 8.568 -0.620) 11.817 10.467 ( 11.911 0.876 20.705) 23.903 10.829 ( 4.814 1.965 5.956) 7.906 11.106 ( -0.390 3.860 -6.096) 7.226 11.433 ( 5.822 6.716 -9.843) 13.263 11.896 ( -4.072 -1.070 5.221) 6.707 12.392 ( 0.112 8.848 5.966) 10.672 12.593 ( -3.822 -0.520 1.118) 4.016 12.669 ( 0.438 -2.756 -2.261) 3.591 13.214 ( 10.285 -13.310 -8.926) 19.043 13.454 ( -5.735 1.603 -5.321) 7.985 13.801 ( -8.298 -6.639 0.069) 10.627 14.265 ( 0.442 1.121 -5.994) 6.114 14.440 ( -3.790 -7.634 2.763) 8.960 14.969 ( -3.505 -4.125 -5.360) 7.618 15.282 ( -2.615 -4.132 -0.865) 4.966 15.547 ( -4.736 -2.384 -3.791) 6.518 15.678 ( -1.170 6.288 -1.345) 6.536 15.997 ( 3.394 0.645 0.109) 3.456 16.735 ( 0.142 -10.102 -3.561) 10.712 16.972 ( -0.879 -17.551 -1.515) 17.639 17.826 ( -6.613 -2.498 4.021) 8.133 18.050 ( -1.738 17.504 6.105) 18.619 18.563 ( -11.649 3.818 -1.698) 12.375 18.895 ( -9.000 5.940 4.090) 11.533 19.370 ( 6.613 7.770 2.122) 10.421 19.913 ( -0.514 -5.470 1.575) 5.716 20.249 ( -0.039 -9.467 -1.062) 9.526 20.766 ( 1.410 -1.969 -2.114) 3.215 22.168 ( 15.451 -9.803 -4.037) 18.738 23.028 ( 0.362 7.620 4.644) 8.931 24.034 ( -0.457 -7.964 -10.876) 13.488 ======================= Grid point 39 (28/146) ======================= q-point: ( 0.55 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.364 ( -17.607 6.572 1.134) 18.828 5.320 ( 0.050 37.187 23.879) 44.194 5.665 ( -4.631 2.494 15.439) 16.310 6.377 ( -6.216 -3.408 3.784) 8.036 6.995 ( -12.025 4.488 4.217) 13.510 7.803 ( -9.062 -6.506 -2.325) 11.395 8.588 ( -8.129 -3.489 0.906) 8.892 9.301 ( 6.841 1.459 -4.128) 8.122 9.511 ( 0.663 12.275 -2.912) 12.633 9.918 ( 8.974 14.363 1.976) 17.050 10.307 ( 11.902 7.989 7.436) 16.149 10.742 ( 7.516 -5.663 10.399) 14.025 10.843 ( -1.652 -1.800 -4.847) 5.428 11.130 ( 1.369 4.251 2.919) 5.335 11.460 ( -0.530 -0.154 -6.349) 6.373 11.864 ( -2.688 1.492 7.536) 8.139 12.407 ( -2.762 -1.287 0.311) 3.062 12.515 ( 3.286 1.075 -2.493) 4.262 12.705 ( -1.426 1.675 -1.963) 2.948 13.201 ( 6.826 -9.714 -8.766) 14.758 13.322 ( -2.956 -8.299 1.672) 8.967 13.707 ( 1.465 -1.276 -1.091) 2.228 14.215 ( -1.664 1.824 -10.164) 10.460 14.378 ( -4.821 -1.985 9.335) 10.692 14.916 ( -0.243 1.516 -3.690) 3.997 15.217 ( -2.404 -1.985 2.916) 4.269 15.490 ( 2.893 1.589 -2.923) 4.409 15.685 ( -3.371 5.485 -1.583) 6.630 16.030 ( -1.758 1.575 1.972) 3.076 16.682 ( 4.634 -8.908 -0.265) 10.045 16.805 ( 2.263 -13.276 -5.040) 14.380 17.732 ( -5.965 -1.673 7.297) 9.572 18.140 ( -10.812 15.038 -2.037) 18.633 18.446 ( -3.994 4.037 0.904) 5.750 18.797 ( -10.512 1.179 4.441) 11.472 19.563 ( 3.630 6.579 2.694) 7.982 19.840 ( -3.715 -4.192 -1.939) 5.927 20.181 ( 4.344 -6.274 2.523) 8.037 20.777 ( 2.031 -0.456 -1.359) 2.486 22.294 ( 16.946 -11.778 -6.999) 21.792 23.107 ( -5.035 9.198 3.940) 11.202 23.934 ( 4.803 -6.978 -6.183) 10.488 ======================= Grid point 40 (29/146) ======================= q-point: (-0.36 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.966 ( -32.012 -1.985 -1.737) 32.121 5.589 ( -15.297 13.869 8.171) 22.206 5.847 ( 2.498 16.692 16.197) 23.393 6.317 ( -4.528 1.703 11.312) 12.303 6.888 ( -7.225 1.681 2.630) 7.870 7.443 ( -12.561 -14.347 -17.396) 25.812 8.458 ( -4.641 -2.314 -0.399) 5.201 9.213 ( -3.315 -4.614 -9.512) 11.080 9.545 ( -11.720 5.479 1.235) 12.997 10.074 ( -1.921 7.599 0.419) 7.850 10.452 ( -17.287 -3.003 -3.470) 17.886 10.578 ( -1.721 -0.513 5.557) 5.840 10.941 ( 5.286 0.031 0.007) 5.286 11.169 ( -2.606 -2.201 -0.240) 3.419 11.593 ( 16.720 3.771 4.758) 17.788 11.956 ( 1.999 8.056 12.515) 15.017 12.347 ( -1.292 -4.221 -5.744) 7.244 12.556 ( 0.369 3.027 -3.950) 4.990 12.740 ( 7.282 1.080 1.058) 7.438 13.060 ( -5.596 -8.216 -3.573) 10.563 13.311 ( 8.830 -6.757 -1.763) 11.258 13.786 ( 7.312 0.711 -0.915) 7.404 14.137 ( -4.622 2.290 -3.781) 6.396 14.333 ( -4.010 -0.526 4.487) 6.040 14.895 ( -2.710 2.050 -3.290) 4.730 15.196 ( 0.419 -1.996 1.845) 2.750 15.583 ( 2.603 3.142 1.991) 4.540 15.738 ( 8.635 4.225 -1.187) 9.686 16.011 ( -2.159 0.089 1.649) 2.718 16.640 ( 3.596 -9.420 -1.136) 10.147 16.821 ( 9.734 -2.236 -2.819) 10.378 17.714 ( -3.299 0.629 9.205) 9.798 17.979 ( -15.642 6.925 -7.047) 18.501 18.476 ( -0.371 4.069 0.508) 4.117 18.675 ( -6.347 -1.838 3.629) 7.539 19.601 ( -3.662 0.456 0.202) 3.696 19.700 ( -5.186 -2.731 -2.089) 6.222 20.332 ( 10.594 1.755 4.375) 11.595 20.794 ( 1.301 -0.146 -0.879) 1.577 22.391 ( 11.459 -7.859 -5.596) 14.980 23.064 ( -9.984 4.770 1.265) 11.137 24.006 ( 12.439 -2.827 -1.215) 12.814 ======================= Grid point 41 (30/146) ======================= q-point: (-0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.365 ( -39.486 0.000 0.000) 39.486 5.269 ( -35.326 0.000 0.000) 35.326 6.044 ( 4.677 -0.000 -0.000) 4.677 6.328 ( -4.282 0.000 0.000) 4.282 6.819 ( -5.493 0.000 0.000) 5.493 7.103 ( -9.148 0.000 0.000) 9.148 8.386 ( -3.010 0.000 0.000) 3.010 9.005 ( -20.635 0.000 0.000) 20.635 9.261 ( -15.630 0.000 0.000) 15.630 10.087 ( -4.210 0.000 0.000) 4.210 10.191 ( -8.066 0.000 0.000) 8.066 10.492 ( -11.218 0.000 0.000) 11.218 10.940 ( -5.470 0.000 0.000) 5.470 11.074 ( -4.203 0.000 0.000) 4.203 11.738 ( -3.612 0.000 0.000) 3.612 12.113 ( -2.477 0.000 0.000) 2.477 12.340 ( 0.968 -0.000 -0.000) 0.968 12.549 ( 0.366 -0.000 -0.000) 0.366 12.768 ( -1.730 0.000 0.000) 1.730 13.075 ( 13.147 -0.000 -0.000) 13.147 13.456 ( 15.661 -0.000 -0.000) 15.661 13.873 ( 3.924 -0.000 -0.000) 3.924 14.106 ( 1.586 -0.000 -0.000) 1.586 14.293 ( -4.428 0.000 0.000) 4.428 14.831 ( -1.777 0.000 0.000) 1.777 15.265 ( 8.627 -0.000 -0.000) 8.627 15.617 ( -1.085 0.000 0.000) 1.085 15.973 ( 12.462 -0.000 -0.000) 12.462 16.015 ( 6.785 -0.000 -0.000) 6.785 16.688 ( 8.223 -0.000 -0.000) 8.223 16.962 ( 9.303 -0.000 -0.000) 9.303 17.701 ( -6.769 0.000 0.000) 6.769 17.731 ( -11.914 0.000 0.000) 11.914 18.516 ( 2.595 -0.000 -0.000) 2.595 18.614 ( -0.995 0.000 0.000) 0.995 19.504 ( -5.798 0.000 0.000) 5.798 19.641 ( -1.662 0.000 0.000) 1.662 20.502 ( 6.040 -0.000 -0.000) 6.040 20.809 ( 1.427 -0.000 -0.000) 1.427 22.432 ( -0.199 0.000 0.000) 0.199 22.944 ( -6.359 0.000 0.000) 6.359 24.222 ( 15.428 -0.000 -0.000) 15.428 ======================= Grid point 48 (31/146) ======================= q-point: ( 0.36 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.466 ( 0.000 29.456 6.862) 30.244 4.769 ( -0.000 31.203 20.831) 37.518 5.773 ( -0.000 -2.905 18.374) 18.602 6.517 ( -0.000 -14.047 2.481) 14.264 7.369 ( -0.000 41.821 38.529) 56.864 7.505 ( -0.000 8.927 6.880) 11.270 8.899 ( 0.000 1.179 -2.801) 3.039 9.050 ( 0.000 7.525 -2.790) 8.026 9.233 ( -0.000 13.669 10.780) 17.408 9.469 ( -0.000 -10.232 3.567) 10.836 9.901 ( 0.000 17.326 -2.842) 17.558 10.395 ( -0.000 0.642 18.604) 18.615 10.640 ( -0.000 8.072 2.792) 8.542 11.034 ( 0.000 4.226 -4.460) 6.144 11.371 ( 0.000 -0.202 -18.136) 18.137 11.965 ( -0.000 1.295 5.087) 5.250 12.431 ( -0.000 12.176 9.342) 15.347 12.448 ( -0.000 2.774 13.261) 13.548 12.914 ( 0.000 -14.098 -7.827) 16.125 12.941 ( 0.000 -2.215 -8.084) 8.382 13.519 ( 0.000 6.005 -7.955) 9.968 14.077 ( 0.000 -2.442 -3.316) 4.118 14.222 ( -0.000 -6.449 -0.759) 6.494 14.449 ( -0.000 -16.700 -0.993) 16.730 15.094 ( 0.000 -4.336 -17.111) 17.652 15.345 ( 0.000 -3.811 -3.578) 5.227 15.669 ( -0.000 -9.142 7.228) 11.654 15.698 ( -0.000 5.506 2.885) 6.216 15.844 ( 0.000 7.557 -3.911) 8.509 16.782 ( -0.000 -15.275 -2.893) 15.547 16.974 ( -0.000 -17.287 -2.862) 17.522 17.936 ( 0.000 0.027 -0.208) 0.210 18.076 ( -0.000 19.994 9.382) 22.086 18.769 ( 0.000 10.985 -0.523) 10.997 19.010 ( -0.000 2.313 9.963) 10.228 19.488 ( -0.000 4.999 2.297) 5.502 19.745 ( 0.000 -3.879 -10.781) 11.458 20.215 ( -0.000 -11.896 4.016) 12.555 20.772 ( 0.000 -3.891 -2.808) 4.798 21.896 ( -0.000 -11.140 -2.664) 11.454 22.993 ( -0.000 7.223 4.981) 8.774 24.060 ( 0.000 -6.700 -11.882) 13.641 ======================= Grid point 49 (32/146) ======================= q-point: ( 0.45 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.675 ( -4.499 17.945 1.485) 18.560 5.204 ( 6.043 27.941 16.896) 33.207 5.827 ( -4.230 -0.769 15.765) 16.341 6.400 ( -0.153 -12.761 1.292) 12.827 7.478 ( -14.548 8.988 5.483) 17.958 8.037 ( 2.849 20.310 28.645) 35.229 8.832 ( -2.079 5.157 2.215) 5.985 9.072 ( -5.818 11.114 -0.853) 12.574 9.354 ( 4.926 0.898 -1.818) 5.327 9.617 ( 10.330 7.000 6.822) 14.221 10.075 ( 4.036 15.355 -3.158) 16.188 10.483 ( 1.512 -1.551 16.447) 16.589 10.792 ( 4.842 1.505 2.061) 5.474 11.033 ( 2.166 -3.686 -7.906) 8.988 11.240 ( 9.822 -5.365 -17.173) 20.498 11.977 ( -3.098 0.444 3.853) 4.964 12.487 ( -2.607 -0.509 2.613) 3.726 12.594 ( 3.426 -0.220 4.901) 5.983 12.748 ( -5.237 0.398 0.504) 5.276 12.940 ( 4.044 -0.949 -5.433) 6.839 13.471 ( -2.522 -1.608 -8.545) 9.053 13.938 ( -11.911 -2.058 1.762) 12.215 14.204 ( 2.335 -3.040 -1.446) 4.097 14.361 ( 3.547 -7.736 0.659) 8.535 14.939 ( -1.536 -1.653 -11.213) 11.437 15.278 ( -0.808 -2.773 -1.541) 3.273 15.582 ( -5.083 -6.650 1.657) 8.533 15.772 ( -0.824 7.834 2.573) 8.287 15.978 ( 4.793 9.831 1.211) 11.004 16.612 ( -1.177 -12.024 -4.050) 12.742 16.793 ( 0.328 -19.007 -2.610) 19.189 17.892 ( -4.613 -0.868 0.589) 4.730 18.328 ( -2.017 21.931 8.093) 23.463 18.811 ( -9.845 7.823 1.469) 12.660 19.060 ( -2.953 -1.066 9.638) 10.136 19.395 ( -3.917 6.432 -4.451) 8.748 19.805 ( 8.899 -2.524 -5.278) 10.650 20.139 ( 1.132 -11.818 2.640) 12.162 20.719 ( 0.103 -2.603 -1.959) 3.259 21.827 ( 8.966 -12.965 -4.923) 16.514 23.121 ( 1.907 8.821 5.748) 10.700 23.918 ( -1.517 -6.515 -9.536) 11.648 ======================= Grid point 50 (33/146) ======================= q-point: ( 0.55 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.660 ( -11.761 5.697 -0.823) 13.094 5.672 ( 8.558 22.841 10.693) 26.632 5.866 ( -3.525 5.173 16.040) 17.219 6.289 ( 1.815 -13.021 -3.778) 13.679 7.283 ( -18.295 3.075 1.108) 18.585 8.058 ( -18.519 1.082 6.469) 19.646 8.744 ( -13.684 -1.319 0.812) 13.771 9.200 ( 4.472 0.859 -0.500) 4.581 9.515 ( 9.610 7.226 -0.997) 12.065 9.927 ( 10.008 19.361 4.843) 22.326 10.279 ( 8.248 8.231 7.034) 13.611 10.635 ( 7.897 -3.676 8.103) 11.897 10.729 ( 4.088 -7.845 -11.797) 14.745 11.092 ( 6.452 -3.172 1.044) 7.265 11.332 ( 10.388 0.051 -6.841) 12.438 11.945 ( -2.749 0.296 3.422) 4.399 12.412 ( -2.813 -4.135 -1.040) 5.108 12.585 ( -3.491 -2.103 2.592) 4.830 12.694 ( -4.752 2.569 -3.394) 6.379 13.019 ( 7.332 2.040 -0.372) 7.620 13.316 ( -5.868 -6.361 -4.497) 9.753 13.755 ( -8.793 -1.164 1.089) 8.937 14.175 ( -0.740 -1.669 -4.034) 4.428 14.402 ( 4.306 -1.636 3.650) 5.877 14.908 ( 1.207 1.873 -3.807) 4.411 15.268 ( -0.094 -0.199 2.710) 2.719 15.452 ( -2.783 -1.870 -2.428) 4.140 15.816 ( -4.527 5.707 1.302) 7.400 16.111 ( -1.270 7.672 1.236) 7.874 16.524 ( 4.578 -7.319 -1.556) 8.772 16.621 ( 1.255 -13.889 -2.826) 14.229 17.810 ( -4.258 -1.398 1.336) 4.677 18.421 ( -11.698 9.365 1.869) 15.101 18.660 ( -12.330 7.277 1.363) 14.382 18.996 ( -8.900 -1.638 4.228) 9.988 19.532 ( 9.418 6.563 0.045) 11.479 19.828 ( 0.143 -1.654 -2.668) 3.143 20.069 ( 1.846 -8.229 1.725) 8.608 20.723 ( 2.987 -0.610 -0.775) 3.146 21.893 ( 15.481 -8.312 -4.368) 18.106 23.260 ( 0.179 7.468 4.559) 8.751 23.788 ( 0.091 -5.812 -5.910) 8.290 ======================= Grid point 51 (34/146) ======================= q-point: (-0.36 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.400 ( -22.961 0.000 0.000) 22.961 5.794 ( -3.639 0.000 0.000) 3.639 6.059 ( -4.960 0.000 0.000) 4.960 6.258 ( 13.378 -0.000 -0.000) 13.378 7.028 ( -13.291 0.000 0.000) 13.291 7.691 ( -26.904 0.000 0.000) 26.904 8.548 ( -8.659 0.000 0.000) 8.659 9.199 ( -1.244 0.000 0.000) 1.244 9.639 ( 2.413 -0.000 -0.000) 2.413 10.132 ( 0.877 -0.000 -0.000) 0.877 10.548 ( 7.806 -0.000 -0.000) 7.806 10.695 ( -7.009 0.000 0.000) 7.009 10.780 ( 13.702 -0.000 -0.000) 13.702 11.115 ( 3.429 -0.000 -0.000) 3.429 11.448 ( 6.406 -0.000 -0.000) 6.406 11.976 ( 3.940 -0.000 -0.000) 3.940 12.331 ( -2.667 0.000 0.000) 2.667 12.540 ( -2.736 0.000 0.000) 2.736 12.663 ( 3.737 -0.000 -0.000) 3.737 13.135 ( -7.468 0.000 0.000) 7.468 13.160 ( 5.726 -0.000 -0.000) 5.726 13.694 ( 2.026 -0.000 -0.000) 2.026 14.145 ( 0.167 -0.000 -0.000) 0.167 14.439 ( -3.045 0.000 0.000) 3.045 14.903 ( -0.326 0.000 0.000) 0.326 15.241 ( -3.731 0.000 0.000) 3.731 15.506 ( 8.293 -0.000 -0.000) 8.293 15.743 ( -6.107 0.000 0.000) 6.107 16.088 ( -5.043 0.000 0.000) 5.043 16.537 ( 2.551 -0.000 -0.000) 2.551 16.645 ( 9.067 -0.000 -0.000) 9.067 17.766 ( -1.300 0.000 0.000) 1.300 18.228 ( -14.589 0.000 0.000) 14.589 18.564 ( -7.190 0.000 0.000) 7.190 18.835 ( -10.972 0.000 0.000) 10.972 19.646 ( 0.292 -0.000 -0.000) 0.292 19.760 ( -5.217 0.000 0.000) 5.217 20.158 ( 11.958 -0.000 -0.000) 11.958 20.764 ( 2.253 -0.000 -0.000) 2.253 22.102 ( 16.640 -0.000 -0.000) 16.640 23.250 ( -8.046 0.000 0.000) 8.046 23.807 ( 8.615 -0.000 -0.000) 8.615 ======================= Grid point 60 (35/146) ======================= q-point: ( 0.45 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.834 ( 0.000 8.539 -1.283) 8.635 5.415 ( -0.000 15.816 8.210) 17.820 5.955 ( -0.000 1.247 10.194) 10.270 6.303 ( -0.000 -9.694 0.724) 9.721 7.700 ( -0.000 4.532 2.360) 5.109 8.351 ( -0.000 8.830 19.360) 21.278 8.951 ( 0.000 13.481 0.790) 13.505 9.127 ( 0.000 4.839 -3.099) 5.747 9.328 ( -0.000 -7.623 2.668) 8.076 9.727 ( -0.000 22.667 15.235) 27.311 10.157 ( 0.000 10.594 -4.652) 11.571 10.524 ( -0.000 -6.702 8.387) 10.736 10.750 ( 0.000 -24.801 -24.656) 34.972 10.793 ( -0.000 2.821 3.556) 4.539 11.039 ( 0.000 2.380 -3.841) 4.518 12.039 ( -0.000 1.388 2.531) 2.886 12.502 ( 0.000 -4.041 -1.731) 4.396 12.530 ( -0.000 -4.582 -1.376) 4.784 12.769 ( -0.000 2.154 4.642) 5.117 13.011 ( 0.000 7.659 1.460) 7.797 13.419 ( 0.000 -2.724 -6.211) 6.782 14.102 ( -0.000 1.819 1.425) 2.311 14.123 ( -0.000 -2.841 -0.299) 2.857 14.265 ( -0.000 -4.144 2.072) 4.633 14.860 ( 0.000 -0.997 -9.179) 9.233 15.238 ( 0.000 -2.684 -1.728) 3.192 15.587 ( -0.000 -4.780 2.435) 5.364 15.865 ( -0.000 5.821 2.809) 6.464 16.044 ( 0.000 11.077 1.143) 11.136 16.506 ( -0.000 -8.838 -2.413) 9.161 16.610 ( -0.000 -14.528 -2.820) 14.799 17.943 ( -0.000 0.347 0.135) 0.372 18.578 ( 0.000 17.809 4.936) 18.480 18.957 ( 0.000 6.264 1.200) 6.378 19.147 ( -0.000 -6.120 14.585) 15.817 19.520 ( 0.000 2.506 -17.210) 17.392 19.570 ( -0.000 1.741 0.716) 1.883 20.050 ( -0.000 -9.370 3.158) 9.888 20.688 ( 0.000 -1.797 -1.212) 2.168 21.621 ( 0.000 -8.876 -3.356) 9.489 23.206 ( -0.000 6.096 4.235) 7.423 23.832 ( 0.000 -4.254 -5.980) 7.339 ======================= Grid point 61 (36/146) ======================= q-point: (-0.45 -0.55 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.823 ( -5.586 0.000 0.000) 5.586 5.621 ( 11.745 -0.000 -0.000) 11.745 5.983 ( -1.303 0.000 0.000) 1.303 6.228 ( -3.336 0.000 0.000) 3.336 7.593 ( -15.537 0.000 0.000) 15.537 8.340 ( -11.433 0.000 0.000) 11.433 8.966 ( -9.368 0.000 0.000) 9.368 9.181 ( -2.384 0.000 0.000) 2.384 9.344 ( 13.077 -0.000 -0.000) 13.077 10.034 ( -3.056 0.000 0.000) 3.056 10.166 ( 13.465 -0.000 -0.000) 13.465 10.501 ( 2.193 -0.000 -0.000) 2.193 10.571 ( 4.002 -0.000 -0.000) 4.002 10.926 ( 10.789 -0.000 -0.000) 10.789 11.127 ( 10.279 -0.000 -0.000) 10.279 12.016 ( -4.065 0.000 0.000) 4.065 12.440 ( -2.793 0.000 0.000) 2.793 12.537 ( 2.819 -0.000 -0.000) 2.819 12.818 ( -0.529 0.000 0.000) 0.529 12.996 ( -4.193 0.000 0.000) 4.193 13.352 ( -3.840 0.000 0.000) 3.840 13.939 ( -12.938 0.000 0.000) 12.938 14.160 ( 0.766 -0.000 -0.000) 0.766 14.318 ( 5.450 -0.000 -0.000) 5.450 14.856 ( 3.491 -0.000 -0.000) 3.491 15.239 ( 2.301 -0.000 -0.000) 2.301 15.522 ( -5.792 0.000 0.000) 5.792 15.895 ( -1.094 0.000 0.000) 1.094 16.159 ( 3.823 -0.000 -0.000) 3.823 16.430 ( -0.830 0.000 0.000) 0.830 16.528 ( 0.229 -0.000 -0.000) 0.229 17.891 ( -5.529 0.000 0.000) 5.529 18.645 ( -6.142 0.000 0.000) 6.142 18.930 ( -14.175 0.000 0.000) 14.175 19.072 ( -2.205 0.000 0.000) 2.205 19.435 ( 3.298 -0.000 -0.000) 3.298 19.745 ( 9.262 -0.000 -0.000) 9.262 20.017 ( 0.451 -0.000 -0.000) 0.451 20.680 ( 1.101 -0.000 -0.000) 1.101 21.639 ( 8.896 -0.000 -0.000) 8.896 23.278 ( 2.963 -0.000 -0.000) 2.963 23.767 ( -2.580 0.000 0.000) 2.580 ======================= Grid point 135 (37/146) ======================= q-point: ( 0.09 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 146 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.956 ( -0.000 0.000 49.062) 49.062 0.956 ( -0.000 0.000 49.062) 49.062 1.967 ( -0.000 0.000 100.924) 100.924 6.728 ( -0.000 0.000 6.729) 6.729 6.728 ( -0.000 0.000 6.729) 6.729 6.952 ( -0.000 0.000 0.136) 0.136 8.883 ( 0.000 -0.000 -6.525) 6.525 8.883 ( 0.000 -0.000 -6.525) 6.525 9.011 ( -0.000 0.000 0.348) 0.348 9.363 ( -0.000 0.000 2.090) 2.090 9.363 ( -0.000 0.000 2.090) 2.090 9.468 ( -0.000 0.000 20.325) 20.325 10.013 ( -0.000 0.000 0.714) 0.714 10.013 ( -0.000 0.000 0.714) 0.714 10.852 ( -0.000 0.000 3.543) 3.543 11.207 ( -0.000 0.000 14.501) 14.501 11.207 ( -0.000 0.000 14.501) 14.501 12.081 ( -0.000 0.000 5.040) 5.040 12.081 ( -0.000 0.000 5.040) 5.040 13.489 ( -0.000 0.000 1.501) 1.501 13.489 ( -0.000 0.000 1.501) 1.501 14.297 ( -0.000 0.000 1.606) 1.606 14.297 ( -0.000 0.000 1.606) 1.606 15.156 ( 0.000 -0.000 -13.979) 13.979 15.360 ( 0.000 -0.000 -1.635) 1.635 16.105 ( 0.000 -0.000 -27.600) 27.600 16.345 ( 0.000 -0.000 -9.193) 9.193 16.345 ( 0.000 -0.000 -9.193) 9.193 17.232 ( -0.000 0.000 5.258) 5.258 17.633 ( 0.000 -0.000 -3.674) 3.674 17.633 ( 0.000 -0.000 -3.674) 3.674 18.051 ( -0.000 0.000 0.711) 0.711 18.051 ( -0.000 0.000 0.711) 0.711 18.532 ( 0.000 -0.000 -13.125) 13.125 18.811 ( -0.000 0.000 0.710) 0.710 18.811 ( -0.000 0.000 0.710) 0.710 19.461 ( -0.000 0.000 16.766) 16.766 20.995 ( 0.000 -0.000 -1.677) 1.677 20.995 ( 0.000 -0.000 -1.677) 1.677 21.041 ( -0.000 0.000 7.220) 7.220 22.714 ( -0.000 0.000 4.552) 4.552 24.863 ( 0.000 -0.000 -3.295) 3.295 ======================= Grid point 136 (38/146) ======================= q-point: ( 0.18 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.266 ( 16.624 9.598 35.794) 40.617 1.779 ( 17.482 10.093 54.801) 58.401 3.083 ( 47.036 27.156 76.249) 93.615 6.662 ( -5.949 -3.434 4.953) 8.468 6.823 ( -0.574 -0.331 7.775) 7.803 6.956 ( -0.651 -0.376 0.505) 0.906 8.725 ( -4.725 -2.728 -5.943) 8.068 8.802 ( -3.254 -1.879 -6.647) 7.636 9.050 ( 1.632 0.942 6.175) 6.456 9.297 ( 0.293 0.169 -1.703) 1.736 9.466 ( -1.987 -1.147 19.134) 19.271 9.633 ( 9.605 5.545 9.901) 14.867 10.147 ( 7.859 4.538 3.756) 9.822 10.234 ( 18.305 10.569 0.911) 21.157 10.892 ( 1.415 0.817 4.196) 4.503 11.246 ( -2.518 -1.453 15.720) 15.986 11.462 ( 8.941 5.162 19.995) 22.503 12.230 ( 10.100 5.831 -2.868) 12.010 12.231 ( 6.301 3.638 7.721) 10.609 13.552 ( 6.582 3.800 -10.049) 12.600 13.591 ( 4.240 2.448 5.748) 7.551 14.232 ( -4.195 -2.422 -0.747) 4.901 14.320 ( -1.513 -0.873 2.636) 3.162 15.094 ( 1.637 0.945 -20.018) 20.107 15.363 ( 1.361 0.786 -2.143) 2.657 15.911 ( -7.061 -4.077 -20.329) 21.903 16.018 ( -14.607 -8.433 -16.852) 23.843 16.294 ( -2.183 -1.260 -8.800) 9.154 17.003 ( -15.249 -8.804 6.221) 18.675 17.502 ( -8.884 -5.129 -4.685) 11.277 17.647 ( -0.980 -0.566 -1.330) 1.746 17.968 ( -5.143 -2.969 -1.778) 6.199 18.035 ( -3.014 -1.740 3.976) 5.284 18.404 ( -3.724 -2.150 2.726) 5.092 18.817 ( 1.689 0.975 -7.254) 7.511 18.817 ( 2.545 1.469 -1.754) 3.422 19.762 ( 10.494 6.059 8.318) 14.698 20.725 ( -13.337 -7.700 5.365) 16.308 20.970 ( -0.845 -0.488 -2.294) 2.493 21.375 ( 16.081 9.284 5.897) 19.483 22.838 ( 5.566 3.214 2.648) 6.952 24.835 ( -0.620 -0.358 -10.866) 10.890 ======================= Grid point 137 (39/146) ======================= q-point: ( 0.27 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.966 ( 29.334 16.936 22.887) 40.879 2.451 ( 12.575 7.260 59.692) 61.432 4.667 ( 58.865 33.986 51.167) 85.077 6.545 ( -7.998 -4.618 3.921) 10.033 6.765 ( -9.313 -5.377 7.692) 13.221 6.890 ( -6.627 -3.826 1.402) 7.780 8.664 ( 2.969 1.714 -7.382) 8.139 8.718 ( 0.090 0.052 -5.834) 5.835 9.135 ( 0.934 0.539 8.372) 8.441 9.350 ( 5.386 3.109 -1.992) 6.530 9.632 ( 5.089 2.938 27.619) 28.238 9.962 ( 15.465 8.929 5.021) 18.550 10.360 ( 9.377 5.414 3.805) 11.477 10.682 ( 21.350 12.326 -0.280) 24.654 10.971 ( 3.450 1.992 4.472) 5.989 11.319 ( 0.384 0.222 17.026) 17.032 11.807 ( 10.180 5.877 19.999) 23.198 12.401 ( 7.951 4.591 -6.554) 11.280 12.444 ( 8.988 5.189 8.866) 13.650 13.587 ( 4.533 2.617 -15.428) 16.292 13.730 ( 3.670 2.119 8.925) 9.880 14.113 ( -5.661 -3.268 -2.834) 7.125 14.268 ( -4.900 -2.829 0.745) 5.706 14.852 ( -15.329 -8.850 -17.340) 24.779 15.385 ( 1.973 1.139 -2.653) 3.497 15.462 ( -14.540 -8.395 -9.906) 19.494 15.800 ( 0.157 0.091 -22.114) 22.115 16.148 ( -6.121 -3.534 -7.825) 10.544 16.746 ( -12.601 -7.275 3.486) 14.962 17.212 ( -14.894 -8.599 -4.045) 17.668 17.553 ( -6.068 -3.503 -1.514) 7.168 17.841 ( -4.413 -2.548 -4.820) 7.015 17.983 ( -5.922 -3.419 6.250) 9.264 18.311 ( -7.104 -4.102 4.415) 9.316 18.842 ( 6.561 3.788 -10.502) 12.949 18.892 ( 4.442 2.564 -1.073) 5.240 19.967 ( 3.226 1.862 9.913) 10.590 20.533 ( -7.742 -4.470 4.457) 9.989 20.930 ( -1.340 -0.774 -2.564) 2.994 21.766 ( 16.651 9.614 6.658) 20.347 22.951 ( 3.117 1.799 4.110) 5.463 24.698 ( -3.979 -2.297 -14.786) 15.483 ======================= Grid point 138 (40/146) ======================= q-point: ( 0.36 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.757 ( 32.401 18.707 16.666) 40.957 3.096 ( 12.786 7.382 55.257) 57.195 5.941 ( 20.943 12.091 17.944) 30.113 6.340 ( -14.665 -8.467 3.244) 17.241 6.724 ( -8.780 -5.069 3.795) 10.825 6.749 ( 16.124 9.309 25.327) 31.434 8.719 ( 3.790 2.188 -1.953) 4.792 8.731 ( 3.918 2.262 -5.159) 6.861 9.227 ( 6.774 3.911 -0.901) 7.874 9.484 ( 7.509 4.336 -0.600) 8.692 9.992 ( 9.703 5.602 27.730) 29.908 10.310 ( 12.960 7.482 6.296) 16.235 10.581 ( 9.397 5.425 2.375) 11.107 11.058 ( 14.701 8.488 -2.330) 17.135 11.092 ( 5.062 2.922 4.387) 7.308 11.518 ( 7.579 4.376 14.800) 17.194 12.102 ( 6.918 3.994 12.780) 15.072 12.448 ( 1.515 0.874 -10.233) 10.381 12.742 ( 12.722 7.345 11.573) 18.701 13.509 ( -3.820 -2.206 -23.266) 23.681 13.796 ( -2.926 -1.689 0.188) 3.384 14.000 ( -3.134 -1.810 4.261) 5.590 14.060 ( -13.015 -7.514 -2.025) 15.164 14.412 ( -13.336 -7.699 -0.300) 15.402 15.235 ( -2.418 -1.396 -13.753) 14.034 15.397 ( 0.479 0.276 -2.902) 2.954 15.680 ( -0.318 -0.183 -15.841) 15.846 15.946 ( -8.088 -4.670 -7.364) 11.894 16.517 ( -10.045 -5.799 2.799) 11.932 16.872 ( -13.915 -8.034 -1.746) 16.162 17.409 ( -5.507 -3.179 -2.845) 6.967 17.725 ( -3.090 -1.784 -5.786) 6.798 17.835 ( -11.709 -6.760 7.217) 15.326 18.191 ( -6.843 -3.951 5.130) 9.420 18.958 ( 10.037 5.795 -9.112) 14.743 18.980 ( 4.258 2.459 -0.534) 4.946 20.019 ( -4.475 -2.584 11.570) 12.671 20.438 ( -3.902 -2.253 1.766) 4.839 20.883 ( -1.548 -0.894 -2.435) 3.021 22.157 ( 15.969 9.220 5.970) 19.382 23.026 ( 1.685 0.973 3.084) 3.647 24.497 ( -5.152 -2.975 -15.306) 16.422 ======================= Grid point 139 (41/146) ======================= q-point: ( 0.45 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.528 ( 30.116 17.387 13.491) 37.300 3.659 ( 7.783 4.494 45.159) 46.044 5.842 ( -17.257 -9.963 8.026) 21.482 5.956 ( -22.271 -12.858 3.785) 25.994 6.612 ( -5.025 -2.901 6.572) 8.767 7.670 ( 34.807 20.096 17.546) 43.855 8.770 ( -0.385 -0.222 6.861) 6.875 8.794 ( 4.371 2.524 -3.964) 6.418 9.433 ( 14.990 8.655 -9.327) 19.662 9.631 ( 5.647 3.260 0.653) 6.553 10.317 ( 9.084 5.245 7.396) 12.835 10.590 ( 7.334 4.235 19.283) 21.061 10.778 ( 7.917 4.571 -0.153) 9.143 11.229 ( 4.828 2.787 4.341) 7.065 11.309 ( 8.291 4.787 -6.887) 11.794 11.648 ( -4.835 -2.791 7.691) 9.504 12.265 ( 3.269 1.887 5.161) 6.394 12.425 ( 3.536 2.041 -1.629) 4.396 13.081 ( -15.348 -8.861 -20.203) 26.875 13.088 ( 11.834 6.833 9.307) 16.534 13.628 ( -6.868 -3.965 -10.918) 13.495 13.947 ( 0.904 0.522 0.807) 1.319 14.004 ( -3.733 -2.156 11.271) 12.067 14.230 ( -6.904 -3.986 2.237) 8.280 15.118 ( -1.122 -0.648 -12.884) 12.949 15.367 ( -1.420 -0.820 -1.550) 2.256 15.592 ( 1.128 0.651 -10.875) 10.953 15.723 ( -7.664 -4.425 -7.595) 11.662 16.386 ( -4.360 -2.517 4.118) 6.504 16.645 ( -7.045 -4.067 1.129) 8.213 17.289 ( -3.693 -2.132 -4.619) 6.286 17.634 ( -10.097 -5.829 7.449) 13.835 17.647 ( -1.001 -0.578 -3.642) 3.821 18.075 ( -7.586 -4.380 5.884) 10.552 19.062 ( 3.306 1.909 0.728) 3.887 19.129 ( 10.548 6.090 -7.571) 14.341 19.957 ( -7.773 -4.488 11.208) 14.359 20.363 ( -3.592 -2.074 0.150) 4.150 20.839 ( -1.081 -0.624 -1.996) 2.354 22.499 ( 12.187 7.036 4.712) 14.840 23.054 ( 0.378 0.218 -2.225) 2.267 24.312 ( -3.165 -1.827 -11.554) 12.118 ======================= Grid point 140 (42/146) ======================= q-point: ( 0.55 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.880 ( -11.666 -6.735 26.725) 29.928 4.131 ( 15.200 8.776 11.514) 20.991 5.543 ( -15.341 -8.857 5.966) 18.692 5.661 ( -5.025 -2.901 21.107) 21.890 6.582 ( -2.644 -1.527 8.624) 9.149 8.094 ( 3.356 1.938 -13.216) 13.773 8.781 ( -3.853 -2.225 6.537) 7.907 8.858 ( 3.345 1.931 -1.982) 4.342 9.617 ( 4.319 2.494 -12.774) 13.713 9.714 ( 1.445 0.834 0.913) 1.902 10.484 ( 3.502 2.022 -1.563) 4.336 10.850 ( -8.890 -5.132 -2.601) 10.589 10.885 ( 2.547 1.471 -3.031) 4.223 11.152 ( 6.876 3.970 14.340) 16.391 11.339 ( 2.318 1.338 4.832) 5.524 11.679 ( -0.475 -0.274 9.243) 9.260 12.305 ( -1.383 -0.798 -0.088) 1.599 12.518 ( 1.038 0.599 -0.875) 1.483 12.879 ( 5.529 3.192 -0.621) 6.415 13.242 ( -2.523 -1.456 -8.094) 8.602 13.482 ( 2.626 1.516 -6.554) 7.222 13.949 ( -7.392 -4.268 9.982) 13.134 13.979 ( 0.194 0.112 1.551) 1.567 14.141 ( -2.090 -1.207 2.097) 3.197 15.020 ( 0.109 0.063 -12.496) 12.497 15.350 ( 0.456 0.263 1.356) 1.454 15.578 ( -1.055 -0.609 -4.523) 4.684 15.632 ( 7.666 4.426 -4.301) 9.841 16.356 ( -1.880 -1.085 4.366) 4.875 16.563 ( -1.982 -1.144 0.961) 2.483 17.191 ( -1.877 -1.083 -5.881) 6.268 17.535 ( -4.164 -2.404 7.512) 8.919 17.647 ( 1.873 1.081 0.748) 2.288 17.953 ( -6.783 -3.916 5.864) 9.784 19.127 ( 1.743 1.006 2.563) 3.259 19.283 ( 8.014 4.627 -7.673) 12.021 19.832 ( -9.780 -5.647 7.995) 13.837 20.320 ( -0.234 -0.135 1.378) 1.404 20.817 ( 0.191 0.110 -1.389) 1.407 22.695 ( 2.329 1.345 3.929) 4.761 23.006 ( -0.297 -0.172 -11.143) 11.148 24.256 ( 3.184 1.838 -4.101) 5.508 ======================= Grid point 141 (43/146) ======================= q-point: (-0.36 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.529 ( -30.745 -17.751 14.797) 38.462 4.117 ( -22.460 -12.967 10.651) 28.037 5.592 ( 14.740 8.510 8.399) 18.980 5.882 ( 7.473 4.314 26.792) 28.147 6.604 ( -1.013 -0.585 9.878) 9.947 7.705 ( -26.223 -15.140 -28.117) 41.321 8.683 ( -7.272 -4.198 2.512) 8.764 8.907 ( 1.628 0.940 0.523) 1.952 9.381 ( -12.490 -7.211 -24.698) 28.601 9.704 ( -2.562 -1.479 0.144) 2.962 10.221 ( -18.036 -10.413 -5.710) 21.595 10.643 ( -3.545 -2.047 0.941) 4.200 10.842 ( -3.885 -2.243 -4.709) 6.504 11.370 ( -2.824 -1.631 5.599) 6.480 11.493 ( -6.155 -3.554 5.249) 8.836 11.893 ( 15.329 8.850 23.020) 29.038 12.191 ( -8.091 -4.671 -4.873) 10.537 12.468 ( 1.347 0.778 -0.683) 1.699 12.982 ( -10.824 -6.249 -16.752) 20.901 13.199 ( 18.306 10.569 9.850) 23.320 13.522 ( 2.162 1.248 -9.267) 9.597 13.898 ( -1.143 -0.660 9.446) 9.537 13.973 ( -1.743 -1.006 0.268) 2.030 14.171 ( 2.254 1.302 6.647) 7.139 14.993 ( 5.607 3.237 -12.422) 14.008 15.405 ( 3.041 1.756 3.034) 4.640 15.618 ( 5.536 3.196 -2.260) 6.781 15.844 ( 11.924 6.885 1.703) 13.874 16.344 ( -1.209 -0.698 2.649) 2.995 16.575 ( 3.207 1.852 1.456) 3.979 17.152 ( 1.647 0.951 -6.177) 6.463 17.512 ( -2.680 -1.547 6.107) 6.847 17.725 ( 3.566 2.059 3.862) 5.645 17.905 ( -0.620 -0.358 5.826) 5.870 19.165 ( -0.435 -0.251 4.455) 4.483 19.354 ( 3.440 1.986 -9.172) 9.995 19.679 ( -7.358 -4.248 5.668) 10.213 20.364 ( 2.355 1.360 2.349) 3.594 20.832 ( 1.778 1.027 -0.714) 2.174 22.601 ( -10.342 -5.971 -3.397) 12.416 22.954 ( 1.695 0.979 -9.322) 9.525 24.385 ( 9.202 5.313 0.471) 10.636 ======================= Grid point 142 (44/146) ======================= q-point: (-0.27 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.884 ( -37.612 -21.715 16.599) 46.494 3.528 ( -36.804 -21.249 13.145) 44.484 6.057 ( 20.154 11.636 8.602) 24.811 6.063 ( -14.635 -8.450 2.500) 17.083 6.664 ( 0.702 0.405 9.706) 9.740 6.814 ( -29.773 -17.190 -12.265) 36.502 8.510 ( -6.999 -4.041 -7.472) 11.007 8.927 ( -0.909 -0.525 2.816) 3.005 8.993 ( -7.230 -4.174 -18.369) 20.177 9.616 ( -5.023 -2.900 -0.850) 5.862 9.855 ( -15.519 -8.960 -1.002) 17.947 10.503 ( -9.752 -5.630 -3.352) 11.749 10.689 ( -7.022 -4.054 -4.068) 9.072 11.298 ( -7.277 -4.201 6.851) 10.841 11.321 ( -10.241 -5.913 7.038) 13.762 11.831 ( -20.695 -11.948 4.559) 24.327 11.894 ( -14.608 -8.434 -11.244) 20.272 12.632 ( -11.503 -6.641 -14.457) 19.632 12.838 ( 14.631 8.447 16.848) 23.859 13.470 ( 0.528 0.305 -10.914) 10.931 13.713 ( 18.199 10.507 4.713) 21.537 13.927 ( 5.367 3.099 0.674) 6.234 14.010 ( 4.891 2.824 7.452) 9.351 14.320 ( 5.574 3.218 12.851) 14.372 15.106 ( 11.182 6.456 -9.737) 16.172 15.487 ( 1.664 0.961 2.935) 3.508 15.739 ( 8.252 4.764 -5.041) 10.780 16.080 ( 6.984 4.032 1.691) 8.240 16.390 ( 6.038 3.486 1.559) 7.144 16.744 ( 10.794 6.232 4.061) 13.109 17.155 ( 2.388 1.379 -7.152) 7.665 17.527 ( 2.218 1.280 2.638) 3.676 17.829 ( 3.491 2.015 4.230) 5.843 17.987 ( 3.284 1.896 7.480) 8.386 19.163 ( -2.903 -1.676 5.699) 6.611 19.317 ( -0.341 -0.197 -8.396) 8.405 19.630 ( -0.870 -0.502 4.657) 4.764 20.412 ( 0.738 0.426 0.282) 0.898 20.879 ( 2.748 1.587 -0.127) 3.176 22.295 ( -14.184 -8.189 -6.461) 17.606 22.927 ( -0.074 -0.043 -5.121) 5.122 24.610 ( 10.952 6.323 0.186) 12.648 ======================= Grid point 143 (45/146) ======================= q-point: (-0.18 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.204 ( -38.489 -22.222 27.513) 52.270 2.790 ( -41.246 -23.813 17.650) 50.792 4.934 ( -66.214 -38.229 -22.789) 79.781 6.468 ( 11.627 6.713 9.310) 16.338 6.673 ( 1.647 0.951 1.612) 2.493 6.766 ( 4.200 2.425 6.646) 8.227 8.389 ( 1.663 0.960 -4.620) 5.003 8.830 ( -1.765 -1.019 -8.205) 8.454 8.901 ( -3.152 -1.820 3.303) 4.915 9.509 ( -4.098 -2.366 -0.002) 4.731 9.535 ( -14.057 -8.116 0.838) 16.253 10.194 ( -15.843 -9.147 -5.388) 19.071 10.513 ( -7.768 -4.485 -1.757) 9.140 11.155 ( -12.456 -7.191 3.954) 14.916 11.166 ( -9.689 -5.594 8.485) 14.041 11.382 ( -20.141 -11.628 9.075) 24.964 11.477 ( -14.510 -8.377 -15.446) 22.788 12.331 ( -9.029 -5.213 -10.648) 14.902 13.009 ( -8.728 -5.039 17.534) 20.224 13.428 ( 1.544 0.891 -8.688) 8.869 13.743 ( 1.317 0.760 -7.441) 7.595 14.156 ( 4.231 2.443 6.049) 7.775 14.302 ( 8.476 4.893 -0.956) 9.833 14.746 ( 28.192 16.276 20.583) 38.514 15.299 ( 10.211 5.896 -4.353) 12.569 15.488 ( -2.203 -1.272 0.752) 2.653 15.920 ( 11.927 6.886 -6.516) 15.236 16.177 ( 4.871 2.812 -3.315) 6.529 16.584 ( 8.904 5.140 0.622) 10.300 17.050 ( 14.328 8.272 4.373) 17.113 17.180 ( 6.370 3.678 -11.741) 13.854 17.634 ( 5.946 3.433 1.455) 7.019 17.920 ( 2.705 1.562 3.123) 4.417 18.103 ( 1.651 0.953 9.741) 9.926 19.114 ( -5.153 -2.975 5.891) 8.373 19.274 ( 1.282 0.740 -8.458) 8.586 19.671 ( 0.995 0.574 6.380) 6.482 20.395 ( -1.018 -0.588 -2.260) 2.548 20.938 ( 2.569 1.483 0.094) 2.968 21.947 ( -15.115 -8.727 -3.751) 17.852 22.890 ( -0.778 -0.449 -2.644) 2.793 24.827 ( 9.828 5.674 -2.959) 11.728 ======================= Grid point 144 (46/146) ======================= q-point: (-0.09 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.659 ( -34.172 -19.729 46.955) 61.333 2.028 ( -42.747 -24.680 24.688) 55.189 3.291 ( -75.213 -43.425 -11.349) 87.587 6.660 ( 1.905 1.100 10.063) 10.301 6.670 ( 0.614 0.354 -7.422) 7.456 6.905 ( 4.568 2.637 2.278) 5.746 8.529 ( 8.944 5.164 6.857) 12.397 8.779 ( 1.822 1.052 -6.402) 6.739 8.862 ( -1.096 -0.633 0.992) 1.608 9.300 ( -9.093 -5.250 4.492) 11.420 9.457 ( -2.044 -1.180 3.401) 4.140 9.806 ( -16.762 -9.678 -4.111) 19.787 10.319 ( -10.083 -5.822 -1.297) 11.715 10.729 ( -22.996 -13.277 -0.640) 26.561 10.985 ( -9.714 -5.609 1.777) 11.357 11.182 ( -6.147 -3.549 -4.224) 8.259 11.240 ( -6.379 -3.683 16.996) 18.523 12.120 ( -5.338 -3.082 -6.415) 8.896 12.791 ( -17.673 -10.204 10.681) 23.034 13.419 ( 1.788 1.032 -5.377) 5.760 13.767 ( 3.379 1.951 -5.159) 6.468 14.259 ( 2.063 1.191 4.908) 5.456 14.352 ( -0.094 -0.054 -4.160) 4.162 15.332 ( 8.358 4.826 -2.724) 10.028 15.433 ( -2.550 -1.472 -0.522) 2.990 15.612 ( 25.206 14.553 14.567) 32.547 16.130 ( 11.446 6.609 -7.743) 15.318 16.275 ( 7.022 4.054 -8.708) 11.898 16.729 ( 5.137 2.966 0.041) 5.931 17.293 ( 12.302 7.103 -13.988) 19.936 17.367 ( 12.669 7.314 2.314) 14.811 17.779 ( 6.304 3.639 2.394) 7.662 17.986 ( 2.105 1.215 1.887) 3.076 18.158 ( -3.092 -1.785 11.611) 12.147 19.022 ( -6.726 -3.883 4.993) 9.233 19.221 ( -0.522 -0.301 -14.110) 14.123 19.739 ( 0.163 0.094 7.861) 7.863 20.404 ( 4.119 2.378 1.491) 4.985 20.982 ( 1.588 0.917 -0.206) 1.845 21.608 ( -15.654 -9.038 -0.004) 18.075 22.865 ( -0.632 -0.365 -0.648) 0.976 24.973 ( 6.961 4.019 -8.690) 11.838 ======================= Grid point 147 (47/146) ======================= q-point: ( 0.18 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.803 ( -0.000 39.461 33.335) 51.657 2.117 ( -0.000 36.146 42.355) 55.682 3.456 ( -0.000 20.945 90.934) 93.315 6.685 ( -0.000 -9.030 5.215) 10.428 6.886 ( -0.000 1.518 5.628) 5.829 6.985 ( -0.000 3.035 2.697) 4.060 8.734 ( 0.000 -1.941 -5.883) 6.195 8.775 ( 0.000 0.356 -6.107) 6.118 8.937 ( -0.000 -10.045 4.527) 11.017 9.360 ( -0.000 4.840 4.859) 6.858 9.562 ( -0.000 6.769 5.460) 8.697 9.753 ( -0.000 1.724 22.745) 22.810 10.052 ( -0.000 5.075 1.931) 5.429 10.324 ( 0.000 20.312 4.608) 20.828 10.917 ( -0.000 0.639 4.863) 4.905 11.377 ( -0.000 0.328 18.458) 18.461 11.617 ( -0.000 11.746 22.667) 25.530 12.073 ( -0.000 -3.393 4.329) 5.500 12.444 ( 0.000 22.471 1.933) 22.554 13.399 ( 0.000 -5.623 -2.137) 6.015 13.670 ( 0.000 7.569 0.561) 7.589 14.227 ( 0.000 -3.639 -1.592) 3.972 14.374 ( -0.000 1.899 2.822) 3.402 14.967 ( 0.000 6.507 -26.642) 27.425 15.348 ( 0.000 1.574 -2.567) 3.012 15.774 ( 0.000 0.867 -22.998) 23.014 16.074 ( 0.000 -9.067 -12.066) 15.093 16.099 ( 0.000 -13.997 -11.625) 18.195 17.014 ( -0.000 -18.720 -2.480) 18.883 17.531 ( -0.000 -10.112 0.605) 10.130 17.537 ( 0.000 -5.521 -3.982) 6.807 17.936 ( -0.000 -7.121 -1.308) 7.240 18.050 ( -0.000 -2.563 -0.092) 2.565 18.405 ( 0.000 4.429 -0.435) 4.450 18.720 ( 0.000 -2.052 -7.326) 7.608 18.960 ( 0.000 9.615 2.686) 9.983 19.798 ( -0.000 7.151 10.413) 12.632 20.764 ( -0.000 -13.190 3.019) 13.531 20.968 ( 0.000 -0.449 -2.475) 2.515 21.391 ( -0.000 16.588 7.303) 18.125 22.851 ( -0.000 4.270 4.595) 6.273 24.750 ( 0.000 -5.845 -9.226) 10.922 ======================= Grid point 148 (48/146) ======================= q-point: ( 0.27 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.289 ( -5.426 45.433 27.679) 53.476 2.812 ( 7.569 24.524 50.188) 56.370 4.553 ( 36.965 29.392 68.038) 82.822 6.598 ( -3.636 -9.848 5.739) 11.964 6.887 ( -3.616 -2.404 3.948) 5.869 7.013 ( -4.693 3.686 5.190) 7.909 8.602 ( -5.632 0.762 -8.440) 10.175 8.717 ( -1.726 3.269 -4.646) 5.937 9.077 ( 12.061 -3.277 8.639) 15.193 9.404 ( -2.995 6.861 2.452) 7.877 9.724 ( 6.292 5.578 6.185) 10.438 9.889 ( 3.731 2.698 21.242) 21.736 10.284 ( 12.513 6.758 5.696) 15.319 10.603 ( 7.244 19.561 4.268) 21.291 10.979 ( 2.858 1.913 4.988) 6.058 11.489 ( -3.155 3.691 19.906) 20.490 11.898 ( 3.348 9.683 20.461) 22.883 12.172 ( 10.737 -2.360 4.877) 12.027 12.625 ( -2.898 19.687 0.695) 19.912 13.385 ( 6.383 -4.677 -8.602) 11.688 13.729 ( 2.959 -0.491 0.738) 3.089 14.165 ( -3.655 -0.006 -2.786) 4.596 14.351 ( -5.674 0.244 0.565) 5.707 14.828 ( -3.715 3.681 -26.315) 26.829 15.357 ( 1.057 1.985 -2.929) 3.692 15.597 ( -19.417 -11.462 -10.624) 24.925 15.668 ( -0.207 0.051 -16.665) 16.666 16.032 ( 3.572 -11.653 -10.128) 15.847 16.766 ( -3.538 -20.621 -3.836) 21.271 17.294 ( -10.663 -10.219 -0.259) 14.771 17.515 ( 1.329 -9.481 -1.168) 9.645 17.815 ( -5.487 -6.222 -0.833) 8.338 18.069 ( 2.408 -0.362 -0.104) 2.437 18.440 ( -2.776 9.111 -7.392) 12.057 18.671 ( 1.044 -3.357 -0.786) 3.602 19.004 ( -5.277 9.947 1.667) 11.382 19.968 ( 6.205 2.202 8.670) 10.886 20.618 ( -5.859 -8.978 3.523) 11.285 20.923 ( -1.615 -1.230 -2.781) 3.443 21.693 ( 11.042 14.004 7.679) 19.416 22.938 ( 3.041 0.861 4.751) 5.706 24.602 ( -1.494 -7.906 -12.839) 15.152 ======================= Grid point 149 (49/146) ======================= q-point: ( 0.36 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.868 ( 6.411 41.854 23.139) 48.252 3.442 ( 5.269 17.228 54.924) 57.804 5.753 ( 31.985 15.745 31.296) 47.439 6.493 ( -5.372 -3.939 8.281) 10.628 6.809 ( -5.267 -1.656 10.009) 11.431 6.991 ( -7.701 6.805 16.108) 19.107 8.551 ( 5.752 2.515 -10.036) 11.838 8.718 ( 0.240 5.960 -5.681) 8.237 9.243 ( 2.084 -0.058 9.617) 9.840 9.461 ( 1.980 8.696 -1.236) 9.004 9.954 ( 12.350 3.176 4.585) 13.551 10.222 ( 14.642 3.589 22.597) 27.164 10.560 ( 7.640 9.327 5.899) 13.423 10.886 ( 8.085 7.095 1.753) 10.899 11.122 ( 5.849 7.823 3.402) 10.343 11.641 ( -0.162 8.042 20.090) 21.640 12.108 ( 5.094 1.895 7.183) 9.007 12.371 ( 5.273 4.265 4.409) 8.089 12.760 ( 2.662 9.849 5.821) 11.746 13.356 ( 2.487 -2.069 -16.362) 16.679 13.744 ( 3.536 -8.692 -2.439) 9.695 14.070 ( -7.303 -0.854 -3.626) 8.198 14.199 ( -9.169 -0.860 -4.554) 10.274 14.564 ( -13.112 0.140 -10.833) 17.008 15.212 ( -8.220 -4.373 -8.670) 12.722 15.382 ( 0.437 2.136 -2.671) 3.448 15.596 ( -0.053 1.346 -11.936) 12.012 15.874 ( -1.277 -12.627 -7.902) 14.951 16.497 ( -2.875 -20.334 -3.279) 20.796 17.030 ( -12.099 -6.144 0.548) 13.581 17.417 ( -2.284 -6.439 -1.875) 7.084 17.666 ( -4.633 -5.738 -1.369) 7.501 18.054 ( -6.718 -0.888 3.795) 7.767 18.366 ( -9.990 8.072 -5.254) 13.876 18.698 ( 7.586 -3.227 -2.223) 8.538 19.059 ( 0.179 10.196 0.453) 10.207 20.091 ( 1.159 -2.800 8.957) 9.456 20.491 ( -4.383 -4.939 2.576) 7.089 20.869 ( -0.823 -2.010 -2.835) 3.571 22.055 ( 13.492 11.089 6.791) 18.738 23.005 ( 2.531 -2.232 3.403) 4.793 24.407 ( -2.271 -7.223 -15.247) 17.023 ======================= Grid point 150 (50/146) ======================= q-point: ( 0.45 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.527 ( 13.383 34.972 19.096) 42.033 3.988 ( 1.821 12.862 50.653) 52.292 5.924 ( -8.514 -17.665 9.588) 21.828 6.349 ( -19.157 0.824 5.714) 20.007 6.776 ( -8.984 2.411 7.476) 11.934 7.499 ( 23.845 20.288 25.863) 40.609 8.673 ( 6.294 0.641 -1.389) 6.478 8.784 ( 9.107 8.597 -5.029) 13.496 9.317 ( 2.576 4.757 1.744) 5.684 9.594 ( 4.787 6.920 0.188) 8.416 10.179 ( 12.176 1.175 -3.028) 12.602 10.632 ( 11.269 2.734 23.820) 26.493 10.765 ( 3.659 9.687 2.395) 10.628 11.028 ( 8.497 -3.471 -0.359) 9.186 11.327 ( 6.286 10.682 1.098) 12.443 11.800 ( -4.851 2.566 13.822) 14.872 12.232 ( 6.316 1.761 2.091) 6.882 12.434 ( -1.698 5.659 0.480) 5.928 12.913 ( 3.411 -8.437 -2.113) 9.343 13.217 ( -4.724 7.195 -5.883) 10.426 13.627 ( -4.050 -6.942 -10.228) 13.008 13.889 ( -1.823 -4.585 -1.202) 5.079 14.120 ( -1.063 2.522 -5.109) 5.796 14.354 ( -11.107 0.298 2.473) 11.382 15.063 ( -2.709 -2.029 -7.475) 8.206 15.369 ( -1.055 -0.822 -1.828) 2.265 15.522 ( -0.992 -0.138 -8.561) 8.620 15.691 ( -2.588 -8.403 -7.060) 11.276 16.293 ( 0.503 -16.753 1.151) 16.800 16.833 ( -8.918 0.417 -0.172) 8.929 17.309 ( -3.695 -4.193 -2.684) 6.200 17.561 ( -3.053 -3.156 0.848) 4.472 17.896 ( -13.207 -0.214 4.950) 14.106 18.255 ( -9.202 5.423 -0.582) 10.697 18.803 ( 11.315 -4.889 -2.913) 12.665 19.190 ( 2.231 12.537 0.175) 12.735 20.073 ( -4.250 -6.623 9.271) 12.161 20.401 ( -3.922 -4.156 1.300) 5.860 20.827 ( -0.263 -1.474 -2.506) 2.919 22.401 ( 13.515 8.646 4.323) 16.617 23.010 ( 0.460 -4.185 -1.214) 4.382 24.226 ( -0.648 -5.168 -13.252) 14.239 ======================= Grid point 151 (51/146) ======================= q-point: ( 0.55 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.059 ( 2.986 7.431 18.602) 20.253 4.366 ( -3.567 20.543 33.809) 39.722 5.673 ( -10.615 -13.419 15.231) 22.907 6.077 ( -21.477 4.486 14.606) 26.357 6.724 ( -7.019 2.085 10.547) 12.840 7.919 ( 8.115 2.274 -12.494) 15.070 8.679 ( 2.093 -7.472 -0.710) 7.792 9.026 ( -0.784 13.766 6.689) 15.325 9.453 ( 8.137 1.486 -8.061) 11.550 9.738 ( 3.082 7.311 3.721) 8.763 10.366 ( 11.907 3.482 -2.428) 12.641 10.830 ( 1.238 1.256 -1.957) 2.635 10.920 ( -1.735 2.339 1.366) 3.216 11.090 ( 8.901 -5.533 8.188) 13.300 11.427 ( -3.235 3.771 5.189) 7.184 11.775 ( -3.907 -0.326 11.552) 12.199 12.337 ( 0.822 3.521 0.429) 3.641 12.484 ( 2.321 0.868 -1.033) 2.684 12.772 ( 2.945 -3.762 -4.128) 6.315 13.289 ( -4.309 4.713 -3.736) 7.398 13.446 ( -0.693 1.066 -7.577) 7.683 13.891 ( 3.336 -5.455 2.037) 6.711 14.077 ( 0.475 0.306 -10.121) 10.137 14.233 ( -9.414 0.968 9.690) 13.545 14.954 ( -2.062 -2.947 -7.313) 8.150 15.340 ( 0.757 -2.340 0.887) 2.615 15.502 ( 3.111 -0.418 -1.726) 3.583 15.571 ( 0.274 0.742 -7.297) 7.339 16.219 ( 4.081 -12.985 4.674) 14.392 16.745 ( -5.527 5.754 -2.463) 8.350 17.182 ( -3.240 -5.200 -4.741) 7.747 17.514 ( -2.486 -1.374 4.308) 5.160 17.776 ( -7.260 2.828 6.560) 10.185 18.157 ( -10.081 5.709 2.597) 11.873 18.909 ( 11.221 -8.502 -1.525) 14.160 19.337 ( 0.515 13.102 -0.387) 13.118 19.966 ( -7.660 -8.421 7.612) 13.694 20.326 ( -1.045 -2.528 1.552) 3.145 20.804 ( 0.248 -0.227 -2.024) 2.052 22.678 ( 10.154 5.601 1.182) 11.656 22.912 ( -3.609 -5.353 -8.172) 10.414 24.153 ( 4.636 -2.133 -7.109) 8.751 ======================= Grid point 152 (52/146) ======================= q-point: (-0.36 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.864 ( -24.890 -23.679 18.853) 39.187 4.646 ( -19.572 21.509 19.454) 34.988 5.595 ( 0.257 4.504 12.247) 13.051 6.081 ( -3.021 6.937 26.564) 27.620 6.723 ( -4.383 1.106 12.340) 13.142 7.698 ( -11.688 -10.998 -29.536) 33.615 8.621 ( 2.035 -11.865 0.584) 12.052 9.081 ( -10.335 10.793 2.916) 15.225 9.351 ( -7.140 -7.817 -13.831) 17.417 9.785 ( -6.182 4.538 0.282) 7.674 10.342 ( -12.822 -6.677 -8.992) 17.025 10.663 ( -3.261 -5.669 1.387) 6.686 10.873 ( -3.302 2.430 -4.189) 5.861 11.319 ( 4.475 -6.673 5.670) 9.834 11.685 ( 1.931 12.911 14.617) 19.598 11.799 ( 14.480 1.446 14.778) 20.740 12.302 ( -8.523 2.155 -2.294) 9.086 12.455 ( -1.563 -3.045 -3.633) 4.991 12.898 ( 7.178 -2.853 -6.637) 10.184 13.122 ( -1.657 2.777 -4.054) 5.186 13.497 ( 1.477 5.924 -5.575) 8.268 13.864 ( 1.436 -7.574 3.429) 8.437 14.078 ( 3.523 3.297 -6.178) 7.839 14.190 ( -5.591 2.196 9.994) 11.661 14.874 ( 1.503 -1.264 -7.363) 7.621 15.362 ( 3.892 -2.287 0.578) 4.552 15.537 ( 2.950 0.264 2.522) 3.890 15.709 ( 12.555 7.682 -3.160) 15.054 16.225 ( 5.997 -9.716 4.782) 12.379 16.703 ( -5.000 7.511 -3.995) 9.868 17.092 ( 1.733 -2.393 -6.051) 6.734 17.509 ( -0.640 -2.249 6.024) 6.462 17.764 ( -3.600 -0.151 8.797) 9.506 18.102 ( -7.922 10.491 4.606) 13.930 18.981 ( 10.013 -11.491 -0.389) 15.247 19.417 ( -3.056 9.769 -2.516) 10.540 19.792 ( -8.186 -8.098 5.756) 12.873 20.360 ( 2.635 2.336 2.542) 4.343 20.807 ( 1.381 0.723 -1.571) 2.213 22.690 ( -8.298 -6.162 -11.208) 15.246 22.839 ( 4.750 2.826 -1.902) 5.845 24.244 ( 10.789 0.837 -2.609) 11.131 ======================= Grid point 153 (53/146) ======================= q-point: (-0.27 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.253 ( -32.309 -33.256 21.829) 51.248 4.339 ( -46.119 11.371 17.675) 50.682 5.923 ( 14.170 10.966 10.032) 20.535 6.237 ( -5.020 1.451 7.821) 9.406 6.756 ( -2.475 -0.103 12.194) 12.443 7.067 ( -27.405 -12.948 -16.113) 34.327 8.518 ( -3.332 -10.608 -0.758) 11.145 8.809 ( -12.309 -11.001 -9.408) 19.001 9.175 ( -7.025 5.105 -0.440) 8.695 9.683 ( -8.347 2.557 -0.397) 8.739 10.060 ( -13.449 0.917 -4.093) 14.087 10.530 ( -6.496 -9.383 -2.799) 11.751 10.769 ( -7.556 0.704 -4.484) 8.814 11.270 ( -1.855 -12.137 6.636) 13.956 11.614 ( -12.633 1.416 8.009) 15.025 12.000 ( -14.412 -5.173 -2.909) 15.586 12.129 ( -17.191 -1.909 1.782) 17.389 12.587 ( 5.213 -2.231 -3.457) 6.641 12.760 ( 9.707 8.871 -0.198) 13.152 13.318 ( 9.663 -3.214 -1.931) 10.365 13.600 ( 12.557 11.943 1.068) 17.363 13.897 ( 3.463 -1.252 0.241) 3.691 14.078 ( -4.591 4.031 2.430) 6.575 14.277 ( 8.274 0.619 6.196) 10.355 14.917 ( 9.300 1.215 -5.161) 10.705 15.445 ( 8.185 -0.536 -1.091) 8.275 15.592 ( 2.225 -1.937 1.152) 3.167 15.967 ( 11.402 5.944 -3.442) 13.311 16.310 ( 8.902 -0.640 1.455) 9.043 16.714 ( 2.407 7.311 -2.467) 8.083 17.097 ( 2.994 0.610 -5.018) 5.875 17.522 ( 0.125 -2.669 7.286) 7.761 17.764 ( 0.344 -4.510 7.459) 8.723 18.169 ( -3.069 13.966 6.703) 15.792 19.007 ( 7.734 -13.390 -0.386) 15.468 19.386 ( -5.292 4.865 -4.916) 8.709 19.687 ( -2.796 -3.946 7.320) 8.773 20.436 ( 0.194 4.852 0.439) 4.875 20.839 ( 2.829 0.776 -1.175) 3.160 22.403 ( -12.046 -4.899 -9.437) 16.068 22.885 ( 1.230 0.681 -2.357) 2.745 24.444 ( 13.459 2.470 -2.714) 13.951 ======================= Grid point 154 (54/146) ======================= q-point: (-0.18 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.571 ( -32.083 -37.772 31.337) 58.635 3.736 ( -53.715 7.601 17.549) 57.018 5.515 ( -53.022 -20.325 -14.411) 58.584 6.388 ( 12.995 8.593 6.350) 16.824 6.711 ( -5.648 -0.688 1.383) 5.856 6.822 ( -1.621 1.184 9.201) 9.417 8.373 ( -1.567 -2.035 1.693) 3.076 8.622 ( 2.489 -13.557 2.716) 14.048 9.099 ( -6.658 1.071 1.365) 6.880 9.596 ( -10.126 8.123 1.570) 13.076 9.818 ( -16.621 4.896 -4.034) 17.790 10.252 ( -10.877 -13.981 -5.173) 18.454 10.615 ( -8.541 0.181 -2.743) 8.972 11.162 ( -3.549 -12.167 7.163) 14.558 11.432 ( -14.133 -4.247 2.020) 14.895 11.643 ( -22.064 -0.568 -2.228) 22.184 11.748 ( -24.304 -3.283 5.576) 25.151 12.369 ( -9.189 -3.281 -8.828) 13.158 13.106 ( 6.685 -2.031 7.438) 10.205 13.361 ( 3.704 2.259 -2.057) 4.802 13.756 ( -7.052 3.152 -6.867) 10.335 14.066 ( 14.020 0.464 4.680) 14.788 14.190 ( 9.373 5.275 2.935) 11.149 14.563 ( 22.091 7.257 6.300) 24.091 15.111 ( 14.862 1.067 0.597) 14.913 15.522 ( -1.057 0.616 -0.600) 1.363 15.643 ( 12.129 -4.354 -3.787) 13.432 16.094 ( 5.662 1.859 -5.995) 8.453 16.502 ( 10.480 11.086 -10.889) 18.743 16.883 ( 10.811 2.179 2.558) 11.321 17.119 ( 2.615 2.510 -2.242) 4.262 17.582 ( 3.679 0.057 6.022) 7.057 17.800 ( 5.764 -7.054 5.403) 10.591 18.313 ( -2.632 14.248 8.782) 16.943 18.972 ( 5.275 -15.699 -1.130) 16.600 19.316 ( -3.640 3.806 -5.911) 7.917 19.706 ( 1.170 -1.799 9.333) 9.576 20.439 ( -3.815 4.115 -2.727) 6.239 20.890 ( 3.607 0.170 -0.891) 3.719 22.112 ( -14.573 -2.720 -3.871) 15.321 22.881 ( -0.203 0.422 -1.629) 1.695 24.655 ( 12.634 3.000 -5.830) 14.234 ======================= Grid point 155 (55/146) ======================= q-point: (-0.09 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.996 ( -26.601 -36.965 46.624) 65.175 2.976 ( -54.886 -7.835 10.781) 56.481 4.307 ( -75.317 -2.129 10.243) 76.040 6.560 ( 3.826 -2.950 -5.927) 7.647 6.701 ( 3.352 1.136 3.811) 5.201 6.888 ( 2.656 0.279 4.991) 5.661 8.487 ( 7.631 3.566 9.616) 12.784 8.612 ( 4.991 -8.548 6.742) 11.977 9.021 ( -6.828 4.295 1.385) 8.185 9.436 ( -14.000 -1.918 1.186) 14.180 9.677 ( -10.553 13.809 2.036) 17.498 9.891 ( -12.994 -14.504 -4.320) 19.946 10.465 ( -10.347 0.904 -1.127) 10.448 10.949 ( -15.243 -9.432 -0.436) 17.930 11.169 ( -14.864 -3.057 -3.145) 15.498 11.251 ( -15.186 -4.328 4.408) 16.394 11.541 ( -14.825 2.081 19.445) 24.540 12.183 ( -7.439 2.253 -4.715) 9.091 13.002 ( -12.260 -12.234 2.946) 17.568 13.428 ( -1.312 6.375 1.417) 6.661 13.706 ( 2.612 3.926 -5.675) 7.379 14.219 ( 5.942 -3.045 3.964) 7.765 14.305 ( 2.400 0.046 -4.506) 5.106 15.067 ( 26.085 -0.363 -6.600) 26.910 15.401 ( 12.649 0.979 7.594) 14.786 15.488 ( 1.136 1.159 1.621) 2.294 15.828 ( 18.230 0.036 -4.215) 18.711 16.151 ( 5.633 2.844 -12.442) 13.951 16.653 ( 7.231 8.767 -13.619) 17.738 17.052 ( 11.827 -1.894 -1.175) 12.035 17.280 ( 9.962 7.641 2.218) 12.749 17.699 ( 6.627 0.607 2.200) 7.009 17.887 ( 6.911 -5.165 7.430) 11.386 18.418 ( -6.978 10.692 8.430) 15.300 18.878 ( 4.267 -17.375 -2.376) 18.048 19.245 ( -4.143 3.280 -10.065) 11.368 19.790 ( 1.552 -1.033 10.721) 10.882 20.404 ( -0.907 3.146 -0.490) 3.310 20.938 ( 3.117 -0.460 -0.997) 3.305 21.836 ( -17.020 -0.794 1.240) 17.084 22.877 ( -0.594 1.131 0.273) 1.306 24.810 ( 9.490 3.151 -10.549) 14.535 ======================= Grid point 159 (56/146) ======================= q-point: ( 0.27 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.978 ( -0.000 43.315 26.601) 50.831 3.295 ( -0.000 36.564 34.965) 50.592 4.980 ( -0.000 26.512 72.940) 77.609 6.581 ( -0.000 -9.502 10.619) 14.249 6.884 ( -0.000 -4.575 -0.198) 4.579 7.132 ( -0.000 7.650 2.652) 8.096 8.705 ( 0.000 5.869 -2.202) 6.269 8.781 ( 0.000 5.763 -2.163) 6.155 8.932 ( -0.000 1.247 5.170) 5.319 9.505 ( 0.000 4.926 1.061) 5.039 9.688 ( -0.000 -0.455 4.547) 4.570 10.118 ( -0.000 4.453 24.952) 25.347 10.243 ( -0.000 9.303 5.846) 10.987 10.787 ( 0.000 21.874 4.888) 22.414 10.987 ( -0.000 -0.395 5.160) 5.175 11.700 ( -0.000 7.528 19.322) 20.737 12.073 ( -0.000 -1.900 4.243) 4.649 12.140 ( -0.000 10.307 23.193) 25.380 12.844 ( 0.000 19.861 -2.499) 20.017 13.229 ( 0.000 -7.020 -6.048) 9.266 13.634 ( 0.000 -7.367 -8.829) 11.499 14.180 ( 0.000 1.280 -4.913) 5.077 14.406 ( -0.000 -1.340 0.055) 1.341 14.735 ( 0.000 8.061 -27.243) 28.410 15.351 ( 0.000 2.729 -3.095) 4.127 15.563 ( 0.000 -5.562 -10.109) 11.538 15.655 ( 0.000 -8.563 -12.327) 15.009 15.780 ( 0.000 -7.808 -6.671) 10.270 16.509 ( -0.000 -28.261 -5.068) 28.712 17.335 ( 0.000 -11.075 -3.481) 11.609 17.370 ( -0.000 -8.523 3.425) 9.186 17.847 ( -0.000 -3.252 0.736) 3.334 17.982 ( 0.000 -2.636 -1.883) 3.239 18.463 ( 0.000 6.020 -9.520) 11.264 18.696 ( 0.000 7.147 0.010) 7.147 19.183 ( 0.000 10.167 2.260) 10.415 19.953 ( -0.000 -2.392 7.015) 7.412 20.587 ( -0.000 -10.417 2.644) 10.747 20.910 ( 0.000 -1.866 -3.195) 3.700 21.792 ( -0.000 14.116 9.168) 16.832 22.942 ( -0.000 -1.516 4.666) 4.906 24.445 ( 0.000 -10.331 -12.597) 16.292 ======================= Grid point 160 (57/146) ======================= q-point: ( 0.36 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.451 ( -6.223 43.190 22.110) 48.918 3.889 ( 4.548 27.380 40.517) 49.112 5.738 ( 13.665 13.089 38.494) 42.893 6.603 ( -3.236 -0.214 16.950) 17.257 6.890 ( 4.548 -0.392 9.643) 10.669 7.204 ( -1.020 9.099 7.635) 11.921 8.592 ( -11.612 7.260 -5.073) 14.605 8.791 ( -3.898 8.116 -1.538) 9.134 9.174 ( 13.080 1.885 4.758) 14.046 9.531 ( -0.678 7.131 -0.970) 7.228 9.799 ( 9.807 -1.416 1.894) 10.088 10.253 ( 1.488 5.677 19.915) 20.762 10.542 ( 11.614 7.147 13.072) 18.890 10.960 ( -1.776 10.280 3.989) 11.169 11.096 ( 6.465 6.750 2.027) 9.564 11.874 ( -1.878 8.009 17.813) 19.621 12.097 ( 0.514 2.114 4.514) 5.011 12.414 ( 5.482 6.609 15.125) 17.392 12.890 ( -6.899 5.893 -1.307) 9.166 13.202 ( 6.152 0.886 -9.753) 11.565 13.522 ( 5.055 -10.883 -11.357) 16.522 14.110 ( -3.416 -1.142 -8.480) 9.213 14.295 ( -9.002 -2.199 -6.553) 11.349 14.626 ( -2.584 4.360 -17.957) 18.658 15.275 ( -9.714 -8.451 -4.373) 13.598 15.382 ( -0.028 0.307 -2.704) 2.722 15.569 ( -1.583 3.822 -6.392) 7.614 15.721 ( 1.249 -7.931 -4.504) 9.206 16.253 ( 2.480 -24.199 -2.922) 24.500 17.109 ( -8.345 -11.136 -2.453) 14.130 17.350 ( 1.532 -8.102 0.764) 8.281 17.757 ( -6.917 1.044 1.969) 7.268 18.016 ( 5.494 -4.742 -0.777) 7.299 18.472 ( -0.676 8.523 -7.487) 11.365 18.738 ( -5.114 9.505 -1.981) 10.974 19.199 ( -6.597 7.559 2.967) 10.462 20.034 ( 7.206 -5.298 5.883) 10.705 20.496 ( -1.784 -8.415 2.240) 8.889 20.849 ( -1.771 -2.577 -3.173) 4.455 22.026 ( 7.623 8.400 8.563) 14.213 22.961 ( 1.873 -3.460 2.993) 4.944 24.261 ( -0.993 -9.025 -13.565) 16.323 ======================= Grid point 161 (58/146) ======================= q-point: ( 0.45 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.906 ( -0.286 37.252 18.750) 41.706 4.435 ( 1.663 20.743 43.241) 47.987 5.948 ( -2.668 -10.653 13.113) 17.104 6.573 ( -6.814 -1.724 2.540) 7.474 6.997 ( -8.062 7.551 7.028) 13.092 7.629 ( 11.178 17.593 34.558) 40.357 8.572 ( 7.374 12.772 -4.313) 15.365 8.758 ( -4.196 4.493 -4.825) 7.815 9.329 ( 3.443 1.457 -0.155) 3.742 9.635 ( 1.956 7.993 5.414) 9.850 9.966 ( 11.966 0.698 -2.382) 12.220 10.556 ( 14.217 3.754 15.447) 21.326 10.809 ( 4.543 5.381 6.576) 9.635 11.016 ( -2.566 3.864 4.355) 6.362 11.275 ( 9.246 5.651 -0.264) 10.839 11.974 ( -3.035 -1.140 11.913) 12.346 12.213 ( 2.528 10.436 4.880) 11.795 12.546 ( -3.486 4.930 1.803) 6.301 12.801 ( -0.778 -8.625 -1.569) 8.801 13.274 ( 4.123 6.412 -5.944) 9.666 13.427 ( 4.459 -11.024 -11.272) 16.385 13.938 ( -8.519 -6.050 -1.336) 10.534 14.100 ( -4.264 5.210 -16.798) 18.097 14.514 ( -5.026 0.615 -3.804) 6.333 15.066 ( -5.387 -6.525 -1.759) 8.642 15.351 ( -0.780 -3.239 -2.888) 4.409 15.524 ( -3.798 2.202 -5.323) 6.900 15.632 ( -2.217 -3.655 -0.569) 4.313 16.125 ( 3.865 -13.202 1.209) 13.809 16.876 ( -5.165 -9.043 -4.869) 11.496 17.261 ( -1.599 -11.813 0.261) 11.924 17.728 ( -7.219 11.341 4.760) 14.261 18.009 ( -0.080 -6.784 1.248) 6.898 18.432 ( -9.416 7.733 -5.245) 13.265 18.727 ( -2.372 8.735 -2.719) 9.451 19.256 ( 2.362 8.051 3.616) 9.136 20.082 ( 1.059 -8.398 6.046) 10.402 20.412 ( -2.035 -6.946 1.831) 7.466 20.790 ( 0.132 -2.312 -2.752) 3.597 22.266 ( 11.856 0.253 3.816) 12.458 22.973 ( 0.666 -0.776 0.877) 1.348 24.090 ( -0.202 -6.633 -12.484) 14.138 ======================= Grid point 162 (59/146) ======================= q-point: ( 0.55 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.283 ( -2.530 15.208 17.221) 23.113 4.867 ( -3.699 24.161 33.681) 41.616 5.841 ( -8.341 -8.414 18.702) 22.139 6.438 ( -10.520 -0.180 4.922) 11.615 6.951 ( -8.918 4.311 7.193) 12.242 7.840 ( -5.783 1.291 -2.188) 6.317 8.623 ( -4.246 -2.331 -6.052) 7.752 9.095 ( 18.023 18.764 7.582) 27.099 9.355 ( 0.502 1.829 -2.568) 3.193 9.795 ( 3.724 6.464 10.309) 12.725 10.183 ( 14.007 6.938 -0.624) 15.643 10.820 ( 0.358 0.110 -4.350) 4.366 10.894 ( 8.825 -1.779 3.818) 9.779 11.052 ( -1.192 5.343 8.035) 9.723 11.455 ( 5.743 0.350 2.349) 6.215 11.937 ( -6.548 -3.012 10.481) 12.720 12.350 ( 0.939 6.926 0.936) 7.051 12.476 ( -2.627 -0.962 -2.913) 4.038 12.711 ( -0.960 -2.478 -2.117) 3.398 13.288 ( 3.198 -7.164 -15.292) 17.187 13.381 ( 2.714 1.695 -1.113) 3.388 13.806 ( -0.463 -7.788 2.795) 8.287 14.014 ( -1.842 8.268 -16.708) 18.733 14.439 ( -6.198 1.020 5.635) 8.438 14.933 ( -3.399 -5.239 -2.073) 6.580 15.302 ( 0.111 -3.663 1.264) 3.877 15.456 ( 0.849 0.676 -2.473) 2.700 15.583 ( -3.399 2.058 -1.089) 4.120 16.113 ( 1.979 -6.810 5.076) 8.721 16.742 ( 0.905 -3.780 -6.892) 7.912 17.102 ( -2.064 -15.216 -0.592) 15.366 17.735 ( -10.460 11.568 5.045) 16.391 17.930 ( -5.591 -0.353 1.807) 5.887 18.340 ( -5.503 6.488 -1.733) 8.682 18.762 ( 0.115 2.720 -0.122) 2.725 19.426 ( 3.646 10.231 2.972) 11.260 20.007 ( -3.568 -10.527 5.162) 12.255 20.324 ( -1.666 -6.347 2.723) 7.105 20.775 ( 1.210 -0.662 -2.076) 2.492 22.434 ( 13.904 -7.627 -6.623) 17.186 22.980 ( -4.075 5.822 2.094) 7.408 23.995 ( 4.129 -4.764 -8.573) 10.641 ======================= Grid point 163 (60/146) ======================= q-point: (-0.36 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.189 ( -22.709 -13.897 17.948) 32.109 5.233 ( -6.461 29.853 20.059) 36.542 5.793 ( -8.615 1.125 16.032) 18.235 6.365 ( -6.526 2.117 14.822) 16.332 6.901 ( -6.445 0.740 8.429) 10.637 7.577 ( -10.679 -9.951 -19.652) 24.480 8.506 ( -0.512 -5.515 -4.809) 7.335 9.229 ( -1.830 -4.119 -7.257) 8.542 9.431 ( -7.132 10.613 7.457) 14.803 9.936 ( -1.734 7.148 3.922) 8.336 10.416 ( -4.849 2.941 -3.856) 6.858 10.675 ( -4.620 -5.589 -0.925) 7.310 10.920 ( -1.680 1.124 -0.737) 2.152 11.222 ( 6.901 -0.306 4.393) 8.187 11.597 ( 15.624 1.653 8.767) 17.992 11.918 ( -3.501 3.698 12.684) 13.668 12.385 ( -1.720 -1.830 -2.949) 3.874 12.436 ( -1.732 3.341 -5.484) 6.651 12.731 ( 6.852 -0.021 -1.429) 6.999 13.138 ( -3.209 -3.375 -10.904) 11.857 13.429 ( 5.412 -3.672 -3.868) 7.598 13.778 ( 3.124 -5.127 -0.676) 6.041 13.994 ( 1.243 7.889 -9.309) 12.265 14.386 ( -6.804 0.287 7.789) 10.346 14.838 ( -2.432 -0.929 -3.002) 3.973 15.297 ( 0.821 -4.831 3.351) 5.937 15.543 ( 2.853 2.461 2.161) 4.343 15.599 ( 5.859 7.831 0.010) 9.781 16.110 ( 2.210 -6.755 4.805) 8.579 16.718 ( 1.458 -0.390 -6.904) 7.067 16.950 ( 2.955 -12.174 -2.421) 12.759 17.689 ( -10.413 10.674 1.769) 15.016 17.864 ( -3.818 -2.298 5.465) 7.051 18.339 ( -5.587 9.664 2.668) 11.477 18.775 ( 2.983 -5.279 1.179) 6.177 19.534 ( -2.520 6.644 0.453) 7.120 19.851 ( -6.175 -10.815 4.454) 13.227 20.338 ( 4.608 0.335 3.188) 5.613 20.781 ( 1.149 0.462 -1.742) 2.137 22.474 ( 9.386 -8.363 -15.181) 19.710 22.970 ( -7.558 6.997 4.866) 11.391 24.038 ( 10.672 -2.368 -4.660) 11.884 ======================= Grid point 164 (61/146) ======================= q-point: (-0.27 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.668 ( -34.127 -22.941 21.925) 46.601 5.211 ( -34.059 10.873 12.942) 38.022 5.930 ( 6.793 12.283 9.125) 16.741 6.340 ( -6.390 -2.852 -4.681) 8.419 6.856 ( -3.670 -3.310 4.422) 6.632 7.216 ( -11.704 -7.690 2.235) 14.182 8.437 ( 0.293 -6.218 -0.793) 6.275 9.003 ( -18.404 -3.296 -4.758) 19.293 9.322 ( -12.972 -1.442 6.111) 14.411 9.935 ( -9.932 12.249 3.276) 16.107 10.198 ( -8.282 -0.583 -5.807) 10.132 10.552 ( -7.981 -6.229 -2.208) 10.363 10.863 ( -5.716 1.915 -4.448) 7.492 11.235 ( -1.070 -8.975 5.841) 10.762 11.789 ( -2.828 -3.093 4.771) 6.350 12.119 ( -2.763 -0.767 -1.154) 3.091 12.323 ( 1.568 3.747 4.917) 6.378 12.449 ( 6.372 8.029 1.047) 10.304 12.726 ( -3.185 0.625 -11.066) 11.532 13.135 ( 9.976 -2.313 3.530) 10.832 13.467 ( 10.190 -2.106 -5.094) 11.585 13.808 ( 4.096 1.903 -2.474) 5.150 14.069 ( 5.194 4.745 -4.644) 8.430 14.335 ( -5.381 -1.662 7.621) 9.476 14.811 ( 1.240 0.654 -0.609) 1.528 15.295 ( 4.758 -3.243 -0.416) 5.773 15.613 ( 0.068 1.262 2.945) 3.204 15.825 ( 10.880 8.104 -2.760) 13.844 16.155 ( 7.266 -6.104 4.607) 10.549 16.676 ( 2.942 -0.325 -6.995) 7.596 16.977 ( 7.809 -1.687 -2.798) 8.465 17.624 ( -6.719 5.023 0.540) 8.407 17.826 ( -5.143 -4.808 10.988) 13.050 18.369 ( -3.358 10.238 3.311) 11.271 18.780 ( 5.292 -10.213 0.964) 11.543 19.479 ( -6.376 1.306 -2.685) 7.040 19.729 ( -3.003 -6.127 6.256) 9.257 20.457 ( 4.196 4.301 -0.390) 6.021 20.798 ( 1.698 0.654 -1.523) 2.373 22.406 ( -0.236 -1.598 -12.229) 12.335 22.932 ( -5.653 2.400 3.568) 7.103 24.209 ( 14.395 0.181 -3.879) 14.909 ======================= Grid point 165 (62/146) ======================= q-point: (-0.18 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.041 ( -36.694 -23.645 30.074) 53.009 4.641 ( -47.267 -4.160 4.579) 47.671 5.914 ( -17.045 -2.985 -15.125) 22.982 6.298 ( 9.255 4.231 2.628) 10.510 6.792 ( -3.225 -5.779 5.037) 8.317 7.037 ( -18.441 -0.254 13.861) 23.071 8.390 ( -0.480 -3.536 4.107) 5.441 8.676 ( -14.894 0.085 7.725) 16.778 9.203 ( -6.000 -1.579 8.855) 10.812 9.913 ( -12.366 10.720 0.470) 16.372 10.034 ( -8.576 4.531 -5.367) 11.085 10.283 ( -12.588 -9.339 -4.905) 16.423 10.744 ( -8.038 3.197 -2.884) 9.118 11.154 ( -2.767 -9.921 6.847) 12.368 11.609 ( -14.248 -5.040 -1.248) 15.165 11.965 ( -12.846 1.110 -0.254) 12.896 12.132 ( -20.066 0.531 3.145) 20.318 12.463 ( -9.097 1.501 -3.851) 9.991 12.901 ( 15.385 -0.848 -2.470) 15.605 13.296 ( 8.854 2.023 3.474) 9.724 13.721 ( 17.229 1.125 -4.618) 17.872 13.905 ( 5.810 4.616 -3.432) 8.176 14.135 ( 3.497 -1.809 3.097) 5.009 14.331 ( 6.043 -1.783 3.234) 7.082 14.915 ( 10.831 0.669 3.986) 11.561 15.398 ( 9.807 0.776 -3.684) 10.505 15.594 ( -2.841 -1.259 0.891) 3.233 15.981 ( 5.262 3.176 -6.506) 8.950 16.282 ( 13.496 -0.982 -7.007) 15.238 16.774 ( 8.742 4.296 -2.279) 10.004 17.065 ( 4.976 1.484 -1.430) 5.386 17.619 ( 0.973 -0.929 8.142) 8.253 17.732 ( -4.814 -7.018 5.146) 9.945 18.486 ( 1.620 11.308 4.573) 12.304 18.747 ( 3.841 -14.621 -0.007) 15.117 19.375 ( -5.507 1.940 -3.404) 6.758 19.714 ( 1.096 -3.651 7.419) 8.341 20.500 ( -0.803 2.540 -4.907) 5.583 20.832 ( 2.787 0.750 -1.054) 3.073 22.290 ( -9.475 3.899 -3.253) 10.750 22.898 ( -1.867 0.718 1.189) 2.327 24.420 ( 14.290 1.750 -6.149) 15.655 ======================= Grid point 166 (63/146) ======================= q-point: (-0.09 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.513 ( -32.621 -18.114 42.020) 56.195 3.722 ( -53.165 -18.863 -2.978) 56.491 5.494 ( -41.009 16.616 11.822) 45.799 6.436 ( 4.386 -4.391 -1.166) 6.315 6.668 ( -5.616 -4.728 2.255) 7.680 6.870 ( -2.344 -6.990 4.957) 8.883 8.463 ( 4.927 2.066 7.428) 9.150 8.639 ( -3.057 3.820 12.720) 13.629 9.201 ( -6.012 4.967 13.312) 15.427 9.646 ( -15.358 -6.223 -5.399) 17.429 9.940 ( -13.388 -8.190 -4.300) 16.273 10.028 ( -10.615 16.881 2.524) 20.100 10.639 ( -9.085 4.328 0.591) 10.081 11.042 ( -6.149 -6.950 2.346) 9.572 11.318 ( -13.777 -1.983 -3.003) 14.240 11.638 ( -25.200 -1.490 2.370) 25.355 11.933 ( -15.641 2.146 15.491) 22.119 12.336 ( -8.528 7.598 -1.647) 11.540 12.964 ( 2.235 -7.911 -6.349) 10.387 13.498 ( 6.167 4.024 6.926) 10.109 13.727 ( -4.993 5.090 -10.212) 12.455 14.052 ( 12.020 -4.833 -0.127) 12.956 14.222 ( 4.284 -2.606 -0.299) 5.024 14.523 ( 22.660 -13.098 -3.360) 26.388 15.229 ( 16.711 4.591 6.517) 18.515 15.501 ( 0.450 -0.512 -3.341) 3.409 15.593 ( 10.117 3.351 -0.919) 10.697 16.006 ( 3.535 1.139 -12.606) 13.141 16.440 ( 13.700 3.926 -17.021) 22.199 16.897 ( 5.782 -2.742 1.762) 6.638 17.206 ( 8.825 5.032 3.179) 10.645 17.643 ( 0.428 -2.349 1.042) 2.605 17.762 ( 9.595 -5.364 9.758) 14.699 18.586 ( -2.978 -11.179 4.027) 12.249 18.676 ( 4.014 3.205 -2.344) 5.646 19.283 ( -5.564 2.371 -6.233) 8.685 19.789 ( 4.427 -2.807 10.117) 11.395 20.449 ( -2.216 0.862 -3.833) 4.511 20.879 ( 3.037 0.650 -1.322) 3.375 22.130 ( -15.483 4.879 2.824) 16.477 22.906 ( -0.190 2.387 1.456) 2.802 24.598 ( 11.765 2.465 -10.092) 15.695 ======================= Grid point 171 (64/146) ======================= q-point: ( 0.36 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.009 ( -0.000 31.952 23.315) 39.554 4.325 ( -0.000 32.266 24.903) 40.758 5.948 ( -0.000 0.895 25.048) 25.064 6.738 ( -0.000 -9.113 -1.896) 9.308 7.006 ( -0.000 23.508 48.772) 54.142 7.323 ( 0.000 12.010 -1.305) 12.081 8.861 ( 0.000 5.911 -0.751) 5.959 8.882 ( 0.000 6.960 -2.504) 7.396 9.036 ( 0.000 8.710 1.522) 8.842 9.612 ( 0.000 10.236 -2.258) 10.482 9.676 ( -0.000 -5.964 3.476) 6.903 10.508 ( -0.000 7.537 10.195) 12.678 10.520 ( -0.000 2.687 24.478) 24.625 11.028 ( -0.000 -1.867 4.506) 4.877 11.159 ( 0.000 12.969 -3.243) 13.368 11.997 ( -0.000 1.006 6.561) 6.638 12.239 ( -0.000 11.671 12.938) 17.425 12.495 ( -0.000 2.430 11.614) 11.865 12.999 ( 0.000 -7.535 -7.343) 10.521 13.017 ( 0.000 -0.849 -9.683) 9.720 13.352 ( 0.000 1.719 -9.658) 9.810 14.066 ( 0.000 -0.444 -9.635) 9.645 14.322 ( 0.000 -4.905 -2.845) 5.670 14.516 ( 0.000 0.981 -22.478) 22.499 15.228 ( -0.000 -14.342 -4.194) 14.943 15.353 ( 0.000 0.776 -3.204) 3.297 15.620 ( 0.000 6.459 -3.656) 7.422 15.661 ( -0.000 -0.380 0.814) 0.899 16.020 ( -0.000 -18.532 2.257) 18.669 17.047 ( -0.000 -15.048 -3.536) 15.458 17.239 ( -0.000 -11.069 -0.571) 11.084 17.868 ( -0.000 5.601 4.577) 7.233 17.927 ( 0.000 -0.151 -2.199) 2.204 18.529 ( 0.000 12.774 -4.305) 13.480 18.865 ( 0.000 11.161 -3.045) 11.569 19.372 ( 0.000 8.281 0.395) 8.291 19.901 ( -0.000 -10.900 4.559) 11.815 20.438 ( -0.000 -9.423 2.276) 9.694 20.820 ( 0.000 -3.223 -3.247) 4.575 22.061 ( -0.000 -1.415 8.973) 9.084 22.938 ( -0.000 -0.578 1.914) 1.999 24.108 ( 0.000 -7.756 -11.998) 14.287 ======================= Grid point 172 (65/146) ======================= q-point: ( 0.45 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.366 ( -3.812 25.274 19.276) 32.014 4.809 ( 6.137 26.140 23.720) 35.827 6.015 ( -3.398 -5.962 15.771) 17.199 6.606 ( -3.049 -8.826 -0.693) 9.364 7.288 ( -11.059 13.213 4.453) 17.797 7.815 ( 17.032 24.022 38.984) 48.856 8.667 ( -8.886 7.661 -5.983) 13.170 8.917 ( -8.485 7.299 -3.676) 11.781 9.256 ( 6.901 6.000 1.296) 9.236 9.661 ( 5.027 2.260 3.066) 6.307 9.819 ( 9.329 6.328 2.258) 11.496 10.569 ( -0.059 4.148 14.181) 14.776 10.802 ( 6.503 0.587 10.660) 12.501 11.070 ( 3.501 -1.575 5.096) 6.380 11.188 ( 2.855 2.207 -7.862) 8.650 12.026 ( -0.651 -1.854 5.321) 5.672 12.389 ( -3.149 11.468 6.926) 13.762 12.602 ( 3.253 1.832 3.406) 5.054 12.781 ( -7.272 -5.996 -2.868) 9.852 13.007 ( 8.752 -8.868 -13.464) 18.344 13.361 ( 0.493 5.127 -7.130) 8.796 13.990 ( -4.570 -1.156 -2.998) 5.586 14.151 ( -8.217 1.088 -10.784) 13.602 14.453 ( 4.582 -2.288 -8.920) 10.286 15.045 ( -3.252 -12.089 -1.631) 12.624 15.317 ( -0.836 -2.480 -2.208) 3.424 15.604 ( -4.329 5.120 -3.171) 7.417 15.679 ( -3.048 0.776 1.598) 3.528 15.970 ( 5.714 -6.250 5.187) 9.931 16.819 ( -5.532 -13.650 -5.351) 15.671 17.133 ( 1.789 -16.708 -0.723) 16.819 17.917 ( 0.187 -1.954 -1.461) 2.447 17.984 ( -1.945 16.363 5.283) 17.304 18.626 ( -4.330 12.517 -0.637) 13.260 18.886 ( -6.012 12.947 -7.454) 16.103 19.345 ( -5.152 3.601 3.253) 7.078 19.942 ( 9.773 -10.453 3.867) 14.823 20.364 ( -0.247 -9.292 2.525) 9.632 20.757 ( -1.027 -2.939 -2.579) 4.042 22.086 ( 6.009 -13.220 4.209) 15.119 22.990 ( 1.634 6.457 1.976) 6.948 23.966 ( -0.820 -5.986 -10.171) 11.830 ======================= Grid point 173 (66/146) ======================= q-point: ( 0.55 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.591 ( -5.670 10.848 17.485) 21.343 5.276 ( 4.688 24.698 19.410) 31.760 5.999 ( -4.062 -4.546 17.393) 18.431 6.474 ( -1.579 -8.748 -3.303) 9.483 7.199 ( -13.377 6.725 2.133) 15.124 8.064 ( -14.679 1.259 5.121) 15.598 8.711 ( -11.430 2.194 -8.950) 14.682 9.005 ( 15.770 20.181 4.757) 26.050 9.374 ( 4.873 6.840 5.703) 10.152 9.826 ( 5.896 -0.192 13.275) 14.526 10.090 ( 11.215 14.175 3.943) 18.500 10.725 ( 5.691 0.035 -2.285) 6.133 10.811 ( 2.132 -5.453 3.849) 7.007 11.158 ( 1.722 2.300 3.319) 4.390 11.307 ( 11.285 -2.808 1.353) 11.708 12.009 ( -1.990 -4.151 4.938) 6.750 12.420 ( -1.542 3.382 -5.035) 6.259 12.587 ( -10.870 2.826 3.752) 11.841 12.671 ( 1.154 -4.501 -3.108) 5.590 13.000 ( 8.460 -3.820 -10.803) 14.243 13.332 ( 0.251 -0.484 -8.639) 8.656 13.836 ( -7.991 -5.250 2.474) 9.877 14.050 ( -3.041 7.461 -11.169) 13.772 14.473 ( 3.018 -1.295 -0.466) 3.317 14.926 ( -1.422 -5.411 2.103) 5.977 15.298 ( 0.760 -1.104 1.975) 2.387 15.478 ( -6.566 -1.774 -2.399) 7.212 15.678 ( -3.261 6.675 0.564) 7.450 16.078 ( 3.359 -0.417 6.615) 7.431 16.621 ( 0.312 -8.134 -7.488) 11.060 16.969 ( -0.774 -19.679 0.315) 19.697 17.869 ( -1.205 -4.563 -0.236) 4.725 18.119 ( -7.484 18.953 1.145) 20.409 18.530 ( -12.576 7.337 -1.328) 14.620 18.892 ( -5.419 11.914 -3.481) 13.544 19.435 ( 6.897 5.402 4.207) 9.719 19.962 ( 0.989 -10.347 3.998) 11.137 20.287 ( -0.586 -10.176 3.796) 10.876 20.730 ( 1.772 -0.927 -1.442) 2.465 22.083 ( 11.064 -15.196 -4.321) 19.288 23.113 ( 0.322 10.604 3.716) 11.240 23.850 ( 0.766 -5.473 -7.784) 9.546 ======================= Grid point 174 (67/146) ======================= q-point: ( 0.64 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.541 ( -17.992 -7.014 18.141) 26.495 5.625 ( -0.341 21.090 9.893) 23.297 6.028 ( -5.729 0.482 13.583) 14.750 6.386 ( 5.303 -8.756 -4.310) 11.107 7.037 ( -10.877 -0.374 1.379) 10.970 7.733 ( -22.662 -4.407 -2.920) 23.271 8.504 ( -7.318 1.407 -6.730) 10.041 9.164 ( 1.654 1.168 -6.056) 6.386 9.638 ( 1.617 7.594 10.642) 13.173 10.010 ( 3.110 6.583 7.624) 10.542 10.467 ( 9.171 11.656 7.129) 16.456 10.678 ( -0.405 -1.541 -6.910) 7.091 10.915 ( 3.561 -6.665 7.430) 10.598 11.164 ( 0.804 -0.740 -0.699) 1.297 11.437 ( 8.478 -1.785 1.944) 8.879 11.994 ( 1.722 -1.276 4.043) 4.576 12.380 ( -0.460 -3.200 -5.532) 6.408 12.478 ( -6.821 3.580 0.699) 7.735 12.635 ( 3.830 -0.385 -5.778) 6.942 13.045 ( 2.638 2.808 -5.893) 7.041 13.275 ( 2.703 -6.564 -6.159) 9.398 13.722 ( -1.719 -3.792 2.296) 4.755 14.026 ( -0.613 8.114 -7.151) 10.833 14.478 ( -1.903 -1.935 -0.263) 2.727 14.886 ( -3.479 0.575 2.215) 4.165 15.284 ( -0.675 -2.707 2.644) 3.844 15.507 ( 6.298 2.009 4.920) 8.240 15.667 ( -4.733 6.375 -0.502) 7.956 16.100 ( -2.324 -2.461 4.620) 5.728 16.609 ( 5.897 -0.575 -5.060) 7.791 16.777 ( 0.397 -17.611 -0.072) 17.616 17.807 ( -1.023 -4.109 -1.524) 4.501 18.062 ( -13.400 12.724 -2.681) 18.672 18.489 ( -3.790 7.284 2.649) 8.628 18.835 ( -8.129 2.333 -0.269) 8.461 19.605 ( 2.148 4.951 1.512) 5.605 19.863 ( -4.051 -8.993 4.405) 10.802 20.251 ( 4.805 -6.951 3.650) 9.205 20.756 ( 1.811 0.570 -0.649) 2.006 22.131 ( 13.525 -6.817 -9.092) 17.665 23.189 ( -6.166 7.720 4.336) 10.790 23.826 ( 7.629 -3.340 -4.905) 9.665 ======================= Grid point 175 (68/146) ======================= q-point: (-0.27 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.164 ( -30.685 -14.332 21.168) 39.938 5.688 ( -12.720 -0.358 1.602) 12.825 5.991 ( -0.591 -1.069 -2.800) 3.055 6.299 ( -4.350 -6.780 -14.560) 16.640 6.914 ( -5.990 -1.290 3.866) 7.245 7.410 ( -11.585 -1.086 12.797) 17.296 8.417 ( -2.346 0.982 -2.435) 3.521 9.160 ( -3.671 4.748 2.822) 6.632 9.634 ( -13.602 -0.814 7.672) 15.638 10.114 ( -0.177 4.373 3.735) 5.753 10.395 ( -19.373 2.502 -1.714) 19.609 10.598 ( -4.474 -4.339 -4.060) 7.438 10.903 ( -0.186 0.470 -3.239) 3.278 11.221 ( 0.474 -3.842 5.396) 6.641 11.648 ( 16.924 -2.823 0.947) 17.184 12.033 ( 2.386 -6.987 -8.661) 11.381 12.324 ( 0.555 1.439 4.569) 4.822 12.507 ( 3.607 8.166 0.128) 8.928 12.699 ( 2.700 5.295 -4.366) 7.375 13.035 ( -0.217 -2.741 1.195) 2.998 13.252 ( 7.016 -2.597 -4.459) 8.709 13.758 ( 4.636 2.550 -1.422) 5.479 14.081 ( -0.261 8.214 -1.151) 8.298 14.375 ( -3.256 -6.078 -0.343) 6.903 14.872 ( -2.815 4.381 0.729) 5.259 15.250 ( -2.252 -5.414 3.493) 6.825 15.604 ( 2.374 0.994 0.015) 2.574 15.738 ( 7.030 3.003 0.803) 7.687 16.079 ( -0.623 -3.482 4.799) 5.962 16.572 ( 1.622 -4.075 -4.624) 6.373 16.813 ( 9.880 0.083 0.567) 9.896 17.702 ( -4.301 -2.889 -7.982) 9.516 18.010 ( -7.876 6.714 8.654) 13.491 18.485 ( -3.153 1.429 0.505) 3.498 18.711 ( -4.456 -4.831 0.303) 6.579 19.584 ( -5.963 0.843 -0.080) 6.023 19.768 ( -4.169 -5.186 6.695) 9.440 20.344 ( 9.417 -2.153 -3.553) 10.293 20.783 ( 0.964 1.277 -0.186) 1.611 22.267 ( 10.353 4.774 -6.575) 13.161 23.112 ( -10.169 0.613 3.517) 10.777 23.963 ( 13.005 0.876 -3.166) 13.414 ======================= Grid point 176 (69/146) ======================= q-point: (-0.18 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.643 ( -35.647 -13.811 26.567) 46.554 5.207 ( -35.322 -16.111 -7.395) 39.521 5.805 ( 1.657 -10.952 -23.450) 25.934 6.207 ( 3.975 -3.467 0.758) 5.329 6.813 ( -4.147 -6.477 2.546) 8.101 7.459 ( -10.059 9.650 21.422) 25.558 8.402 ( -0.249 0.681 2.500) 2.603 9.099 ( -20.199 9.305 6.720) 23.232 9.426 ( -11.904 -0.244 16.785) 20.580 10.039 ( -9.254 -8.196 -4.680) 13.218 10.229 ( -7.751 8.823 3.197) 12.172 10.400 ( -9.925 -0.272 -7.420) 12.395 10.882 ( -4.315 7.080 -3.325) 8.933 11.164 ( -3.776 -7.408 5.780) 10.127 11.749 ( -6.421 -4.441 0.185) 7.809 11.923 ( 10.225 -7.074 -15.509) 19.878 12.338 ( -4.951 0.722 1.214) 5.148 12.583 ( -3.442 -1.829 0.978) 4.018 12.770 ( 1.243 8.346 -0.822) 8.478 13.126 ( 12.155 -3.494 4.991) 13.596 13.432 ( 14.274 7.016 -2.739) 16.139 13.847 ( 4.159 5.126 -3.185) 7.330 14.082 ( -1.454 -3.592 0.408) 3.897 14.339 ( 0.120 -2.842 3.556) 4.554 14.870 ( -0.078 3.390 3.001) 4.528 15.248 ( 6.035 -0.901 -1.516) 6.287 15.606 ( -0.296 -3.106 -1.228) 3.353 15.892 ( 7.534 4.921 -5.932) 10.778 16.049 ( 3.867 -9.147 0.509) 9.944 16.663 ( 8.670 7.078 -1.580) 11.303 16.978 ( 7.603 2.919 0.280) 8.149 17.571 ( -0.379 -5.553 -3.953) 6.827 17.909 ( -13.848 -5.633 9.812) 17.882 18.525 ( 5.079 6.388 -0.608) 8.184 18.607 ( -1.025 -10.618 1.137) 10.727 19.494 ( -6.997 2.729 -0.033) 7.510 19.721 ( -1.589 -3.476 6.617) 7.642 20.410 ( 6.108 -2.367 -8.591) 10.804 20.812 ( 1.086 1.549 -0.024) 1.892 22.425 ( 0.792 12.214 -0.850) 12.269 22.973 ( -6.721 -2.746 2.703) 7.747 24.174 ( 13.690 2.585 -4.612) 14.676 ======================= Grid point 177 (70/146) ======================= q-point: (-0.09 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.180 ( -32.830 -7.814 34.879) 48.533 4.307 ( -46.314 -19.868 -7.692) 50.979 5.701 ( 8.701 -3.107 -13.602) 16.443 6.245 ( 9.092 -13.872 1.817) 16.686 6.718 ( -0.447 -9.102 2.381) 9.419 7.348 ( -35.024 13.190 21.105) 42.966 8.471 ( 3.239 2.969 6.752) 8.056 8.911 ( -14.702 8.954 6.475) 18.391 9.460 ( -6.329 5.324 16.703) 18.639 9.767 ( -11.763 -5.963 0.113) 13.189 10.056 ( -12.501 -3.399 -4.007) 13.561 10.346 ( -6.859 13.883 1.906) 15.602 10.841 ( -8.354 6.955 0.474) 10.881 11.077 ( -3.314 -3.954 2.369) 5.677 11.520 ( -14.009 -1.454 -1.959) 14.220 11.877 ( -3.644 -4.483 -8.313) 10.124 12.232 ( -10.962 0.618 6.758) 12.893 12.500 ( -3.502 0.414 -0.850) 3.628 12.836 ( 1.232 3.977 -1.427) 4.401 13.344 ( 16.238 -4.109 0.760) 16.767 13.644 ( 7.143 3.001 -6.026) 9.815 13.903 ( 1.190 2.272 -8.382) 8.765 14.091 ( 8.326 -9.272 7.742) 14.671 14.275 ( -2.458 -8.382 3.021) 9.243 15.080 ( 13.182 8.546 5.226) 16.556 15.354 ( 9.353 0.063 -5.438) 10.819 15.560 ( -0.079 -1.308 -1.192) 1.772 15.911 ( 0.394 1.062 -11.199) 11.257 16.136 ( 13.792 -0.706 -8.064) 15.993 16.822 ( 3.244 0.783 0.293) 3.350 17.131 ( 8.407 5.651 1.085) 10.188 17.562 ( 5.721 -8.172 1.038) 10.029 17.711 ( -4.979 -7.036 7.252) 11.264 18.447 ( -1.837 -17.804 0.172) 17.899 18.715 ( 4.934 11.639 -0.224) 12.643 19.398 ( -8.230 3.150 -2.197) 9.082 19.752 ( 3.365 -3.148 8.442) 9.618 20.403 ( 2.846 -2.173 -6.598) 7.507 20.843 ( 1.639 1.033 -0.886) 2.130 22.443 ( -12.298 9.210 3.718) 15.808 22.936 ( 0.708 1.847 1.811) 2.682 24.366 ( 12.064 2.482 -8.184) 14.788 ======================= Grid point 183 (71/146) ======================= q-point: ( 0.45 0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.698 ( -0.000 12.806 18.964) 22.883 5.083 ( -0.000 24.397 10.289) 26.478 6.099 ( -0.000 -5.526 14.814) 15.811 6.519 ( -0.000 -11.819 -1.996) 11.987 7.526 ( 0.000 12.888 -3.859) 13.453 8.138 ( -0.000 25.546 25.681) 36.223 8.813 ( -0.000 1.349 4.143) 4.357 8.942 ( 0.000 6.283 -7.043) 9.438 9.402 ( 0.000 22.029 6.115) 22.862 9.580 ( -0.000 -9.803 5.255) 11.123 9.869 ( 0.000 16.037 3.953) 16.517 10.745 ( -0.000 3.776 7.702) 8.578 10.764 ( -0.000 -6.470 15.110) 16.437 10.998 ( 0.000 -15.721 -18.675) 24.411 11.055 ( -0.000 -1.874 7.066) 7.310 12.057 ( -0.000 -0.366 4.565) 4.579 12.507 ( 0.000 2.334 -3.796) 4.456 12.558 ( 0.000 -1.783 -5.459) 5.742 12.767 ( 0.000 -1.485 -5.191) 5.399 12.906 ( -0.000 3.877 6.498) 7.567 13.338 ( 0.000 3.523 -11.051) 11.599 14.020 ( 0.000 4.617 -5.931) 7.517 14.198 ( -0.000 -4.709 -1.393) 4.911 14.305 ( 0.000 -0.172 -6.340) 6.343 14.955 ( -0.000 -10.794 1.958) 10.970 15.283 ( 0.000 -3.165 -2.714) 4.169 15.643 ( 0.000 0.272 -5.509) 5.516 15.763 ( -0.000 6.594 3.293) 7.370 15.925 ( -0.000 0.575 6.662) 6.687 16.712 ( -0.000 -15.015 -3.982) 15.534 16.925 ( -0.000 -18.662 -2.478) 18.826 17.918 ( 0.000 1.623 -1.722) 2.366 18.194 ( 0.000 20.870 2.334) 21.000 18.791 ( 0.000 14.190 2.450) 14.400 19.002 ( 0.000 12.695 -9.686) 15.968 19.494 ( 0.000 5.875 -1.721) 6.122 19.704 ( -0.000 -16.670 7.224) 18.167 20.295 ( -0.000 -10.560 3.814) 11.227 20.724 ( 0.000 -2.973 -1.948) 3.554 21.903 ( -0.000 -20.450 3.538) 20.754 23.067 ( 0.000 10.220 1.890) 10.393 23.871 ( 0.000 -4.523 -7.100) 8.418 ======================= Grid point 184 (72/146) ======================= q-point: ( 0.55 0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.857 ( -4.314 3.533 18.109) 18.948 5.412 ( 9.973 18.852 3.327) 21.586 6.100 ( -2.323 -6.590 11.151) 13.160 6.373 ( -2.214 -12.910 -3.683) 13.606 7.496 ( -12.533 9.114 -2.978) 15.780 8.271 ( -7.880 2.615 -9.043) 12.277 8.801 ( -3.908 10.711 -10.112) 15.240 9.142 ( 0.520 8.495 14.660) 16.951 9.386 ( -0.536 1.643 4.266) 4.603 9.843 ( 9.152 13.307 16.118) 22.817 10.107 ( 7.428 13.525 8.887) 17.807 10.610 ( -1.218 -13.617 -11.387) 17.793 10.760 ( 0.054 -9.503 6.386) 11.450 10.958 ( 13.910 -6.215 -3.648) 15.666 11.178 ( 7.926 -1.716 10.400) 13.188 12.045 ( -3.566 -2.121 2.634) 4.914 12.430 ( -2.473 -0.164 -5.672) 6.190 12.515 ( 3.051 -2.306 -12.341) 12.920 12.790 ( -0.080 2.798 0.416) 2.830 12.948 ( -4.887 5.342 5.942) 9.366 13.286 ( -1.409 2.673 -10.198) 10.636 13.964 ( -8.590 0.597 -1.632) 8.764 14.072 ( -2.958 0.873 -7.291) 7.916 14.377 ( 6.131 -1.978 1.422) 6.597 14.913 ( 0.540 -3.833 6.927) 7.935 15.259 ( 2.166 -2.127 -0.281) 3.049 15.548 ( -5.431 -2.929 -4.186) 7.456 15.805 ( -3.086 8.032 1.110) 8.676 16.075 ( 6.018 5.857 6.890) 10.863 16.517 ( -3.342 -9.958 -5.187) 11.715 16.767 ( 2.056 -19.607 -0.680) 19.726 17.882 ( -3.998 0.245 -1.652) 4.333 18.382 ( -2.214 20.349 -2.909) 20.674 18.805 ( -12.906 6.261 -2.443) 14.551 19.032 ( -2.081 12.062 -9.886) 15.734 19.414 ( -0.849 -0.568 5.909) 5.996 19.821 ( 10.982 -6.779 6.090) 14.271 20.214 ( -0.282 -12.394 4.631) 13.234 20.693 ( 0.535 -1.442 -0.633) 1.663 21.787 ( 5.785 -15.982 1.113) 17.033 23.193 ( 2.897 9.069 0.841) 9.557 23.785 ( -2.030 -2.915 -3.385) 4.907 ======================= Grid point 185 (73/146) ======================= q-point: ( 0.64 0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.842 ( -11.769 -6.363 18.884) 23.143 5.711 ( 8.698 7.363 -6.880) 13.312 6.101 ( 4.414 -11.446 2.235) 12.469 6.159 ( -3.548 -6.894 -4.286) 8.859 7.290 ( -16.703 2.140 -0.314) 16.843 8.002 ( -16.986 -0.131 -11.044) 20.261 8.673 ( -12.538 3.949 -6.626) 14.720 9.131 ( 0.486 4.886 -4.063) 6.374 9.635 ( 10.652 -0.416 9.175) 14.064 10.092 ( 1.448 5.574 9.782) 11.352 10.388 ( 12.236 -8.027 -3.990) 15.168 10.582 ( 5.253 6.653 5.002) 9.842 10.753 ( 8.429 -10.100 5.570) 14.285 11.089 ( 9.102 -2.810 -1.258) 9.609 11.354 ( 5.872 1.690 8.499) 10.468 11.966 ( -2.152 -3.322 -1.566) 4.256 12.365 ( -2.725 0.187 -3.383) 4.348 12.485 ( 1.115 3.764 -9.540) 10.316 12.717 ( -8.338 1.298 2.479) 8.795 13.021 ( 5.128 4.241 0.235) 6.659 13.213 ( -4.813 2.700 -5.038) 7.473 13.786 ( -8.824 -3.942 1.802) 9.832 14.050 ( 0.999 6.718 -7.033) 9.777 14.431 ( 2.740 -2.896 -0.107) 3.988 14.957 ( -0.886 0.337 5.161) 5.248 15.276 ( 0.432 -2.126 0.241) 2.183 15.464 ( 1.394 -1.010 2.568) 3.092 15.814 ( -5.076 5.263 -1.202) 7.410 16.181 ( -3.528 1.607 4.789) 6.162 16.477 ( 7.410 0.586 -1.327) 7.551 16.615 ( 0.384 -14.636 0.915) 14.670 17.796 ( -3.938 -1.289 -2.757) 4.977 18.363 ( -13.538 10.471 -7.147) 18.548 18.654 ( -7.779 6.153 -2.031) 10.124 18.958 ( -6.894 -0.369 -6.155) 9.249 19.557 ( 8.503 2.805 1.644) 9.103 19.893 ( -1.289 -2.444 7.153) 7.668 20.132 ( 1.535 -12.802 4.859) 13.779 20.719 ( 3.014 0.258 0.299) 3.040 21.844 ( 12.226 -2.451 -0.096) 12.469 23.296 ( 1.693 2.326 -1.466) 3.229 23.735 ( -0.809 1.518 1.048) 2.015 ======================= Grid point 186 (74/146) ======================= q-point: (-0.27 -0.55 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.599 ( -21.802 -12.936 17.683) 30.909 5.638 ( 0.034 -14.373 -24.280) 28.215 5.853 ( -2.769 -19.867 -3.178) 20.310 6.274 ( 1.776 4.519 -1.393) 5.052 7.059 ( -11.333 -3.216 0.908) 11.815 7.685 ( -14.089 4.576 -1.214) 14.863 8.500 ( -7.578 3.318 -3.997) 9.188 9.246 ( 5.002 8.424 2.272) 10.057 9.739 ( 0.053 -6.868 8.399) 10.850 10.149 ( -0.110 -3.797 2.208) 4.394 10.440 ( 11.508 -13.328 -7.246) 19.041 10.608 ( 0.496 1.574 -6.506) 6.712 10.859 ( 0.881 -3.298 2.061) 3.988 11.191 ( 3.664 -1.615 5.991) 7.206 11.477 ( -0.441 2.742 5.054) 5.767 11.901 ( 0.715 -5.958 -4.348) 7.411 12.351 ( 0.269 4.073 1.173) 4.247 12.469 ( 2.431 3.987 -5.974) 7.583 12.737 ( 1.555 4.972 5.040) 7.248 13.105 ( -5.011 0.968 -1.913) 5.451 13.147 ( 3.133 7.165 -1.421) 7.948 13.713 ( 1.294 -0.195 1.728) 2.167 14.137 ( 3.722 9.644 -1.590) 10.459 14.377 ( -5.058 -4.819 -3.172) 7.673 14.938 ( -1.947 1.387 -0.359) 2.417 15.258 ( -1.060 -5.062 3.350) 6.162 15.547 ( 5.021 -2.406 3.056) 6.351 15.730 ( -4.782 0.832 -0.592) 4.890 16.134 ( -4.682 -3.906 3.345) 6.955 16.500 ( 2.041 0.298 -1.993) 2.868 16.707 ( 8.054 5.532 4.785) 10.880 17.689 ( -4.781 -2.057 -6.362) 8.220 18.231 ( -6.890 7.008 -0.721) 9.854 18.538 ( -7.136 -5.802 -2.288) 9.478 18.775 ( -8.448 -2.398 -4.334) 9.793 19.629 ( 0.236 -2.276 -1.271) 2.617 19.878 ( -5.156 -0.952 8.430) 9.927 20.129 ( 7.510 -4.825 -1.597) 9.068 20.772 ( 2.163 0.879 0.613) 2.414 22.112 ( 14.945 10.119 1.225) 18.090 23.235 ( -5.021 -5.746 -1.636) 7.805 23.830 ( 5.502 6.653 2.312) 8.938 ======================= Grid point 187 (75/146) ======================= q-point: (-0.18 0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.180 ( -26.446 -14.209 15.333) 33.710 5.235 ( -6.576 -25.057 -23.390) 34.903 5.609 ( -5.401 -15.707 -4.106) 17.110 6.170 ( -7.978 -5.969 -3.235) 10.476 6.844 ( -8.109 -8.768 -1.200) 12.004 7.739 ( 2.257 15.123 8.624) 17.555 8.441 ( -1.770 3.227 -1.020) 3.819 9.393 ( -1.601 4.816 3.586) 6.214 9.660 ( -6.735 -6.210 13.487) 16.304 10.053 ( -3.563 -9.759 -3.360) 10.919 10.399 ( 0.635 -4.004 -7.110) 8.185 10.573 ( -12.600 11.052 5.645) 17.685 10.868 ( 7.733 -0.143 -7.311) 10.642 11.201 ( -2.100 -5.835 2.816) 6.811 11.469 ( 5.679 -7.343 -5.928) 11.013 11.811 ( -2.583 -5.484 -2.215) 6.454 12.408 ( 0.890 3.709 0.808) 3.899 12.593 ( 4.815 4.593 -0.155) 6.656 12.728 ( -1.636 -7.747 0.425) 7.930 13.126 ( -0.309 11.083 2.164) 11.297 13.332 ( 9.842 11.569 0.560) 15.199 13.797 ( 5.405 2.290 0.438) 5.886 14.144 ( -11.387 -7.600 -2.462) 13.910 14.303 ( 4.805 4.930 1.523) 7.051 14.934 ( -0.826 1.542 0.049) 1.750 15.191 ( -1.037 -2.980 0.886) 3.277 15.554 ( -0.015 -3.631 -0.816) 3.721 15.766 ( 5.894 0.612 1.178) 6.042 16.010 ( -4.321 -6.628 0.670) 7.941 16.626 ( 6.205 11.882 -1.156) 13.455 16.908 ( 6.700 5.197 4.133) 9.433 17.528 ( -5.090 -3.849 -6.978) 9.456 18.108 ( -13.148 -12.419 4.303) 18.591 18.460 ( 5.198 2.535 -1.071) 5.881 18.603 ( -6.173 -3.146 -2.445) 7.348 19.576 ( -2.223 -1.878 -1.040) 3.090 19.818 ( -6.005 -1.824 6.516) 9.047 20.214 ( 7.478 -0.081 -5.904) 9.528 20.809 ( 1.057 0.951 0.478) 1.501 22.465 ( 11.138 16.013 1.888) 19.597 23.058 ( -7.318 -8.065 0.230) 10.893 24.016 ( 8.132 6.724 0.078) 10.552 ======================= Grid point 188 (76/146) ======================= q-point: (-0.09 0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.767 ( -23.401 -9.592 19.345) 31.841 4.659 ( -25.299 -21.456 -9.145) 34.409 5.418 ( 3.407 -8.581 -7.241) 11.734 5.988 ( 1.787 -18.557 0.800) 18.660 6.665 ( -3.198 -9.331 0.628) 9.884 7.946 ( -6.122 16.292 9.238) 19.704 8.488 ( 2.785 3.989 2.768) 5.597 9.229 ( -14.429 -5.963 1.553) 15.690 9.689 ( -4.998 4.465 11.992) 13.738 9.861 ( -5.676 -5.691 -5.422) 9.695 10.307 ( -10.953 7.771 3.220) 13.810 10.552 ( -8.780 10.076 9.572) 16.439 10.954 ( 3.575 2.206 -4.891) 6.448 11.105 ( -2.294 -1.709 -1.749) 3.353 11.489 ( 14.607 -13.715 -10.749) 22.738 11.697 ( -5.372 -2.746 -0.729) 6.078 12.405 ( -6.836 0.781 2.292) 7.252 12.541 ( -4.108 -3.477 2.104) 5.779 12.792 ( 9.226 2.765 -6.424) 11.577 13.235 ( 0.006 5.284 6.337) 8.251 13.580 ( 6.384 8.743 -1.921) 10.995 13.861 ( -2.640 -1.660 -7.037) 7.697 13.952 ( 4.584 -7.188 6.556) 10.754 14.298 ( -5.324 -7.635 1.229) 9.389 15.040 ( 7.043 10.422 2.877) 12.904 15.208 ( 4.356 0.086 -2.918) 5.244 15.517 ( 0.652 -2.621 -1.644) 3.162 15.832 ( 1.850 -1.316 -6.641) 7.019 15.969 ( 4.287 2.197 0.247) 4.824 16.809 ( 2.657 4.906 0.632) 5.615 17.066 ( 6.471 6.637 -0.340) 9.276 17.429 ( 2.021 -5.410 0.340) 5.785 17.784 ( -10.502 -14.208 2.840) 17.895 18.352 ( -5.600 -15.428 -0.029) 16.413 18.723 ( 7.721 13.318 -0.272) 15.397 19.517 ( -4.284 0.120 -0.942) 4.388 19.759 ( -2.076 -3.134 5.188) 6.407 20.277 ( 4.850 0.207 -4.524) 6.636 20.829 ( 0.595 0.480 -0.323) 0.830 22.699 ( -3.915 10.885 2.099) 11.757 22.928 ( 1.147 -1.837 0.723) 2.283 24.191 ( 7.961 4.877 -3.503) 9.972 ======================= Grid point 195 (77/146) ======================= q-point: ( 0.55 0.55 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.014 ( -0.000 -3.359 19.054) 19.348 5.441 ( 0.000 8.875 -5.724) 10.561 6.063 ( -0.000 -13.078 0.575) 13.091 6.270 ( 0.000 -8.617 -3.932) 9.471 7.648 ( 0.000 6.522 -7.234) 9.740 8.242 ( 0.000 4.567 -23.053) 23.501 8.964 ( 0.000 8.626 -9.113) 12.548 9.093 ( -0.000 -0.069 5.504) 5.505 9.482 ( -0.000 -9.904 8.737) 13.207 10.000 ( 0.000 8.022 -1.060) 8.092 10.137 ( -0.000 -6.442 5.168) 8.259 10.481 ( -0.000 11.794 12.964) 17.527 10.678 ( -0.000 -16.179 3.668) 16.589 10.795 ( 0.000 -0.813 -2.200) 2.346 11.167 ( -0.000 -3.486 15.031) 15.430 12.080 ( -0.000 -3.130 1.642) 3.534 12.410 ( 0.000 4.516 -10.220) 11.173 12.430 ( 0.000 2.149 -4.265) 4.776 12.770 ( 0.000 -0.476 -4.980) 5.003 13.087 ( -0.000 0.890 5.412) 5.484 13.300 ( 0.000 9.061 -6.215) 10.988 13.996 ( 0.000 5.638 -10.985) 12.348 14.125 ( -0.000 -2.479 0.547) 2.538 14.286 ( -0.000 -3.814 2.877) 4.777 14.955 ( -0.000 -0.996 14.259) 14.294 15.221 ( -0.000 -0.329 -0.008) 0.329 15.526 ( 0.000 -2.078 -7.266) 7.558 15.897 ( 0.000 2.296 -0.020) 2.296 16.106 ( -0.000 6.462 4.465) 7.854 16.463 ( 0.000 -4.857 -1.599) 5.113 16.592 ( -0.000 -11.860 0.962) 11.899 17.927 ( 0.000 1.446 -1.841) 2.341 18.520 ( 0.000 16.249 -10.916) 19.575 18.927 ( 0.000 1.247 -7.038) 7.148 19.038 ( 0.000 2.529 -10.379) 10.683 19.544 ( 0.000 3.058 -3.307) 4.504 19.667 ( -0.000 -1.732 19.681) 19.757 20.128 ( -0.000 -13.680 4.775) 14.489 20.680 ( -0.000 -0.364 0.382) 0.527 21.644 ( -0.000 -8.884 5.978) 10.708 23.212 ( 0.000 3.036 -3.833) 4.890 23.800 ( -0.000 1.966 2.827) 3.444 ======================= Grid point 196 (78/146) ======================= q-point: (-0.36 -0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.020 ( -6.263 -12.707 17.425) 22.457 5.473 ( 8.563 -7.690 -13.658) 17.860 5.890 ( -0.322 -17.636 -8.645) 19.643 6.189 ( -1.321 4.372 -4.280) 6.260 7.518 ( -12.416 0.002 -8.274) 14.920 8.085 ( -4.032 -2.066 -21.052) 21.534 8.789 ( -9.013 4.227 -11.449) 15.172 9.227 ( -8.295 -4.092 1.150) 9.321 9.421 ( 15.082 -4.513 4.058) 16.257 9.893 ( 13.474 -24.884 -9.143) 29.738 10.210 ( 0.128 3.441 -0.184) 3.448 10.532 ( 0.198 -15.265 -0.901) 15.293 10.782 ( 1.148 5.400 9.332) 10.842 10.944 ( 8.282 13.633 16.564) 22.996 11.311 ( 9.550 -1.840 15.878) 18.620 11.999 ( -5.154 -3.431 -0.922) 6.260 12.390 ( -2.198 5.301 -4.996) 7.609 12.492 ( 2.651 8.413 -3.731) 9.577 12.725 ( 2.032 -2.832 -8.549) 9.233 13.045 ( -4.407 -3.759 4.741) 7.485 13.355 ( -3.639 12.641 -0.597) 13.168 13.942 ( -12.486 -2.735 0.068) 12.782 14.020 ( 2.208 7.467 -9.915) 12.607 14.358 ( 6.079 -2.988 3.117) 7.456 15.018 ( -3.616 0.295 9.294) 9.978 15.263 ( 1.573 0.237 4.536) 4.806 15.464 ( -0.254 2.097 -4.836) 5.277 15.861 ( -1.555 -2.828 -3.146) 4.507 16.192 ( 4.294 -7.345 2.584) 8.892 16.443 ( -0.940 6.349 1.271) 6.543 16.575 ( 0.136 3.641 5.185) 6.338 17.866 ( -6.104 0.936 -2.614) 6.706 18.508 ( -3.485 0.675 -14.402) 14.833 18.791 ( -8.452 3.594 -11.559) 14.763 18.968 ( -2.266 -2.679 -4.224) 5.491 19.494 ( -0.324 -0.041 0.502) 0.599 19.923 ( 6.823 2.184 13.941) 15.674 20.030 ( 0.327 -10.242 2.401) 10.524 20.694 ( 0.875 1.121 1.332) 1.948 21.716 ( 7.085 2.618 8.239) 11.177 23.203 ( 3.214 -3.627 -6.726) 8.290 23.849 ( -2.784 6.484 7.349) 10.188 ======================= Grid point 197 (79/146) ======================= q-point: (-0.27 -0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.750 ( -11.259 -25.461 -4.172) 28.151 5.325 ( 0.685 -23.572 -9.673) 25.489 5.679 ( -0.153 -14.117 -5.048) 14.994 6.280 ( 3.623 10.877 -4.175) 12.201 7.206 ( -14.651 -6.228 -7.756) 17.708 7.841 ( -6.440 -3.575 -13.359) 15.255 8.620 ( -8.079 2.840 -9.877) 13.073 9.127 ( 7.830 -5.632 -5.879) 11.296 9.653 ( 9.786 -6.656 6.707) 13.604 9.885 ( 14.773 -18.146 -2.175) 23.500 10.204 ( 1.561 -4.550 -0.281) 4.819 10.431 ( 6.260 -8.824 -9.168) 14.181 10.831 ( 2.360 -1.827 -2.748) 4.057 11.194 ( 1.354 1.436 12.422) 12.578 11.586 ( 5.489 1.207 16.727) 17.646 11.875 ( -5.568 -2.021 -2.206) 6.321 12.389 ( -0.067 3.997 -3.956) 5.624 12.514 ( -3.582 4.086 -1.938) 5.769 12.714 ( 3.255 0.020 -2.515) 4.113 13.075 ( 5.724 4.294 5.226) 8.860 13.364 ( -11.109 11.987 0.666) 16.357 13.754 ( -6.002 -0.525 0.960) 6.101 14.110 ( 5.283 9.503 -7.803) 13.383 14.414 ( -0.837 -0.882 3.657) 3.854 14.962 ( -4.180 -0.089 -2.744) 5.001 15.264 ( -2.343 -2.263 2.842) 4.323 15.528 ( 1.739 3.433 5.793) 6.954 15.775 ( -2.062 -4.186 -1.950) 5.058 16.140 ( -1.102 -10.604 3.313) 11.164 16.525 ( 0.197 11.056 -0.206) 11.059 16.733 ( 3.401 11.401 7.530) 14.081 17.751 ( -6.949 1.684 -4.369) 8.379 18.291 ( -4.489 -8.716 -10.677) 14.496 18.600 ( -9.648 -2.340 -5.080) 11.152 18.866 ( -6.728 1.446 -6.133) 9.218 19.511 ( 5.751 -6.574 -2.328) 9.039 19.911 ( -2.234 -5.227 0.278) 5.691 20.131 ( 0.851 5.153 10.534) 11.758 20.745 ( 2.545 1.500 1.342) 3.244 22.004 ( 13.738 10.749 7.194) 18.868 23.149 ( 1.988 -8.305 -6.387) 10.664 23.933 ( -2.186 9.598 8.487) 12.997 ======================= Grid point 198 (80/146) ======================= q-point: (-0.18 -0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.219 ( -7.379 -30.370 -24.418) 39.661 5.005 ( -4.416 -33.084 4.291) 33.652 5.542 ( -4.931 -6.764 2.046) 8.617 6.283 ( -9.678 1.435 -5.291) 11.123 6.895 ( -10.364 -7.908 -5.312) 14.077 7.751 ( 7.461 1.706 -8.507) 11.443 8.495 ( -3.772 3.502 -6.445) 8.248 9.228 ( 16.326 -11.960 -6.743) 21.332 9.689 ( 3.132 -7.206 0.345) 7.864 9.920 ( 3.921 -12.487 4.018) 13.691 10.222 ( 7.269 -6.474 0.366) 9.740 10.456 ( 11.983 -2.937 -14.395) 18.959 10.848 ( 3.538 1.375 -0.206) 3.801 11.198 ( -3.892 -5.950 4.099) 8.207 11.636 ( -9.712 0.600 11.092) 14.756 11.762 ( -3.104 -3.884 -1.525) 5.201 12.383 ( 2.044 -0.978 -2.463) 3.347 12.564 ( 1.917 3.257 2.504) 4.533 12.736 ( 1.186 -2.538 1.793) 3.326 13.238 ( -4.605 7.433 -5.802) 10.494 13.348 ( 3.849 15.378 5.867) 16.903 13.763 ( 2.213 1.886 4.404) 5.277 14.176 ( -2.917 0.694 -8.505) 9.018 14.363 ( -4.107 1.381 2.566) 5.036 14.923 ( 1.257 2.562 -2.286) 3.657 15.219 ( -3.193 0.704 1.538) 3.613 15.564 ( -2.649 -1.577 3.344) 4.548 15.759 ( 1.011 0.734 6.595) 6.712 16.031 ( -4.654 -5.053 1.479) 7.027 16.659 ( 3.083 13.119 -1.169) 13.527 16.926 ( 3.220 8.837 5.572) 10.932 17.593 ( -9.912 0.314 -5.586) 11.382 18.081 ( -3.194 -17.495 -7.202) 19.188 18.475 ( -2.413 3.290 3.221) 5.198 18.687 ( -9.367 -1.361 -5.913) 11.160 19.514 ( 4.334 -6.470 -2.006) 8.041 19.839 ( -1.177 -2.626 -4.030) 4.952 20.228 ( -2.425 6.178 7.977) 10.377 20.802 ( 1.637 1.243 1.015) 2.292 22.390 ( 15.849 11.656 3.069) 19.911 23.036 ( -1.693 -8.780 -3.533) 9.614 24.060 ( -0.091 10.539 6.659) 12.467 ======================= Grid point 207 (81/146) ======================= q-point: (-0.36 -0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.006 ( -0.000 -26.149 10.035) 28.008 5.156 ( 0.000 -21.963 -17.404) 28.023 5.700 ( 0.000 -8.320 -11.681) 14.341 6.231 ( 0.000 11.463 -6.846) 13.351 7.547 ( 0.000 -2.604 -13.202) 13.456 7.797 ( 0.000 -21.872 -28.532) 35.951 9.000 ( -0.000 -7.926 0.503) 7.942 9.026 ( 0.000 8.104 -6.997) 10.707 9.412 ( 0.000 -18.096 -16.696) 24.621 9.455 ( -0.000 -6.007 9.835) 11.524 10.143 ( 0.000 -8.193 -10.707) 13.482 10.435 ( -0.000 -11.783 5.117) 12.846 10.717 ( 0.000 -3.246 -3.158) 4.529 11.241 ( -0.000 -9.458 14.248) 17.102 11.337 ( -0.000 20.263 31.841) 37.742 12.000 ( -0.000 -4.818 -0.762) 4.878 12.432 ( 0.000 -1.155 -11.499) 11.557 12.463 ( 0.000 2.386 -4.919) 5.467 12.671 ( 0.000 10.997 -3.459) 11.528 13.060 ( -0.000 -7.623 6.018) 9.712 13.512 ( 0.000 13.197 2.289) 13.394 13.988 ( 0.000 7.299 -7.840) 10.712 14.131 ( 0.000 2.729 0.179) 2.735 14.227 ( 0.000 -0.682 -0.254) 0.728 15.191 ( -0.000 0.450 16.190) 16.196 15.284 ( -0.000 4.404 2.860) 5.251 15.444 ( 0.000 6.739 -7.495) 10.079 15.799 ( 0.000 -6.864 -3.898) 7.893 16.072 ( -0.000 -11.131 3.587) 11.695 16.547 ( 0.000 10.959 1.831) 11.111 16.706 ( -0.000 13.426 7.028) 15.155 17.923 ( 0.000 1.015 -1.817) 2.081 18.340 ( 0.000 -12.840 -18.075) 22.171 18.809 ( 0.000 6.379 -17.868) 18.973 18.943 ( -0.000 -5.483 1.045) 5.581 19.519 ( 0.000 -0.502 -4.463) 4.491 19.922 ( -0.000 -8.537 16.993) 19.017 20.009 ( 0.000 6.239 0.802) 6.290 20.723 ( -0.000 2.919 2.231) 3.674 21.769 ( -0.000 6.373 11.825) 13.433 23.084 ( 0.000 -5.954 -7.483) 9.563 23.997 ( -0.000 7.935 10.033) 12.792 ======================= Grid point 208 (82/146) ======================= q-point: (-0.27 -0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.525 ( -12.542 -34.910 -25.433) 44.976 4.939 ( 9.275 -36.844 -5.524) 38.393 5.608 ( -0.069 -1.928 -0.554) 2.007 6.320 ( 1.115 14.351 -6.619) 15.843 7.270 ( -9.398 -12.070 -14.940) 21.383 7.520 ( 10.481 -24.548 -21.585) 34.328 8.728 ( -11.981 1.988 -7.866) 14.470 8.986 ( -6.889 -12.240 -9.177) 16.778 9.392 ( 16.694 -4.513 -1.358) 17.346 9.585 ( 11.945 -3.165 2.531) 12.613 10.024 ( 6.586 -10.245 -10.500) 16.081 10.315 ( -4.627 -11.793 4.418) 13.417 10.712 ( 4.681 -4.384 -3.159) 7.149 11.248 ( 1.238 -7.625 11.370) 13.746 11.617 ( 0.528 -3.249 16.430) 16.756 11.925 ( -2.178 -3.697 -0.311) 4.302 12.317 ( 2.464 -5.256 -12.319) 13.618 12.448 ( 5.027 -4.444 -7.086) 9.759 12.794 ( -4.804 12.759 3.826) 14.160 13.087 ( 4.140 4.517 8.474) 10.457 13.607 ( -3.104 6.138 5.160) 8.599 13.920 ( -12.316 4.439 -0.386) 13.097 14.124 ( 0.634 16.081 -6.109) 17.214 14.368 ( 7.084 1.678 0.003) 7.280 15.126 ( -12.519 5.399 -0.198) 13.635 15.316 ( -2.368 2.104 2.085) 3.792 15.580 ( 3.265 5.778 7.065) 9.693 15.721 ( 0.996 -4.345 -1.580) 4.730 16.049 ( 3.830 -8.824 7.373) 12.120 16.660 ( -1.488 13.639 1.124) 13.766 16.880 ( -0.103 14.233 5.883) 15.401 17.855 ( -6.258 2.206 -3.696) 7.595 18.109 ( 0.518 -16.890 -12.914) 21.268 18.688 ( -6.044 2.595 -13.779) 15.268 18.906 ( -1.242 -1.481 -1.265) 2.310 19.413 ( -3.922 -5.703 -2.136) 7.243 19.913 ( -1.405 -2.599 0.203) 2.962 20.183 ( 6.707 5.622 9.180) 12.684 20.762 ( -0.471 3.352 2.413) 4.157 21.968 ( 7.880 6.932 9.501) 14.157 22.999 ( 2.055 -6.529 -6.241) 9.263 24.125 ( -2.147 9.262 11.249) 14.728 ======================= Grid point 209 (83/146) ======================= q-point: (-0.18 -0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.776 ( -8.488 -37.694 -41.171) 56.462 4.647 ( 4.997 -47.316 2.589) 47.650 5.644 ( 0.613 1.524 7.178) 7.364 6.392 ( -2.826 8.024 -5.607) 10.189 6.942 ( -9.039 -8.315 -9.504) 15.529 7.360 ( 14.717 -23.952 -19.270) 34.082 8.540 ( -5.903 1.412 -10.306) 11.961 8.827 ( 7.344 -9.708 -5.878) 13.518 9.474 ( 8.471 -6.704 -11.813) 16.007 9.792 ( 8.320 -6.696 7.769) 13.206 10.066 ( 12.132 -3.990 -5.560) 13.929 10.177 ( 2.111 -11.859 1.393) 12.126 10.735 ( 6.125 -3.499 -2.234) 7.399 11.222 ( -3.370 -7.698 1.999) 8.638 11.562 ( 2.151 -15.448 2.959) 15.875 11.894 ( -0.408 -3.768 5.196) 6.432 12.260 ( 5.268 -7.488 -7.904) 12.095 12.474 ( 8.802 -6.900 -5.542) 12.482 12.797 ( -7.312 7.063 7.123) 12.413 13.322 ( 3.996 13.087 2.214) 13.861 13.585 ( -8.534 4.708 8.038) 12.633 13.834 ( -5.305 7.692 3.186) 9.872 14.225 ( -2.880 10.476 -6.003) 12.413 14.404 ( -2.341 -0.772 -2.983) 3.870 15.006 ( -7.098 10.527 -2.862) 13.015 15.323 ( -3.271 6.137 3.198) 7.654 15.596 ( -1.306 -3.458 0.890) 3.802 15.799 ( 2.020 2.460 10.782) 11.242 16.095 ( -1.157 0.758 9.285) 9.387 16.759 ( -1.440 12.101 -0.059) 12.186 17.025 ( 0.054 11.142 2.921) 11.519 17.739 ( -9.175 1.956 -4.703) 10.494 17.891 ( -0.162 -12.806 -9.709) 16.071 18.570 ( -3.129 3.283 -2.075) 4.987 18.781 ( -9.910 -3.697 -4.993) 11.697 19.347 ( 4.900 -7.191 -0.254) 8.705 19.849 ( -3.748 1.563 -5.611) 6.927 20.353 ( 1.405 3.383 8.525) 9.279 20.805 ( 0.615 2.661 1.740) 3.238 22.234 ( 13.647 2.454 2.894) 14.165 22.946 ( 1.556 -4.244 -3.599) 5.778 24.250 ( -2.839 11.001 10.715) 15.617 ======================= Grid point 219 (84/146) ======================= q-point: (-0.27 -0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.215 ( 0.000 -40.494 -26.444) 48.364 4.323 ( 0.000 -36.884 -24.149) 44.086 5.534 ( -0.000 -16.367 0.871) 16.390 6.420 ( 0.000 17.407 -7.358) 18.898 6.881 ( 0.000 -36.392 -11.639) 38.208 7.265 ( 0.000 -5.509 -16.754) 17.636 8.764 ( 0.000 -6.005 -16.003) 17.093 9.034 ( 0.000 -0.646 -2.916) 2.987 9.065 ( 0.000 -6.804 -7.651) 10.239 9.494 ( -0.000 -0.920 4.615) 4.706 9.799 ( 0.000 -11.132 -7.910) 13.656 10.286 ( -0.000 -13.132 5.150) 14.106 10.607 ( -0.000 -5.789 -0.801) 5.844 11.212 ( -0.000 -11.385 12.337) 16.788 11.620 ( -0.000 -16.380 5.697) 17.343 11.843 ( 0.000 -9.540 -7.818) 12.335 12.129 ( 0.000 -6.604 -17.180) 18.406 12.294 ( -0.000 -10.564 -2.226) 10.796 13.069 ( -0.000 21.311 7.373) 22.550 13.116 ( -0.000 2.122 9.051) 9.296 13.648 ( -0.000 -6.257 5.230) 8.155 14.140 ( 0.000 11.795 -0.237) 11.797 14.212 ( 0.000 6.317 -2.121) 6.663 14.372 ( 0.000 21.277 -3.624) 21.583 15.270 ( 0.000 8.221 -7.887) 11.393 15.423 ( -0.000 4.563 4.586) 6.469 15.658 ( 0.000 -2.648 -1.264) 2.934 15.688 ( -0.000 8.671 16.741) 18.854 16.004 ( -0.000 -3.752 11.214) 11.825 16.817 ( 0.000 15.427 0.577) 15.438 17.032 ( 0.000 11.426 2.767) 11.756 17.859 ( 0.000 -12.631 -12.103) 17.494 17.928 ( 0.000 1.692 -1.032) 1.982 18.639 ( 0.000 1.547 -18.759) 18.823 18.901 ( -0.000 -3.204 5.865) 6.683 19.411 ( 0.000 -4.121 -5.493) 6.867 19.903 ( -0.000 -1.208 0.028) 1.208 20.213 ( -0.000 5.007 6.337) 8.076 20.825 ( -0.000 4.236 2.502) 4.919 21.995 ( -0.000 0.289 7.097) 7.103 22.902 ( 0.000 -3.651 -3.856) 5.310 24.306 ( -0.000 9.316 12.827) 15.853 ======================= Grid point 220 (85/146) ======================= q-point: (-0.18 -0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.353 ( -19.013 -40.178 -43.989) 62.536 4.035 ( 14.171 -46.867 -11.432) 50.279 5.399 ( 16.959 -31.428 -5.372) 36.113 6.472 ( -3.469 5.864 -2.377) 7.216 6.717 ( 9.238 -12.137 -4.164) 15.811 7.057 ( -5.361 -5.838 -14.043) 16.125 8.565 ( -5.754 -1.021 -13.151) 14.391 8.760 ( -8.907 -2.861 -8.082) 12.363 9.193 ( 10.276 -7.755 -7.343) 14.821 9.602 ( 11.137 -2.589 0.437) 11.443 9.766 ( 11.795 -7.281 -2.021) 14.008 10.136 ( -5.498 -15.338 5.810) 17.298 10.591 ( 4.777 -6.161 -0.466) 7.810 11.184 ( -0.505 -11.234 6.659) 13.069 11.420 ( -2.074 -18.616 -0.874) 18.752 11.710 ( 6.246 -17.297 -7.445) 19.840 12.002 ( 6.980 -9.583 -17.102) 20.810 12.250 ( 5.549 -8.580 1.791) 10.374 13.063 ( -10.561 4.566 7.579) 13.777 13.382 ( 6.462 12.229 2.928) 14.138 13.623 ( 2.857 -7.815 5.993) 10.255 14.111 ( -9.678 10.860 0.107) 14.547 14.273 ( -0.035 1.900 -4.166) 4.579 14.562 ( -5.448 24.208 0.169) 24.814 15.242 ( -8.996 13.650 -7.006) 17.786 15.458 ( -2.003 4.998 4.914) 7.289 15.596 ( -4.062 0.327 1.288) 4.274 15.888 ( 0.980 4.077 14.211) 14.817 16.182 ( 6.191 8.318 17.024) 19.933 16.917 ( -4.421 12.344 -0.747) 13.133 17.127 ( 0.740 8.366 -1.243) 8.490 17.713 ( -0.457 -4.712 -6.979) 8.433 17.894 ( -5.650 2.915 -3.559) 7.286 18.550 ( 2.602 1.748 -13.271) 13.636 18.885 ( -7.007 -3.105 5.214) 9.269 19.275 ( -3.217 -6.044 -0.921) 6.908 19.877 ( -1.862 1.808 -6.429) 6.933 20.347 ( 6.068 2.054 5.218) 8.262 20.861 ( -1.703 3.627 2.135) 4.540 22.057 ( 7.619 -6.647 1.798) 10.269 22.880 ( 1.601 -0.609 -1.526) 2.294 24.464 ( -1.807 10.356 12.825) 16.583 ======================= Grid point 231 (86/146) ======================= q-point: (-0.18 -0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.001 ( 0.000 -39.917 -44.423) 59.723 3.235 ( 0.000 -44.441 -27.047) 52.024 4.697 ( -0.000 -67.269 -3.216) 67.346 6.553 ( -0.000 -4.087 10.034) 10.834 6.636 ( 0.000 14.238 -6.870) 15.809 6.971 ( 0.000 -2.897 -14.048) 14.344 8.530 ( 0.000 3.873 -14.709) 15.211 8.833 ( 0.000 -6.056 -6.800) 9.106 8.946 ( -0.000 -5.252 -0.954) 5.338 9.510 ( 0.000 -0.445 -0.742) 0.865 9.545 ( -0.000 -10.908 -2.583) 11.209 10.081 ( -0.000 -16.765 5.505) 17.645 10.483 ( -0.000 -8.328 1.386) 8.443 11.154 ( -0.000 -12.094 11.493) 16.684 11.205 ( -0.000 -25.265 -1.457) 25.307 11.442 ( 0.000 -14.072 -13.834) 19.733 11.698 ( 0.000 -11.924 -21.641) 24.709 12.162 ( -0.000 -7.645 6.062) 9.757 13.270 ( 0.000 -12.672 -4.974) 13.613 13.284 ( -0.000 3.926 6.741) 7.801 13.608 ( -0.000 4.686 4.595) 6.563 14.262 ( -0.000 4.017 1.894) 4.441 14.268 ( 0.000 4.486 -5.163) 6.839 14.887 ( 0.000 28.757 3.707) 28.995 15.392 ( 0.000 16.350 -10.536) 19.451 15.477 ( -0.000 -3.001 1.926) 3.566 15.783 ( -0.000 11.480 6.899) 13.394 16.006 ( -0.000 3.949 13.918) 14.467 16.341 ( -0.000 15.395 20.729) 25.820 17.106 ( 0.000 16.128 -1.330) 16.183 17.118 ( 0.000 1.757 -4.129) 4.488 17.693 ( 0.000 4.230 -3.557) 5.527 17.957 ( 0.000 2.433 -0.815) 2.566 18.404 ( 0.000 -0.732 -18.411) 18.426 19.004 ( -0.000 -0.095 14.883) 14.884 19.233 ( 0.000 -6.853 -5.963) 9.084 19.853 ( 0.000 0.294 -7.308) 7.314 20.338 ( -0.000 3.017 2.177) 3.720 20.924 ( -0.000 3.357 1.516) 3.684 21.907 ( -0.000 -13.019 0.259) 13.022 22.863 ( 0.000 0.363 0.004) 0.363 24.656 ( -0.000 9.772 13.291) 16.497 ======================= Grid point 268 (87/146) ======================= q-point: ( 0.18 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 146 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.890 ( -0.000 0.000 47.261) 47.261 1.890 ( -0.000 0.000 47.261) 47.261 3.888 ( -0.000 0.000 97.332) 97.332 6.860 ( -0.000 0.000 4.851) 4.851 6.860 ( -0.000 0.000 4.851) 4.851 6.956 ( -0.000 0.000 0.222) 0.222 8.729 ( 0.000 -0.000 -7.923) 7.923 8.729 ( 0.000 -0.000 -7.923) 7.923 9.082 ( -0.000 0.000 5.846) 5.846 9.401 ( -0.000 0.000 1.517) 1.517 9.401 ( -0.000 0.000 1.517) 1.517 9.926 ( -0.000 0.000 26.213) 26.213 10.109 ( -0.000 0.000 10.135) 10.135 10.109 ( -0.000 0.000 10.135) 10.135 10.948 ( -0.000 0.000 6.056) 6.056 11.574 ( -0.000 0.000 22.019) 22.019 11.574 ( -0.000 0.000 22.019) 22.019 12.205 ( -0.000 0.000 7.591) 7.591 12.205 ( -0.000 0.000 7.591) 7.591 13.517 ( 0.000 0.000 0.963) 0.963 13.517 ( -0.000 0.000 0.963) 0.963 14.321 ( 0.000 -0.000 -0.067) 0.067 14.321 ( -0.000 0.000 -0.067) 0.067 14.687 ( 0.000 -0.000 -35.106) 35.106 15.316 ( 0.000 -0.000 -2.862) 2.862 15.629 ( 0.000 -0.000 -18.780) 18.780 16.120 ( 0.000 -0.000 -12.866) 12.866 16.120 ( 0.000 -0.000 -12.866) 12.866 17.192 ( 0.000 -0.000 -9.068) 9.068 17.535 ( 0.000 -0.000 -6.065) 6.065 17.535 ( 0.000 -0.000 -6.065) 6.065 18.058 ( 0.000 0.000 -0.327) 0.327 18.058 ( 0.000 -0.000 -0.327) 0.327 18.285 ( 0.000 -0.000 -11.710) 11.710 18.831 ( -0.000 0.000 1.297) 1.297 18.831 ( -0.000 0.000 1.297) 1.297 19.807 ( -0.000 0.000 17.636) 17.636 20.949 ( 0.000 -0.000 -2.888) 2.888 20.949 ( 0.000 -0.000 -2.888) 2.888 21.227 ( -0.000 0.000 11.542) 11.542 22.841 ( -0.000 0.000 8.337) 8.337 24.770 ( 0.000 -0.000 -6.243) 6.243 ======================= Grid point 269 (88/146) ======================= q-point: ( 0.27 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.056 ( 3.567 2.059 43.377) 43.572 2.735 ( 28.415 16.405 45.307) 55.940 4.684 ( 18.842 10.878 85.151) 87.886 6.761 ( -6.435 -3.715 3.677) 8.290 6.960 ( 2.212 1.277 4.357) 5.050 6.970 ( 0.004 0.002 0.754) 0.754 8.570 ( -8.402 -4.851 -6.727) 11.806 8.656 ( -1.581 -0.913 -7.063) 7.295 9.206 ( 7.994 4.615 6.358) 11.209 9.293 ( -1.819 -1.050 1.116) 2.378 9.646 ( 10.298 5.945 4.190) 12.608 9.994 ( -1.608 -0.928 20.390) 20.474 10.288 ( 5.878 3.394 11.088) 13.000 10.374 ( 14.418 8.324 16.804) 23.655 10.999 ( 1.151 0.665 6.530) 6.664 11.623 ( -3.517 -2.031 21.804) 22.179 11.878 ( 8.251 4.764 21.046) 23.102 12.243 ( 3.303 1.907 3.638) 5.271 12.392 ( 7.179 4.145 9.893) 12.907 13.399 ( -2.936 -1.695 -7.512) 8.242 13.693 ( 7.802 4.504 4.140) 9.914 14.198 ( -6.037 -3.486 -3.878) 7.977 14.311 ( -2.244 -1.296 -10.729) 11.037 14.559 ( 6.262 3.615 -28.523) 29.425 15.311 ( 1.342 0.775 -3.090) 3.457 15.537 ( 1.047 0.604 -13.914) 13.966 15.773 ( -19.224 -11.099 -10.182) 24.422 16.074 ( -0.396 -0.228 -12.595) 12.604 16.985 ( -9.667 -5.581 -7.324) 13.350 17.401 ( -7.489 -4.324 -5.269) 10.126 17.585 ( 1.663 0.960 -4.936) 5.297 17.931 ( -7.858 -4.537 -2.179) 9.331 18.040 ( 0.419 0.242 -3.933) 3.963 18.262 ( 1.988 1.148 -8.336) 8.647 18.818 ( 1.855 1.071 0.880) 2.316 18.847 ( -3.178 -1.835 4.013) 5.439 19.981 ( 5.520 3.187 12.679) 14.191 20.780 ( -10.196 -5.887 0.671) 11.793 20.917 ( -0.850 -0.490 -3.073) 3.226 21.520 ( 15.323 8.847 9.159) 19.923 22.942 ( 3.536 2.042 7.419) 8.469 24.649 ( -6.214 -3.588 -9.157) 11.634 ======================= Grid point 270 (89/146) ======================= q-point: ( 0.36 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.547 ( 17.500 10.104 35.108) 40.508 3.554 ( 18.463 10.659 52.505) 56.668 5.675 ( 28.282 16.328 48.193) 58.216 6.637 ( -8.151 -4.706 4.334) 10.361 6.932 ( -4.830 -2.789 2.623) 6.163 7.049 ( 0.324 0.187 23.008) 23.011 8.408 ( 1.463 0.845 -14.265) 14.365 8.605 ( 1.067 0.616 -5.047) 5.196 9.335 ( 4.844 2.797 0.517) 5.617 9.363 ( -0.239 -0.138 10.042) 10.046 9.879 ( 10.484 6.053 2.242) 12.312 10.248 ( 13.625 7.867 16.572) 22.851 10.482 ( 5.968 3.446 8.921) 11.273 10.783 ( 12.312 7.108 14.170) 20.072 11.086 ( 2.972 1.716 6.972) 7.771 11.718 ( -0.256 -0.148 23.101) 23.103 12.135 ( 5.165 2.982 11.777) 13.201 12.313 ( 1.844 1.064 -2.084) 2.979 12.664 ( 10.832 6.254 15.461) 19.887 13.283 ( -1.200 -0.693 -15.758) 15.819 13.836 ( 0.283 0.163 0.413) 0.526 14.057 ( -1.698 -0.980 -3.277) 3.819 14.129 ( -4.314 -2.491 -24.343) 24.847 14.478 ( -2.290 -1.322 -12.756) 13.027 15.305 ( -15.371 -8.874 -3.557) 18.102 15.330 ( 2.090 1.207 -2.870) 3.750 15.508 ( 0.912 0.526 -8.869) 8.931 15.945 ( -4.204 -2.427 -11.986) 12.931 16.735 ( -9.889 -5.709 -5.268) 12.575 17.160 ( -12.707 -7.336 -0.879) 14.699 17.490 ( -6.155 -3.554 -4.561) 8.445 17.748 ( -6.310 -3.643 -4.682) 8.661 18.057 ( -0.484 -0.280 1.224) 1.346 18.236 ( 0.924 0.533 -8.026) 8.097 18.797 ( -1.791 -1.034 2.420) 3.184 18.894 ( 4.109 2.372 1.190) 4.891 20.158 ( 3.370 1.945 9.394) 10.168 20.594 ( -7.579 -4.376 1.609) 8.898 20.875 ( -1.151 -0.665 -3.015) 3.295 21.910 ( 15.512 8.956 8.335) 19.756 23.045 ( 1.695 0.979 5.308) 5.657 24.423 ( -7.332 -4.233 -13.381) 15.834 ======================= Grid point 271 (90/146) ======================= q-point: ( 0.45 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.202 ( 24.002 13.858 28.014) 39.407 4.195 ( 8.558 4.941 56.018) 56.883 6.187 ( 1.429 0.825 8.550) 8.708 6.431 ( -15.085 -8.709 5.439) 18.248 6.834 ( -5.920 -3.418 7.005) 9.787 7.426 ( 13.542 7.818 38.426) 41.486 8.518 ( 18.312 10.573 -11.595) 24.116 8.638 ( 4.357 2.515 -4.051) 6.459 9.357 ( -4.518 -2.608 9.645) 10.965 9.483 ( 8.076 4.662 0.514) 9.339 10.092 ( 9.403 5.429 -4.558) 11.776 10.648 ( 5.395 3.115 4.716) 7.813 10.687 ( 14.745 8.513 13.906) 21.983 11.032 ( 6.944 4.009 4.514) 9.202 11.212 ( 4.324 2.497 7.539) 9.043 11.898 ( 0.037 0.021 23.232) 23.232 12.261 ( 2.657 1.534 3.873) 4.941 12.323 ( 2.893 1.670 -1.924) 3.855 13.006 ( 10.416 6.014 14.934) 19.175 13.088 ( -8.563 -4.944 -18.585) 21.051 13.659 ( -9.283 -5.360 -11.851) 15.979 13.861 ( -2.332 -1.347 -24.055) 24.205 14.118 ( 2.960 1.709 3.949) 5.223 14.346 ( -4.606 -2.660 -1.725) 5.592 15.086 ( -5.766 -3.329 0.326) 6.666 15.353 ( 1.221 0.705 -1.527) 2.079 15.467 ( -0.225 -0.130 -6.802) 6.807 15.752 ( -6.500 -3.753 -10.993) 13.311 16.524 ( -6.606 -3.814 -3.146) 8.251 16.888 ( -12.642 -7.299 2.988) 14.900 17.324 ( -5.825 -3.363 -5.456) 8.661 17.627 ( -2.137 -1.234 -3.921) 4.633 17.951 ( -10.261 -5.924 4.804) 12.785 18.220 ( -0.380 -0.220 -1.388) 1.456 18.852 ( 6.720 3.880 -2.135) 8.048 18.996 ( 4.421 2.553 2.050) 5.501 20.213 ( -3.291 -1.900 8.040) 8.893 20.478 ( -5.059 -2.921 1.972) 6.166 20.831 ( -1.159 -0.669 -2.768) 3.074 22.274 ( 14.040 8.106 6.340) 17.408 23.061 ( -2.260 -1.305 0.101) 2.612 24.205 ( -3.912 -2.259 -14.130) 14.835 ======================= Grid point 272 (91/146) ======================= q-point: ( 0.55 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.889 ( 24.113 13.922 22.897) 36.048 4.579 ( -6.231 -3.598 47.632) 48.173 6.072 ( -21.493 -12.409 7.669) 25.976 6.134 ( -8.376 -4.836 19.299) 21.587 6.795 ( -3.617 -2.088 11.649) 12.375 7.760 ( 6.812 3.933 -10.456) 13.084 8.720 ( 5.399 3.117 -3.368) 7.086 8.910 ( 8.778 5.068 9.988) 14.231 9.394 ( 5.572 3.217 5.669) 8.575 9.647 ( 6.123 3.535 0.853) 7.122 10.251 ( 10.703 6.180 -4.839) 13.273 10.768 ( 4.313 2.490 -0.390) 4.995 10.897 ( 0.815 0.470 -1.461) 1.738 11.215 ( 5.891 3.401 4.569) 8.195 11.353 ( 3.908 2.256 7.852) 9.056 11.917 ( -7.508 -4.335 16.643) 18.766 12.312 ( 0.860 0.497 0.078) 0.996 12.460 ( 5.472 3.159 3.730) 7.338 12.790 ( -3.885 -2.243 -8.885) 9.953 13.199 ( -1.105 -0.638 -2.258) 2.593 13.406 ( -3.480 -2.009 -8.550) 9.448 13.801 ( 8.184 4.725 -18.198) 20.506 14.162 ( -1.841 -1.063 4.579) 5.049 14.256 ( -5.013 -2.894 4.093) 7.090 14.990 ( -4.663 -2.692 1.013) 5.479 15.357 ( -0.196 -0.113 -0.529) 0.575 15.443 ( 2.851 1.646 -4.599) 5.656 15.571 ( -3.967 -2.291 -5.339) 7.035 16.425 ( -1.725 -0.996 -1.498) 2.492 16.681 ( -8.216 -4.743 1.635) 9.626 17.175 ( -4.494 -2.595 -7.078) 8.776 17.614 ( 1.792 1.035 0.525) 2.135 17.770 ( -8.711 -5.030 6.709) 12.091 18.179 ( -4.528 -2.614 5.452) 7.554 19.012 ( 9.092 5.249 -4.457) 11.405 19.104 ( 3.992 2.305 3.522) 5.801 20.147 ( -7.731 -4.463 7.754) 11.824 20.381 ( -4.539 -2.620 1.371) 5.417 20.795 ( -0.533 -0.308 -2.435) 2.512 22.574 ( 11.174 6.451 2.096) 13.072 22.944 ( -6.181 -3.569 -7.931) 10.670 24.106 ( 2.133 1.232 -9.285) 9.607 ======================= Grid point 273 (92/146) ======================= q-point: (-0.36 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.435 ( 10.555 6.094 19.106) 22.662 4.489 ( -26.015 -15.020 35.038) 46.152 5.712 ( -13.976 -8.069 10.922) 19.487 6.204 ( -1.134 -0.654 29.482) 29.511 6.818 ( -2.617 -1.511 15.067) 15.367 7.623 ( -5.697 -3.289 -30.784) 31.479 8.817 ( 5.282 3.050 -1.983) 6.414 8.936 ( -7.254 -4.188 8.445) 11.894 9.422 ( -8.382 -4.840 -5.685) 11.225 9.729 ( 0.966 0.558 0.329) 1.163 10.378 ( -4.492 -2.593 -8.138) 9.650 10.754 ( -6.288 -3.631 -1.476) 7.409 10.810 ( 0.676 0.390 -4.094) 4.168 11.462 ( 1.315 0.759 7.062) 7.223 11.494 ( 18.192 10.503 11.231) 23.820 11.905 ( -1.142 -0.659 15.262) 15.319 12.285 ( -3.508 -2.025 -1.565) 4.343 12.489 ( -1.915 -1.106 -2.252) 3.156 12.933 ( 14.792 8.540 3.609) 17.458 12.944 ( -9.742 -5.625 -20.016) 22.961 13.403 ( 1.308 0.755 -3.733) 4.027 13.907 ( 9.007 5.200 -10.376) 14.691 14.097 ( -6.182 -3.569 5.025) 8.729 14.190 ( -3.251 -1.877 5.161) 6.382 14.898 ( -4.166 -2.405 1.847) 5.153 15.356 ( 1.878 1.084 -2.399) 3.234 15.551 ( 1.607 0.928 3.911) 4.328 15.563 ( 10.359 5.981 -2.529) 12.226 16.393 ( -1.292 -0.746 -1.824) 2.357 16.565 ( -2.451 -1.415 -1.140) 3.052 17.053 ( -1.445 -0.834 -8.735) 8.893 17.692 ( -3.919 -2.263 9.200) 10.253 17.694 ( 3.813 2.202 3.889) 5.875 18.114 ( -5.887 -3.399 11.023) 12.950 19.142 ( 5.804 3.351 -6.435) 9.291 19.205 ( 2.638 1.523 5.327) 6.136 19.977 ( -11.579 -6.685 6.562) 14.894 20.345 ( 0.546 0.315 0.524) 0.820 20.783 ( 0.879 0.508 -2.079) 2.314 22.685 ( -3.325 -1.920 -20.815) 21.167 22.793 ( 1.342 0.775 6.154) 6.346 24.170 ( 7.704 4.448 -5.087) 10.248 ======================= Grid point 274 (93/146) ======================= q-point: (-0.27 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.035 ( -35.666 -20.592 35.029) 54.065 4.402 ( -23.408 -13.514 18.016) 32.483 5.801 ( 13.627 7.868 12.540) 20.121 6.300 ( -5.451 -3.147 4.123) 7.524 6.869 ( -2.443 -1.410 16.877) 17.111 7.198 ( -18.503 -10.683 -13.177) 25.102 8.741 ( -16.125 -9.310 2.484) 18.784 8.914 ( 4.066 2.348 0.402) 4.713 9.080 ( -13.123 -7.577 -3.090) 15.465 9.694 ( -3.615 -2.087 -1.723) 4.516 10.081 ( -12.416 -7.168 -7.978) 16.407 10.638 ( -6.936 -4.005 -1.875) 8.226 10.745 ( -3.667 -2.117 -4.589) 6.244 11.482 ( -3.159 -1.824 4.613) 5.881 11.661 ( -6.957 -4.016 11.522) 14.046 12.107 ( -12.468 -7.198 -3.587) 14.837 12.207 ( -3.968 -2.291 5.546) 7.194 12.512 ( 22.079 12.747 6.357) 26.275 12.625 ( -7.684 -4.436 -17.985) 20.054 13.358 ( -1.583 -0.914 -8.013) 8.219 13.359 ( 21.224 12.253 6.711) 25.409 13.967 ( -1.102 -0.636 -1.904) 2.290 14.045 ( -0.491 -0.283 5.658) 5.687 14.232 ( 6.302 3.638 -1.035) 7.350 14.885 ( 2.363 1.364 4.245) 5.046 15.417 ( 4.976 2.873 -2.500) 6.267 15.621 ( 1.412 0.815 3.460) 3.825 15.805 ( 13.148 7.591 -5.134) 16.026 16.324 ( -2.668 -1.540 -5.424) 6.238 16.591 ( 5.852 3.379 0.007) 6.757 17.027 ( 3.624 2.093 -7.325) 8.436 17.676 ( -4.920 -2.840 11.738) 13.041 17.803 ( 3.718 2.147 4.042) 5.896 18.114 ( -1.219 -0.704 15.132) 15.197 19.161 ( 0.952 0.550 -9.525) 9.589 19.275 ( 0.087 0.050 6.648) 6.649 19.811 ( -6.800 -3.926 6.908) 10.458 20.373 ( 1.627 0.939 -2.230) 2.915 20.808 ( 2.564 1.480 -1.702) 3.415 22.416 ( -8.292 -4.788 -16.089) 18.723 22.860 ( 1.186 0.684 0.965) 1.675 24.339 ( 10.583 6.110 -5.304) 13.321 ======================= Grid point 275 (94/146) ======================= q-point: (-0.18 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.491 ( -37.486 -21.643 40.968) 59.598 3.872 ( -35.451 -20.468 21.527) 46.251 5.810 ( -35.689 -20.605 -21.328) 46.402 6.246 ( 18.242 10.532 10.124) 23.370 6.789 ( -15.780 -9.111 2.408) 18.380 6.925 ( -2.573 -1.486 16.690) 16.953 8.468 ( -7.281 -4.204 8.540) 11.984 8.912 ( -6.246 -3.606 5.511) 9.076 8.979 ( 0.495 0.286 2.659) 2.720 9.579 ( -4.604 -2.658 -3.289) 6.251 9.784 ( -11.787 -6.805 -4.364) 14.292 10.410 ( -11.893 -6.866 -6.078) 15.018 10.621 ( -5.392 -3.113 -2.419) 6.679 11.390 ( -6.506 -3.756 -1.649) 7.691 11.537 ( -12.518 -7.228 12.403) 19.047 11.738 ( -18.344 -10.591 -1.375) 21.227 11.909 ( -17.791 -10.271 5.077) 21.161 12.377 ( -7.918 -4.572 -10.157) 13.666 13.097 ( 19.355 11.175 6.833) 23.370 13.285 ( 0.788 0.455 -8.663) 8.711 13.720 ( -2.583 -1.491 -2.305) 3.769 14.014 ( 15.455 8.923 7.969) 19.544 14.137 ( 4.576 2.642 5.437) 7.582 14.424 ( 14.724 8.501 -3.765) 17.413 15.068 ( 10.451 6.034 7.773) 14.355 15.503 ( 2.836 1.637 -2.270) 3.984 15.657 ( 3.384 1.954 -1.992) 4.385 15.986 ( 7.297 4.213 -10.550) 13.502 16.264 ( 4.302 2.484 -13.418) 14.308 16.804 ( 12.565 7.255 1.952) 14.640 17.075 ( 2.853 1.647 -2.096) 3.905 17.645 ( -3.161 -1.825 9.276) 9.969 17.895 ( 2.823 1.630 2.508) 4.113 18.250 ( 2.610 1.507 18.717) 18.958 19.090 ( -0.206 -0.119 -12.195) 12.197 19.288 ( -3.065 -1.770 6.834) 7.696 19.789 ( -0.665 -0.384 8.899) 8.932 20.361 ( -0.172 -0.099 -5.922) 5.926 20.864 ( 3.417 1.973 -1.435) 4.199 22.150 ( -9.309 -5.375 -8.295) 13.578 22.866 ( -0.162 -0.093 -0.620) 0.648 24.523 ( 10.499 6.062 -8.699) 14.922 ======================= Grid point 280 (95/146) ======================= q-point: ( 0.27 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.539 ( -0.000 22.539 40.817) 46.627 2.925 ( -0.000 29.208 40.381) 49.837 5.192 ( -0.000 8.082 86.376) 86.753 6.801 ( -0.000 -5.425 5.586) 7.787 6.911 ( 0.000 0.068 -3.017) 3.018 7.009 ( 0.000 5.108 -1.765) 5.404 8.602 ( 0.000 0.050 -5.263) 5.263 8.692 ( 0.000 3.072 -1.418) 3.384 9.030 ( -0.000 -8.266 4.024) 9.193 9.446 ( -0.000 5.240 3.226) 6.154 9.594 ( 0.000 9.222 -1.888) 9.413 10.214 ( -0.000 0.948 22.201) 22.221 10.255 ( -0.000 -0.052 19.175) 19.175 10.520 ( -0.000 14.357 17.359) 22.527 11.034 ( -0.000 0.006 6.789) 6.789 11.768 ( -0.000 -1.577 19.402) 19.466 12.053 ( -0.000 13.237 19.732) 23.761 12.200 ( -0.000 -6.015 9.845) 11.537 12.526 ( -0.000 14.833 7.967) 16.837 13.338 ( 0.000 -8.861 -4.566) 9.968 13.647 ( 0.000 0.996 -6.217) 6.296 14.141 ( 0.000 -1.430 -12.453) 12.535 14.325 ( 0.000 10.094 -31.888) 33.447 14.381 ( 0.000 3.074 -2.855) 4.196 15.290 ( 0.000 1.558 -3.205) 3.563 15.466 ( 0.000 2.562 -9.560) 9.897 15.854 ( 0.000 -13.464 -11.896) 17.967 15.864 ( 0.000 -6.397 -8.637) 10.749 16.875 ( 0.000 -15.785 -11.136) 19.318 17.443 ( 0.000 -3.645 -5.231) 6.376 17.497 ( 0.000 0.145 -3.625) 3.628 17.874 ( 0.000 -6.826 -4.783) 8.335 18.029 ( 0.000 -3.344 -2.135) 3.967 18.269 ( 0.000 8.510 -7.997) 11.678 18.716 ( -0.000 -7.151 2.208) 7.484 19.001 ( 0.000 10.282 1.374) 10.373 20.032 ( -0.000 0.502 12.132) 12.142 20.780 ( -0.000 -9.936 -0.806) 9.969 20.910 ( 0.000 -0.471 -3.339) 3.372 21.569 ( -0.000 15.523 10.802) 18.912 22.981 ( -0.000 1.394 8.249) 8.366 24.579 ( 0.000 -10.030 -8.887) 13.401 ======================= Grid point 281 (96/146) ======================= q-point: ( 0.36 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.921 ( -7.045 30.755 36.029) 47.892 3.687 ( 21.693 23.916 40.425) 51.737 5.834 ( 8.402 6.732 56.216) 57.237 6.740 ( -6.449 -2.243 5.093) 8.519 6.962 ( 1.794 -0.919 5.874) 6.210 7.106 ( 9.633 6.998 8.522) 14.642 8.466 ( -13.780 1.387 -3.287) 14.234 8.631 ( -3.924 5.401 -2.954) 7.301 9.195 ( 14.186 -1.425 3.185) 14.609 9.443 ( -2.033 4.878 0.492) 5.307 9.774 ( 10.482 4.185 -0.918) 11.323 10.280 ( -0.955 4.118 19.348) 19.805 10.524 ( 5.930 5.542 15.468) 17.468 10.817 ( 6.710 8.736 19.520) 22.414 11.098 ( 2.685 0.443 6.850) 7.370 11.876 ( -0.094 2.148 16.601) 16.739 12.174 ( -1.807 -1.194 11.318) 11.523 12.342 ( 2.905 7.436 8.243) 11.475 12.733 ( 3.072 11.453 12.881) 17.508 13.190 ( -2.103 -5.203 -11.542) 12.834 13.629 ( 10.013 -9.647 -15.526) 20.842 14.042 ( -3.386 0.286 -13.993) 14.400 14.151 ( -8.728 10.961 -19.105) 23.692 14.429 ( 2.677 3.172 -7.769) 8.808 15.296 ( 0.903 1.707 -3.060) 3.618 15.426 ( -7.114 -1.129 -8.102) 10.841 15.500 ( -7.785 -5.550 -0.699) 9.587 15.830 ( 2.760 -7.674 -9.243) 12.326 16.639 ( -0.613 -18.537 -9.316) 20.755 17.266 ( -9.240 -6.756 -2.063) 11.631 17.476 ( -0.550 -5.872 -2.499) 6.406 17.777 ( -5.670 -3.221 -3.241) 7.282 18.014 ( 5.054 2.951 -4.833) 7.590 18.277 ( -2.503 7.181 -6.150) 9.780 18.695 ( 1.675 -6.080 1.237) 6.427 19.049 ( -5.413 10.174 2.045) 11.705 20.146 ( 5.513 -1.272 8.852) 10.506 20.648 ( -4.658 -7.670 -0.256) 8.977 20.864 ( -1.398 -1.248 -3.191) 3.701 21.869 ( 9.416 13.804 10.370) 19.666 23.048 ( 1.744 -1.754 6.211) 6.685 24.372 ( -4.554 -11.061 -11.123) 16.334 ======================= Grid point 282 (97/146) ======================= q-point: ( 0.45 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.396 ( 3.379 31.230 30.699) 43.922 4.444 ( 14.630 13.713 46.857) 50.968 6.155 ( 3.772 -3.036 10.756) 11.796 6.623 ( -9.638 -2.254 3.181) 10.397 6.955 ( -5.201 1.560 5.049) 7.415 7.636 ( 11.983 9.661 46.323) 48.814 8.318 ( 3.101 9.042 -9.875) 13.744 8.622 ( -1.340 5.419 -3.792) 6.748 9.345 ( 5.226 -1.906 -0.341) 5.574 9.519 ( 1.827 7.364 4.737) 8.945 9.952 ( 9.221 1.494 -0.789) 9.375 10.537 ( 13.564 5.827 9.825) 17.733 10.712 ( 0.479 8.034 7.092) 10.727 11.044 ( 2.318 -0.246 13.087) 13.293 11.225 ( 5.562 3.245 7.579) 9.945 12.048 ( 3.567 3.339 17.005) 17.693 12.191 ( -0.266 -3.639 8.054) 8.842 12.421 ( -3.677 8.768 0.051) 9.508 12.927 ( 2.610 -5.128 0.668) 5.793 13.119 ( 2.456 7.134 0.468) 7.560 13.531 ( 4.604 -10.496 -22.416) 25.176 13.815 ( -10.817 4.979 -21.884) 24.914 14.058 ( 0.509 -1.883 -3.934) 4.391 14.429 ( -2.051 4.316 -2.553) 5.418 15.163 ( -7.758 -5.434 -0.274) 9.476 15.333 ( 0.839 1.973 -2.615) 3.381 15.469 ( -2.490 2.032 -0.976) 3.358 15.708 ( -2.396 -5.962 -7.290) 9.717 16.420 ( 0.746 -16.722 -5.695) 17.681 17.022 ( -9.962 -9.409 -1.340) 13.768 17.375 ( -4.885 -2.384 -2.116) 5.833 17.641 ( -5.620 0.182 -1.241) 5.758 18.096 ( -0.721 0.133 1.139) 1.354 18.238 ( -4.553 8.194 -5.672) 10.956 18.676 ( 5.144 -6.113 -0.815) 8.031 19.103 ( -1.600 10.962 3.286) 11.555 20.245 ( 1.949 -3.941 6.499) 7.847 20.520 ( -3.552 -4.670 0.121) 5.869 20.813 ( -0.512 -1.949 -2.877) 3.512 22.206 ( 10.556 9.562 9.063) 16.882 23.054 ( -0.446 -5.534 1.070) 5.654 24.134 ( -3.608 -7.195 -12.469) 14.841 ======================= Grid point 283 (98/146) ======================= q-point: ( 0.55 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.966 ( 10.076 27.265 25.913) 38.941 4.949 ( -0.681 1.893 46.317) 46.361 6.146 ( -3.374 -11.094 10.447) 15.608 6.446 ( -11.895 1.502 3.004) 12.360 6.936 ( -4.581 2.462 8.358) 9.844 7.775 ( -11.881 2.181 0.334) 12.084 8.616 ( 2.898 -1.023 -4.743) 5.651 8.840 ( 24.608 16.888 16.714) 34.207 9.367 ( 2.074 -3.076 1.021) 3.848 9.685 ( 1.957 12.634 7.952) 15.056 10.095 ( 9.926 1.893 -1.731) 10.253 10.767 ( 0.195 2.081 -3.043) 3.691 10.835 ( 7.672 5.913 1.144) 9.753 11.117 ( 4.254 -3.361 6.528) 8.485 11.415 ( 4.796 6.691 6.809) 10.683 12.109 ( -6.675 -5.864 15.652) 17.998 12.275 ( 4.132 1.361 2.321) 4.930 12.455 ( 0.039 4.334 1.045) 4.458 12.755 ( -5.026 -6.533 -8.457) 11.810 13.249 ( -1.406 1.315 -7.398) 7.645 13.356 ( 1.145 -3.384 -9.515) 10.164 13.655 ( -0.118 12.334 -17.555) 21.455 14.045 ( 4.728 -9.959 0.675) 11.045 14.420 ( -4.535 4.349 3.403) 7.146 15.034 ( -4.299 -5.278 0.968) 6.876 15.341 ( 1.005 -0.593 -0.255) 1.195 15.420 ( -1.875 0.379 -2.944) 3.511 15.592 ( -3.768 -1.144 -1.113) 4.092 16.306 ( 3.320 -10.741 -1.384) 11.327 16.788 ( -6.976 -6.622 -4.064) 10.442 17.240 ( -7.697 -0.943 -4.840) 9.141 17.601 ( -2.788 2.674 3.126) 4.970 17.976 ( -11.018 0.416 3.916) 11.700 18.250 ( -0.820 2.655 1.326) 3.079 18.758 ( 10.864 -4.303 -1.778) 11.819 19.230 ( 0.301 12.974 3.549) 13.454 20.215 ( -2.956 -6.962 4.782) 8.948 20.433 ( -3.927 -4.225 1.462) 5.951 20.778 ( 0.072 -1.167 -2.444) 2.709 22.468 ( 9.242 2.449 2.412) 9.860 22.952 ( -4.226 -3.550 -4.298) 6.996 24.002 ( 2.039 -2.553 -9.571) 10.113 ======================= Grid point 284 (99/146) ======================= q-point: ( 0.64 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.464 ( 5.213 8.368 23.670) 25.641 5.036 ( -16.186 0.803 32.866) 36.644 5.965 ( -15.780 -8.749 12.939) 22.203 6.426 ( -2.936 2.641 15.973) 16.454 6.957 ( -3.027 0.459 11.617) 12.014 7.526 ( -10.006 0.118 -19.916) 22.288 8.611 ( 6.734 -8.628 -4.835) 11.965 9.199 ( -4.524 11.410 9.101) 15.281 9.380 ( 1.848 -7.907 -0.622) 8.144 9.834 ( -4.921 9.473 6.463) 12.479 10.331 ( 7.007 4.101 -1.282) 8.220 10.730 ( 0.679 -2.704 -3.941) 4.828 10.872 ( -6.015 3.859 -1.377) 7.278 11.264 ( 13.911 -1.105 4.403) 14.633 11.558 ( 4.002 6.580 3.960) 8.660 12.031 ( -5.818 -5.253 15.174) 17.079 12.322 ( -0.392 2.768 -1.900) 3.381 12.451 ( -0.039 -3.938 -3.329) 5.157 12.723 ( 6.349 -1.147 -4.589) 7.917 13.033 ( -6.327 4.067 -17.171) 18.746 13.382 ( 1.477 1.733 -3.338) 4.040 13.753 ( 7.441 10.566 -10.038) 16.364 14.002 ( 2.515 -14.538 2.357) 14.941 14.396 ( -7.399 3.927 6.414) 10.550 14.923 ( -2.757 -7.476 2.243) 8.278 15.353 ( -1.290 1.217 0.668) 1.895 15.449 ( 6.591 3.793 -2.603) 8.038 15.574 ( 0.486 0.499 6.379) 6.417 16.277 ( 3.235 -7.987 0.712) 8.647 16.648 ( -3.001 1.080 -6.940) 7.638 17.056 ( -7.102 -1.838 -8.722) 11.397 17.608 ( -0.367 -1.681 5.353) 5.622 17.908 ( -4.894 4.930 7.264) 10.052 18.258 ( -4.288 1.388 8.375) 9.511 18.879 ( 11.136 -6.685 -1.393) 13.063 19.365 ( -1.874 12.487 2.969) 12.971 20.088 ( -7.047 -10.070 4.386) 13.050 20.358 ( -1.889 -1.104 1.185) 2.488 20.762 ( 0.467 0.130 -2.195) 2.248 22.506 ( 3.697 -6.597 -17.264) 18.848 22.888 ( -3.873 4.974 5.034) 8.067 24.024 ( 8.135 0.117 -6.435) 10.373 ======================= Grid point 285 (100/146) ======================= q-point: (-0.27 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.362 ( -21.340 -29.802 30.597) 47.747 5.054 ( -24.079 16.278 21.696) 36.270 5.833 ( -0.728 4.070 12.089) 12.776 6.369 ( -9.684 -5.514 -10.567) 15.357 6.984 ( -1.194 -3.929 12.474) 13.133 7.319 ( -8.690 -0.076 5.251) 10.154 8.611 ( 7.548 -12.975 -0.931) 15.040 9.101 ( -17.496 -6.568 0.281) 18.690 9.290 ( -8.450 7.239 6.206) 12.740 9.786 ( -10.657 4.617 -0.503) 11.625 10.184 ( -11.391 -3.303 -5.891) 13.243 10.658 ( -4.792 -6.412 -2.321) 8.335 10.805 ( -5.318 2.428 -2.755) 6.463 11.429 ( 3.977 -8.174 4.530) 10.156 11.809 ( 4.639 7.808 2.379) 9.388 12.131 ( 4.406 -0.765 6.837) 8.170 12.273 ( -0.027 3.835 4.449) 5.874 12.374 ( 0.285 -1.046 -4.404) 4.536 12.617 ( -5.253 0.448 -16.857) 17.662 13.142 ( 13.820 4.305 2.219) 14.644 13.383 ( 0.701 5.486 -5.813) 8.024 13.904 ( 7.205 -0.115 -3.258) 7.908 13.928 ( 4.661 -6.147 -1.793) 7.920 14.353 ( -7.779 5.330 5.792) 11.067 14.873 ( 2.069 -5.979 5.856) 8.621 15.340 ( 1.158 -0.671 -1.527) 2.031 15.613 ( 6.644 1.921 0.950) 6.981 15.675 ( 5.062 5.433 2.208) 7.747 16.270 ( 2.804 -4.672 -0.235) 5.454 16.592 ( -1.644 4.101 -6.546) 7.898 16.939 ( 2.102 1.313 -9.974) 10.278 17.643 ( 3.261 -4.812 7.795) 9.724 17.949 ( -4.373 3.114 10.268) 11.586 18.267 ( -4.131 3.206 12.358) 13.419 18.956 ( 8.464 -9.095 -1.800) 12.554 19.411 ( -5.117 6.136 1.783) 8.186 19.907 ( -6.844 -8.089 5.516) 11.946 20.366 ( 0.670 3.613 -2.658) 4.535 20.770 ( 1.769 0.934 -2.168) 2.950 22.340 ( -1.138 -2.872 -20.709) 20.939 22.914 ( -3.576 2.702 6.389) 7.805 24.158 ( 11.774 1.960 -6.311) 13.502 ======================= Grid point 286 (101/146) ======================= q-point: (-0.18 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.860 ( -27.131 -37.296 37.181) 59.241 4.704 ( -43.775 4.284 18.334) 47.652 5.910 ( -13.070 -9.313 -22.971) 28.022 6.170 ( 11.371 11.153 6.527) 17.213 6.990 ( -4.300 -8.667 12.880) 16.109 7.161 ( -21.381 -2.367 16.662) 27.210 8.566 ( -1.219 -11.256 7.290) 13.466 8.803 ( -6.506 -8.344 6.860) 12.610 9.265 ( -9.568 5.895 8.199) 13.911 9.654 ( -9.155 7.764 -2.988) 12.370 9.960 ( -12.975 1.517 -3.818) 13.610 10.442 ( -8.571 -10.445 -6.162) 14.851 10.701 ( -6.808 0.734 -1.973) 7.126 11.369 ( -2.447 -9.264 0.695) 9.607 11.752 ( -13.329 -7.737 2.093) 15.553 11.941 ( -10.891 -1.025 -0.117) 10.940 12.157 ( -15.500 -0.984 1.919) 15.650 12.418 ( -6.521 -0.052 -5.658) 8.633 12.840 ( 23.422 8.526 1.002) 24.945 13.234 ( 2.104 1.742 -6.117) 6.699 13.646 ( 16.214 7.189 1.429) 17.793 13.902 ( 5.375 -4.900 1.073) 7.352 14.078 ( 11.270 4.855 -1.560) 12.370 14.338 ( -1.992 4.727 2.501) 5.707 14.981 ( 10.200 -2.549 9.179) 13.957 15.380 ( 7.144 -1.410 -4.201) 8.406 15.638 ( -2.018 -2.471 2.415) 4.001 15.834 ( 7.843 6.685 -9.891) 14.284 16.224 ( -2.467 1.223 -9.088) 9.496 16.675 ( 10.498 4.955 -1.023) 11.654 16.996 ( 6.786 3.729 -5.731) 9.633 17.713 ( 2.371 -4.562 10.731) 11.899 17.906 ( -6.321 -3.965 7.607) 10.656 18.384 ( 1.584 5.913 15.011) 16.211 18.952 ( 3.884 -8.413 -4.132) 10.146 19.363 ( -4.520 -1.163 1.925) 5.049 19.832 ( -0.866 -3.683 6.781) 7.765 20.372 ( -1.739 5.801 -7.383) 9.549 20.807 ( 3.402 0.935 -2.088) 4.100 22.184 ( -4.616 2.066 -12.192) 13.199 22.900 ( -3.382 0.363 3.491) 4.874 24.327 ( 12.004 3.046 -8.906) 15.254 ======================= Grid point 292 (102/146) ======================= q-point: ( 0.36 0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.577 ( -0.000 33.667 34.416) 48.145 3.927 ( -0.000 29.279 29.197) 41.348 6.127 ( -0.000 -2.346 35.442) 35.520 6.811 ( 0.000 -1.990 -8.578) 8.806 7.071 ( -0.000 9.305 45.939) 46.871 7.097 ( 0.000 8.892 -3.763) 9.656 8.649 ( 0.000 9.614 -2.241) 9.871 8.773 ( 0.000 4.512 0.730) 4.571 9.001 ( -0.000 -0.635 2.450) 2.530 9.509 ( 0.000 1.567 -0.778) 1.749 9.674 ( 0.000 4.486 -4.463) 6.328 10.560 ( -0.000 0.326 25.034) 25.036 10.563 ( -0.000 7.527 18.380) 19.861 10.969 ( -0.000 9.398 14.387) 17.184 11.107 ( -0.000 -1.820 6.643) 6.888 11.964 ( -0.000 3.706 5.415) 6.562 12.285 ( -0.000 -3.301 18.620) 18.910 12.447 ( -0.000 9.686 5.802) 11.291 12.884 ( -0.000 9.034 5.200) 10.424 13.096 ( 0.000 -8.133 -7.019) 10.743 13.316 ( 0.000 -5.140 -22.438) 23.019 13.974 ( 0.000 0.727 -16.426) 16.442 14.246 ( 0.000 11.726 -17.904) 21.402 14.347 ( 0.000 -0.489 -5.761) 5.782 15.294 ( 0.000 2.848 -2.717) 3.936 15.414 ( 0.000 -6.436 -11.175) 12.896 15.527 ( -0.000 -1.334 3.436) 3.686 15.701 ( 0.000 -3.591 -1.939) 4.082 16.390 ( 0.000 -20.799 -7.714) 22.183 17.263 ( 0.000 -10.122 -3.397) 10.676 17.388 ( -0.000 -7.438 -0.991) 7.504 17.835 ( 0.000 4.477 -1.315) 4.666 17.927 ( 0.000 -2.396 -3.831) 4.519 18.301 ( 0.000 6.763 -5.919) 8.988 18.695 ( 0.000 3.396 -0.200) 3.402 19.200 ( 0.000 10.092 -0.603) 10.110 20.108 ( -0.000 -6.218 8.004) 10.136 20.599 ( -0.000 -8.438 -0.909) 8.487 20.845 ( 0.000 -1.835 -3.343) 3.814 22.002 ( -0.000 14.028 12.040) 18.487 23.039 ( -0.000 -5.682 4.838) 7.463 24.224 ( 0.000 -12.879 -10.359) 16.528 ======================= Grid point 293 (103/146) ======================= q-point: ( 0.45 0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.960 ( -9.026 33.449 29.115) 45.254 4.570 ( 19.082 20.927 29.379) 40.807 6.199 ( -3.592 -5.040 12.040) 13.538 6.709 ( -3.536 -3.231 -3.398) 5.873 7.105 ( -5.257 8.331 0.951) 9.896 7.741 ( 21.454 15.045 49.443) 55.958 8.516 ( -18.323 6.061 -1.903) 19.393 8.726 ( -6.160 7.748 -4.303) 10.793 9.211 ( 11.580 0.465 0.532) 11.602 9.530 ( 3.624 7.015 0.365) 7.904 9.802 ( 10.944 2.707 -1.843) 11.423 10.607 ( -4.407 2.506 19.323) 19.977 10.832 ( 2.346 5.724 12.650) 14.082 11.089 ( 0.005 -0.029 6.033) 6.033 11.190 ( 6.213 -0.560 9.256) 11.162 12.045 ( 3.353 2.995 1.585) 4.767 12.341 ( -4.715 -0.040 16.810) 17.459 12.537 ( -1.106 6.812 -1.529) 7.068 12.854 ( -1.417 -4.723 -9.167) 10.408 13.049 ( 7.392 -4.660 -8.540) 12.218 13.264 ( 3.664 0.809 -7.423) 8.317 13.862 ( -3.721 5.347 -16.729) 17.953 14.097 ( -9.646 1.083 -6.474) 11.667 14.395 ( 5.752 2.043 -6.782) 9.124 15.204 ( -6.026 -6.902 -4.607) 10.255 15.321 ( 0.970 0.976 -3.100) 3.391 15.541 ( -3.237 1.190 1.639) 3.818 15.676 ( -0.664 -0.325 0.162) 0.757 16.196 ( 2.494 -15.836 -4.050) 16.534 17.038 ( -8.700 -13.240 -4.031) 16.347 17.345 ( 1.865 -7.806 -1.569) 8.178 17.785 ( -6.352 6.492 0.534) 9.098 17.992 ( 7.312 -2.478 -0.427) 7.733 18.367 ( -0.043 11.844 -3.446) 12.335 18.669 ( -6.486 4.498 -4.029) 8.862 19.245 ( -2.791 8.426 1.573) 9.015 20.156 ( 6.904 -7.772 6.013) 12.010 20.506 ( -1.643 -6.521 -0.894) 6.784 20.789 ( -1.447 -2.383 -2.849) 3.986 22.229 ( 4.861 6.258 12.249) 14.589 22.996 ( 0.360 -7.300 -0.037) 7.308 24.032 ( -2.161 -8.962 -9.757) 13.423 ======================= Grid point 294 (104/146) ======================= q-point: ( 0.55 0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.346 ( -1.656 29.393 25.491) 38.942 5.163 ( 11.686 7.412 30.912) 33.868 6.156 ( -1.823 -2.486 4.672) 5.597 6.582 ( -6.727 -4.937 0.166) 8.345 7.095 ( -6.090 6.076 3.625) 9.335 8.093 ( -17.971 -0.419 6.666) 19.172 8.580 ( 0.196 2.542 -10.921) 11.215 8.726 ( 15.959 17.062 21.140) 31.507 9.331 ( 3.323 2.472 4.614) 6.200 9.778 ( 11.300 14.727 4.185) 19.029 9.981 ( 6.785 0.673 5.833) 8.973 10.697 ( 2.009 0.602 1.652) 2.670 10.896 ( -1.349 1.357 7.507) 7.747 11.106 ( 0.223 0.875 1.075) 1.404 11.384 ( 8.589 0.557 8.329) 11.977 12.118 ( 3.326 -2.368 2.390) 4.731 12.343 ( -4.394 -0.277 4.157) 6.055 12.540 ( -3.467 4.792 -1.727) 6.162 12.733 ( -3.328 -3.856 -4.600) 6.863 13.015 ( 6.682 -8.152 -18.010) 20.868 13.286 ( 2.871 -0.545 -4.410) 5.290 13.762 ( -4.861 11.883 -12.690) 18.052 13.972 ( -4.263 -3.561 4.198) 6.962 14.455 ( 3.458 1.519 -2.360) 4.454 15.048 ( -3.952 -5.634 -1.573) 7.059 15.327 ( 1.134 -0.430 1.390) 1.844 15.473 ( -5.706 0.501 -0.653) 5.765 15.642 ( -3.233 -0.826 1.227) 3.555 16.157 ( 5.432 -5.067 0.867) 7.479 16.757 ( -6.244 -12.087 -6.563) 15.104 17.246 ( -2.310 -9.979 -2.344) 10.507 17.789 ( -6.143 11.463 0.748) 13.027 18.047 ( 2.290 -7.176 4.284) 8.666 18.360 ( -9.847 9.592 -2.332) 13.943 18.652 ( 2.700 8.132 -4.095) 9.497 19.337 ( 2.001 8.602 4.335) 9.839 20.186 ( 1.198 -9.507 4.260) 10.487 20.434 ( -0.821 -4.466 0.102) 4.542 20.742 ( 0.441 -1.681 -2.063) 2.698 22.351 ( 3.911 -10.544 5.052) 12.329 22.962 ( 0.432 3.968 -2.189) 4.552 23.891 ( -0.017 -4.809 -7.709) 9.086 ======================= Grid point 295 (105/146) ======================= q-point: ( 0.64 0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.706 ( -2.283 12.194 25.366) 28.237 5.414 ( -5.009 4.112 21.843) 22.784 6.160 ( -5.070 -3.984 8.474) 10.648 6.465 ( 0.915 -2.359 -2.202) 3.354 7.060 ( -5.538 -0.117 4.813) 7.338 7.761 ( -21.768 0.830 -1.530) 21.837 8.453 ( -0.957 -2.618 -8.370) 8.822 9.129 ( 10.958 -2.369 -3.284) 11.682 9.493 ( -0.445 12.728 11.653) 17.262 10.054 ( -3.123 2.945 14.862) 15.469 10.243 ( 14.904 14.798 6.532) 21.995 10.665 ( 0.844 -1.662 -5.709) 6.005 11.013 ( 0.339 5.108 5.161) 7.270 11.105 ( 2.321 -0.691 -0.630) 2.503 11.522 ( 5.286 -1.760 2.607) 6.151 12.106 ( -1.504 -8.297 3.358) 9.076 12.295 ( 1.712 3.340 -6.699) 7.679 12.482 ( -5.976 0.199 1.105) 6.081 12.641 ( -1.168 -3.352 -6.083) 7.043 12.944 ( 3.891 1.315 -13.014) 13.646 13.290 ( 4.949 -2.285 -7.722) 9.451 13.790 ( 0.046 12.276 -4.570) 13.100 13.886 ( -3.039 -9.442 4.250) 10.792 14.490 ( 0.436 0.013 -0.028) 0.437 14.939 ( -4.808 -4.198 1.728) 6.613 15.349 ( 0.787 -2.188 3.148) 3.914 15.456 ( 1.106 6.046 2.026) 6.472 15.610 ( -1.171 -0.105 3.007) 3.228 16.208 ( 0.945 -3.494 4.608) 5.859 16.582 ( 1.339 -3.506 -8.936) 9.692 17.062 ( -5.574 -11.596 -4.302) 13.567 17.750 ( -9.128 7.038 -1.417) 11.613 17.996 ( -1.670 -4.090 4.560) 6.349 18.368 ( -0.510 6.801 4.125) 7.971 18.750 ( 2.141 4.932 -0.514) 5.402 19.489 ( 1.965 9.131 3.178) 9.866 20.087 ( -3.289 -11.053 2.621) 11.826 20.383 ( -1.781 -3.896 2.712) 5.070 20.741 ( 1.003 0.197 -1.359) 1.701 22.256 ( 3.712 -13.801 -10.517) 17.744 23.043 ( -1.963 10.481 4.126) 11.434 23.852 ( 5.583 -3.162 -6.182) 8.909 ======================= Grid point 296 (106/146) ======================= q-point: (-0.27 0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.669 ( -20.139 -18.376 29.682) 40.303 5.554 ( -5.134 16.830 11.127) 20.819 6.002 ( -9.119 -3.156 4.762) 10.761 6.351 ( -9.263 -9.068 -18.490) 22.581 7.015 ( -1.419 -4.239 9.404) 10.412 7.538 ( -8.541 -0.336 12.703) 15.311 8.421 ( 3.643 -3.410 -1.464) 5.200 9.141 ( 0.169 -5.037 -2.770) 5.751 9.598 ( -9.086 11.361 8.324) 16.761 10.064 ( -9.877 4.456 9.151) 14.183 10.323 ( -11.704 2.582 -3.637) 12.525 10.659 ( -2.931 -4.408 -2.733) 5.957 10.906 ( -8.232 -0.390 -0.553) 8.259 11.298 ( 9.332 -0.833 2.345) 9.658 11.670 ( 14.653 2.886 0.882) 14.960 12.074 ( 3.167 -2.855 -5.211) 6.733 12.335 ( 0.879 0.571 -1.304) 1.674 12.390 ( -1.946 2.445 1.890) 3.653 12.564 ( -0.279 1.978 -9.573) 9.779 13.022 ( 7.080 3.788 -0.560) 8.049 13.303 ( 5.262 -2.527 -8.089) 9.975 13.779 ( -0.615 -6.813 1.773) 7.067 13.899 ( 2.311 8.476 -1.162) 8.862 14.471 ( -1.085 -2.348 0.835) 2.718 14.851 ( -3.199 -2.484 3.739) 5.512 15.363 ( -2.584 -3.598 2.811) 5.246 15.530 ( 3.774 6.468 -1.219) 7.587 15.698 ( 3.961 2.663 5.873) 7.568 16.188 ( 1.585 -5.600 3.347) 6.714 16.586 ( 0.505 2.103 -5.775) 6.167 16.850 ( -0.862 -6.094 -8.594) 10.570 17.668 ( -4.032 1.335 -0.093) 4.248 18.026 ( 2.210 -1.836 8.916) 9.368 18.440 ( -3.077 4.845 7.166) 9.181 18.794 ( 2.359 -3.161 1.290) 4.149 19.549 ( -4.644 4.218 1.058) 6.362 19.947 ( -4.383 -9.410 4.299) 11.236 20.357 ( 0.930 -0.791 -1.760) 2.142 20.751 ( 0.470 1.451 -1.289) 1.997 22.160 ( 4.964 -1.829 -15.744) 16.609 23.086 ( -6.812 5.493 6.700) 11.021 23.933 ( 11.351 -0.673 -6.117) 12.911 ======================= Grid point 297 (107/146) ======================= q-point: (-0.18 0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.249 ( -28.890 -27.167 34.759) 52.733 5.398 ( -31.058 -4.430 3.643) 31.583 5.815 ( -6.856 -8.850 -24.825) 27.232 6.163 ( 5.703 9.241 5.857) 12.338 7.006 ( -0.989 -10.050 11.143) 15.038 7.542 ( -8.552 -1.810 18.889) 20.813 8.462 ( 4.522 -4.719 4.716) 8.059 9.021 ( -14.122 0.847 4.548) 14.860 9.528 ( -13.217 1.853 13.851) 19.235 9.947 ( -13.886 12.925 -4.623) 19.526 10.146 ( -10.467 1.043 3.262) 11.014 10.447 ( -9.028 -8.641 -7.340) 14.493 10.800 ( -5.357 0.910 -1.066) 5.538 11.325 ( -0.269 -6.157 1.020) 6.247 11.847 ( -3.789 -3.413 -3.070) 5.952 11.932 ( 2.430 -5.344 -11.350) 12.778 12.328 ( -3.413 0.862 -0.517) 3.558 12.532 ( -4.040 5.967 -2.215) 7.539 12.620 ( 12.390 8.521 5.441) 15.991 13.163 ( 5.515 2.601 -1.937) 6.398 13.381 ( 16.942 -3.215 -2.620) 17.443 13.775 ( 3.602 -1.429 -0.963) 3.993 14.014 ( 3.439 8.465 0.711) 9.164 14.439 ( -1.519 -2.536 2.211) 3.692 14.863 ( 3.693 -1.749 5.076) 6.516 15.288 ( -0.286 -3.411 -0.150) 3.427 15.635 ( 2.731 0.426 -2.156) 3.506 15.772 ( 1.576 3.904 -2.079) 4.696 16.193 ( -0.422 -5.693 -0.944) 5.786 16.556 ( 5.966 2.630 -4.205) 7.759 16.881 ( 7.019 5.253 -7.035) 11.241 17.662 ( 3.397 -3.813 3.958) 6.461 18.060 ( -6.844 -4.510 12.354) 14.826 18.473 ( 0.416 1.736 6.995) 7.219 18.797 ( 3.769 -8.169 1.494) 9.119 19.469 ( -7.836 0.846 1.359) 7.998 19.848 ( -2.499 -5.983 5.388) 8.430 20.358 ( 2.648 1.792 -9.728) 10.240 20.771 ( 1.065 2.156 -1.280) 2.724 22.177 ( 2.480 9.735 -10.723) 14.694 23.027 ( -7.913 -0.012 5.904) 9.873 24.094 ( 12.739 1.748 -7.597) 14.935 ======================= Grid point 304 (108/146) ======================= q-point: ( 0.45 0.45 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.551 ( -0.000 22.955 32.151) 39.505 4.698 ( -0.000 24.404 11.952) 27.173 6.273 ( -0.000 -4.067 10.943) 11.674 6.656 ( 0.000 -4.571 -5.724) 7.325 7.238 ( 0.000 12.853 -5.693) 14.057 7.990 ( -0.000 10.477 37.656) 39.086 8.809 ( -0.000 9.284 4.732) 10.421 8.828 ( 0.000 2.854 -3.489) 4.508 9.074 ( 0.000 9.097 2.702) 9.489 9.644 ( -0.000 12.255 6.187) 13.728 9.668 ( 0.000 0.752 -3.175) 3.263 10.831 ( -0.000 -4.097 17.924) 18.386 10.890 ( -0.000 3.441 12.969) 13.418 11.105 ( 0.000 -5.957 -3.144) 6.736 11.157 ( -0.000 -2.309 10.408) 10.660 12.058 ( 0.000 3.647 0.865) 3.748 12.470 ( -0.000 -0.921 7.392) 7.449 12.524 ( 0.000 0.215 -14.186) 14.188 12.723 ( 0.000 -0.218 -13.575) 13.577 12.945 ( -0.000 -2.592 4.649) 5.323 13.228 ( 0.000 1.128 -5.843) 5.950 13.851 ( 0.000 6.836 -12.561) 14.301 14.231 ( 0.000 4.783 -2.621) 5.454 14.248 ( 0.000 -2.175 -4.328) 4.844 15.149 ( 0.000 -8.617 -3.754) 9.399 15.298 ( 0.000 0.205 -2.329) 2.338 15.598 ( -0.000 0.450 0.155) 0.476 15.686 ( -0.000 2.753 0.893) 2.894 16.046 ( -0.000 -9.026 -0.177) 9.027 16.982 ( -0.000 -15.829 -2.636) 16.047 17.188 ( 0.000 -11.633 -4.501) 12.473 17.868 ( 0.000 1.510 -3.974) 4.252 17.958 ( -0.000 7.082 4.906) 8.615 18.470 ( 0.000 17.553 -2.808) 17.776 18.781 ( 0.000 7.181 -3.224) 7.871 19.345 ( 0.000 8.287 -3.151) 8.866 20.028 ( -0.000 -12.370 7.414) 14.422 20.454 ( -0.000 -6.336 -0.095) 6.337 20.764 ( 0.000 -2.680 -2.316) 3.542 22.283 ( -0.000 -7.773 13.554) 15.625 22.934 ( 0.000 -0.792 -2.959) 3.064 23.921 ( 0.000 -6.646 -6.973) 9.633 ======================= Grid point 305 (109/146) ======================= q-point: ( 0.55 0.45 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.808 ( -5.849 20.733 22.334) 31.030 5.150 ( 15.393 11.481 13.202) 23.304 6.249 ( -5.997 -0.964 6.395) 8.820 6.572 ( -0.923 -9.288 -0.882) 9.375 7.274 ( -5.518 11.004 -3.283) 12.740 8.198 ( 4.701 -3.657 -8.443) 10.332 8.596 ( -13.223 4.262 -4.864) 14.719 9.037 ( -9.124 18.769 22.914) 30.993 9.308 ( 10.321 4.991 4.421) 12.287 9.722 ( 10.405 10.828 6.348) 16.303 9.942 ( 9.550 10.789 9.517) 17.268 10.751 ( -7.397 -7.265 2.290) 10.618 10.938 ( -2.815 -7.257 2.858) 8.292 11.059 ( 7.838 -3.260 1.170) 8.569 11.302 ( 7.300 -2.229 12.879) 14.971 12.091 ( -0.448 0.530 0.958) 1.183 12.376 ( -2.150 -0.393 -12.893) 13.077 12.481 ( 2.579 -3.827 -10.260) 11.250 12.718 ( 2.260 3.848 -3.665) 5.775 12.946 ( -5.708 -0.296 8.762) 10.462 13.188 ( 1.760 -1.099 -10.370) 10.576 13.820 ( -2.026 7.415 -10.900) 13.338 14.101 ( -7.937 -1.388 2.751) 8.514 14.373 ( 6.118 2.631 0.157) 6.662 15.041 ( -2.837 -5.736 0.327) 6.407 15.297 ( 2.475 -1.297 0.386) 2.821 15.553 ( -3.799 -0.640 -1.917) 4.303 15.705 ( -3.493 2.655 0.439) 4.409 16.057 ( 6.242 0.410 3.264) 7.056 16.716 ( -8.594 -14.646 -4.555) 17.581 17.096 ( 4.029 -15.504 -2.981) 16.294 17.863 ( 0.178 0.862 -3.667) 3.771 18.068 ( -0.168 10.227 2.910) 10.634 18.618 ( -5.405 15.373 -2.137) 16.435 18.725 ( -6.233 9.600 -6.027) 12.936 19.392 ( 0.950 5.425 1.174) 5.631 20.046 ( 7.678 -11.081 6.155) 14.820 20.397 ( -0.400 -5.495 1.145) 5.627 20.719 ( -0.699 -1.925 -1.219) 2.383 22.207 ( 0.021 -23.380 7.932) 24.689 22.988 ( 2.959 11.094 -2.381) 11.726 23.824 ( -1.483 -4.057 -4.243) 6.055 ======================= Grid point 306 (110/146) ======================= q-point: ( 0.64 0.45 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.033 ( -5.036 8.019 25.423) 27.129 5.493 ( 10.886 6.128 2.325) 12.706 6.191 ( -2.844 -0.233 -1.483) 3.216 6.422 ( -3.336 -14.417 1.832) 14.911 7.215 ( -8.867 4.122 -0.340) 9.784 7.991 ( -12.369 -6.751 -9.405) 16.941 8.496 ( -3.660 8.248 -9.975) 13.451 9.030 ( -5.918 3.602 0.039) 6.928 9.605 ( 9.433 7.805 8.900) 15.136 10.103 ( 8.042 4.676 13.100) 16.068 10.292 ( 9.333 17.808 16.494) 26.006 10.591 ( 0.427 -6.471 -5.324) 8.391 10.932 ( 6.025 -3.038 3.222) 7.477 11.144 ( 4.509 -2.786 -0.198) 5.304 11.437 ( 3.430 -3.548 8.463) 9.797 12.038 ( -1.488 -5.637 -3.550) 6.825 12.289 ( -2.053 4.382 -8.312) 9.618 12.402 ( 2.559 -4.331 -12.894) 13.840 12.736 ( -6.546 -0.260 3.608) 7.479 12.904 ( -0.961 5.228 0.729) 5.365 13.150 ( 2.575 -0.535 -7.971) 8.394 13.817 ( -0.228 5.527 -3.451) 6.520 13.969 ( -6.669 -4.087 0.604) 7.845 14.453 ( 1.802 0.335 -0.470) 1.892 14.983 ( -2.034 -0.991 1.652) 2.802 15.346 ( 0.867 -3.865 3.173) 5.075 15.479 ( 0.862 1.388 1.670) 2.337 15.684 ( -3.890 5.535 -0.300) 6.772 16.219 ( 2.937 1.982 7.712) 8.487 16.472 ( -1.001 -6.448 -7.336) 9.818 16.958 ( -0.524 -17.729 -1.298) 17.784 17.821 ( -1.259 -3.148 -3.750) 5.055 18.110 ( -7.993 8.733 -1.572) 11.942 18.508 ( -7.708 8.488 -1.437) 11.555 18.816 ( 0.108 10.967 -3.661) 11.563 19.508 ( 5.321 4.601 2.864) 7.595 20.047 ( -0.857 -9.544 4.008) 10.387 20.364 ( 0.657 -6.434 3.605) 7.405 20.715 ( 1.759 0.259 -0.111) 1.781 22.027 ( 1.378 -18.063 -0.666) 18.128 23.155 ( 3.752 11.711 0.259) 12.300 23.749 ( -0.797 -2.872 -2.313) 3.772 ======================= Grid point 307 (111/146) ======================= q-point: (-0.27 0.45 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.011 ( -16.574 -13.361 26.399) 33.913 5.648 ( 4.726 3.193 -12.166) 13.437 6.045 ( -5.725 -7.297 -4.275) 10.213 6.312 ( -1.123 -7.955 -0.669) 8.062 7.108 ( -6.550 -0.649 4.248) 7.834 7.683 ( -10.370 -6.029 -2.534) 12.259 8.440 ( -4.780 2.354 -0.013) 5.328 9.072 ( 5.713 7.489 -3.021) 9.892 9.789 ( 0.820 5.555 3.451) 6.591 10.227 ( -1.676 -2.043 12.816) 13.085 10.489 ( -1.550 4.790 -1.909) 5.384 10.598 ( 2.274 -2.876 -5.150) 6.321 11.035 ( -5.041 -9.652 3.727) 11.509 11.194 ( 7.702 7.259 3.480) 11.141 11.494 ( 4.954 -2.907 4.275) 7.161 11.963 ( 1.711 -2.880 -5.177) 6.167 12.283 ( 1.818 3.193 -3.352) 4.974 12.341 ( 2.463 1.800 -10.083) 10.535 12.648 ( -4.234 2.683 4.848) 6.974 12.994 ( 2.421 6.854 -0.550) 7.290 13.154 ( 3.047 -2.408 -4.481) 5.930 13.767 ( -3.344 -5.734 1.620) 6.833 13.951 ( 2.414 8.749 -1.382) 9.180 14.438 ( -1.065 -3.104 -1.864) 3.774 14.927 ( -4.060 -1.158 0.796) 4.296 15.345 ( 1.545 -1.570 3.077) 3.784 15.603 ( 2.894 0.774 3.153) 4.349 15.661 ( -1.326 4.464 -0.190) 4.660 16.179 ( -3.277 -4.123 2.556) 5.854 16.559 ( 5.731 6.431 0.311) 8.620 16.745 ( -3.136 -15.005 -2.934) 15.608 17.716 ( -4.054 -3.902 -4.284) 7.072 18.061 ( -2.401 6.646 0.782) 7.109 18.528 ( -0.781 4.568 1.132) 4.770 18.818 ( -3.903 -0.699 -0.749) 4.035 19.625 ( 1.211 3.101 0.554) 3.375 19.951 ( -2.773 -5.311 3.069) 6.731 20.305 ( -1.383 -9.688 1.602) 9.916 20.752 ( 1.254 1.451 0.088) 1.920 21.986 ( 6.691 0.547 -4.604) 8.140 23.259 ( -2.650 4.200 2.299) 5.472 23.752 ( 5.348 0.975 -2.268) 5.890 ======================= Grid point 308 (112/146) ======================= q-point: (-0.18 0.45 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.660 ( -23.767 -22.353 22.415) 39.585 5.465 ( -4.179 -14.909 -18.545) 24.159 5.851 ( -14.287 -10.908 -1.711) 18.056 6.222 ( -1.289 2.115 2.708) 3.670 7.018 ( -4.573 -8.522 4.858) 10.823 7.622 ( 3.830 0.208 6.359) 7.426 8.423 ( 1.208 -1.114 3.134) 3.539 9.235 ( 0.045 12.361 3.160) 12.759 9.793 ( -6.378 -0.042 5.357) 8.329 10.176 ( -9.272 -4.077 1.480) 10.236 10.403 ( -12.762 4.870 -1.334) 13.724 10.489 ( -7.179 -2.785 0.335) 7.707 10.857 ( -3.558 -2.723 -0.624) 4.524 11.293 ( -0.725 -1.468 -0.912) 1.874 11.590 ( 13.017 -8.608 -5.901) 16.684 11.900 ( -4.190 -4.505 -3.380) 7.019 12.338 ( 2.479 3.477 0.130) 4.273 12.452 ( 7.825 6.996 -4.422) 11.390 12.738 ( 0.093 9.972 5.183) 11.239 13.077 ( 6.237 -4.156 2.267) 7.830 13.157 ( 4.829 4.284 -4.081) 7.637 13.742 ( 1.140 1.465 -0.860) 2.046 14.091 ( 1.524 10.807 2.032) 11.102 14.360 ( 1.208 -8.473 -0.598) 8.580 14.897 ( -1.129 1.654 2.062) 2.874 15.302 ( -4.900 -5.577 0.575) 7.446 15.593 ( -0.291 0.664 -1.345) 1.528 15.738 ( 4.127 -0.511 -0.905) 4.256 16.155 ( -1.247 -4.636 1.892) 5.160 16.500 ( -0.526 -1.427 -2.202) 2.676 16.793 ( 6.660 7.711 -3.191) 10.677 17.606 ( -1.079 -6.005 0.050) 6.101 18.165 ( 1.966 5.334 6.221) 8.428 18.500 ( -3.534 -6.444 1.262) 7.457 18.718 ( -1.350 -6.969 1.310) 7.218 19.602 ( -4.840 -0.105 1.452) 5.054 19.902 ( -4.836 -2.407 5.683) 7.841 20.211 ( 3.590 -5.096 -8.805) 10.788 20.781 ( 0.401 2.177 -0.251) 2.228 22.161 ( 7.663 15.034 -4.030) 17.349 23.184 ( -7.850 -3.583 3.513) 9.317 23.892 ( 9.703 4.772 -3.836) 11.474 ======================= Grid point 316 (113/146) ======================= q-point: ( 0.55 0.55 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.121 ( 0.000 18.663 -6.909) 19.901 5.187 ( -0.000 2.697 29.793) 29.914 6.325 ( -0.000 -7.496 7.393) 10.528 6.460 ( 0.000 -11.589 -3.710) 12.169 7.404 ( 0.000 13.146 -7.761) 15.266 7.993 ( 0.000 -0.349 -24.802) 24.805 8.807 ( 0.000 3.196 -6.465) 7.212 9.127 ( -0.000 0.247 8.332) 8.335 9.638 ( -0.000 -2.287 1.261) 2.611 9.644 ( -0.000 29.922 19.415) 35.669 10.101 ( -0.000 17.821 20.706) 27.319 10.667 ( 0.000 -22.782 -13.591) 26.528 10.839 ( -0.000 -5.119 1.076) 5.231 10.965 ( -0.000 -9.307 6.339) 11.261 11.331 ( -0.000 -1.898 18.616) 18.713 12.136 ( -0.000 1.023 3.436) 3.585 12.256 ( 0.000 2.153 -19.839) 19.955 12.407 ( 0.000 -4.191 -2.588) 4.926 12.710 ( 0.000 3.849 -3.625) 5.287 13.094 ( 0.000 3.077 -13.997) 14.331 13.095 ( -0.000 2.447 10.600) 10.879 13.820 ( 0.000 5.936 -11.047) 12.541 14.178 ( -0.000 -2.010 -0.469) 2.064 14.351 ( -0.000 1.050 6.563) 6.647 15.050 ( -0.000 -2.147 5.478) 5.884 15.246 ( 0.000 -2.304 -0.990) 2.508 15.544 ( 0.000 -3.142 -4.260) 5.293 15.796 ( 0.000 7.173 -0.654) 7.203 16.029 ( -0.000 3.117 4.816) 5.737 16.650 ( -0.000 -15.386 -1.917) 15.505 16.871 ( -0.000 -15.723 -2.534) 15.926 17.866 ( 0.000 3.100 -3.761) 4.874 18.166 ( 0.000 12.447 -4.630) 13.280 18.742 ( 0.000 14.528 -10.876) 18.148 18.880 ( 0.000 6.604 1.744) 6.830 19.426 ( 0.000 6.420 -5.070) 8.180 19.913 ( -0.000 -10.977 12.289) 16.477 20.360 ( -0.000 -6.939 2.944) 7.538 20.702 ( -0.000 -1.815 -0.266) 1.835 22.029 ( -0.000 -26.009 9.261) 27.608 23.048 ( 0.000 11.480 -3.719) 12.067 23.801 ( -0.000 -1.058 -0.118) 1.064 ======================= Grid point 317 (114/146) ======================= q-point: ( 0.64 0.55 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.282 ( 4.340 12.762 1.210) 13.534 5.349 ( 2.368 -4.862 11.523) 12.729 6.206 ( -3.676 -11.802 -2.544) 12.621 6.298 ( -1.159 -18.407 -1.121) 18.477 7.377 ( -7.651 7.734 -9.255) 14.283 7.917 ( 4.347 2.089 -22.157) 22.676 8.605 ( -12.706 6.325 -7.284) 15.953 9.308 ( -11.436 -2.708 2.783) 12.077 9.446 ( 9.890 3.424 -0.061) 10.466 10.098 ( 12.537 6.983 4.525) 15.047 10.301 ( 4.249 -15.735 -2.320) 16.463 10.582 ( 0.186 15.585 16.592) 22.764 10.845 ( 5.088 -2.821 4.818) 7.553 10.942 ( 6.131 -10.725 5.014) 13.332 11.452 ( 3.015 -1.665 14.257) 14.667 12.057 ( -6.962 -1.628 -1.833) 7.381 12.252 ( 3.526 3.878 -8.540) 10.020 12.355 ( -1.615 1.079 -1.159) 2.262 12.722 ( 2.985 -1.460 -7.284) 8.006 13.035 ( -5.091 7.854 -4.985) 10.604 13.144 ( -1.856 3.707 2.859) 5.036 13.832 ( 2.490 6.471 -7.600) 10.287 14.041 ( -10.406 -5.517 0.279) 11.782 14.433 ( 3.460 -1.702 3.413) 5.149 15.033 ( -4.589 0.726 1.793) 4.980 15.297 ( 5.206 0.141 4.704) 7.017 15.466 ( -0.744 -4.035 -3.366) 5.307 15.801 ( -3.848 6.101 -2.117) 7.517 16.205 ( 8.963 6.113 5.476) 12.153 16.444 ( -6.882 -7.630 -1.006) 10.324 16.767 ( 2.957 -16.196 1.550) 16.537 17.825 ( -4.258 0.868 -4.263) 6.088 18.242 ( -0.008 11.418 -9.788) 15.039 18.692 ( -8.141 3.611 -9.559) 13.065 18.889 ( -3.677 8.347 -3.611) 9.810 19.474 ( 3.589 2.571 -0.127) 4.416 19.987 ( 4.735 -4.626 9.053) 11.215 20.303 ( 0.401 -9.823 4.142) 10.668 20.695 ( 0.685 -0.395 0.882) 1.185 21.886 ( 0.171 -15.648 9.519) 18.317 23.143 ( 4.726 6.199 -5.461) 9.518 23.796 ( -3.175 2.792 3.829) 5.704 ======================= Grid point 318 (115/146) ======================= q-point: (-0.27 -0.45 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.170 ( -9.127 -21.111 -7.199) 24.100 5.496 ( 4.552 1.128 4.679) 6.625 6.017 ( -2.008 -12.244 -3.590) 12.916 6.172 ( 5.412 -10.786 0.684) 12.087 7.220 ( -8.860 -0.292 -8.267) 12.121 7.771 ( -8.147 -0.510 -10.846) 13.574 8.506 ( -3.604 3.713 -9.041) 10.417 9.103 ( -4.111 3.434 0.909) 5.433 9.712 ( 12.949 0.984 -2.146) 13.162 10.218 ( 8.458 -15.737 -3.684) 18.241 10.286 ( 9.439 -3.891 1.244) 10.285 10.599 ( -3.803 -6.883 0.122) 7.865 10.912 ( 4.014 -10.110 0.494) 10.889 11.183 ( 5.624 9.919 14.083) 18.120 11.589 ( 0.454 6.427 11.260) 12.973 11.937 ( -4.241 -2.570 2.040) 5.363 12.272 ( 1.094 4.315 -2.956) 5.343 12.378 ( -2.504 8.438 -0.625) 8.824 12.667 ( 1.790 -2.379 -8.236) 8.757 13.036 ( -0.660 6.996 -0.140) 7.029 13.175 ( -3.927 5.703 3.040) 7.562 13.809 ( -7.894 -5.162 0.024) 9.431 13.931 ( 5.651 6.129 -4.638) 9.540 14.450 ( -1.817 -1.036 1.901) 2.827 14.946 ( -3.141 -2.140 -4.883) 6.188 15.357 ( -1.197 -2.332 4.552) 5.253 15.500 ( 6.563 1.158 1.477) 6.826 15.778 ( -3.370 3.642 -2.650) 5.625 16.231 ( -5.133 -1.764 -0.402) 5.443 16.508 ( 7.723 3.075 3.166) 8.895 16.672 ( -1.236 -8.001 6.844) 10.601 17.718 ( -4.421 -1.460 -4.427) 6.424 18.196 ( -6.910 6.954 -8.981) 13.295 18.577 ( -2.197 2.060 -5.997) 6.711 18.846 ( -3.854 -0.482 -4.404) 5.872 19.566 ( 5.957 -1.048 -0.481) 6.068 19.985 ( -3.531 -3.047 1.034) 4.777 20.263 ( -0.412 -9.145 7.396) 11.769 20.731 ( 2.467 0.783 0.831) 2.718 21.918 ( 4.920 2.212 8.287) 9.888 23.214 ( 5.596 -2.105 -6.096) 8.539 23.812 ( -4.101 7.630 5.910) 10.487 ======================= Grid point 328 (116/146) ======================= q-point: (-0.36 -0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.213 ( 0.000 5.847 -16.851) 17.837 5.430 ( -0.000 -11.363 13.198) 17.415 6.020 ( -0.000 -27.005 2.670) 27.137 6.148 ( 0.000 -9.937 -8.820) 13.287 7.439 ( 0.000 4.326 -13.867) 14.526 7.735 ( 0.000 6.129 -26.044) 26.756 8.830 ( 0.000 7.494 -4.355) 8.668 9.114 ( 0.000 -4.508 -1.790) 4.851 9.625 ( -0.000 -4.288 6.019) 7.390 9.724 ( 0.000 -22.614 -17.074) 28.335 10.202 ( -0.000 -5.340 0.776) 5.396 10.720 ( -0.000 -9.771 2.625) 10.118 10.754 ( 0.000 -3.015 -1.568) 3.398 11.113 ( -0.000 23.903 35.573) 42.857 11.481 ( -0.000 -5.276 13.135) 14.155 12.136 ( -0.000 -7.295 5.909) 9.387 12.217 ( 0.000 12.959 -6.169) 14.352 12.377 ( 0.000 2.556 -0.193) 2.564 12.592 ( 0.000 -4.863 -12.952) 13.835 13.156 ( 0.000 19.050 -8.686) 20.937 13.200 ( -0.000 -2.861 6.031) 6.675 13.813 ( 0.000 6.685 -6.508) 9.330 14.142 ( -0.000 -2.720 0.927) 2.874 14.338 ( -0.000 -7.157 1.051) 7.234 15.175 ( 0.000 5.386 0.594) 5.419 15.239 ( -0.000 1.733 1.804) 2.501 15.417 ( -0.000 -3.469 1.991) 3.999 15.842 ( 0.000 0.384 -5.796) 5.808 16.192 ( -0.000 2.300 4.360) 4.929 16.463 ( -0.000 -2.319 1.840) 2.960 16.664 ( -0.000 -5.050 7.007) 8.637 17.871 ( 0.000 2.734 -3.841) 4.714 18.220 ( 0.000 7.333 -17.362) 18.847 18.674 ( 0.000 -0.187 -15.310) 15.311 18.993 ( -0.000 1.655 1.262) 2.082 19.451 ( 0.000 3.921 -6.048) 7.208 19.980 ( -0.000 -1.478 10.589) 10.691 20.227 ( -0.000 -11.965 5.341) 13.103 20.701 ( -0.000 0.780 1.693) 1.864 21.860 ( -0.000 -7.515 16.342) 17.987 23.088 ( 0.000 0.659 -7.951) 7.979 23.909 ( -0.000 7.115 7.287) 10.185 ======================= Grid point 329 (117/146) ======================= q-point: (-0.27 -0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.947 ( -10.663 -25.781 -26.636) 38.572 5.396 ( 13.429 -12.411 -7.153) 19.635 5.867 ( -1.626 -20.837 19.101) 28.314 6.062 ( 2.415 3.203 -7.710) 8.691 7.273 ( -8.225 -1.314 -15.833) 17.890 7.670 ( 5.952 -3.855 -21.400) 22.544 8.632 ( -14.958 4.167 -4.183) 16.081 9.175 ( -5.285 -13.060 -5.731) 15.210 9.420 ( 15.737 -1.546 -4.642) 16.480 9.779 ( 14.112 -15.706 -1.419) 21.162 10.155 ( 4.244 -8.876 -2.782) 10.224 10.584 ( -4.493 -11.742 4.783) 13.451 10.777 ( 4.877 -4.375 -0.490) 6.570 11.389 ( -6.574 3.557 13.092) 15.076 11.665 ( 8.118 10.069 18.526) 22.594 12.037 ( -6.569 -6.470 5.904) 10.948 12.301 ( 0.267 4.341 -0.767) 4.416 12.439 ( 3.807 2.894 -0.617) 4.822 12.519 ( 3.482 5.152 -12.031) 13.543 13.143 ( -4.787 1.458 3.675) 6.209 13.323 ( 0.496 15.755 -1.005) 15.794 13.877 ( 3.181 7.634 -3.280) 8.896 13.944 ( -13.710 -4.080 -0.539) 14.315 14.402 ( 8.154 -3.466 0.506) 8.874 15.018 ( -11.349 1.971 -6.766) 13.359 15.334 ( 1.571 -2.804 -0.997) 3.366 15.507 ( 3.347 8.018 9.581) 12.933 15.778 ( -0.452 -2.487 -5.434) 5.993 16.238 ( 2.272 -4.799 2.244) 5.764 16.487 ( 0.122 4.212 3.753) 5.643 16.731 ( 0.412 5.597 10.414) 11.830 17.784 ( -7.509 1.900 -6.023) 9.812 18.191 ( 2.961 -0.466 -15.416) 15.705 18.539 ( -1.963 -0.602 -14.421) 14.566 18.933 ( -7.419 0.602 0.111) 7.444 19.462 ( 2.977 -1.831 -2.801) 4.479 19.986 ( -1.901 -5.885 -2.268) 6.587 20.234 ( 4.341 -2.637 11.149) 12.251 20.728 ( 0.309 1.839 2.084) 2.796 21.963 ( 2.618 1.686 16.966) 17.249 23.055 ( 3.832 -3.738 -7.899) 9.542 24.010 ( -3.433 9.749 8.540) 13.407 ======================= Grid point 340 (118/146) ======================= q-point: (-0.27 -0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.747 ( 0.000 -37.679 -33.707) 50.555 4.782 ( 0.000 -25.693 -20.407) 32.812 5.912 ( -0.000 -15.272 29.114) 32.877 6.045 ( 0.000 13.708 -11.852) 18.121 7.225 ( 0.000 -2.820 -18.835) 19.045 7.352 ( 0.000 -18.005 -18.465) 25.791 8.868 ( 0.000 -15.949 -11.322) 19.559 8.936 ( 0.000 7.043 -2.428) 7.450 9.170 ( 0.000 -12.242 -8.480) 14.892 9.618 ( -0.000 -5.596 6.346) 8.461 9.990 ( -0.000 -12.932 -1.134) 12.982 10.563 ( -0.000 -11.711 5.858) 13.095 10.690 ( -0.000 -3.721 0.714) 3.789 11.476 ( -0.000 -8.192 6.961) 10.751 11.789 ( -0.000 4.277 7.597) 8.718 12.034 ( -0.000 -12.563 4.065) 13.205 12.215 ( 0.000 -10.185 -4.732) 11.230 12.406 ( -0.000 -2.193 2.398) 3.250 12.620 ( 0.000 27.036 -3.113) 27.214 13.203 ( -0.000 -4.314 8.054) 9.137 13.476 ( 0.000 24.177 -5.312) 24.753 13.913 ( 0.000 6.206 1.025) 6.290 14.117 ( 0.000 1.378 -1.918) 2.362 14.224 ( 0.000 -1.283 -0.462) 1.364 15.088 ( 0.000 2.162 -13.790) 13.959 15.348 ( -0.000 5.583 3.741) 6.720 15.632 ( -0.000 9.304 13.567) 16.451 15.713 ( 0.000 -3.838 -5.013) 6.314 16.178 ( -0.000 -6.973 7.550) 10.278 16.578 ( 0.000 9.883 1.272) 9.965 16.866 ( -0.000 9.431 8.880) 12.953 17.874 ( 0.000 2.789 -3.185) 4.233 17.971 ( 0.000 -7.376 -18.241) 19.676 18.452 ( 0.000 1.496 -18.781) 18.840 19.010 ( -0.000 -3.030 5.764) 6.512 19.408 ( 0.000 0.188 -6.659) 6.662 19.925 ( 0.000 -4.975 -4.530) 6.728 20.249 ( -0.000 -0.339 11.048) 11.053 20.768 ( -0.000 3.319 2.317) 4.048 22.065 ( -0.000 -0.143 18.111) 18.112 22.943 ( 0.000 -3.667 -6.500) 7.463 24.191 ( -0.000 10.692 9.448) 14.268 ======================= Grid point 401 (119/146) ======================= q-point: ( 0.27 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 146 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.770 ( -0.000 0.000 43.340) 43.340 2.770 ( -0.000 0.000 43.340) 43.340 5.711 ( -0.000 0.000 90.460) 90.460 6.843 ( 0.000 -0.000 -7.623) 7.623 6.843 ( 0.000 -0.000 -7.623) 7.623 6.960 ( -0.000 0.000 0.233) 0.233 8.633 ( 0.000 -0.000 -1.208) 1.208 8.633 ( 0.000 -0.000 -1.208) 1.208 9.181 ( -0.000 0.000 3.234) 3.234 9.418 ( 0.000 0.000 0.297) 0.297 9.418 ( -0.000 0.000 0.297) 0.297 10.412 ( -0.000 0.000 20.936) 20.936 10.412 ( -0.000 0.000 20.936) 20.936 10.455 ( -0.000 0.000 27.678) 27.678 11.075 ( -0.000 0.000 6.745) 6.745 11.976 ( -0.000 0.000 16.103) 16.103 11.976 ( -0.000 0.000 16.103) 16.103 12.403 ( -0.000 0.000 14.853) 14.853 12.403 ( -0.000 0.000 14.853) 14.853 13.507 ( 0.000 -0.000 -2.538) 2.538 13.507 ( 0.000 -0.000 -2.538) 2.538 13.855 ( 0.000 -0.000 -48.804) 48.804 14.256 ( 0.000 -0.000 -7.230) 7.230 14.256 ( 0.000 -0.000 -7.230) 7.230 15.254 ( 0.000 -0.000 -3.290) 3.290 15.387 ( 0.000 -0.000 -6.959) 6.959 15.895 ( 0.000 -0.000 -9.432) 9.432 15.895 ( 0.000 -0.000 -9.432) 9.432 16.924 ( 0.000 -0.000 -17.313) 17.313 17.418 ( 0.000 -0.000 -5.388) 5.388 17.418 ( 0.000 -0.000 -5.388) 5.388 18.031 ( 0.000 -0.000 -2.540) 2.540 18.031 ( 0.000 -0.000 -2.540) 2.540 18.085 ( 0.000 -0.000 -8.962) 8.962 18.859 ( -0.000 0.000 1.515) 1.515 18.859 ( -0.000 0.000 1.515) 1.515 20.104 ( -0.000 0.000 12.463) 12.463 20.889 ( 0.000 -0.000 -3.247) 3.247 20.889 ( 0.000 -0.000 -3.247) 3.247 21.468 ( -0.000 0.000 12.848) 12.848 23.024 ( -0.000 0.000 10.226) 10.226 24.628 ( 0.000 -0.000 -8.268) 8.268 ======================= Grid point 402 (120/146) ======================= q-point: ( 0.36 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.890 ( -0.696 -0.402 41.911) 41.918 3.546 ( 30.483 17.599 38.122) 51.887 6.200 ( -5.079 -2.932 59.679) 59.967 6.750 ( -2.083 -1.203 -5.780) 6.260 6.978 ( 0.851 0.491 0.084) 0.986 7.003 ( 18.215 10.517 9.953) 23.269 8.545 ( -12.154 -7.017 4.472) 14.730 8.578 ( -2.124 -1.227 -0.442) 2.493 9.251 ( 8.629 4.982 -1.037) 10.018 9.329 ( -1.982 -1.144 2.341) 3.274 9.651 ( 12.411 7.165 -3.673) 14.794 10.402 ( -6.058 -3.498 23.532) 24.550 10.576 ( 1.517 0.876 18.458) 18.541 10.844 ( 11.550 6.669 27.419) 30.491 11.130 ( 1.358 0.784 6.719) 6.899 11.984 ( -1.672 -0.965 11.556) 11.716 12.167 ( 4.042 2.334 7.378) 8.730 12.405 ( -3.830 -2.211 15.135) 15.768 12.682 ( 9.240 5.335 20.299) 22.932 13.207 ( -9.669 -5.583 -14.826) 18.560 13.634 ( 4.542 2.622 -41.811) 42.139 13.726 ( 10.332 5.965 -1.622) 12.040 14.043 ( -7.592 -4.383 -12.052) 14.903 14.336 ( 5.180 2.991 -7.255) 9.403 15.250 ( 1.527 0.881 -3.043) 3.517 15.366 ( 0.590 0.341 -4.702) 4.751 15.646 ( -13.850 -7.996 -2.962) 16.265 15.853 ( -0.980 -0.566 -9.555) 9.622 16.753 ( -4.541 -2.622 -15.541) 16.402 17.323 ( -4.670 -2.696 -2.180) 5.817 17.477 ( 3.031 1.750 -5.309) 6.358 17.877 ( -9.225 -5.326 -3.401) 11.182 17.918 ( -0.081 -0.047 -6.928) 6.928 18.163 ( 3.193 1.844 -3.264) 4.924 18.848 ( 1.787 1.032 2.146) 2.977 18.894 ( -1.724 -0.996 0.932) 2.198 20.199 ( 2.470 1.426 9.130) 9.565 20.765 ( -7.934 -4.581 -1.767) 9.330 20.856 ( -0.756 -0.436 -2.993) 3.118 21.720 ( 13.359 7.713 10.982) 18.936 23.103 ( 0.973 0.562 8.707) 8.779 24.469 ( -8.815 -5.090 -9.343) 13.817 ======================= Grid point 403 (121/146) ======================= q-point: ( 0.45 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.258 ( 10.695 6.175 37.087) 39.089 4.447 ( 29.085 16.792 39.025) 51.486 6.268 ( -5.354 -3.091 9.924) 11.693 6.672 ( -3.742 -2.160 -1.373) 4.533 6.976 ( -1.565 -0.904 1.657) 2.452 7.735 ( 28.287 16.332 45.529) 56.034 8.253 ( -15.401 -8.892 1.868) 17.882 8.555 ( 0.311 0.179 0.401) 0.538 9.365 ( 3.727 2.152 2.353) 4.905 9.417 ( 5.559 3.209 -3.629) 7.373 9.867 ( 10.822 6.248 -5.027) 13.469 10.517 ( 4.708 2.718 17.023) 17.870 10.702 ( 0.390 0.225 13.548) 13.556 11.146 ( 1.417 0.818 16.128) 16.211 11.227 ( 3.522 2.034 7.343) 8.394 12.100 ( 6.686 3.860 10.096) 12.710 12.250 ( 1.732 1.000 1.324) 2.398 12.389 ( -6.262 -3.615 13.692) 15.484 12.988 ( -1.941 -1.120 -14.746) 14.915 13.019 ( 9.270 5.352 18.654) 21.507 13.440 ( 0.678 0.391 -36.171) 36.180 13.694 ( -9.563 -5.521 -15.468) 19.005 13.987 ( 8.183 4.724 -3.461) 10.062 14.371 ( 1.514 0.874 -3.129) 3.584 15.254 ( -7.969 -4.601 -3.229) 9.752 15.281 ( 2.862 1.652 -2.125) 3.928 15.462 ( -3.049 -1.760 3.210) 4.764 15.735 ( -4.246 -2.452 -8.763) 10.041 16.551 ( -5.384 -3.109 -12.925) 14.343 17.186 ( -9.302 -5.371 3.329) 11.245 17.389 ( -6.421 -3.707 -5.393) 9.168 17.663 ( -6.789 -3.920 -3.860) 8.738 18.014 ( 10.189 5.883 -4.601) 12.633 18.153 ( -3.116 -1.799 -0.273) 3.609 18.834 ( -2.813 -1.624 0.613) 3.305 18.934 ( 4.264 2.462 2.934) 5.732 20.305 ( 1.973 1.139 5.294) 5.764 20.595 ( -6.301 -3.638 -1.291) 7.390 20.819 ( -1.027 -0.593 -2.671) 2.923 22.091 ( 14.122 8.153 10.155) 19.210 23.138 ( -2.520 -1.455 3.800) 4.786 24.186 ( -10.058 -5.807 -10.883) 15.916 ======================= Grid point 404 (122/146) ======================= q-point: ( 0.55 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.788 ( 17.596 10.159 31.288) 37.306 5.198 ( 12.462 7.195 46.315) 48.499 6.222 ( 3.131 1.808 -7.132) 7.996 6.525 ( -11.739 -6.778 3.689) 14.048 6.967 ( -0.646 -0.373 6.032) 6.078 7.865 ( -19.548 -11.286 3.443) 22.833 8.595 ( 3.054 1.763 0.078) 3.527 8.685 ( 29.537 17.053 31.913) 46.709 9.438 ( 1.016 0.587 -2.393) 2.665 9.502 ( 7.411 4.279 1.438) 8.678 10.041 ( 7.283 4.205 -0.412) 8.420 10.735 ( 6.520 3.764 1.599) 7.696 10.765 ( -0.623 -0.360 7.224) 7.260 11.183 ( 0.237 0.137 2.918) 2.931 11.368 ( 4.632 2.674 8.120) 9.723 12.277 ( 1.234 0.713 -1.624) 2.161 12.294 ( 2.528 1.460 3.851) 4.832 12.375 ( -0.867 -0.501 14.049) 14.085 12.816 ( -8.918 -5.149 -11.899) 15.736 13.231 ( -1.609 -0.929 1.275) 2.253 13.326 ( 9.248 5.339 -18.268) 21.161 13.375 ( -5.761 -3.326 -12.349) 14.027 14.127 ( 5.861 3.384 -1.764) 6.994 14.380 ( -0.448 -0.258 3.071) 3.114 15.115 ( -4.149 -2.395 0.245) 4.797 15.327 ( 1.798 1.038 -1.746) 2.713 15.428 ( -2.430 -1.403 2.475) 3.741 15.594 ( -3.643 -2.103 -3.864) 5.712 16.388 ( -2.402 -1.387 -10.255) 10.623 16.954 ( -13.772 -7.951 2.771) 16.142 17.204 ( -6.839 -3.948 -6.679) 10.342 17.592 ( 0.827 0.478 0.709) 1.190 18.030 ( -8.132 -4.695 3.367) 9.975 18.200 ( 7.037 4.063 0.830) 8.168 18.840 ( 3.509 2.026 -0.112) 4.053 19.056 ( 4.964 2.866 4.101) 7.047 20.310 ( -3.355 -1.937 1.770) 4.259 20.498 ( -3.166 -1.828 -0.240) 3.664 20.780 ( -1.027 -0.593 -2.391) 2.669 22.417 ( 9.748 5.628 8.721) 14.239 23.011 ( -8.418 -4.860 -5.727) 11.282 23.976 ( -2.534 -1.463 -9.043) 9.504 ======================= Grid point 405 (123/146) ======================= q-point: ( 0.64 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.371 ( 18.835 10.875 25.813) 33.754 5.416 ( -15.819 -9.133 35.760) 40.155 6.231 ( -18.335 -10.586 8.208) 22.707 6.417 ( 12.223 7.057 4.319) 14.760 7.031 ( 0.807 0.466 11.991) 12.027 7.451 ( -14.479 -8.359 -11.826) 20.479 8.678 ( 4.831 2.789 -0.629) 5.614 9.113 ( -0.454 -0.262 7.121) 7.140 9.578 ( 2.409 1.391 12.556) 12.860 9.657 ( 5.674 3.276 0.089) 6.552 10.245 ( 10.983 6.341 4.118) 13.334 10.765 ( 0.788 0.455 -6.061) 6.129 10.777 ( -0.788 -0.455 1.485) 1.741 11.248 ( 6.102 3.523 -4.215) 8.211 11.506 ( 3.247 1.875 7.168) 8.090 12.239 ( -9.668 -5.582 12.398) 16.684 12.285 ( 0.628 0.362 -2.607) 2.706 12.458 ( 0.951 0.549 -7.735) 7.813 12.671 ( 7.702 4.447 -1.553) 9.028 12.912 ( -12.158 -7.019 -21.550) 25.719 13.361 ( -0.204 -0.118 -1.676) 1.693 13.527 ( 12.660 7.309 -2.570) 14.842 14.195 ( 0.564 0.326 -0.296) 0.715 14.375 ( -3.596 -2.076 6.273) 7.522 15.055 ( -3.072 -1.774 3.548) 5.017 15.303 ( -1.168 -0.674 -3.872) 4.100 15.422 ( 1.468 0.847 2.102) 2.700 15.591 ( 2.147 1.239 6.041) 6.530 16.319 ( 1.321 0.763 -8.592) 8.726 16.684 ( -10.929 -6.310 -1.316) 12.688 17.014 ( -6.222 -3.593 -9.045) 11.551 17.669 ( 3.790 2.188 4.774) 6.476 17.906 ( -5.551 -3.205 7.360) 9.760 18.315 ( 1.046 0.604 8.977) 9.058 18.953 ( 6.524 3.767 -1.974) 7.788 19.194 ( 4.871 2.812 5.565) 7.912 20.222 ( -5.334 -3.079 -0.622) 6.190 20.408 ( -5.419 -3.129 1.132) 6.359 20.749 ( -0.400 -0.231 -2.247) 2.294 22.499 ( -4.632 -2.674 -10.730) 11.989 22.862 ( 0.402 0.232 1.491) 1.562 23.955 ( 4.465 2.578 -6.595) 8.371 ======================= Grid point 406 (124/146) ======================= q-point: (-0.27 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.834 ( 6.674 3.854 21.157) 22.517 5.161 ( -26.042 -15.036 31.284) 43.393 5.940 ( -11.369 -6.564 12.002) 17.787 6.396 ( -12.582 -7.264 -19.136) 24.026 7.135 ( -0.233 -0.134 16.897) 16.899 7.321 ( 2.812 1.624 10.649) 11.133 8.793 ( 6.259 3.614 -0.114) 7.228 9.056 ( -6.536 -3.774 3.914) 8.502 9.455 ( -17.604 -10.164 9.227) 22.324 9.710 ( -0.313 -0.181 -2.608) 2.633 10.241 ( -9.655 -5.574 -4.655) 12.082 10.751 ( -1.661 -0.959 -1.527) 2.452 10.753 ( -4.524 -2.612 -0.337) 5.235 11.539 ( 22.688 13.099 -6.723) 27.047 11.571 ( -0.866 -0.500 2.655) 2.837 12.223 ( 5.154 2.976 9.445) 11.164 12.250 ( -3.879 -2.240 -2.663) 5.211 12.366 ( -4.645 -2.682 -4.090) 6.745 12.542 ( -8.080 -4.665 -18.658) 20.861 13.003 ( 18.475 10.667 5.647) 22.068 13.313 ( -1.930 -1.114 -5.467) 5.904 13.760 ( 10.080 5.819 -1.905) 11.794 14.148 ( -3.820 -2.206 0.667) 4.461 14.302 ( -6.044 -3.489 4.727) 8.429 15.029 ( -2.907 -1.678 9.632) 10.200 15.289 ( 2.372 1.369 -3.397) 4.364 15.519 ( 7.085 4.091 -3.472) 8.888 15.692 ( 1.197 0.691 8.825) 8.933 16.297 ( -0.280 -0.162 -6.536) 6.544 16.519 ( -2.144 -1.238 -3.225) 4.065 16.852 ( -1.244 -0.718 -11.304) 11.395 17.783 ( 3.585 2.070 4.964) 6.464 17.913 ( -0.718 -0.415 13.805) 13.829 18.373 ( -2.506 -1.447 15.166) 15.440 19.043 ( 2.855 1.648 -3.780) 5.015 19.324 ( 3.367 1.944 6.679) 7.728 20.060 ( -9.136 -5.275 1.174) 10.615 20.320 ( -2.127 -1.228 -3.407) 4.200 20.740 ( 1.086 0.627 -2.246) 2.572 22.250 ( -4.662 -2.692 -22.724) 23.353 22.931 ( 0.196 0.113 7.896) 7.899 24.052 ( 8.279 4.780 -7.040) 11.872 ======================= Grid point 413 (125/146) ======================= q-point: ( 0.36 0.36 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.327 ( -0.000 16.306 39.524) 42.756 3.646 ( -0.000 22.572 33.003) 39.984 6.485 ( -0.000 -12.070 21.766) 24.888 6.709 ( 0.000 2.158 -16.412) 16.553 6.987 ( 0.000 2.661 -0.170) 2.666 7.102 ( -0.000 17.775 48.653) 51.799 8.589 ( -0.000 -0.967 4.354) 4.460 8.712 ( -0.000 3.579 2.335) 4.274 9.088 ( -0.000 -7.440 2.407) 7.820 9.458 ( 0.000 4.114 -1.744) 4.468 9.533 ( 0.000 6.462 -3.620) 7.407 10.602 ( -0.000 -1.876 19.785) 19.874 10.739 ( -0.000 0.650 29.124) 29.131 10.954 ( -0.000 8.036 23.303) 24.650 11.163 ( -0.000 0.174 6.199) 6.201 12.004 ( -0.000 -4.267 4.333) 6.081 12.264 ( 0.000 10.612 2.408) 10.882 12.513 ( -0.000 -6.462 21.331) 22.289 12.801 ( -0.000 7.866 15.476) 17.360 13.175 ( 0.000 -0.761 -39.037) 39.044 13.222 ( 0.000 -10.796 -6.745) 12.730 13.758 ( 0.000 14.167 -14.070) 19.966 14.020 ( 0.000 -1.251 -10.774) 10.847 14.259 ( 0.000 4.833 -9.137) 10.337 15.230 ( 0.000 1.831 -2.805) 3.349 15.358 ( 0.000 2.272 -2.771) 3.583 15.688 ( 0.000 -10.673 -4.961) 11.769 15.748 ( 0.000 -3.232 -3.909) 5.072 16.605 ( 0.000 -10.027 -15.824) 18.734 17.358 ( 0.000 -2.593 -3.048) 4.001 17.432 ( 0.000 5.029 -2.179) 5.481 17.777 ( 0.000 -7.323 -4.637) 8.668 17.966 ( 0.000 -3.935 -4.362) 5.874 18.147 ( 0.000 7.925 -4.778) 9.254 18.760 ( -0.000 -7.078 2.345) 7.456 19.011 ( 0.000 9.346 -0.276) 9.350 20.227 ( -0.000 -1.621 7.706) 7.875 20.749 ( -0.000 -8.432 -1.996) 8.665 20.846 ( 0.000 -0.601 -3.070) 3.128 21.788 ( -0.000 14.752 11.085) 18.452 23.149 ( -0.000 -1.483 8.552) 8.680 24.405 ( 0.000 -11.428 -8.874) 14.469 ======================= Grid point 414 (126/146) ======================= q-point: ( 0.45 0.36 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.624 ( -7.999 22.834 35.134) 42.659 4.361 ( 29.144 21.702 28.085) 45.925 6.374 ( -8.097 -7.114 2.520) 11.069 6.664 ( 1.693 2.402 -9.421) 9.869 7.008 ( -0.807 2.796 0.332) 2.929 7.773 ( 19.028 17.346 49.521) 55.815 8.522 ( -15.875 -5.693 9.230) 19.225 8.626 ( -6.060 3.237 2.694) 7.379 9.219 ( 12.134 -0.991 0.257) 12.177 9.428 ( -0.683 4.719 -0.676) 4.816 9.685 ( 11.623 5.516 -7.235) 14.760 10.683 ( -4.231 1.863 20.815) 21.322 10.860 ( -5.207 2.067 20.475) 21.227 11.188 ( 2.751 -2.665 11.066) 11.710 11.242 ( 4.254 1.654 9.854) 10.860 12.021 ( 4.718 -0.823 0.242) 4.795 12.335 ( -2.097 9.396 -3.045) 10.097 12.543 ( -4.816 -5.188 16.197) 17.676 12.824 ( 3.831 -2.991 -21.245) 21.794 13.087 ( 3.323 2.272 8.356) 9.275 13.188 ( 4.752 -0.512 -11.327) 12.294 13.689 ( -5.353 0.062 -19.212) 19.944 13.964 ( -1.836 8.657 -4.060) 9.737 14.304 ( 5.690 3.369 -6.796) 9.482 15.245 ( 0.845 1.487 -2.267) 2.840 15.296 ( -4.521 -3.314 -4.709) 7.321 15.548 ( -4.561 -1.276 3.248) 5.743 15.701 ( -0.991 -3.008 -4.096) 5.177 16.413 ( 0.720 -11.865 -13.189) 17.755 17.235 ( -6.390 -8.908 -0.903) 11.000 17.439 ( -1.526 -2.124 -0.884) 2.761 17.706 ( -5.384 -0.546 -3.253) 6.313 17.921 ( 5.135 5.774 -4.136) 8.764 18.205 ( 0.297 5.512 -2.105) 5.908 18.712 ( 0.334 -8.848 0.647) 8.878 19.073 ( -2.165 10.566 0.527) 10.798 20.283 ( 3.742 -2.371 4.957) 6.648 20.623 ( -4.175 -7.243 -1.798) 8.552 20.806 ( -1.045 -1.384 -2.558) 3.090 22.077 ( 8.435 14.771 10.425) 19.950 23.159 ( -1.069 -6.044 4.817) 7.802 24.175 ( -6.288 -12.110 -8.887) 16.284 ======================= Grid point 415 (127/146) ======================= q-point: ( 0.55 0.36 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.003 ( 1.648 23.996 30.472) 38.821 5.194 ( 29.465 13.976 28.100) 43.048 6.184 ( -6.889 -3.910 -6.144) 10.025 6.638 ( -4.129 0.043 -0.479) 4.157 7.023 ( -1.128 3.588 2.426) 4.476 8.171 ( -22.773 -3.956 2.733) 23.275 8.546 ( 10.654 1.117 10.607) 15.075 8.641 ( 13.246 9.099 27.132) 31.534 9.331 ( 3.928 -0.250 1.626) 4.259 9.539 ( 4.908 10.942 -0.344) 11.997 9.915 ( 13.323 7.307 -3.584) 15.612 10.761 ( -2.969 -1.611 13.721) 14.131 10.898 ( -5.530 3.059 12.626) 14.119 11.164 ( -0.904 -5.688 -0.928) 5.833 11.386 ( 4.306 3.803 7.056) 9.099 12.115 ( 7.668 0.306 -5.410) 9.390 12.326 ( -0.800 5.724 -12.654) 13.911 12.535 ( -4.393 -3.233 15.238) 16.184 12.759 ( 0.867 -4.878 -9.565) 10.772 13.070 ( 2.484 -7.122 -8.653) 11.479 13.296 ( 4.212 0.437 3.477) 5.479 13.456 ( -9.771 9.980 -13.770) 19.613 14.024 ( 3.574 1.092 0.751) 3.811 14.389 ( 4.371 3.653 -2.407) 6.184 15.127 ( -3.789 -5.293 -2.616) 7.015 15.308 ( 2.258 2.958 0.040) 3.722 15.484 ( -4.926 -1.879 0.541) 5.300 15.643 ( -3.488 1.722 0.675) 3.948 16.263 ( 2.436 -8.329 -9.857) 13.133 16.989 ( -8.019 -15.750 -1.859) 17.771 17.332 ( -8.516 -1.967 -2.563) 9.108 17.636 ( -3.250 5.711 1.420) 6.723 18.111 ( 7.545 6.386 0.109) 9.886 18.191 ( -6.549 4.727 1.085) 8.149 18.653 ( 6.463 -10.055 -1.685) 12.071 19.171 ( -0.405 12.021 3.555) 12.542 20.325 ( 0.381 -3.286 1.594) 3.672 20.498 ( -2.193 -4.258 -1.929) 5.164 20.764 ( -0.348 -1.924 -2.075) 2.851 22.405 ( 8.017 9.450 11.157) 16.675 23.024 ( -6.177 -11.043 -4.512) 13.434 23.942 ( -3.931 -6.135 -7.047) 10.137 ======================= Grid point 416 (128/146) ======================= q-point: ( 0.64 0.36 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.483 ( 7.766 22.376 25.978) 35.155 5.700 ( -2.490 -10.177 27.138) 29.090 6.150 ( 15.467 5.987 -11.378) 20.113 6.503 ( -11.545 -1.654 5.157) 12.752 7.087 ( 0.682 2.579 7.070) 7.556 7.732 ( -26.746 -1.880 1.137) 26.836 8.532 ( 4.812 -8.981 -2.973) 10.614 9.187 ( 14.117 2.222 9.973) 17.427 9.388 ( 0.788 0.934 2.542) 2.820 9.844 ( 7.365 22.536 9.297) 25.467 10.163 ( 10.130 5.352 6.919) 13.384 10.695 ( -2.764 -5.341 -1.479) 6.194 10.903 ( -5.648 5.409 3.475) 8.557 11.149 ( 3.088 -1.811 -1.378) 3.836 11.521 ( 3.443 2.721 4.283) 6.132 12.197 ( 7.169 0.076 -12.377) 14.304 12.252 ( -1.051 -1.875 -10.069) 10.296 12.509 ( -5.304 -3.048 10.475) 12.130 12.640 ( -2.406 -0.877 -1.643) 3.043 12.887 ( -6.219 -5.439 -14.259) 16.479 13.311 ( 2.718 -3.643 -4.290) 6.250 13.525 ( 2.344 14.432 3.086) 14.943 14.075 ( 4.070 -6.850 2.069) 8.232 14.465 ( 1.060 3.211 0.728) 3.459 15.036 ( -0.787 -5.399 -0.163) 5.459 15.353 ( -2.863 4.822 -1.263) 5.748 15.416 ( 0.226 -2.758 4.611) 5.378 15.634 ( -0.582 1.722 3.635) 4.064 16.224 ( 3.481 0.075 -6.253) 7.157 16.706 ( -6.608 -14.414 -3.748) 16.294 17.125 ( -12.012 -0.764 -5.986) 13.442 17.681 ( -0.873 3.476 5.021) 6.168 18.051 ( -7.539 0.994 3.238) 8.265 18.332 ( 6.052 3.500 6.942) 9.852 18.730 ( 11.771 -5.439 -1.284) 13.030 19.312 ( -0.015 12.603 4.445) 13.364 20.246 ( -4.206 -4.895 -1.576) 6.643 20.441 ( -1.595 -2.829 -0.712) 3.325 20.736 ( -0.001 -0.825 -1.783) 1.964 22.477 ( -7.035 -12.969 -2.278) 14.929 22.883 ( 1.681 6.869 -1.456) 7.220 23.860 ( 2.467 -1.794 -5.177) 6.009 ======================= Grid point 417 (129/146) ======================= q-point: (-0.27 0.36 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.933 ( 4.838 11.934 23.320) 26.639 5.534 ( -13.355 -8.985 13.016) 20.701 6.142 ( -10.509 -8.503 4.106) 14.128 6.388 ( -9.847 -6.235 -13.990) 18.208 7.153 ( 3.597 -3.000 12.225) 13.092 7.528 ( -7.523 10.646 16.167) 20.768 8.545 ( 10.273 -11.099 -0.894) 15.150 9.313 ( -2.786 0.113 2.309) 3.620 9.405 ( 0.435 -1.200 2.812) 3.088 9.999 ( -15.474 11.412 9.828) 21.593 10.297 ( -4.167 -1.914 -1.855) 4.947 10.708 ( 3.949 -1.498 -0.471) 4.250 10.869 ( -7.293 4.757 0.371) 8.715 11.229 ( 14.465 5.644 -9.982) 18.459 11.594 ( 2.130 2.082 -0.534) 3.026 12.098 ( 3.774 -3.987 -9.850) 11.276 12.283 ( 1.291 3.304 -4.106) 5.426 12.418 ( -2.695 -7.362 -3.703) 8.670 12.546 ( -7.598 -0.763 1.979) 7.889 12.903 ( 9.951 9.584 3.734) 14.312 13.275 ( 1.647 -2.263 -7.035) 7.571 13.715 ( 4.190 8.821 3.985) 10.547 14.037 ( 1.917 -13.365 0.907) 13.532 14.467 ( -4.593 2.482 0.685) 5.265 14.992 ( 1.607 -7.926 4.094) 9.064 15.357 ( -2.819 7.687 -0.591) 8.209 15.439 ( 2.055 -1.112 0.286) 2.355 15.715 ( 3.869 0.693 6.636) 7.713 16.261 ( 0.913 2.538 -1.500) 3.086 16.509 ( -1.273 -4.456 -6.551) 8.025 16.868 ( -10.908 -2.436 -8.941) 14.313 17.722 ( 2.269 -3.320 6.063) 7.275 18.060 ( 0.143 5.002 8.563) 9.918 18.468 ( 1.243 -0.347 12.395) 12.462 18.863 ( 10.216 -4.829 -0.080) 11.300 19.433 ( -1.733 9.534 3.438) 10.282 20.108 ( -4.641 -5.633 -2.708) 7.785 20.359 ( -5.290 -1.765 -1.360) 5.740 20.722 ( 0.016 0.429 -1.797) 1.847 22.152 ( -6.402 -9.016 -17.314) 20.543 23.014 ( -0.188 6.718 7.162) 9.822 23.900 ( 7.714 0.137 -6.277) 9.946 ======================= Grid point 425 (130/146) ======================= q-point: ( 0.45 0.45 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.263 ( -0.000 29.802 35.130) 46.068 4.362 ( -0.000 20.533 13.626) 24.643 6.409 ( -0.000 -5.765 0.698) 5.807 6.583 ( 0.000 5.399 -11.763) 12.942 7.049 ( 0.000 5.024 -1.414) 5.219 8.093 ( -0.000 13.126 44.741) 46.627 8.661 ( -0.000 -0.177 3.777) 3.781 8.774 ( 0.000 1.670 -1.346) 2.145 9.091 ( -0.000 0.024 11.088) 11.088 9.494 ( 0.000 6.358 0.667) 6.393 9.574 ( 0.000 4.722 -5.132) 6.974 10.871 ( -0.000 5.147 15.533) 16.364 11.063 ( -0.000 -5.962 19.375) 20.272 11.204 ( -0.000 -3.394 4.938) 5.992 11.251 ( -0.000 0.110 11.608) 11.608 11.981 ( 0.000 2.108 -1.549) 2.616 12.350 ( 0.000 4.164 -22.508) 22.890 12.602 ( 0.000 2.991 -17.926) 18.174 12.640 ( -0.000 -7.973 14.084) 16.185 13.033 ( -0.000 -4.120 3.847) 5.637 13.207 ( -0.000 2.209 3.633) 4.252 13.640 ( 0.000 4.995 -15.655) 16.433 14.081 ( 0.000 10.391 -0.553) 10.405 14.209 ( 0.000 2.298 -7.948) 8.274 15.250 ( 0.000 3.028 -1.663) 3.454 15.251 ( 0.000 -7.022 -5.483) 8.909 15.600 ( -0.000 0.699 2.623) 2.714 15.672 ( 0.000 -1.115 -1.792) 2.111 16.217 ( 0.000 -11.669 -8.860) 14.652 17.225 ( -0.000 -10.428 -0.237) 10.431 17.345 ( 0.000 -9.379 -2.972) 9.839 17.832 ( 0.000 -1.810 -6.002) 6.269 17.841 ( 0.000 11.834 2.250) 12.046 18.225 ( 0.000 6.729 -2.530) 7.189 18.706 ( -0.000 -0.669 1.562) 1.699 19.162 ( 0.000 8.995 -3.118) 9.520 20.239 ( -0.000 -6.015 5.374) 8.066 20.571 ( -0.000 -7.752 -1.567) 7.909 20.790 ( 0.000 -1.685 -2.198) 2.769 22.228 ( -0.000 16.827 10.260) 19.708 23.114 ( -0.000 -12.421 2.767) 12.726 24.053 ( 0.000 -12.683 -6.923) 14.449 ======================= Grid point 426 (131/146) ======================= q-point: ( 0.55 0.45 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.473 ( -6.894 25.655 18.944) 32.628 5.016 ( 24.251 18.541 18.132) 35.505 6.265 ( -9.593 -2.335 -3.696) 10.543 6.638 ( 4.169 2.450 -2.307) 5.358 7.088 ( -0.231 6.585 -1.349) 6.725 8.369 ( 5.655 -14.240 2.361) 15.503 8.536 ( -16.612 3.394 2.500) 17.138 8.798 ( -1.930 15.065 15.025) 21.364 9.314 ( 9.873 1.965 12.653) 16.169 9.556 ( 2.567 9.546 3.953) 10.646 9.767 ( 12.482 11.991 0.974) 17.336 10.919 ( -7.914 -4.224 11.282) 14.413 11.060 ( -3.169 -4.995 0.978) 5.996 11.126 ( -0.578 -3.896 5.166) 6.496 11.389 ( 3.934 1.162 11.071) 11.807 12.023 ( 1.855 4.564 -4.369) 6.585 12.211 ( 3.220 1.830 -26.779) 27.034 12.597 ( -0.084 -0.761 0.505) 0.917 12.643 ( 2.614 -5.384 2.343) 6.427 13.038 ( -3.200 -2.614 9.069) 9.966 13.209 ( 2.707 -5.116 -4.590) 7.387 13.582 ( -3.621 10.137 -11.620) 15.839 14.096 ( -4.729 4.828 3.490) 7.606 14.295 ( 7.041 4.561 -3.218) 8.985 15.123 ( -3.818 -5.310 -2.859) 7.138 15.292 ( 2.789 2.135 0.022) 3.512 15.549 ( -4.504 -0.131 -1.370) 4.709 15.697 ( 0.534 0.362 0.879) 1.091 16.099 ( 1.895 -5.900 -4.510) 7.665 16.977 ( -10.494 -15.427 -2.010) 18.766 17.300 ( 2.787 -9.996 -2.152) 10.598 17.763 ( -2.540 6.049 -2.757) 7.116 18.030 ( 7.656 4.021 3.666) 9.393 18.317 ( 1.851 11.148 -2.468) 11.567 18.611 ( -10.472 -0.003 -1.478) 10.576 19.258 ( 3.471 8.996 -0.337) 9.648 20.250 ( 4.261 -6.749 3.740) 8.815 20.481 ( -2.149 -5.208 -1.162) 5.753 20.746 ( -1.317 -1.970 -1.406) 2.755 22.476 ( 4.112 9.808 12.027) 16.055 22.946 ( -3.237 -15.509 -4.661) 16.515 23.895 ( -2.562 -7.255 -4.294) 8.811 ======================= Grid point 427 (132/146) ======================= q-point: ( 0.64 0.45 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.794 ( 2.465 25.000 16.549) 30.082 5.580 ( 18.653 0.360 10.637) 21.476 6.078 ( -6.370 3.806 -7.297) 10.407 6.637 ( -4.326 -5.177 3.388) 7.550 7.150 ( -0.100 5.059 1.853) 5.389 8.106 ( -17.243 -8.276 -1.042) 19.154 8.379 ( -0.123 -5.120 -6.721) 8.450 8.994 ( 4.080 2.651 4.064) 6.340 9.514 ( 2.875 7.264 6.016) 9.860 9.903 ( 14.521 20.220 8.133) 26.188 10.120 ( 11.326 13.396 9.502) 19.950 10.728 ( -8.114 -10.389 0.264) 13.185 10.972 ( -0.265 -2.667 -2.429) 3.617 11.175 ( -1.203 1.568 7.394) 7.654 11.509 ( 2.681 0.507 5.295) 5.957 12.035 ( 2.377 2.406 -13.478) 13.896 12.162 ( 3.154 1.685 -10.352) 10.952 12.511 ( -3.045 -11.850 0.069) 12.235 12.671 ( 1.423 4.733 -1.537) 5.176 12.952 ( -9.403 -4.173 7.061) 12.477 13.165 ( 3.701 -6.413 -6.917) 10.133 13.622 ( 2.034 11.696 -3.101) 12.270 14.067 ( -4.174 -2.611 3.846) 6.248 14.417 ( 4.797 3.086 -1.412) 5.876 15.020 ( -2.249 -3.148 -0.774) 3.945 15.384 ( 4.398 2.982 2.857) 6.033 15.478 ( -5.203 -0.050 0.643) 5.243 15.651 ( -2.019 -2.741 -0.406) 3.428 16.152 ( 5.954 5.431 -0.793) 8.098 16.657 ( -8.615 -15.596 -3.013) 18.070 17.185 ( -3.981 -8.953 -2.602) 10.138 17.789 ( -1.592 5.040 0.003) 5.285 18.144 ( -0.380 -7.802 3.887) 8.725 18.328 ( -3.797 9.214 -1.061) 10.022 18.590 ( 5.702 8.879 -1.906) 10.723 19.407 ( 3.496 8.420 2.289) 9.400 20.238 ( -1.408 -7.814 1.182) 8.027 20.422 ( 0.115 -1.062 -0.726) 1.292 20.715 ( 0.196 -0.783 -0.731) 1.089 22.446 ( -9.097 -23.491 3.645) 25.453 22.904 ( 5.895 13.585 -2.755) 15.063 23.796 ( -1.052 -3.750 -2.336) 4.542 ======================= Grid point 428 (133/146) ======================= q-point: ( 0.73 0.45 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.170 ( 2.910 17.738 18.115) 25.520 5.587 ( -4.322 -10.193 -8.408) 13.902 6.118 ( 2.541 -1.632 -0.995) 3.179 6.464 ( -9.980 -8.825 0.030) 13.322 7.166 ( -0.202 -2.159 5.011) 5.461 7.819 ( -11.053 -4.343 6.636) 13.604 8.379 ( 3.936 2.190 1.454) 4.732 9.059 ( 8.759 -8.930 -3.009) 12.865 9.639 ( -2.219 12.481 3.358) 13.114 10.244 ( 4.401 11.107 -0.781) 11.973 10.403 ( -5.864 3.441 11.355) 13.235 10.592 ( 5.536 0.110 -6.097) 8.236 11.002 ( 3.429 9.463 -3.877) 10.786 11.151 ( -7.233 -0.934 1.847) 7.523 11.552 ( 2.373 -0.935 -1.177) 2.809 11.972 ( 0.367 -3.194 -5.595) 6.453 12.212 ( 5.578 2.493 -3.511) 7.047 12.341 ( -2.576 -7.511 -4.319) 9.039 12.707 ( -5.472 -0.105 6.370) 8.398 12.887 ( 2.584 3.504 2.858) 5.208 13.140 ( 4.274 -2.267 -6.573) 8.162 13.770 ( 4.155 8.456 1.194) 9.497 13.957 ( -4.567 -9.228 2.417) 10.577 14.467 ( 1.719 -1.113 -1.550) 2.568 14.976 ( -1.513 -2.432 1.676) 3.318 15.389 ( -1.630 -2.068 -0.010) 2.633 15.494 ( -0.909 6.550 0.792) 6.660 15.662 ( 5.003 -0.486 1.937) 5.387 16.300 ( 0.066 3.786 3.803) 5.367 16.420 ( -0.097 -4.865 -6.382) 8.025 16.967 ( -10.913 -9.306 -3.442) 14.749 17.758 ( -4.590 -1.416 2.269) 5.313 18.068 ( 2.705 -3.613 2.808) 5.316 18.457 ( 6.341 2.745 4.042) 8.005 18.761 ( 4.807 6.298 1.811) 8.127 19.531 ( 1.223 7.044 0.674) 7.181 20.100 ( -4.552 -8.149 -1.255) 9.417 20.407 ( -2.716 -1.196 -0.503) 3.010 20.722 ( 0.317 1.326 -0.667) 1.518 22.081 ( -8.395 -14.500 -6.446) 17.952 23.121 ( 3.235 11.669 3.410) 12.580 23.760 ( 2.944 -2.870 -3.084) 5.140 ======================= Grid point 437 (134/146) ======================= q-point: ( 0.55 0.55 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.725 ( 0.000 17.508 -9.752) 20.041 5.210 ( -0.000 20.583 34.499) 40.173 6.342 ( 0.000 2.434 -5.828) 6.316 6.572 ( 0.000 -0.952 -1.978) 2.196 7.139 ( 0.000 9.304 -4.411) 10.297 8.107 ( 0.000 -22.490 -10.682) 24.898 8.742 ( 0.000 0.364 -5.231) 5.244 9.065 ( -0.000 18.246 5.743) 19.129 9.335 ( -0.000 9.747 21.360) 23.479 9.597 ( 0.000 4.371 -3.586) 5.654 9.880 ( -0.000 19.455 17.963) 26.479 10.949 ( 0.000 -15.037 -10.521) 18.352 10.989 ( -0.000 -9.772 -0.214) 9.774 11.104 ( -0.000 -2.636 8.533) 8.931 11.453 ( -0.000 0.478 13.063) 13.072 12.029 ( 0.000 6.787 -24.124) 25.061 12.077 ( -0.000 5.490 3.662) 6.599 12.580 ( -0.000 -11.027 8.471) 13.905 12.610 ( 0.000 4.109 -3.158) 5.182 13.068 ( 0.000 -7.919 -11.148) 13.675 13.148 ( -0.000 0.382 12.662) 12.668 13.614 ( 0.000 8.797 -12.129) 14.983 14.167 ( 0.000 2.044 -3.838) 4.348 14.317 ( -0.000 7.605 7.231) 10.494 15.106 ( -0.000 -3.138 -0.762) 3.229 15.270 ( 0.000 -0.096 -0.401) 0.412 15.581 ( 0.000 -2.985 -2.546) 3.924 15.670 ( 0.000 4.201 -2.706) 4.998 16.048 ( -0.000 -2.166 2.315) 3.170 16.958 ( -0.000 -17.615 0.221) 17.616 17.101 ( -0.000 -11.912 -3.170) 12.327 17.772 ( 0.000 3.261 -5.824) 6.675 18.039 ( -0.000 3.297 2.874) 4.373 18.390 ( 0.000 15.752 -5.516) 16.690 18.779 ( -0.000 5.340 2.267) 5.801 19.259 ( 0.000 7.661 -5.384) 9.364 20.167 ( -0.000 -9.173 6.905) 11.481 20.454 ( -0.000 -3.738 0.443) 3.764 20.736 ( -0.000 -1.981 -0.508) 2.045 22.563 ( -0.000 -10.428 14.648) 17.981 22.816 ( 0.000 -1.281 -8.738) 8.831 23.842 ( 0.000 -4.334 -1.440) 4.567 ======================= Grid point 438 (135/146) ======================= q-point: ( 0.64 0.55 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.891 ( 10.543 18.418 -13.231) 25.009 5.567 ( 1.735 3.247 27.683) 27.926 6.212 ( -10.663 6.181 -9.613) 15.630 6.578 ( 3.581 -9.427 -1.003) 10.134 7.198 ( -0.262 7.097 -4.522) 8.419 7.896 ( 9.484 -17.645 -15.333) 25.227 8.520 ( -16.542 -0.172 -1.855) 16.646 9.239 ( -12.606 13.264 1.234) 18.340 9.411 ( 9.493 -0.945 1.811) 9.710 9.900 ( 15.237 17.473 5.385) 23.801 10.220 ( 5.196 20.281 11.596) 23.933 10.684 ( -3.824 -16.032 -4.106) 16.986 10.923 ( 1.797 -5.336 -0.734) 5.678 11.141 ( 4.126 -5.718 2.547) 7.497 11.531 ( 0.337 0.597 6.395) 6.432 11.992 ( -0.781 5.415 -7.051) 8.924 12.145 ( -0.303 5.095 2.738) 5.792 12.492 ( -5.123 -11.430 6.963) 14.331 12.654 ( 3.620 4.221 -3.140) 6.386 12.940 ( 2.339 -6.734 -12.064) 14.013 13.173 ( -5.801 -0.353 9.572) 11.198 13.645 ( 2.952 9.159 -7.745) 12.352 14.115 ( -5.092 -2.149 -1.419) 5.706 14.431 ( 1.281 4.822 3.940) 6.358 15.041 ( -4.024 -1.560 -0.368) 4.332 15.323 ( 6.115 -0.409 1.676) 6.354 15.509 ( -2.118 -1.985 -3.553) 4.588 15.690 ( -2.279 2.901 -1.860) 4.131 16.117 ( 5.579 5.225 3.935) 8.597 16.667 ( -11.010 -15.211 -0.170) 18.779 17.057 ( 5.061 -13.880 0.308) 14.777 17.780 ( 1.320 1.584 -4.874) 5.292 18.089 ( 2.494 0.683 -0.612) 2.657 18.490 ( -1.563 11.438 -8.629) 14.413 18.705 ( -10.685 8.996 1.186) 14.018 19.382 ( 7.748 6.231 -2.312) 10.208 20.166 ( 2.642 -7.934 5.894) 10.230 20.419 ( -1.088 -2.428 1.213) 2.924 20.712 ( -0.542 -0.898 0.553) 1.186 22.370 ( -6.264 -27.888 8.017) 29.686 22.916 ( 5.647 14.394 -4.001) 15.971 23.798 ( -2.309 -1.191 1.190) 2.858 ======================= Grid point 449 (136/146) ======================= q-point: (-0.36 -0.36 -0.73) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.838 ( 0.000 17.963 -20.945) 27.593 5.697 ( -0.000 -9.337 13.856) 16.709 6.361 ( 0.000 3.626 -0.175) 3.631 6.371 ( 0.000 -15.650 -5.879) 16.718 7.239 ( 0.000 8.223 -9.429) 12.511 7.532 ( 0.000 -11.539 -18.076) 21.445 8.706 ( 0.000 3.499 -3.589) 5.012 9.167 ( -0.000 -2.258 -0.389) 2.291 9.652 ( 0.000 3.539 0.521) 3.577 9.793 ( 0.000 8.435 -4.981) 9.796 10.335 ( 0.000 1.397 -3.627) 3.887 10.653 ( -0.000 5.998 9.736) 11.435 10.818 ( 0.000 -5.340 -2.330) 5.826 11.107 ( -0.000 -1.949 9.070) 9.277 11.572 ( -0.000 1.015 3.074) 3.237 12.056 ( -0.000 4.790 6.364) 7.966 12.214 ( -0.000 2.379 4.647) 5.221 12.517 ( -0.000 -11.913 15.327) 19.412 12.593 ( 0.000 -2.488 -9.359) 9.684 12.810 ( 0.000 7.134 -13.709) 15.454 13.273 ( -0.000 -1.274 7.250) 7.361 13.630 ( 0.000 8.549 -8.890) 12.334 14.181 ( -0.000 0.489 0.670) 0.829 14.437 ( -0.000 -1.900 0.837) 2.076 15.101 ( 0.000 1.931 -0.632) 2.031 15.250 ( -0.000 -1.582 1.477) 2.164 15.480 ( 0.000 -2.950 -2.907) 4.142 15.725 ( 0.000 6.233 -6.276) 8.845 16.146 ( -0.000 4.100 7.922) 8.920 16.649 ( -0.000 -14.913 1.571) 14.996 16.875 ( -0.000 -11.332 3.956) 12.003 17.774 ( 0.000 4.334 -5.517) 7.016 18.047 ( 0.000 1.128 -7.058) 7.147 18.519 ( 0.000 7.621 -11.522) 13.814 18.920 ( 0.000 6.224 1.724) 6.458 19.312 ( 0.000 6.355 -6.368) 8.997 20.127 ( -0.000 -6.096 8.745) 10.660 20.405 ( -0.000 -5.330 1.510) 5.539 20.713 ( -0.000 -0.879 1.321) 1.587 22.249 ( -0.000 -22.602 13.048) 26.098 22.947 ( 0.000 9.499 -5.826) 11.144 23.848 ( -0.000 3.238 4.341) 5.416 ======================= Grid point 534 (137/146) ======================= q-point: ( 0.36 0.36 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 146 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.539 ( -0.000 0.000 35.050) 35.050 3.539 ( -0.000 0.000 35.050) 35.050 6.587 ( 0.000 -0.000 -16.866) 16.866 6.587 ( 0.000 -0.000 -16.866) 16.866 6.964 ( -0.000 0.000 0.172) 0.172 7.342 ( -0.000 0.000 75.979) 75.979 8.664 ( -0.000 0.000 3.183) 3.183 8.664 ( -0.000 0.000 3.183) 3.183 9.203 ( -0.000 0.000 0.267) 0.267 9.418 ( 0.000 0.000 -0.127) 0.127 9.418 ( -0.000 -0.000 -0.127) 0.127 10.890 ( -0.000 0.000 27.245) 27.245 10.890 ( -0.000 0.000 27.245) 27.245 10.946 ( -0.000 0.000 20.881) 20.881 11.194 ( -0.000 0.000 5.275) 5.275 12.128 ( -0.000 0.000 0.963) 0.963 12.128 ( -0.000 0.000 0.963) 0.963 12.781 ( -0.000 0.000 20.496) 20.496 12.781 ( -0.000 0.000 20.496) 20.496 12.871 ( 0.000 -0.000 -50.583) 50.583 13.411 ( 0.000 -0.000 -6.541) 6.541 13.411 ( 0.000 -0.000 -6.541) 6.541 14.059 ( 0.000 -0.000 -11.785) 11.785 14.059 ( 0.000 -0.000 -11.785) 11.785 15.195 ( 0.000 -0.000 -2.652) 2.652 15.332 ( -0.000 0.000 0.381) 0.381 15.759 ( 0.000 -0.000 -5.121) 5.121 15.759 ( 0.000 -0.000 -5.121) 5.121 16.574 ( 0.000 -0.000 -17.404) 17.404 17.348 ( 0.000 -0.000 -1.597) 1.597 17.348 ( 0.000 -0.000 -1.597) 1.597 17.942 ( 0.000 -0.000 -5.768) 5.768 17.964 ( 0.000 -0.000 -4.047) 4.047 17.964 ( 0.000 -0.000 -4.047) 4.047 18.886 ( -0.000 0.000 1.193) 1.193 18.886 ( -0.000 0.000 1.193) 1.193 20.282 ( -0.000 0.000 6.160) 6.160 20.831 ( 0.000 -0.000 -2.562) 2.562 20.831 ( 0.000 -0.000 -2.562) 2.562 21.701 ( -0.000 0.000 10.538) 10.538 23.218 ( -0.000 0.000 9.208) 9.208 24.464 ( 0.000 -0.000 -8.182) 8.182 ======================= Grid point 535 (138/146) ======================= q-point: ( 0.45 0.36 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.639 ( -0.872 -0.504 34.300) 34.315 4.169 ( 28.395 16.394 24.399) 40.870 6.420 ( -4.418 -2.551 -12.067) 13.101 6.548 ( 4.297 2.481 -13.413) 14.302 6.981 ( 1.093 0.631 0.272) 1.291 7.883 ( 9.261 5.347 54.105) 55.152 8.624 ( -2.668 -1.541 4.264) 5.260 8.709 ( -5.177 -2.989 11.586) 13.037 9.220 ( 4.917 2.839 0.432) 5.695 9.376 ( -0.773 -0.446 2.356) 2.519 9.540 ( 7.920 4.572 -6.547) 11.247 10.876 ( -7.399 -4.272 22.742) 24.294 10.979 ( -4.417 -2.550 21.808) 22.396 11.248 ( 2.245 1.296 5.479) 6.062 11.290 ( 5.628 3.249 15.425) 16.738 12.038 ( -1.497 -0.864 -5.401) 5.671 12.204 ( 2.497 1.441 -2.705) 3.953 12.563 ( 1.210 0.699 -30.770) 30.802 12.818 ( -2.280 -1.316 11.944) 12.230 13.058 ( 8.012 4.626 13.793) 16.609 13.199 ( -4.788 -2.765 -4.392) 7.061 13.561 ( 3.173 1.832 -14.708) 15.157 13.845 ( -2.016 -1.164 -5.077) 5.585 14.170 ( 8.771 5.064 -9.571) 13.934 15.200 ( 1.892 1.093 -2.000) 2.962 15.323 ( -2.406 -1.389 -0.445) 2.814 15.626 ( -7.127 -4.115 0.035) 8.229 15.712 ( -2.003 -1.157 -5.120) 5.618 16.438 ( -2.455 -1.417 -15.208) 15.470 17.323 ( -1.487 -0.858 1.644) 2.377 17.409 ( 1.881 1.086 -1.465) 2.619 17.802 ( -0.037 -0.021 -4.912) 4.912 17.810 ( -9.266 -5.350 -3.031) 11.121 18.106 ( 6.063 3.501 -2.730) 7.515 18.890 ( -2.490 -1.437 -1.225) 3.125 18.897 ( 2.549 1.471 2.720) 4.007 20.324 ( 0.958 0.553 3.879) 4.034 20.727 ( -7.139 -4.122 -1.820) 8.442 20.807 ( -0.660 -0.381 -1.991) 2.132 21.916 ( 12.615 7.283 8.497) 16.863 23.258 ( -1.754 -1.013 6.720) 7.019 24.300 ( -9.799 -5.658 -7.555) 13.605 ======================= Grid point 536 (139/146) ======================= q-point: ( 0.55 0.36 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.931 ( 8.110 4.682 30.960) 32.345 4.989 ( 35.973 20.769 13.280) 43.609 6.239 ( -8.031 -4.637 -4.665) 10.381 6.580 ( 4.061 2.345 -7.193) 8.586 7.002 ( 0.526 0.304 1.280) 1.417 8.263 ( -4.339 -2.505 11.428) 12.478 8.614 ( -1.024 -0.591 4.944) 5.083 8.729 ( 5.541 3.199 30.309) 30.977 9.337 ( 2.426 1.401 0.525) 2.850 9.419 ( 3.145 1.816 3.158) 4.813 9.721 ( 14.887 8.595 -6.988) 18.556 10.916 ( -3.135 -1.810 19.868) 20.195 10.978 ( -6.130 -3.539 13.599) 15.331 11.261 ( -8.048 -4.646 -2.087) 9.524 11.365 ( 4.544 2.623 6.994) 8.743 11.987 ( 4.425 2.555 -21.779) 22.370 12.213 ( 1.208 0.698 -5.311) 5.491 12.557 ( 5.468 3.157 -7.283) 9.639 12.862 ( -2.657 -1.534 15.092) 15.401 13.143 ( 1.108 0.640 4.897) 5.062 13.219 ( -0.717 -0.414 -11.487) 11.517 13.347 ( -4.930 -2.846 -7.084) 9.088 13.952 ( 7.906 4.564 1.260) 9.216 14.297 ( 7.414 4.280 -5.047) 9.937 15.203 ( -6.229 -3.597 -1.632) 7.376 15.248 ( 3.295 1.902 -1.275) 4.013 15.542 ( -3.018 -1.742 3.921) 5.246 15.625 ( -3.070 -1.772 -2.460) 4.315 16.287 ( -2.863 -1.653 -12.624) 13.049 17.254 ( -8.809 -5.086 2.202) 10.407 17.307 ( -8.206 -4.738 -2.500) 9.800 17.624 ( -4.273 -2.467 0.856) 5.008 17.943 ( 12.316 7.111 -2.584) 14.455 18.168 ( 0.235 0.136 1.143) 1.174 18.815 ( -1.783 -1.029 -2.420) 3.178 19.004 ( 4.991 2.882 4.114) 7.081 20.355 ( -0.144 -0.083 -0.016) 0.167 20.563 ( -6.193 -3.576 -1.439) 7.295 20.777 ( -1.051 -0.607 -1.509) 1.937 22.277 ( 15.196 8.774 7.958) 19.267 23.177 ( -9.656 -5.575 0.026) 11.150 24.019 ( -10.258 -5.923 -5.855) 13.213 ======================= Grid point 537 (140/146) ======================= q-point: ( 0.64 0.36 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.359 ( 14.177 8.185 26.143) 30.846 5.777 ( 29.847 17.232 -12.309) 36.597 6.045 ( -6.947 -4.011 14.738) 16.779 6.562 ( -5.122 -2.957 0.343) 5.924 7.061 ( 4.537 2.619 4.014) 6.600 7.922 ( -25.328 -14.623 6.284) 29.914 8.642 ( 0.777 0.449 4.419) 4.509 9.144 ( 8.809 5.086 1.970) 10.361 9.446 ( 13.464 7.773 7.687) 17.343 9.539 ( 5.805 3.352 2.392) 7.118 10.043 ( 16.036 9.258 1.210) 18.556 10.840 ( -11.925 -6.885 3.719) 14.263 10.909 ( -6.234 -3.599 6.817) 9.914 11.156 ( -0.818 -0.472 0.113) 0.951 11.504 ( 4.201 2.426 4.868) 6.873 11.997 ( 9.860 5.693 -21.174) 24.041 12.203 ( 1.775 1.025 -6.238) 6.566 12.579 ( -0.225 -0.130 0.129) 0.290 12.792 ( -10.357 -5.980 15.421) 19.515 12.887 ( -11.778 -6.800 -21.986) 25.852 13.333 ( -0.072 -0.041 -4.753) 4.753 13.367 ( 10.350 5.976 12.839) 17.541 14.112 ( 5.618 3.244 1.207) 6.599 14.408 ( 4.429 2.557 -1.263) 5.267 15.105 ( -2.153 -1.243 -0.479) 2.532 15.285 ( 0.230 0.133 -1.916) 1.935 15.507 ( -2.846 -1.643 4.564) 5.624 15.602 ( 1.768 1.021 3.324) 3.900 16.174 ( -0.485 -0.280 -10.198) 10.213 16.973 ( -15.744 -9.090 -0.564) 18.188 17.099 ( -9.198 -5.310 -3.135) 11.074 17.657 ( 3.271 1.889 5.461) 6.640 18.065 ( -2.442 -1.410 0.152) 2.824 18.272 ( 10.057 5.806 5.922) 13.035 18.825 ( 3.768 2.175 -1.727) 4.681 19.151 ( 5.778 3.336 5.497) 8.644 20.283 ( -4.890 -2.823 -4.336) 7.120 20.475 ( -1.938 -1.119 -1.559) 2.727 20.744 ( -1.223 -0.706 -1.253) 1.888 22.609 ( 5.533 3.195 10.637) 12.408 22.837 ( -13.098 -7.562 -11.767) 19.163 23.859 ( -2.172 -1.254 -3.268) 4.119 ======================= Grid point 546 (141/146) ======================= q-point: ( 0.45 0.45 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.017 ( -0.000 17.311 30.026) 34.659 4.135 ( -0.000 13.882 15.068) 20.488 6.396 ( 0.000 4.430 -12.582) 13.339 6.419 ( 0.000 1.365 -11.626) 11.705 6.987 ( 0.000 2.133 0.040) 2.134 8.179 ( -0.000 2.629 40.404) 40.490 8.741 ( 0.000 1.543 0.022) 1.543 8.748 ( -0.000 2.662 10.349) 10.686 9.187 ( -0.000 -2.884 11.591) 11.944 9.419 ( 0.000 1.726 -1.033) 2.011 9.469 ( 0.000 3.415 -2.908) 4.486 10.985 ( -0.000 -6.103 17.177) 18.229 11.232 ( -0.000 -1.719 7.739) 7.928 11.270 ( -0.000 0.516 6.959) 6.978 11.317 ( -0.000 2.632 19.374) 19.552 11.992 ( 0.000 -4.389 -3.292) 5.486 12.151 ( 0.000 0.994 -20.796) 20.819 12.375 ( 0.000 8.231 -19.230) 20.917 12.870 ( -0.000 -6.390 11.152) 12.853 13.132 ( -0.000 8.741 4.246) 9.718 13.173 ( -0.000 -8.478 6.080) 10.432 13.496 ( 0.000 2.019 -10.821) 11.008 13.888 ( 0.000 7.412 -1.695) 7.603 14.060 ( 0.000 6.972 -10.829) 12.879 15.188 ( 0.000 2.200 -1.479) 2.651 15.329 ( -0.000 -3.041 -0.554) 3.091 15.639 ( -0.000 -4.437 -0.975) 4.542 15.687 ( 0.000 -1.631 -2.704) 3.158 16.323 ( 0.000 -6.439 -11.293) 13.000 17.336 ( -0.000 -1.912 0.556) 1.992 17.418 ( 0.000 4.161 0.094) 4.162 17.715 ( 0.000 -4.226 -1.369) 4.442 17.869 ( 0.000 -5.276 -5.279) 7.463 18.078 ( 0.000 8.857 -2.291) 9.148 18.807 ( -0.000 -6.596 2.495) 7.052 18.991 ( 0.000 7.227 -1.713) 7.428 20.330 ( -0.000 -1.497 3.195) 3.528 20.715 ( -0.000 -8.016 -1.317) 8.124 20.798 ( 0.000 -0.698 -1.688) 1.826 21.966 ( -0.000 14.838 6.551) 16.220 23.291 ( -0.000 -3.927 5.522) 6.776 24.255 ( 0.000 -11.611 -5.897) 13.022 ======================= Grid point 547 (142/146) ======================= q-point: ( 0.55 0.45 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.195 ( -4.333 16.813 20.059) 26.529 4.708 ( 27.213 21.518 6.841) 35.361 6.285 ( -5.551 -1.461 -4.410) 7.238 6.490 ( 6.744 7.777 -7.087) 12.497 7.013 ( 0.484 2.247 0.165) 2.304 8.415 ( 0.364 6.446 13.438) 14.909 8.652 ( -5.129 -4.445 3.321) 7.556 8.799 ( -0.897 -6.191 5.456) 8.301 9.360 ( 4.091 3.426 15.164) 16.076 9.444 ( 0.693 4.748 2.975) 5.646 9.555 ( 9.709 8.457 -4.314) 13.579 11.030 ( -1.860 -1.173 11.048) 11.264 11.160 ( -7.279 -3.790 4.462) 9.341 11.267 ( -1.164 -7.865 1.596) 8.109 11.417 ( -0.834 2.543 8.744) 9.145 11.871 ( -3.797 2.474 -15.554) 16.201 12.097 ( 6.606 -2.454 -11.149) 13.190 12.464 ( 5.908 9.091 -3.622) 11.431 12.887 ( 1.906 -9.067 10.196) 13.777 13.149 ( -2.775 -3.173 6.487) 7.736 13.220 ( 2.550 4.453 -2.983) 5.935 13.372 ( -5.472 0.344 -10.213) 11.592 13.972 ( 0.021 9.987 4.398) 10.913 14.163 ( 9.173 6.391 -7.115) 13.252 15.209 ( -1.083 -1.587 -1.098) 2.213 15.248 ( -1.162 -1.844 -0.775) 2.314 15.569 ( -3.319 -3.068 -0.744) 4.581 15.674 ( -0.302 1.986 0.552) 2.083 16.193 ( -0.805 -7.104 -7.316) 10.229 17.229 ( -6.435 -11.514 0.040) 13.190 17.437 ( -0.981 -2.736 0.147) 2.910 17.669 ( -4.607 -0.129 -0.724) 4.665 17.865 ( 6.965 9.642 -1.479) 11.986 18.179 ( 2.991 6.108 -0.719) 6.839 18.720 ( -3.181 -9.810 0.205) 10.315 19.076 ( 2.542 9.875 -0.054) 10.197 20.340 ( 0.912 -1.954 1.241) 2.488 20.595 ( -4.257 -7.268 -0.838) 8.464 20.771 ( -0.872 -1.470 -0.979) 1.970 22.234 ( 9.262 16.580 4.719) 19.569 23.223 ( -4.939 -10.444 1.665) 11.672 24.048 ( -6.537 -11.477 -3.659) 13.706 ======================= Grid point 548 (143/146) ======================= q-point: ( 0.64 0.45 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.489 ( 5.873 17.783 16.383) 24.882 5.351 ( 27.673 19.754 -12.368) 36.180 6.148 ( -4.534 -7.882 5.792) 10.781 6.620 ( 1.158 7.173 -0.622) 7.292 7.060 ( 2.394 4.112 1.565) 5.009 8.270 ( -23.180 -7.317 7.102) 25.324 8.562 ( 2.581 -12.870 -0.568) 13.139 8.942 ( 16.717 5.093 -0.795) 17.494 9.430 ( -2.439 3.598 1.285) 4.532 9.609 ( 5.876 14.321 3.887) 15.960 9.883 ( 15.572 13.913 -1.524) 20.938 10.946 ( -9.944 -10.314 3.073) 14.653 11.024 ( -4.237 -4.512 0.497) 6.209 11.203 ( -2.598 -1.019 4.226) 5.064 11.511 ( 1.008 3.035 4.642) 5.637 11.834 ( 4.980 7.339 -8.067) 11.989 12.105 ( 4.106 -0.465 -7.387) 8.464 12.574 ( 2.471 3.646 -0.750) 4.468 12.773 ( -6.054 -13.294 -4.832) 15.386 13.056 ( -10.436 -1.711 6.653) 12.494 13.246 ( 1.936 -5.174 -6.535) 8.557 13.400 ( 6.434 10.624 5.545) 13.602 14.087 ( 1.703 3.249 4.303) 5.655 14.320 ( 7.857 5.153 -4.403) 10.377 15.098 ( -2.660 -5.458 -0.143) 6.073 15.306 ( 1.252 5.120 -0.736) 5.322 15.504 ( -0.356 -3.274 2.212) 3.967 15.684 ( -3.147 2.426 2.204) 4.544 16.098 ( 0.852 -2.601 -5.279) 5.946 16.963 ( -8.194 -18.004 -0.484) 19.787 17.289 ( -10.824 -3.455 -1.169) 11.422 17.694 ( 1.362 5.082 3.877) 6.536 18.091 ( 3.677 10.264 -2.142) 11.111 18.253 ( 2.230 5.185 4.033) 6.937 18.617 ( 6.881 -11.862 -1.657) 13.813 19.231 ( 2.623 11.624 2.393) 12.154 20.310 ( -3.346 -1.647 -2.515) 4.498 20.473 ( -2.531 -4.567 -0.371) 5.234 20.738 ( -0.581 -1.956 -0.508) 2.103 22.584 ( 11.720 14.917 4.115) 19.412 22.911 ( -15.796 -19.335 -4.244) 25.325 23.865 ( -3.843 -5.266 -1.107) 6.613 ======================= Grid point 558 (144/146) ======================= q-point: ( 0.55 0.55 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.377 ( 0.000 11.931 -12.667) 17.401 4.861 ( -0.000 34.278 23.500) 41.560 6.297 ( 0.000 -2.120 -8.875) 9.124 6.472 ( 0.000 9.281 1.361) 9.381 7.026 ( 0.000 2.467 -1.191) 2.739 8.431 ( 0.000 -9.288 -3.570) 9.951 8.714 ( 0.000 -0.662 -4.649) 4.696 8.817 ( -0.000 5.149 10.034) 11.278 9.383 ( -0.000 -0.924 6.442) 6.508 9.487 ( 0.000 3.925 -3.923) 5.549 9.626 ( -0.000 17.671 10.542) 20.577 11.061 ( 0.000 -3.020 -2.736) 4.076 11.157 ( 0.000 -9.110 -3.702) 9.834 11.242 ( -0.000 -5.859 8.855) 10.618 11.468 ( 0.000 2.085 0.234) 2.098 11.798 ( 0.000 -0.109 -18.413) 18.414 12.041 ( -0.000 3.052 10.075) 10.527 12.493 ( 0.000 8.598 -0.255) 8.602 12.862 ( -0.000 -9.883 14.262) 17.352 13.145 ( 0.000 -4.226 -10.056) 10.907 13.230 ( -0.000 -1.108 11.267) 11.321 13.362 ( 0.000 6.352 -13.965) 15.342 14.053 ( 0.000 6.095 -7.765) 9.871 14.171 ( -0.000 12.753 7.421) 14.755 15.195 ( -0.000 -7.313 -0.856) 7.363 15.234 ( 0.000 3.367 0.032) 3.367 15.603 ( 0.000 -1.169 -2.103) 2.407 15.629 ( 0.000 -1.133 -2.098) 2.384 16.132 ( -0.000 -5.197 1.878) 5.526 17.248 ( -0.000 -11.171 1.890) 11.330 17.298 ( -0.000 -10.933 -1.355) 11.017 17.705 ( 0.000 -1.884 -6.456) 6.725 17.896 ( 0.000 14.781 2.728) 15.030 18.190 ( 0.000 4.849 -1.268) 5.012 18.755 ( -0.000 -1.735 3.263) 3.696 19.087 ( 0.000 7.288 -4.348) 8.487 20.320 ( -0.000 -3.652 3.154) 4.825 20.551 ( -0.000 -7.411 -0.295) 7.416 20.765 ( -0.000 -1.424 -0.298) 1.455 22.350 ( 0.000 19.676 1.337) 19.721 23.154 ( -0.000 -17.001 1.758) 17.092 23.972 ( -0.000 -11.360 -1.065) 11.409 ======================= Grid point 668 (145/146) ======================= q-point: ( 0.45 0.45 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 146 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.055 ( -0.000 0.000 15.647) 15.647 4.055 ( -0.000 0.000 15.647) 15.647 6.294 ( 0.000 -0.000 -10.170) 10.170 6.294 ( 0.000 -0.000 -10.170) 10.170 6.967 ( -0.000 0.000 0.063) 0.063 8.453 ( -0.000 0.000 30.512) 30.512 8.717 ( -0.000 0.000 1.654) 1.654 8.717 ( -0.000 0.000 1.654) 1.654 9.291 ( -0.000 0.000 10.434) 10.434 9.416 ( 0.000 0.000 -0.079) 0.079 9.416 ( -0.000 0.000 -0.079) 0.079 11.136 ( 0.000 -0.000 -2.864) 2.864 11.267 ( -0.000 0.000 1.997) 1.997 11.383 ( -0.000 0.000 19.569) 19.569 11.383 ( -0.000 0.000 19.569) 19.569 12.055 ( 0.000 -0.000 -6.875) 6.875 12.055 ( 0.000 -0.000 -6.875) 6.875 12.096 ( 0.000 -0.000 -21.754) 21.754 13.004 ( -0.000 0.000 0.900) 0.900 13.004 ( -0.000 0.000 0.900) 0.900 13.390 ( -0.000 0.000 6.146) 6.146 13.390 ( -0.000 0.000 6.146) 6.146 13.850 ( 0.000 -0.000 -8.384) 8.384 13.850 ( 0.000 -0.000 -8.384) 8.384 15.158 ( 0.000 -0.000 -1.023) 1.023 15.359 ( -0.000 0.000 1.343) 1.343 15.687 ( 0.000 -0.000 -2.154) 2.154 15.687 ( 0.000 -0.000 -2.154) 2.154 16.315 ( 0.000 -0.000 -7.720) 7.720 17.346 ( -0.000 0.000 0.609) 0.609 17.346 ( -0.000 0.000 0.609) 0.609 17.865 ( 0.000 -0.000 -2.043) 2.043 17.895 ( 0.000 -0.000 -2.350) 2.350 17.895 ( 0.000 -0.000 -2.350) 2.350 18.902 ( -0.000 0.000 0.447) 0.447 18.902 ( -0.000 0.000 0.447) 0.447 20.355 ( -0.000 0.000 1.697) 1.697 20.795 ( 0.000 -0.000 -0.975) 0.975 20.795 ( 0.000 -0.000 -0.975) 0.975 21.849 ( -0.000 0.000 4.129) 4.129 23.354 ( -0.000 0.000 4.101) 4.101 24.339 ( 0.000 -0.000 -3.868) 3.868 ======================= Grid point 669 (146/146) ======================= q-point: ( 0.55 0.45 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 7.40e-04 7.40e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.140 ( 3.282 1.895 14.829) 15.306 4.383 ( 21.776 12.572 -4.670) 25.575 6.267 ( 1.234 0.712 0.358) 1.469 6.329 ( 6.594 3.807 -6.111) 9.763 6.986 ( 1.508 0.871 0.173) 1.750 8.461 ( -3.672 -2.120 6.273) 7.571 8.706 ( -1.152 -0.665 3.464) 3.711 8.863 ( 3.048 1.760 -0.149) 3.522 9.371 ( 3.759 2.170 5.292) 6.844 9.420 ( 0.915 0.528 2.286) 2.518 9.444 ( 2.672 1.543 -1.979) 3.666 11.085 ( -1.695 -0.979 -0.381) 1.994 11.256 ( -3.289 -1.899 3.238) 4.990 11.411 ( -5.649 -3.262 -3.889) 7.594 11.418 ( -1.470 -0.849 11.622) 11.745 11.836 ( -7.576 -4.374 -0.369) 8.755 12.065 ( 2.229 1.287 -10.521) 10.831 12.259 ( 13.715 7.919 -0.546) 15.847 13.030 ( 3.411 1.969 8.628) 9.484 13.037 ( 0.816 0.471 -10.348) 10.390 13.318 ( -5.577 -3.220 11.102) 12.834 13.369 ( -5.707 -3.295 -8.263) 10.569 13.867 ( 6.088 3.515 7.505) 10.283 13.979 ( 11.158 6.442 -9.372) 15.932 15.176 ( 2.087 1.205 -0.332) 2.433 15.324 ( -4.507 -2.602 0.187) 5.207 15.629 ( -2.906 -1.678 0.246) 3.364 15.658 ( -1.684 -0.972 -0.350) 1.975 16.240 ( -3.487 -2.013 -3.595) 5.397 17.349 ( -0.599 -0.346 0.167) 0.712 17.410 ( 1.231 0.711 0.881) 1.672 17.729 ( -0.210 -0.121 -2.575) 2.587 17.791 ( -7.322 -4.227 1.787) 8.641 18.065 ( 7.903 4.563 -1.024) 9.183 18.854 ( -4.327 -2.498 -2.272) 5.488 18.949 ( 4.159 2.401 2.567) 5.446 20.360 ( -0.342 -0.197 0.077) 0.402 20.705 ( -6.959 -4.018 -0.324) 8.042 20.784 ( -0.624 -0.361 -0.253) 0.764 22.018 ( 12.861 7.425 1.458) 14.922 23.338 ( -3.733 -2.155 1.017) 4.429 24.207 ( -9.959 -5.750 -1.383) 11.582 =================== 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 3/55902 10.0 4157.716 4157.716 5030.928 0.000 -0.000 0.000 3/55902 20.0 4457.412 4457.412 5005.872 0.000 -0.000 0.000 3/55902 30.0 3347.187 3347.187 4110.177 0.000 -0.000 0.000 3/55902 40.0 2051.600 2051.600 2683.243 0.000 -0.000 0.000 3/55902 50.0 1182.889 1182.889 1633.157 0.000 -0.000 0.000 3/55902 60.0 705.289 705.289 1011.984 0.000 -0.000 0.000 3/55902 70.0 445.329 445.329 655.751 0.000 -0.000 0.000 3/55902 80.0 298.441 298.441 446.688 0.000 -0.000 0.000 3/55902 90.0 211.203 211.203 319.104 0.000 -0.000 0.000 3/55902 100.0 156.688 156.688 237.851 0.000 -0.000 0.000 3/55902 110.0 120.969 120.969 183.927 0.000 -0.000 0.000 3/55902 120.0 96.556 96.556 146.761 0.000 -0.000 0.000 3/55902 130.0 79.240 79.240 120.261 0.000 -0.000 0.000 3/55902 140.0 66.554 66.554 100.791 0.000 -0.000 0.000 3/55902 150.0 56.996 56.996 86.101 0.000 -0.000 0.000 3/55902 160.0 49.616 49.616 74.755 0.000 -0.000 0.000 3/55902 170.0 43.796 43.796 65.810 0.000 -0.000 0.000 3/55902 180.0 39.119 39.119 58.629 0.000 -0.000 0.000 3/55902 190.0 35.298 35.298 52.769 0.000 -0.000 0.000 3/55902 200.0 32.131 32.131 47.917 0.000 -0.000 0.000 3/55902 210.0 29.471 29.471 43.850 0.000 -0.000 0.000 3/55902 220.0 27.211 27.211 40.399 0.000 -0.000 0.000 3/55902 230.0 25.270 25.270 37.442 0.000 -0.000 0.000 3/55902 240.0 23.589 23.589 34.884 0.000 -0.000 0.000 3/55902 250.0 22.120 22.120 32.652 0.000 -0.000 0.000 3/55902 260.0 20.826 20.826 30.689 0.000 -0.000 0.000 3/55902 270.0 19.678 19.678 28.952 0.000 -0.000 0.000 3/55902 280.0 18.654 18.654 27.404 0.000 -0.000 0.000 3/55902 290.0 17.734 17.734 26.016 0.000 -0.000 0.000 3/55902 300.0 16.904 16.904 24.766 0.000 -0.000 0.000 3/55902 310.0 16.152 16.152 23.634 0.000 -0.000 0.000 3/55902 320.0 15.466 15.466 22.605 0.000 -0.000 0.000 3/55902 330.0 14.839 14.839 21.664 0.000 -0.000 0.000 3/55902 340.0 14.263 14.263 20.802 0.000 -0.000 0.000 3/55902 350.0 13.732 13.732 20.008 0.000 -0.000 0.000 3/55902 360.0 13.242 13.242 19.275 0.000 -0.000 0.000 3/55902 370.0 12.786 12.786 18.597 0.000 -0.000 0.000 3/55902 380.0 12.363 12.363 17.967 0.000 -0.000 0.000 3/55902 390.0 11.968 11.968 17.379 0.000 -0.000 0.000 3/55902 400.0 11.599 11.599 16.831 0.000 -0.000 0.000 3/55902 410.0 11.254 11.254 16.318 0.000 -0.000 0.000 3/55902 420.0 10.929 10.929 15.837 0.000 -0.000 0.000 3/55902 430.0 10.623 10.623 15.385 0.000 -0.000 0.000 3/55902 440.0 10.335 10.335 14.959 0.000 -0.000 0.000 3/55902 450.0 10.063 10.063 14.557 0.000 -0.000 0.000 3/55902 460.0 9.806 9.806 14.177 0.000 -0.000 0.000 3/55902 470.0 9.562 9.562 13.817 0.000 -0.000 0.000 3/55902 480.0 9.330 9.330 13.476 0.000 -0.000 0.000 3/55902 490.0 9.110 9.110 13.153 0.000 -0.000 0.000 3/55902 500.0 8.901 8.901 12.845 0.000 -0.000 0.000 3/55902 510.0 8.701 8.701 12.552 0.000 -0.000 0.000 3/55902 520.0 8.511 8.511 12.272 0.000 -0.000 0.000 3/55902 530.0 8.329 8.329 12.005 0.000 -0.000 0.000 3/55902 540.0 8.155 8.155 11.750 0.000 -0.000 0.000 3/55902 550.0 7.989 7.989 11.507 0.000 -0.000 0.000 3/55902 560.0 7.829 7.829 11.273 0.000 -0.000 0.000 3/55902 570.0 7.676 7.676 11.049 0.000 -0.000 0.000 3/55902 580.0 7.529 7.529 10.834 0.000 -0.000 0.000 3/55902 590.0 7.388 7.388 10.628 0.000 -0.000 0.000 3/55902 600.0 7.252 7.252 10.430 0.000 -0.000 0.000 3/55902 610.0 7.121 7.121 10.239 0.000 -0.000 0.000 3/55902 620.0 6.995 6.995 10.056 0.000 -0.000 0.000 3/55902 630.0 6.874 6.874 9.879 0.000 -0.000 0.000 3/55902 640.0 6.757 6.757 9.708 0.000 -0.000 0.000 3/55902 650.0 6.644 6.644 9.544 0.000 -0.000 0.000 3/55902 660.0 6.535 6.535 9.385 0.000 -0.000 0.000 3/55902 670.0 6.429 6.429 9.232 0.000 -0.000 0.000 3/55902 680.0 6.327 6.327 9.083 0.000 -0.000 0.000 3/55902 690.0 6.228 6.228 8.940 0.000 -0.000 0.000 3/55902 700.0 6.133 6.133 8.801 0.000 -0.000 0.000 3/55902 710.0 6.040 6.040 8.666 0.000 -0.000 0.000 3/55902 720.0 5.950 5.950 8.536 0.000 -0.000 0.000 3/55902 730.0 5.863 5.863 8.410 0.000 -0.000 0.000 3/55902 740.0 5.778 5.778 8.287 0.000 -0.000 0.000 3/55902 750.0 5.696 5.696 8.168 0.000 -0.000 0.000 3/55902 760.0 5.617 5.617 8.053 0.000 -0.000 0.000 3/55902 770.0 5.539 5.539 7.941 0.000 -0.000 0.000 3/55902 780.0 5.464 5.464 7.832 0.000 -0.000 0.000 3/55902 790.0 5.391 5.391 7.726 0.000 -0.000 0.000 3/55902 800.0 5.320 5.320 7.623 0.000 -0.000 0.000 3/55902 810.0 5.250 5.250 7.523 0.000 -0.000 0.000 3/55902 820.0 5.183 5.183 7.425 0.000 -0.000 0.000 3/55902 830.0 5.117 5.117 7.330 0.000 -0.000 0.000 3/55902 840.0 5.053 5.053 7.237 0.000 -0.000 0.000 3/55902 850.0 4.991 4.991 7.147 0.000 -0.000 0.000 3/55902 860.0 4.930 4.930 7.059 0.000 -0.000 0.000 3/55902 870.0 4.870 4.870 6.974 0.000 -0.000 0.000 3/55902 880.0 4.812 4.812 6.890 0.000 -0.000 0.000 3/55902 890.0 4.756 4.756 6.808 0.000 -0.000 0.000 3/55902 900.0 4.701 4.701 6.729 0.000 -0.000 0.000 3/55902 910.0 4.647 4.647 6.651 0.000 -0.000 0.000 3/55902 920.0 4.594 4.594 6.575 0.000 -0.000 0.000 3/55902 930.0 4.543 4.543 6.501 0.000 -0.000 0.000 3/55902 940.0 4.492 4.492 6.428 0.000 -0.000 0.000 3/55902 950.0 4.443 4.443 6.358 0.000 -0.000 0.000 3/55902 960.0 4.395 4.395 6.288 0.000 -0.000 0.000 3/55902 970.0 4.348 4.348 6.221 0.000 -0.000 0.000 3/55902 980.0 4.302 4.302 6.154 0.000 -0.000 0.000 3/55902 990.0 4.257 4.257 6.089 0.000 -0.000 0.000 3/55902 1000.0 4.213 4.213 6.026 0.000 -0.000 0.000 3/55902 Thermal conductivity related properties were written into "kappa-m111111.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 09:27:10]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|