----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-09 04:50:04]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 1 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P-3 (147) Number of symmetry operations in supercell: 12 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 7.520953763864816 0.000000000000000 0.000000000000000 b -3.760476881932408 6.513337020195121 0.000000000000000 c 0.000000000000000 0.000000000000000 6.474311490000000 Atomic positions (fractional): *1 Ba 0.66666666666667 0.33333333333333 0.39693571571404 137.327 2 Ba 0.33333333333333 0.66666666666667 0.60306428428596 137.327 *3 Ba 0.00000000000000 0.00000000000000 0.50000000000000 137.327 *4 Si 0.16984706189811 0.76321058731195 0.11131236548461 28.085 5 Si 0.59336352541384 0.83015293810189 0.11131236548461 28.085 6 Si 0.23678941268805 0.40663647458616 0.11131236548461 28.085 7 Si 0.83015293810189 0.23678941268805 0.88868763451539 28.085 8 Si 0.40663647458616 0.16984706189811 0.88868763451539 28.085 9 Si 0.76321058731195 0.59336352541384 0.88868763451539 28.085 *10 N 0.66666666666667 0.33333333333333 0.93576123071024 14.007 11 N 0.33333333333333 0.66666666666667 0.06423876928976 14.007 *12 O 0.94120526284288 0.30144387515914 0.66897056022582 15.999 13 O 0.36023861231627 0.05879473715712 0.66897056022582 15.999 14 O 0.69855612484086 0.63976138768373 0.66897056022582 15.999 15 O 0.05879473715712 0.69855612484086 0.33102943977418 15.999 16 O 0.63976138768373 0.94120526284288 0.33102943977418 15.999 17 O 0.30144387515914 0.36023861231627 0.33102943977418 15.999 *18 O 0.68217700207673 0.98421385421226 0.90744664594785 15.999 19 O 0.30203685213553 0.31782299792328 0.90744664594785 15.999 20 O 0.01578614578774 0.69796314786447 0.90744664594785 15.999 21 O 0.31782299792328 0.01578614578774 0.09255335405215 15.999 22 O 0.69796314786447 0.68217700207673 0.09255335405215 15.999 23 O 0.98421385421226 0.30203685213553 0.09255335405215 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 7.520953763864816 0.000000000000000 0.000000000000000 b -3.760476881932408 6.513337020195121 0.000000000000000 c 0.000000000000000 0.000000000000000 6.474311490000000 Atomic positions (fractional): *1 Ba 0.66666666666667 0.33333333333333 0.39693571571404 137.327 > 1 2 Ba 0.33333333333333 0.66666666666667 0.60306428428596 137.327 > 2 *3 Ba 0.00000000000000 0.00000000000000 0.50000000000000 137.327 > 3 *4 Si 0.16984706189811 0.76321058731195 0.11131236548461 28.085 > 4 5 Si 0.59336352541384 0.83015293810189 0.11131236548461 28.085 > 5 6 Si 0.23678941268805 0.40663647458616 0.11131236548461 28.085 > 6 7 Si 0.83015293810189 0.23678941268805 0.88868763451539 28.085 > 7 8 Si 0.40663647458616 0.16984706189811 0.88868763451539 28.085 > 8 9 Si 0.76321058731195 0.59336352541384 0.88868763451539 28.085 > 9 *10 N 0.66666666666667 0.33333333333333 0.93576123071024 14.007 > 10 11 N 0.33333333333333 0.66666666666667 0.06423876928976 14.007 > 11 *12 O 0.94120526284288 0.30144387515914 0.66897056022582 15.999 > 12 13 O 0.36023861231627 0.05879473715712 0.66897056022582 15.999 > 13 14 O 0.69855612484086 0.63976138768373 0.66897056022582 15.999 > 14 15 O 0.05879473715712 0.69855612484086 0.33102943977418 15.999 > 15 16 O 0.63976138768373 0.94120526284288 0.33102943977418 15.999 > 16 17 O 0.30144387515914 0.36023861231627 0.33102943977418 15.999 > 17 *18 O 0.68217700207673 0.98421385421226 0.90744664594785 15.999 > 18 19 O 0.30203685213553 0.31782299792328 0.90744664594785 15.999 > 19 20 O 0.01578614578774 0.69796314786447 0.90744664594785 15.999 > 20 21 O 0.31782299792328 0.01578614578774 0.09255335405215 15.999 > 21 22 O 0.69796314786447 0.68217700207673 0.09255335405215 15.999 > 22 23 O 0.98421385421226 0.30203685213553 0.09255335405215 15.999 > 23 -------------------------------- super cell -------------------------------- Lattice vectors: a 7.520953763864816 0.000000000000000 0.000000000000000 b -3.760476881932408 6.513337020195121 0.000000000000000 c 0.000000000000000 0.000000000000000 12.948622980000000 Atomic positions (fractional): *1 Ba 0.66666666666667 0.33333333333333 0.19846785785702 137.327 > 1 2 Ba 0.66666666666667 0.33333333333333 0.69846785785702 137.327 > 1 3 Ba 0.33333333333333 0.66666666666667 0.30153214214298 137.327 > 2 4 Ba 0.33333333333333 0.66666666666667 0.80153214214298 137.327 > 2 *5 Ba 0.00000000000000 0.00000000000000 0.25000000000000 137.327 > 3 6 Ba 0.00000000000000 0.00000000000000 0.75000000000000 137.327 > 3 *7 Si 0.16984706189811 0.76321058731195 0.05565618274231 28.085 > 4 8 Si 0.16984706189811 0.76321058731195 0.55565618274231 28.085 > 4 9 Si 0.59336352541384 0.83015293810189 0.05565618274231 28.085 > 5 10 Si 0.59336352541384 0.83015293810189 0.55565618274231 28.085 > 5 11 Si 0.23678941268805 0.40663647458616 0.05565618274231 28.085 > 6 12 Si 0.23678941268805 0.40663647458616 0.55565618274231 28.085 > 6 13 Si 0.83015293810189 0.23678941268805 0.44434381725769 28.085 > 7 14 Si 0.83015293810189 0.23678941268805 0.94434381725769 28.085 > 7 15 Si 0.40663647458616 0.16984706189811 0.44434381725769 28.085 > 8 16 Si 0.40663647458616 0.16984706189811 0.94434381725769 28.085 > 8 17 Si 0.76321058731195 0.59336352541384 0.44434381725769 28.085 > 9 18 Si 0.76321058731195 0.59336352541384 0.94434381725769 28.085 > 9 *19 N 0.66666666666667 0.33333333333333 0.46788061535512 14.007 > 10 20 N 0.66666666666667 0.33333333333333 0.96788061535512 14.007 > 10 21 N 0.33333333333333 0.66666666666667 0.03211938464488 14.007 > 11 22 N 0.33333333333333 0.66666666666667 0.53211938464488 14.007 > 11 *23 O 0.94120526284288 0.30144387515914 0.33448528011291 15.999 > 12 24 O 0.94120526284288 0.30144387515914 0.83448528011291 15.999 > 12 25 O 0.36023861231627 0.05879473715712 0.33448528011291 15.999 > 13 26 O 0.36023861231627 0.05879473715712 0.83448528011291 15.999 > 13 27 O 0.69855612484086 0.63976138768373 0.33448528011291 15.999 > 14 28 O 0.69855612484086 0.63976138768373 0.83448528011291 15.999 > 14 29 O 0.05879473715712 0.69855612484086 0.16551471988709 15.999 > 15 30 O 0.05879473715712 0.69855612484086 0.66551471988709 15.999 > 15 31 O 0.63976138768373 0.94120526284288 0.16551471988709 15.999 > 16 32 O 0.63976138768373 0.94120526284288 0.66551471988709 15.999 > 16 33 O 0.30144387515914 0.36023861231627 0.16551471988709 15.999 > 17 34 O 0.30144387515914 0.36023861231627 0.66551471988709 15.999 > 17 *35 O 0.68217700207673 0.98421385421226 0.45372332297393 15.999 > 18 36 O 0.68217700207673 0.98421385421226 0.95372332297393 15.999 > 18 37 O 0.30203685213553 0.31782299792328 0.45372332297393 15.999 > 19 38 O 0.30203685213553 0.31782299792328 0.95372332297393 15.999 > 19 39 O 0.01578614578774 0.69796314786447 0.45372332297393 15.999 > 20 40 O 0.01578614578774 0.69796314786447 0.95372332297393 15.999 > 20 41 O 0.31782299792328 0.01578614578774 0.04627667702607 15.999 > 21 42 O 0.31782299792328 0.01578614578774 0.54627667702607 15.999 > 21 43 O 0.69796314786447 0.68217700207673 0.04627667702607 15.999 > 22 44 O 0.69796314786447 0.68217700207673 0.54627667702607 15.999 > 22 45 O 0.98421385421226 0.30203685213553 0.04627667702607 15.999 > 23 46 O 0.98421385421226 0.30203685213553 0.54627667702607 15.999 > 23 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.1784019 0.0000003 0.0000000 -0.0000003 3.1784019 0.0000000 0.0000000 0.0000000 3.1751155 -------------------------- Born effective charges -------------------------- 1 Ba 2.5788291 0.0270976 -0.0000000 -0.0270976 2.5788291 0.0000000 0.0000000 0.0000000 2.8765954 2 Ba 2.5788291 0.0270976 -0.0000000 -0.0270976 2.5788291 0.0000000 0.0000000 0.0000000 2.8765954 3 Ba 2.9418145 -0.1123083 -0.0000000 0.1123083 2.9418145 0.0000000 0.0000000 0.0000000 2.4175326 4 Si 3.2153947 0.1168987 0.1580351 0.0752133 3.1739907 0.1070248 -0.0801155 -0.2381571 2.9116953 5 Si 3.1011548 -0.0092568 0.0136686 -0.0509422 3.2882306 -0.1903748 -0.1661923 0.1884606 2.9116953 6 Si 3.2675286 -0.0451138 -0.1717037 -0.0867991 3.1218568 0.0833500 0.2463078 0.0496965 2.9116953 7 Si 3.2153947 0.1168987 0.1580351 0.0752133 3.1739907 0.1070248 -0.0801155 -0.2381571 2.9116953 8 Si 3.1011548 -0.0092568 0.0136686 -0.0509422 3.2882306 -0.1903748 -0.1661923 0.1884606 2.9116953 9 Si 3.2675286 -0.0451138 -0.1717037 -0.0867991 3.1218568 0.0833500 0.2463078 0.0496965 2.9116953 10 N -2.4852858 -0.0318118 -0.0000000 0.0318118 -2.4852858 0.0000000 0.0000000 0.0000000 -1.6962564 11 N -2.4852858 -0.0318118 -0.0000000 0.0318118 -2.4852858 0.0000000 0.0000000 0.0000000 -1.6962564 12 O -1.8561574 -0.0052240 0.2076574 0.0199855 -1.6033020 0.0267063 0.2707790 0.0755258 -2.0530094 13 O -1.6729078 -0.1257848 -0.0807003 -0.1005752 -1.7865517 -0.1931897 -0.0699822 -0.2722644 -2.0530094 14 O -1.6601239 0.0931945 -0.1269570 0.1184040 -1.7993355 0.1664834 -0.2007968 0.1967386 -2.0530094 15 O -1.8561574 -0.0052240 0.2076574 0.0199855 -1.6033020 0.0267063 0.2707790 0.0755258 -2.0530094 16 O -1.6729078 -0.1257848 -0.0807003 -0.1005752 -1.7865517 -0.1931897 -0.0699822 -0.2722644 -2.0530094 17 O -1.6601239 0.0931945 -0.1269570 0.1184040 -1.7993355 0.1664834 -0.2007968 0.1967386 -2.0530094 18 O -1.2877934 -0.1016714 0.0446825 -0.1257745 -2.6850997 0.6757001 0.1045464 0.5086552 -1.6550543 19 O -2.2372861 0.6739644 0.5628323 0.6498613 -1.7356069 -0.3765462 0.3882352 -0.3448675 -1.6550543 20 O -2.4342600 -0.5361384 -0.6075147 -0.5602415 -1.5386330 -0.2991539 -0.4927815 -0.1637878 -1.6550543 21 O -1.2877934 -0.1016714 0.0446825 -0.1257745 -2.6850997 0.6757001 0.1045464 0.5086552 -1.6550543 22 O -2.2372861 0.6739644 0.5628323 0.6498613 -1.7356069 -0.3765462 0.3882352 -0.3448675 -1.6550543 23 O -2.4342600 -0.5361384 -0.6075147 -0.5602415 -1.5386330 -0.2991539 -0.4927815 -0.1637878 -1.6550543 ---------------------------------------------------------------------------- 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: 138/138 Permutation basis: 4830/4830 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 818 Number of blocks in projector: 398 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: 374 Use standard eigh solver. --- Eigsh_solver_block: 2 / 3 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 3 / 3 --- Block_size: 108 Use standard eigh solver. Tree of FC basis block matrices: - (818, 783), data: False |-- (108, 102), data: True |-- (336, 324), data: True |-- (374, 357), data: True ----- Solver_atoms: 1 -- 46 / 46 Time (Solver_compr_matrix_reshape): 0.001 Solver_block: 100 / 480 - Time: 0.323 Solver_block: 200 / 480 - Time: 0.325 Solver_block: 300 / 480 - Time: 0.325 Solver_block: 400 / 480 - Time: 0.325 Solver_block: 480 / 480 - Time: 0.268 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 1.580 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 138/138 Permutation basis: 4830/4830 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 818 Number of blocks in projector: 398 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: 374 Use standard eigh solver. --- Eigsh_solver_block: 2 / 3 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 3 / 3 --- Block_size: 108 Use standard eigh solver. Tree of FC basis block matrices: - (818, 783), data: False |-- (108, 102), data: True |-- (336, 324), data: True |-- (374, 357), data: True Max drift after symmetrization by symfc projector: -0.00000000 (xx) -0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-09 04:50:14]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 04:50:14]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 1 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P-3 (147) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 7.520953763864816 0.000000000000000 0.000000000000000 b -3.760476881932408 6.513337020195121 0.000000000000000 c 0.000000000000000 0.000000000000000 6.474311490000000 Atomic positions (fractional): 1 Ba 0.66666666666667 0.33333333333333 0.39693571571404 137.327 2 Ba 0.33333333333333 0.66666666666667 0.60306428428596 137.327 3 Ba 0.00000000000000 0.00000000000000 0.50000000000000 137.327 4 Si 0.16984706189811 0.76321058731195 0.11131236548461 28.085 5 Si 0.59336352541384 0.83015293810189 0.11131236548461 28.085 6 Si 0.23678941268805 0.40663647458616 0.11131236548461 28.085 7 Si 0.83015293810189 0.23678941268805 0.88868763451539 28.085 8 Si 0.40663647458616 0.16984706189811 0.88868763451539 28.085 9 Si 0.76321058731195 0.59336352541384 0.88868763451539 28.085 10 N 0.66666666666667 0.33333333333333 0.93576123071024 14.007 11 N 0.33333333333333 0.66666666666667 0.06423876928976 14.007 12 O 0.94120526284288 0.30144387515914 0.66897056022582 15.999 13 O 0.36023861231627 0.05879473715712 0.66897056022582 15.999 14 O 0.69855612484086 0.63976138768373 0.66897056022582 15.999 15 O 0.05879473715712 0.69855612484086 0.33102943977418 15.999 16 O 0.63976138768373 0.94120526284288 0.33102943977418 15.999 17 O 0.30144387515914 0.36023861231627 0.33102943977418 15.999 18 O 0.68217700207673 0.98421385421226 0.90744664594785 15.999 19 O 0.30203685213553 0.31782299792328 0.90744664594785 15.999 20 O 0.01578614578774 0.69796314786447 0.90744664594785 15.999 21 O 0.31782299792328 0.01578614578774 0.09255335405215 15.999 22 O 0.69796314786447 0.68217700207673 0.09255335405215 15.999 23 O 0.98421385421226 0.30203685213553 0.09255335405215 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 7.520953763864816 0.000000000000000 0.000000000000000 b -3.760476881932408 6.513337020195121 0.000000000000000 c 0.000000000000000 0.000000000000000 12.948622980000000 Atomic positions (fractional): 1 Ba 0.66666666666667 0.33333333333333 0.19846785785702 137.327 > 1 2 Ba 0.66666666666667 0.33333333333333 0.69846785785702 137.327 > 1 3 Ba 0.33333333333333 0.66666666666667 0.30153214214298 137.327 > 3 4 Ba 0.33333333333333 0.66666666666667 0.80153214214298 137.327 > 3 5 Ba 0.00000000000000 0.00000000000000 0.25000000000000 137.327 > 5 6 Ba 0.00000000000000 0.00000000000000 0.75000000000000 137.327 > 5 7 Si 0.16984706189811 0.76321058731195 0.05565618274231 28.085 > 7 8 Si 0.16984706189811 0.76321058731195 0.55565618274231 28.085 > 7 9 Si 0.59336352541384 0.83015293810189 0.05565618274231 28.085 > 9 10 Si 0.59336352541384 0.83015293810189 0.55565618274231 28.085 > 9 11 Si 0.23678941268805 0.40663647458616 0.05565618274231 28.085 > 11 12 Si 0.23678941268805 0.40663647458616 0.55565618274231 28.085 > 11 13 Si 0.83015293810189 0.23678941268805 0.44434381725769 28.085 > 13 14 Si 0.83015293810189 0.23678941268805 0.94434381725769 28.085 > 13 15 Si 0.40663647458616 0.16984706189811 0.44434381725769 28.085 > 15 16 Si 0.40663647458616 0.16984706189811 0.94434381725769 28.085 > 15 17 Si 0.76321058731195 0.59336352541384 0.44434381725769 28.085 > 17 18 Si 0.76321058731195 0.59336352541384 0.94434381725769 28.085 > 17 19 N 0.66666666666667 0.33333333333333 0.46788061535512 14.007 > 19 20 N 0.66666666666667 0.33333333333333 0.96788061535512 14.007 > 19 21 N 0.33333333333333 0.66666666666667 0.03211938464488 14.007 > 21 22 N 0.33333333333333 0.66666666666667 0.53211938464488 14.007 > 21 23 O 0.94120526284288 0.30144387515914 0.33448528011291 15.999 > 23 24 O 0.94120526284288 0.30144387515914 0.83448528011291 15.999 > 23 25 O 0.36023861231627 0.05879473715712 0.33448528011291 15.999 > 25 26 O 0.36023861231627 0.05879473715712 0.83448528011291 15.999 > 25 27 O 0.69855612484086 0.63976138768373 0.33448528011291 15.999 > 27 28 O 0.69855612484086 0.63976138768373 0.83448528011291 15.999 > 27 29 O 0.05879473715712 0.69855612484086 0.16551471988709 15.999 > 29 30 O 0.05879473715712 0.69855612484086 0.66551471988709 15.999 > 29 31 O 0.63976138768373 0.94120526284288 0.16551471988709 15.999 > 31 32 O 0.63976138768373 0.94120526284288 0.66551471988709 15.999 > 31 33 O 0.30144387515914 0.36023861231627 0.16551471988709 15.999 > 33 34 O 0.30144387515914 0.36023861231627 0.66551471988709 15.999 > 33 35 O 0.68217700207673 0.98421385421226 0.45372332297393 15.999 > 35 36 O 0.68217700207673 0.98421385421226 0.95372332297393 15.999 > 35 37 O 0.30203685213553 0.31782299792328 0.45372332297393 15.999 > 37 38 O 0.30203685213553 0.31782299792328 0.95372332297393 15.999 > 37 39 O 0.01578614578774 0.69796314786447 0.45372332297393 15.999 > 39 40 O 0.01578614578774 0.69796314786447 0.95372332297393 15.999 > 39 41 O 0.31782299792328 0.01578614578774 0.04627667702607 15.999 > 41 42 O 0.31782299792328 0.01578614578774 0.54627667702607 15.999 > 41 43 O 0.69796314786447 0.68217700207673 0.04627667702607 15.999 > 43 44 O 0.69796314786447 0.68217700207673 0.54627667702607 15.999 > 43 45 O 0.98421385421226 0.30203685213553 0.04627667702607 15.999 > 45 46 O 0.98421385421226 0.30203685213553 0.54627667702607 15.999 > 45 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.1784019 0.0000003 0.0000000 -0.0000003 3.1784019 0.0000000 0.0000000 0.0000000 3.1751155 -------------------------- Born effective charges -------------------------- 1 Ba 2.5788291 0.0270976 -0.0000000 -0.0270976 2.5788291 0.0000000 0.0000000 0.0000000 2.8765954 2 Ba 2.5788291 0.0270976 -0.0000000 -0.0270976 2.5788291 0.0000000 0.0000000 0.0000000 2.8765954 3 Ba 2.9418145 -0.1123083 -0.0000000 0.1123083 2.9418145 0.0000000 0.0000000 0.0000000 2.4175326 4 Si 3.2153947 0.1168987 0.1580351 0.0752133 3.1739907 0.1070248 -0.0801155 -0.2381571 2.9116953 5 Si 3.1011548 -0.0092568 0.0136686 -0.0509422 3.2882306 -0.1903748 -0.1661923 0.1884606 2.9116953 6 Si 3.2675286 -0.0451138 -0.1717037 -0.0867991 3.1218568 0.0833500 0.2463078 0.0496965 2.9116953 7 Si 3.2153947 0.1168987 0.1580351 0.0752133 3.1739907 0.1070248 -0.0801155 -0.2381571 2.9116953 8 Si 3.1011548 -0.0092568 0.0136686 -0.0509422 3.2882306 -0.1903748 -0.1661923 0.1884606 2.9116953 9 Si 3.2675286 -0.0451138 -0.1717037 -0.0867991 3.1218568 0.0833500 0.2463078 0.0496965 2.9116953 10 N -2.4852858 -0.0318118 -0.0000000 0.0318118 -2.4852858 0.0000000 0.0000000 0.0000000 -1.6962564 11 N -2.4852858 -0.0318118 -0.0000000 0.0318118 -2.4852858 0.0000000 0.0000000 0.0000000 -1.6962564 12 O -1.8561574 -0.0052240 0.2076574 0.0199855 -1.6033020 0.0267063 0.2707790 0.0755258 -2.0530094 13 O -1.6729078 -0.1257848 -0.0807003 -0.1005752 -1.7865517 -0.1931897 -0.0699822 -0.2722644 -2.0530094 14 O -1.6601239 0.0931945 -0.1269570 0.1184040 -1.7993355 0.1664834 -0.2007968 0.1967386 -2.0530094 15 O -1.8561574 -0.0052240 0.2076574 0.0199855 -1.6033020 0.0267063 0.2707790 0.0755258 -2.0530094 16 O -1.6729078 -0.1257848 -0.0807003 -0.1005752 -1.7865517 -0.1931897 -0.0699822 -0.2722644 -2.0530094 17 O -1.6601239 0.0931945 -0.1269570 0.1184040 -1.7993355 0.1664834 -0.2007968 0.1967386 -2.0530094 18 O -1.2877934 -0.1016714 0.0446825 -0.1257745 -2.6850997 0.6757001 0.1045464 0.5086552 -1.6550543 19 O -2.2372861 0.6739644 0.5628323 0.6498613 -1.7356069 -0.3765462 0.3882352 -0.3448675 -1.6550543 20 O -2.4342600 -0.5361384 -0.6075147 -0.5602415 -1.5386330 -0.2991539 -0.4927815 -0.1637878 -1.6550543 21 O -1.2877934 -0.1016714 0.0446825 -0.1257745 -2.6850997 0.6757001 0.1045464 0.5086552 -1.6550543 22 O -2.2372861 0.6739644 0.5628323 0.6498613 -1.7356069 -0.3765462 0.3882352 -0.3448675 -1.6550543 23 O -2.4342600 -0.5361384 -0.6075147 -0.5602415 -1.5386330 -0.2991539 -0.4927815 -0.1637878 -1.6550543 ---------------------------------------------------------------------------- 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[ 5, 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[ 7, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [-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[ 19, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 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] [-0.0050 0.0087 0.0000] [ 0.0050 -0.0087 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 35, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [-0.0050 0.0087 0.0000] [ 0.0050 -0.0087 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: -0.00000008 (yxy) -0.00000008 (yxy) -0.00000008 (yyx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000004 (yx) 0.00000004 (yx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 04:50:20]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 04:50:21]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 1 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P-3 (147) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 7.520953763864816 0.000000000000000 0.000000000000000 b -3.760476881932408 6.513337020195121 0.000000000000000 c 0.000000000000000 0.000000000000000 6.474311490000000 Atomic positions (fractional): 1 Ba 0.66666666666667 0.33333333333333 0.39693571571404 137.327 2 Ba 0.33333333333333 0.66666666666667 0.60306428428596 137.327 3 Ba 0.00000000000000 0.00000000000000 0.50000000000000 137.327 4 Si 0.16984706189811 0.76321058731195 0.11131236548461 28.085 5 Si 0.59336352541384 0.83015293810189 0.11131236548461 28.085 6 Si 0.23678941268805 0.40663647458616 0.11131236548461 28.085 7 Si 0.83015293810189 0.23678941268805 0.88868763451539 28.085 8 Si 0.40663647458616 0.16984706189811 0.88868763451539 28.085 9 Si 0.76321058731195 0.59336352541384 0.88868763451539 28.085 10 N 0.66666666666667 0.33333333333333 0.93576123071024 14.007 11 N 0.33333333333333 0.66666666666667 0.06423876928976 14.007 12 O 0.94120526284288 0.30144387515914 0.66897056022582 15.999 13 O 0.36023861231627 0.05879473715712 0.66897056022582 15.999 14 O 0.69855612484086 0.63976138768373 0.66897056022582 15.999 15 O 0.05879473715712 0.69855612484086 0.33102943977418 15.999 16 O 0.63976138768373 0.94120526284288 0.33102943977418 15.999 17 O 0.30144387515914 0.36023861231627 0.33102943977418 15.999 18 O 0.68217700207673 0.98421385421226 0.90744664594785 15.999 19 O 0.30203685213553 0.31782299792328 0.90744664594785 15.999 20 O 0.01578614578774 0.69796314786447 0.90744664594785 15.999 21 O 0.31782299792328 0.01578614578774 0.09255335405215 15.999 22 O 0.69796314786447 0.68217700207673 0.09255335405215 15.999 23 O 0.98421385421226 0.30203685213553 0.09255335405215 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 7.520953763864816 0.000000000000000 0.000000000000000 b -3.760476881932408 6.513337020195121 0.000000000000000 c 0.000000000000000 0.000000000000000 12.948622980000000 Atomic positions (fractional): 1 Ba 0.66666666666667 0.33333333333333 0.19846785785702 137.327 > 1 2 Ba 0.66666666666667 0.33333333333333 0.69846785785702 137.327 > 1 3 Ba 0.33333333333333 0.66666666666667 0.30153214214298 137.327 > 3 4 Ba 0.33333333333333 0.66666666666667 0.80153214214298 137.327 > 3 5 Ba 0.00000000000000 0.00000000000000 0.25000000000000 137.327 > 5 6 Ba 0.00000000000000 0.00000000000000 0.75000000000000 137.327 > 5 7 Si 0.16984706189811 0.76321058731195 0.05565618274231 28.085 > 7 8 Si 0.16984706189811 0.76321058731195 0.55565618274231 28.085 > 7 9 Si 0.59336352541384 0.83015293810189 0.05565618274231 28.085 > 9 10 Si 0.59336352541384 0.83015293810189 0.55565618274231 28.085 > 9 11 Si 0.23678941268805 0.40663647458616 0.05565618274231 28.085 > 11 12 Si 0.23678941268805 0.40663647458616 0.55565618274231 28.085 > 11 13 Si 0.83015293810189 0.23678941268805 0.44434381725769 28.085 > 13 14 Si 0.83015293810189 0.23678941268805 0.94434381725769 28.085 > 13 15 Si 0.40663647458616 0.16984706189811 0.44434381725769 28.085 > 15 16 Si 0.40663647458616 0.16984706189811 0.94434381725769 28.085 > 15 17 Si 0.76321058731195 0.59336352541384 0.44434381725769 28.085 > 17 18 Si 0.76321058731195 0.59336352541384 0.94434381725769 28.085 > 17 19 N 0.66666666666667 0.33333333333333 0.46788061535512 14.007 > 19 20 N 0.66666666666667 0.33333333333333 0.96788061535512 14.007 > 19 21 N 0.33333333333333 0.66666666666667 0.03211938464488 14.007 > 21 22 N 0.33333333333333 0.66666666666667 0.53211938464488 14.007 > 21 23 O 0.94120526284288 0.30144387515914 0.33448528011291 15.999 > 23 24 O 0.94120526284288 0.30144387515914 0.83448528011291 15.999 > 23 25 O 0.36023861231627 0.05879473715712 0.33448528011291 15.999 > 25 26 O 0.36023861231627 0.05879473715712 0.83448528011291 15.999 > 25 27 O 0.69855612484086 0.63976138768373 0.33448528011291 15.999 > 27 28 O 0.69855612484086 0.63976138768373 0.83448528011291 15.999 > 27 29 O 0.05879473715712 0.69855612484086 0.16551471988709 15.999 > 29 30 O 0.05879473715712 0.69855612484086 0.66551471988709 15.999 > 29 31 O 0.63976138768373 0.94120526284288 0.16551471988709 15.999 > 31 32 O 0.63976138768373 0.94120526284288 0.66551471988709 15.999 > 31 33 O 0.30144387515914 0.36023861231627 0.16551471988709 15.999 > 33 34 O 0.30144387515914 0.36023861231627 0.66551471988709 15.999 > 33 35 O 0.68217700207673 0.98421385421226 0.45372332297393 15.999 > 35 36 O 0.68217700207673 0.98421385421226 0.95372332297393 15.999 > 35 37 O 0.30203685213553 0.31782299792328 0.45372332297393 15.999 > 37 38 O 0.30203685213553 0.31782299792328 0.95372332297393 15.999 > 37 39 O 0.01578614578774 0.69796314786447 0.45372332297393 15.999 > 39 40 O 0.01578614578774 0.69796314786447 0.95372332297393 15.999 > 39 41 O 0.31782299792328 0.01578614578774 0.04627667702607 15.999 > 41 42 O 0.31782299792328 0.01578614578774 0.54627667702607 15.999 > 41 43 O 0.69796314786447 0.68217700207673 0.04627667702607 15.999 > 43 44 O 0.69796314786447 0.68217700207673 0.54627667702607 15.999 > 43 45 O 0.98421385421226 0.30203685213553 0.04627667702607 15.999 > 45 46 O 0.98421385421226 0.30203685213553 0.54627667702607 15.999 > 45 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.1784019 0.0000003 0.0000000 -0.0000003 3.1784019 0.0000000 0.0000000 0.0000000 3.1751155 -------------------------- Born effective charges -------------------------- 1 Ba 2.5788291 0.0270976 -0.0000000 -0.0270976 2.5788291 0.0000000 0.0000000 0.0000000 2.8765954 2 Ba 2.5788291 0.0270976 -0.0000000 -0.0270976 2.5788291 0.0000000 0.0000000 0.0000000 2.8765954 3 Ba 2.9418145 -0.1123083 -0.0000000 0.1123083 2.9418145 0.0000000 0.0000000 0.0000000 2.4175326 4 Si 3.2153947 0.1168987 0.1580351 0.0752133 3.1739907 0.1070248 -0.0801155 -0.2381571 2.9116953 5 Si 3.1011548 -0.0092568 0.0136686 -0.0509422 3.2882306 -0.1903748 -0.1661923 0.1884606 2.9116953 6 Si 3.2675286 -0.0451138 -0.1717037 -0.0867991 3.1218568 0.0833500 0.2463078 0.0496965 2.9116953 7 Si 3.2153947 0.1168987 0.1580351 0.0752133 3.1739907 0.1070248 -0.0801155 -0.2381571 2.9116953 8 Si 3.1011548 -0.0092568 0.0136686 -0.0509422 3.2882306 -0.1903748 -0.1661923 0.1884606 2.9116953 9 Si 3.2675286 -0.0451138 -0.1717037 -0.0867991 3.1218568 0.0833500 0.2463078 0.0496965 2.9116953 10 N -2.4852858 -0.0318118 -0.0000000 0.0318118 -2.4852858 0.0000000 0.0000000 0.0000000 -1.6962564 11 N -2.4852858 -0.0318118 -0.0000000 0.0318118 -2.4852858 0.0000000 0.0000000 0.0000000 -1.6962564 12 O -1.8561574 -0.0052240 0.2076574 0.0199855 -1.6033020 0.0267063 0.2707790 0.0755258 -2.0530094 13 O -1.6729078 -0.1257848 -0.0807003 -0.1005752 -1.7865517 -0.1931897 -0.0699822 -0.2722644 -2.0530094 14 O -1.6601239 0.0931945 -0.1269570 0.1184040 -1.7993355 0.1664834 -0.2007968 0.1967386 -2.0530094 15 O -1.8561574 -0.0052240 0.2076574 0.0199855 -1.6033020 0.0267063 0.2707790 0.0755258 -2.0530094 16 O -1.6729078 -0.1257848 -0.0807003 -0.1005752 -1.7865517 -0.1931897 -0.0699822 -0.2722644 -2.0530094 17 O -1.6601239 0.0931945 -0.1269570 0.1184040 -1.7993355 0.1664834 -0.2007968 0.1967386 -2.0530094 18 O -1.2877934 -0.1016714 0.0446825 -0.1257745 -2.6850997 0.6757001 0.1045464 0.5086552 -1.6550543 19 O -2.2372861 0.6739644 0.5628323 0.6498613 -1.7356069 -0.3765462 0.3882352 -0.3448675 -1.6550543 20 O -2.4342600 -0.5361384 -0.6075147 -0.5602415 -1.5386330 -0.2991539 -0.4927815 -0.1637878 -1.6550543 21 O -1.2877934 -0.1016714 0.0446825 -0.1257745 -2.6850997 0.6757001 0.1045464 0.5086552 -1.6550543 22 O -2.2372861 0.6739644 0.5628323 0.6498613 -1.7356069 -0.3765462 0.3882352 -0.3448675 -1.6550543 23 O -2.4342600 -0.5361384 -0.6075147 -0.5602415 -1.5386330 -0.2991539 -0.4927815 -0.1637878 -1.6550543 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000008 (yxy) -0.00000008 (yxy) -0.00000008 (yyx) Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 8 8 8 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.61, Number of G-points: 277, Lambda: 0.11 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/90) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 2.027 ( 0.000 0.000 0.000) 0.000 2.589 ( 0.000 0.000 0.000) 0.000 2.589 ( 0.000 0.000 0.000) 0.000 2.665 ( 0.000 0.000 0.000) 0.000 2.665 ( 0.000 0.000 0.000) 0.000 2.903 ( 0.000 0.000 0.000) 0.000 3.113 ( 0.000 0.000 0.000) 0.000 3.113 ( 0.000 0.000 0.000) 0.000 4.220 ( 0.000 0.000 0.000) 0.000 4.220 ( 0.000 0.000 0.000) 0.000 4.253 ( 0.000 0.000 0.000) 0.000 4.766 ( 0.000 0.000 0.000) 0.000 5.087 ( 0.000 0.000 0.000) 0.000 5.165 ( 0.000 0.000 0.000) 0.000 5.165 ( 0.000 0.000 0.000) 0.000 5.875 ( 0.000 0.000 0.000) 0.000 5.875 ( 0.000 0.000 0.000) 0.000 6.316 ( 0.000 0.000 0.000) 0.000 6.472 ( 0.000 0.000 0.000) 0.000 7.045 ( 0.000 0.000 0.000) 0.000 8.042 ( 0.000 0.000 0.000) 0.000 8.042 ( 0.000 0.000 0.000) 0.000 8.080 ( 0.000 0.000 0.000) 0.000 8.080 ( 0.000 0.000 0.000) 0.000 8.584 ( 0.000 0.000 0.000) 0.000 9.179 ( 0.000 0.000 0.000) 0.000 9.179 ( 0.000 0.000 0.000) 0.000 9.573 ( 0.000 0.000 0.000) 0.000 10.180 ( 0.000 0.000 0.000) 0.000 10.180 ( 0.000 0.000 0.000) 0.000 10.816 ( 0.000 0.000 0.000) 0.000 10.816 ( 0.000 0.000 0.000) 0.000 11.795 ( 0.000 0.000 0.000) 0.000 12.269 ( 0.000 0.000 0.000) 0.000 12.269 ( 0.000 0.000 0.000) 0.000 12.608 ( 0.000 0.000 0.000) 0.000 13.468 ( 0.000 0.000 0.000) 0.000 13.468 ( 0.000 0.000 0.000) 0.000 13.757 ( 0.000 0.000 0.000) 0.000 13.757 ( 0.000 0.000 0.000) 0.000 14.471 ( 0.000 0.000 0.000) 0.000 14.602 ( 0.000 0.000 0.000) 0.000 16.353 ( 0.000 0.000 0.000) 0.000 17.929 ( 0.000 0.000 0.000) 0.000 19.393 ( 0.000 0.000 0.000) 0.000 19.393 ( 0.000 0.000 0.000) 0.000 20.887 ( 0.000 0.000 0.000) 0.000 20.887 ( 0.000 0.000 0.000) 0.000 21.599 ( 0.000 0.000 0.000) 0.000 21.893 ( 0.000 0.000 0.000) 0.000 26.710 ( 0.000 0.000 0.000) 0.000 26.710 ( 0.000 0.000 0.000) 0.000 27.496 ( 0.000 0.000 0.000) 0.000 27.496 ( 0.000 0.000 0.000) 0.000 27.924 ( 0.000 0.000 0.000) 0.000 28.734 ( 0.000 0.000 0.000) 0.000 28.734 ( 0.000 0.000 0.000) 0.000 29.262 ( 0.000 0.000 0.000) 0.000 29.262 ( 0.000 0.000 0.000) 0.000 29.338 ( 0.000 0.000 0.000) 0.000 29.906 ( 0.000 0.000 0.000) 0.000 29.906 ( 0.000 0.000 0.000) 0.000 30.481 ( 0.000 0.000 0.000) 0.000 30.481 ( 0.000 0.000 0.000) 0.000 30.813 ( 0.000 0.000 0.000) 0.000 30.893 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/90) ======================= q-point: ( 0.12 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.448 ( 17.302 16.236 -18.450) 30.056 0.499 ( 24.039 9.608 -6.839) 26.776 1.069 ( 45.653 25.871 9.888) 53.397 2.002 ( -1.987 -1.322 0.502) 2.439 2.511 ( -4.779 -2.817 1.633) 5.783 2.626 ( -4.387 -0.542 0.366) 4.435 2.684 ( 0.288 -2.010 -1.454) 2.497 2.857 ( -3.347 -2.184 1.031) 4.127 3.014 ( -0.491 -0.046 -0.233) 0.546 3.113 ( -0.130 0.105 1.670) 1.678 3.570 ( -2.197 -1.115 -0.290) 2.480 4.172 ( -2.374 -1.589 -4.715) 5.513 4.260 ( 1.802 1.093 0.655) 2.207 4.369 ( 8.625 4.833 1.322) 9.975 4.816 ( 2.923 1.741 0.107) 3.404 5.088 ( -2.551 -3.209 -1.901) 4.519 5.134 ( 1.110 4.179 2.678) 5.086 5.203 ( 3.748 0.365 -0.482) 3.796 5.815 ( -5.879 -1.447 -0.578) 6.082 5.942 ( 6.728 1.882 1.181) 7.085 6.488 ( 8.865 5.622 -8.332) 13.402 6.566 ( 8.793 4.891 7.870) 12.774 7.102 ( 5.457 3.089 -0.310) 6.278 7.967 ( -6.186 -5.077 -0.144) 8.004 7.997 ( -5.644 -0.168 -2.187) 6.055 8.142 ( 4.723 -0.108 6.958) 8.410 8.275 ( 2.065 2.387 0.032) 3.157 8.567 ( -1.109 -0.688 -1.163) 1.748 9.118 ( -5.267 -3.158 -0.458) 6.158 9.177 ( -0.207 0.017 0.354) 0.411 9.486 ( -7.665 -4.406 0.208) 8.844 9.994 ( -15.334 -9.156 -1.263) 17.904 10.284 ( -10.455 -5.570 -0.907) 11.881 10.816 ( -1.033 -0.519 -0.347) 1.207 11.445 ( -18.812 -10.706 -6.251) 22.530 11.755 ( -6.449 -3.795 0.454) 7.496 12.171 ( -10.881 4.416 4.614) 12.617 12.370 ( 16.043 -11.730 1.391) 19.923 12.633 ( -3.751 3.357 -1.088) 5.150 13.240 ( -27.413 20.114 0.218) 34.002 13.422 ( 14.619 -26.777 -2.611) 30.619 14.029 ( 11.755 10.510 0.230) 15.771 14.575 ( 9.339 4.509 -1.855) 10.535 14.689 ( 9.099 3.634 -1.416) 9.899 14.958 ( 11.971 9.476 5.346) 16.176 16.373 ( 2.537 1.486 0.052) 2.940 17.913 ( -2.136 -1.170 0.164) 2.441 19.282 ( -8.880 -7.515 -0.153) 11.634 19.305 ( -6.784 -1.603 -0.009) 6.971 20.910 ( 0.912 1.264 0.039) 1.559 21.090 ( 15.589 8.000 0.280) 17.524 21.585 ( -0.563 -0.066 -0.198) 0.600 21.984 ( 7.868 4.498 0.596) 9.083 26.732 ( 2.002 1.210 -0.014) 2.339 27.489 ( -1.105 -0.126 0.098) 1.116 27.513 ( 1.626 0.373 -0.010) 1.668 27.936 ( 0.988 0.555 -0.043) 1.134 28.400 ( -8.511 -10.102 12.159) 17.954 28.637 ( -15.551 11.745 -8.236) 21.157 28.800 ( 11.746 -12.823 -13.356) 21.927 29.266 ( -3.230 5.132 0.237) 6.068 29.485 ( 12.436 4.330 10.201) 16.658 29.752 ( 0.151 -0.038 2.779) 2.783 29.908 ( 0.256 0.214 -2.810) 2.830 30.453 ( -2.490 -1.376 -1.118) 3.057 30.500 ( 1.673 0.924 0.869) 2.099 30.750 ( -5.164 -2.971 1.486) 6.140 30.878 ( -1.248 -0.737 -1.796) 2.308 31.109 ( 0.304 0.175 -0.923) 0.988 ======================= Grid point 2 (3/90) ======================= q-point: ( 0.25 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.876 ( 13.049 19.413 -17.319) 29.104 0.974 ( 23.132 7.170 -7.502) 25.353 1.905 ( 16.926 10.112 5.234) 20.400 1.968 ( 10.706 3.663 2.234) 11.534 2.420 ( -3.078 -1.424 1.577) 3.740 2.492 ( -9.252 -4.971 1.503) 10.610 2.612 ( -4.555 -2.425 -0.872) 5.234 2.771 ( -3.201 -5.524 4.253) 7.671 2.981 ( -3.291 -0.527 -1.905) 3.839 3.111 ( 0.057 0.092 1.622) 1.626 3.618 ( 8.499 4.412 2.460) 9.887 4.122 ( -2.040 -0.951 -4.279) 4.835 4.286 ( -0.038 1.521 0.829) 1.733 4.528 ( 3.715 0.236 -2.540) 4.506 4.786 ( -2.554 0.216 -0.375) 2.591 5.142 ( 0.481 5.307 2.737) 5.990 5.236 ( 5.726 -7.576 -0.883) 9.538 5.267 ( 10.886 9.437 0.600) 14.419 5.847 ( 4.637 9.658 0.038) 10.714 6.134 ( 13.893 1.669 -1.743) 14.101 6.627 ( 3.651 3.324 -7.748) 9.187 6.801 ( 9.537 8.150 11.301) 16.885 7.277 ( 9.957 3.936 -1.292) 10.785 7.736 ( -15.272 -5.193 0.564) 16.141 7.894 ( -3.431 -7.171 -4.000) 8.899 8.216 ( 4.694 -1.120 8.353) 9.647 8.303 ( -2.316 3.454 1.458) 4.407 8.566 ( 1.809 0.752 -1.171) 2.282 8.964 ( -7.648 -4.819 -0.239) 9.042 9.153 ( -5.306 -3.344 -0.880) 6.333 9.259 ( -9.958 -4.568 2.024) 11.141 9.583 ( -18.807 -12.813 -3.344) 23.001 9.975 ( -16.748 -6.425 -3.753) 18.326 10.716 ( -8.500 -4.029 -0.178) 9.409 11.058 ( -14.638 -8.928 -4.563) 17.743 11.602 ( -8.266 -7.210 1.950) 11.140 11.983 ( -8.862 1.884 0.644) 9.083 12.468 ( 12.121 -17.609 2.771) 21.556 12.660 ( 3.441 1.662 -0.518) 3.857 13.022 ( -25.380 29.102 -1.483) 38.642 13.450 ( 14.030 -20.945 -1.888) 25.280 14.228 ( 2.519 7.974 1.862) 8.567 14.798 ( 13.788 -0.701 -4.896) 14.649 14.969 ( 15.771 5.218 0.043) 16.612 15.224 ( 5.494 12.952 5.526) 15.116 16.509 ( 10.136 6.245 0.300) 11.909 17.798 ( -9.224 -4.298 0.509) 10.189 19.034 ( -8.888 -10.175 -0.352) 13.515 19.241 ( -0.748 3.573 0.101) 3.652 20.914 ( -2.223 1.870 0.081) 2.906 21.307 ( 2.343 -4.357 0.744) 5.003 21.715 ( 13.635 10.534 -0.847) 17.251 22.207 ( 11.243 6.212 0.927) 12.879 26.797 ( 3.505 2.398 -0.040) 4.247 27.445 ( -3.220 -1.941 0.308) 3.773 27.545 ( 1.200 0.222 0.091) 1.224 27.958 ( 0.825 -0.036 -0.395) 0.915 28.173 ( -6.461 -8.048 6.681) 12.294 28.508 ( -11.986 10.992 -4.974) 17.007 28.846 ( 10.212 -15.653 -9.803) 21.105 29.250 ( -6.031 7.499 0.327) 9.629 29.744 ( 11.352 4.622 13.117) 17.952 29.757 ( 0.564 0.345 2.180) 2.278 29.928 ( 2.187 0.795 -5.624) 6.086 30.379 ( -3.928 -2.306 -2.780) 5.337 30.550 ( 2.336 1.942 -0.262) 3.050 30.610 ( -6.717 -4.194 6.413) 10.190 30.845 ( -1.350 -0.944 -5.695) 5.928 31.096 ( -1.660 -0.910 -0.214) 1.905 ======================= Grid point 3 (4/90) ======================= q-point: ( 0.38 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.231 ( 7.575 17.098 -12.406) 22.441 1.394 ( 19.915 5.019 -7.978) 22.033 1.872 ( -3.010 -2.838 0.531) 4.171 2.178 ( -11.597 -3.399 1.856) 12.227 2.381 ( 4.276 -2.524 4.418) 6.646 2.414 ( 2.618 4.348 -0.153) 5.078 2.542 ( 0.166 -1.526 3.266) 3.608 2.630 ( -5.022 -7.728 5.145) 10.556 2.903 ( -4.869 -0.617 -3.258) 5.891 3.122 ( 0.839 0.211 0.513) 1.006 3.903 ( 14.228 6.018 6.829) 16.890 4.093 ( 0.169 -0.226 -7.904) 7.909 4.283 ( -2.554 1.254 3.030) 4.157 4.482 ( -4.016 -0.380 -3.708) 5.479 4.882 ( 8.501 3.241 -0.895) 9.142 5.149 ( -1.396 0.938 4.508) 4.812 5.237 ( 3.051 -4.717 0.224) 5.622 5.654 ( 16.291 17.311 -2.584) 23.911 6.073 ( 11.876 5.264 1.715) 13.103 6.346 ( 5.975 -2.970 -7.619) 10.128 6.698 ( 1.665 4.060 2.888) 5.253 6.976 ( -4.631 12.372 8.839) 15.894 7.392 ( -4.962 -0.530 -0.637) 5.030 7.424 ( 1.041 -17.024 -4.094) 17.540 7.820 ( 2.814 -0.475 -1.558) 3.252 8.275 ( 3.399 -0.777 6.367) 7.259 8.288 ( -2.206 2.722 0.678) 3.569 8.610 ( -4.537 2.693 -0.479) 5.298 8.802 ( -7.804 -3.753 0.535) 8.676 8.839 ( -8.211 -10.371 1.063) 13.270 9.150 ( -13.572 -4.772 -2.951) 14.686 9.254 ( -1.795 -2.964 -1.657) 3.841 9.711 ( -8.872 -1.710 -3.442) 9.668 10.533 ( -7.472 -0.554 -0.959) 7.554 10.763 ( -10.852 -10.498 -1.030) 15.134 11.338 ( -9.228 -7.984 1.421) 12.285 12.016 ( 3.262 6.256 -0.478) 7.072 12.475 ( 4.519 -7.722 2.574) 9.311 12.665 ( -0.464 -5.333 -1.104) 5.466 12.989 ( -8.870 20.029 -1.050) 21.931 13.460 ( 6.563 -12.233 -0.916) 13.912 14.304 ( -1.267 6.857 1.705) 7.179 14.977 ( 9.882 -5.426 -3.420) 11.781 15.190 ( 7.547 0.078 -0.150) 7.549 15.417 ( 3.258 12.144 3.222) 12.980 16.812 ( 15.848 9.555 0.206) 18.507 17.532 ( -15.569 -6.699 0.728) 16.964 18.833 ( -4.518 -7.258 -0.264) 8.554 19.327 ( 4.049 5.111 0.015) 6.520 20.886 ( -3.203 2.734 0.120) 4.213 21.211 ( -3.126 -7.556 0.330) 8.183 22.060 ( 12.310 8.362 -0.553) 14.892 22.425 ( 7.682 4.193 0.709) 8.780 26.886 ( 3.615 2.912 -0.050) 4.642 27.348 ( -4.385 -3.704 0.393) 5.754 27.543 ( -0.814 -0.881 0.242) 1.224 27.957 ( 0.515 -1.344 -0.918) 1.707 28.059 ( -3.050 -0.609 2.932) 4.274 28.466 ( -3.658 6.520 -1.965) 7.730 28.847 ( 5.532 -10.688 -4.875) 12.984 29.213 ( -5.000 4.680 -0.040) 6.849 29.770 ( 1.081 -0.509 4.571) 4.724 29.881 ( 0.986 3.014 2.174) 3.845 30.046 ( 8.984 2.601 -0.160) 9.355 30.296 ( -2.531 -2.265 -4.774) 5.859 30.447 ( -7.899 -2.877 2.866) 8.882 30.616 ( 2.676 1.157 5.534) 6.255 30.828 ( 0.245 -0.214 -7.341) 7.348 31.039 ( -3.241 -1.708 0.946) 3.783 ======================= Grid point 4 (5/90) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 132 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.394 ( 0.000 -0.000 -0.000) 0.000 1.682 ( -0.000 0.000 0.000) 0.000 1.769 ( 0.000 0.000 -0.000) 0.000 2.004 ( 0.000 0.000 0.000) 0.000 2.391 ( 0.000 0.000 0.000) 0.000 2.473 ( 0.000 0.000 -0.000) 0.000 2.495 ( -0.000 0.000 -0.000) 0.000 2.587 ( 0.000 0.000 0.000) 0.000 2.846 ( 0.000 0.000 -0.000) 0.000 3.132 ( 0.000 0.000 -0.000) 0.000 4.019 ( 0.000 0.000 0.000) 0.000 4.171 ( 0.000 0.000 -0.000) 0.000 4.225 ( -0.000 0.000 0.000) 0.000 4.454 ( 0.000 0.000 0.000) 0.000 4.993 ( 0.000 0.000 -0.000) 0.000 5.145 ( 0.000 0.000 0.000) 0.000 5.241 ( 0.000 -0.000 -0.000) 0.000 6.049 ( 0.000 0.000 0.000) 0.000 6.144 ( -0.000 -0.000 -0.000) 0.000 6.316 ( 0.000 0.000 0.000) 0.000 6.663 ( 0.000 0.000 0.000) 0.000 6.989 ( 0.000 0.000 0.000) 0.000 7.251 ( 0.000 -0.000 -0.000) 0.000 7.470 ( 0.000 0.000 -0.000) 0.000 7.897 ( 0.000 0.000 0.000) 0.000 8.271 ( 0.000 0.000 0.000) 0.000 8.363 ( -0.000 0.000 -0.000) 0.000 8.365 ( 0.000 -0.000 0.000) 0.000 8.762 ( 0.000 0.000 -0.000) 0.000 8.843 ( -0.000 0.000 -0.000) 0.000 8.911 ( 0.000 0.000 0.000) 0.000 9.251 ( 0.000 0.000 0.000) 0.000 9.637 ( 0.000 0.000 -0.000) 0.000 10.527 ( -0.000 -0.000 0.000) 0.000 10.537 ( 0.000 0.000 -0.000) 0.000 11.224 ( 0.000 0.000 0.000) 0.000 12.087 ( 0.000 0.000 -0.000) 0.000 12.485 ( 0.000 0.000 0.000) 0.000 12.615 ( 0.000 0.000 0.000) 0.000 13.023 ( 0.000 0.000 -0.000) 0.000 13.451 ( 0.000 -0.000 -0.000) 0.000 14.326 ( 0.000 0.000 0.000) 0.000 15.024 ( 0.000 0.000 0.000) 0.000 15.255 ( 0.000 0.000 0.000) 0.000 15.511 ( 0.000 0.000 -0.000) 0.000 17.171 ( 0.000 0.000 -0.000) 0.000 17.190 ( 0.000 0.000 0.000) 0.000 18.759 ( 0.000 0.000 0.000) 0.000 19.399 ( 0.000 0.000 0.000) 0.000 20.872 ( 0.000 -0.000 -0.000) 0.000 21.136 ( 0.000 0.000 -0.000) 0.000 22.210 ( 0.000 0.000 0.000) 0.000 22.512 ( 0.000 0.000 -0.000) 0.000 26.940 ( 0.000 -0.000 -0.000) 0.000 27.280 ( 0.000 0.000 0.000) 0.000 27.526 ( 0.000 0.000 0.000) 0.000 27.957 ( 0.000 0.000 0.000) 0.000 28.032 ( 0.000 0.000 0.000) 0.000 28.475 ( 0.000 0.000 -0.000) 0.000 28.839 ( 0.000 0.000 -0.000) 0.000 29.191 ( 0.000 0.000 -0.000) 0.000 29.777 ( 0.000 0.000 0.000) 0.000 29.900 ( 0.000 0.000 -0.000) 0.000 30.162 ( 0.000 0.000 -0.000) 0.000 30.285 ( 0.000 0.000 -0.000) 0.000 30.319 ( 0.000 0.000 0.000) 0.000 30.646 ( 0.000 0.000 0.000) 0.000 30.839 ( 0.000 0.000 -0.000) 0.000 30.990 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 10 (6/90) ======================= q-point: ( 0.12 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.629 ( 13.253 15.474 5.960) 21.228 1.002 ( 15.066 25.000 8.660) 30.447 1.722 ( 19.408 35.417 -6.791) 40.953 1.952 ( -2.598 -2.845 -0.537) 3.889 2.437 ( -2.379 -4.496 0.794) 5.148 2.535 ( -3.002 -6.496 -2.620) 7.621 2.691 ( -0.917 -1.598 -2.752) 3.311 2.798 ( -4.270 -2.304 1.860) 5.196 3.015 ( 0.417 -0.487 0.169) 0.663 3.109 ( -0.008 -0.833 -0.749) 1.121 3.508 ( -0.781 -1.191 -0.814) 1.640 4.138 ( -0.999 -1.911 2.802) 3.535 4.282 ( 1.316 0.583 -3.871) 4.130 4.503 ( 2.405 6.995 5.534) 9.238 4.814 ( -0.668 -3.469 -1.374) 3.790 5.088 ( -2.164 -6.357 -1.943) 6.991 5.177 ( 6.367 10.510 0.991) 12.328 5.289 ( 2.020 10.650 -1.529) 10.947 5.851 ( 11.176 3.136 -1.891) 11.761 6.019 ( -2.625 9.778 -0.770) 10.154 6.639 ( 4.540 6.551 3.618) 8.753 6.702 ( 6.318 8.571 0.084) 10.648 7.226 ( 4.766 9.844 1.013) 10.984 7.808 ( -5.124 -14.153 -3.144) 15.377 7.935 ( -4.708 -2.223 7.792) 9.372 8.164 ( -0.587 2.561 2.380) 3.545 8.345 ( 3.733 2.580 -5.675) 7.266 8.547 ( -0.699 -0.615 -0.130) 0.940 9.010 ( -4.716 -7.587 1.984) 9.151 9.175 ( -0.056 -0.429 -4.298) 4.320 9.322 ( -6.805 -12.545 -0.080) 14.272 9.695 ( -11.933 -18.247 -2.966) 22.003 10.085 ( -6.758 -15.691 -1.723) 17.171 10.752 ( -3.624 -7.028 0.989) 7.969 11.314 ( -4.956 -9.763 2.472) 11.225 11.703 ( -18.245 -11.295 1.599) 21.518 11.717 ( 5.965 -9.956 -1.109) 11.659 12.408 ( -11.131 -1.020 1.419) 11.268 12.641 ( -9.694 -13.588 -0.021) 16.691 13.037 ( 22.312 -0.432 -2.198) 22.424 13.712 ( -7.825 19.622 1.703) 21.193 14.142 ( 9.558 1.559 0.726) 9.712 14.704 ( -3.667 10.941 -9.297) 14.819 14.804 ( 9.564 11.170 0.363) 14.709 15.218 ( 11.438 10.897 7.895) 17.660 16.458 ( 5.074 8.360 1.249) 9.859 17.843 ( -3.384 -6.947 0.094) 7.728 19.099 ( -10.363 -10.319 0.163) 14.625 19.241 ( 2.346 -2.428 -0.106) 3.378 20.883 ( -0.884 -4.819 -1.149) 5.033 21.387 ( 5.657 20.886 -0.733) 21.651 21.575 ( 3.812 -1.311 0.382) 4.049 22.145 ( 6.451 11.538 -0.137) 13.220 26.776 ( 2.081 3.162 0.030) 3.785 27.476 ( -0.387 -1.322 -0.064) 1.379 27.521 ( -0.776 -0.130 -0.031) 0.787 27.955 ( 0.525 1.322 0.054) 1.424 28.278 ( -12.925 -2.728 9.291) 16.150 28.440 ( 11.216 -16.236 -5.954) 20.612 28.915 ( -13.133 10.896 -9.260) 19.415 29.234 ( 9.255 -6.972 4.986) 12.615 29.659 ( 3.940 10.676 10.296) 15.346 29.767 ( 0.679 2.073 -7.515) 7.825 29.920 ( 0.676 1.286 1.349) 1.982 30.400 ( -2.260 -3.960 -4.868) 6.670 30.531 ( 1.216 1.837 4.826) 5.305 30.653 ( -3.622 -6.242 -5.978) 9.371 30.854 ( -0.953 -1.460 2.040) 2.683 31.104 ( -0.566 -1.025 1.252) 1.714 ======================= Grid point 11 (7/90) ======================= q-point: ( 0.25 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.049 ( 19.286 10.661 -5.301) 22.665 1.446 ( 7.910 25.580 3.067) 26.950 1.876 ( -1.630 -3.492 0.017) 3.854 2.211 ( 8.399 7.712 -2.624) 11.701 2.372 ( -8.322 -3.925 2.249) 9.472 2.402 ( 2.433 0.861 -0.636) 2.658 2.630 ( -4.568 -6.932 4.783) 9.580 2.673 ( -8.579 6.313 -2.597) 10.963 2.985 ( -4.266 0.616 -1.977) 4.742 3.095 ( 0.185 -1.545 0.131) 1.561 3.640 ( 16.887 0.763 -1.336) 16.957 4.102 ( -1.412 -1.529 -1.006) 2.312 4.312 ( 0.794 0.181 -2.218) 2.363 4.530 ( -2.084 0.290 4.201) 4.698 4.815 ( 2.536 1.814 -3.159) 4.438 4.964 ( 0.725 -13.044 -1.330) 13.132 5.337 ( 0.547 9.913 0.127) 9.929 5.589 ( 13.945 20.254 -2.060) 24.677 6.058 ( -0.778 4.995 -1.256) 5.209 6.179 ( 14.877 10.588 -1.898) 18.358 6.696 ( -0.411 1.272 1.635) 2.112 6.936 ( 12.856 1.126 6.832) 14.602 7.350 ( -1.483 1.501 1.424) 2.546 7.574 ( -9.219 -3.004 -0.539) 9.711 7.819 ( -4.889 0.593 4.464) 6.647 8.201 ( 3.063 -0.313 8.144) 8.706 8.388 ( -3.290 3.335 0.511) 4.712 8.565 ( 5.169 -1.116 -2.567) 5.878 8.846 ( -5.258 -6.999 0.274) 8.758 8.990 ( -15.318 -11.344 -1.961) 19.161 9.206 ( 2.279 -2.673 -3.492) 4.953 9.332 ( -13.813 -10.539 -8.144) 19.189 9.806 ( -8.541 -12.466 -4.659) 15.813 10.591 ( -4.596 -7.771 1.623) 9.173 11.011 ( -23.471 2.318 -1.457) 23.630 11.416 ( -5.291 -14.027 3.685) 15.438 11.744 ( 13.345 -20.395 -0.363) 24.375 12.252 ( -3.682 -0.420 2.350) 4.388 12.453 ( 6.052 -19.618 0.245) 20.531 13.342 ( 8.356 8.092 -1.727) 11.759 13.681 ( -21.700 30.231 -1.042) 37.228 14.286 ( 7.506 -4.664 1.262) 8.926 14.799 ( 5.959 5.475 -5.684) 9.890 15.074 ( 9.202 8.045 0.275) 12.226 15.434 ( 5.724 4.524 3.789) 8.221 16.712 ( 10.988 14.326 3.001) 18.303 17.665 ( -8.294 -9.508 1.094) 12.664 18.826 ( -8.346 -10.578 0.412) 13.481 19.335 ( 5.009 7.275 0.022) 8.833 20.780 ( -0.271 -14.467 -1.574) 14.555 21.435 ( -11.531 14.344 0.990) 18.431 21.858 ( 18.369 4.588 -1.326) 18.980 22.372 ( 6.938 9.928 0.444) 12.120 26.857 ( 3.475 3.433 0.005) 4.885 27.407 ( -5.768 -2.011 0.172) 6.111 27.503 ( 1.176 -4.287 0.211) 4.450 27.955 ( -0.945 -0.253 -0.211) 1.001 28.141 ( -4.557 3.818 3.698) 7.001 28.489 ( 9.064 -9.704 -0.076) 13.278 28.768 ( -10.493 4.298 -6.690) 13.166 29.282 ( 1.119 -2.848 1.183) 3.281 29.762 ( 0.652 2.575 5.635) 6.230 29.886 ( 7.859 7.029 3.727) 11.183 29.950 ( 0.729 2.157 -2.134) 3.121 30.308 ( -3.223 -4.900 -9.441) 11.115 30.497 ( -3.732 -6.884 9.092) 11.999 30.602 ( 1.007 2.763 -5.743) 6.452 30.829 ( -0.584 -0.338 -0.541) 0.865 31.064 ( -2.141 -2.482 1.125) 3.465 ======================= Grid point 12 (8/90) ======================= q-point: ( 0.38 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.387 ( 7.969 4.510 -11.820) 14.952 1.677 ( 0.100 11.785 3.586) 12.319 1.889 ( -0.610 8.156 5.510) 9.862 2.099 ( -12.553 -3.738 2.076) 13.261 2.326 ( 5.690 -3.215 4.922) 8.182 2.455 ( -2.877 -5.112 7.453) 9.484 2.507 ( -0.456 3.508 -3.268) 4.816 2.679 ( -3.272 12.750 -6.369) 14.623 2.902 ( -5.603 0.435 -3.706) 6.732 3.094 ( 1.872 -2.795 -0.493) 3.399 3.943 ( 12.216 0.019 -0.579) 12.230 4.092 ( 4.049 0.078 -7.849) 8.832 4.278 ( -3.743 -2.929 0.815) 4.822 4.482 ( -3.759 -0.204 2.597) 4.573 4.881 ( 5.871 -7.125 0.550) 9.249 4.929 ( 8.399 -7.562 -3.424) 11.809 5.422 ( -3.048 11.744 -0.857) 12.163 5.967 ( 8.530 1.062 -6.622) 10.851 6.129 ( 6.113 8.927 0.911) 10.858 6.297 ( -4.665 -0.295 4.702) 6.630 6.749 ( 1.496 2.372 3.184) 4.243 6.979 ( -2.570 -12.121 1.358) 12.465 7.377 ( 1.796 10.731 5.625) 12.248 7.465 ( -5.271 13.045 2.162) 14.235 7.840 ( 3.157 0.093 0.611) 3.217 8.235 ( 2.445 -3.326 8.805) 9.724 8.303 ( -4.584 -3.191 3.202) 6.438 8.618 ( -15.964 -1.574 -4.897) 16.773 8.706 ( 10.505 0.706 -1.859) 10.691 8.763 ( -1.166 -1.137 1.573) 2.265 9.037 ( -11.227 -5.810 -9.853) 16.028 9.230 ( 1.319 -0.757 -3.635) 3.941 9.611 ( -1.831 -9.289 -4.316) 10.405 10.512 ( -0.554 -2.342 1.158) 2.671 10.681 ( -14.262 3.601 0.011) 14.710 11.266 ( -3.436 0.041 0.567) 3.483 11.754 ( 18.560 -31.924 1.442) 36.955 12.200 ( 3.671 -15.113 0.440) 15.559 12.463 ( 7.148 -3.341 1.471) 8.026 13.469 ( -5.972 11.312 -0.117) 12.793 13.633 ( -14.970 28.777 -2.206) 32.512 14.288 ( 0.676 -7.802 -0.373) 7.840 14.980 ( 7.354 6.786 -2.405) 10.291 15.234 ( 3.306 3.702 -0.198) 4.967 15.503 ( 0.795 -2.662 1.019) 2.959 17.040 ( 11.815 12.773 2.751) 17.616 17.392 ( -14.729 -7.277 2.281) 16.586 18.673 ( 1.765 -8.473 0.629) 8.678 19.481 ( -0.687 11.195 -0.087) 11.216 20.632 ( 5.090 -20.975 -1.524) 21.637 21.400 ( -10.532 17.940 0.851) 20.821 22.115 ( 9.447 -2.098 -1.268) 9.760 22.527 ( 1.943 5.489 0.491) 5.843 26.933 ( 1.777 1.443 0.022) 2.289 27.304 ( -3.087 -0.391 0.034) 3.112 27.476 ( 1.360 -4.930 0.039) 5.114 27.950 ( 0.801 -0.435 -1.116) 1.441 28.123 ( -5.121 7.032 2.023) 8.932 28.518 ( -1.887 -0.598 0.860) 2.158 28.713 ( 5.848 -4.161 -1.211) 7.278 29.241 ( -2.918 -1.007 0.671) 3.159 29.791 ( -0.450 3.354 2.690) 4.322 29.953 ( -3.148 3.754 -1.916) 5.260 30.093 ( 9.449 2.279 4.377) 10.660 30.222 ( -0.400 -5.177 -11.696) 12.797 30.365 ( -4.262 -5.355 6.589) 9.501 30.644 ( 0.784 1.274 -2.647) 3.040 30.839 ( 0.789 1.584 -0.452) 1.826 30.998 ( -2.068 -2.519 1.704) 3.678 ======================= Grid point 13 (9/90) ======================= q-point: (-0.50 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.300 ( -13.577 -4.557 -0.431) 14.328 1.765 ( -20.370 5.582 13.492) 25.063 1.835 ( 4.461 3.595 1.677) 5.969 2.030 ( 7.778 2.011 -0.787) 8.072 2.380 ( 3.197 -1.272 0.874) 3.550 2.452 ( -2.328 2.084 1.070) 3.303 2.549 ( 6.504 0.349 0.094) 6.514 2.724 ( -7.972 12.417 -10.028) 17.840 2.871 ( 1.407 4.604 -1.408) 5.015 3.095 ( 1.750 -3.432 -0.951) 3.968 3.967 ( -3.915 -8.417 -11.787) 15.004 4.124 ( -5.037 -6.559 9.207) 12.375 4.224 ( 5.125 1.675 -7.224) 9.014 4.445 ( 0.228 2.248 5.533) 5.977 4.900 ( 4.273 -9.472 1.427) 10.489 4.967 ( 3.958 -7.752 -5.172) 10.125 5.444 ( -6.183 9.034 -4.066) 11.678 5.797 ( -13.093 -7.204 0.488) 14.952 6.254 ( -2.223 -2.883 0.098) 3.642 6.418 ( 1.359 8.129 7.188) 10.936 6.639 ( -3.667 2.345 -3.726) 5.730 6.809 ( -1.549 -11.027 1.763) 11.274 7.405 ( -5.108 1.950 2.835) 6.159 7.658 ( -1.582 18.806 5.978) 19.797 7.853 ( 0.381 -2.567 1.288) 2.897 8.206 ( 1.079 -5.681 6.534) 8.725 8.358 ( 13.831 0.185 3.094) 14.174 8.421 ( -8.294 3.897 -6.215) 11.072 8.775 ( 1.120 -0.157 -0.179) 1.145 8.852 ( -0.355 1.712 -6.602) 6.829 8.980 ( 11.896 5.970 -2.567) 13.555 9.237 ( 1.053 -0.804 -4.028) 4.241 9.573 ( 6.152 -5.155 -1.200) 8.116 10.451 ( 0.308 0.257 2.574) 2.605 10.745 ( 6.328 11.876 0.180) 13.458 11.314 ( 3.339 9.226 -0.987) 9.861 11.768 ( 20.304 -32.252 1.831) 38.155 12.102 ( 5.822 -18.046 -0.411) 18.966 12.534 ( 4.436 -4.631 2.157) 6.766 13.371 ( -19.296 16.783 -1.107) 25.598 13.752 ( -3.995 23.913 -0.434) 24.249 14.203 ( -0.299 -8.448 -1.442) 8.575 15.113 ( -0.387 3.710 -0.787) 3.812 15.276 ( -0.501 3.663 -0.298) 3.709 15.383 ( -7.310 -11.212 -0.405) 13.391 17.050 ( -18.967 -4.398 2.882) 19.682 17.348 ( 13.421 8.055 1.356) 15.711 18.717 ( 9.935 -4.008 0.841) 10.746 19.461 ( -11.282 5.602 -0.066) 12.596 20.612 ( 13.581 -14.908 -1.595) 20.230 21.433 ( -7.254 19.184 0.565) 20.517 22.102 ( -3.927 -10.275 -0.887) 11.036 22.528 ( -5.558 1.100 0.028) 5.666 26.921 ( -2.790 -1.264 0.041) 3.064 27.329 ( 2.846 4.215 -0.176) 5.089 27.471 ( 3.889 -4.797 -0.256) 6.181 27.963 ( 1.302 -0.821 -1.083) 1.882 28.111 ( -4.539 8.895 0.688) 10.010 28.424 ( -4.657 -4.931 1.709) 6.995 28.850 ( 11.065 -0.416 2.441) 11.339 29.182 ( -3.644 0.116 0.727) 3.718 29.804 ( -1.879 2.873 -1.133) 3.615 29.910 ( -3.744 0.463 -0.901) 3.879 30.136 ( -4.714 -2.417 0.005) 5.298 30.245 ( 4.689 -3.468 -6.339) 8.614 30.329 ( 6.360 1.024 4.908) 8.099 30.646 ( -1.267 0.025 -6.745) 6.863 30.845 ( -1.524 0.312 6.496) 6.680 30.995 ( 3.135 0.417 -0.079) 3.163 ======================= Grid point 14 (10/90) ======================= q-point: (-0.38 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.971 ( -18.630 -5.112 8.301) 21.027 1.430 ( -25.655 4.830 14.167) 29.702 1.891 ( 3.319 -1.178 0.012) 3.522 2.197 ( -2.491 -0.641 -5.874) 6.413 2.365 ( -3.955 0.514 -0.189) 3.993 2.426 ( 3.749 0.237 -2.917) 4.756 2.619 ( 1.551 3.603 -2.644) 4.730 2.757 ( 2.343 2.736 -0.604) 3.652 2.971 ( 1.214 7.137 -1.029) 7.312 3.092 ( 1.494 -1.948 -1.963) 3.143 3.656 ( -10.078 -15.989 -5.552) 19.699 4.101 ( 1.657 0.454 5.240) 5.515 4.277 ( 0.376 1.587 -4.330) 4.627 4.529 ( 4.043 3.131 6.630) 8.373 4.801 ( -4.336 -3.019 -0.861) 5.353 4.996 ( 7.653 -7.148 -4.680) 11.470 5.384 ( -7.684 -0.510 -3.232) 8.352 5.526 ( -18.316 4.826 0.439) 18.946 6.001 ( -16.993 0.860 0.097) 17.015 6.278 ( -10.867 -9.747 0.567) 14.609 6.703 ( -2.832 4.484 7.945) 9.552 6.805 ( 2.759 -3.451 -6.080) 7.515 7.390 ( 0.600 -1.134 0.896) 1.564 7.599 ( -3.959 1.845 2.181) 4.883 7.897 ( 2.205 1.851 8.768) 9.228 8.193 ( 1.561 -3.103 4.341) 5.560 8.363 ( -4.261 6.185 -8.858) 11.613 8.547 ( 3.606 -3.240 0.353) 4.860 8.848 ( 9.090 1.173 -0.269) 9.169 9.025 ( 14.955 6.177 -0.662) 16.194 9.160 ( 2.911 -0.999 -6.720) 7.391 9.369 ( 14.871 4.289 -3.268) 15.819 9.748 ( 15.778 4.054 1.102) 16.327 10.568 ( 10.378 2.203 1.981) 10.792 11.014 ( 9.166 17.093 3.772) 19.759 11.486 ( 11.421 -3.148 -2.343) 12.077 11.759 ( 6.602 -18.092 1.160) 19.294 12.182 ( 19.956 -5.504 -0.204) 20.702 12.522 ( 5.782 -13.029 2.283) 14.436 13.188 ( -20.479 15.035 -1.805) 25.470 13.877 ( -10.493 21.485 1.092) 23.935 14.144 ( 2.809 -6.927 -1.242) 7.577 14.989 ( -7.894 -12.908 -4.387) 15.754 15.075 ( -15.384 -8.080 0.364) 17.380 15.314 ( -4.401 7.962 2.408) 9.411 16.704 ( -17.914 -1.923 2.571) 18.199 17.637 ( 13.600 4.130 0.339) 14.217 18.892 ( 13.587 -2.025 0.778) 13.759 19.294 ( -9.882 1.772 -0.034) 10.040 20.749 ( 12.119 -4.453 -1.624) 13.013 21.509 ( -4.885 16.283 0.208) 17.001 21.814 ( -14.451 -15.209 -0.472) 20.985 22.375 ( -11.996 -1.256 -0.400) 12.068 26.847 ( -4.303 -0.697 0.055) 4.359 27.425 ( 2.786 3.741 -0.227) 4.670 27.501 ( 4.231 -4.034 -0.088) 5.846 27.972 ( 0.195 -0.547 0.027) 0.581 28.185 ( 2.939 10.682 -2.316) 11.319 28.310 ( -0.748 -6.791 4.179) 8.009 29.018 ( 10.146 -7.855 0.118) 12.832 29.123 ( -6.036 8.686 2.823) 10.948 29.776 ( -2.948 -0.160 -1.139) 3.164 29.850 ( -4.511 -0.352 -2.768) 5.305 29.994 ( -6.810 -2.720 2.505) 7.749 30.313 ( 5.365 -0.073 -5.635) 7.781 30.479 ( 8.235 1.033 6.166) 10.340 30.609 ( -2.475 0.054 -10.790) 11.070 30.833 ( 0.416 0.079 7.178) 7.191 31.063 ( 3.322 0.724 0.554) 3.445 ======================= Grid point 19 (11/90) ======================= q-point: ( 0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.290 ( 11.136 12.685 -4.193) 17.393 1.798 ( -1.406 7.464 4.881) 9.028 1.881 ( 9.352 8.037 7.303) 14.331 2.119 ( 1.820 -10.142 -0.574) 10.320 2.326 ( -6.640 -1.614 2.634) 7.323 2.490 ( -1.166 1.284 3.237) 3.673 2.515 ( -2.466 -3.675 1.782) 4.771 2.829 ( 2.812 7.051 -5.857) 9.588 3.018 ( -4.062 2.076 -3.779) 5.924 3.063 ( 3.911 -0.975 -5.309) 6.666 3.738 ( 4.861 10.895 -6.579) 13.624 4.067 ( -1.221 -1.669 1.094) 2.340 4.268 ( -0.776 -5.515 -5.000) 7.484 4.530 ( 2.256 -0.571 5.860) 6.305 4.753 ( -5.035 -6.509 -0.442) 8.242 4.863 ( -2.348 1.134 -3.084) 4.039 5.506 ( 3.403 7.195 -4.660) 9.223 5.839 ( 8.864 2.013 -4.319) 10.064 6.163 ( -1.023 7.257 0.101) 7.329 6.427 ( -2.130 9.749 3.346) 10.525 6.694 ( 3.207 2.709 4.990) 6.521 6.804 ( 9.297 -7.223 3.270) 12.219 7.397 ( 1.788 6.260 2.263) 6.892 7.736 ( -2.295 9.219 2.096) 9.729 7.868 ( -3.244 4.425 9.023) 10.560 8.157 ( 1.085 -5.628 9.654) 11.228 8.348 ( -7.482 -9.599 4.478) 12.968 8.535 ( 10.768 1.935 -7.560) 13.298 8.755 ( -1.892 -0.077 -3.187) 3.707 8.833 ( -8.718 -4.294 -2.227) 9.970 9.075 ( -2.725 -10.508 -10.545) 15.134 9.235 ( -1.589 -0.938 -5.593) 5.890 9.533 ( -4.404 -13.269 -3.142) 14.330 10.490 ( 1.665 -1.255 1.716) 2.701 11.011 ( -0.729 -20.138 2.303) 20.283 11.109 ( -15.919 5.183 1.427) 16.802 11.545 ( -5.356 -6.414 -0.779) 8.392 11.918 ( -1.813 -18.948 0.324) 19.037 12.464 ( 0.309 7.525 1.774) 7.738 13.541 ( 7.687 10.887 -0.629) 13.342 14.011 ( -6.937 -3.893 -0.590) 7.977 14.167 ( 9.205 3.410 -1.603) 9.946 15.013 ( -1.890 13.418 -3.501) 13.995 15.245 ( 1.999 8.337 0.601) 8.594 15.409 ( 5.347 -5.567 0.615) 7.743 17.010 ( 8.743 15.467 4.292) 18.278 17.459 ( -3.700 -11.014 2.063) 11.801 18.639 ( -7.906 -8.552 1.299) 11.718 19.546 ( 9.354 14.121 -0.267) 16.941 20.457 ( -9.244 -17.607 -1.529) 19.945 21.679 ( 1.180 8.114 0.359) 8.207 21.934 ( 5.116 4.430 -1.284) 6.888 22.539 ( 3.720 6.597 0.118) 7.574 26.914 ( 2.152 2.343 -0.034) 3.181 27.373 ( -5.847 -1.489 -0.050) 6.034 27.411 ( 1.226 -4.453 0.049) 4.619 27.944 ( -1.101 -0.828 -1.256) 1.864 28.262 ( 0.127 6.303 1.175) 6.413 28.374 ( 9.695 -0.410 2.047) 9.917 28.768 ( -11.430 -5.051 0.425) 12.503 29.222 ( 2.491 -1.908 1.914) 3.675 29.845 ( 1.215 5.522 -4.039) 6.948 29.938 ( 6.441 0.519 4.207) 7.711 30.067 ( -1.382 7.376 3.553) 8.303 30.201 ( -3.671 -5.819 -13.417) 15.078 30.355 ( -2.623 -7.385 6.992) 10.503 30.645 ( 0.712 1.438 -6.922) 7.106 30.844 ( 0.790 1.989 4.313) 4.815 31.002 ( -1.985 -3.792 1.251) 4.459 ======================= Grid point 20 (12/90) ======================= q-point: ( 0.38 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.451 ( -2.879 2.094 -10.828) 11.398 1.835 ( 0.465 6.867 5.414) 8.757 1.960 ( 0.669 -3.949 3.034) 5.025 2.087 ( -9.013 3.252 7.684) 12.282 2.299 ( 3.443 0.469 5.586) 6.579 2.393 ( 4.228 -3.028 5.241) 7.383 2.533 ( -1.063 0.055 2.031) 2.293 2.913 ( -2.267 2.829 -4.257) 5.591 2.979 ( 0.403 3.196 -7.117) 7.812 3.091 ( -6.931 10.370 -8.033) 14.836 3.936 ( 1.578 -0.499 -8.502) 8.661 4.086 ( 7.049 -4.225 -9.806) 12.795 4.118 ( -1.810 -7.499 4.932) 9.156 4.526 ( -4.080 5.084 5.011) 8.222 4.687 ( 5.806 -8.492 0.840) 10.321 4.864 ( 2.599 -2.686 -1.467) 4.015 5.604 ( -3.884 6.818 -6.225) 10.016 5.799 ( 3.079 -8.573 -7.125) 11.565 6.245 ( -3.213 2.070 0.670) 3.881 6.458 ( 2.472 11.786 7.495) 14.184 6.684 ( 1.419 -11.511 6.447) 13.269 6.919 ( -8.386 6.478 2.999) 11.013 7.518 ( -2.047 5.607 2.304) 6.398 7.710 ( 6.222 -3.496 -0.159) 7.139 7.874 ( -5.312 13.154 9.591) 17.124 8.117 ( 2.292 -8.340 10.209) 13.380 8.237 ( 1.126 -2.061 7.587) 7.943 8.646 ( -10.917 3.494 -7.656) 13.784 8.736 ( 4.036 1.638 -4.862) 6.528 8.798 ( 6.507 2.166 -3.782) 7.832 8.922 ( -1.933 -5.044 -8.174) 9.798 9.238 ( -1.313 2.431 -6.192) 6.780 9.400 ( 4.804 -10.157 -4.468) 12.091 10.540 ( -5.504 5.627 1.727) 8.058 10.746 ( 1.756 -0.684 1.057) 2.161 11.171 ( 13.421 -15.648 2.169) 20.730 11.422 ( -6.315 8.786 -0.365) 10.827 11.782 ( 9.687 -21.155 -0.002) 23.267 12.538 ( -1.346 4.038 1.381) 4.474 13.683 ( -4.967 9.677 0.156) 10.879 13.883 ( 1.202 -3.811 -0.433) 4.019 14.247 ( -4.117 5.671 -3.058) 7.646 15.146 ( 0.235 7.916 -1.744) 8.110 15.291 ( 1.192 -0.326 -0.369) 1.290 15.384 ( -1.482 -5.326 -0.163) 5.531 17.237 ( 1.394 4.267 4.066) 6.057 17.293 ( -4.509 -0.447 3.266) 5.586 18.534 ( 3.842 -4.952 1.546) 6.456 19.755 ( -9.558 16.001 -0.548) 18.647 20.224 ( 11.024 -19.529 -1.234) 22.459 21.733 ( -7.697 15.000 -0.119) 16.860 22.001 ( 4.502 -9.001 -1.025) 10.116 22.605 ( -1.257 2.210 0.191) 2.550 26.942 ( -0.331 -0.022 -0.135) 0.358 27.330 ( 0.336 2.317 -0.017) 2.341 27.385 ( 1.085 -3.968 -0.014) 4.114 27.933 ( 0.652 -0.872 -1.762) 2.071 28.296 ( -4.621 9.170 1.190) 10.337 28.485 ( -4.804 -2.096 2.040) 5.625 28.627 ( 8.792 -5.135 2.232) 10.423 29.216 ( -0.443 -0.740 1.682) 1.890 29.899 ( -2.815 7.496 -2.625) 8.427 29.991 ( -5.169 -0.831 0.659) 5.277 30.081 ( 7.895 -4.693 -4.780) 10.354 30.174 ( -0.610 1.966 -1.877) 2.785 30.263 ( 0.914 -4.293 4.589) 6.350 30.658 ( -0.129 0.265 -6.377) 6.384 30.881 ( -1.050 2.268 3.374) 4.198 30.947 ( 1.185 -2.408 1.915) 3.297 ======================= Grid point 73 (13/90) ======================= q-point: ( 0.00 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 88 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.577 ( 0.000 0.000 28.799) 28.799 0.577 ( -0.000 0.000 28.799) 28.799 0.985 ( -0.000 0.000 49.258) 49.258 2.024 ( 0.000 0.000 -3.988) 3.988 2.563 ( 0.000 0.000 -2.432) 2.432 2.563 ( -0.000 0.000 -2.432) 2.432 2.662 ( 0.000 0.000 -0.355) 0.355 2.662 ( -0.000 0.000 -0.355) 0.355 2.915 ( 0.000 0.000 1.113) 1.113 3.082 ( 0.000 0.000 -3.131) 3.131 3.082 ( 0.000 0.000 -3.131) 3.131 4.198 ( 0.000 0.000 -2.158) 2.158 4.198 ( 0.000 0.000 -2.158) 2.158 4.728 ( -0.000 0.000 -3.594) 3.594 5.028 ( 0.000 0.000 -6.104) 6.104 5.155 ( -0.000 0.000 -0.927) 0.927 5.155 ( 0.000 0.000 -0.927) 0.927 5.544 ( 0.000 0.000 -8.948) 8.948 5.881 ( 0.000 -0.000 0.594) 0.594 5.881 ( 0.000 0.000 0.594) 0.594 6.097 ( 0.000 0.000 -13.993) 13.993 6.651 ( 0.000 0.000 1.318) 1.318 7.151 ( 0.000 0.000 14.242) 14.242 7.916 ( 0.000 0.000 -8.450) 8.450 7.916 ( 0.000 0.000 -8.450) 8.450 8.179 ( 0.000 -0.000 5.746) 5.746 8.179 ( -0.000 0.000 5.746) 5.746 8.824 ( 0.000 0.000 0.412) 0.412 9.191 ( 0.000 0.000 1.237) 1.237 9.191 ( 0.000 0.000 1.237) 1.237 9.605 ( 0.000 -0.000 2.508) 2.508 10.192 ( 0.000 -0.000 1.081) 1.081 10.192 ( 0.000 0.000 1.081) 1.081 10.842 ( 0.000 0.000 2.571) 2.571 10.842 ( 0.000 0.000 2.571) 2.571 11.737 ( 0.000 0.000 -5.629) 5.629 12.261 ( 0.000 0.000 -0.733) 0.733 12.261 ( -0.000 0.000 -0.733) 0.733 12.607 ( 0.000 0.000 -2.129) 2.129 13.465 ( 0.000 0.000 -0.235) 0.235 13.465 ( -0.000 0.000 -0.235) 0.235 13.759 ( 0.000 0.000 0.177) 0.177 13.759 ( -0.000 0.000 0.177) 0.177 14.488 ( 0.000 0.000 1.596) 1.596 14.839 ( 0.000 0.000 3.034) 3.034 16.388 ( 0.000 -0.000 3.448) 3.448 17.926 ( 0.000 0.000 -0.643) 0.643 19.383 ( 0.000 0.000 -0.952) 0.952 19.383 ( 0.000 -0.000 -0.952) 0.952 20.881 ( 0.000 0.000 -0.569) 0.569 20.881 ( 0.000 -0.000 -0.569) 0.569 21.585 ( 0.000 0.000 -1.318) 1.318 22.373 ( 0.000 0.000 -0.506) 0.506 26.710 ( 0.000 0.000 0.002) 0.002 26.710 ( -0.000 0.000 0.002) 0.002 27.496 ( 0.000 0.000 -0.084) 0.084 27.496 ( 0.000 -0.000 -0.084) 0.084 27.923 ( 0.000 0.000 -0.087) 0.087 28.737 ( 0.000 0.000 0.291) 0.291 28.737 ( 0.000 -0.000 0.291) 0.291 29.267 ( 0.000 0.000 0.481) 0.481 29.267 ( 0.000 -0.000 0.481) 0.481 29.913 ( 0.000 0.000 0.710) 0.710 29.913 ( 0.000 0.000 0.710) 0.710 30.096 ( 0.000 0.000 -0.676) 0.676 30.476 ( 0.000 -0.000 -0.473) 0.473 30.476 ( 0.000 0.000 -0.473) 0.473 30.820 ( 0.000 0.000 0.732) 0.732 32.974 ( 0.000 0.000 -0.577) 0.577 ======================= Grid point 74 (14/90) ======================= q-point: ( 0.12 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.427 ( -7.888 22.619 18.329) 30.163 0.860 ( 8.877 2.719 29.574) 30.997 1.467 ( 38.092 16.121 28.283) 50.108 1.987 ( -2.520 -1.967 -2.847) 4.280 2.521 ( -5.650 -2.091 -0.743) 6.070 2.604 ( 1.209 -5.497 -2.995) 6.376 2.634 ( 1.502 -4.319 -3.869) 5.990 2.865 ( 1.802 5.838 -5.185) 8.013 2.920 ( 5.535 3.679 -2.855) 7.234 3.091 ( 4.167 4.752 -11.800) 13.386 3.124 ( 1.705 0.770 -0.520) 1.942 4.189 ( -0.755 -0.427 -1.987) 2.168 4.283 ( 5.985 2.593 -2.254) 6.901 4.770 ( 1.560 -0.450 -3.346) 3.719 4.825 ( -22.878 -10.881 13.464) 28.689 5.025 ( -5.023 -0.924 -3.180) 6.016 5.178 ( -0.395 0.494 2.000) 2.098 5.234 ( 6.576 2.081 3.311) 7.651 5.788 ( -2.323 -3.275 -1.874) 4.431 5.974 ( 7.241 0.691 1.859) 7.507 6.250 ( 6.667 8.298 -10.911) 15.243 6.740 ( 9.866 5.457 0.438) 11.283 7.147 ( 0.178 1.096 10.061) 10.122 7.869 ( -5.298 2.661 -6.653) 8.911 8.056 ( -7.498 -3.718 4.507) 9.506 8.157 ( 11.924 1.767 -10.027) 15.679 8.251 ( 3.522 1.024 3.077) 4.787 8.645 ( -5.427 -4.730 7.159) 10.153 9.104 ( -8.106 -1.381 -0.325) 8.229 9.219 ( 2.184 -3.519 2.714) 4.952 9.512 ( -7.189 -3.915 2.372) 8.523 9.980 ( -15.790 -11.784 -0.161) 19.703 10.227 ( -9.342 -6.594 -4.429) 12.263 10.836 ( -1.577 0.276 2.298) 2.801 11.142 ( -1.604 2.318 -15.048) 15.310 11.712 ( -3.006 -1.921 -4.558) 5.788 12.130 ( -7.902 2.684 -5.538) 10.015 12.365 ( 12.069 -4.234 -0.935) 12.824 12.614 ( -2.030 -0.427 -0.811) 2.227 13.204 ( -24.299 11.664 -3.292) 27.154 13.354 ( 9.494 -17.006 -1.503) 19.534 14.033 ( 12.487 11.835 0.207) 17.206 14.313 ( 28.837 5.795 -14.829) 32.940 14.627 ( 13.798 6.874 0.218) 15.418 14.934 ( 6.128 13.112 0.587) 14.485 16.388 ( 0.950 0.809 2.595) 2.879 17.907 ( -2.273 -1.242 -0.773) 2.703 19.259 ( -8.577 -7.942 -1.618) 11.800 19.292 ( -7.346 -1.405 -1.304) 7.592 20.922 ( 1.933 1.356 0.390) 2.393 21.092 ( 16.766 7.392 -0.306) 18.326 21.571 ( -0.861 0.171 -1.217) 1.500 22.216 ( -2.302 -1.705 12.000) 12.337 26.732 ( 1.979 1.259 0.015) 2.346 27.485 ( 0.255 2.287 -2.325) 3.271 27.500 ( 5.238 -0.936 -3.556) 6.400 27.631 ( 37.117 27.076 -38.212) 59.758 27.934 ( 0.984 0.513 -0.083) 1.113 28.590 ( -10.190 -10.174 2.374) 14.594 28.698 ( -1.040 -3.811 0.028) 3.951 29.274 ( -1.905 3.163 0.504) 3.726 29.372 ( 8.626 7.224 -4.144) 11.990 29.859 ( -2.093 -2.238 -1.853) 3.581 29.936 ( 1.558 1.154 6.054) 6.356 30.162 ( 2.895 0.631 -8.711) 9.201 30.459 ( 2.295 -3.431 -1.560) 4.413 30.545 ( 2.475 5.967 0.024) 6.460 30.817 ( -0.250 -0.489 0.695) 0.886 32.305 ( -38.684 -22.205 35.479) 56.994 ======================= Grid point 75 (15/90) ======================= q-point: ( 0.25 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.670 ( 5.821 24.615 0.233) 25.295 1.075 ( 10.355 8.448 14.993) 20.085 1.914 ( -2.820 -2.817 -3.513) 5.313 2.158 ( 24.776 8.678 14.599) 30.038 2.392 ( -6.531 -1.963 -2.847) 7.390 2.540 ( -2.985 -3.208 1.793) 4.735 2.597 ( 1.770 -7.810 -0.989) 8.069 2.834 ( -5.314 1.287 0.880) 5.538 2.949 ( -1.111 -2.374 0.689) 2.710 3.138 ( 0.296 -1.150 1.376) 1.817 3.395 ( 18.788 10.183 -13.135) 25.084 4.173 ( -1.830 3.135 0.533) 3.669 4.326 ( -0.936 -6.169 1.981) 6.547 4.548 ( -6.101 3.964 3.669) 8.149 4.755 ( 0.306 -2.198 -2.698) 3.493 5.129 ( 11.032 5.275 -4.422) 13.003 5.217 ( 3.052 0.746 0.685) 3.216 5.350 ( 6.150 -2.536 5.388) 8.560 5.854 ( 7.122 10.413 0.686) 12.635 6.105 ( 10.348 -4.278 -0.877) 11.232 6.483 ( 8.240 14.049 -6.594) 17.572 6.987 ( 10.269 6.371 3.643) 12.622 7.198 ( 3.763 3.585 -2.288) 5.678 7.732 ( -12.487 -7.624 -1.049) 14.668 7.860 ( -10.552 0.915 0.562) 10.607 8.253 ( -3.464 6.026 -0.966) 7.017 8.353 ( 8.477 -4.516 -2.832) 10.014 8.577 ( 0.054 -0.622 4.008) 4.056 8.923 ( -9.359 -3.346 -3.012) 10.386 9.164 ( -5.617 -8.954 1.543) 10.682 9.331 ( -6.187 -3.806 4.617) 8.607 9.514 ( -19.576 -20.225 -3.296) 28.339 9.894 ( -16.516 -7.834 -4.290) 18.777 10.739 ( -9.695 -1.471 2.291) 10.070 10.969 ( -9.296 -5.959 -3.515) 11.588 11.603 ( -7.179 -6.155 -1.694) 9.607 11.966 ( -8.946 2.493 -2.258) 9.558 12.477 ( 10.164 -12.590 -1.826) 16.283 12.647 ( 3.789 0.372 -0.835) 3.897 12.974 ( -21.954 24.691 -2.948) 33.171 13.412 ( 13.364 -16.586 -1.349) 21.343 14.257 ( 3.183 8.126 1.007) 8.785 14.677 ( 18.624 -2.828 -6.838) 20.040 14.963 ( 16.561 3.461 -0.433) 16.924 15.233 ( 5.928 19.382 -2.036) 20.370 16.489 ( 7.959 6.875 -0.778) 10.546 17.789 ( -9.627 -4.053 -1.347) 10.532 19.014 ( -8.208 -10.870 -1.533) 13.707 19.215 ( -2.210 4.426 -2.599) 5.588 20.935 ( -0.981 -0.216 1.518) 1.820 21.313 ( 1.355 -3.620 -0.300) 3.877 21.707 ( 14.885 10.251 -0.110) 18.073 22.309 ( 8.339 4.448 7.787) 12.246 26.797 ( 3.505 2.455 0.068) 4.280 27.450 ( -3.020 -1.631 0.103) 3.434 27.540 ( 1.570 -0.072 -0.655) 1.702 27.952 ( 0.336 0.387 -0.318) 0.603 28.196 ( 6.432 10.845 -15.164) 19.721 28.329 ( -9.041 -1.106 -1.736) 9.273 28.682 ( 8.746 -11.402 -3.498) 14.789 29.256 ( -4.992 5.082 0.336) 7.132 29.603 ( 8.705 6.646 -9.193) 14.299 29.805 ( -2.734 -0.203 -5.982) 6.580 30.000 ( 4.213 1.034 6.683) 7.968 30.162 ( -0.061 -3.305 -9.152) 9.730 30.482 ( 3.367 -2.361 -0.761) 4.182 30.654 ( 2.696 6.793 -1.186) 7.404 30.797 ( -0.779 -1.923 1.918) 2.825 31.623 ( -23.523 -13.189 30.858) 40.981 ======================= Grid point 76 (16/90) ======================= q-point: ( 0.38 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.016 ( 11.457 15.387 -5.940) 20.082 1.348 ( 10.453 12.031 2.088) 16.074 1.866 ( -0.374 -0.322 -0.976) 1.093 2.210 ( -8.411 -3.076 0.416) 8.965 2.421 ( -1.094 0.060 0.862) 1.394 2.472 ( -2.478 -0.775 3.448) 4.316 2.584 ( 3.242 -5.622 1.133) 6.588 2.745 ( -2.861 -1.515 5.533) 6.410 2.898 ( -0.347 -4.309 4.760) 6.430 3.127 ( 0.232 -1.227 0.390) 1.308 3.785 ( 16.172 3.257 -9.433) 19.003 4.148 ( -3.185 -6.949 3.976) 8.617 4.300 ( 2.814 6.451 1.312) 7.159 4.502 ( -3.224 4.052 2.988) 5.978 4.865 ( 9.731 2.392 -0.891) 10.060 5.216 ( 2.746 -11.395 2.107) 11.909 5.266 ( 1.604 1.721 2.636) 3.533 5.604 ( 16.296 17.052 -2.446) 23.713 6.099 ( 10.159 0.971 0.402) 10.214 6.229 ( 5.172 3.438 -3.339) 7.051 6.750 ( 5.632 12.154 2.262) 13.585 7.132 ( -8.024 10.012 7.007) 14.620 7.280 ( -2.882 -13.910 -9.580) 17.134 7.364 ( -3.555 -0.158 -2.681) 4.455 7.776 ( -1.433 2.411 -2.222) 3.579 8.226 ( -5.817 5.966 -3.476) 9.029 8.381 ( 1.735 -4.559 -0.569) 4.911 8.585 ( -5.425 -0.009 -2.321) 5.901 8.767 ( -11.370 -2.065 -2.001) 11.728 8.867 ( -2.446 -12.060 0.323) 12.310 9.042 ( -13.465 -14.375 -7.366) 21.029 9.287 ( 1.186 -3.193 5.419) 6.401 9.668 ( -3.965 -2.553 -1.327) 4.899 10.548 ( -10.261 1.396 2.020) 10.551 10.766 ( -6.171 -9.717 1.772) 11.646 11.353 ( -9.532 -7.694 0.041) 12.250 12.008 ( 4.268 6.338 -0.236) 7.645 12.479 ( -0.201 -3.216 -2.572) 4.123 12.637 ( -2.206 -1.617 -1.428) 3.086 12.978 ( -3.207 13.802 -0.023) 14.170 13.446 ( 6.964 -10.988 -0.348) 13.014 14.328 ( -1.421 4.864 0.591) 5.101 14.914 ( 13.436 -4.610 -2.865) 14.491 15.185 ( 7.751 0.541 -0.305) 7.776 15.445 ( 2.064 11.141 -0.000) 11.331 16.773 ( 13.810 11.931 -3.284) 18.543 17.514 ( -16.931 -5.765 -2.387) 18.045 18.819 ( -4.029 -7.315 -1.029) 8.414 19.285 ( 2.934 5.626 -4.038) 7.521 20.905 ( -1.343 -0.920 1.515) 2.224 21.212 ( -4.725 -4.825 -0.221) 6.757 22.066 ( 13.671 7.391 1.087) 15.579 22.485 ( 6.231 3.723 4.910) 8.763 26.887 ( 3.648 2.992 0.170) 4.721 27.358 ( -4.359 -3.560 0.495) 5.650 27.542 ( -0.555 -1.036 -0.313) 1.216 27.950 ( 0.435 -0.919 0.247) 1.046 28.126 ( -5.021 -1.795 3.947) 6.634 28.401 ( -0.143 10.920 -5.182) 12.087 28.750 ( 9.268 -7.709 -4.262) 12.786 29.215 ( -4.700 3.955 0.189) 6.145 29.688 ( -1.793 -2.222 -7.244) 7.787 29.834 ( 3.803 5.510 -9.891) 11.944 30.035 ( -0.342 -2.619 -6.254) 6.789 30.172 ( 4.719 -0.802 2.175) 5.257 30.511 ( 2.196 -1.736 3.403) 4.407 30.691 ( -5.044 1.029 -2.873) 5.895 30.827 ( 6.670 2.838 7.273) 10.268 31.221 ( -14.080 -7.483 15.419) 22.181 ======================= Grid point 77 (17/90) ======================= q-point: (-0.50 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.295 ( 11.205 0.141 -5.776) 12.607 1.644 ( 9.930 12.614 -3.058) 16.342 1.877 ( -5.429 5.903 7.144) 10.740 2.056 ( -3.258 -1.567 4.505) 5.777 2.359 ( -7.080 1.146 -5.838) 9.248 2.398 ( -2.628 0.946 -1.703) 3.272 2.548 ( 1.044 -4.798 3.605) 6.092 2.684 ( -1.323 -7.777 9.299) 12.194 2.904 ( 3.360 -0.468 4.934) 5.988 3.122 ( 0.366 -1.343 -0.586) 1.511 3.958 ( -0.787 -2.718 -5.332) 6.037 4.021 ( 2.745 -5.010 -7.215) 9.203 4.351 ( -1.485 -1.110 4.535) 4.899 4.582 ( 4.712 5.015 11.478) 13.383 4.993 ( 1.392 -0.089 -0.355) 1.439 5.125 ( 0.683 -10.697 -0.538) 10.733 5.282 ( -3.412 3.160 3.301) 5.703 5.996 ( 1.251 -7.642 -4.858) 9.142 6.164 ( 10.603 12.789 1.841) 16.715 6.306 ( -7.695 5.675 -0.610) 9.581 6.705 ( -3.479 -8.603 3.781) 10.021 6.961 ( -5.004 -4.033 -3.624) 7.378 7.218 ( -0.710 12.800 -2.664) 13.093 7.479 ( -1.439 1.576 1.170) 2.434 7.798 ( 0.047 0.163 -9.497) 9.498 8.215 ( -2.216 6.372 -5.319) 8.591 8.277 ( -11.197 -1.480 -3.882) 11.943 8.460 ( 8.507 -1.904 2.959) 9.206 8.649 ( -1.325 2.296 -7.368) 7.830 8.794 ( -6.184 -5.043 -4.070) 8.958 8.965 ( 13.966 -2.338 1.340) 14.224 9.268 ( 0.829 -4.758 2.880) 5.623 9.667 ( 4.731 -1.489 2.141) 5.402 10.524 ( 3.031 9.248 0.626) 9.752 10.605 ( -2.310 -6.507 5.882) 9.070 11.223 ( -0.938 -1.076 -0.100) 1.431 12.099 ( 0.800 -0.126 0.923) 1.228 12.430 ( -5.802 4.334 -5.101) 8.858 12.619 ( 0.117 3.100 0.159) 3.106 13.035 ( 3.816 -4.967 1.150) 6.368 13.453 ( 0.937 -0.166 0.197) 0.972 14.318 ( -0.940 -2.024 -0.747) 2.354 15.031 ( 3.521 0.727 0.748) 3.672 15.253 ( 0.499 -0.757 -0.152) 0.919 15.493 ( -2.832 -1.071 -1.775) 3.510 17.128 ( 6.493 5.593 -3.873) 9.405 17.153 ( -10.063 -1.487 -3.421) 10.732 18.752 ( -0.200 0.820 -0.679) 1.083 19.351 ( 0.178 -0.009 -4.533) 4.537 20.886 ( 2.314 -4.322 1.298) 5.071 21.136 ( -2.250 3.332 -0.073) 4.021 22.231 ( 1.382 -0.967 2.025) 2.636 22.550 ( -1.001 0.051 3.481) 3.623 26.943 ( 0.001 0.146 0.263) 0.301 27.285 ( -0.299 -0.370 0.516) 0.702 27.524 ( -0.120 -0.388 -0.218) 0.461 27.963 ( 1.843 -0.623 0.655) 2.053 28.054 ( -3.447 0.312 2.125) 4.062 28.472 ( 1.232 1.768 -0.341) 2.182 28.829 ( 2.890 3.269 -1.181) 4.521 29.194 ( 0.023 0.338 0.306) 0.456 29.604 ( -5.078 -1.625 -12.061) 13.187 29.921 ( 1.366 -1.454 -2.022) 2.841 30.001 ( 1.025 -1.129 -12.404) 12.497 30.241 ( 2.814 -0.011 1.149) 3.039 30.500 ( -3.078 -0.953 9.809) 10.325 30.621 ( -0.127 -1.094 -1.291) 1.696 30.985 ( -8.394 -3.779 3.475) 9.840 31.010 ( 9.656 5.946 10.151) 15.220 ======================= Grid point 79 (18/90) ======================= q-point: (-0.38 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.341 ( -0.075 -10.342 0.969) 10.388 1.685 ( -19.280 3.004 17.500) 26.210 1.847 ( 1.950 6.340 -1.663) 6.838 2.166 ( 11.045 0.524 0.143) 11.059 2.282 ( -4.061 2.678 -6.110) 7.810 2.440 ( 2.321 3.888 -0.877) 4.612 2.507 ( -0.314 -5.397 5.712) 7.865 2.612 ( 1.749 -0.646 3.223) 3.723 2.955 ( 2.339 0.355 1.491) 2.797 3.106 ( -0.408 -1.905 -0.808) 2.110 3.724 ( -13.765 -12.407 -7.691) 20.064 4.120 ( 4.664 2.166 -7.246) 8.886 4.310 ( 0.182 -0.899 5.493) 5.569 4.648 ( 1.252 -1.584 11.390) 11.568 4.899 ( -8.064 -3.173 0.799) 8.702 5.075 ( 2.325 -3.924 -2.423) 5.165 5.242 ( -2.999 2.136 0.356) 3.699 5.682 ( -15.815 -14.744 -0.261) 21.623 6.057 ( -11.821 -4.257 0.629) 12.580 6.492 ( -8.515 0.665 6.889) 10.973 6.637 ( 6.519 -0.432 -3.483) 7.403 6.805 ( -5.395 -8.351 -8.387) 13.007 7.366 ( -2.862 -0.173 -2.893) 4.073 7.471 ( 5.483 17.379 0.990) 18.250 7.782 ( -0.784 5.995 -6.394) 8.799 8.137 ( -6.313 2.258 -3.485) 7.557 8.256 ( 1.545 -0.477 -5.210) 5.455 8.622 ( 1.374 -2.082 1.184) 2.761 8.743 ( 5.490 2.298 -5.304) 7.972 8.839 ( 17.867 11.082 1.251) 21.062 9.218 ( 9.737 -4.514 3.983) 11.448 9.255 ( 11.068 1.070 -1.885) 11.278 9.789 ( 11.045 0.028 3.851) 11.697 10.594 ( 4.692 1.118 5.071) 6.999 10.789 ( 12.114 13.184 1.422) 17.961 11.304 ( 7.715 6.442 -1.954) 10.239 12.022 ( -4.001 -7.048 -0.018) 8.104 12.396 ( -7.650 12.092 -5.183) 15.218 12.673 ( -0.443 5.864 -0.207) 5.885 13.012 ( 10.654 -22.748 1.125) 25.144 13.473 ( -5.520 11.128 0.317) 12.426 14.269 ( 0.164 -6.561 -1.694) 6.779 15.040 ( -7.206 4.898 2.983) 9.209 15.189 ( -6.761 -0.022 -0.294) 6.767 15.322 ( -8.018 -15.325 -5.966) 18.296 16.767 ( -17.345 -6.871 -3.444) 18.971 17.490 ( 15.295 8.277 -3.264) 17.695 18.827 ( 3.560 8.742 -0.810) 9.473 19.289 ( -2.887 -5.556 -3.457) 7.152 20.901 ( 5.163 -5.835 1.360) 7.909 21.200 ( 1.309 9.404 -0.723) 9.522 22.089 ( -11.667 -9.188 2.321) 15.031 22.459 ( -7.236 -3.721 3.699) 8.938 26.889 ( -3.700 -2.866 0.232) 4.686 27.345 ( 4.149 3.322 0.044) 5.315 27.535 ( 0.596 0.872 -0.557) 1.194 27.980 ( -0.359 0.507 1.302) 1.442 28.018 ( -0.846 0.281 -1.163) 1.465 28.492 ( 3.954 -4.323 0.959) 5.936 28.900 ( -3.654 10.980 -0.545) 11.585 29.217 ( 5.595 -6.260 0.331) 8.402 29.492 ( -8.023 0.712 -16.487) 18.349 29.858 ( -2.913 -4.314 -3.153) 6.086 30.028 ( 0.472 -0.195 -3.603) 3.639 30.266 ( 2.085 -2.178 -2.558) 3.954 30.430 ( -3.299 0.283 2.681) 4.260 30.653 ( 2.667 -0.353 4.572) 5.305 30.853 ( -4.672 -1.390 -2.627) 5.537 31.267 ( 13.481 8.359 18.382) 24.279 ======================= Grid point 80 (19/90) ======================= q-point: (-0.25 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.124 ( -13.742 -8.908 9.207) 18.788 1.351 ( -24.116 4.612 23.842) 34.224 1.853 ( -6.495 -11.914 -1.549) 13.658 2.008 ( -12.144 -11.338 9.146) 18.965 2.338 ( 5.195 3.685 -4.819) 7.987 2.503 ( 8.386 -2.949 1.586) 9.030 2.606 ( 5.397 4.026 -3.398) 7.542 2.725 ( 5.331 7.868 1.684) 9.652 2.984 ( 0.652 -0.429 -1.757) 1.922 3.073 ( -1.497 -1.437 -2.063) 2.926 3.364 ( -13.409 -8.330 -13.138) 20.538 4.186 ( 1.738 0.800 -3.499) 3.988 4.365 ( 5.520 -1.716 5.477) 7.963 4.631 ( -5.567 7.530 6.531) 11.417 4.777 ( 0.458 -4.195 -0.796) 4.294 5.103 ( 4.202 -3.916 -0.627) 5.778 5.215 ( -6.141 1.864 -1.689) 6.636 5.295 ( -11.087 -9.059 0.695) 14.334 5.859 ( -4.401 -8.209 1.586) 9.449 6.162 ( -15.404 -7.399 1.062) 17.121 6.587 ( -12.043 -5.315 -9.293) 16.113 6.764 ( 0.830 2.452 3.727) 4.538 7.243 ( -8.463 -2.056 -2.305) 9.009 7.696 ( 9.912 3.241 -4.068) 11.194 7.972 ( 4.887 13.324 -0.828) 14.216 8.077 ( -2.757 1.687 0.714) 3.310 8.265 ( 1.442 -3.224 -3.661) 5.087 8.597 ( 0.179 -0.957 1.729) 1.984 8.934 ( 8.572 8.054 -2.371) 11.999 9.198 ( 6.635 -1.148 3.241) 7.473 9.252 ( 11.719 4.053 0.699) 12.420 9.631 ( 21.270 6.921 1.355) 22.409 10.028 ( 15.138 2.555 1.480) 15.423 10.746 ( 7.242 5.125 2.720) 9.280 11.112 ( 12.256 11.271 0.780) 16.669 11.528 ( 7.377 6.101 -5.410) 10.996 11.947 ( 3.699 -2.417 -2.718) 5.188 12.387 ( -11.040 17.906 -4.822) 21.581 12.665 ( -2.429 -2.913 -0.067) 3.794 13.028 ( 22.025 -27.101 -0.721) 34.929 13.458 ( -14.072 18.628 -1.228) 23.378 14.194 ( -2.628 -5.787 -1.255) 6.478 14.849 ( -16.609 -6.295 -2.127) 17.889 14.934 ( -10.945 -21.322 -3.554) 24.229 15.068 ( -14.110 4.205 -4.348) 15.352 16.484 ( -9.309 -3.693 -0.661) 10.036 17.772 ( 9.879 5.063 -2.035) 11.286 19.024 ( 7.510 11.758 -1.332) 14.015 19.219 ( 2.119 -4.469 -1.943) 5.314 20.931 ( 3.254 -3.756 1.222) 5.117 21.289 ( -2.141 4.505 -1.102) 5.108 21.739 ( -14.597 -10.871 1.404) 18.254 22.278 ( -7.797 -4.550 6.712) 11.249 26.798 ( -3.593 -2.389 0.115) 4.317 27.438 ( 3.383 1.614 -0.437) 3.774 27.537 ( -1.253 0.270 -0.690) 1.456 27.965 ( -1.843 0.318 0.143) 1.876 28.001 ( -5.102 1.818 -10.901) 12.172 28.555 ( 10.091 -6.878 0.841) 12.241 28.858 ( -10.332 2.124 -9.614) 14.272 29.249 ( 6.659 -7.968 0.722) 10.409 29.361 ( -11.542 7.849 -11.087) 17.825 29.796 ( 0.083 -2.020 -0.094) 2.024 30.005 ( -1.978 -0.803 1.797) 2.791 30.264 ( -0.512 -2.577 -7.562) 8.005 30.412 ( 1.662 -1.246 -1.619) 2.634 30.647 ( -3.873 -0.033 1.547) 4.170 30.808 ( 0.054 -0.388 -1.393) 1.447 31.652 ( 22.015 13.128 31.087) 40.291 ======================= Grid point 81 (20/90) ======================= q-point: (-0.12 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.736 ( -27.783 2.182 12.237) 30.437 0.990 ( -20.313 -5.295 27.587) 34.666 1.273 ( -19.531 -26.356 30.752) 44.964 1.984 ( 2.526 1.065 -1.511) 3.130 2.462 ( 6.426 1.650 -3.282) 7.402 2.600 ( 5.449 -1.274 -1.890) 5.907 2.682 ( 1.584 -1.380 -2.837) 3.530 2.865 ( 4.003 3.410 1.779) 5.551 2.879 ( -13.407 -4.212 -11.252) 18.003 3.058 ( 0.018 1.055 -3.769) 3.914 3.159 ( -5.848 -2.787 -8.554) 10.730 4.201 ( 0.312 -0.623 -2.677) 2.766 4.299 ( -7.465 -4.766 -1.682) 9.015 4.768 ( -1.253 -2.028 -3.883) 4.556 4.844 ( 19.979 14.589 14.858) 28.858 5.066 ( -0.906 4.447 -1.779) 4.875 5.140 ( 3.759 -1.955 2.975) 5.177 5.217 ( -2.724 -1.569 -0.053) 3.144 5.805 ( 5.295 -2.826 -1.402) 6.164 5.930 ( -6.836 -2.074 -0.015) 7.144 6.320 ( -13.688 -5.387 -9.017) 17.253 6.702 ( -5.224 -3.089 1.361) 6.220 7.149 ( -1.493 0.095 9.253) 9.373 7.856 ( 1.601 8.543 -8.979) 12.497 8.029 ( 2.531 -7.445 -4.473) 9.047 8.124 ( 0.871 3.892 6.482) 7.610 8.238 ( -1.375 -2.617 -1.365) 3.256 8.643 ( 5.925 2.097 5.259) 8.195 9.119 ( 4.132 6.804 0.188) 7.963 9.211 ( 2.382 -4.350 2.664) 5.630 9.500 ( 8.291 4.759 1.381) 9.659 10.023 ( 15.417 7.181 1.545) 17.077 10.263 ( 7.391 1.425 -2.797) 8.030 10.847 ( 0.833 1.066 2.650) 2.976 11.255 ( -10.717 -1.902 -17.056) 20.233 11.695 ( 5.888 3.467 -5.238) 8.610 12.037 ( 8.973 3.744 -4.676) 10.789 12.340 ( -8.120 2.682 -1.166) 8.631 12.639 ( 2.798 -2.016 -0.473) 3.481 13.218 ( 23.906 -14.243 -1.534) 27.869 13.387 ( -15.109 22.453 -3.825) 27.333 14.025 ( -11.588 -7.774 -0.003) 13.954 14.319 ( -25.000 -25.526 -16.652) 39.419 14.619 ( -11.621 -7.172 0.776) 13.678 14.890 ( -9.193 3.858 2.150) 10.199 16.388 ( -1.107 -0.398 2.637) 2.887 17.903 ( 2.711 1.506 -0.877) 3.222 19.263 ( 8.313 7.690 -1.547) 11.430 19.293 ( 7.264 1.291 -1.172) 7.471 20.917 ( -1.621 -1.942 -0.023) 2.530 21.090 ( -14.611 -9.112 -0.028) 17.220 21.577 ( -0.492 0.043 -0.985) 1.102 22.203 ( 3.666 1.776 11.934) 12.611 26.733 ( -2.064 -1.184 0.031) 2.380 27.471 ( -2.367 -4.061 -5.871) 7.521 27.506 ( -3.037 0.711 -1.501) 3.461 27.621 ( -36.642 -17.155 -34.239) 53.002 27.936 ( -1.127 -0.643 -0.022) 1.298 28.661 ( 9.077 -6.301 -1.716) 11.182 28.724 ( -2.451 2.735 -1.693) 4.044 29.277 ( 0.796 -1.762 0.639) 2.036 29.284 ( -4.973 5.779 -0.698) 7.656 29.828 ( 4.005 1.086 1.981) 4.598 29.961 ( -2.240 -0.892 2.316) 3.343 30.188 ( -4.838 -3.651 -8.689) 10.594 30.442 ( 3.222 -2.066 -1.739) 4.205 30.551 ( -6.275 -0.021 0.059) 6.275 30.816 ( 0.530 -0.021 0.558) 0.770 32.311 ( 37.860 21.991 35.314) 56.249 ======================= Grid point 83 (21/90) ======================= q-point: ( 0.12 0.12 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.005 ( -1.795 12.919 26.049) 29.132 1.148 ( -4.214 35.620 4.963) 36.210 1.808 ( 25.863 15.612 12.218) 32.587 1.932 ( -1.215 0.771 1.658) 2.196 2.437 ( 4.028 -4.694 -1.603) 6.390 2.459 ( -5.321 -6.169 -3.684) 8.941 2.646 ( -3.243 -0.195 -2.924) 4.371 2.850 ( 0.925 -4.194 4.232) 6.030 2.983 ( -0.077 1.621 -2.974) 3.388 3.069 ( 3.311 -3.058 -3.872) 5.942 3.262 ( 4.019 7.876 -10.930) 14.059 4.211 ( 1.850 1.156 -2.218) 3.111 4.299 ( -4.472 -2.790 2.258) 5.734 4.675 ( -4.091 2.116 8.508) 9.675 4.757 ( -1.855 -4.563 -3.160) 5.852 5.040 ( -2.905 -4.145 -2.889) 5.828 5.184 ( 6.609 8.977 -0.285) 11.151 5.299 ( 3.985 4.782 1.396) 6.379 5.838 ( 9.462 7.167 1.000) 11.912 6.005 ( -1.998 7.843 -0.511) 8.110 6.511 ( 4.664 13.682 -7.162) 16.132 6.850 ( 9.409 3.755 1.892) 10.306 7.212 ( 2.333 6.619 1.691) 7.219 7.774 ( -4.572 -12.593 -0.823) 13.423 8.039 ( -6.241 1.170 -0.406) 6.363 8.121 ( 9.147 -0.073 -6.355) 11.139 8.292 ( 3.892 0.836 3.194) 5.103 8.581 ( -1.345 -1.108 3.462) 3.875 9.031 ( -6.883 -8.582 0.558) 11.015 9.127 ( -1.932 -3.783 -0.330) 4.261 9.344 ( -4.402 -12.937 1.861) 13.792 9.659 ( -17.076 -19.385 -0.868) 25.848 10.032 ( -11.015 -14.152 -3.568) 18.285 10.793 ( -2.993 -6.071 2.960) 7.388 11.249 ( -13.841 3.706 -7.292) 16.077 11.673 ( 8.587 -11.202 -3.234) 14.480 11.730 ( -9.281 -13.732 0.628) 16.586 12.424 ( -9.337 -0.973 0.199) 9.390 12.630 ( -8.748 -10.998 -1.105) 14.096 12.980 ( 20.296 0.030 -3.165) 20.541 13.690 ( -8.264 21.509 -3.773) 23.349 14.129 ( 10.300 -0.172 -1.926) 10.480 14.514 ( 1.743 15.596 -7.301) 17.309 14.824 ( 8.450 12.722 1.270) 15.325 15.220 ( 14.200 11.646 -3.763) 18.747 16.458 ( 4.879 7.804 0.261) 9.207 17.832 ( -2.878 -7.346 -1.210) 7.982 19.075 ( -11.587 -10.039 -2.350) 15.510 19.233 ( 3.161 -2.349 -0.667) 3.994 20.878 ( -1.575 -5.951 0.125) 6.157 21.385 ( 8.545 20.067 0.299) 21.813 21.578 ( 1.407 0.644 -0.078) 1.549 22.250 ( 5.024 6.431 8.340) 11.668 26.777 ( 2.069 3.242 0.096) 3.847 27.468 ( 0.389 -1.627 -0.857) 1.880 27.519 ( -1.079 0.314 -0.177) 1.138 27.955 ( 0.520 1.502 -0.198) 1.601 28.138 ( 17.839 13.430 -24.903) 33.448 28.384 ( -11.483 -8.156 2.815) 14.363 28.717 ( -9.419 9.117 -4.786) 13.955 29.272 ( 3.358 -4.001 0.008) 5.224 29.509 ( 10.557 5.876 -8.465) 14.753 29.791 ( 1.040 -2.252 -0.238) 2.492 29.987 ( 0.212 2.745 2.999) 4.072 30.184 ( -4.246 0.590 -8.567) 9.579 30.421 ( 2.120 -0.300 -2.160) 3.042 30.655 ( 3.285 4.530 1.435) 5.777 30.799 ( -0.999 -0.887 -0.692) 1.505 31.786 ( -15.984 -25.675 34.277) 45.713 ======================= Grid point 84 (22/90) ======================= q-point: ( 0.25 0.12 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.121 ( 0.655 14.050 10.576) 17.598 1.462 ( 1.005 29.935 0.121) 29.953 1.853 ( -0.210 -1.050 -2.472) 2.694 2.234 ( 4.785 -2.541 2.687) 6.047 2.384 ( 3.177 1.750 2.571) 4.445 2.463 ( 2.576 -0.196 4.544) 5.227 2.589 ( -4.590 3.214 -4.191) 6.998 2.772 ( -4.029 -6.919 7.680) 11.095 2.929 ( -5.252 0.306 -2.600) 5.868 3.085 ( 2.024 -4.145 -1.410) 4.823 3.506 ( 18.197 3.497 -7.472) 19.980 4.156 ( -5.894 -5.719 2.544) 8.598 4.290 ( 4.413 1.977 0.446) 4.856 4.618 ( -5.914 2.185 3.176) 7.060 4.751 ( 4.142 2.064 -2.842) 5.431 4.952 ( 2.868 -13.452 0.466) 13.762 5.355 ( 1.808 6.654 1.334) 7.023 5.543 ( 12.529 18.819 -2.705) 22.769 6.027 ( 0.873 1.895 -1.166) 2.390 6.180 ( 11.351 17.141 1.593) 20.620 6.720 ( 7.576 7.236 0.771) 10.505 7.016 ( 9.704 -4.729 -0.531) 10.808 7.305 ( -1.236 5.149 -4.333) 6.842 7.561 ( -8.379 -3.672 -0.256) 9.151 7.904 ( -10.013 3.794 3.536) 11.277 8.280 ( 7.353 -0.962 -4.879) 8.877 8.339 ( -0.369 2.558 -2.079) 3.317 8.577 ( 1.320 -0.204 4.008) 4.225 8.796 ( -7.101 -11.399 -4.305) 14.103 8.966 ( -11.202 -9.001 -0.549) 14.381 9.154 ( -10.962 -15.247 -2.134) 18.899 9.242 ( -5.615 -6.227 -0.024) 8.385 9.712 ( -9.240 -12.082 -4.767) 15.940 10.656 ( -4.101 -6.547 4.731) 9.058 10.965 ( -22.097 5.049 -2.950) 22.858 11.466 ( -9.785 -10.220 1.324) 14.211 11.743 ( 16.576 -20.833 0.160) 26.623 12.272 ( -3.947 -2.523 -0.357) 4.698 12.452 ( 6.090 -18.299 -0.334) 19.289 13.310 ( 9.412 10.718 -1.564) 14.349 13.654 ( -22.508 29.945 -1.567) 37.494 14.272 ( 8.680 -7.554 -2.729) 11.826 14.712 ( 8.782 8.383 -2.500) 12.395 15.080 ( 8.219 8.402 0.341) 11.758 15.456 ( 5.917 3.273 -0.981) 6.832 16.715 ( 10.638 15.805 -1.905) 19.147 17.664 ( -7.846 -8.924 -1.162) 11.939 18.791 ( -8.256 -11.252 -3.662) 14.428 19.328 ( 4.032 7.954 -0.691) 8.944 20.757 ( -0.192 -15.566 -0.794) 15.588 21.465 ( -11.532 14.803 1.799) 18.850 21.846 ( 18.795 4.674 0.108) 19.368 22.434 ( 6.633 7.964 5.186) 11.590 26.859 ( 3.486 3.571 0.208) 4.994 27.411 ( -5.162 -2.184 0.198) 5.608 27.500 ( 1.146 -4.092 -0.450) 4.274 27.957 ( -1.076 -0.218 0.463) 1.192 28.207 ( -5.088 1.046 3.063) 6.031 28.457 ( 15.879 -2.992 -6.277) 17.335 28.630 ( -11.652 11.414 -4.331) 16.876 29.274 ( 0.282 -2.883 -1.613) 3.316 29.655 ( 3.427 -0.052 -8.906) 9.543 29.848 ( 3.456 4.198 -8.196) 9.836 30.012 ( 0.132 -1.167 -2.422) 2.692 30.113 ( -0.786 -0.326 -0.177) 0.869 30.464 ( 1.990 0.023 -0.002) 1.990 30.734 ( 2.318 -2.935 6.414) 7.425 30.780 ( -0.143 4.761 -2.595) 5.425 31.357 ( -13.284 -13.306 20.938) 28.141 ======================= Grid point 85 (23/90) ======================= q-point: ( 0.38 0.12 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.246 ( 1.505 5.965 -2.044) 6.483 1.698 ( 1.299 16.585 -0.425) 16.642 1.947 ( 4.258 11.289 0.570) 12.078 2.171 ( -6.496 0.408 3.635) 7.455 2.397 ( 0.199 -2.133 1.832) 2.819 2.485 ( -4.261 1.711 1.146) 4.733 2.566 ( -4.601 4.008 -4.301) 7.465 2.637 ( -1.449 -6.363 10.236) 12.139 2.871 ( -0.732 0.385 1.860) 2.036 3.074 ( 1.673 -4.186 -1.625) 4.792 3.832 ( 15.698 1.358 -8.195) 17.761 3.992 ( -6.248 -7.330 -2.683) 9.999 4.348 ( 1.007 -1.438 4.818) 5.128 4.586 ( -1.640 2.955 6.724) 7.526 4.853 ( 6.916 -6.770 -3.728) 10.372 4.916 ( 7.874 -8.006 3.402) 11.733 5.424 ( -1.835 6.957 0.878) 7.249 5.846 ( 7.026 -2.643 -5.442) 9.271 6.137 ( 7.220 11.987 0.154) 13.994 6.389 ( 0.299 7.659 4.157) 8.719 6.829 ( -5.067 -0.850 4.864) 7.075 6.994 ( -3.405 -7.664 -0.874) 8.432 7.387 ( 8.209 7.378 -2.495) 11.316 7.461 ( -7.101 13.796 -4.490) 16.153 7.834 ( -4.645 3.132 -0.493) 5.624 8.301 ( -2.145 -3.556 -4.915) 6.435 8.316 ( -3.126 2.994 -2.806) 5.158 8.573 ( -13.380 -3.189 0.505) 13.764 8.638 ( 7.091 -5.819 -2.455) 9.496 8.759 ( 1.928 -0.335 -1.353) 2.379 8.871 ( -8.267 -5.072 -6.463) 11.654 9.188 ( 1.163 -6.303 0.347) 6.419 9.549 ( 2.191 -10.168 -2.230) 10.638 10.588 ( -0.055 -1.291 6.178) 6.311 10.686 ( -13.633 6.132 0.296) 14.951 11.273 ( -5.413 -0.688 0.157) 5.459 11.793 ( 18.964 -30.133 2.493) 35.691 12.184 ( 2.744 -16.082 -2.098) 16.448 12.479 ( 7.605 -3.128 0.075) 8.224 13.480 ( -6.152 11.713 1.195) 13.285 13.585 ( -14.700 29.604 -2.568) 33.153 14.264 ( 1.386 -9.603 -1.975) 9.901 14.949 ( 9.312 7.574 -0.625) 12.019 15.228 ( 2.667 3.545 -0.350) 4.451 15.506 ( 0.008 -3.811 -0.633) 3.863 17.045 ( 10.289 14.783 -1.948) 18.116 17.399 ( -15.477 -5.808 -1.464) 16.596 18.640 ( 3.119 -9.881 -3.718) 11.008 19.460 ( -2.118 12.159 -1.927) 12.492 20.608 ( 5.559 -21.348 -0.839) 22.075 21.429 ( -10.804 17.712 1.810) 20.826 22.114 ( 10.081 -1.967 1.081) 10.328 22.571 ( 1.673 4.536 3.694) 6.084 26.938 ( 1.820 1.647 0.416) 2.490 27.309 ( -3.165 -0.846 0.411) 3.302 27.473 ( 1.263 -4.973 -0.274) 5.138 27.945 ( 0.554 -0.711 0.590) 1.078 28.169 ( -5.312 6.092 2.519) 8.467 28.539 ( -5.244 2.087 0.918) 5.718 28.687 ( 11.610 1.026 -1.499) 11.752 29.230 ( -2.534 -1.847 -1.737) 3.584 29.669 ( -1.689 0.633 -10.061) 10.222 29.914 ( 0.667 2.838 -8.599) 9.080 29.958 ( -0.709 -4.683 -10.136) 11.188 30.186 ( 4.666 2.165 5.220) 7.328 30.471 ( 1.030 -3.178 4.680) 5.750 30.678 ( -4.039 -0.569 2.932) 5.023 30.904 ( 7.743 3.992 6.260) 10.728 31.080 ( -8.705 -6.715 7.163) 13.122 ======================= Grid point 86 (24/90) ======================= q-point: (-0.50 0.12 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.278 ( -0.266 -0.962 -0.447) 1.093 1.878 ( 2.707 9.015 1.972) 9.616 2.009 ( -10.868 -0.676 8.276) 13.677 2.056 ( -1.789 3.081 3.814) 5.219 2.381 ( -1.475 1.305 -0.465) 2.024 2.502 ( -1.248 5.629 -3.334) 6.660 2.523 ( -4.471 9.842 -1.600) 10.928 2.580 ( 1.264 -1.561 4.769) 5.175 2.906 ( 3.193 0.306 3.777) 4.955 3.060 ( 1.815 -4.811 -2.517) 5.725 3.773 ( -8.414 -13.159 -7.598) 17.369 4.056 ( 7.958 3.805 -8.467) 12.227 4.306 ( -1.923 -3.919 7.681) 8.835 4.580 ( 0.968 -1.852 7.286) 7.580 4.877 ( 6.039 -7.406 -1.672) 9.702 4.953 ( 1.157 -7.447 2.837) 8.052 5.393 ( -6.821 3.904 -1.275) 7.962 5.794 ( -5.689 -5.894 -0.852) 8.236 6.254 ( -2.383 -3.468 0.092) 4.209 6.541 ( -8.476 -1.378 3.469) 9.261 6.588 ( -1.355 14.627 0.521) 14.699 6.844 ( -5.502 -6.988 0.818) 8.931 7.387 ( -5.273 0.936 -4.303) 6.870 7.722 ( -8.403 14.380 -0.721) 16.671 7.789 ( 9.093 6.224 -6.749) 12.921 8.250 ( -0.622 0.044 -1.631) 1.746 8.302 ( -7.925 1.885 -6.593) 10.479 8.446 ( 9.003 -0.373 4.831) 10.224 8.710 ( 0.486 -3.113 -3.275) 4.544 8.757 ( 3.988 5.783 -2.897) 7.599 8.951 ( 14.105 1.119 -2.209) 14.321 9.146 ( 2.480 -6.315 -3.501) 7.634 9.571 ( 10.378 -7.202 0.834) 12.659 10.537 ( 0.083 0.304 5.788) 5.797 10.786 ( 6.969 14.756 3.544) 16.699 11.285 ( 2.137 7.667 -1.798) 8.160 11.814 ( 19.299 -31.315 2.663) 36.880 12.073 ( 5.073 -17.284 -2.545) 18.192 12.557 ( 4.937 -4.976 0.079) 7.010 13.357 ( -21.065 17.814 -0.283) 27.589 13.729 ( -2.566 22.326 -1.792) 22.545 14.182 ( 0.103 -8.082 -0.684) 8.112 15.106 ( 1.050 -0.041 0.195) 1.069 15.260 ( -0.418 3.932 -1.459) 4.215 15.363 ( -9.292 -9.360 -1.458) 13.269 17.054 ( -20.543 -2.401 -2.158) 20.795 17.341 ( 11.796 9.563 -1.890) 15.302 18.696 ( 11.482 -5.642 -2.870) 13.111 19.435 ( -11.852 7.244 -2.337) 14.086 20.590 ( 13.860 -15.474 -0.588) 20.782 21.452 ( -7.869 19.020 1.200) 20.618 22.112 ( -3.250 -10.502 1.817) 11.142 22.563 ( -5.643 0.914 3.191) 6.547 26.926 ( -2.898 -1.237 0.454) 3.184 27.328 ( 2.585 4.059 0.037) 4.812 27.466 ( 3.791 -4.671 -0.198) 6.019 27.955 ( 1.621 -1.095 0.414) 1.999 28.138 ( -6.225 8.521 1.862) 10.715 28.453 ( -4.059 -3.255 1.262) 5.354 28.900 ( 12.153 1.209 2.468) 12.460 29.155 ( -4.643 -2.152 -3.936) 6.456 29.625 ( -4.652 2.781 -12.009) 13.175 29.890 ( -4.156 -0.334 -5.084) 6.575 29.972 ( 4.794 -1.919 -9.679) 10.970 30.225 ( -0.458 -1.996 1.000) 2.279 30.464 ( 1.021 -2.067 7.741) 8.077 30.632 ( -1.214 2.073 3.194) 3.997 30.918 ( -5.299 -3.186 0.001) 6.183 31.106 ( 11.807 3.482 11.472) 16.826 ======================= Grid point 87 (25/90) ======================= q-point: (-0.38 0.12 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.207 ( -6.141 -4.100 13.025) 14.973 1.699 ( -20.780 -5.628 10.222) 23.832 1.881 ( -2.226 -2.234 -0.054) 3.155 2.129 ( -2.623 1.022 0.160) 2.819 2.367 ( -2.545 2.728 -1.264) 3.940 2.406 ( -2.807 0.788 4.486) 5.350 2.595 ( 1.694 5.644 -1.247) 6.023 2.730 ( 5.070 8.633 -0.236) 10.015 2.961 ( 2.267 1.776 -0.282) 2.894 3.044 ( 1.643 -4.046 -3.194) 5.411 3.471 ( -11.189 -10.718 -8.718) 17.778 4.186 ( 3.315 3.409 -4.696) 6.683 4.256 ( 1.436 -3.708 6.544) 7.657 4.631 ( 5.415 2.084 2.276) 6.233 4.812 ( -6.353 -5.989 2.367) 9.046 4.936 ( 7.798 -5.975 -0.532) 9.838 5.336 ( -4.886 3.272 -1.598) 6.094 5.535 ( -20.261 -1.443 -0.402) 20.316 6.023 ( -15.323 0.652 2.668) 15.568 6.275 ( -12.864 -11.606 -0.993) 17.354 6.699 ( -4.603 -1.112 -4.474) 6.515 6.824 ( 1.187 9.597 3.536) 10.296 7.355 ( -2.235 -1.376 -4.387) 5.112 7.588 ( -1.579 0.430 -2.070) 2.639 8.012 ( 3.522 5.932 -1.881) 7.151 8.174 ( -7.151 2.169 -4.483) 8.714 8.272 ( -0.582 4.882 2.399) 5.471 8.584 ( 0.876 -1.556 2.694) 3.232 8.785 ( 14.530 1.786 -4.647) 15.359 9.040 ( 16.478 7.490 1.724) 18.182 9.092 ( 5.145 -5.795 -0.230) 7.753 9.294 ( 19.135 0.767 -4.493) 19.671 9.750 ( 16.545 -2.643 -0.407) 16.760 10.632 ( 8.588 2.240 4.244) 9.837 11.094 ( 9.488 18.371 3.995) 21.059 11.414 ( 8.980 -3.728 -4.824) 10.854 11.782 ( 5.003 -18.479 1.099) 19.176 12.165 ( 20.319 -3.438 -1.475) 20.660 12.546 ( 5.637 -13.438 0.067) 14.572 13.155 ( -21.768 14.929 -1.481) 26.437 13.862 ( -8.995 20.607 -2.758) 22.653 14.127 ( 2.095 -6.662 -0.126) 6.985 14.895 ( -11.320 -20.806 -4.636) 24.136 15.086 ( -14.769 -2.683 0.584) 15.022 15.315 ( -4.628 9.902 -1.609) 11.048 16.701 ( -18.999 -0.470 -1.917) 19.101 17.622 ( 12.810 5.257 -1.771) 13.959 18.875 ( 14.545 -3.953 -2.421) 15.266 19.279 ( -10.301 3.732 -1.293) 11.033 20.729 ( 13.015 -5.275 -0.507) 14.053 21.513 ( -6.454 16.878 0.170) 18.071 21.830 ( -13.500 -16.133 1.916) 21.123 22.420 ( -10.727 -0.476 4.408) 11.607 26.850 ( -4.409 -0.726 0.248) 4.475 27.417 ( 2.525 3.615 -0.528) 4.441 27.500 ( 4.191 -3.397 -0.031) 5.395 27.972 ( 0.767 -0.736 0.085) 1.067 28.150 ( -3.230 11.490 -1.528) 12.033 28.365 ( 0.424 -7.262 1.230) 7.378 28.961 ( -3.130 -16.319 -6.847) 17.972 29.138 ( 3.463 10.814 -0.555) 11.368 29.582 ( -5.630 5.322 -11.115) 13.548 29.810 ( -4.424 0.238 -3.189) 5.459 30.016 ( 0.879 -0.708 -3.237) 3.428 30.188 ( 1.984 -5.312 -2.600) 6.238 30.441 ( -2.617 0.853 0.606) 2.818 30.672 ( 1.551 2.281 5.791) 6.414 30.824 ( -3.175 -1.804 -3.579) 5.113 31.380 ( 18.204 2.684 21.895) 28.600 ======================= Grid point 92 (26/90) ======================= q-point: ( 0.25 0.25 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.270 ( 1.251 2.890 1.883) 3.669 1.864 ( -3.899 10.762 2.866) 11.800 1.980 ( 3.808 9.356 1.148) 10.167 2.148 ( 6.975 -2.641 2.773) 7.957 2.380 ( -1.710 -1.376 2.736) 3.507 2.524 ( 2.928 4.129 2.910) 5.838 2.598 ( -1.645 -6.511 5.088) 8.425 2.742 ( 0.329 7.604 -3.499) 8.376 2.943 ( -4.736 1.074 -2.837) 5.624 2.985 ( 3.748 -5.850 -2.446) 7.366 3.599 ( 7.698 7.732 -6.279) 12.589 4.057 ( -7.760 -5.512 -3.353) 10.092 4.285 ( 3.123 -1.583 6.245) 7.160 4.618 ( 3.306 -1.571 2.842) 4.634 4.760 ( -6.551 -3.639 1.857) 7.721 4.831 ( -1.439 2.297 0.113) 2.713 5.443 ( 4.295 3.648 -1.903) 5.948 5.772 ( 1.678 0.346 -2.404) 2.952 6.165 ( 1.768 10.228 0.081) 10.380 6.498 ( 0.873 13.471 3.420) 13.926 6.771 ( 10.117 5.591 3.326) 12.028 6.870 ( 6.133 -8.491 2.329) 10.730 7.367 ( 1.046 5.432 -5.168) 7.570 7.684 ( -3.074 7.549 -6.053) 10.153 7.987 ( -3.252 3.456 0.943) 4.839 8.286 ( -0.075 -5.048 1.228) 5.196 8.352 ( 6.779 1.651 -8.916) 11.321 8.447 ( -1.946 -8.607 3.808) 9.611 8.679 ( 0.065 1.920 -1.412) 2.384 8.795 ( -8.896 -10.320 -2.740) 13.898 8.923 ( -6.299 -6.981 -4.140) 10.274 9.145 ( 0.745 -4.397 -2.745) 5.237 9.461 ( -8.365 -12.187 -3.443) 15.177 10.569 ( 1.397 -0.924 5.749) 5.988 11.068 ( -14.479 -11.824 2.378) 18.844 11.140 ( -0.284 -0.711 2.230) 2.358 11.534 ( -6.039 -6.692 -0.162) 9.016 11.912 ( -1.615 -19.538 -0.948) 19.628 12.475 ( -0.396 7.168 -0.752) 7.219 13.539 ( 8.846 11.898 0.342) 14.830 14.005 ( -6.618 -3.617 0.036) 7.542 14.113 ( 7.426 2.825 -3.638) 8.739 14.957 ( -0.059 14.855 -2.049) 14.996 15.251 ( 1.346 7.957 0.110) 8.071 15.407 ( 5.228 -6.635 -0.720) 8.478 17.038 ( 9.469 16.464 -1.266) 19.035 17.473 ( -2.477 -10.090 -0.617) 10.408 18.592 ( -8.952 -9.213 -5.653) 14.035 19.541 ( 9.366 13.711 -0.233) 16.606 20.428 ( -9.199 -17.318 -1.260) 19.650 21.705 ( 1.673 7.297 2.014) 7.752 21.932 ( 4.644 5.390 1.073) 7.195 22.576 ( 3.743 5.897 3.284) 7.718 26.919 ( 2.214 2.465 0.513) 3.353 27.374 ( -5.839 -1.519 0.152) 6.035 27.408 ( 1.451 -4.644 -0.327) 4.877 27.937 ( -1.186 -1.349 0.631) 1.904 28.280 ( 2.064 4.469 0.836) 4.993 28.428 ( 9.172 2.369 2.994) 9.935 28.781 ( -12.371 1.016 0.643) 12.430 29.196 ( 3.096 -3.114 -4.614) 6.369 29.669 ( 2.748 2.092 -10.635) 11.182 29.907 ( 0.506 -0.931 -12.956) 12.999 29.953 ( -0.307 -1.227 -4.335) 4.516 30.173 ( 0.416 5.229 4.795) 7.107 30.444 ( -1.614 -3.170 4.406) 5.662 30.684 ( 2.371 -0.769 6.493) 6.955 30.870 ( 1.100 4.356 -0.443) 4.515 31.132 ( -6.787 -10.078 10.661) 16.164 ======================= Grid point 93 (27/90) ======================= q-point: ( 0.38 0.25 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.290 ( -0.307 0.383 -4.427) 4.454 1.926 ( -0.283 8.911 3.796) 9.690 2.043 ( 0.203 -2.775 3.679) 4.613 2.200 ( -4.430 0.480 3.783) 5.845 2.387 ( 0.154 0.589 3.429) 3.482 2.472 ( 3.032 -2.090 2.681) 4.555 2.582 ( -1.352 0.516 1.662) 2.204 2.829 ( -7.352 16.158 -5.797) 18.675 2.885 ( -0.116 1.480 1.575) 2.165 2.984 ( 0.602 -4.292 -2.465) 4.986 3.784 ( -2.233 -4.219 -6.741) 8.260 3.909 ( 6.937 -3.071 -7.854) 10.919 4.286 ( 0.071 -2.788 10.933) 11.283 4.617 ( -3.542 1.766 4.454) 5.958 4.708 ( 5.316 -5.143 2.088) 7.686 4.845 ( 3.018 -2.926 -0.274) 4.212 5.520 ( -3.787 3.887 -2.467) 5.961 5.691 ( 5.054 -7.759 -4.039) 10.102 6.274 ( -2.167 2.562 2.250) 4.040 6.589 ( 1.626 10.958 5.536) 12.384 6.787 ( -0.475 -9.355 3.548) 10.016 6.977 ( -10.946 8.786 2.601) 14.275 7.498 ( -1.612 2.098 -4.257) 5.012 7.618 ( 7.258 -0.503 -8.976) 11.554 7.974 ( -6.371 12.635 -0.462) 14.158 8.202 ( 1.606 -7.217 -2.291) 7.740 8.367 ( -1.208 2.138 0.403) 2.489 8.493 ( -2.655 -1.700 -4.765) 5.714 8.631 ( 0.760 2.816 -1.869) 3.464 8.755 ( 2.798 -5.459 1.609) 6.342 8.815 ( 1.651 0.945 -5.130) 5.472 9.112 ( -3.247 1.597 -5.244) 6.371 9.321 ( 7.692 -11.672 -2.884) 14.273 10.620 ( -5.041 5.384 5.881) 9.433 10.804 ( 1.402 1.530 4.321) 4.793 11.233 ( 13.461 -15.451 3.964) 20.872 11.401 ( -7.165 7.968 -1.747) 10.857 11.767 ( 9.632 -21.188 -1.450) 23.320 12.542 ( -0.903 3.544 -0.997) 3.791 13.697 ( -5.012 9.422 1.149) 10.733 13.876 ( -0.234 -1.786 -0.308) 1.827 14.183 ( -2.576 4.125 -3.236) 5.842 15.118 ( 0.262 7.984 -1.053) 8.057 15.278 ( 0.787 -1.234 -0.959) 1.750 15.379 ( -1.214 -4.805 -0.335) 4.967 17.275 ( 2.117 5.678 -0.140) 6.062 17.321 ( -6.604 -0.005 -0.419) 6.617 18.477 ( 4.667 -5.960 -6.974) 10.293 19.742 ( -9.661 15.997 -0.701) 18.701 20.202 ( 10.880 -19.161 -0.871) 22.051 21.752 ( -7.655 14.426 1.860) 16.437 22.007 ( 4.516 -8.487 1.584) 9.744 22.636 ( -1.199 1.910 2.805) 3.599 26.948 ( -0.342 -0.019 0.749) 0.824 27.329 ( 0.369 2.240 -0.054) 2.271 27.383 ( 0.984 -3.934 -0.210) 4.061 27.921 ( 0.701 -1.048 0.655) 1.421 28.319 ( -3.947 7.212 1.022) 8.285 28.539 ( -6.180 0.092 3.388) 7.049 28.685 ( 9.198 -3.080 3.512) 10.317 29.187 ( -0.560 -1.299 -4.777) 4.982 29.715 ( -2.895 3.797 -11.718) 12.654 29.847 ( 3.611 -5.365 -13.050) 14.565 29.974 ( -1.828 2.113 -4.964) 5.696 30.248 ( -1.188 3.791 4.777) 6.213 30.379 ( 2.801 -5.412 5.950) 8.517 30.697 ( -2.024 1.874 8.402) 8.843 30.947 ( 0.988 -0.697 3.626) 3.822 30.985 ( 1.184 -1.690 2.184) 3.005 ======================= Grid point 98 (28/90) ======================= q-point: (-0.12 0.25 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.731 ( 13.082 32.481 7.993) 35.918 1.052 ( -1.564 13.180 17.817) 22.217 1.926 ( -1.616 -1.868 -2.968) 3.861 1.991 ( -20.437 24.203 18.332) 36.599 2.411 ( 1.938 -6.368 -1.834) 6.905 2.558 ( 2.679 -3.606 -0.124) 4.494 2.754 ( -4.395 -6.031 -1.997) 7.725 2.774 ( 2.013 -1.520 4.959) 5.564 2.979 ( -0.583 2.602 -3.103) 4.092 3.076 ( -6.743 -0.299 -6.536) 9.395 3.238 ( -3.178 9.906 -12.076) 15.939 4.190 ( 2.907 -0.062 0.074) 2.909 4.397 ( -0.263 5.660 0.944) 5.744 4.506 ( 6.491 -11.514 7.388) 15.142 4.802 ( 0.772 1.093 -2.196) 2.571 5.089 ( 2.414 2.076 -2.759) 4.213 5.168 ( -5.405 5.534 0.739) 7.771 5.350 ( -11.199 7.532 3.845) 14.033 5.890 ( 4.675 13.173 1.617) 14.071 6.038 ( -12.293 1.845 1.266) 12.495 6.416 ( 1.582 12.870 -11.122) 17.083 6.840 ( -9.377 1.525 4.193) 10.384 7.175 ( -1.737 5.012 -0.475) 5.326 7.774 ( 0.368 -4.639 -8.769) 9.927 7.903 ( 12.655 -12.106 6.651) 18.734 8.121 ( -4.972 -5.238 -1.487) 7.373 8.348 ( -6.024 1.767 -5.520) 8.360 8.600 ( 1.377 -0.918 4.272) 4.581 8.957 ( 5.598 -8.956 -2.955) 10.967 9.264 ( -0.262 1.247 4.049) 4.245 9.346 ( 5.320 -12.405 1.979) 13.642 9.768 ( 10.287 -13.733 4.185) 17.661 10.084 ( 15.231 -9.931 -2.179) 18.312 10.759 ( 5.394 -7.205 1.677) 9.156 11.179 ( 11.576 1.231 -8.710) 14.539 11.658 ( -10.177 -19.775 -3.044) 22.447 11.721 ( 12.923 -3.992 -0.911) 13.556 12.377 ( -5.374 -11.767 -1.536) 13.027 12.630 ( 8.860 -14.257 -1.149) 16.825 13.042 ( 9.793 20.846 -1.886) 23.109 13.646 ( -18.286 7.725 -3.992) 20.248 14.116 ( -0.499 5.981 -1.438) 6.172 14.724 ( -7.331 16.473 -5.498) 18.850 14.893 ( -6.124 2.453 6.746) 9.435 14.966 ( -12.619 21.033 -11.065) 26.908 16.432 ( -3.117 5.349 0.199) 6.194 17.828 ( 4.187 -7.327 -1.412) 8.556 19.066 ( 4.228 -15.438 -2.988) 16.284 19.233 ( 3.729 1.505 -0.914) 4.124 20.911 ( 3.078 -2.739 1.020) 4.245 21.407 ( -17.084 14.215 0.937) 22.245 21.565 ( 4.628 4.907 -0.639) 6.775 22.256 ( -5.182 6.322 8.621) 11.881 26.776 ( -1.674 3.444 0.050) 3.830 27.473 ( 1.091 -0.847 -0.456) 1.454 27.519 ( -1.009 -1.318 -0.255) 1.680 27.930 ( -3.561 3.279 -9.759) 10.894 27.994 ( -7.860 6.652 -11.413) 15.371 28.512 ( 15.617 -2.286 2.860) 16.040 28.860 ( -5.990 10.710 -12.036) 17.189 29.150 ( 5.065 -5.885 0.364) 7.773 29.439 ( -12.736 3.035 -5.589) 14.236 29.812 ( 0.741 -1.631 -1.598) 2.401 29.989 ( -1.588 2.870 4.892) 5.890 30.225 ( 1.885 3.144 -9.863) 10.522 30.510 ( -4.922 -2.520 1.532) 5.738 30.566 ( 0.523 6.055 -4.029) 7.292 30.814 ( 0.226 -0.310 1.031) 1.100 31.780 ( 16.211 -26.101 34.545) 46.232 ======================= Grid point 107 (29/90) ======================= q-point: (-0.25 0.38 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.945 ( -2.809 27.406 4.460) 27.908 1.266 ( -6.688 15.369 -0.464) 16.768 1.864 ( 0.990 -3.643 -2.778) 4.687 2.264 ( 5.958 -6.084 -0.139) 8.516 2.414 ( -3.135 4.546 3.089) 6.328 2.478 ( 0.879 -2.031 3.265) 3.944 2.645 ( 0.375 -10.967 0.354) 10.979 2.808 ( 3.414 10.525 5.443) 12.332 2.984 ( 1.749 3.115 0.037) 3.573 3.139 ( 0.206 -0.121 3.093) 3.102 3.599 ( -24.911 9.999 -5.937) 27.492 4.127 ( 1.089 -1.550 3.561) 4.033 4.353 ( 7.220 2.152 3.259) 8.208 4.436 ( -1.318 -4.067 -2.672) 5.042 4.816 ( -2.401 2.738 0.184) 3.646 5.067 ( -4.185 -8.412 1.740) 9.555 5.410 ( -11.128 11.596 -1.122) 16.111 5.577 ( 3.350 16.384 5.800) 17.701 6.007 ( -7.073 14.415 0.612) 16.068 6.274 ( -7.138 5.604 0.666) 9.100 6.525 ( -5.975 4.256 -9.710) 12.169 6.936 ( -4.371 -9.978 7.118) 13.013 7.324 ( -6.050 4.320 -6.598) 9.939 7.523 ( 12.896 -5.771 -3.373) 14.525 7.744 ( -0.096 -3.999 -6.503) 7.635 8.111 ( -1.759 -7.234 -3.313) 8.149 8.417 ( -2.022 -1.543 -3.263) 4.137 8.588 ( 1.705 -0.424 2.211) 2.824 8.791 ( 4.776 -7.597 -4.306) 9.954 9.067 ( 11.380 -7.358 2.572) 13.794 9.296 ( -1.335 -0.352 5.067) 5.252 9.416 ( 24.563 -4.708 1.824) 25.076 9.713 ( 10.406 -7.984 -1.571) 13.210 10.566 ( 7.101 -7.649 1.819) 10.594 10.970 ( 13.304 2.331 -0.384) 13.512 11.498 ( 3.488 -12.482 -1.125) 13.009 11.742 ( -12.121 -13.218 -0.462) 17.940 12.174 ( 5.804 -19.347 -0.981) 20.222 12.467 ( -8.380 -12.399 -3.110) 15.285 13.216 ( 2.669 25.607 0.823) 25.759 13.831 ( 12.031 20.919 -3.372) 24.367 14.171 ( -6.926 -6.185 1.570) 9.417 15.007 ( -5.570 15.067 -2.900) 16.323 15.105 ( -20.010 -4.286 3.145) 20.705 15.233 ( -0.826 10.961 -4.358) 11.825 16.626 ( -10.444 11.381 -3.773) 15.901 17.609 ( 10.782 -11.126 -2.411) 15.680 18.845 ( 3.939 -15.564 -3.871) 16.514 19.278 ( -1.818 11.063 -1.544) 11.317 20.782 ( 1.995 -13.120 1.406) 13.345 21.507 ( 11.790 12.706 0.125) 17.334 21.840 ( -20.186 6.587 1.753) 21.305 22.437 ( -6.281 7.717 5.243) 11.247 26.849 ( -2.787 3.516 0.164) 4.489 27.425 ( 4.102 -0.902 -0.241) 4.207 27.503 ( -1.516 -5.553 0.063) 5.757 27.967 ( -0.962 1.157 -0.498) 1.585 28.188 ( -8.699 -0.323 -5.301) 10.192 28.263 ( 10.563 2.455 2.711) 11.178 28.950 ( 9.739 6.966 -7.152) 13.947 29.072 ( -7.619 -7.494 -0.999) 10.733 29.680 ( -10.902 3.983 -8.483) 14.376 29.765 ( 3.306 -0.292 -6.161) 6.998 30.051 ( -1.672 1.528 1.235) 2.580 30.212 ( 1.839 2.708 -4.368) 5.458 30.529 ( -0.756 -2.190 6.636) 7.029 30.643 ( -2.637 2.602 -7.975) 8.794 30.809 ( -0.533 0.698 4.795) 4.875 31.343 ( 13.250 -14.084 21.527) 28.937 ======================= Grid point 108 (30/90) ======================= q-point: (-0.12 0.38 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.301 ( 10.648 22.506 18.028) 30.739 1.356 ( -5.158 19.402 -4.765) 20.633 1.849 ( 2.265 -4.551 -2.941) 5.873 2.257 ( -0.206 -5.726 -2.345) 6.191 2.368 ( -9.521 2.028 3.561) 10.366 2.451 ( 2.902 -7.498 3.173) 8.644 2.549 ( 0.915 -5.093 0.217) 5.179 2.770 ( -16.338 0.401 6.627) 17.636 2.980 ( -1.283 -1.207 -1.970) 2.643 3.097 ( -0.447 1.515 0.410) 1.632 3.546 ( -0.244 21.135 -6.587) 22.139 4.166 ( 1.202 -2.156 0.315) 2.489 4.335 ( -0.607 -4.533 1.021) 4.686 4.547 ( 7.124 6.933 5.948) 11.584 4.850 ( -0.324 3.808 0.075) 3.822 4.991 ( 7.010 -7.179 1.107) 10.095 5.343 ( -10.714 6.770 0.344) 12.679 5.618 ( -12.115 20.580 0.831) 23.896 6.075 ( -10.669 2.574 0.955) 11.017 6.247 ( 6.993 19.222 4.338) 20.910 6.631 ( 4.936 3.502 -6.399) 8.808 6.819 ( -5.095 3.700 -3.268) 7.094 7.277 ( 0.168 -0.038 -4.569) 4.572 7.591 ( 3.437 -16.348 1.616) 16.783 7.703 ( 3.120 -0.913 -8.290) 8.905 8.063 ( 1.370 -0.870 -4.352) 4.645 8.325 ( -4.207 -3.120 -5.891) 7.883 8.619 ( 0.160 2.180 1.895) 2.893 8.779 ( 3.548 -8.588 -5.683) 10.892 9.046 ( 1.488 -18.217 3.204) 18.556 9.278 ( -1.069 0.439 3.382) 3.574 9.488 ( -0.628 -15.036 6.892) 16.553 9.874 ( 10.321 -10.814 1.696) 15.045 10.605 ( 5.170 -6.271 3.184) 8.729 11.016 ( -10.655 -18.229 -0.897) 21.134 11.339 ( 11.397 -8.345 -3.691) 14.599 11.756 ( 20.137 0.695 0.820) 20.166 12.187 ( -3.568 -3.683 -4.027) 6.520 12.444 ( 21.808 -5.056 -0.616) 22.394 13.371 ( -3.040 11.313 0.981) 11.755 13.688 ( -37.086 -1.199 -0.311) 37.107 14.235 ( 7.186 4.976 -3.515) 9.421 14.896 ( -1.940 6.148 3.535) 7.352 15.072 ( -1.130 11.788 0.131) 11.843 15.320 ( -4.876 13.323 -6.648) 15.667 16.628 ( -4.740 14.851 -3.945) 16.081 17.625 ( 4.043 -13.540 -2.837) 14.413 18.774 ( 7.476 -13.099 -4.525) 15.746 19.330 ( -4.864 7.717 -0.437) 9.132 20.807 ( 12.561 -7.720 0.899) 14.771 21.431 ( -19.412 -2.685 0.445) 19.602 21.893 ( 5.025 19.003 2.003) 19.758 22.419 ( -5.196 9.040 4.681) 11.429 26.859 ( -1.261 4.825 0.186) 4.991 27.406 ( -1.475 -5.898 0.089) 6.080 27.493 ( 4.100 -1.096 -0.812) 4.321 27.957 ( -0.420 1.146 -0.351) 1.269 28.071 ( -6.419 2.421 -3.205) 7.572 28.502 ( 11.052 0.825 1.453) 11.178 28.846 ( -5.324 -7.943 0.629) 9.583 29.192 ( 9.967 4.147 -8.910) 13.997 29.509 ( -12.821 4.842 -10.413) 17.212 29.832 ( 1.086 3.975 -3.836) 5.630 30.031 ( -1.535 1.174 2.099) 2.853 30.270 ( 2.111 1.495 -4.549) 5.233 30.446 ( -3.194 -3.545 1.610) 5.036 30.669 ( -0.694 3.931 -0.122) 3.993 30.810 ( 0.543 0.556 0.027) 0.778 31.366 ( 7.439 -17.383 22.370) 29.290 ======================= Grid point 116 (31/90) ======================= q-point: (-0.38 0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.292 ( -9.179 20.967 -0.180) 22.889 1.549 ( -7.199 17.589 -7.742) 20.522 1.835 ( 0.295 -2.798 1.535) 3.205 2.077 ( 5.907 -7.332 2.478) 9.736 2.340 ( 3.506 -7.785 -3.825) 9.355 2.413 ( 5.230 -4.258 -2.114) 7.068 2.597 ( -2.541 -3.587 5.817) 7.291 2.870 ( 5.886 13.878 4.272) 15.668 2.966 ( 4.946 4.995 7.045) 9.952 3.121 ( 0.124 -1.003 3.094) 3.255 3.971 ( -4.294 6.680 -5.826) 9.849 4.167 ( 2.907 1.223 4.382) 5.399 4.293 ( -8.502 0.239 3.756) 9.298 4.437 ( -3.087 -2.328 3.534) 5.238 4.887 ( -6.457 -7.870 0.315) 10.185 5.052 ( -3.574 -9.822 2.826) 10.828 5.540 ( 11.787 13.008 5.510) 18.399 5.779 ( -16.862 12.632 -1.367) 21.113 6.236 ( -1.429 -1.700 -2.156) 3.095 6.310 ( 8.261 7.724 -2.791) 11.649 6.683 ( -8.401 -2.957 0.219) 8.909 6.828 ( -6.273 -10.002 4.445) 12.616 7.278 ( 6.305 2.954 -9.231) 11.562 7.539 ( 3.494 8.171 -6.327) 10.909 7.753 ( -3.513 -1.812 -8.104) 9.017 8.070 ( -3.613 -8.612 -5.768) 10.977 8.293 ( 8.487 -14.772 -3.257) 17.345 8.535 ( 0.506 8.818 3.192) 9.391 8.675 ( 3.533 -0.580 -7.471) 8.284 8.966 ( 19.910 -3.854 -3.621) 20.600 9.003 ( -2.815 6.865 4.639) 8.751 9.313 ( -0.222 0.247 5.124) 5.135 9.619 ( -3.499 -4.201 2.861) 6.170 10.449 ( 1.039 0.806 2.424) 2.758 10.785 ( 11.263 1.217 4.076) 12.039 11.318 ( 9.459 0.960 -0.606) 9.527 11.748 ( -18.495 -35.828 -0.281) 40.322 12.089 ( -10.788 -11.358 -1.667) 15.753 12.484 ( -3.050 -6.914 -2.724) 8.033 13.397 ( 4.830 24.205 1.446) 24.724 13.744 ( 16.987 16.654 -1.161) 23.817 14.233 ( -5.975 -3.835 1.496) 7.256 15.127 ( 4.320 6.286 0.462) 7.641 15.273 ( 0.724 1.926 -0.507) 2.119 15.379 ( -12.518 -0.823 -0.744) 12.567 16.960 ( -14.614 12.429 -5.377) 19.924 17.293 ( 14.433 -9.603 -3.961) 17.783 18.664 ( -0.205 -14.053 -4.402) 14.728 19.438 ( 0.358 14.569 -2.141) 14.730 20.643 ( -6.167 -19.770 1.278) 20.749 21.434 ( 13.541 17.029 0.681) 21.767 22.139 ( -10.893 -0.721 2.619) 11.226 22.564 ( -1.286 4.306 3.387) 5.627 26.924 ( -2.442 2.058 0.364) 3.214 27.333 ( 4.709 -0.727 0.214) 4.770 27.475 ( -2.059 -5.821 0.056) 6.175 27.990 ( -0.268 1.009 1.613) 1.921 28.119 ( 6.602 5.144 1.611) 8.523 28.390 ( -8.743 2.901 -1.779) 9.382 28.810 ( 4.496 -6.886 -1.740) 8.406 29.143 ( -4.010 -0.297 -2.987) 5.009 29.688 ( 6.051 2.381 -8.360) 10.591 29.884 ( -8.073 3.710 -6.862) 11.226 30.038 ( 3.063 -0.996 -7.307) 7.985 30.239 ( -1.327 2.446 2.081) 3.475 30.485 ( 0.931 -6.676 9.785) 11.882 30.670 ( 1.841 4.251 -4.249) 6.286 30.898 ( -7.771 2.688 7.585) 11.187 31.057 ( 8.729 -8.210 8.576) 14.736 ======================= Grid point 117 (32/90) ======================= q-point: (-0.25 0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.428 ( 0.156 20.840 9.021) 22.709 1.650 ( -7.133 20.261 -7.437) 22.731 1.794 ( -0.379 -2.467 -2.602) 3.606 2.125 ( 7.888 -7.927 -1.863) 11.337 2.318 ( 1.782 -9.401 2.250) 9.829 2.388 ( -4.289 -12.144 -4.646) 13.691 2.519 ( 4.352 0.675 0.828) 4.481 2.971 ( -2.888 5.065 8.049) 9.939 3.080 ( -0.826 3.888 2.816) 4.871 3.164 ( -7.923 4.769 4.901) 10.466 3.810 ( -12.553 13.249 1.574) 18.319 4.107 ( 2.907 -0.619 4.272) 5.205 4.360 ( -3.150 -2.033 0.494) 3.781 4.453 ( 9.155 3.869 1.214) 10.013 4.768 ( 5.170 -8.116 1.042) 9.679 4.920 ( -2.725 -4.954 2.197) 6.066 5.600 ( -9.613 8.900 4.130) 13.736 5.924 ( 3.388 16.716 4.026) 17.525 6.172 ( -4.356 -0.639 1.717) 4.726 6.388 ( -9.142 -1.736 -0.829) 9.342 6.572 ( 4.967 3.231 -6.872) 9.073 6.785 ( 5.905 2.530 1.470) 6.590 7.287 ( -5.618 1.942 -8.236) 10.157 7.616 ( -7.579 1.832 -9.011) 11.916 7.685 ( 0.406 0.448 -10.120) 10.138 7.987 ( 4.078 -6.312 -6.222) 9.756 8.272 ( 4.775 -12.540 -3.471) 13.860 8.628 ( 0.961 7.558 0.711) 7.652 8.684 ( -0.157 -2.902 -7.431) 7.979 8.946 ( -5.448 -5.423 6.586) 10.123 9.265 ( 5.649 -5.775 7.410) 10.962 9.327 ( 7.653 -2.060 3.388) 8.620 9.565 ( 9.507 -7.699 0.333) 12.238 10.517 ( 2.686 2.799 4.343) 5.823 11.006 ( 14.168 -8.631 1.930) 16.702 11.082 ( -13.446 -12.062 -1.300) 18.110 11.559 ( 4.257 -8.219 0.603) 9.275 11.901 ( 14.575 -11.794 -1.330) 18.796 12.412 ( -6.165 4.921 -3.381) 8.582 13.562 ( -5.362 11.198 1.408) 12.495 14.021 ( 4.406 -7.473 0.213) 8.678 14.175 ( -4.739 11.866 -0.494) 12.787 15.078 ( -11.625 2.835 2.827) 12.295 15.227 ( -4.796 7.252 -1.218) 8.779 15.385 ( 4.927 4.057 -1.586) 6.576 16.898 ( -8.940 15.141 -6.061) 18.599 17.400 ( 8.146 -10.492 -3.707) 13.791 18.545 ( 4.339 -12.978 -7.639) 15.672 19.550 ( -7.468 15.719 0.164) 17.404 20.479 ( 10.583 -17.302 0.597) 20.291 21.693 ( -6.840 6.036 1.605) 9.262 21.975 ( -1.302 6.754 2.693) 7.387 22.572 ( -3.650 5.589 3.200) 7.403 26.920 ( -1.145 3.362 0.515) 3.588 27.376 ( -1.428 -5.810 0.233) 5.987 27.406 ( 3.956 -1.274 -0.479) 4.184 27.979 ( -0.802 0.289 2.263) 2.418 28.234 ( -8.298 3.352 -1.601) 9.092 28.363 ( 8.233 7.712 0.917) 11.318 28.771 ( 1.631 -13.390 0.828) 13.514 29.128 ( 2.076 2.318 -7.616) 8.227 29.744 ( -10.216 2.375 -8.758) 13.665 29.835 ( 3.881 7.251 -6.711) 10.615 30.051 ( -0.142 -1.837 -3.551) 4.000 30.256 ( 0.849 2.005 1.712) 2.770 30.422 ( 0.161 -6.613 6.992) 9.625 30.742 ( -1.194 6.000 -3.464) 7.030 30.817 ( -2.138 0.553 5.395) 5.830 31.104 ( 7.464 -10.735 11.835) 17.636 ======================= Grid point 118 (33/90) ======================= q-point: (-0.12 0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.553 ( -11.465 -2.447 -6.309) 13.313 1.659 ( 5.616 11.156 12.751) 17.849 1.770 ( -4.652 -2.552 -5.324) 7.516 2.112 ( -2.536 -11.623 2.617) 12.181 2.201 ( 6.775 1.167 -7.863) 10.445 2.367 ( 2.976 -1.527 -1.120) 3.528 2.597 ( 0.838 1.514 5.708) 5.964 2.824 ( -20.035 4.670 7.457) 21.882 2.961 ( -2.919 -0.767 2.703) 4.052 3.116 ( 1.020 0.393 2.483) 2.713 3.920 ( -1.542 13.624 -1.305) 13.773 4.120 ( -3.479 -1.782 -5.484) 6.735 4.320 ( 0.779 2.801 4.026) 4.966 4.584 ( 6.954 -6.172 12.081) 15.245 4.885 ( 9.081 -0.495 0.692) 9.121 4.964 ( 10.139 6.128 -0.001) 11.847 5.451 ( -16.605 5.087 1.868) 17.467 6.022 ( -9.635 17.496 -3.475) 20.273 6.142 ( 1.192 3.968 3.872) 5.670 6.249 ( 4.497 -16.892 0.554) 17.489 6.711 ( 2.976 6.759 -0.832) 7.432 6.960 ( 7.399 -2.588 -1.144) 7.922 7.187 ( -7.062 1.291 -10.505) 12.724 7.435 ( -6.769 3.335 -1.588) 7.711 7.754 ( 3.249 2.669 -9.462) 10.354 8.063 ( 7.586 0.372 -6.537) 10.021 8.230 ( 1.938 -6.194 -4.187) 7.724 8.633 ( -1.280 -0.898 -7.127) 7.296 8.704 ( -3.072 -6.105 -1.802) 7.068 8.745 ( -4.313 -1.515 2.621) 5.269 9.198 ( -3.685 -12.882 5.304) 14.410 9.302 ( -1.984 0.668 4.603) 5.057 9.701 ( 7.248 -6.924 3.818) 10.726 10.544 ( 1.511 -4.545 3.969) 6.220 10.697 ( -8.924 -6.802 1.949) 11.389 11.253 ( -1.042 -0.905 -0.778) 1.584 11.738 ( 37.394 -1.007 -0.223) 37.408 12.168 ( 10.394 -2.395 -2.784) 11.024 12.431 ( 9.665 3.199 -1.616) 10.308 13.484 ( -12.042 0.347 1.385) 12.127 13.664 ( -32.994 0.608 0.814) 33.009 14.277 ( 5.915 -0.634 -1.421) 6.117 15.032 ( -2.499 7.287 2.791) 8.194 15.235 ( -1.165 5.095 -0.042) 5.227 15.466 ( 1.172 1.677 -2.704) 3.391 16.953 ( -2.995 17.767 -5.264) 18.771 17.321 ( -0.307 -17.795 -4.555) 18.371 18.616 ( 11.976 -2.691 -4.818) 13.186 19.466 ( -12.039 4.341 -1.404) 12.874 20.658 ( 21.175 -5.928 0.867) 22.006 21.401 ( -22.272 0.031 0.857) 22.288 22.158 ( 6.169 7.189 2.856) 9.895 22.554 ( -3.710 4.179 3.004) 6.344 26.937 ( -0.573 2.324 0.357) 2.420 27.308 ( -1.247 -2.653 0.370) 2.954 27.472 ( 4.999 -0.795 -0.358) 5.075 27.984 ( 0.185 1.307 2.257) 2.615 28.096 ( -8.455 0.414 -0.711) 8.495 28.512 ( 0.597 -2.102 0.282) 2.203 28.731 ( 7.352 -1.318 0.437) 7.482 29.198 ( 3.723 -2.211 -4.026) 5.913 29.605 ( -8.181 4.645 -11.111) 14.559 29.941 ( -0.754 5.876 -6.265) 8.623 30.014 ( 0.103 -3.373 -4.226) 5.408 30.276 ( -0.202 -1.088 0.853) 1.397 30.415 ( 3.178 1.486 6.218) 7.140 30.690 ( -4.737 -1.068 2.062) 5.275 30.880 ( 2.193 6.838 0.274) 7.186 31.091 ( 3.864 -11.882 12.376) 17.586 ======================= Grid point 124 (34/90) ======================= q-point: (-0.38 0.62 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.636 ( -2.912 12.749 5.403) 14.150 1.758 ( 8.650 -2.097 -0.902) 8.946 1.912 ( 5.764 3.513 -3.923) 7.807 1.974 ( -11.793 4.408 -0.969) 12.627 2.190 ( 6.060 -3.751 -4.466) 8.410 2.308 ( -1.254 -5.978 -2.685) 6.672 2.501 ( -4.588 -4.989 -1.559) 6.955 3.026 ( 2.181 3.353 6.801) 7.890 3.089 ( -1.274 -1.259 4.556) 4.896 3.255 ( 11.990 18.455 8.376) 23.548 4.032 ( 3.674 0.233 1.698) 4.054 4.148 ( -1.319 -4.874 5.311) 7.328 4.259 ( -7.895 -4.780 7.213) 11.713 4.449 ( 2.114 5.820 -1.421) 6.353 4.667 ( -6.477 -10.727 -0.929) 12.565 4.890 ( -0.869 -5.148 1.007) 5.317 5.743 ( 8.006 8.264 7.259) 13.605 5.947 ( -8.203 -1.646 7.097) 10.971 6.238 ( -0.893 9.070 -0.880) 9.156 6.337 ( 14.965 -1.863 -3.298) 15.437 6.567 ( -11.604 -9.516 -4.816) 15.761 6.878 ( 0.099 6.573 -0.718) 6.613 7.394 ( 5.802 7.253 -10.856) 14.287 7.629 ( 1.895 -6.925 -8.122) 10.840 7.676 ( 2.150 5.814 -10.162) 11.903 7.894 ( -6.338 -8.437 -10.084) 14.596 8.124 ( -2.031 -3.341 -3.767) 5.430 8.641 ( -0.363 0.642 -9.011) 9.041 8.818 ( -2.378 13.825 6.349) 15.398 8.896 ( 18.738 -3.163 2.975) 19.234 9.092 ( -9.875 0.914 7.493) 12.430 9.320 ( -0.042 1.467 2.920) 3.268 9.467 ( -6.800 -10.718 1.811) 12.821 10.566 ( 1.329 9.034 4.197) 10.050 10.776 ( 1.764 -3.816 4.032) 5.825 11.158 ( -6.333 -17.428 0.903) 18.565 11.412 ( 3.905 9.466 -1.369) 10.331 11.769 ( -13.424 -19.739 -1.292) 23.906 12.494 ( 2.855 3.588 -3.051) 5.508 13.692 ( 6.035 8.837 0.962) 10.744 13.892 ( -3.584 -3.065 0.453) 4.738 14.291 ( 4.151 7.523 1.258) 8.684 15.180 ( 6.361 2.692 1.617) 7.094 15.289 ( -0.046 -0.590 -0.620) 0.857 15.384 ( -4.307 -0.566 -0.205) 4.349 17.136 ( 3.489 1.358 -5.534) 6.681 17.207 ( -1.944 2.639 -4.985) 5.966 18.423 ( -3.464 -7.831 -9.130) 12.517 19.762 ( 9.438 17.251 0.122) 19.664 20.243 ( -11.504 -19.806 0.650) 22.914 21.757 ( 9.698 15.165 2.119) 18.124 22.042 ( -5.796 -8.780 2.960) 10.929 22.630 ( 1.280 2.032 2.527) 3.486 26.952 ( -0.000 0.588 0.856) 1.039 27.330 ( 1.837 0.758 -0.070) 1.988 27.383 ( -2.691 -3.224 -0.241) 4.207 27.984 ( -0.077 -0.451 3.370) 3.401 28.279 ( 6.555 8.537 -0.462) 10.773 28.463 ( -5.302 3.027 -0.211) 6.108 28.606 ( -0.753 -10.384 0.101) 10.412 29.133 ( -1.401 -1.104 -6.515) 6.755 29.784 ( 5.580 6.108 -8.080) 11.564 29.946 ( -4.567 0.965 -7.723) 9.024 29.991 ( 1.784 -2.708 -6.598) 7.352 30.278 ( -0.016 1.870 5.073) 5.407 30.353 ( -1.227 -5.128 8.457) 9.966 30.783 ( 2.869 6.715 0.655) 7.331 30.910 ( 5.678 -7.051 3.394) 9.668 30.925 ( -9.128 0.154 7.302) 11.690 ======================= Grid point 146 (35/90) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.090 ( 0.000 0.000 23.737) 23.737 1.090 ( 0.000 0.000 23.737) 23.737 1.681 ( 0.000 0.000 8.174) 8.174 2.149 ( 0.000 -0.000 31.787) 31.787 2.504 ( 0.000 -0.000 -3.464) 3.464 2.504 ( 0.000 -0.000 -3.464) 3.464 2.651 ( 0.000 0.000 -0.767) 0.767 2.651 ( 0.000 -0.000 -0.767) 0.767 2.941 ( -0.000 0.000 1.685) 1.685 2.999 ( 0.000 -0.000 -5.133) 5.133 2.999 ( 0.000 0.000 -5.133) 5.133 4.144 ( 0.000 -0.000 -3.151) 3.151 4.144 ( -0.000 0.000 -3.151) 3.151 4.650 ( 0.000 0.000 -3.933) 3.933 4.851 ( 0.000 0.000 -12.525) 12.525 5.137 ( 0.000 0.000 -0.761) 0.761 5.137 ( 0.000 0.000 -0.761) 0.761 5.301 ( 0.000 0.000 -16.333) 16.333 5.876 ( 0.000 0.000 -7.135) 7.135 5.898 ( 0.000 0.000 1.117) 1.117 5.898 ( -0.000 -0.000 1.117) 1.117 6.525 ( 0.000 0.000 -11.380) 11.380 7.536 ( 0.000 0.000 21.643) 21.643 7.738 ( 0.000 -0.000 -9.471) 9.471 7.738 ( 0.000 0.000 -9.471) 9.471 8.286 ( 0.000 0.000 5.180) 5.180 8.286 ( 0.000 0.000 5.180) 5.180 8.863 ( 0.000 0.000 4.249) 4.249 9.224 ( 0.000 -0.000 1.997) 1.997 9.224 ( 0.000 0.000 1.997) 1.997 9.628 ( 0.000 0.000 -1.140) 1.140 10.214 ( 0.000 0.000 1.029) 1.029 10.214 ( 0.000 0.000 1.029) 1.029 10.906 ( 0.000 0.000 3.652) 3.652 10.906 ( 0.000 0.000 3.652) 3.652 11.604 ( 0.000 0.000 -7.253) 7.253 12.243 ( 0.000 0.000 -1.064) 1.064 12.243 ( 0.000 0.000 -1.064) 1.064 12.557 ( 0.000 0.000 -2.787) 2.787 13.460 ( 0.000 -0.000 -0.300) 0.300 13.460 ( 0.000 0.000 -0.300) 0.300 13.763 ( 0.000 -0.000 0.241) 0.241 13.763 ( 0.000 0.000 0.241) 0.241 14.524 ( -0.000 0.000 1.893) 1.893 14.913 ( 0.000 -0.000 4.185) 4.185 16.472 ( 0.000 -0.000 4.824) 4.824 17.910 ( 0.000 0.000 -0.980) 0.980 19.360 ( 0.000 0.000 -1.308) 1.308 19.360 ( 0.000 0.000 -1.308) 1.308 20.867 ( 0.000 -0.000 -0.799) 0.799 20.867 ( 0.000 0.000 -0.799) 0.799 21.553 ( 0.000 0.000 -1.841) 1.841 22.360 ( 0.000 0.000 -0.740) 0.740 26.710 ( 0.000 0.000 0.005) 0.005 26.710 ( 0.000 0.000 0.005) 0.005 27.494 ( 0.000 0.000 -0.117) 0.117 27.494 ( 0.000 0.000 -0.117) 0.117 27.921 ( 0.000 0.000 -0.120) 0.120 28.745 ( 0.000 -0.000 0.444) 0.444 28.745 ( 0.000 0.000 0.444) 0.444 29.278 ( 0.000 0.000 0.580) 0.580 29.278 ( 0.000 0.000 0.580) 0.580 29.932 ( 0.000 0.000 1.143) 1.143 29.932 ( -0.000 -0.000 1.143) 1.143 30.079 ( 0.000 0.000 -0.946) 0.946 30.464 ( 0.000 -0.000 -0.764) 0.764 30.464 ( 0.000 0.000 -0.764) 0.764 30.838 ( 0.000 0.000 1.040) 1.040 32.960 ( -0.000 0.000 -0.816) 0.816 ======================= Grid point 147 (36/90) ======================= q-point: ( 0.12 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.872 ( -10.415 6.398 23.976) 26.912 1.343 ( 5.582 1.555 18.666) 19.544 1.793 ( 6.664 1.172 -5.511) 8.727 2.199 ( 9.354 4.737 34.519) 36.076 2.484 ( -3.487 -3.098 -2.050) 5.095 2.524 ( 6.258 -8.096 -3.125) 10.699 2.594 ( -1.938 -0.386 -1.006) 2.217 2.792 ( 7.674 11.872 -0.615) 14.150 2.936 ( -0.651 3.380 -0.082) 3.443 2.969 ( 1.018 -0.563 -2.756) 2.991 3.095 ( 4.600 2.948 -2.340) 5.944 4.141 ( 0.108 -1.599 -2.750) 3.183 4.231 ( 7.338 3.455 -2.568) 8.508 4.685 ( 1.078 -0.236 -5.028) 5.147 4.783 ( -7.882 -3.158 -10.920) 13.833 4.969 ( -11.314 -2.767 -3.987) 12.311 5.173 ( 2.304 -1.610 -2.129) 3.527 5.278 ( 6.106 2.480 -0.893) 6.651 5.766 ( 0.430 -1.241 0.282) 1.343 6.003 ( 8.715 -0.597 1.038) 8.797 6.096 ( 6.127 10.735 -4.609) 13.192 6.594 ( 7.960 3.810 -11.968) 14.870 7.465 ( -5.622 -1.997 18.658) 19.588 7.721 ( -4.404 6.247 -8.015) 11.075 7.918 ( 16.678 -1.754 -12.715) 21.045 8.163 ( -7.052 -6.549 5.788) 11.231 8.308 ( -3.557 4.064 2.728) 6.051 8.774 ( -5.169 -3.880 5.825) 8.701 9.119 ( -10.462 -0.236 2.077) 10.669 9.261 ( 3.220 -3.926 1.670) 5.346 9.550 ( -6.427 -3.180 0.453) 7.185 9.983 ( -16.584 -13.656 0.318) 21.485 10.147 ( -10.268 -7.135 -3.187) 12.903 10.893 ( -2.241 0.466 3.304) 4.019 10.998 ( 1.661 2.145 -1.669) 3.185 11.604 ( -0.551 -0.306 -5.938) 5.972 12.030 ( -9.935 -2.197 -4.518) 11.133 12.347 ( 8.050 0.545 -0.949) 8.124 12.600 ( -1.405 -0.328 -0.627) 1.573 13.157 ( -20.458 0.974 -1.476) 20.534 13.348 ( 4.212 -9.337 0.091) 10.244 14.038 ( 13.435 11.104 0.335) 17.433 14.165 ( 24.265 7.810 -3.095) 25.679 14.643 ( 11.242 6.545 1.026) 13.049 14.978 ( 5.070 6.679 3.164) 8.962 16.463 ( -0.319 -0.014 4.547) 4.558 17.886 ( -2.770 -1.499 -1.305) 3.410 19.225 ( -8.681 -8.751 -1.845) 12.464 19.261 ( -8.793 -0.876 -1.659) 8.991 20.922 ( 2.986 2.223 -0.343) 3.739 21.083 ( 17.272 7.418 -0.542) 18.806 21.542 ( -0.453 0.569 -1.551) 1.713 22.351 ( 1.130 0.376 3.327) 3.533 26.733 ( 2.009 1.305 0.035) 2.396 27.123 ( 29.419 18.025 -12.402) 36.663 27.488 ( -0.573 -0.391 -0.117) 0.703 27.518 ( 2.229 1.936 -0.279) 2.965 27.933 ( 1.029 0.560 -0.059) 1.173 28.627 ( -7.306 -9.295 1.667) 11.940 28.709 ( -3.673 -0.186 0.690) 3.742 29.283 ( -1.347 1.844 0.356) 2.312 29.332 ( 4.698 3.337 -0.877) 5.828 29.840 ( -4.536 -3.153 -0.017) 5.524 29.995 ( 2.089 0.911 0.276) 2.295 30.090 ( 1.180 0.114 -0.791) 1.426 30.437 ( 1.652 -1.600 -0.426) 2.339 30.543 ( 2.922 4.657 -0.534) 5.524 30.834 ( -0.147 -0.581 0.986) 1.154 32.655 ( -24.067 -13.814 7.995) 28.879 ======================= Grid point 148 (37/90) ======================= q-point: ( 0.25 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.871 ( -2.428 14.493 16.957) 22.438 1.398 ( 0.196 3.555 15.329) 15.737 1.791 ( -0.477 -2.020 -8.285) 8.541 2.333 ( -6.464 -4.432 -1.407) 7.963 2.463 ( 3.350 2.732 9.585) 10.515 2.532 ( 1.936 -0.882 2.022) 2.935 2.592 ( 6.333 -7.829 0.128) 10.070 2.844 ( -3.191 3.077 3.592) 5.706 3.000 ( 2.413 0.064 2.660) 3.592 3.164 ( 4.887 -1.203 1.479) 5.246 3.297 ( 21.625 14.395 2.344) 26.083 4.135 ( 0.535 1.983 -3.620) 4.162 4.337 ( 0.780 -5.518 -0.323) 5.582 4.547 ( -8.262 4.278 -4.677) 10.413 4.695 ( 2.470 -1.746 -3.056) 4.299 5.028 ( 11.364 6.154 -5.498) 14.044 5.227 ( 3.831 2.258 -0.195) 4.451 5.409 ( 7.710 -5.570 0.036) 9.511 5.883 ( 8.468 10.776 2.627) 13.955 6.109 ( 7.896 -4.695 1.381) 9.290 6.386 ( 11.321 18.740 -3.358) 22.150 6.828 ( 13.806 3.620 -14.106) 20.067 7.340 ( -7.334 -0.772 11.824) 13.935 7.679 ( -6.374 1.632 -4.318) 7.870 7.918 ( -15.162 -5.596 4.783) 16.854 8.163 ( 12.855 -2.979 -11.874) 17.751 8.257 ( -6.709 3.972 -0.654) 7.825 8.642 ( -7.525 -1.931 -0.024) 7.769 8.896 ( -12.610 -2.714 1.168) 12.951 9.194 ( -5.255 -10.770 1.053) 12.030 9.399 ( -11.972 -3.654 1.877) 12.657 9.470 ( -15.507 -20.917 -1.334) 26.072 9.834 ( -12.577 -8.856 -1.093) 15.421 10.791 ( -10.359 0.215 2.946) 10.772 10.946 ( -3.076 -5.989 1.031) 6.812 11.544 ( -6.136 -3.772 -4.107) 8.291 11.913 ( -4.505 3.752 -2.749) 6.475 12.413 ( 6.676 -9.962 -4.138) 12.686 12.631 ( 1.331 2.415 -0.652) 2.833 12.931 ( -14.374 17.121 -1.324) 22.394 13.404 ( 10.694 -11.105 0.262) 15.420 14.265 ( 4.917 4.774 -0.085) 6.853 14.580 ( 19.703 2.779 -2.708) 20.082 14.956 ( 15.314 5.370 -0.275) 16.231 15.208 ( 7.653 15.361 -0.382) 17.166 16.508 ( 4.695 4.481 2.399) 6.920 17.751 ( -10.839 -4.332 -2.406) 11.918 18.981 ( -6.277 -13.272 -1.791) 14.790 19.156 ( -5.577 6.650 -3.115) 9.221 20.958 ( 0.205 -0.691 0.752) 1.042 21.297 ( 0.474 -2.796 -1.201) 3.080 21.711 ( 16.868 10.748 0.572) 20.010 22.442 ( 6.686 3.489 5.223) 9.174 26.799 ( 3.587 2.531 0.129) 4.392 27.448 ( -2.981 -0.518 -0.302) 3.041 27.514 ( 3.735 -0.731 -2.160) 4.376 27.831 ( 19.824 19.594 -13.596) 31.012 27.963 ( 2.884 0.275 -0.432) 2.929 28.388 ( -9.127 -8.319 3.750) 12.907 28.663 ( 1.575 -4.117 0.244) 4.415 29.262 ( -4.226 3.509 0.237) 5.498 29.461 ( 6.039 3.702 -5.233) 8.807 29.723 ( -5.748 -3.346 -2.382) 7.065 29.983 ( -2.230 -2.273 -4.482) 5.498 30.154 ( 5.897 0.359 2.847) 6.558 30.479 ( 3.511 0.384 0.602) 3.583 30.637 ( 1.799 5.262 -0.785) 5.616 30.833 ( 1.650 -0.642 1.595) 2.383 32.063 ( -26.958 -15.388 15.173) 34.550 ======================= Grid point 149 (38/90) ======================= q-point: ( 0.38 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.035 ( 6.079 11.608 6.595) 14.670 1.450 ( 0.776 8.087 7.438) 11.015 1.840 ( 5.947 2.165 -1.620) 6.533 2.188 ( -7.058 -1.538 -2.261) 7.569 2.394 ( -5.990 -1.391 -3.576) 7.113 2.500 ( -6.562 -0.768 0.933) 6.672 2.622 ( 5.725 -7.965 1.763) 9.966 2.873 ( 0.256 3.836 8.433) 9.268 3.043 ( 3.057 -1.448 7.545) 8.269 3.169 ( 1.150 -5.809 5.050) 7.782 3.684 ( 13.068 0.134 -0.838) 13.096 4.148 ( -3.803 -9.466 -3.476) 10.778 4.298 ( 3.098 5.800 -2.981) 7.219 4.567 ( 4.475 10.999 3.990) 12.527 4.852 ( 11.634 1.310 -0.197) 11.709 5.220 ( 0.747 1.638 -2.574) 3.141 5.333 ( 8.645 -6.648 4.587) 11.831 5.555 ( 14.522 12.939 -2.619) 19.626 6.100 ( 6.902 -3.939 0.762) 7.983 6.227 ( 5.139 9.966 2.072) 11.403 6.754 ( 6.978 17.316 -3.063) 18.919 7.085 ( 13.867 -4.419 -9.593) 17.431 7.218 ( -6.153 3.007 2.016) 7.139 7.354 ( -24.881 -7.208 3.081) 26.087 7.734 ( -5.535 4.190 -2.549) 7.395 8.156 ( -7.278 0.888 -4.517) 8.612 8.245 ( 2.780 -7.109 -10.409) 12.908 8.503 ( -8.283 0.860 -6.590) 10.620 8.767 ( -2.352 -1.543 -0.009) 2.813 8.831 ( -21.455 -10.891 -0.873) 24.077 8.958 ( -6.327 -13.147 -1.770) 14.697 9.403 ( 1.625 -3.632 5.301) 6.628 9.653 ( -0.816 -5.283 -0.047) 5.346 10.602 ( -10.500 0.356 3.456) 11.060 10.831 ( -1.740 -8.466 4.513) 9.751 11.338 ( -8.751 -5.573 -1.587) 10.495 12.003 ( 5.627 6.414 -0.560) 8.550 12.387 ( -3.422 -0.842 -5.956) 6.920 12.619 ( -1.947 0.734 -0.460) 2.132 12.987 ( 0.906 9.901 0.819) 9.976 13.447 ( 6.037 -8.639 0.365) 10.545 14.326 ( -0.346 1.353 -0.703) 1.563 14.881 ( 15.050 -0.792 -0.362) 15.075 15.179 ( 7.741 1.083 -0.239) 7.820 15.429 ( 2.296 10.077 -1.480) 10.440 16.724 ( 11.531 10.928 -1.404) 15.949 17.452 ( -18.287 -5.745 -3.684) 19.520 18.797 ( -2.600 -8.671 -1.136) 9.123 19.193 ( 0.577 6.895 -4.899) 8.478 20.934 ( -0.316 -2.764 1.266) 3.057 21.203 ( -5.149 -2.864 -0.699) 5.933 22.097 ( 14.998 7.459 2.061) 16.877 22.582 ( 4.803 2.979 4.476) 7.210 26.891 ( 3.755 3.069 0.267) 4.857 27.365 ( -4.169 -3.076 0.246) 5.187 27.532 ( 0.109 -1.058 -0.717) 1.283 27.964 ( 0.791 0.028 1.169) 1.412 28.206 ( -5.759 -2.976 4.155) 7.700 28.273 ( 9.557 14.049 -7.190) 18.450 28.696 ( 6.989 -4.351 -1.589) 8.385 29.219 ( -4.331 3.286 0.191) 5.440 29.552 ( -2.132 -4.509 -6.738) 8.384 29.631 ( 2.227 3.348 -8.033) 8.983 29.912 ( -2.232 -3.778 -5.629) 7.137 30.253 ( 4.470 0.357 3.471) 5.671 30.548 ( 3.577 1.509 0.682) 3.942 30.662 ( -2.212 0.906 -0.135) 2.394 30.925 ( 7.491 4.219 3.435) 9.259 31.523 ( -21.092 -12.219 13.874) 28.047 ======================= Grid point 150 (39/90) ======================= q-point: (-0.50 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.250 ( 8.677 3.913 1.012) 9.572 1.610 ( 6.345 11.812 0.222) 13.410 1.978 ( 4.396 5.536 2.869) 7.629 2.089 ( -3.981 2.383 -2.927) 5.486 2.242 ( -10.443 -2.086 -3.352) 11.164 2.424 ( -0.318 0.733 3.606) 3.693 2.629 ( 4.034 -7.149 3.550) 8.944 2.872 ( -4.013 2.313 8.405) 9.597 3.040 ( 0.120 -5.200 10.125) 11.382 3.133 ( 2.194 -6.225 2.387) 7.019 3.839 ( 7.416 1.435 -5.081) 9.103 3.943 ( -6.816 -12.768 -2.739) 14.730 4.349 ( -0.378 0.383 -4.096) 4.131 4.813 ( 8.474 5.706 9.477) 13.934 4.987 ( 4.367 -3.837 0.375) 5.825 5.145 ( -4.478 -4.772 2.734) 7.092 5.354 ( -3.306 -1.233 4.217) 5.498 5.908 ( 1.874 -4.243 -2.943) 5.493 6.198 ( 14.467 15.506 0.923) 21.227 6.299 ( -9.279 3.308 -0.168) 9.853 6.773 ( -9.449 -16.860 -0.352) 19.330 6.848 ( -5.065 3.175 -3.696) 7.028 7.187 ( 0.298 9.867 -0.542) 9.887 7.504 ( 6.924 7.485 -0.213) 10.198 7.580 ( -12.620 -1.517 -10.478) 16.473 8.069 ( -2.355 -0.023 -9.438) 9.728 8.197 ( -3.848 -1.438 -4.049) 5.768 8.417 ( 4.443 2.476 -8.155) 9.611 8.575 ( -2.367 8.502 0.072) 8.826 8.726 ( -4.116 -2.772 -1.086) 5.080 8.952 ( 14.761 -8.029 -2.419) 16.976 9.352 ( -0.588 -8.077 5.025) 9.531 9.691 ( 7.418 -0.496 0.001) 7.435 10.551 ( 2.682 6.500 2.137) 7.349 10.743 ( -1.336 -3.684 7.664) 8.608 11.220 ( -1.324 -1.217 -0.219) 1.812 12.099 ( 0.451 -1.060 -1.797) 2.135 12.326 ( -6.761 7.384 -4.342) 10.913 12.616 ( -0.159 2.974 -0.399) 3.005 13.061 ( 4.800 -6.133 1.392) 7.911 13.458 ( 1.065 -0.328 0.284) 1.150 14.300 ( -1.219 -2.886 -1.006) 3.291 15.053 ( 5.198 1.696 1.418) 5.648 15.252 ( 1.194 -1.581 0.110) 1.984 15.447 ( -5.237 -1.666 -2.775) 6.157 17.047 ( 3.395 4.905 -3.930) 7.143 17.084 ( -8.025 0.551 -3.151) 8.639 18.736 ( -0.633 1.561 -0.889) 1.904 19.247 ( 0.809 -0.274 -5.587) 5.652 20.914 ( 3.260 -5.999 1.326) 6.955 21.133 ( -3.237 4.685 -0.233) 5.700 22.281 ( 2.112 -1.024 2.911) 3.739 22.625 ( -1.513 -0.137 3.756) 4.051 26.949 ( -0.010 0.212 0.339) 0.400 27.297 ( -0.365 -0.435 0.554) 0.794 27.519 ( -0.153 -0.432 -0.266) 0.530 27.984 ( 1.878 -0.709 1.440) 2.471 28.108 ( -4.903 -0.169 3.343) 5.936 28.458 ( 3.384 3.255 -1.268) 4.863 28.786 ( 2.905 3.922 -3.225) 5.850 29.200 ( -0.088 0.977 0.202) 1.001 29.405 ( -7.037 -4.427 -7.554) 11.233 29.760 ( 6.669 1.353 -10.963) 12.903 29.847 ( -0.849 -3.009 -4.984) 5.884 30.286 ( 0.052 -1.200 2.258) 2.557 30.588 ( -4.945 3.328 0.102) 5.962 30.653 ( 5.641 -2.112 3.421) 6.927 31.029 ( -8.334 -2.687 3.737) 9.521 31.252 ( 6.513 2.610 11.359) 13.351 ======================= Grid point 152 (40/90) ======================= q-point: (-0.38 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.343 ( 0.434 -1.012 0.096) 1.105 1.787 ( 1.068 6.941 -2.170) 7.350 1.962 ( -14.279 1.967 5.684) 15.494 2.143 ( 1.024 8.411 -2.908) 8.959 2.169 ( 10.378 0.794 -2.119) 10.622 2.489 ( 5.993 -1.188 5.784) 8.413 2.633 ( 3.251 -3.707 4.728) 6.831 2.787 ( -6.225 -0.551 13.193) 14.599 2.982 ( -1.529 -3.145 3.669) 5.068 3.104 ( 0.812 -5.605 1.020) 5.754 3.639 ( -14.475 -15.283 -1.240) 21.086 3.989 ( 7.057 3.726 -5.727) 9.822 4.322 ( -1.359 -0.298 -3.985) 4.221 4.821 ( -0.979 -11.106 3.201) 11.599 4.953 ( -10.230 -2.315 6.853) 12.529 5.050 ( -0.010 2.276 -1.452) 2.700 5.246 ( -3.617 -3.042 0.535) 4.757 5.649 ( -15.641 -12.714 -2.409) 20.300 6.102 ( -10.901 -1.417 3.706) 11.600 6.532 ( -6.056 -17.772 -3.547) 19.107 6.615 ( 7.504 13.892 -0.699) 15.805 6.672 ( -12.681 -3.651 -2.942) 13.520 7.295 ( -4.660 -1.297 -3.616) 6.039 7.466 ( 7.837 10.259 -1.613) 13.010 7.646 ( 4.344 11.510 -4.820) 13.213 8.083 ( 1.219 2.677 -7.545) 8.098 8.163 ( -1.877 5.870 0.891) 6.227 8.591 ( 1.170 3.091 -9.786) 10.330 8.656 ( 4.357 3.795 0.998) 5.863 8.876 ( 20.785 10.267 2.274) 23.294 9.196 ( 20.668 -2.934 -3.878) 21.232 9.287 ( 3.715 -7.718 3.004) 9.077 9.840 ( 10.009 0.317 1.192) 10.085 10.703 ( 4.589 -0.950 5.101) 6.927 10.821 ( 8.986 15.551 2.476) 18.130 11.268 ( 5.408 3.852 -1.562) 6.821 12.005 ( -4.574 -7.326 -1.910) 8.845 12.299 ( -8.555 13.013 -4.084) 16.100 12.661 ( 0.054 4.497 -1.007) 4.608 13.029 ( 8.439 -21.790 0.527) 23.373 13.471 ( -5.003 8.278 -0.426) 9.682 14.248 ( -0.756 -4.041 -0.323) 4.124 15.069 ( -9.492 3.653 -1.332) 10.257 15.177 ( -6.401 -4.722 -0.297) 7.960 15.242 ( -8.212 -12.806 -1.047) 15.249 16.719 ( -15.083 -5.172 -1.163) 15.988 17.421 ( 15.723 9.320 -3.496) 18.609 18.805 ( 1.474 11.220 -1.324) 11.393 19.210 ( 0.097 -7.047 -4.361) 8.288 20.928 ( 5.607 -6.794 1.278) 8.901 21.185 ( 0.269 9.585 -0.746) 9.618 22.137 ( -12.445 -9.435 2.339) 15.791 22.543 ( -5.827 -3.164 4.439) 7.979 26.894 ( -3.846 -2.874 0.255) 4.808 27.349 ( 3.865 2.711 0.370) 4.735 27.523 ( -0.055 0.985 -0.577) 1.143 27.997 ( 0.303 -1.942 0.550) 2.041 28.017 ( -6.949 0.648 0.807) 7.026 28.498 ( 4.440 -5.497 -0.809) 7.112 28.804 ( -7.725 5.220 -7.711) 12.099 29.229 ( 5.894 -5.920 0.830) 8.395 29.287 ( -6.157 5.631 -4.485) 9.473 29.776 ( -0.481 -2.093 -4.412) 4.907 29.909 ( 5.882 0.373 -7.499) 9.538 30.252 ( -0.727 -3.599 0.156) 3.674 30.505 ( -6.851 1.476 4.032) 8.086 30.740 ( 5.002 -0.637 2.725) 5.731 30.809 ( -8.950 -3.698 0.040) 9.684 31.581 ( 19.499 11.395 13.023) 26.070 ======================= Grid point 153 (41/90) ======================= q-point: (-0.25 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.244 ( -12.566 1.089 4.265) 13.314 1.719 ( -17.065 4.894 10.585) 20.669 1.801 ( 1.242 -6.555 -1.890) 6.935 2.269 ( 6.372 3.311 -1.190) 7.279 2.298 ( 1.525 -6.939 11.492) 13.511 2.543 ( 2.019 2.271 0.341) 3.058 2.576 ( -0.272 -8.674 9.787) 13.080 2.805 ( 3.104 6.748 4.781) 8.833 2.930 ( -2.462 -2.334 -2.745) 4.364 3.051 ( -1.610 -4.169 0.244) 4.476 3.237 ( -15.429 -7.230 -0.050) 17.040 4.106 ( 2.662 1.985 -3.759) 5.015 4.357 ( 4.986 -1.977 -5.977) 8.030 4.705 ( -5.930 0.197 1.612) 6.148 4.755 ( -5.017 -2.919 -2.135) 6.184 5.081 ( 2.912 -1.443 -3.505) 4.780 5.175 ( -7.498 -0.683 -1.550) 7.687 5.278 ( -8.350 -10.884 -2.164) 13.888 5.915 ( -7.619 -5.453 4.118) 10.235 6.183 ( -13.892 -10.182 1.439) 17.284 6.443 ( -12.027 -3.444 -5.779) 13.781 6.702 ( -4.050 -1.807 -9.778) 10.737 7.302 ( 3.761 5.061 8.481) 10.568 7.583 ( 3.216 5.461 -6.371) 8.987 7.909 ( 9.153 -0.684 -2.602) 9.541 8.145 ( 2.085 0.431 -3.568) 4.155 8.224 ( -1.274 12.701 5.882) 14.054 8.607 ( 3.819 2.669 -1.395) 4.864 8.899 ( 10.527 11.217 -1.108) 15.423 9.259 ( 10.082 1.305 2.630) 10.501 9.271 ( 8.184 -0.106 1.228) 8.277 9.628 ( 25.380 3.955 -1.773) 25.747 10.029 ( 11.770 0.889 -1.251) 11.870 10.808 ( 6.022 3.837 3.310) 7.870 11.099 ( 4.586 10.524 -1.558) 11.585 11.420 ( 6.825 3.939 -4.865) 9.261 11.896 ( -0.968 -3.059 -2.297) 3.946 12.308 ( -6.175 16.416 -2.998) 17.793 12.657 ( -2.143 -3.105 -0.658) 3.830 13.001 ( 16.158 -21.197 -1.868) 26.718 13.424 ( -12.214 11.522 -1.488) 16.857 14.190 ( -3.476 -2.407 0.763) 4.296 14.710 ( -20.169 -18.734 -6.727) 28.337 14.937 ( -12.442 -9.153 1.107) 15.485 15.074 ( -9.561 1.939 2.708) 10.125 16.507 ( -5.846 -1.956 2.607) 6.693 17.727 ( 11.063 5.919 -2.373) 12.769 18.990 ( 5.273 14.634 -1.974) 15.680 19.173 ( 4.830 -6.371 -2.632) 8.417 20.949 ( 2.546 -4.464 0.643) 5.179 21.267 ( -1.482 4.459 -1.081) 4.822 21.760 ( -16.893 -11.507 0.652) 20.450 22.404 ( -5.458 -3.469 5.552) 8.523 26.801 ( -3.712 -2.427 0.117) 4.437 27.427 ( 2.630 -0.127 -0.746) 2.737 27.515 ( -2.895 1.523 -1.631) 3.655 27.782 ( -19.706 -7.295 -9.647) 23.122 27.973 ( -1.851 -1.083 0.201) 2.154 28.535 ( 8.848 -8.841 -2.599) 12.775 28.705 ( -5.203 4.729 -2.935) 7.619 29.273 ( 2.688 -1.958 -0.083) 3.327 29.286 ( -2.422 7.118 0.857) 7.568 29.778 ( 2.267 0.029 -1.024) 2.487 29.979 ( 2.127 -0.006 -3.918) 4.458 30.194 ( -1.984 -4.445 -1.476) 5.087 30.423 ( -2.569 -0.201 2.626) 3.680 30.660 ( -6.614 -1.079 -0.265) 6.707 30.804 ( 2.760 -0.321 0.762) 2.882 32.086 ( 25.476 14.917 14.636) 32.951 ======================= Grid point 154 (42/90) ======================= q-point: (-0.12 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.012 ( -12.705 4.186 15.944) 20.812 1.439 ( -15.941 -8.428 18.521) 25.849 1.732 ( -0.803 -6.422 2.147) 6.819 2.177 ( -3.904 -2.077 31.168) 31.480 2.399 ( 7.465 -0.990 -2.415) 7.909 2.566 ( 5.568 -5.827 -0.870) 8.106 2.606 ( 0.217 2.572 -2.790) 3.801 2.763 ( -11.763 0.206 -2.911) 12.120 2.904 ( 1.119 3.428 0.471) 3.637 2.994 ( -1.513 -0.805 -1.616) 2.355 3.078 ( -3.362 -1.808 -2.335) 4.475 4.135 ( 0.956 -0.603 -3.616) 3.788 4.256 ( -8.009 -6.195 -2.572) 10.447 4.689 ( -2.172 -2.314 -3.803) 4.953 4.804 ( 5.861 5.811 -12.370) 14.871 5.035 ( -0.386 6.932 -2.033) 7.234 5.146 ( 8.184 -5.375 -3.726) 10.476 5.205 ( -1.816 1.494 -1.373) 2.723 5.789 ( -0.222 -3.579 0.519) 3.624 5.946 ( -6.576 -3.053 1.691) 7.444 6.184 ( -14.079 -5.891 -5.313) 16.160 6.572 ( -4.713 -3.341 -11.471) 12.844 7.454 ( 6.019 4.835 18.178) 19.750 7.674 ( 0.187 6.856 -8.703) 11.081 7.898 ( -2.654 -11.035 -9.015) 14.494 8.194 ( 6.046 -0.274 2.464) 6.535 8.298 ( -1.889 6.598 5.425) 8.749 8.754 ( 7.725 3.750 6.046) 10.502 9.131 ( 4.546 9.070 1.136) 10.209 9.258 ( 1.784 -5.444 2.178) 6.129 9.521 ( 8.903 5.107 0.144) 10.265 10.043 ( 16.254 6.773 0.293) 17.611 10.195 ( 5.224 -0.269 -3.690) 6.402 10.906 ( 1.439 1.254 3.135) 3.671 11.051 ( -11.352 -3.037 -4.300) 12.513 11.581 ( 3.647 2.309 -5.817) 7.244 11.976 ( 12.993 7.189 -2.537) 15.065 12.322 ( -6.234 0.618 -0.776) 6.312 12.624 ( 0.655 0.014 -0.947) 1.151 13.189 ( 20.663 -5.046 -1.408) 21.316 13.339 ( -7.461 12.229 -1.183) 14.375 14.031 ( -12.873 -5.430 0.549) 13.982 14.164 ( -21.184 -19.782 -2.994) 29.139 14.641 ( -11.119 -5.942 1.204) 12.665 14.954 ( -5.226 0.442 3.901) 6.537 16.463 ( 0.146 0.245 4.560) 4.569 17.881 ( 3.346 1.887 -1.285) 4.050 19.229 ( 8.322 8.883 -1.864) 12.314 19.265 ( 7.921 1.076 -1.626) 8.157 20.911 ( -2.801 -2.177 -0.416) 3.572 21.085 ( -14.667 -9.596 -0.458) 17.533 21.551 ( -1.477 -0.333 -1.531) 2.153 22.340 ( 0.210 -0.146 3.566) 3.575 26.734 ( -2.126 -1.194 0.030) 2.438 27.121 ( -29.691 -16.028 -12.101) 35.845 27.490 ( -0.252 1.211 -0.236) 1.260 27.516 ( -2.025 -1.929 -0.252) 2.808 27.935 ( -1.259 -0.725 -0.066) 1.454 28.641 ( 8.894 -1.082 -0.122) 8.961 28.730 ( 0.798 3.568 0.733) 3.729 29.275 ( -1.187 1.609 0.142) 2.004 29.304 ( -0.973 0.356 0.958) 1.411 29.846 ( 4.257 1.797 0.703) 4.674 29.984 ( -0.937 -0.856 -0.056) 1.271 30.112 ( -2.956 -2.149 -1.457) 3.935 30.419 ( 2.060 -0.835 -0.303) 2.243 30.549 ( -5.666 -0.824 -0.508) 5.748 30.832 ( 0.879 0.008 0.949) 1.293 32.659 ( 23.535 13.671 7.880) 28.335 ======================= Grid point 156 (43/90) ======================= q-point: ( 0.12 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.240 ( -0.603 22.671 6.018) 23.464 1.457 ( -10.596 9.223 16.949) 22.014 1.787 ( 1.591 1.291 -5.078) 5.475 2.280 ( 6.605 -0.972 17.099) 18.356 2.388 ( 5.691 -2.700 0.558) 6.324 2.466 ( -0.136 3.738 7.399) 8.290 2.581 ( -3.013 -1.723 -3.112) 4.662 2.931 ( 0.566 2.511 -0.187) 2.581 2.953 ( 5.865 -0.788 3.348) 6.799 2.975 ( 3.365 -2.151 -3.905) 5.586 3.197 ( 6.238 7.646 2.368) 10.148 4.159 ( 3.057 2.962 -2.739) 5.061 4.277 ( -2.397 -1.055 -3.193) 4.130 4.682 ( -2.405 1.183 -2.124) 3.420 4.716 ( -5.597 -2.257 -6.748) 9.053 4.979 ( -3.378 1.886 -3.696) 5.350 5.169 ( 6.741 6.252 -0.711) 9.221 5.295 ( 6.119 0.907 -2.243) 6.580 5.893 ( 8.315 12.896 4.220) 15.914 6.016 ( -0.974 5.591 1.918) 5.991 6.391 ( 6.805 14.790 -5.355) 17.138 6.706 ( 7.251 7.226 -12.936) 16.496 7.378 ( -1.578 -6.111 12.617) 14.108 7.755 ( 1.463 -9.574 -1.882) 9.866 7.853 ( 4.145 0.766 -11.961) 12.682 8.104 ( -4.259 1.315 0.435) 4.478 8.352 ( -0.311 0.437 1.774) 1.853 8.669 ( -0.592 -5.561 4.564) 7.218 9.041 ( -7.552 -12.450 0.429) 14.568 9.158 ( -4.037 -3.211 3.254) 6.099 9.371 ( -2.059 -13.089 0.371) 13.255 9.657 ( -17.782 -20.732 0.618) 27.320 9.956 ( -13.669 -11.725 -3.828) 18.411 10.853 ( -2.046 -5.986 2.942) 6.977 11.117 ( -10.499 8.374 -5.072) 14.355 11.607 ( 9.367 -6.027 -3.116) 11.566 11.718 ( -7.155 -13.031 -1.739) 14.968 12.418 ( -8.648 -1.033 -0.801) 8.747 12.603 ( -6.536 -9.772 -1.527) 11.855 12.930 ( 16.399 0.131 -1.866) 16.506 13.607 ( -2.400 19.616 -3.623) 20.092 14.100 ( 4.665 1.268 -0.590) 4.870 14.453 ( 7.726 16.194 -0.186) 17.944 14.848 ( 7.388 13.164 1.048) 15.132 15.168 ( 11.932 10.468 -1.339) 15.930 16.494 ( 2.738 4.548 3.022) 6.108 17.801 ( -2.945 -8.084 -1.848) 8.800 19.018 ( -13.208 -11.116 -3.349) 17.585 19.216 ( 3.822 -1.977 -0.983) 4.414 20.877 ( -1.892 -6.212 -0.135) 6.495 21.392 ( 10.535 20.276 0.469) 22.854 21.570 ( 0.692 2.991 -0.711) 3.151 22.389 ( 4.176 4.525 5.363) 8.166 26.779 ( 2.123 3.358 0.102) 3.974 27.432 ( 3.239 1.623 -3.401) 4.969 27.514 ( -2.193 1.426 -0.259) 2.629 27.718 ( 17.280 25.242 -14.355) 33.791 27.960 ( 0.655 2.439 0.039) 2.525 28.429 ( -7.914 -9.369 2.299) 12.478 28.701 ( -4.413 1.062 0.885) 4.624 29.261 ( 0.710 -3.984 -0.818) 4.128 29.421 ( 6.097 3.936 -2.176) 7.577 29.767 ( -3.221 -3.371 -0.984) 4.765 29.985 ( -0.558 -2.274 -2.895) 3.724 30.120 ( -0.946 2.688 -0.175) 2.855 30.435 ( 3.073 2.303 2.883) 4.802 30.650 ( 2.927 5.690 -1.759) 6.636 30.808 ( -0.427 -2.208 1.163) 2.532 32.234 ( -16.146 -26.492 14.051) 34.058 ======================= Grid point 157 (44/90) ======================= q-point: ( 0.25 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.310 ( -13.179 18.334 5.696) 23.286 1.525 ( 5.256 11.463 7.083) 14.463 1.794 ( -0.713 5.772 -2.563) 6.356 2.243 ( -1.775 -4.507 -0.734) 4.899 2.478 ( -3.441 -1.921 0.915) 4.046 2.506 ( 2.526 2.550 0.002) 3.590 2.566 ( 0.607 2.087 4.786) 5.256 2.885 ( -2.164 0.029 5.040) 5.485 2.989 ( 2.046 -1.483 6.925) 7.372 3.051 ( 5.206 -9.190 0.923) 10.602 3.448 ( 15.861 4.239 1.366) 16.475 4.150 ( -6.411 -6.961 -3.186) 9.985 4.297 ( 5.729 5.514 -0.472) 7.966 4.630 ( -1.553 3.376 -1.104) 3.877 4.716 ( 2.922 3.985 -1.224) 5.092 4.988 ( 6.006 -8.813 2.989) 11.077 5.358 ( 2.835 6.375 -1.370) 7.110 5.484 ( 11.531 17.154 -3.298) 20.931 6.035 ( -0.474 2.542 1.847) 3.178 6.233 ( 10.130 17.136 3.837) 20.273 6.714 ( 16.427 12.327 -1.726) 20.610 6.866 ( 5.444 0.932 -12.969) 14.096 7.286 ( -4.289 -4.995 2.523) 7.051 7.589 ( -8.619 -7.120 3.152) 11.615 7.885 ( -4.179 0.684 -7.666) 8.757 8.112 ( 2.984 0.046 -6.411) 7.071 8.301 ( -5.983 0.848 -3.793) 7.135 8.610 ( -3.366 -0.824 -3.229) 4.737 8.723 ( -8.635 -15.557 -2.985) 18.041 8.997 ( -9.398 -6.442 4.154) 12.128 9.152 ( -19.832 -14.195 2.834) 24.553 9.293 ( 3.447 -8.394 4.052) 9.938 9.632 ( -8.435 -11.364 -3.214) 14.513 10.754 ( -1.934 -5.220 4.920) 7.429 10.916 ( -18.730 5.391 -1.784) 19.572 11.468 ( -11.363 -6.582 -1.052) 13.174 11.749 ( 18.408 -17.441 0.425) 25.362 12.238 ( -6.363 -2.858 -2.974) 7.583 12.440 ( 6.814 -19.154 -0.910) 20.351 13.281 ( 9.666 15.153 -1.333) 18.022 13.631 ( -19.683 27.937 -0.494) 34.178 14.207 ( 9.720 -8.716 -3.156) 13.432 14.709 ( 9.481 9.511 1.724) 13.540 15.086 ( 7.317 8.355 0.226) 11.109 15.420 ( 7.503 4.379 -2.254) 8.975 16.682 ( 8.900 13.647 -0.941) 16.320 17.626 ( -8.560 -8.664 -2.604) 12.455 18.702 ( -7.741 -14.245 -5.068) 16.986 19.312 ( 2.137 9.593 -0.893) 9.869 20.746 ( 0.059 -16.700 -0.317) 16.703 21.493 ( -11.881 16.563 0.955) 20.406 21.861 ( 19.953 5.391 1.334) 20.711 22.537 ( 5.781 6.065 4.771) 9.643 26.864 ( 3.573 3.822 0.271) 5.239 27.413 ( -4.096 -2.227 -0.061) 4.662 27.488 ( 0.776 -3.295 -0.814) 3.482 27.972 ( -0.180 0.725 1.079) 1.312 28.222 ( 8.184 14.189 -8.382) 18.400 28.288 ( 4.138 1.878 -0.656) 4.591 28.631 ( -5.317 2.595 1.929) 6.223 29.232 ( 1.393 -5.979 -2.453) 6.611 29.513 ( 1.646 0.246 -5.304) 5.559 29.699 ( -3.229 1.285 -5.445) 6.460 29.912 ( -2.686 -4.662 -5.395) 7.619 30.179 ( 4.487 2.359 2.978) 5.879 30.520 ( 2.284 3.377 4.630) 6.169 30.710 ( -1.471 1.665 -3.560) 4.196 30.832 ( 6.311 1.372 3.240) 7.225 31.711 ( -18.573 -19.624 14.511) 30.670 ======================= Grid point 158 (45/90) ======================= q-point: ( 0.38 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.291 ( -3.166 6.577 5.012) 8.855 1.697 ( 0.476 17.078 1.068) 17.118 1.931 ( 5.982 8.274 -2.208) 10.446 2.201 ( -2.517 3.665 -0.196) 4.451 2.362 ( -7.048 -1.305 -5.126) 8.813 2.482 ( -5.686 -1.494 0.725) 5.924 2.587 ( -0.617 5.147 4.233) 6.693 2.855 ( 1.900 -9.141 10.898) 14.350 2.990 ( 1.369 -1.998 10.590) 10.864 3.042 ( 1.803 -3.634 -1.219) 4.236 3.719 ( 12.243 2.220 -3.195) 12.846 3.940 ( -7.886 -10.855 -3.058) 13.761 4.386 ( -0.657 4.082 -1.281) 4.329 4.724 ( 2.967 1.470 5.710) 6.600 4.818 ( 9.317 -2.021 1.363) 9.630 5.016 ( 7.824 -8.832 6.580) 13.510 5.439 ( 0.219 4.873 0.311) 4.888 5.778 ( 5.470 -1.225 -1.115) 5.715 6.141 ( 8.498 13.437 0.223) 15.900 6.442 ( 0.210 10.149 1.020) 10.202 6.890 ( -4.268 -2.726 -6.585) 8.307 6.938 ( -7.545 -4.648 2.861) 9.312 7.308 ( 18.610 8.759 -5.700) 21.344 7.364 ( -12.764 3.885 -3.083) 13.694 7.791 ( -9.993 1.570 -5.339) 11.439 8.101 ( -1.765 -1.171 -11.097) 11.297 8.204 ( -5.259 -0.326 -8.109) 9.671 8.532 ( -5.854 0.522 -6.727) 8.933 8.607 ( 7.003 -8.946 -2.753) 11.690 8.749 ( -6.553 -1.843 2.136) 7.135 8.864 ( -10.508 2.394 5.299) 12.010 9.242 ( 1.166 -12.096 4.717) 13.036 9.522 ( 6.374 -9.122 -0.725) 11.152 10.693 ( -11.651 7.045 0.624) 13.629 10.724 ( 1.302 0.398 7.187) 7.315 11.272 ( -6.159 -1.212 -0.302) 6.285 11.840 ( 19.030 -28.828 2.114) 34.608 12.121 ( 0.327 -12.689 -4.191) 13.367 12.464 ( 8.563 -5.629 -1.546) 10.363 13.508 ( -3.618 10.967 1.493) 11.645 13.546 ( -17.185 31.045 -1.057) 35.500 14.222 ( 3.520 -9.733 -2.048) 10.551 14.959 ( 10.028 7.519 1.657) 12.643 15.221 ( 1.982 3.207 -0.406) 3.792 15.483 ( -0.544 -3.677 -1.539) 4.023 16.989 ( 9.720 15.268 -3.234) 18.385 17.346 ( -16.957 -4.920 -3.587) 18.017 18.547 ( 6.404 -14.413 -5.330) 16.648 19.419 ( -5.101 14.638 -2.029) 15.633 20.600 ( 6.504 -21.948 -0.015) 22.892 21.461 ( -11.623 18.755 1.360) 22.106 22.152 ( 10.998 -1.427 2.654) 11.403 22.648 ( 1.196 3.378 3.750) 5.187 26.948 ( 1.819 2.127 0.510) 2.845 27.317 ( -3.068 -1.235 0.390) 3.330 27.467 ( 1.574 -4.804 -0.376) 5.069 27.972 ( 0.321 -0.082 2.148) 2.173 28.217 ( -4.555 4.392 2.412) 6.772 28.530 ( -4.937 9.707 -2.411) 11.154 28.662 ( 13.198 1.823 -0.752) 13.344 29.185 ( -0.575 -5.988 -2.411) 6.481 29.483 ( -3.262 -1.599 -8.455) 9.202 29.693 ( 1.470 0.644 -9.035) 9.176 29.844 ( -1.680 -1.561 -5.137) 5.625 30.271 ( 2.502 1.731 3.127) 4.363 30.554 ( 2.430 -2.538 3.397) 4.887 30.695 ( -3.012 4.546 -0.226) 5.458 31.009 ( 10.139 3.783 3.999) 11.537 31.274 ( -13.604 -12.909 11.247) 21.868 ======================= Grid point 159 (46/90) ======================= q-point: (-0.50 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.324 ( 1.898 2.300 5.079) 5.890 1.896 ( 0.512 13.082 -0.471) 13.101 1.993 ( 0.923 -3.019 -4.872) 5.806 2.165 ( -8.372 -3.360 1.694) 9.178 2.321 ( -1.382 18.596 -5.497) 19.440 2.431 ( 0.442 0.547 3.755) 3.820 2.614 ( -1.428 4.231 5.087) 6.769 2.790 ( 1.498 -8.250 13.421) 15.825 2.988 ( -0.280 -1.434 4.842) 5.057 3.026 ( 0.497 -3.802 0.682) 3.895 3.670 ( -8.554 -14.798 -3.414) 17.430 3.928 ( 7.841 5.845 -4.640) 10.825 4.377 ( -4.101 2.336 0.248) 4.726 4.685 ( 0.884 -9.587 3.117) 10.119 4.944 ( 5.494 -3.512 7.525) 9.958 5.013 ( 0.066 -8.871 3.160) 9.417 5.381 ( -8.455 1.101 -0.269) 8.531 5.772 ( -2.370 -3.891 -0.730) 4.614 6.258 ( -3.676 -4.669 0.275) 5.949 6.553 ( -18.217 4.670 0.682) 18.819 6.648 ( 5.891 10.852 1.871) 12.489 6.816 ( -8.301 -4.082 -3.665) 9.950 7.268 ( -0.816 -1.677 -6.712) 6.966 7.615 ( -5.806 2.342 -6.599) 9.096 7.685 ( 2.618 13.044 -5.475) 14.386 8.107 ( -1.480 2.250 -11.434) 11.747 8.204 ( 7.819 3.933 -3.571) 9.453 8.509 ( 3.660 4.304 -0.656) 5.688 8.659 ( -1.275 -2.121 -2.032) 3.202 8.721 ( 8.503 -0.573 -2.077) 8.772 8.902 ( 8.683 8.143 -0.287) 11.908 9.150 ( 3.191 -11.036 3.310) 11.956 9.606 ( 12.300 -8.151 2.647) 14.991 10.646 ( 0.091 1.385 4.827) 5.022 10.867 ( 6.090 15.881 4.673) 17.639 11.251 ( 0.811 4.665 -1.557) 4.985 11.859 ( 19.739 -32.408 1.551) 37.978 12.010 ( 2.013 -12.398 -3.579) 13.060 12.536 ( 5.645 -6.534 -2.111) 8.889 13.361 ( -22.643 18.585 0.614) 29.300 13.692 ( -2.661 19.259 -1.741) 19.519 14.180 ( 1.518 -6.353 0.496) 6.551 15.124 ( 1.186 -4.594 1.677) 5.033 15.221 ( -2.535 4.092 -2.368) 5.364 15.337 ( -9.212 -5.867 -1.065) 10.973 16.994 ( -20.439 -1.597 -3.377) 20.778 17.287 ( 11.277 10.859 -3.350) 16.009 18.619 ( 15.166 -10.391 -4.662) 18.966 19.385 ( -13.333 10.990 -2.522) 17.462 20.589 ( 14.370 -16.427 0.329) 21.828 21.474 ( -9.254 19.812 0.998) 21.890 22.163 ( -3.090 -10.589 3.073) 11.451 22.633 ( -5.083 0.746 3.569) 6.255 26.936 ( -3.257 -1.016 0.531) 3.453 27.330 ( 2.414 3.409 0.144) 4.180 27.464 ( 3.757 -4.440 -0.069) 5.817 27.980 ( 0.876 -0.653 2.106) 2.372 28.176 ( -6.940 7.398 2.029) 10.345 28.463 ( -5.151 -2.204 -0.649) 5.641 28.909 ( 7.778 7.842 -3.389) 11.554 29.066 ( -3.175 -12.158 -2.341) 12.782 29.437 ( -2.924 4.734 -7.191) 9.093 29.735 ( 3.277 -3.251 -8.139) 9.357 29.833 ( 1.472 1.427 -5.660) 6.019 30.261 ( -3.116 -1.325 2.057) 3.962 30.586 ( 2.623 -3.017 3.533) 5.335 30.691 ( -2.473 5.601 2.586) 6.647 30.928 ( -10.324 -5.894 2.158) 12.083 31.333 ( 18.133 3.607 10.681) 21.352 ======================= Grid point 160 (47/90) ======================= q-point: (-0.38 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.388 ( 0.192 4.929 5.510) 7.395 1.733 ( -9.808 -13.093 -3.849) 16.806 1.949 ( -10.445 -7.442 4.714) 13.664 2.157 ( 7.728 5.372 0.737) 9.440 2.402 ( -6.824 8.691 5.385) 12.292 2.511 ( 3.761 4.337 -3.221) 6.583 2.590 ( -4.268 -2.194 8.611) 9.858 2.819 ( 4.766 7.204 8.306) 11.983 2.957 ( -1.572 -0.614 0.738) 1.842 2.991 ( 0.798 -5.158 -0.237) 5.225 3.392 ( -10.723 -7.104 0.496) 12.873 4.110 ( 5.622 7.188 -3.424) 9.746 4.299 ( -3.754 -3.031 -1.508) 5.055 4.646 ( 2.723 -3.539 0.773) 4.532 4.839 ( -6.318 -8.347 -1.086) 10.525 4.972 ( 3.372 -5.786 3.183) 7.415 5.306 ( -4.774 4.916 -1.876) 7.105 5.500 ( -22.418 -3.310 -2.973) 22.855 6.107 ( -9.261 -1.227 5.398) 10.789 6.260 ( -15.348 -7.622 0.543) 17.145 6.619 ( -10.757 -0.071 -4.163) 11.534 6.799 ( -2.758 5.421 -6.918) 9.212 7.288 ( 3.081 0.320 -0.260) 3.108 7.565 ( 2.678 3.997 -0.107) 4.813 7.842 ( 1.880 5.466 -10.187) 11.713 8.125 ( 0.886 0.498 -4.498) 4.612 8.324 ( 0.838 5.606 1.965) 6.000 8.599 ( -0.624 1.443 -2.675) 3.103 8.726 ( 16.978 1.206 -0.924) 17.046 9.077 ( 17.468 6.095 1.884) 18.597 9.138 ( 7.580 -4.059 4.493) 9.701 9.199 ( 20.675 3.739 -4.747) 21.540 9.755 ( 14.987 -8.087 1.158) 17.069 10.715 ( 6.305 1.909 3.900) 7.656 11.154 ( 5.073 14.728 1.936) 15.697 11.319 ( 7.433 -1.894 -4.333) 8.809 11.798 ( 2.037 -18.351 0.489) 18.470 12.130 ( 20.961 0.148 -1.972) 21.054 12.525 ( 6.220 -14.165 -2.132) 15.617 13.135 ( -23.234 14.299 -0.575) 27.287 13.787 ( -9.431 17.680 -4.181) 20.469 14.145 ( 1.398 -7.273 1.749) 7.610 14.828 ( -15.130 -17.900 -2.169) 23.537 15.099 ( -12.791 -2.095 0.748) 12.983 15.282 ( -5.815 8.610 -1.311) 10.472 16.672 ( -15.927 -0.255 -0.644) 15.942 17.577 ( 12.902 6.437 -2.725) 14.674 18.808 ( 17.134 -7.975 -4.179) 19.355 19.251 ( -10.987 7.507 -1.493) 13.391 20.725 ( 13.762 -6.533 0.096) 15.234 21.516 ( -8.351 17.833 0.172) 19.692 21.872 ( -14.126 -16.801 2.087) 22.049 22.514 ( -8.656 0.083 4.695) 9.847 26.856 ( -4.683 -0.716 0.271) 4.746 27.406 ( 2.008 2.738 -0.596) 3.447 27.500 ( 3.932 -2.624 -0.017) 4.727 27.977 ( -1.640 -0.263 0.364) 1.700 28.108 ( -13.541 7.791 -3.411) 15.990 28.354 ( 0.664 -7.786 -1.732) 8.004 28.812 ( -8.260 -7.512 -5.752) 12.560 29.135 ( 8.772 2.384 0.230) 9.093 29.453 ( -3.291 6.625 -3.480) 8.175 29.735 ( 0.982 -1.586 -3.527) 3.990 29.912 ( 5.610 -0.006 -6.341) 8.466 30.185 ( -2.900 -2.843 1.020) 4.187 30.521 ( -6.652 0.101 5.700) 8.761 30.742 ( 2.139 -0.571 -2.322) 3.208 30.766 ( -5.037 0.741 1.953) 5.452 31.736 ( 25.621 3.824 14.099) 29.493 ======================= Grid point 165 (48/90) ======================= q-point: ( 0.25 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.349 ( -2.195 -4.055 5.474) 7.157 1.872 ( 0.236 16.413 -2.887) 16.667 1.978 ( -1.787 6.650 0.008) 6.886 2.186 ( 6.226 0.137 1.226) 6.347 2.425 ( -2.776 -2.569 0.125) 3.784 2.547 ( -1.160 -0.773 -0.053) 1.395 2.696 ( 0.964 2.565 4.278) 5.080 2.738 ( 0.952 -3.488 2.061) 4.161 2.972 ( 3.098 -0.575 3.552) 4.749 2.980 ( -0.935 1.075 6.828) 6.975 3.521 ( 7.852 4.927 -1.832) 9.449 3.983 ( -7.010 -9.917 -3.880) 12.749 4.402 ( 3.955 5.556 4.739) 8.305 4.663 ( 7.056 0.127 2.758) 7.577 4.813 ( -8.094 4.700 1.189) 9.435 4.877 ( -1.591 -2.768 5.505) 6.364 5.421 ( 4.778 2.925 -0.407) 5.617 5.746 ( -0.191 0.321 -0.433) 0.572 6.167 ( 3.455 12.771 0.179) 13.231 6.547 ( 1.895 14.197 1.653) 14.418 6.799 ( 12.127 3.347 -2.288) 12.787 6.885 ( 6.545 -2.650 0.661) 7.092 7.219 ( -0.829 1.923 -8.962) 9.203 7.581 ( -6.029 2.408 -3.255) 7.262 7.878 ( 2.555 -1.532 -10.589) 11.000 8.117 ( -0.796 -1.239 -11.578) 11.671 8.270 ( -4.599 -8.443 -4.833) 10.761 8.504 ( -4.028 0.380 2.058) 4.539 8.621 ( -1.421 1.953 -7.645) 8.018 8.773 ( -2.348 -14.067 1.508) 14.342 8.960 ( -5.397 -5.739 7.323) 10.756 9.149 ( 4.463 -7.327 2.972) 9.080 9.426 ( -12.430 -9.101 0.049) 15.406 10.685 ( 2.569 -0.443 5.740) 6.305 11.077 ( -22.114 5.780 -0.831) 22.872 11.199 ( 9.565 -12.658 3.055) 16.157 11.541 ( -6.494 -7.715 0.813) 10.117 11.885 ( -2.218 -20.176 -1.680) 20.367 12.435 ( -0.754 6.817 -3.260) 7.594 13.551 ( 9.823 12.994 0.870) 16.312 14.001 ( 3.984 -10.608 -1.250) 11.400 14.054 ( -3.825 11.963 -1.215) 12.618 14.940 ( 1.570 14.239 0.299) 14.328 15.250 ( 1.212 7.141 -0.188) 7.245 15.389 ( 5.509 -5.811 -0.930) 8.061 16.987 ( 9.760 16.679 -3.286) 19.602 17.440 ( -1.942 -9.895 -2.560) 10.404 18.451 ( -11.384 -11.595 -8.105) 18.159 19.537 ( 9.700 13.465 -0.187) 16.597 20.411 ( -9.434 -17.036 -0.472) 19.480 21.747 ( 3.008 7.164 2.107) 8.050 21.968 ( 3.943 6.817 2.437) 8.244 22.647 ( 3.391 4.698 3.625) 6.835 26.932 ( 2.484 2.957 0.682) 3.922 27.377 ( -5.526 -1.387 0.094) 5.698 27.400 ( 1.195 -4.797 -0.410) 4.961 27.968 ( -0.755 -0.880 2.545) 2.797 28.297 ( 2.124 3.391 1.029) 4.132 28.460 ( 11.729 7.080 -0.574) 13.712 28.784 ( -12.302 8.919 -0.457) 15.202 29.078 ( 4.498 -8.189 -6.025) 11.117 29.497 ( 0.508 -0.566 -6.686) 6.729 29.693 ( -2.949 -3.664 -8.448) 9.669 29.857 ( 0.361 0.047 -5.052) 5.065 30.247 ( 3.142 4.676 2.856) 6.316 30.537 ( -3.348 -3.074 3.691) 5.855 30.770 ( 2.279 6.479 2.640) 7.358 30.876 ( 6.365 2.825 1.477) 7.119 31.353 ( -11.938 -17.055 10.946) 23.520 ======================= Grid point 166 (49/90) ======================= q-point: ( 0.38 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.302 ( 0.807 -1.523 5.045) 5.331 1.971 ( -1.066 9.335 0.482) 9.408 2.049 ( -0.591 1.331 -3.009) 3.343 2.245 ( -3.162 -0.383 1.442) 3.496 2.429 ( 3.137 8.221 -5.302) 10.273 2.446 ( -4.705 -1.738 1.086) 5.132 2.616 ( 5.199 -12.099 3.432) 13.608 2.829 ( -7.619 15.748 3.912) 17.926 2.969 ( -0.221 -1.002 7.108) 7.182 3.009 ( 1.071 -1.567 5.010) 5.357 3.677 ( -2.779 -5.309 -4.179) 7.305 3.793 ( 6.585 -3.869 -4.073) 8.655 4.480 ( -2.931 5.157 7.993) 9.954 4.695 ( -6.185 0.799 3.122) 6.974 4.798 ( 8.001 -2.405 6.661) 10.685 4.864 ( 4.741 -8.102 2.771) 9.787 5.498 ( -3.398 2.556 0.095) 4.253 5.645 ( 4.860 -6.616 -0.347) 8.216 6.327 ( -2.440 4.065 3.094) 5.661 6.658 ( 2.994 10.106 1.233) 10.612 6.801 ( -3.420 -7.956 -2.372) 8.979 7.003 ( -11.540 12.412 -0.339) 16.951 7.351 ( -11.061 -5.701 -10.555) 16.318 7.436 ( 19.072 1.435 -7.458) 20.529 7.863 ( -5.948 7.429 -9.932) 13.756 8.083 ( 4.709 -7.234 -8.131) 11.858 8.155 ( -1.908 -0.163 -14.091) 14.221 8.550 ( -0.390 7.650 2.296) 7.996 8.645 ( -1.223 5.863 -1.276) 6.124 8.700 ( -3.672 -2.976 -0.606) 4.765 8.873 ( 5.789 -8.418 7.521) 12.686 9.072 ( -5.580 2.608 1.152) 6.267 9.310 ( 10.029 -12.044 1.648) 15.759 10.738 ( -5.801 4.600 5.661) 9.320 10.892 ( 3.280 4.594 4.402) 7.159 11.307 ( 13.510 -8.693 2.914) 16.328 11.364 ( -9.699 0.689 -1.482) 9.836 11.730 ( 10.193 -21.332 -2.175) 23.742 12.499 ( -0.567 3.032 -3.357) 4.559 13.723 ( -4.483 9.197 1.346) 10.319 13.873 ( -3.274 0.141 0.041) 3.277 14.136 ( -0.278 3.505 -1.387) 3.780 15.110 ( 0.809 6.846 0.295) 6.900 15.258 ( -0.154 -1.970 -0.957) 2.196 15.374 ( -1.153 -3.340 -0.185) 3.538 17.241 ( 2.297 6.786 -2.995) 7.765 17.284 ( -8.237 0.853 -3.086) 8.837 18.304 ( 6.947 -9.146 -9.812) 15.106 19.730 ( -10.311 16.709 -0.442) 19.639 20.192 ( 11.052 -19.086 -0.147) 22.055 21.796 ( -8.223 14.749 2.435) 17.061 22.054 ( 4.814 -8.271 2.991) 10.026 22.697 ( -1.063 1.492 3.069) 3.574 26.967 ( -0.543 0.312 1.082) 1.250 27.328 ( 0.356 1.844 -0.109) 1.881 27.378 ( 1.198 -3.901 -0.290) 4.091 27.957 ( 0.539 -0.830 2.936) 3.098 28.335 ( -3.011 5.405 0.674) 6.224 28.603 ( -9.031 2.118 2.731) 9.670 28.746 ( 10.654 1.306 2.154) 10.947 29.051 ( -0.736 -4.997 -8.026) 9.483 29.505 ( -2.205 3.366 -9.395) 10.221 29.627 ( 3.364 -5.251 -9.020) 10.966 29.869 ( -1.245 1.919 -4.931) 5.436 30.325 ( -2.653 3.689 2.791) 5.333 30.464 ( 3.962 -5.427 2.488) 7.165 30.839 ( -4.446 9.724 4.685) 11.674 31.021 ( -6.760 -6.891 2.782) 10.046 31.074 ( 11.263 -3.491 8.476) 14.521 ======================= Grid point 171 (50/90) ======================= q-point: (-0.12 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.949 ( 9.246 18.287 14.690) 25.213 1.436 ( 6.663 5.594 16.433) 18.594 1.820 ( 1.854 -1.247 -7.156) 7.497 2.372 ( 0.935 -6.221 0.239) 6.295 2.395 ( -8.618 6.441 16.350) 19.572 2.527 ( 0.800 -1.096 1.151) 1.779 2.755 ( -3.319 -0.371 0.512) 3.378 2.830 ( 4.401 5.279 1.144) 6.968 2.915 ( -22.336 7.115 -1.881) 23.517 2.999 ( 0.233 1.462 3.163) 3.492 3.155 ( -4.073 6.155 -0.945) 7.440 4.153 ( -1.131 -0.102 -2.804) 3.025 4.404 ( -1.783 9.114 -0.911) 9.331 4.528 ( 10.345 -10.696 -4.770) 15.626 4.744 ( 0.490 2.786 -3.153) 4.236 5.001 ( 1.729 5.659 -5.690) 8.210 5.169 ( -4.118 2.314 -1.547) 4.971 5.398 ( -14.102 7.409 0.155) 15.930 5.905 ( 1.689 14.081 0.366) 14.187 6.070 ( -11.475 3.211 2.342) 12.144 6.268 ( 3.477 12.210 -4.127) 13.350 6.739 ( -10.412 8.384 -11.787) 17.822 7.326 ( 3.461 -9.061 12.946) 16.177 7.611 ( -0.915 -5.077 -7.229) 8.881 8.054 ( 13.680 -12.151 8.256) 20.074 8.102 ( -7.009 -0.755 -2.468) 7.469 8.192 ( -2.560 -0.842 -7.074) 7.570 8.648 ( 2.968 -8.209 -0.361) 8.737 8.918 ( 6.993 -11.387 -0.543) 13.374 9.314 ( 1.758 0.107 1.384) 2.240 9.386 ( 2.470 -10.533 1.751) 10.959 9.838 ( 8.339 -10.429 2.403) 13.567 10.003 ( 19.083 -7.985 -5.443) 21.390 10.808 ( 6.132 -6.738 3.046) 9.607 11.061 ( 4.304 3.470 -2.996) 6.288 11.601 ( -11.801 -11.552 -2.527) 16.706 11.682 ( 13.283 -6.600 -2.731) 15.081 12.356 ( -6.019 -13.132 -0.592) 14.458 12.602 ( 10.205 -11.134 -1.563) 15.184 12.984 ( 6.419 19.342 -3.305) 20.645 13.593 ( -14.666 9.266 -1.436) 17.407 14.100 ( -3.609 3.205 -0.265) 4.834 14.599 ( -8.502 21.916 -5.109) 24.056 14.869 ( -10.537 14.531 -1.327) 17.999 15.013 ( -5.936 5.014 5.442) 9.486 16.474 ( -1.345 2.454 3.544) 4.515 17.794 ( 4.608 -8.349 -1.956) 9.735 18.999 ( 4.808 -17.690 -3.559) 18.674 19.212 ( 4.299 2.696 -1.103) 5.193 20.915 ( 2.387 -2.711 -0.407) 3.635 21.418 ( -18.338 14.356 0.268) 23.290 21.551 ( 5.101 7.424 -0.704) 9.035 22.397 ( -4.313 4.688 5.264) 8.263 26.778 ( -1.718 3.549 0.098) 3.944 27.443 ( -0.328 3.443 -3.866) 5.187 27.509 ( -4.922 -1.902 -0.820) 5.340 27.623 ( -9.421 20.494 -10.143) 24.731 27.964 ( -1.380 2.702 -0.036) 3.034 28.557 ( 11.773 -3.324 1.486) 12.323 28.706 ( -4.474 2.281 -3.699) 6.238 29.176 ( 3.187 -7.347 1.487) 8.145 29.391 ( -6.652 2.561 -0.827) 7.175 29.781 ( 3.782 -2.900 -1.094) 4.889 29.999 ( -0.060 -0.632 -3.291) 3.351 30.168 ( -1.222 5.961 1.231) 6.208 30.460 ( -3.629 -0.659 -2.613) 4.520 30.581 ( -0.548 4.346 1.815) 4.742 30.835 ( -0.621 -0.201 0.954) 1.156 32.231 ( 16.231 -26.669 14.141) 34.274 ======================= Grid point 180 (51/90) ======================= q-point: (-0.25 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.084 ( 1.318 25.789 9.584) 27.544 1.392 ( 2.031 2.929 9.977) 10.595 1.801 ( -2.276 0.155 -2.899) 3.689 2.228 ( 5.862 -7.233 -2.830) 9.731 2.395 ( 1.703 -6.233 -3.139) 7.184 2.530 ( 5.142 -2.647 1.524) 5.981 2.756 ( -4.894 -7.411 8.812) 12.511 2.853 ( 6.691 15.682 -0.643) 17.062 3.046 ( -2.895 3.709 7.680) 9.007 3.189 ( -4.552 0.343 1.265) 4.737 3.572 ( -25.876 14.596 3.359) 29.898 4.155 ( 0.227 1.579 -0.799) 1.784 4.358 ( 1.306 -1.931 -5.684) 6.144 4.429 ( 4.938 0.341 4.446) 6.653 4.797 ( -4.629 4.854 -2.127) 7.037 5.049 ( -5.692 -4.812 -3.412) 8.197 5.377 ( -10.444 13.710 -1.920) 17.342 5.667 ( 1.365 15.408 1.432) 15.534 6.031 ( -5.901 13.429 2.264) 14.842 6.293 ( 4.224 9.475 0.228) 10.376 6.388 ( -19.827 -0.308 -2.386) 19.973 7.007 ( -11.819 -0.118 -6.206) 13.350 7.194 ( 2.561 -2.764 0.689) 3.831 7.503 ( 13.278 -14.263 -0.549) 19.495 7.672 ( 4.711 -10.207 0.362) 11.248 8.084 ( -0.551 -8.388 0.467) 8.419 8.294 ( -4.461 0.534 -8.552) 9.660 8.513 ( 5.320 -5.642 -8.943) 11.837 8.762 ( 1.641 -6.577 0.383) 6.790 9.092 ( 14.182 -7.748 0.153) 16.161 9.296 ( 17.414 -0.349 -3.846) 17.837 9.449 ( 14.629 -2.679 0.831) 14.896 9.728 ( 4.587 -5.374 3.072) 7.704 10.631 ( 6.321 -5.401 4.408) 9.410 10.996 ( 7.100 3.423 2.637) 8.311 11.449 ( 4.802 -10.677 -3.594) 12.246 11.744 ( -14.179 -11.334 0.705) 18.166 12.146 ( 9.485 -17.484 -1.855) 19.977 12.415 ( -9.373 -14.192 -1.931) 17.117 13.214 ( 1.208 27.337 -1.022) 27.383 13.765 ( 9.820 19.014 -2.917) 21.598 14.202 ( -8.639 -5.654 1.546) 10.440 14.922 ( -9.079 16.258 -4.717) 19.210 15.132 ( -11.572 1.465 -0.468) 11.674 15.213 ( -6.327 7.917 1.954) 10.321 16.596 ( -7.862 8.148 0.576) 11.337 17.554 ( 11.804 -11.834 -2.964) 16.976 18.759 ( 1.866 -20.323 -4.530) 20.906 19.245 ( 1.082 14.041 -1.591) 14.173 20.793 ( 1.184 -14.262 -0.247) 14.314 21.513 ( 11.915 14.757 0.412) 18.971 21.872 ( -20.867 7.828 1.561) 22.342 22.540 ( -5.197 5.876 4.739) 9.165 26.853 ( -2.895 3.751 0.262) 4.745 27.416 ( 3.030 -1.181 -0.658) 3.318 27.503 ( -1.004 -5.002 -0.070) 5.102 27.947 ( -6.228 5.256 -1.815) 8.350 28.079 ( -9.693 7.670 -4.411) 13.124 28.331 ( 11.386 -0.315 3.397) 11.886 28.809 ( 1.676 9.326 -6.062) 11.249 29.073 ( -3.937 -12.746 0.724) 13.359 29.541 ( -7.377 4.000 -5.217) 9.881 29.673 ( 6.624 -0.922 -3.364) 7.486 29.966 ( 2.655 -1.120 -6.203) 6.840 30.255 ( -2.010 4.856 3.764) 6.464 30.512 ( -3.361 -1.051 -4.743) 5.907 30.640 ( -1.465 3.296 4.459) 5.735 30.865 ( -3.325 1.328 1.763) 3.991 31.707 ( 18.295 -19.633 14.842) 30.667 ======================= Grid point 181 (52/90) ======================= q-point: (-0.12 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.300 ( -0.821 13.254 -0.785) 13.302 1.629 ( 12.700 14.996 12.629) 23.360 1.783 ( 1.378 -2.002 -2.250) 3.312 2.191 ( -0.128 -10.894 -3.002) 11.301 2.319 ( -2.041 -8.563 -4.475) 9.875 2.608 ( -1.954 -9.456 9.206) 13.341 2.642 ( 7.444 3.171 5.847) 9.983 2.861 ( -20.331 1.478 1.651) 20.452 3.011 ( -5.932 3.612 6.908) 9.796 3.114 ( 0.307 5.605 2.554) 6.167 3.479 ( -4.992 24.698 0.344) 25.199 4.112 ( -5.879 -4.544 -3.859) 8.373 4.312 ( 2.560 -3.642 -5.412) 7.008 4.699 ( 11.286 13.800 9.064) 19.999 4.820 ( 0.458 4.689 -2.725) 5.443 4.982 ( 3.915 -4.634 -2.686) 6.635 5.338 ( -10.581 9.163 -0.956) 14.030 5.614 ( -14.923 16.681 -1.483) 22.431 6.104 ( -12.288 4.185 1.979) 13.131 6.311 ( 9.832 20.396 1.181) 22.673 6.492 ( 5.086 10.503 -4.981) 12.688 6.786 ( -10.514 -4.878 -2.969) 11.964 7.218 ( 3.361 -1.508 -0.221) 3.690 7.525 ( 0.960 -2.837 -7.614) 8.182 7.659 ( 11.281 -24.310 4.837) 27.233 8.043 ( 3.230 -2.602 1.230) 4.326 8.184 ( -5.382 -1.795 -7.367) 9.299 8.557 ( 4.148 -2.551 -9.475) 10.654 8.705 ( 1.929 -10.090 -0.837) 10.307 9.096 ( 1.479 -17.099 1.931) 17.271 9.328 ( -1.683 -0.279 1.855) 2.520 9.577 ( -6.170 -15.346 2.052) 16.666 9.852 ( 15.746 -7.489 -3.814) 17.849 10.700 ( 5.419 -2.708 5.891) 8.450 10.986 ( -7.829 -14.414 -1.905) 16.514 11.296 ( 6.452 -7.602 -0.525) 9.985 11.771 ( 17.916 2.856 0.613) 18.152 12.111 ( -5.161 -6.215 -3.440) 8.780 12.431 ( 23.129 -5.140 -0.751) 23.705 13.367 ( -6.010 14.856 -1.520) 16.098 13.676 ( -35.290 0.476 -0.680) 35.299 14.174 ( 8.049 4.144 -2.364) 9.356 14.914 ( -2.362 11.036 -1.425) 11.375 15.080 ( -1.423 9.567 0.483) 9.684 15.244 ( -6.465 13.854 -0.443) 15.295 16.597 ( -3.115 10.913 0.664) 11.368 17.568 ( 3.804 -14.904 -2.785) 15.632 18.674 ( 11.103 -14.127 -5.215) 18.709 19.319 ( -6.624 7.353 -0.691) 9.921 20.808 ( 13.262 -7.968 -0.784) 15.492 21.446 ( -21.073 -1.782 1.076) 21.176 21.926 ( 5.042 20.542 1.289) 21.191 22.518 ( -4.581 6.956 4.883) 9.655 26.863 ( -1.396 5.020 0.251) 5.216 27.410 ( -1.289 -5.378 0.184) 5.534 27.474 ( 3.423 -0.670 -0.979) 3.623 27.931 ( -2.873 9.426 -2.029) 10.060 28.032 ( -4.591 4.029 -0.799) 6.161 28.537 ( 10.476 0.597 1.620) 10.617 28.754 ( -11.064 0.296 -8.557) 13.990 29.071 ( 11.867 -1.547 -1.310) 12.039 29.421 ( -9.924 0.966 -1.209) 10.044 29.757 ( 2.903 0.699 -3.472) 4.579 29.972 ( -0.113 -2.585 -6.114) 6.639 30.276 ( -2.016 4.287 1.301) 4.912 30.438 ( -1.535 -0.352 -0.235) 1.592 30.698 ( 1.106 7.675 2.638) 8.191 30.820 ( -2.524 -1.497 0.829) 3.049 31.731 ( 9.619 -24.013 14.409) 29.610 ======================= Grid point 189 (53/90) ======================= q-point: (-0.38 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.322 ( 1.008 24.154 3.294) 24.398 1.487 ( -6.891 8.023 1.094) 10.633 1.889 ( -5.687 1.454 3.795) 6.990 2.064 ( 3.673 -7.105 -3.927) 8.910 2.274 ( 5.762 -7.141 -1.735) 9.338 2.404 ( 2.330 -5.018 1.052) 5.632 2.741 ( -4.651 -11.344 6.899) 14.068 2.884 ( 8.965 17.278 -0.505) 19.472 3.114 ( 0.306 3.381 7.769) 8.479 3.225 ( 1.791 2.978 6.083) 7.006 3.900 ( -0.345 11.476 -0.905) 11.516 4.169 ( 11.287 0.455 -2.591) 11.590 4.323 ( -5.190 2.155 -2.976) 6.359 4.550 ( -18.736 -1.076 7.482) 20.203 4.913 ( -8.192 -6.991 2.244) 11.000 5.066 ( -3.059 -9.506 -1.272) 10.067 5.633 ( 15.191 13.633 3.411) 20.694 5.742 ( -15.887 14.303 -2.032) 21.473 6.216 ( 2.729 0.288 0.992) 2.918 6.294 ( 2.763 8.629 0.292) 9.065 6.673 ( -14.027 -5.209 -0.981) 14.995 6.941 ( -1.608 -12.262 6.095) 13.787 7.126 ( 13.363 -3.071 -4.498) 14.431 7.356 ( -11.177 6.848 -13.137) 18.558 7.617 ( 3.075 -6.411 -4.381) 8.351 8.007 ( -1.411 -9.563 -1.277) 9.751 8.226 ( 6.926 -10.621 -4.198) 13.357 8.430 ( -0.085 -0.749 -10.131) 10.159 8.625 ( 9.773 7.121 -1.377) 12.170 8.811 ( 13.612 0.186 -7.564) 15.574 9.080 ( 0.202 8.343 1.488) 8.478 9.410 ( -1.406 -2.068 3.806) 4.554 9.658 ( -1.227 -3.216 1.055) 3.601 10.534 ( 2.558 2.606 5.723) 6.789 10.884 ( 9.651 2.267 5.605) 11.389 11.291 ( 6.999 0.116 -2.148) 7.322 11.754 ( -17.710 -37.306 0.698) 41.302 12.043 ( -7.768 -5.929 -2.815) 10.170 12.440 ( -5.326 -9.353 -1.620) 10.884 13.420 ( 4.535 25.235 0.813) 25.652 13.714 ( 14.193 16.108 -1.761) 21.541 14.255 ( -3.307 -3.935 0.633) 5.179 15.128 ( 2.151 9.969 -0.275) 10.202 15.263 ( -2.367 0.570 -0.446) 2.475 15.359 ( -8.558 -1.177 -1.235) 8.726 16.879 ( -13.936 11.213 -2.489) 18.059 17.216 ( 15.237 -10.064 -3.517) 18.596 18.567 ( -2.952 -19.991 -5.041) 20.827 19.392 ( 2.533 18.141 -2.376) 18.471 20.655 ( -6.530 -20.696 -0.076) 21.702 21.455 ( 13.901 18.847 1.305) 23.456 22.193 ( -11.315 0.179 2.680) 11.629 22.638 ( -0.745 3.056 3.740) 4.887 26.933 ( -2.411 2.479 0.496) 3.493 27.336 ( 4.033 -1.051 0.057) 4.168 27.473 ( -1.884 -5.719 -0.206) 6.024 28.023 ( -0.365 3.808 1.773) 4.216 28.167 ( 6.513 1.944 3.072) 7.459 28.358 ( -10.218 6.090 -1.506) 11.990 28.776 ( 4.276 -2.414 -2.009) 5.305 29.083 ( -6.436 -6.932 -2.647) 9.823 29.552 ( 8.442 2.874 -5.457) 10.455 29.711 ( -7.176 4.887 -8.913) 12.442 29.901 ( 3.364 -1.507 -6.760) 7.700 30.308 ( -0.092 2.417 3.236) 4.040 30.527 ( -1.131 -4.711 -2.916) 5.655 30.695 ( -0.576 5.790 4.826) 7.559 30.980 ( -7.006 0.749 3.201) 7.739 31.291 ( 11.531 -10.720 12.169) 19.899 ======================= Grid point 190 (54/90) ======================= q-point: (-0.25 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.497 ( -5.507 12.457 -1.891) 13.750 1.634 ( 5.342 19.373 2.943) 20.311 1.809 ( -4.591 3.413 6.510) 8.666 2.057 ( 4.037 -10.017 -3.901) 11.483 2.284 ( 0.070 -4.521 -2.953) 5.400 2.423 ( 5.599 -10.334 3.649) 12.307 2.555 ( 2.193 -9.218 3.427) 10.076 3.099 ( -3.315 5.659 4.566) 7.991 3.149 ( 1.128 4.186 4.249) 6.070 3.247 ( -10.650 9.758 3.521) 14.868 3.839 ( -14.907 14.037 1.785) 20.554 4.164 ( -0.908 -0.741 1.236) 1.703 4.314 ( -7.138 -0.760 -4.148) 8.291 4.538 ( 17.595 7.337 5.957) 19.972 4.786 ( 2.898 -7.189 0.549) 7.771 4.937 ( -2.509 -5.422 -0.440) 5.991 5.644 ( -12.025 12.675 0.755) 17.488 5.972 ( -2.235 16.156 -0.064) 16.310 6.236 ( 3.826 1.382 3.437) 5.326 6.358 ( -13.369 -4.589 -1.965) 14.270 6.499 ( 7.030 10.200 0.634) 12.404 6.843 ( 0.699 -1.796 3.542) 4.032 7.137 ( -2.917 -7.038 -6.076) 9.745 7.383 ( 6.046 1.657 -12.767) 14.223 7.541 ( -5.057 -4.318 -4.812) 8.208 7.935 ( 4.842 -8.563 0.250) 9.841 8.214 ( 2.539 -9.270 -2.690) 9.981 8.446 ( 3.445 -2.006 -13.390) 13.971 8.643 ( -5.943 0.958 -1.376) 6.175 9.029 ( -5.646 -1.277 1.370) 5.948 9.326 ( 14.473 3.585 -2.069) 15.053 9.358 ( 12.625 -6.575 1.247) 14.289 9.576 ( 0.589 -10.836 1.121) 10.910 10.632 ( 3.369 4.790 6.638) 8.853 11.060 ( -17.385 -18.566 -0.326) 25.437 11.076 ( 12.650 1.698 4.143) 13.419 11.567 ( 6.636 -8.468 0.329) 10.763 11.872 ( 13.280 -13.459 -1.550) 18.972 12.344 ( -5.807 5.278 -3.370) 8.540 13.588 ( -5.487 11.620 1.118) 12.898 14.010 ( 10.456 -2.028 -1.326) 10.733 14.159 ( -13.640 8.406 -1.018) 16.055 15.101 ( -10.192 4.436 -0.907) 11.152 15.211 ( -3.027 6.924 0.112) 7.557 15.363 ( 2.068 4.879 -0.554) 5.328 16.817 ( -8.134 13.791 -1.845) 16.117 17.333 ( 8.480 -11.161 -2.800) 14.294 18.382 ( 5.652 -16.143 -8.252) 18.991 19.550 ( -7.044 16.293 -0.160) 17.751 20.477 ( 10.153 -17.504 -0.793) 20.251 21.733 ( -7.017 7.182 2.263) 10.293 22.025 ( -1.914 7.509 2.212) 8.059 22.644 ( -3.011 4.244 3.698) 6.383 26.932 ( -1.442 3.870 0.625) 4.177 27.380 ( -1.413 -5.957 0.173) 6.124 27.394 ( 3.897 -1.161 -0.582) 4.108 28.027 ( -1.855 2.698 2.669) 4.224 28.206 ( -8.931 5.337 -1.146) 10.467 28.399 ( 8.602 6.791 2.335) 11.205 28.800 ( 1.564 -13.821 2.059) 14.060 28.956 ( 0.039 3.953 -9.067) 9.891 29.608 ( -9.845 3.103 -5.541) 11.716 29.707 ( 5.472 4.301 -5.469) 8.852 29.924 ( 2.181 -3.770 -7.896) 9.018 30.333 ( -0.427 3.257 3.476) 4.783 30.454 ( -1.937 -3.458 -1.915) 4.402 30.762 ( 0.653 8.152 4.671) 9.418 30.875 ( -5.463 -0.291 1.847) 5.774 31.358 ( 10.927 -15.856 12.051) 22.717 ======================= Grid point 191 (55/90) ======================= q-point: (-0.12 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.446 ( -10.947 1.070 -3.770) 11.627 1.670 ( -1.469 -7.205 -2.664) 7.821 1.913 ( 4.042 4.077 10.435) 11.910 2.047 ( 3.875 1.550 -7.033) 8.178 2.158 ( -2.514 -5.763 1.051) 6.375 2.413 ( 4.640 -6.141 5.598) 9.517 2.704 ( 11.550 2.253 3.708) 12.338 2.885 ( -21.595 0.713 1.280) 21.644 3.090 ( -5.044 3.460 8.497) 10.470 3.194 ( -3.257 2.935 6.138) 7.543 3.905 ( -4.235 16.602 -0.633) 17.146 4.006 ( -9.560 -4.785 -4.609) 11.642 4.335 ( 1.089 3.384 -3.365) 4.895 4.831 ( 9.616 -9.359 7.543) 15.393 4.909 ( 13.455 3.133 4.050) 14.397 4.944 ( 7.030 9.060 0.196) 11.469 5.485 ( -17.917 7.593 1.452) 19.513 5.936 ( -10.154 10.885 -3.681) 15.334 6.188 ( -4.544 5.106 0.990) 6.906 6.308 ( 7.127 -16.153 3.495) 17.998 6.699 ( 6.616 6.956 -1.636) 9.738 6.870 ( -10.396 11.612 -5.452) 16.512 7.113 ( 12.205 -11.025 1.850) 16.551 7.390 ( -3.735 5.623 -3.921) 7.807 7.520 ( 5.220 -1.876 -10.944) 12.269 8.000 ( 8.056 -2.344 -1.636) 8.548 8.148 ( -2.310 -1.459 -3.444) 4.396 8.473 ( 3.857 -5.266 -11.241) 12.998 8.573 ( -1.318 -2.160 -6.469) 6.946 8.823 ( -9.489 -8.856 3.176) 13.362 9.252 ( -7.942 -10.993 0.976) 13.597 9.390 ( -2.563 0.268 3.464) 4.318 9.721 ( 10.312 -6.071 -1.991) 12.131 10.635 ( -2.369 -10.241 4.574) 11.463 10.765 ( -5.493 2.207 4.949) 7.716 11.240 ( -0.866 -0.241 -0.456) 1.008 11.742 ( 35.802 -2.188 0.529) 35.873 12.102 ( 5.608 -0.408 -3.638) 6.697 12.405 ( 13.816 2.074 -0.958) 14.004 13.515 ( -11.248 0.579 1.549) 11.369 13.663 ( -34.723 0.058 -0.858) 34.733 14.240 ( 6.356 2.339 -2.112) 7.095 15.078 ( -2.690 6.381 1.681) 7.126 15.232 ( -0.245 5.319 -0.378) 5.338 15.413 ( -0.798 2.785 -2.222) 3.651 16.874 ( -2.337 16.829 -2.419) 17.162 17.239 ( -0.482 -18.739 -3.438) 19.058 18.510 ( 18.001 -2.458 -5.523) 18.989 19.435 ( -15.470 2.951 -1.700) 15.841 20.661 ( 22.005 -5.383 -0.479) 22.659 21.427 ( -23.943 0.144 1.636) 23.999 22.214 ( 6.025 7.841 2.622) 10.230 22.624 ( -3.219 3.398 3.764) 6.006 26.945 ( -0.962 2.517 0.477) 2.736 27.316 ( -0.930 -2.715 0.398) 2.898 27.464 ( 5.064 -0.270 -0.406) 5.087 28.032 ( -0.950 1.998 2.486) 3.328 28.097 ( -7.352 2.863 0.894) 7.941 28.529 ( -0.434 -4.027 1.444) 4.300 28.712 ( 4.592 -0.610 -2.997) 5.517 29.096 ( 9.503 1.280 -5.163) 10.890 29.458 ( -10.830 3.511 -4.132) 12.111 29.798 ( 1.114 2.251 -7.364) 7.780 29.891 ( -0.871 -5.073 -7.547) 9.135 30.314 ( -2.980 0.385 1.214) 3.241 30.474 ( 3.932 3.362 1.338) 5.344 30.765 ( -4.144 -3.265 3.667) 6.425 30.890 ( 1.574 11.238 2.672) 11.658 31.340 ( 5.345 -15.892 11.377) 20.262 ======================= Grid point 197 (56/90) ======================= q-point: (-0.38 0.62 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.665 ( 1.990 12.460 0.985) 12.657 1.711 ( 4.860 4.966 -4.619) 8.343 1.906 ( -0.958 -5.202 -1.025) 5.388 2.002 ( -2.734 7.585 5.746) 9.901 2.184 ( 3.923 0.756 3.337) 5.205 2.295 ( -0.933 -6.260 1.229) 6.447 2.477 ( -7.432 -12.853 -0.331) 14.851 3.151 ( 2.972 3.979 4.470) 6.682 3.163 ( 0.182 2.121 4.140) 4.655 3.392 ( 9.685 15.972 4.602) 19.237 4.075 ( 4.451 3.379 2.955) 6.322 4.171 ( 5.289 1.204 -2.444) 5.949 4.308 ( -3.124 -5.378 -2.711) 6.785 4.526 ( -11.329 0.400 7.784) 13.751 4.671 ( -4.410 -12.327 1.803) 13.216 4.901 ( -0.537 -5.186 0.268) 5.220 5.846 ( 11.340 8.725 2.908) 14.601 6.023 ( -7.871 7.627 0.390) 10.967 6.241 ( 2.787 6.597 2.714) 7.659 6.342 ( 11.746 -2.718 2.296) 12.273 6.528 ( -12.115 -9.788 0.886) 15.600 6.904 ( -1.981 3.538 3.487) 5.348 7.146 ( 7.331 4.604 -12.609) 15.295 7.356 ( -6.492 -7.098 -17.433) 19.911 7.551 ( 6.564 3.232 -3.536) 8.127 7.780 ( -7.560 -10.830 -2.558) 13.453 8.093 ( -1.911 -2.851 0.022) 3.432 8.413 ( -0.701 -0.277 -13.140) 13.161 8.861 ( 20.574 5.054 -4.379) 21.633 8.914 ( -0.600 16.709 2.025) 16.842 9.195 ( -11.270 1.080 3.212) 11.769 9.366 ( -4.219 -0.807 1.164) 4.450 9.462 ( -2.919 -15.885 -1.787) 16.249 10.677 ( 1.256 10.144 6.452) 12.087 10.877 ( 4.177 -4.864 5.629) 8.532 11.203 ( -5.219 -14.182 3.478) 15.507 11.374 ( 1.938 9.516 -2.411) 10.006 11.737 ( -13.335 -21.091 -1.863) 25.023 12.429 ( 2.598 3.355 -3.402) 5.439 13.716 ( 6.035 8.386 1.373) 10.423 13.899 ( -4.048 -1.404 0.222) 4.290 14.291 ( 5.626 7.295 -1.229) 9.294 15.204 ( 5.542 0.729 0.692) 5.633 15.269 ( -1.367 0.838 -1.385) 2.119 15.378 ( -2.352 0.451 -0.308) 2.414 17.054 ( 3.444 1.496 -2.487) 4.504 17.125 ( -1.545 3.180 -2.976) 4.621 18.229 ( -5.278 -11.321 -9.791) 15.871 19.759 ( 9.705 18.328 -0.413) 20.743 20.246 ( -11.330 -20.019 -0.386) 23.006 21.805 ( 10.112 16.139 2.538) 19.214 22.102 ( -5.831 -8.955 2.915) 11.076 22.687 ( 1.088 1.631 3.066) 3.639 26.971 ( 0.241 1.019 0.979) 1.433 27.327 ( 1.389 0.550 -0.164) 1.503 27.377 ( -2.508 -3.507 -0.353) 4.326 28.053 ( 0.256 0.249 3.439) 3.457 28.279 ( 6.441 6.843 0.458) 9.409 28.479 ( -5.492 4.990 1.962) 7.675 28.627 ( 0.170 -9.213 1.840) 9.397 28.987 ( -2.071 -3.038 -7.843) 8.662 29.659 ( 6.621 6.740 -5.137) 10.754 29.777 ( -3.836 1.034 -8.278) 9.182 29.844 ( -0.543 -3.745 -8.337) 9.156 30.360 ( 0.818 2.936 2.348) 3.847 30.432 ( -0.731 -4.141 0.536) 4.239 30.824 ( 1.054 6.826 3.936) 7.950 30.934 ( 1.299 -4.891 3.142) 5.957 31.152 ( -3.794 -3.657 10.431) 11.687 ======================= Grid point 219 (57/90) ======================= q-point: ( 0.00 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 88 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.467 ( 0.000 -0.000 14.537) 14.537 1.467 ( 0.000 0.000 14.537) 14.537 1.627 ( 0.000 -0.000 -5.071) 5.071 2.438 ( 0.000 0.000 -3.043) 3.043 2.438 ( 0.000 -0.000 -3.043) 3.043 2.638 ( 0.000 0.000 -0.467) 0.467 2.638 ( 0.000 0.000 -0.467) 0.467 2.843 ( 0.000 0.000 17.426) 17.426 2.901 ( 0.000 -0.000 -4.378) 4.378 2.901 ( 0.000 0.000 -4.378) 4.378 3.079 ( 0.000 0.000 26.893) 26.893 4.089 ( 0.000 0.000 -2.261) 2.261 4.089 ( 0.000 0.000 -2.261) 2.261 4.486 ( 0.000 0.000 -24.879) 24.879 4.603 ( 0.000 0.000 -2.615) 2.615 4.989 ( 0.000 0.000 -12.656) 12.656 5.128 ( -0.000 0.000 -0.247) 0.247 5.128 ( 0.000 -0.000 -0.247) 0.247 5.836 ( 0.000 0.000 2.073) 2.073 5.920 ( 0.000 0.000 1.094) 1.094 5.920 ( 0.000 0.000 1.094) 1.094 6.286 ( 0.000 0.000 -12.021) 12.021 7.576 ( 0.000 0.000 -6.564) 6.564 7.576 ( 0.000 0.000 -6.564) 6.564 7.885 ( -0.000 0.000 12.975) 12.975 8.369 ( -0.000 0.000 3.131) 3.131 8.369 ( -0.000 0.000 3.131) 3.131 9.007 ( 0.000 -0.000 10.705) 10.705 9.260 ( 0.000 -0.000 1.513) 1.513 9.260 ( 0.000 0.000 1.513) 1.513 9.535 ( -0.000 0.000 -8.552) 8.552 10.229 ( 0.000 0.000 0.505) 0.505 10.229 ( 0.000 -0.000 0.505) 0.505 10.969 ( 0.000 0.000 2.547) 2.547 10.969 ( 0.000 0.000 2.547) 2.547 11.486 ( 0.000 0.000 -4.441) 4.441 12.224 ( 0.000 -0.000 -0.775) 0.775 12.224 ( 0.000 0.000 -0.775) 0.775 12.510 ( 0.000 0.000 -1.847) 1.847 13.455 ( 0.000 0.000 -0.190) 0.190 13.455 ( 0.000 0.000 -0.190) 0.190 13.767 ( 0.000 0.000 0.164) 0.164 13.767 ( 0.000 0.000 0.164) 0.164 14.554 ( 0.000 0.000 1.119) 1.119 14.985 ( 0.000 0.000 2.915) 2.915 16.556 ( 0.000 0.000 3.380) 3.380 17.892 ( 0.000 0.000 -0.750) 0.750 19.338 ( -0.000 0.000 -0.899) 0.899 19.338 ( 0.000 -0.000 -0.899) 0.899 20.853 ( 0.000 0.000 -0.561) 0.561 20.853 ( 0.000 -0.000 -0.561) 0.561 21.521 ( 0.000 0.000 -1.288) 1.288 22.347 ( 0.000 0.000 -0.540) 0.540 26.710 ( 0.000 0.000 0.004) 0.004 26.710 ( 0.000 -0.000 0.004) 0.004 27.492 ( -0.000 -0.000 -0.082) 0.082 27.492 ( 0.000 0.000 -0.082) 0.082 27.919 ( 0.000 -0.000 -0.082) 0.082 28.753 ( 0.000 0.000 0.336) 0.336 28.753 ( 0.000 0.000 0.336) 0.336 29.287 ( 0.000 0.000 0.337) 0.337 29.287 ( 0.000 0.000 0.337) 0.337 29.953 ( 0.000 0.000 0.924) 0.924 29.953 ( 0.000 0.000 0.924) 0.924 30.063 ( -0.000 0.000 -0.662) 0.662 30.449 ( 0.000 -0.000 -0.624) 0.624 30.449 ( 0.000 0.000 -0.624) 0.624 30.857 ( 0.000 0.000 0.740) 0.740 32.946 ( 0.000 0.000 -0.578) 0.578 ======================= Grid point 220 (58/90) ======================= q-point: ( 0.12 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.294 ( -7.608 0.011 18.921) 20.394 1.564 ( 1.020 0.609 3.553) 3.746 1.662 ( 0.342 0.173 -4.658) 4.673 2.440 ( 3.397 -5.122 -1.116) 6.246 2.479 ( -2.639 -2.830 -1.546) 4.167 2.581 ( -0.364 -2.341 -0.312) 2.390 2.745 ( 1.069 6.637 4.226) 7.941 2.816 ( 7.723 6.406 3.280) 10.557 2.957 ( 7.452 -0.030 1.619) 7.626 3.031 ( 5.002 9.197 -0.500) 10.481 3.093 ( 2.160 -0.399 25.194) 25.290 4.093 ( 0.275 -1.451 -2.037) 2.516 4.192 ( 9.118 3.883 -1.812) 10.075 4.404 ( -7.148 -1.308 -23.533) 24.630 4.656 ( 4.209 1.757 -1.667) 4.856 4.884 ( -6.055 -4.238 -3.930) 8.371 5.132 ( 0.633 2.884 -1.629) 3.372 5.217 ( 7.882 1.001 -3.968) 8.881 5.812 ( 2.205 1.628 4.348) 5.140 6.017 ( 8.657 0.144 0.486) 8.672 6.061 ( 6.904 9.146 0.113) 11.460 6.350 ( 6.629 3.238 -12.094) 14.166 7.573 ( -3.376 6.341 -5.669) 9.152 7.698 ( 12.220 -0.716 -8.104) 14.680 7.788 ( -7.007 -4.910 11.234) 14.121 8.272 ( -5.005 -7.887 5.002) 10.596 8.350 ( -5.331 2.490 1.442) 6.058 8.870 ( -11.871 -4.583 4.124) 13.377 9.183 ( -9.125 0.571 4.078) 10.011 9.287 ( 2.751 -3.342 1.366) 4.539 9.501 ( -3.396 -2.907 -5.504) 7.090 9.989 ( -18.598 -12.941 0.436) 22.662 10.113 ( -10.124 -7.456 -0.506) 12.584 10.949 ( -2.958 -0.118 2.225) 3.703 11.006 ( 1.560 0.456 1.329) 2.100 11.506 ( 0.695 0.568 -3.763) 3.869 11.958 ( -12.144 -4.717 -2.800) 13.325 12.329 ( 6.995 1.435 -0.931) 7.201 12.592 ( -0.544 0.017 -0.143) 0.563 13.142 ( -20.070 -1.622 -0.168) 20.136 13.347 ( 3.819 -7.365 -0.243) 8.300 14.045 ( 14.257 9.193 0.337) 16.967 14.136 ( 21.209 10.514 -0.566) 23.679 14.660 ( 10.074 5.925 0.665) 11.707 15.035 ( 4.309 3.826 2.290) 6.200 16.543 ( -0.750 -0.351 3.284) 3.387 17.862 ( -3.415 -1.844 -1.052) 4.021 19.194 ( -8.911 -9.403 -1.249) 13.015 19.234 ( -9.488 -0.776 -1.015) 9.573 20.913 ( 3.579 2.498 -0.477) 4.390 21.074 ( 16.968 7.969 -0.340) 18.749 21.517 ( 0.489 0.915 -0.953) 1.409 22.384 ( 3.702 2.022 0.671) 4.271 26.734 ( 2.071 1.317 0.031) 2.454 26.983 ( 21.775 12.988 -3.713) 25.625 27.486 ( -0.566 -0.433 -0.070) 0.716 27.514 ( 1.970 1.488 -0.129) 2.472 27.932 ( 1.170 0.653 -0.015) 1.340 28.654 ( -6.438 -7.371 1.057) 9.844 28.720 ( -3.530 0.340 0.471) 3.578 29.287 ( -1.045 0.884 0.053) 1.369 29.323 ( 3.004 1.663 -0.194) 3.439 29.860 ( -5.467 -3.430 1.955) 6.744 29.969 ( -1.717 -0.835 -2.299) 2.988 30.087 ( 3.223 0.699 -0.127) 3.300 30.449 ( 1.925 1.263 1.576) 2.790 30.522 ( 3.775 2.904 -1.664) 5.045 30.851 ( -0.272 -0.491 0.666) 0.871 32.739 ( -17.423 -10.013 2.023) 20.197 ======================= Grid point 221 (59/90) ======================= q-point: ( 0.25 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.205 ( -4.727 2.207 15.404) 16.263 1.614 ( -0.662 3.574 7.091) 7.968 1.644 ( 3.060 0.593 -5.524) 6.342 2.312 ( -8.039 -4.066 -0.722) 9.038 2.426 ( -3.016 -3.468 -3.942) 6.055 2.579 ( 2.851 -3.478 -0.868) 4.581 2.662 ( -5.933 -1.045 3.071) 6.762 2.997 ( 3.677 -0.501 1.095) 3.870 3.135 ( 4.644 -1.779 19.307) 19.937 3.194 ( 4.971 6.521 1.372) 8.313 3.387 ( 24.982 15.780 4.897) 29.951 4.060 ( -1.229 -3.439 -3.535) 5.083 4.203 ( -4.174 -1.463 -15.401) 16.024 4.507 ( 9.138 5.627 3.359) 11.245 4.659 ( 0.944 0.155 0.146) 0.968 4.923 ( 9.030 6.903 -5.267) 12.527 5.207 ( 4.089 6.187 -1.471) 7.561 5.366 ( 10.480 -4.647 -3.776) 12.070 5.961 ( 8.376 8.699 5.612) 13.316 6.149 ( 7.732 -0.628 2.082) 8.032 6.346 ( 13.043 15.001 -1.011) 19.904 6.551 ( 12.437 3.724 -13.446) 18.690 7.546 ( -10.137 0.024 5.241) 11.412 7.595 ( -4.623 0.547 -1.249) 4.820 7.900 ( 6.767 -7.955 -8.541) 13.491 8.070 ( -8.295 -4.116 5.624) 10.834 8.240 ( -9.173 -0.655 -1.690) 9.351 8.597 ( -14.344 -2.946 -2.900) 14.928 8.931 ( -16.400 -5.970 0.712) 17.468 9.201 ( -7.316 -9.557 0.541) 12.048 9.417 ( -6.374 -0.359 -0.908) 6.449 9.449 ( -21.641 -15.990 0.498) 26.912 9.859 ( -7.391 -10.344 3.104) 13.087 10.846 ( -9.089 0.273 2.440) 9.415 10.986 ( -0.095 -6.561 2.529) 7.032 11.457 ( -6.654 -1.833 -4.544) 8.263 11.871 ( 0.191 4.271 -1.524) 4.539 12.337 ( 2.563 -11.101 -3.464) 11.909 12.624 ( 0.323 3.526 -0.040) 3.541 12.922 ( -10.271 13.665 0.256) 17.096 13.411 ( 8.931 -7.755 0.314) 11.832 14.258 ( 6.225 0.773 -0.592) 6.301 14.563 ( 17.964 9.332 0.445) 20.248 14.953 ( 14.377 6.256 -0.072) 15.680 15.205 ( 7.325 9.798 -0.311) 12.237 16.560 ( 2.876 2.557 2.449) 4.561 17.706 ( -12.006 -4.994 -2.056) 13.165 18.950 ( -3.990 -16.141 -1.214) 16.672 19.108 ( -8.547 8.872 -1.573) 12.419 20.965 ( 0.644 0.139 0.070) 0.663 21.272 ( 0.148 -2.584 -1.265) 2.881 21.728 ( 18.553 11.540 1.085) 21.876 22.507 ( 6.942 3.843 1.773) 8.131 26.801 ( 3.696 2.575 0.106) 4.506 27.426 ( 2.781 5.291 -2.298) 6.404 27.472 ( 5.429 -2.750 -1.181) 6.199 27.671 ( 16.606 14.231 -3.854) 22.207 27.966 ( 1.877 0.568 0.316) 1.986 28.450 ( -8.390 -6.631 2.535) 10.990 28.672 ( -0.548 -2.023 0.506) 2.157 29.264 ( -3.317 1.903 -0.008) 3.824 29.389 ( 2.910 0.925 -2.649) 4.042 29.715 ( -7.153 -4.273 1.576) 8.480 29.898 ( -3.762 -2.783 -4.293) 6.350 30.180 ( 6.175 0.968 -0.021) 6.250 30.513 ( 1.877 4.068 2.748) 5.256 30.616 ( 4.030 1.870 -1.494) 4.687 30.855 ( 1.976 0.370 0.581) 2.093 32.256 ( -24.409 -14.015 5.832) 28.744 ======================= Grid point 222 (60/90) ======================= q-point: ( 0.38 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.195 ( 2.123 1.713 8.208) 8.650 1.599 ( -3.826 7.708 7.458) 11.387 1.805 ( 10.337 1.243 -1.944) 10.591 2.145 ( -8.634 -0.470 -1.723) 8.816 2.323 ( -4.832 -3.513 -3.398) 6.873 2.530 ( -4.241 -0.661 1.960) 4.719 2.632 ( 2.993 -2.454 0.345) 3.886 3.033 ( -0.192 2.171 5.294) 5.725 3.169 ( 3.203 -5.121 7.684) 9.773 3.289 ( 1.396 2.053 4.376) 5.031 3.746 ( 9.284 -4.048 6.897) 12.253 4.021 ( -1.313 -4.883 -8.752) 10.108 4.176 ( 0.291 2.163 -9.381) 9.632 4.673 ( 10.752 12.013 7.095) 17.614 4.862 ( 12.465 1.140 0.976) 12.555 5.126 ( 2.439 11.011 -5.796) 12.680 5.418 ( 12.163 -3.770 3.036) 13.091 5.522 ( 14.263 10.907 -0.248) 17.958 6.142 ( 6.245 -3.451 3.836) 8.101 6.266 ( 2.209 6.980 0.914) 7.377 6.651 ( 6.043 7.219 -5.590) 10.949 6.897 ( 21.330 12.877 -9.970) 26.836 7.300 ( -12.166 -7.849 6.062) 15.696 7.435 ( -27.117 -8.756 4.189) 28.802 7.654 ( -3.476 0.867 -5.998) 6.986 8.053 ( -8.045 -3.491 -7.006) 11.225 8.066 ( 1.710 -7.286 -4.914) 8.953 8.376 ( -10.417 -0.340 -5.271) 11.679 8.739 ( 2.965 -6.265 -2.491) 7.365 8.868 ( -27.228 -2.205 3.722) 27.570 8.949 ( -10.100 -8.717 0.614) 13.355 9.451 ( 3.105 1.174 -0.530) 3.362 9.687 ( -2.261 -10.082 3.670) 10.965 10.674 ( -8.999 -2.268 3.764) 10.015 10.917 ( 0.506 -6.972 3.712) 7.914 11.296 ( -7.151 -2.453 -2.465) 7.952 11.977 ( 3.879 5.297 -2.068) 6.883 12.289 ( -0.423 -1.676 -3.547) 3.946 12.615 ( -1.595 0.487 0.011) 1.668 13.005 ( 1.237 10.832 0.991) 10.948 13.455 ( 4.848 -6.618 0.390) 8.213 14.306 ( 0.683 -1.161 -1.234) 1.826 14.897 ( 14.569 3.099 1.827) 15.006 15.177 ( 7.921 1.409 0.028) 8.046 15.391 ( 1.965 8.530 -2.445) 9.088 16.716 ( 9.653 8.068 0.283) 12.584 17.387 ( -18.301 -6.422 -2.715) 19.584 18.779 ( -0.653 -11.013 -0.710) 11.056 19.116 ( -2.042 8.592 -2.714) 9.239 20.951 ( -0.571 -1.827 0.512) 1.981 21.188 ( -4.198 -2.931 -0.779) 5.178 22.139 ( 15.675 8.201 2.023) 17.806 22.644 ( 4.368 2.778 1.834) 5.491 26.896 ( 3.872 3.090 0.202) 4.958 27.367 ( -3.988 -2.583 -0.053) 4.752 27.518 ( 0.909 -0.924 -0.611) 1.433 27.989 ( 1.368 0.822 1.265) 2.036 28.148 ( 16.362 12.713 -5.328) 21.395 28.285 ( -6.249 -1.514 3.934) 7.538 28.677 ( 3.830 -2.669 -0.512) 4.696 29.220 ( -3.739 1.843 -0.142) 4.172 29.422 ( 0.078 -2.226 -6.029) 6.427 29.568 ( -4.344 -2.030 0.712) 4.848 29.813 ( -2.719 -3.005 -4.601) 6.132 30.282 ( 4.348 0.598 -0.176) 4.393 30.573 ( -0.399 5.577 2.224) 6.017 30.660 ( 2.147 -2.915 -0.476) 3.651 30.970 ( 8.533 5.303 1.101) 10.107 31.728 ( -21.854 -12.797 7.267) 26.347 ======================= Grid point 223 (61/90) ======================= q-point: (-0.50 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.294 ( 3.837 4.694 2.408) 6.524 1.656 ( 1.817 7.592 4.109) 8.822 1.919 ( 2.168 -2.156 -6.980) 7.621 2.074 ( -1.104 5.513 1.604) 5.847 2.207 ( -5.016 -2.477 -1.218) 5.725 2.510 ( 2.098 0.933 3.963) 4.580 2.657 ( 2.471 -2.139 0.205) 3.275 3.017 ( -5.690 4.176 6.921) 9.885 3.168 ( 3.663 -5.366 2.717) 7.042 3.282 ( 0.249 -5.967 9.322) 11.071 3.806 ( 4.559 -2.174 2.966) 5.857 3.882 ( -4.436 -10.079 -3.251) 11.481 4.219 ( -0.303 3.420 -9.155) 9.778 4.905 ( 5.461 -1.385 1.855) 5.931 4.966 ( -1.274 3.095 -3.033) 4.517 5.263 ( 3.927 -1.370 8.124) 9.127 5.437 ( -4.274 -3.837 3.773) 6.872 5.888 ( -0.129 1.338 -0.599) 1.472 6.174 ( 6.662 9.941 -2.486) 12.222 6.308 ( 0.835 0.565 1.089) 1.484 6.669 ( -8.317 -4.152 -4.103) 10.160 6.915 ( -6.243 -9.216 5.675) 12.495 7.158 ( 0.123 7.758 -3.714) 8.602 7.340 ( -1.355 4.907 -8.919) 10.270 7.568 ( -2.645 1.320 3.137) 4.310 7.917 ( -3.703 -3.218 -5.121) 7.091 8.069 ( 8.701 -2.705 -10.437) 13.855 8.263 ( -4.539 6.976 -4.200) 9.322 8.619 ( -4.157 8.886 3.251) 10.335 8.732 ( -3.302 -1.007 0.769) 3.537 8.882 ( 13.283 -9.227 -4.212) 16.713 9.445 ( -2.407 -7.811 4.363) 9.266 9.665 ( 6.666 2.438 -2.439) 7.506 10.597 ( 1.698 2.865 2.216) 4.000 10.875 ( -0.485 -1.851 5.410) 5.738 11.215 ( -0.887 -0.595 -0.180) 1.083 12.023 ( -1.523 0.036 -4.820) 5.055 12.289 ( -2.895 4.491 -0.114) 5.345 12.607 ( -0.095 1.530 -0.476) 1.606 13.084 ( 3.126 -3.885 0.881) 5.064 13.463 ( 0.567 -0.307 0.196) 0.674 14.284 ( -0.785 -2.014 -0.602) 2.244 15.079 ( 3.662 1.728 1.033) 4.179 15.261 ( 2.238 -1.686 0.893) 2.941 15.394 ( -5.400 -1.143 -2.477) 6.050 16.989 ( 0.718 2.534 -1.996) 3.305 17.041 ( -3.668 1.129 -1.267) 4.042 18.721 ( -0.732 1.444 -0.558) 1.713 19.155 ( 0.939 -0.459 -3.589) 3.738 20.933 ( 2.310 -4.204 0.674) 4.844 21.128 ( -2.331 3.313 -0.221) 4.057 22.331 ( 1.578 -0.575 2.036) 2.640 22.683 ( -1.121 -0.174 2.079) 2.368 26.955 ( -0.014 0.152 0.220) 0.268 27.305 ( -0.224 -0.254 0.289) 0.445 27.514 ( -0.092 -0.235 -0.177) 0.308 28.011 ( 1.114 -0.330 1.189) 1.662 28.180 ( -5.078 -1.027 3.959) 6.520 28.415 ( 5.225 3.197 -3.160) 6.893 28.723 ( 0.502 2.049 -2.570) 3.325 29.194 ( -1.329 2.429 -0.827) 2.890 29.321 ( -3.403 -5.844 -1.719) 6.978 29.599 ( 5.384 1.982 -5.273) 7.792 29.757 ( -0.915 -1.882 -3.938) 4.460 30.311 ( -0.754 -1.073 0.383) 1.366 30.602 ( -2.996 5.488 1.440) 6.417 30.673 ( 4.345 -3.806 -0.739) 5.823 31.112 ( -5.093 -1.664 3.832) 6.587 31.422 ( 3.537 1.141 6.025) 7.079 ======================= Grid point 225 (62/90) ======================= q-point: (-0.38 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.347 ( -2.311 3.841 -0.160) 4.485 1.754 ( 0.189 4.793 -1.080) 4.917 1.896 ( -3.525 -1.569 -7.141) 8.116 2.134 ( 6.264 -0.224 -0.767) 6.315 2.194 ( 0.771 9.329 3.721) 10.073 2.577 ( 4.810 -3.253 1.420) 5.978 2.689 ( 3.969 -0.559 0.981) 4.126 2.947 ( -7.335 5.551 5.071) 10.503 3.171 ( 2.059 -7.694 5.973) 9.955 3.198 ( -1.404 -7.168 14.104) 15.884 3.669 ( -9.266 -11.762 4.576) 15.657 3.899 ( 5.345 3.071 -3.539) 7.108 4.194 ( -5.376 1.508 -8.375) 10.066 4.835 ( -3.089 -7.312 0.202) 7.940 4.976 ( -4.822 5.483 -5.994) 9.447 5.049 ( -11.478 -15.426 1.220) 19.267 5.311 ( -6.375 -4.387 6.196) 9.914 5.603 ( -17.465 -12.527 -2.533) 21.642 6.181 ( -7.599 1.986 3.979) 8.805 6.432 ( -7.806 1.135 -7.574) 10.936 6.536 ( 3.093 -6.487 -1.910) 7.436 6.692 ( -14.946 -7.650 1.367) 16.845 7.275 ( 3.798 4.929 2.235) 6.612 7.448 ( 6.860 9.567 1.135) 11.827 7.597 ( 10.824 6.411 -1.926) 12.726 7.946 ( 5.562 2.859 -4.898) 7.944 8.208 ( 2.181 8.227 2.217) 8.795 8.363 ( 3.589 8.026 -12.224) 15.058 8.673 ( 0.076 5.385 0.653) 5.425 8.918 ( 21.254 9.824 1.789) 23.483 9.103 ( 23.024 -6.599 -5.754) 24.632 9.345 ( 0.103 -6.313 3.189) 7.073 9.832 ( 7.175 4.670 -2.025) 8.797 10.753 ( 8.339 2.586 0.355) 8.738 10.898 ( 1.971 9.835 4.524) 11.004 11.247 ( 3.983 1.269 -0.503) 4.210 11.958 ( -2.833 -4.746 -2.273) 5.976 12.252 ( -7.796 8.862 -1.002) 11.846 12.639 ( 0.785 2.608 -1.126) 2.948 13.032 ( 4.502 -18.505 -0.180) 19.046 13.463 ( -4.526 6.029 -0.262) 7.543 14.256 ( -0.953 -0.834 1.007) 1.618 15.006 ( -13.138 -3.921 -3.720) 14.207 15.182 ( -8.393 -2.545 0.121) 8.771 15.269 ( -2.471 -8.413 3.100) 9.300 16.716 ( -11.588 -4.725 0.422) 12.521 17.368 ( 16.359 8.995 -1.844) 18.760 18.782 ( -0.408 13.160 -0.939) 13.199 19.134 ( 2.829 -8.932 -3.244) 9.915 20.947 ( 4.293 -4.985 0.672) 6.613 21.175 ( 0.692 7.846 -0.278) 7.882 22.169 ( -14.051 -9.401 0.853) 16.927 22.616 ( -4.871 -2.924 2.990) 6.420 26.898 ( -3.946 -2.942 0.139) 4.924 27.357 ( 3.768 2.298 0.398) 4.431 27.514 ( -0.849 0.997 -0.366) 1.360 28.009 ( -1.235 -1.436 0.550) 1.972 28.035 ( -11.984 -3.608 1.082) 12.562 28.445 ( 3.892 -7.285 -4.366) 9.342 28.697 ( -5.931 4.966 -2.648) 8.176 29.224 ( 0.213 4.571 -0.832) 4.651 29.280 ( 2.907 -2.410 2.017) 4.281 29.708 ( 3.770 1.229 -2.717) 4.807 29.772 ( 4.852 0.532 -5.827) 7.601 30.256 ( -2.770 -2.969 0.308) 4.072 30.572 ( -5.309 2.896 2.872) 6.695 30.712 ( 1.959 -2.513 -3.058) 4.416 30.888 ( -8.423 -5.112 5.038) 11.066 31.760 ( 20.987 12.124 5.670) 24.891 ======================= Grid point 226 (63/90) ======================= q-point: (-0.25 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.318 ( -4.759 3.349 3.560) 6.822 1.735 ( -0.764 -6.774 -1.666) 7.017 1.794 ( -8.445 4.947 -4.549) 10.793 2.280 ( 5.640 4.049 1.829) 7.180 2.343 ( 7.345 5.676 -0.798) 9.317 2.583 ( 2.314 -5.829 1.238) 6.392 2.756 ( 3.945 -2.454 -0.524) 4.675 2.901 ( -5.829 7.068 3.843) 9.935 3.021 ( -3.955 -15.188 9.691) 18.446 3.135 ( -3.787 -1.899 14.653) 15.253 3.344 ( -15.807 -5.748 10.444) 19.798 4.040 ( 4.460 4.888 -4.989) 8.287 4.151 ( 2.368 0.659 -13.083) 13.312 4.674 ( -16.154 -10.360 -4.542) 19.721 4.745 ( -3.127 -5.878 1.795) 6.896 4.946 ( -1.112 1.375 -9.221) 9.389 5.192 ( -7.311 -0.338 3.201) 7.989 5.229 ( -7.087 -11.398 -2.525) 13.657 6.013 ( -10.630 -3.457 5.705) 12.550 6.216 ( -11.770 -8.122 1.416) 14.370 6.348 ( -11.457 -5.607 -4.542) 13.540 6.478 ( -7.047 -4.912 -10.755) 13.764 7.448 ( 2.114 6.735 1.702) 7.262 7.546 ( 10.170 6.164 6.315) 13.465 7.849 ( 4.108 -5.466 -3.890) 7.866 8.087 ( 6.111 3.995 -0.538) 7.320 8.337 ( 0.801 7.156 2.880) 7.755 8.549 ( 11.930 13.760 -3.071) 18.468 8.889 ( 12.689 12.668 0.081) 17.931 9.276 ( 13.197 3.805 -0.506) 13.744 9.314 ( 2.025 -3.071 2.614) 4.513 9.567 ( 28.786 4.186 -4.002) 29.363 9.988 ( 7.278 3.579 -2.762) 8.568 10.861 ( 5.749 1.339 1.968) 6.223 11.066 ( -0.308 8.920 -1.701) 9.086 11.363 ( 8.230 2.438 -0.861) 8.626 11.862 ( -2.779 -3.402 -1.089) 4.526 12.275 ( -2.328 15.125 -0.498) 15.311 12.643 ( -1.583 -3.202 -0.805) 3.662 12.964 ( 11.696 -16.030 -1.745) 19.920 13.410 ( -9.310 6.757 -0.088) 11.504 14.214 ( -4.798 0.015 1.535) 5.037 14.623 ( -18.487 -16.431 -2.869) 24.899 14.950 ( -13.919 -6.874 0.325) 15.527 15.136 ( -6.778 -2.710 3.216) 7.976 16.561 ( -3.527 -1.356 2.463) 4.510 17.689 ( 12.047 6.229 -1.366) 13.631 18.955 ( 3.450 17.019 -1.459) 17.426 19.125 ( 7.625 -8.490 -2.103) 11.604 20.958 ( 1.204 -3.695 0.342) 3.901 21.251 ( -0.911 3.969 -0.415) 4.093 21.763 ( -18.663 -12.062 -0.347) 22.224 22.485 ( -6.021 -3.742 2.824) 7.631 26.803 ( -3.785 -2.494 0.058) 4.533 27.406 ( -3.024 -4.565 -1.360) 5.642 27.481 ( -4.956 3.023 -1.459) 5.986 27.662 ( -16.996 -9.915 -3.075) 19.915 27.974 ( -2.105 -1.204 -0.037) 2.425 28.497 ( 8.828 -2.860 -1.040) 9.338 28.689 ( -0.688 4.847 -0.148) 4.898 29.264 ( 0.189 2.551 -0.274) 2.573 29.319 ( 1.296 0.719 1.631) 2.204 29.775 ( 3.858 1.778 0.988) 4.361 29.883 ( 5.461 1.625 -5.499) 7.919 30.174 ( -3.020 -3.845 -0.619) 4.928 30.493 ( -5.242 0.429 3.944) 6.574 30.637 ( -5.072 -3.283 -2.020) 6.371 30.829 ( 1.273 -0.404 1.518) 2.022 32.268 ( 23.602 13.733 5.218) 27.801 ======================= Grid point 227 (64/90) ======================= q-point: (-0.12 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.303 ( 1.230 4.204 13.046) 13.762 1.648 ( -6.275 0.446 0.767) 6.338 1.687 ( -4.677 -5.359 -0.637) 7.142 2.364 ( 4.913 -2.952 0.877) 5.798 2.496 ( 5.580 0.006 -0.738) 5.628 2.584 ( 2.460 -1.218 0.221) 2.753 2.714 ( -10.058 1.654 -2.044) 10.396 2.823 ( -1.924 1.246 10.182) 10.436 2.905 ( 0.093 -4.097 2.437) 4.769 3.035 ( -7.302 -0.753 2.145) 7.647 3.120 ( -5.326 -3.421 21.255) 22.178 4.079 ( 0.462 -0.116 -1.855) 1.915 4.198 ( -4.733 -5.131 -4.484) 8.297 4.431 ( 0.007 2.751 -22.809) 22.975 4.653 ( -3.618 -2.753 -1.353) 4.743 4.947 ( 1.293 -0.485 -6.656) 6.798 5.097 ( 0.139 1.955 -0.063) 1.961 5.169 ( -0.417 -2.463 -1.740) 3.044 5.837 ( -4.294 -2.916 4.129) 6.632 5.987 ( -6.860 -4.339 2.216) 8.414 6.107 ( -11.448 -5.458 -2.938) 13.018 6.336 ( -4.378 -3.038 -11.588) 12.754 7.525 ( 0.548 5.579 -4.550) 7.220 7.717 ( -6.255 -8.590 -7.156) 12.810 7.781 ( 8.621 4.324 11.136) 14.731 8.255 ( 9.183 2.288 3.603) 10.126 8.377 ( -0.982 3.149 2.230) 3.981 8.867 ( 10.340 8.523 5.200) 14.374 9.166 ( 5.808 8.147 2.578) 10.332 9.299 ( 0.247 -3.882 2.400) 4.570 9.480 ( 6.620 2.558 -4.664) 8.493 10.031 ( 17.709 8.215 -1.360) 19.569 10.139 ( 7.152 1.866 -1.899) 7.632 10.956 ( 2.435 1.228 1.868) 3.305 11.024 ( -5.391 -1.017 0.161) 5.488 11.492 ( 1.136 0.876 -3.111) 3.426 11.935 ( 13.516 7.321 -1.467) 15.441 12.312 ( -6.250 -0.274 -0.222) 6.260 12.606 ( -0.234 0.481 -0.800) 0.962 13.165 ( 19.814 -0.253 -1.108) 19.847 13.331 ( -4.180 7.383 0.192) 8.486 14.042 ( -14.221 -5.294 0.514) 15.183 14.136 ( -19.668 -16.678 -0.569) 25.794 14.660 ( -10.333 -5.470 0.683) 11.711 15.023 ( -3.945 -1.144 2.887) 5.021 16.543 ( 0.640 0.445 3.272) 3.364 17.858 ( 3.795 2.149 -0.912) 4.456 19.196 ( 8.598 9.631 -1.354) 12.981 19.237 ( 8.770 0.937 -1.123) 8.891 20.905 ( -3.440 -2.366 -0.164) 4.178 21.076 ( -15.196 -9.394 -0.424) 17.870 21.523 ( -1.913 -0.771 -1.203) 2.388 22.379 ( -2.989 -1.843 0.939) 3.635 26.734 ( -2.151 -1.234 0.015) 2.480 26.983 ( -22.130 -12.256 -3.700) 25.566 27.487 ( 0.220 0.932 -0.100) 0.963 27.513 ( -1.792 -1.601 -0.091) 2.405 27.934 ( -1.322 -0.763 -0.066) 1.527 28.649 ( 8.681 1.400 0.769) 8.827 28.737 ( 0.956 2.953 -0.038) 3.104 29.280 ( -0.068 0.985 0.304) 1.033 29.316 ( -1.516 -0.538 0.401) 1.658 29.870 ( 4.588 2.405 1.929) 5.528 29.961 ( 1.983 1.044 -2.145) 3.102 30.093 ( -2.484 -2.421 -0.749) 3.549 30.436 ( -1.189 -0.376 1.894) 2.268 30.528 ( -4.749 -2.140 -1.637) 5.460 30.849 ( 0.838 0.141 0.726) 1.118 32.741 ( 17.161 9.955 1.933) 19.934 ======================= Grid point 229 (65/90) ======================= q-point: ( 0.12 0.12 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.373 ( 1.924 8.019 7.393) 11.075 1.559 ( -8.049 -1.321 -3.765) 8.983 1.784 ( -1.450 10.626 2.435) 10.997 2.342 ( -3.344 -8.486 0.144) 9.122 2.403 ( 3.573 1.639 -0.110) 3.932 2.547 ( -1.004 -1.829 0.155) 2.092 2.755 ( -4.691 -2.178 6.546) 8.343 2.867 ( 5.454 -0.926 -4.338) 7.030 3.037 ( 10.054 1.731 3.968) 10.947 3.108 ( 2.480 4.192 20.449) 21.021 3.293 ( 7.481 13.749 6.968) 17.133 4.106 ( -1.499 4.112 -3.577) 5.653 4.174 ( 2.407 -6.796 -9.253) 11.730 4.496 ( 0.293 11.121 -10.439) 15.255 4.683 ( -1.665 1.024 1.558) 2.500 4.895 ( -0.440 5.129 -4.613) 6.912 5.171 ( 5.686 3.326 -0.275) 6.593 5.233 ( 5.263 2.904 -2.278) 6.428 5.988 ( 5.988 15.621 5.714) 17.678 6.066 ( 1.619 5.843 2.371) 6.510 6.300 ( 7.772 13.037 -4.126) 15.729 6.452 ( 6.156 7.263 -11.723) 15.102 7.604 ( 2.797 -8.316 1.458) 8.895 7.631 ( -0.927 -7.252 -0.795) 7.354 7.739 ( -1.142 3.631 -0.780) 3.885 8.128 ( -3.216 -4.990 2.356) 6.387 8.355 ( -4.740 -1.512 -1.343) 5.154 8.707 ( -6.407 -12.002 -1.385) 13.676 9.037 ( -8.615 -17.362 -1.163) 19.416 9.246 ( -3.946 -1.076 5.495) 6.850 9.352 ( -0.105 -9.435 -1.685) 9.585 9.682 ( -11.940 -22.682 1.964) 25.708 9.907 ( -14.077 -8.782 -0.961) 16.620 10.896 ( -1.265 -6.549 1.291) 6.794 11.060 ( -6.927 5.861 -1.322) 9.170 11.562 ( 9.738 -1.224 -1.457) 9.923 11.674 ( -8.504 -11.447 -2.427) 14.465 12.396 ( -10.429 -0.962 -1.314) 10.555 12.577 ( -4.088 -10.862 -1.087) 11.656 12.908 ( 13.699 0.216 -0.457) 13.709 13.567 ( 1.150 16.460 -0.650) 16.513 14.100 ( 0.846 3.254 0.242) 3.370 14.470 ( 11.129 16.112 1.453) 19.635 14.861 ( 6.820 13.602 0.363) 15.221 15.158 ( 8.184 7.961 -0.114) 11.418 16.553 ( 1.390 2.391 2.539) 3.754 17.767 ( -3.525 -8.778 -1.490) 9.576 18.957 ( -14.359 -12.749 -2.617) 19.380 19.198 ( 4.429 -1.700 -0.780) 4.807 20.876 ( -2.072 -5.731 0.122) 6.095 21.403 ( 10.873 21.371 0.628) 23.986 21.554 ( 1.855 3.804 -0.886) 4.324 22.459 ( 4.310 5.804 2.142) 7.540 26.781 ( 2.201 3.438 0.045) 4.083 27.343 ( 9.155 14.179 -4.469) 17.459 27.508 ( -3.275 3.010 -0.352) 4.462 27.571 ( 10.276 10.341 -2.954) 14.875 27.962 ( 0.993 2.486 0.115) 2.679 28.477 ( -5.408 -9.585 2.628) 11.315 28.714 ( -2.850 -0.002 0.191) 2.857 29.245 ( -1.017 -4.385 -0.902) 4.591 29.394 ( 3.443 3.487 -0.814) 4.967 29.774 ( -4.695 -4.635 1.806) 6.840 29.910 ( -2.107 -5.275 -4.330) 7.142 30.128 ( 1.724 3.439 0.624) 3.897 30.505 ( 3.831 4.955 3.778) 7.315 30.599 ( 1.714 4.270 -3.207) 5.609 30.832 ( 0.082 -1.279 1.176) 1.739 32.403 ( -13.762 -23.094 4.752) 27.300 ======================= Grid point 230 (66/90) ======================= q-point: ( 0.25 0.12 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.357 ( -10.286 10.497 0.433) 14.703 1.618 ( 10.695 2.157 1.018) 10.958 1.815 ( -6.752 11.460 4.489) 14.038 2.229 ( -2.367 -3.830 -0.712) 4.558 2.381 ( -5.666 -0.723 -5.699) 8.068 2.572 ( -0.020 2.489 0.554) 2.550 2.645 ( -4.506 0.152 6.311) 7.756 2.943 ( 7.863 -7.189 -4.737) 11.659 3.087 ( 1.147 -1.655 13.345) 13.496 3.250 ( 5.060 -0.313 10.751) 11.887 3.533 ( 11.824 0.734 7.429) 13.984 4.037 ( -4.596 -3.885 -8.409) 10.341 4.239 ( 0.378 8.745 -6.187) 10.719 4.625 ( 5.545 8.297 1.831) 10.146 4.711 ( 4.935 2.607 1.152) 5.699 5.029 ( 10.417 -1.649 -0.034) 10.547 5.335 ( 2.807 9.199 0.314) 9.623 5.423 ( 12.863 14.353 -2.597) 19.447 6.087 ( -0.435 3.056 3.640) 4.773 6.305 ( 6.053 14.594 2.275) 15.963 6.617 ( 5.297 5.922 -10.705) 13.331 6.651 ( 19.939 13.015 -4.422) 24.218 7.377 ( -9.469 -14.001 5.780) 17.863 7.654 ( -2.364 -10.600 -6.476) 12.644 7.676 ( -4.456 2.231 -0.823) 5.051 8.056 ( -2.905 -3.041 -1.025) 4.328 8.197 ( -11.225 -1.647 -6.252) 12.954 8.475 ( -6.611 -7.588 -9.733) 14.000 8.667 ( -9.816 -13.486 -1.879) 16.786 9.086 ( -11.849 -8.429 3.705) 15.005 9.263 ( -15.110 -6.719 7.815) 18.290 9.361 ( 4.294 -6.066 2.285) 7.775 9.605 ( -7.269 -12.034 0.947) 14.091 10.832 ( 0.916 -4.584 2.816) 5.458 10.902 ( -15.565 3.386 0.295) 15.932 11.431 ( -11.004 -4.070 -2.627) 12.023 11.758 ( 18.929 -13.574 0.568) 23.300 12.166 ( -10.075 -1.936 -4.168) 11.074 12.422 ( 7.563 -21.289 -0.798) 22.607 13.267 ( 9.799 18.345 -0.025) 20.798 13.636 ( -16.057 25.229 0.813) 29.916 14.163 ( 8.404 -8.259 -1.383) 11.864 14.759 ( 9.840 9.624 3.081) 14.104 15.088 ( 6.705 8.181 0.001) 10.578 15.377 ( 7.600 5.179 -2.215) 9.459 16.676 ( 6.636 9.998 -0.044) 12.000 17.573 ( -9.786 -8.855 -2.670) 13.465 18.613 ( -6.975 -17.421 -3.754) 19.137 19.298 ( 1.019 10.841 -0.444) 10.898 20.745 ( 0.327 -17.016 0.285) 17.022 21.500 ( -12.059 18.305 -0.138) 21.921 21.893 ( 21.189 6.158 1.781) 22.138 22.605 ( 5.216 5.804 2.232) 8.116 26.868 ( 3.675 4.018 0.162) 5.447 27.410 ( -2.733 -2.273 -0.214) 3.561 27.472 ( 0.050 -2.018 -0.731) 2.147 27.989 ( 4.212 4.729 -0.158) 6.335 28.042 ( 12.917 18.534 -6.554) 23.523 28.345 ( -1.659 -3.259 3.914) 5.356 28.661 ( -4.138 1.911 0.825) 4.632 29.183 ( 1.255 -8.175 -2.608) 8.672 29.444 ( -1.297 1.308 -2.212) 2.879 29.652 ( -5.541 -1.716 0.517) 5.824 29.814 ( -2.254 -5.113 -4.534) 7.196 30.215 ( 4.608 2.766 1.005) 5.468 30.608 ( 1.077 1.932 2.743) 3.524 30.644 ( 0.279 4.562 -1.803) 4.913 30.875 ( 6.347 1.761 1.212) 6.698 31.913 ( -18.372 -20.316 6.693) 28.196 ======================= Grid point 231 (67/90) ======================= q-point: ( 0.38 0.12 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.370 ( -0.965 10.067 2.385) 10.390 1.745 ( -1.096 8.565 2.758) 9.065 1.865 ( 2.302 5.329 -3.620) 6.842 2.185 ( -3.337 5.001 -1.135) 6.118 2.267 ( -6.048 -1.641 -4.164) 7.524 2.516 ( -2.443 -1.092 2.210) 3.471 2.663 ( -1.164 5.608 3.606) 6.768 2.976 ( 7.470 -12.274 -0.102) 14.369 3.092 ( 0.001 1.559 8.316) 8.460 3.243 ( -1.629 -4.361 12.588) 13.422 3.707 ( 9.037 -0.663 2.700) 9.455 3.883 ( -6.386 -7.875 -2.439) 10.428 4.315 ( -2.672 11.411 -5.882) 13.113 4.765 ( 3.118 -4.336 0.278) 5.348 4.895 ( 13.257 4.568 3.783) 14.523 5.138 ( 6.364 -7.173 5.353) 10.982 5.457 ( 2.169 5.242 2.221) 6.092 5.796 ( 9.553 3.877 2.455) 10.598 6.146 ( 7.073 11.644 0.358) 13.629 6.410 ( -5.058 7.276 -4.604) 9.987 6.730 ( 2.989 3.121 -5.978) 7.377 7.014 ( -16.477 -14.181 2.766) 21.915 7.183 ( 24.050 13.229 -7.526) 28.462 7.333 ( -15.164 -4.157 -1.063) 15.759 7.645 ( -5.935 -2.883 -6.590) 9.326 7.956 ( -2.620 -3.513 -5.081) 6.710 8.037 ( -6.578 1.375 -7.714) 10.231 8.379 ( -3.952 1.115 -7.763) 8.782 8.544 ( 6.667 -7.948 -2.843) 10.756 8.811 ( -10.131 -1.881 3.096) 10.759 8.998 ( -15.709 6.922 7.549) 18.753 9.350 ( 0.812 -14.154 5.955) 15.377 9.512 ( 8.848 -6.056 -0.402) 10.729 10.710 ( -9.805 6.917 1.024) 12.042 10.845 ( 2.903 0.049 4.885) 5.683 11.262 ( -5.557 -0.963 -0.679) 5.681 11.859 ( 17.052 -29.262 -0.650) 33.874 12.040 ( -0.840 -6.304 -3.414) 7.218 12.429 ( 9.590 -9.458 -1.822) 13.592 13.527 ( 2.072 14.008 0.705) 14.178 13.554 ( -22.802 27.970 1.521) 36.119 14.193 ( 5.311 -8.670 -0.901) 10.207 15.005 ( 9.800 7.117 2.861) 12.445 15.214 ( 1.666 2.701 -0.276) 3.186 15.450 ( -1.073 -2.467 -1.805) 3.240 16.932 ( 9.197 13.470 -2.597) 16.516 17.275 ( -17.332 -5.020 -3.554) 18.391 18.453 ( 9.132 -18.696 -4.021) 21.192 19.390 ( -7.422 16.658 -0.876) 18.258 20.606 ( 7.283 -22.223 0.569) 23.393 21.478 ( -12.299 20.270 0.386) 23.713 22.206 ( 11.624 -0.945 2.642) 11.958 22.703 ( 0.865 2.906 1.822) 3.537 26.956 ( 1.776 2.532 0.286) 3.106 27.323 ( -2.889 -1.393 0.160) 3.211 27.460 ( 2.038 -4.550 -0.292) 4.994 28.019 ( 0.056 1.542 2.415) 2.866 28.254 ( -2.076 2.925 0.754) 3.666 28.463 ( 1.098 13.984 -2.922) 14.328 28.653 ( 5.717 0.266 -0.582) 5.753 29.139 ( 2.721 -8.369 -2.783) 9.230 29.368 ( -5.379 -2.651 -2.924) 6.672 29.590 ( -0.752 0.664 -1.812) 2.071 29.756 ( -1.380 -1.147 -3.955) 4.343 30.304 ( 2.155 1.774 0.542) 2.844 30.580 ( 1.089 -4.972 -0.788) 5.150 30.710 ( -1.913 8.480 2.074) 8.937 31.063 ( 10.490 3.673 1.533) 11.220 31.459 ( -13.527 -14.201 7.186) 20.887 ======================= Grid point 232 (68/90) ======================= q-point: (-0.50 0.12 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.431 ( -0.729 3.994 4.515) 6.073 1.823 ( -6.692 1.349 -6.948) 9.741 1.918 ( 6.433 10.220 -1.613) 12.183 2.131 ( -7.671 -0.810 -3.296) 8.388 2.265 ( 2.817 9.181 -1.071) 9.663 2.519 ( 2.298 1.564 3.437) 4.420 2.672 ( -2.218 1.861 0.375) 2.919 2.977 ( 6.316 -11.970 6.846) 15.167 3.092 ( -4.528 2.387 5.901) 7.811 3.170 ( -0.120 -3.068 10.886) 11.310 3.658 ( -5.186 -11.339 3.762) 13.024 3.870 ( 5.307 4.381 -1.412) 7.026 4.348 ( -6.805 9.685 -3.204) 12.263 4.729 ( 1.511 -8.176 1.745) 8.496 5.042 ( 0.744 -11.150 1.336) 11.255 5.056 ( -3.608 -6.050 0.169) 7.046 5.406 ( -8.292 0.028 4.093) 9.247 5.789 ( -7.635 -4.181 2.055) 8.944 6.260 ( -4.323 -4.539 -0.194) 6.271 6.526 ( 2.827 13.976 -5.902) 15.432 6.644 ( -15.563 4.726 0.747) 16.282 6.765 ( -2.974 -7.308 -0.583) 7.911 7.182 ( 4.171 -4.101 -1.680) 6.086 7.482 ( 2.388 11.443 -9.180) 14.864 7.601 ( -1.513 0.903 -1.069) 2.060 7.913 ( 0.781 -0.772 -7.614) 7.692 8.133 ( 15.192 7.749 -3.280) 17.366 8.379 ( 0.116 3.994 -9.638) 10.434 8.645 ( 8.454 -0.698 -1.833) 8.678 8.699 ( 1.809 -3.198 0.853) 3.772 8.940 ( -1.150 12.467 3.138) 12.908 9.247 ( 3.114 -9.740 6.141) 11.928 9.656 ( 12.416 -5.158 2.058) 13.602 10.710 ( 0.310 4.265 1.665) 4.589 10.956 ( 4.588 12.732 4.182) 14.165 11.227 ( -0.324 1.775 -0.969) 2.048 11.851 ( 20.106 -29.916 -2.488) 36.131 11.965 ( -0.077 -9.733 -0.584) 9.751 12.486 ( 6.506 -9.066 -2.733) 11.488 13.380 ( -23.412 18.478 1.326) 29.855 13.669 ( -3.713 16.910 -0.635) 17.324 14.199 ( 3.159 -4.385 1.468) 5.600 15.152 ( -6.797 -10.455 -0.133) 12.470 15.193 ( 2.352 7.331 0.853) 7.746 15.322 ( -7.601 -2.925 -0.576) 8.165 16.936 ( -17.971 -1.815 -2.568) 18.244 17.224 ( 11.670 10.765 -3.004) 16.158 18.532 ( 18.195 -14.870 -3.992) 23.836 19.346 ( -14.832 14.042 -1.322) 20.467 20.601 ( 14.720 -17.045 0.872) 22.538 21.488 ( -10.445 21.027 0.439) 23.482 22.217 ( -3.906 -10.701 2.317) 11.625 22.689 ( -4.228 0.726 2.152) 4.799 26.944 ( -3.597 -0.773 0.278) 3.690 27.332 ( 2.420 2.739 0.113) 3.657 27.463 ( 3.753 -4.284 0.007) 5.695 28.028 ( -0.479 0.546 2.437) 2.543 28.218 ( -7.179 5.768 2.400) 9.517 28.415 ( -7.745 -2.808 -4.240) 9.266 28.807 ( 0.960 5.837 -4.799) 7.617 29.074 ( 3.426 -11.602 1.188) 12.156 29.337 ( 1.202 5.147 -3.013) 6.084 29.630 ( 5.075 -1.099 -2.497) 5.762 29.739 ( -0.527 1.431 -4.005) 4.285 30.291 ( -3.528 -0.908 1.080) 3.800 30.594 ( 4.437 -3.206 -1.800) 5.762 30.735 ( -4.252 7.317 1.944) 8.683 30.997 ( -11.342 -8.058 4.035) 14.487 31.493 ( 19.407 3.878 5.583) 20.563 ======================= Grid point 233 (69/90) ======================= q-point: (-0.38 0.12 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.452 ( -2.419 5.888 1.667) 6.581 1.645 ( -5.565 -11.279 -4.587) 13.388 1.976 ( -9.276 -1.417 -1.792) 9.553 2.155 ( 9.729 5.219 -0.475) 11.051 2.405 ( 1.832 7.081 -3.810) 8.247 2.566 ( -4.988 4.040 6.348) 9.028 2.663 ( 5.438 -0.878 -1.311) 5.662 2.907 ( 0.927 -12.199 3.471) 12.717 3.046 ( -2.878 3.873 6.756) 8.302 3.164 ( -1.938 1.351 14.043) 14.241 3.488 ( -6.144 -4.968 10.136) 12.852 4.011 ( 6.096 5.500 -8.109) 11.540 4.250 ( -11.215 3.095 -2.433) 11.886 4.684 ( -0.219 -6.732 2.971) 7.361 4.776 ( -8.541 -9.945 -3.932) 13.686 4.984 ( -3.521 -3.950 -3.876) 6.559 5.297 ( -7.418 4.073 2.346) 8.782 5.440 ( -22.002 -5.065 -2.504) 22.716 6.188 ( -2.467 -5.250 2.475) 6.306 6.331 ( -19.172 -2.057 6.475) 20.340 6.526 ( -12.947 1.583 -6.195) 14.440 6.611 ( -8.815 -0.883 -9.547) 13.024 7.354 ( 14.339 3.143 5.824) 15.792 7.548 ( -2.148 4.889 -3.301) 6.278 7.719 ( 7.391 1.896 -0.467) 7.644 8.017 ( 8.591 4.324 -5.367) 11.014 8.323 ( 4.220 -1.635 -1.937) 4.923 8.467 ( 7.349 3.347 -10.299) 13.088 8.729 ( 12.616 -1.146 0.700) 12.688 9.096 ( 29.507 7.817 -0.651) 30.531 9.136 ( 9.470 10.106 -0.242) 13.851 9.254 ( 3.523 -0.620 6.368) 7.304 9.790 ( 11.844 -9.171 2.034) 15.117 10.770 ( 4.679 1.685 1.582) 5.219 11.157 ( -0.997 2.542 -1.600) 3.165 11.274 ( 9.050 8.458 0.036) 12.387 11.800 ( -0.407 -18.498 -0.241) 18.504 12.097 ( 21.852 3.395 -1.227) 22.148 12.473 ( 7.322 -15.330 -2.969) 17.246 13.134 ( -24.170 13.241 0.521) 27.564 13.727 ( -9.575 15.602 -1.819) 18.396 14.184 ( 1.100 -8.343 2.051) 8.661 14.808 ( -16.789 -11.440 -0.087) 20.317 15.112 ( -11.279 -3.093 0.584) 11.710 15.269 ( -5.739 5.661 -0.181) 8.064 16.671 ( -11.677 -0.471 0.137) 11.687 17.526 ( 13.707 6.885 -2.265) 15.505 18.728 ( 19.573 -11.219 -3.713) 22.864 19.226 ( -11.676 10.408 -1.006) 15.673 20.733 ( 13.884 -7.499 0.692) 15.795 21.520 ( -9.553 18.876 0.198) 21.156 21.903 ( -15.830 -17.061 1.003) 23.296 22.588 ( -7.799 -0.076 2.799) 8.287 26.860 ( -4.928 -0.678 0.130) 4.976 27.396 ( 1.391 1.594 -0.383) 2.150 27.499 ( 3.654 -2.019 -0.025) 4.175 27.970 ( -16.410 -0.894 -2.023) 16.559 28.033 ( -11.003 0.850 -2.515) 11.319 28.340 ( 4.930 -2.228 0.657) 5.450 28.753 ( -4.388 -1.268 -1.440) 4.789 29.136 ( 8.722 -2.440 -0.315) 9.062 29.412 ( -0.908 5.861 -1.014) 6.017 29.701 ( 4.563 -1.659 0.346) 4.868 29.794 ( 5.664 1.467 -5.690) 8.161 30.208 ( -4.334 -1.661 1.237) 4.804 30.605 ( -3.537 0.513 1.092) 3.737 30.684 ( -5.337 -1.266 -1.061) 5.587 30.824 ( -2.251 -0.430 2.915) 3.709 31.927 ( 26.325 4.383 6.028) 27.360 ======================= Grid point 238 (70/90) ======================= q-point: ( 0.25 0.25 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.440 ( -2.042 -0.337 3.100) 3.728 1.795 ( 5.428 12.720 -4.154) 14.440 1.973 ( -5.292 3.142 -0.475) 6.173 2.204 ( 6.517 2.123 0.477) 6.870 2.355 ( -3.586 -2.283 -5.116) 6.652 2.556 ( -4.196 -4.179 -1.284) 6.059 2.734 ( 1.237 -11.318 -2.349) 11.626 2.806 ( 1.581 13.901 8.469) 16.354 3.082 ( 0.627 0.789 9.069) 9.125 3.214 ( 2.520 -3.179 10.539) 11.293 3.542 ( 4.913 2.438 6.214) 8.289 3.913 ( -5.023 -8.064 -3.242) 10.038 4.451 ( 3.046 10.954 -0.255) 11.373 4.730 ( 6.911 -0.046 3.365) 7.687 4.802 ( -2.390 7.947 -1.199) 8.384 4.970 ( -0.825 -2.477 1.774) 3.157 5.455 ( 5.728 5.028 5.202) 9.228 5.743 ( 3.215 6.873 -0.238) 7.591 6.176 ( 2.466 10.941 1.019) 11.261 6.561 ( -1.537 11.482 -0.428) 11.592 6.692 ( 3.169 1.880 -6.654) 7.606 6.872 ( 21.447 7.172 -4.248) 23.010 7.109 ( -9.266 -9.166 -0.433) 13.041 7.551 ( -10.260 -3.433 -1.188) 10.884 7.654 ( 2.089 -3.948 -11.464) 12.304 7.914 ( -1.088 -6.934 -7.942) 10.599 8.154 ( -9.316 -8.055 -6.489) 13.921 8.430 ( 1.201 1.840 -8.958) 9.224 8.552 ( -6.962 5.745 1.621) 9.170 8.819 ( 3.046 -14.513 2.979) 15.125 9.112 ( -0.327 -8.198 6.787) 10.648 9.231 ( 6.905 -7.536 4.813) 11.298 9.460 ( -17.827 -5.014 3.201) 18.793 10.774 ( 4.177 -0.145 3.096) 5.201 11.057 ( -18.424 9.994 -0.937) 20.981 11.236 ( 6.479 -12.229 0.662) 13.855 11.560 ( -4.917 -8.893 1.000) 10.211 11.854 ( -3.910 -20.240 -1.268) 20.653 12.360 ( -0.712 6.561 -4.032) 7.734 13.570 ( 10.193 13.759 1.081) 17.157 13.967 ( 11.896 -6.925 -1.347) 13.831 14.068 ( -11.572 10.695 1.715) 15.850 14.964 ( 2.867 12.512 1.964) 12.985 15.245 ( 1.265 6.342 -0.351) 6.477 15.375 ( 5.261 -4.008 -0.505) 6.633 16.925 ( 8.674 14.898 -3.043) 17.506 17.382 ( -2.231 -10.297 -3.201) 11.011 18.307 ( -13.210 -13.865 -6.132) 20.109 19.535 ( 10.209 13.498 0.017) 16.924 20.411 ( -9.722 -16.763 0.423) 19.382 21.779 ( 3.890 8.002 1.179) 8.975 22.016 ( 4.117 7.692 2.260) 9.013 22.704 ( 2.891 3.904 2.064) 5.278 26.943 ( 2.772 3.454 0.417) 4.448 27.376 ( -4.154 -1.103 -0.126) 4.300 27.394 ( -0.264 -4.939 -0.211) 4.950 28.027 ( -0.048 0.428 3.158) 3.188 28.314 ( -0.155 3.778 -0.150) 3.784 28.405 ( 15.556 12.198 -3.448) 20.067 28.773 ( -8.923 9.340 -0.521) 12.928 28.992 ( 1.363 -11.475 -3.292) 12.016 29.411 ( -1.011 -3.072 -2.190) 3.905 29.593 ( -4.017 -5.480 -1.626) 6.986 29.770 ( 0.861 0.892 -3.973) 4.162 30.284 ( 3.084 4.356 1.168) 5.463 30.554 ( -3.495 -4.781 -1.551) 6.122 30.829 ( 0.937 12.071 3.516) 12.607 30.908 ( 8.466 1.374 1.272) 8.670 31.523 ( -12.429 -19.295 6.284) 23.796 ======================= Grid point 239 (71/90) ======================= q-point: ( 0.38 0.25 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.428 ( 0.901 -0.908 6.538) 6.661 1.947 ( -1.697 4.851 -2.661) 5.787 1.954 ( -1.101 4.916 -5.957) 7.802 2.272 ( -5.154 3.197 1.097) 6.163 2.307 ( -0.601 5.290 -5.008) 7.309 2.485 ( 0.801 -0.912 1.170) 1.686 2.630 ( 5.514 -12.059 -2.236) 13.447 2.947 ( -5.217 12.490 7.832) 15.639 3.130 ( 3.998 1.842 6.802) 8.102 3.155 ( -3.619 -5.482 10.022) 11.983 3.654 ( -1.899 -3.672 3.340) 5.315 3.761 ( 5.218 -4.187 1.249) 6.806 4.570 ( -4.641 11.685 0.602) 12.588 4.724 ( -4.402 3.301 0.102) 5.504 4.884 ( 4.541 -5.878 1.679) 7.615 4.945 ( 6.366 -10.967 2.979) 13.026 5.544 ( -4.439 4.428 5.542) 8.368 5.704 ( 4.852 -6.196 6.919) 10.479 6.383 ( -3.610 5.987 2.270) 7.350 6.612 ( 1.435 10.707 -6.753) 12.740 6.714 ( -0.296 -5.742 -5.114) 7.694 6.949 ( -9.475 10.476 -4.634) 14.865 7.188 ( -12.240 -11.343 -5.806) 17.669 7.317 ( 20.793 -0.386 -5.809) 21.593 7.665 ( -4.829 6.871 -8.078) 11.652 7.907 ( -2.133 -3.447 -10.669) 11.414 7.932 ( 8.630 -9.453 -6.890) 14.536 8.487 ( -3.478 6.273 -7.309) 10.241 8.610 ( -0.202 15.318 1.336) 15.378 8.799 ( -9.788 -2.248 5.674) 11.535 9.009 ( 8.268 -13.729 6.616) 17.338 9.139 ( -7.212 4.998 4.893) 10.047 9.363 ( 11.596 -10.135 3.175) 15.725 10.822 ( -6.816 4.894 2.836) 8.857 10.964 ( 5.508 5.674 2.903) 8.424 11.312 ( 2.639 9.307 -1.124) 9.739 11.370 ( -2.024 -17.305 0.701) 17.437 11.694 ( 11.458 -21.403 -1.318) 24.313 12.425 ( -0.375 2.577 -3.861) 4.657 13.744 ( -3.725 9.246 0.757) 9.997 13.879 ( -5.713 0.137 0.599) 5.746 14.135 ( 1.097 4.666 1.340) 4.977 15.129 ( 1.506 4.905 1.555) 5.361 15.244 ( -1.053 -1.580 -0.436) 1.948 15.372 ( -1.306 -1.987 -0.017) 2.378 17.172 ( 2.215 6.702 -3.939) 8.084 17.213 ( -8.503 1.452 -3.924) 9.476 18.134 ( 8.950 -12.199 -7.085) 16.706 19.727 ( -10.983 17.444 0.086) 20.614 20.196 ( 11.338 -19.178 0.514) 22.285 21.837 ( -8.923 15.753 1.705) 18.185 22.111 ( 5.057 -8.492 2.619) 10.225 22.744 ( -0.911 1.220 1.659) 2.251 26.985 ( -0.805 0.751 0.715) 1.313 27.325 ( 0.334 1.425 -0.134) 1.469 27.372 ( 1.530 -3.928 -0.246) 4.223 28.026 ( 0.256 -0.317 3.833) 3.854 28.345 ( -2.185 4.403 0.275) 4.923 28.625 ( -13.585 3.190 -0.775) 13.975 28.740 ( 12.383 8.292 -2.773) 15.158 28.932 ( 1.338 -12.163 -3.871) 12.834 29.380 ( -2.558 3.878 -2.885) 5.468 29.518 ( 3.734 -6.029 -2.008) 7.371 29.787 ( -1.285 2.114 -3.698) 4.450 30.354 ( -2.337 3.282 0.493) 4.059 30.477 ( 3.424 -5.060 -0.725) 6.152 30.900 ( -4.515 10.997 2.117) 12.075 31.066 ( -1.367 -5.137 1.643) 5.564 31.239 ( 6.175 -6.558 7.135) 11.491 ======================= Grid point 244 (72/90) ======================= q-point: (-0.12 0.25 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.238 ( 2.453 2.348 13.732) 14.146 1.628 ( 6.389 1.833 1.204) 6.755 1.694 ( 1.160 6.171 -1.924) 6.567 2.354 ( 3.166 -8.334 -0.437) 8.926 2.421 ( 0.255 -7.670 -2.300) 8.011 2.676 ( -1.098 0.887 -3.035) 3.347 2.725 ( 8.311 4.337 0.857) 9.413 2.919 ( -19.086 1.325 -1.163) 19.167 3.026 ( 1.168 4.395 12.570) 13.367 3.114 ( -9.579 9.430 10.601) 17.119 3.226 ( -5.654 11.791 12.852) 18.335 4.104 ( -3.235 -0.640 -2.360) 4.055 4.203 ( 2.716 -7.656 -18.016) 19.762 4.479 ( -1.864 17.297 -1.639) 17.475 4.716 ( 1.834 2.833 0.868) 3.484 4.890 ( 2.564 1.830 -5.391) 6.244 5.118 ( -3.931 3.920 -2.486) 6.083 5.352 ( -12.511 7.304 -4.143) 15.068 5.943 ( -1.232 11.876 4.088) 12.621 6.127 ( -9.034 6.525 2.828) 11.497 6.225 ( 0.031 11.551 -1.033) 11.597 6.487 ( -8.706 9.615 -12.750) 18.188 7.459 ( -0.434 -6.335 -1.248) 6.471 7.618 ( 5.231 -10.974 8.890) 15.061 7.927 ( -7.378 8.580 -10.168) 15.214 8.183 ( 0.615 -10.226 2.451) 10.534 8.226 ( 11.540 -5.681 7.212) 14.746 8.599 ( 8.649 -18.496 -2.756) 20.604 8.939 ( 7.216 -15.336 2.308) 17.106 9.328 ( 2.771 -0.389 0.079) 2.799 9.400 ( 1.585 -8.045 -0.540) 8.218 9.823 ( 15.761 -9.088 -4.233) 18.680 9.929 ( 8.368 -11.822 -1.436) 14.555 10.865 ( 6.205 -5.580 2.569) 8.732 11.041 ( -1.073 0.751 0.119) 1.315 11.566 ( -9.835 0.107 -1.189) 9.908 11.637 ( 12.990 -11.521 -1.455) 17.423 12.355 ( -6.289 -13.292 0.444) 14.712 12.576 ( 10.619 -8.758 -1.045) 13.804 12.933 ( 5.453 15.026 -1.866) 16.093 13.578 ( -12.522 9.563 -0.469) 15.763 14.101 ( -4.696 2.045 0.207) 5.126 14.534 ( -8.015 21.129 -2.172) 22.703 14.861 ( -9.142 13.188 0.024) 16.047 15.101 ( -4.661 6.076 3.533) 8.434 16.543 ( -0.685 1.364 3.050) 3.411 17.761 ( 5.253 -8.774 -1.287) 10.307 18.942 ( 5.188 -19.325 -2.056) 20.115 19.194 ( 4.280 3.338 -0.632) 5.465 20.901 ( 2.490 -3.407 -0.946) 4.325 21.420 ( -18.144 16.239 -0.068) 24.350 21.540 ( 3.726 7.738 -0.353) 8.595 22.463 ( -4.369 5.993 1.927) 7.663 26.780 ( -1.794 3.639 0.091) 4.058 27.337 ( -9.394 16.454 -4.639) 19.507 27.499 ( -5.530 -0.907 -0.086) 5.604 27.547 ( 0.142 8.898 -0.849) 8.940 27.964 ( -1.363 2.654 0.011) 2.984 28.560 ( 7.343 -5.371 -1.056) 9.159 28.686 ( -1.334 -1.272 0.685) 1.967 29.202 ( 3.122 -6.129 1.243) 6.990 29.384 ( -3.791 2.981 -0.064) 4.823 29.781 ( 4.755 -4.463 1.220) 6.635 29.922 ( 1.757 -3.383 -4.377) 5.804 30.171 ( -3.165 5.207 -1.198) 6.210 30.461 ( -1.697 0.586 2.493) 3.073 30.597 ( -2.447 5.599 -0.270) 6.117 30.849 ( -0.505 -0.237 0.402) 0.688 32.401 ( 13.791 -23.170 4.836) 27.394 ======================= Grid point 253 (73/90) ======================= q-point: (-0.25 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.288 ( -0.450 10.486 10.322) 14.721 1.537 ( 3.908 1.460 3.752) 5.611 1.796 ( -3.829 8.521 3.218) 9.880 2.177 ( 6.989 -8.420 -2.110) 11.144 2.350 ( 1.387 -5.798 -1.126) 6.067 2.555 ( 6.518 -4.806 1.628) 8.260 2.737 ( 1.949 6.592 -5.117) 8.570 3.009 ( 1.618 0.139 9.965) 10.096 3.155 ( -9.722 -1.207 -3.136) 10.286 3.242 ( -0.725 4.422 9.646) 10.636 3.667 ( -21.166 12.228 4.673) 24.887 4.101 ( 4.274 1.489 -8.015) 9.204 4.188 ( -4.440 3.343 -6.324) 8.419 4.580 ( 6.174 3.188 9.986) 12.165 4.745 ( -9.881 5.843 -2.714) 11.796 4.951 ( -6.142 -1.766 -6.214) 8.914 5.344 ( -11.642 14.882 -1.095) 18.926 5.606 ( -2.848 12.726 -6.685) 14.655 6.104 ( -6.515 10.368 5.125) 13.275 6.307 ( 2.839 9.873 2.100) 10.486 6.412 ( -17.535 2.459 2.993) 17.958 6.758 ( -10.836 10.157 -14.577) 20.811 7.321 ( 5.769 -14.214 7.621) 17.129 7.478 ( 2.178 -8.484 -0.783) 8.795 7.752 ( 18.799 -18.361 5.389) 26.825 8.090 ( 0.591 -3.256 -3.277) 4.657 8.149 ( -1.965 4.261 -2.602) 5.365 8.326 ( 3.896 -14.052 -7.798) 16.536 8.759 ( 0.934 -6.317 -0.640) 6.417 9.092 ( 20.882 -14.252 0.042) 25.282 9.209 ( 21.767 0.780 -4.301) 22.201 9.435 ( 4.533 -1.721 -2.166) 5.310 9.792 ( 2.735 -6.729 2.625) 7.723 10.716 ( 4.876 -3.422 3.978) 7.163 11.056 ( 2.494 2.974 3.205) 5.034 11.372 ( 8.111 -6.754 -4.058) 11.308 11.766 ( -16.720 -9.957 1.338) 19.506 12.109 ( 13.845 -16.117 -1.724) 21.317 12.398 ( -10.361 -15.653 0.202) 18.773 13.184 ( -0.580 28.152 -1.762) 28.213 13.725 ( 8.764 16.582 -1.287) 18.800 14.223 ( -8.888 -5.337 0.418) 10.375 14.851 ( -11.228 14.797 -2.553) 18.750 15.123 ( -9.252 6.139 -0.263) 11.106 15.252 ( -4.566 5.243 1.498) 7.112 16.629 ( -5.756 6.733 2.225) 9.133 17.508 ( 12.669 -11.252 -1.622) 17.021 18.689 ( 0.334 -23.604 -2.279) 23.716 19.221 ( 3.160 15.921 -0.821) 16.252 20.777 ( 0.407 -15.240 -1.253) 15.296 21.520 ( 12.027 16.952 0.262) 20.787 21.898 ( -22.139 7.810 1.046) 23.499 22.606 ( -4.723 5.725 2.038) 7.696 26.858 ( -3.004 3.946 0.214) 4.964 27.402 ( 1.826 -1.002 -0.674) 2.189 27.501 ( -0.237 -4.312 -0.120) 4.320 27.909 ( -14.919 14.757 -1.275) 21.023 28.032 ( -3.378 5.738 -1.007) 6.734 28.375 ( 9.033 -1.876 0.837) 9.264 28.735 ( -0.960 4.857 -1.662) 5.223 29.094 ( -1.528 -11.856 1.361) 12.031 29.463 ( -1.201 3.293 -3.282) 4.802 29.647 ( 6.502 -1.927 0.829) 6.832 29.849 ( 2.805 -3.182 -5.860) 7.235 30.275 ( -3.035 4.375 -1.573) 5.552 30.490 ( -2.274 -1.773 2.268) 3.668 30.699 ( -1.841 6.130 1.612) 6.601 30.885 ( -4.519 1.425 0.204) 4.743 31.912 ( 18.108 -20.131 6.769) 27.910 ======================= Grid point 254 (74/90) ======================= q-point: (-0.12 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.312 ( -2.208 4.337 1.553) 5.108 1.672 ( 5.900 2.267 -2.676) 6.863 1.856 ( -0.834 9.208 4.638) 10.344 2.172 ( 3.214 -9.649 1.262) 10.248 2.261 ( -2.830 -7.854 -1.285) 8.446 2.666 ( 3.474 -0.200 -2.833) 4.487 2.737 ( 4.371 -6.696 4.901) 9.379 2.885 ( -12.930 0.984 -1.856) 13.100 3.165 ( 2.164 6.227 9.418) 11.496 3.254 ( -4.041 5.206 9.754) 11.772 3.561 ( -6.508 19.943 7.549) 22.294 4.032 ( -8.886 -4.107 -6.285) 11.633 4.145 ( -0.165 0.734 -8.494) 8.527 4.757 ( 3.669 4.422 -3.174) 6.564 4.872 ( 9.134 13.936 6.586) 17.917 4.888 ( 1.380 4.074 -5.475) 6.963 5.317 ( -9.522 11.637 -0.556) 15.046 5.550 ( -13.620 15.805 -5.147) 21.490 6.151 ( -7.270 6.662 3.095) 10.335 6.284 ( 3.154 7.914 -2.490) 8.876 6.482 ( 2.618 16.602 2.180) 16.948 6.661 ( -10.690 6.332 -8.296) 14.940 7.285 ( 5.920 -12.306 5.748) 14.816 7.451 ( 1.754 -3.648 0.484) 4.076 7.767 ( 7.984 -27.097 4.661) 28.631 8.026 ( -2.407 -4.446 -2.410) 5.601 8.143 ( 2.073 0.646 3.542) 4.155 8.328 ( 7.974 -9.205 -12.545) 17.484 8.688 ( 1.510 -10.404 -1.399) 10.606 9.124 ( 2.914 -17.104 0.959) 17.377 9.352 ( -0.195 0.938 0.777) 1.234 9.559 ( -9.052 -16.603 -4.035) 19.336 9.755 ( 16.879 -6.524 -5.307) 18.858 10.804 ( 5.822 0.115 4.335) 7.259 10.950 ( -6.902 -11.830 -1.743) 13.806 11.316 ( 0.515 -8.668 2.339) 8.993 11.777 ( 17.885 7.136 -0.092) 19.256 12.070 ( -5.893 -10.124 -0.490) 11.724 12.418 ( 23.766 -4.956 -0.527) 24.282 13.323 ( -9.853 18.112 -2.539) 20.775 13.667 ( -31.057 0.234 -0.422) 31.061 14.148 ( 8.833 2.749 -0.514) 9.266 14.871 ( -3.100 14.012 -2.585) 14.582 15.085 ( -2.912 9.482 0.097) 9.920 15.277 ( -4.134 10.179 2.852) 11.351 16.632 ( -2.815 8.466 2.256) 9.202 17.529 ( 3.360 -15.086 -0.999) 15.488 18.592 ( 13.488 -14.924 -2.940) 20.330 19.305 ( -8.226 6.945 -0.662) 10.785 20.784 ( 14.001 -8.053 -1.453) 16.218 21.469 ( -22.307 -0.982 1.204) 22.361 21.938 ( 5.153 21.832 -0.099) 22.432 22.593 ( -3.901 6.656 2.745) 8.189 26.867 ( -1.551 5.192 0.184) 5.422 27.411 ( -0.062 -4.235 -0.118) 4.237 27.460 ( 1.838 -0.393 -0.357) 1.913 27.903 ( -5.650 18.276 -0.456) 19.135 28.025 ( -2.997 3.286 -0.238) 4.453 28.521 ( 6.806 2.227 -4.124) 8.263 28.649 ( -8.484 -2.828 -0.817) 8.980 29.087 ( 10.053 -4.964 1.933) 11.377 29.414 ( -6.484 0.062 0.046) 6.484 29.714 ( 3.337 -2.080 -0.634) 3.983 29.841 ( 0.492 -5.079 -6.964) 8.633 30.259 ( -3.257 3.682 -1.902) 5.271 30.482 ( 1.947 1.533 3.799) 4.536 30.728 ( -2.849 7.474 -0.099) 8.000 30.847 ( -1.169 0.911 1.940) 2.441 31.925 ( 9.316 -24.838 6.109) 27.222 ======================= Grid point 262 (75/90) ======================= q-point: (-0.38 0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.402 ( 4.444 16.601 4.346) 17.727 1.561 ( -3.381 3.842 5.694) 7.656 1.944 ( -1.183 4.845 -0.807) 5.052 2.003 ( 0.615 -4.917 1.180) 5.094 2.257 ( 4.304 -3.719 -0.425) 5.705 2.455 ( -1.408 -4.452 4.072) 6.196 2.744 ( 1.037 -0.191 -4.138) 4.271 2.974 ( 3.955 2.417 7.387) 8.720 3.228 ( 0.070 1.331 2.110) 2.495 3.303 ( -2.785 1.941 2.273) 4.085 3.939 ( 0.325 10.176 3.083) 10.638 4.050 ( 6.130 0.728 -9.199) 11.078 4.225 ( 4.231 5.216 -5.336) 8.578 4.681 ( -14.746 -2.831 5.548) 16.007 4.962 ( -10.911 -3.738 2.019) 11.709 5.031 ( -9.738 -5.692 -0.696) 11.301 5.648 ( 10.395 11.296 -3.064) 15.654 5.725 ( -14.137 14.385 1.534) 20.227 6.252 ( 1.349 0.748 1.617) 2.235 6.325 ( 4.606 9.087 3.215) 10.683 6.653 ( -7.866 -1.994 -0.452) 8.128 6.976 ( -6.162 -4.235 -7.370) 10.499 7.128 ( 11.808 -9.233 2.335) 15.170 7.167 ( -4.054 -5.236 1.395) 6.768 7.572 ( 1.149 -4.423 -0.635) 4.613 7.976 ( 4.043 -4.839 -3.783) 7.353 8.138 ( 1.203 -13.270 -3.581) 13.797 8.247 ( 4.846 7.441 -7.327) 11.513 8.575 ( 16.050 -1.453 -1.299) 16.168 8.742 ( -0.596 0.288 -1.144) 1.322 9.065 ( 2.927 10.937 -2.461) 11.586 9.436 ( -4.692 -3.750 -1.352) 6.157 9.670 ( 4.242 -5.812 0.517) 7.214 10.643 ( 3.807 3.430 4.945) 7.122 10.981 ( 9.129 2.368 3.841) 10.183 11.244 ( 3.024 -0.138 -2.331) 3.821 11.770 ( -14.196 -35.087 0.968) 37.862 11.995 ( -7.291 -3.324 -1.954) 8.248 12.425 ( -6.787 -11.509 0.052) 13.362 13.425 ( 4.048 27.464 -0.411) 27.763 13.683 ( 12.201 14.118 -1.260) 18.702 14.254 ( -1.126 -4.419 -0.710) 4.615 15.124 ( -2.578 10.329 0.044) 10.646 15.256 ( -3.120 -1.311 -0.455) 3.414 15.333 ( -4.236 0.568 -1.381) 4.491 16.865 ( -11.776 10.904 0.680) 16.063 17.171 ( 15.114 -8.649 -0.930) 17.439 18.490 ( -4.862 -24.246 -2.468) 24.852 19.353 ( 4.367 20.616 -1.524) 21.129 20.643 ( -6.996 -21.286 -1.009) 22.428 21.478 ( 13.925 20.163 0.966) 24.523 22.235 ( -11.806 0.144 1.481) 11.899 22.695 ( -0.640 2.737 1.982) 3.439 26.942 ( -2.409 2.804 0.368) 3.715 27.336 ( 3.500 -1.159 -0.064) 3.687 27.468 ( -1.808 -5.535 -0.247) 5.827 28.054 ( 0.324 4.595 1.196) 4.759 28.231 ( 3.839 0.514 3.456) 5.191 28.328 ( -9.930 10.295 -1.726) 14.407 28.739 ( 4.228 -0.147 -1.257) 4.413 29.058 ( -6.376 -10.669 0.129) 12.430 29.444 ( 5.581 2.210 -6.308) 8.708 29.606 ( -0.459 4.790 -1.371) 5.004 29.777 ( 1.947 -3.047 -5.841) 6.870 30.332 ( 0.149 1.867 -0.638) 1.978 30.505 ( -2.830 -3.798 1.010) 4.843 30.756 ( 1.588 6.398 1.488) 6.758 31.038 ( -9.306 1.860 2.309) 9.767 31.476 ( 12.483 -12.493 6.608) 18.856 ======================= Grid point 263 (76/90) ======================= q-point: (-0.25 0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.475 ( -6.825 9.941 -0.436) 12.067 1.664 ( 0.257 6.418 1.790) 6.668 1.963 ( -2.121 2.762 2.942) 4.559 2.033 ( 4.407 0.239 5.442) 7.007 2.250 ( -1.879 -3.751 -0.519) 4.227 2.472 ( 11.350 -3.297 2.223) 12.026 2.632 ( -0.425 -13.793 3.383) 14.208 3.147 ( -10.671 4.792 -4.803) 12.646 3.182 ( 3.444 7.088 4.024) 8.848 3.313 ( -0.453 4.475 2.319) 5.061 3.855 ( -11.881 8.981 -0.657) 14.908 4.129 ( 1.747 1.782 -11.608) 11.873 4.244 ( -11.379 0.678 4.762) 12.354 4.666 ( 9.365 4.664 5.565) 11.850 4.802 ( 6.336 -0.816 2.512) 6.865 4.909 ( -2.715 -1.913 -2.068) 3.913 5.660 ( -13.644 14.104 1.396) 19.673 5.876 ( -2.313 16.234 -9.597) 19.000 6.244 ( -0.927 2.755 -0.792) 3.013 6.408 ( -12.833 -2.228 5.268) 14.050 6.549 ( 6.218 10.233 3.326) 12.428 6.855 ( -6.539 2.525 -4.219) 8.181 7.065 ( 4.240 -9.281 0.225) 10.206 7.280 ( 14.367 -10.792 3.848) 18.376 7.486 ( -4.594 -6.474 -0.872) 7.986 7.972 ( 5.224 -10.253 2.930) 11.874 8.106 ( 6.060 -7.189 -11.462) 14.826 8.251 ( -4.474 1.860 -2.453) 5.431 8.613 ( -7.093 -3.601 -1.477) 8.091 8.992 ( 4.256 3.012 -4.614) 6.963 9.258 ( 21.981 2.431 -3.294) 22.359 9.366 ( 2.352 -3.809 -0.859) 4.559 9.580 ( -2.981 -15.214 -1.168) 15.547 10.745 ( 3.401 5.405 4.552) 7.842 11.050 ( -16.783 -9.938 -0.364) 19.508 11.163 ( 9.533 -3.144 4.110) 10.847 11.573 ( 8.355 -7.863 0.235) 11.475 11.847 ( 12.465 -15.142 -0.887) 19.633 12.295 ( -5.515 4.668 -1.403) 7.361 13.600 ( -6.163 13.348 0.010) 14.702 13.979 ( 12.057 4.884 -1.566) 13.103 14.136 ( -16.790 1.080 -1.373) 16.881 15.060 ( -7.826 7.996 -2.652) 11.498 15.224 ( -3.886 4.747 0.783) 6.185 15.362 ( 2.045 3.917 0.285) 4.428 16.821 ( -7.293 12.455 1.777) 14.542 17.303 ( 8.385 -10.183 -0.113) 13.191 18.258 ( 6.425 -18.529 -4.154) 20.046 19.545 ( -6.688 16.429 -0.382) 17.742 20.454 ( 9.671 -17.311 -1.445) 19.882 21.771 ( -6.795 7.890 1.579) 10.531 22.053 ( -2.935 8.195 0.638) 8.728 22.702 ( -2.407 3.656 2.154) 4.878 26.942 ( -1.668 4.260 0.415) 4.594 27.379 ( -1.029 -4.084 -0.303) 4.222 27.389 ( 3.656 -2.950 0.037) 4.698 28.076 ( -1.728 3.219 1.830) 4.086 28.197 ( -9.657 8.550 0.717) 12.918 28.430 ( 7.168 7.900 0.297) 10.672 28.799 ( -10.410 -4.305 -3.889) 11.917 28.868 ( 9.790 -5.833 2.299) 11.626 29.499 ( -2.824 1.642 -5.586) 6.471 29.656 ( 2.822 1.927 -0.163) 3.421 29.770 ( 1.845 -5.049 -7.508) 9.234 30.338 ( -2.380 2.344 -2.025) 3.906 30.456 ( 1.025 -1.576 2.248) 2.930 30.853 ( 0.650 9.740 3.802) 10.476 30.902 ( -7.250 0.300 0.888) 7.310 31.534 ( 11.405 -18.119 5.973) 22.227 ======================= Grid point 264 (77/90) ======================= q-point: (-0.12 0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.404 ( -10.495 4.137 -1.017) 11.326 1.661 ( 0.260 -3.751 1.614) 4.092 1.935 ( 0.047 -2.312 -4.331) 4.909 2.076 ( 0.575 -1.159 6.460) 6.588 2.164 ( -2.244 0.600 0.131) 2.327 2.541 ( 3.091 -9.103 5.977) 11.321 2.706 ( 7.635 2.370 -1.794) 8.193 2.928 ( -9.944 2.499 1.621) 10.380 3.227 ( -1.772 0.830 6.220) 6.521 3.324 ( -1.898 1.578 4.415) 5.058 3.877 ( -4.223 12.375 -2.064) 13.237 3.984 ( -13.385 -1.663 2.109) 13.651 4.195 ( 0.129 3.091 -9.909) 10.381 4.801 ( 10.067 -0.995 -3.638) 10.750 4.933 ( 3.005 5.363 0.372) 6.159 5.127 ( 17.613 3.789 9.578) 20.403 5.500 ( -16.136 9.153 0.035) 18.551 5.887 ( -9.425 11.418 -1.884) 14.924 6.202 ( -4.425 0.267 0.397) 4.451 6.318 ( 2.999 -3.241 -2.193) 4.930 6.656 ( -1.378 1.181 -0.605) 1.913 6.871 ( -2.565 14.596 4.172) 15.396 7.102 ( 8.925 -7.613 -4.340) 12.508 7.301 ( 0.973 -10.991 -1.405) 11.123 7.469 ( 7.167 2.069 3.949) 8.440 7.947 ( -1.594 -3.691 -3.341) 5.228 8.143 ( 5.220 -4.185 0.794) 6.738 8.198 ( -2.241 -0.028 -12.950) 13.143 8.515 ( 4.055 -6.423 -0.887) 7.647 8.859 ( -8.756 -8.843 0.684) 12.464 9.232 ( -12.950 -12.954 -3.157) 18.587 9.435 ( 0.330 3.469 1.450) 3.774 9.638 ( 13.565 -4.883 -5.900) 15.578 10.702 ( -6.823 -9.049 2.274) 11.559 10.861 ( -0.679 4.815 4.138) 6.385 11.238 ( -1.296 -1.445 0.255) 1.957 11.762 ( 31.415 -3.691 1.788) 31.682 12.041 ( 4.910 0.870 -2.466) 5.563 12.395 ( 16.011 1.907 -0.138) 16.125 13.538 ( -10.204 2.212 0.706) 10.465 13.633 ( -36.590 -0.762 -2.053) 36.655 14.205 ( 7.878 3.180 -1.438) 8.616 15.089 ( -2.540 8.364 -0.566) 8.759 15.221 ( 0.380 4.681 -0.643) 4.740 15.394 ( -1.541 0.704 0.337) 1.728 16.861 ( -3.137 14.627 0.703) 14.976 17.200 ( -1.503 -18.352 -0.463) 18.420 18.425 ( 22.237 -2.124 -2.942) 22.531 19.404 ( -18.109 1.917 -1.366) 18.261 20.644 ( 22.632 -4.806 -1.154) 23.165 21.457 ( -24.893 0.107 1.346) 24.929 22.249 ( 6.185 8.857 0.868) 10.837 22.686 ( -2.721 2.651 2.510) 4.554 26.954 ( -1.294 2.711 0.346) 3.024 27.322 ( -0.503 -2.910 0.201) 2.960 27.458 ( 5.065 -0.013 -0.208) 5.069 28.064 ( -3.308 1.081 0.534) 3.521 28.139 ( -4.568 6.674 3.511) 8.817 28.552 ( -6.887 -8.102 -0.683) 10.655 28.626 ( 4.986 6.923 -3.599) 9.260 29.046 ( 11.376 0.712 0.046) 11.398 29.406 ( -7.533 0.021 -2.185) 7.844 29.685 ( -1.377 -3.024 -3.995) 5.196 29.750 ( 1.480 -2.052 -6.339) 6.825 30.314 ( -2.199 2.154 -0.602) 3.137 30.506 ( 4.689 0.624 2.018) 5.143 30.784 ( -6.096 -0.892 -0.756) 6.207 30.986 ( 1.826 11.887 5.403) 13.184 31.502 ( 5.612 -17.437 5.219) 19.047 ======================= Grid point 270 (78/90) ======================= q-point: (-0.38 0.62 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.618 ( 1.786 4.700 -4.373) 6.663 1.723 ( 5.978 8.217 4.429) 11.085 1.877 ( -2.056 -3.458 -0.506) 4.055 2.139 ( 3.074 10.336 6.997) 12.855 2.230 ( 3.526 2.437 0.678) 4.340 2.370 ( -7.675 -3.346 6.323) 10.492 2.503 ( -4.694 -17.356 2.578) 18.163 3.179 ( 5.700 8.254 -0.540) 10.045 3.243 ( -0.620 0.002 2.038) 2.131 3.390 ( 3.251 8.020 -4.216) 9.626 4.036 ( 7.288 -1.109 -8.401) 11.177 4.102 ( -4.654 4.574 -9.462) 11.494 4.288 ( 6.227 -0.242 7.552) 9.791 4.645 ( -5.473 1.621 4.034) 6.989 4.758 ( -8.106 -11.560 6.765) 15.656 4.908 ( -2.034 -6.040 0.718) 6.414 5.854 ( 11.652 8.906 -2.943) 14.958 5.989 ( -5.931 7.207 -3.322) 9.907 6.313 ( 1.765 7.742 4.002) 8.892 6.393 ( 12.144 -1.053 2.424) 12.428 6.571 ( -8.748 -6.562 2.775) 11.283 6.953 ( -2.716 0.872 -3.008) 4.145 7.020 ( 7.871 -3.753 -0.175) 8.722 7.081 ( -11.162 -2.248 -3.725) 11.980 7.522 ( 6.085 1.254 0.623) 6.244 7.770 ( -8.275 -11.735 1.215) 14.410 8.023 ( -1.791 -1.174 -10.443) 10.660 8.256 ( -0.133 -1.169 0.729) 1.384 8.752 ( 24.451 11.575 -5.733) 27.653 8.925 ( -9.060 16.769 -0.925) 19.082 9.211 ( -10.408 -4.298 -1.646) 11.380 9.331 ( -3.978 -1.935 -4.461) 6.282 9.436 ( 1.212 -14.966 -0.675) 15.030 10.788 ( 1.472 10.030 4.560) 11.116 10.968 ( 6.015 -4.940 3.299) 8.454 11.277 ( 1.145 -12.011 3.480) 12.557 11.332 ( -6.014 10.295 -1.272) 11.990 11.703 ( -12.969 -22.148 -1.470) 25.708 12.375 ( 2.140 2.497 -1.799) 3.748 13.739 ( 6.113 7.975 0.951) 10.093 13.899 ( -4.198 1.236 -0.183) 4.380 14.247 ( 6.497 5.665 -3.141) 9.175 15.199 ( 4.227 -1.137 -1.244) 4.550 15.247 ( -1.455 2.253 -0.637) 2.756 15.374 ( -1.432 0.999 -0.147) 1.752 17.046 ( 4.140 1.319 1.456) 4.582 17.103 ( -1.580 4.899 0.639) 5.187 18.081 ( -6.628 -14.096 -4.930) 16.338 19.747 ( 9.805 18.868 -0.730) 21.276 20.231 ( -11.087 -19.928 -1.014) 22.828 21.845 ( 10.197 16.645 1.448) 19.574 22.144 ( -5.625 -8.965 1.241) 10.656 22.737 ( 0.838 1.332 1.935) 2.495 26.987 ( 0.403 1.327 0.608) 1.514 27.324 ( 1.144 0.376 -0.117) 1.210 27.371 ( -2.475 -3.623 -0.215) 4.393 28.101 ( 0.377 0.633 1.136) 1.354 28.299 ( 5.158 4.783 1.698) 7.236 28.534 ( -5.693 8.803 3.349) 11.005 28.659 ( 5.663 -5.635 0.995) 8.051 28.870 ( -4.978 -7.496 -3.115) 9.522 29.534 ( 4.146 5.992 -7.914) 10.758 29.671 ( -4.266 -0.867 -6.365) 7.711 29.702 ( 1.356 -2.318 -2.151) 3.441 30.368 ( 1.703 2.131 -0.709) 2.819 30.435 ( -1.986 -3.105 0.543) 3.725 30.894 ( 3.034 7.548 2.702) 8.572 31.016 ( -0.401 -4.387 4.282) 6.144 31.299 ( -3.721 -4.968 4.554) 7.698 ======================= Grid point 292 (79/90) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 46 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.572 ( 0.000 -0.000 0.000) 0.000 1.615 ( 0.000 0.000 0.000) 0.000 1.615 ( 0.000 0.000 0.000) 0.000 2.405 ( 0.000 0.000 0.000) 0.000 2.405 ( -0.000 0.000 0.000) 0.000 2.633 ( 0.000 0.000 0.000) 0.000 2.633 ( 0.000 -0.000 0.000) 0.000 2.854 ( 0.000 0.000 0.000) 0.000 2.854 ( 0.000 0.000 0.000) 0.000 2.917 ( 0.000 0.000 0.000) 0.000 3.693 ( 0.000 0.000 -0.000) 0.000 3.974 ( -0.000 0.000 0.000) 0.000 4.066 ( 0.000 0.000 0.000) 0.000 4.066 ( 0.000 0.000 0.000) 0.000 4.586 ( -0.000 -0.000 0.000) 0.000 4.867 ( 0.000 0.000 0.000) 0.000 5.126 ( 0.000 0.000 0.000) 0.000 5.126 ( 0.000 0.000 0.000) 0.000 5.887 ( 0.000 0.000 0.000) 0.000 5.932 ( 0.000 0.000 0.000) 0.000 5.932 ( 0.000 0.000 0.000) 0.000 6.138 ( 0.000 0.000 0.000) 0.000 7.509 ( 0.000 0.000 0.000) 0.000 7.509 ( 0.000 -0.000 0.000) 0.000 8.011 ( 0.000 -0.000 0.000) 0.000 8.400 ( -0.000 0.000 0.000) 0.000 8.400 ( 0.000 -0.000 0.000) 0.000 9.195 ( 0.000 0.000 0.000) 0.000 9.275 ( 0.000 0.000 0.000) 0.000 9.275 ( 0.000 0.000 0.000) 0.000 9.371 ( 0.000 0.000 0.000) 0.000 10.233 ( -0.000 0.000 0.000) 0.000 10.233 ( 0.000 0.000 0.000) 0.000 10.995 ( 0.000 -0.000 0.000) 0.000 10.995 ( -0.000 0.000 0.000) 0.000 11.443 ( -0.000 -0.000 0.000) 0.000 12.216 ( 0.000 0.000 0.000) 0.000 12.216 ( 0.000 0.000 0.000) 0.000 12.491 ( 0.000 0.000 0.000) 0.000 13.453 ( 0.000 -0.000 0.000) 0.000 13.453 ( 0.000 -0.000 0.000) 0.000 13.769 ( 0.000 0.000 0.000) 0.000 13.769 ( 0.000 0.000 0.000) 0.000 14.565 ( -0.000 0.000 0.000) 0.000 15.015 ( 0.000 0.000 0.000) 0.000 16.590 ( 0.000 0.000 0.000) 0.000 17.884 ( 0.000 0.000 0.000) 0.000 19.329 ( 0.000 0.000 0.000) 0.000 19.329 ( 0.000 0.000 0.000) 0.000 20.848 ( 0.000 0.000 0.000) 0.000 20.848 ( -0.000 0.000 0.000) 0.000 21.508 ( 0.000 0.000 0.000) 0.000 22.342 ( 0.000 0.000 0.000) 0.000 26.710 ( 0.000 0.000 0.000) 0.000 26.710 ( 0.000 -0.000 0.000) 0.000 27.491 ( 0.000 0.000 0.000) 0.000 27.491 ( 0.000 0.000 0.000) 0.000 27.918 ( 0.000 0.000 0.000) 0.000 28.756 ( 0.000 0.000 0.000) 0.000 28.756 ( 0.000 0.000 0.000) 0.000 29.290 ( 0.000 0.000 0.000) 0.000 29.290 ( 0.000 0.000 0.000) 0.000 29.963 ( -0.000 0.000 0.000) 0.000 29.963 ( -0.000 0.000 0.000) 0.000 30.056 ( -0.000 -0.000 0.000) 0.000 30.443 ( 0.000 -0.000 0.000) 0.000 30.443 ( 0.000 0.000 0.000) 0.000 30.864 ( 0.000 0.000 0.000) 0.000 32.940 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 294 (80/90) ======================= q-point: ( 0.12 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.489 ( -6.550 -3.088 -5.677) 9.202 1.596 ( 2.029 -4.206 9.511) 10.596 1.637 ( 0.806 5.243 -0.402) 5.319 2.405 ( -0.241 -1.506 -2.493) 2.923 2.474 ( -3.668 -1.583 0.902) 4.096 2.585 ( -1.472 -0.872 0.469) 1.774 2.713 ( 6.909 5.847 -2.171) 9.308 2.856 ( 4.268 -0.998 0.810) 4.457 2.938 ( 5.040 7.210 -2.235) 9.076 3.021 ( 10.326 4.041 1.425) 11.179 3.644 ( -4.206 -2.440 1.085) 4.982 3.916 ( -3.800 -2.161 -1.580) 4.648 4.068 ( 0.182 -0.552 -0.380) 0.695 4.213 ( 12.628 7.913 1.473) 14.975 4.645 ( 4.933 2.838 -0.063) 5.692 4.855 ( -1.846 -1.365 1.726) 2.873 5.112 ( -0.870 2.221 -0.826) 2.525 5.160 ( 4.286 -0.035 -1.389) 4.505 5.891 ( 4.220 2.876 1.202) 5.247 6.018 ( 7.856 3.201 -0.594) 8.504 6.072 ( 7.940 5.474 0.521) 9.658 6.200 ( 5.695 3.325 -0.360) 6.604 7.498 ( -0.896 -0.469 -1.744) 2.016 7.621 ( 8.851 5.123 1.038) 10.279 7.902 ( -8.856 -5.175 -0.207) 10.259 8.313 ( -7.323 -4.023 -1.512) 8.491 8.378 ( -2.204 -1.525 1.706) 3.177 8.920 ( -16.070 -9.431 0.329) 18.636 9.218 ( -6.814 -4.027 -1.523) 8.061 9.359 ( -1.907 -0.104 5.832) 6.136 9.375 ( 1.000 -0.169 -5.317) 5.412 10.005 ( -19.105 -10.573 1.154) 21.865 10.116 ( -8.758 -5.284 0.632) 10.248 10.973 ( -3.051 -0.824 0.174) 3.165 11.025 ( 2.577 0.234 0.418) 2.621 11.465 ( 0.435 0.262 -0.389) 0.640 11.925 ( -13.144 -6.315 -0.573) 14.594 12.314 ( 6.570 1.065 -0.479) 6.673 12.595 ( 0.140 -0.208 0.391) 0.464 13.148 ( -19.923 -1.495 0.648) 19.989 13.339 ( 3.785 -6.564 -0.508) 7.594 14.048 ( 14.623 6.955 -0.048) 16.193 14.131 ( 19.953 13.720 -0.001) 24.215 14.666 ( 9.847 5.497 0.021) 11.278 15.056 ( 3.801 2.284 -0.289) 4.444 16.577 ( -0.818 -0.470 0.012) 0.943 17.850 ( -3.832 -2.122 -0.096) 4.382 19.182 ( -8.929 -9.737 0.079) 13.211 19.225 ( -9.360 -0.866 0.080) 9.400 20.906 ( 3.723 2.485 -0.235) 4.482 21.071 ( 16.100 8.760 0.062) 18.329 21.509 ( 1.493 1.004 0.191) 1.809 22.388 ( 4.194 2.424 -0.137) 4.846 26.734 ( 2.128 1.286 0.009) 2.486 26.950 ( 19.784 11.368 0.016) 22.817 27.486 ( -0.433 -0.657 0.009) 0.787 27.512 ( 1.854 1.479 -0.023) 2.372 27.933 ( 1.289 0.735 0.033) 1.484 28.662 ( -7.587 -3.989 -0.297) 8.577 28.730 ( -1.927 -1.541 0.591) 2.537 29.285 ( -0.590 -0.162 -0.207) 0.646 29.321 ( 2.061 1.043 -0.123) 2.313 29.908 ( -4.442 -3.126 2.209) 5.864 29.919 ( -3.955 -1.625 -2.063) 4.748 30.085 ( 2.888 1.577 0.076) 3.291 30.480 ( 3.015 1.702 -2.064) 4.031 30.490 ( 3.795 2.231 1.921) 4.803 30.857 ( -0.563 -0.321 -0.052) 0.650 32.757 ( -15.598 -9.006 0.043) 18.012 ======================= Grid point 296 (81/90) ======================= q-point: ( 0.25 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.366 ( -2.858 -4.994 0.233) 5.759 1.653 ( 6.758 0.732 7.177) 9.885 1.700 ( -0.257 5.546 2.510) 6.093 2.302 ( -9.619 -3.222 -0.412) 10.153 2.359 ( -1.751 -6.562 -2.629) 7.283 2.578 ( 0.097 0.125 0.756) 0.772 2.709 ( -5.460 2.050 2.648) 6.405 2.968 ( 7.824 -5.207 -2.849) 9.821 3.142 ( 3.452 14.314 -4.957) 15.537 3.359 ( 12.899 5.327 -3.401) 14.364 3.566 ( 4.684 0.888 5.313) 7.138 3.856 ( -1.304 -0.360 -6.074) 6.223 4.056 ( 0.532 -2.779 0.460) 2.866 4.591 ( 18.067 11.822 4.033) 21.965 4.730 ( 0.476 -0.761 6.129) 6.195 4.839 ( 3.797 4.857 -2.134) 6.524 5.194 ( 4.440 9.835 0.581) 10.807 5.279 ( 11.242 -1.379 -4.970) 12.368 6.075 ( 9.795 7.053 2.803) 12.391 6.182 ( 8.651 -1.355 3.021) 9.263 6.323 ( 13.515 12.157 -3.470) 18.507 6.376 ( 9.447 5.534 -0.822) 10.979 7.485 ( 0.349 0.399 -3.774) 3.811 7.649 ( -13.318 -6.628 -0.946) 14.906 7.805 ( 3.673 0.610 -0.698) 3.788 8.116 ( -10.567 -4.496 -2.456) 11.743 8.277 ( -6.500 -5.505 6.655) 10.810 8.551 ( -15.299 -10.336 -2.108) 18.583 8.909 ( -15.872 -13.181 -1.960) 20.724 9.239 ( -11.298 -2.722 2.829) 11.961 9.368 ( 0.002 0.181 -2.971) 2.976 9.495 ( -28.721 -8.559 3.233) 30.143 9.927 ( -5.455 -7.920 3.494) 10.232 10.876 ( -7.079 0.091 0.500) 7.097 11.031 ( 1.124 -7.573 2.039) 7.923 11.383 ( -8.005 -1.510 -2.742) 8.595 11.854 ( 2.583 3.895 -0.216) 4.679 12.286 ( 1.063 -13.310 -1.660) 13.455 12.629 ( 0.745 3.455 0.513) 3.572 12.936 ( -9.762 13.689 1.163) 16.853 13.413 ( 8.363 -6.068 -0.140) 10.333 14.241 ( 5.972 -0.689 -1.149) 6.121 14.583 ( 17.541 13.594 1.483) 22.241 14.952 ( 14.120 6.400 -0.020) 15.502 15.186 ( 6.543 5.942 -1.803) 9.020 16.586 ( 2.572 1.570 0.043) 3.014 17.680 ( -12.437 -5.790 -0.475) 13.727 18.939 ( -2.872 -17.628 0.123) 17.861 19.098 ( -9.243 9.567 0.511) 13.312 20.963 ( 0.055 1.879 -0.216) 1.892 21.253 ( 0.380 -3.117 -0.575) 3.192 21.749 ( 19.252 12.075 1.013) 22.748 22.517 ( 6.842 4.026 -0.627) 7.963 26.803 ( 3.775 2.557 0.028) 4.560 27.393 ( 8.551 7.444 -0.470) 11.346 27.466 ( 3.054 -3.520 0.247) 4.667 27.638 ( 13.665 10.315 -0.172) 17.122 27.971 ( 2.067 1.028 0.243) 2.321 28.483 ( -8.706 -2.593 0.923) 9.131 28.682 ( -0.433 -3.049 0.540) 3.127 29.263 ( -1.898 -0.409 -0.079) 1.943 29.349 ( 0.370 -0.131 -1.661) 1.707 29.776 ( -6.821 -3.900 4.190) 8.905 29.823 ( -4.573 -2.171 -2.882) 5.825 30.172 ( 4.722 2.371 -0.359) 5.296 30.552 ( 3.094 1.841 -0.953) 3.724 30.594 ( 5.048 2.757 1.147) 5.865 30.853 ( 0.919 0.682 -0.752) 1.369 32.312 ( -22.936 -13.256 0.311) 26.493 ======================= Grid point 298 (82/90) ======================= q-point: ( 0.38 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.314 ( 2.208 -4.818 3.778) 6.509 1.723 ( -3.005 6.043 4.272) 7.987 1.788 ( 7.154 -1.797 1.809) 7.595 2.127 ( -7.536 0.363 -0.183) 7.547 2.261 ( -2.385 -6.167 -3.218) 7.354 2.564 ( -1.772 -0.061 1.546) 2.352 2.665 ( -2.061 2.373 2.639) 4.104 3.039 ( 6.971 -4.373 -3.465) 8.929 3.280 ( -5.273 6.493 -3.263) 8.979 3.319 ( -0.567 -0.303 2.597) 2.675 3.828 ( 4.359 2.700 -9.394) 10.703 3.873 ( 4.055 2.943 -0.049) 5.011 4.049 ( 2.939 -4.953 2.621) 6.328 4.814 ( 6.974 7.199 5.719) 11.540 4.874 ( 9.245 -2.871 1.241) 9.760 5.053 ( 9.026 18.505 -1.050) 20.616 5.417 ( 9.952 2.760 -3.348) 10.856 5.548 ( 17.125 11.242 2.693) 20.662 6.241 ( 1.062 -3.104 -0.867) 3.394 6.267 ( 7.066 -1.129 6.784) 9.861 6.567 ( 6.501 5.518 -3.618) 9.263 6.741 ( 17.622 15.120 -4.983) 23.748 7.345 ( -11.074 -9.359 -2.702) 14.749 7.496 ( -23.877 -17.134 -0.400) 29.391 7.559 ( 1.395 5.490 -0.635) 5.700 7.918 ( -8.176 -2.770 -2.832) 9.085 8.121 ( -5.144 -8.882 7.838) 12.915 8.295 ( -5.547 -4.903 -3.298) 8.104 8.693 ( 3.101 -7.325 -1.735) 8.141 8.932 ( -24.317 -7.508 0.913) 25.466 8.990 ( -18.307 3.983 4.930) 19.373 9.408 ( 2.532 3.826 -3.183) 5.584 9.769 ( -4.648 -9.156 4.174) 11.084 10.734 ( -8.416 -3.688 2.182) 9.445 10.952 ( 0.605 -6.988 -0.478) 7.031 11.255 ( -5.059 -0.292 -1.430) 5.266 11.942 ( 1.497 3.723 -0.862) 4.105 12.250 ( 4.983 -4.426 -0.764) 6.708 12.621 ( -1.295 -0.827 0.640) 1.665 13.023 ( -0.904 14.351 0.734) 14.398 13.460 ( 4.290 -5.584 0.136) 7.043 14.280 ( 0.948 -1.217 -1.369) 2.062 14.943 ( 13.870 5.026 2.817) 15.019 15.180 ( 8.372 1.681 0.225) 8.542 15.335 ( 1.506 7.704 -3.305) 8.517 16.721 ( 9.560 5.725 0.013) 11.143 17.355 ( -17.310 -7.691 -0.545) 18.949 18.772 ( 0.766 -13.091 0.067) 13.114 19.095 ( -3.602 9.661 0.574) 10.326 20.954 ( -2.170 1.346 -0.103) 2.556 21.176 ( -2.372 -5.010 -0.378) 5.556 22.168 ( 15.338 8.970 0.895) 17.791 22.654 ( 4.454 2.836 -0.800) 5.341 26.899 ( 3.949 3.035 0.038) 4.981 27.364 ( -3.845 -2.272 -0.268) 4.475 27.511 ( 1.258 -0.903 -0.102) 1.552 28.009 ( 1.448 0.759 0.633) 1.753 28.070 ( 16.625 9.263 -2.816) 19.238 28.360 ( -5.165 2.690 4.035) 7.084 28.675 ( 3.377 -3.492 0.318) 4.868 29.217 ( -2.105 -1.767 -0.058) 2.750 29.332 ( -2.187 0.389 -3.448) 4.102 29.627 ( -6.086 -3.227 4.764) 8.375 29.744 ( -2.616 -1.450 -2.113) 3.662 30.268 ( 3.766 1.850 -0.880) 4.287 30.608 ( 1.569 1.380 -0.104) 2.091 30.659 ( 0.782 -0.400 1.607) 1.831 30.960 ( 9.013 5.699 -2.161) 10.880 31.806 ( -21.390 -12.434 0.853) 24.756 ======================= Grid point 300 (83/90) ======================= q-point: (-0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 132 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.319 ( 0.000 0.000 0.000) 0.000 1.726 ( 0.000 0.000 0.000) 0.000 1.820 ( 0.000 -0.000 0.000) 0.000 2.093 ( 0.000 -0.000 0.000) 0.000 2.193 ( 0.000 0.000 0.000) 0.000 2.545 ( 0.000 0.000 0.000) 0.000 2.664 ( 0.000 0.000 0.000) 0.000 3.106 ( 0.000 -0.000 0.000) 0.000 3.185 ( -0.000 0.000 0.000) 0.000 3.362 ( 0.000 0.000 0.000) 0.000 3.845 ( 0.000 0.000 0.000) 0.000 3.935 ( 0.000 0.000 0.000) 0.000 4.040 ( 0.000 0.000 0.000) 0.000 4.922 ( -0.000 0.000 0.000) 0.000 4.927 ( 0.000 -0.000 0.000) 0.000 5.361 ( 0.000 0.000 0.000) 0.000 5.476 ( 0.000 0.000 0.000) 0.000 5.864 ( 0.000 0.000 0.000) 0.000 6.156 ( -0.000 -0.000 0.000) 0.000 6.323 ( 0.000 0.000 0.000) 0.000 6.636 ( 0.000 -0.000 0.000) 0.000 7.034 ( 0.000 0.000 -0.000) 0.000 7.041 ( -0.000 -0.000 0.000) 0.000 7.259 ( 0.000 0.000 0.000) 0.000 7.623 ( 0.000 0.000 0.000) 0.000 7.869 ( 0.000 0.000 -0.000) 0.000 7.923 ( -0.000 -0.000 0.000) 0.000 8.233 ( 0.000 0.000 0.000) 0.000 8.660 ( -0.000 0.000 0.000) 0.000 8.743 ( 0.000 -0.000 0.000) 0.000 8.827 ( -0.000 0.000 0.000) 0.000 9.499 ( -0.000 -0.000 0.000) 0.000 9.628 ( 0.000 0.000 0.000) 0.000 10.621 ( 0.000 0.000 0.000) 0.000 10.931 ( 0.000 0.000 0.000) 0.000 11.214 ( 0.000 0.000 0.000) 0.000 11.968 ( 0.000 -0.000 0.000) 0.000 12.291 ( 0.000 -0.000 0.000) 0.000 12.602 ( 0.000 0.000 0.000) 0.000 13.093 ( 0.000 0.000 0.000) 0.000 13.465 ( 0.000 -0.000 0.000) 0.000 14.278 ( 0.000 0.000 0.000) 0.000 15.089 ( 0.000 0.000 0.000) 0.000 15.275 ( 0.000 0.000 0.000) 0.000 15.366 ( 0.000 0.000 0.000) 0.000 16.970 ( -0.000 -0.000 0.000) 0.000 17.030 ( 0.000 0.000 0.000) 0.000 18.716 ( 0.000 0.000 0.000) 0.000 19.119 ( 0.000 0.000 0.000) 0.000 20.940 ( 0.000 -0.000 0.000) 0.000 21.126 ( 0.000 0.000 0.000) 0.000 22.352 ( 0.000 0.000 0.000) 0.000 22.703 ( 0.000 0.000 0.000) 0.000 26.957 ( 0.000 -0.000 0.000) 0.000 27.308 ( 0.000 0.000 0.000) 0.000 27.513 ( 0.000 0.000 0.000) 0.000 28.024 ( 0.000 0.000 0.000) 0.000 28.233 ( -0.000 0.000 0.000) 0.000 28.367 ( 0.000 0.000 0.000) 0.000 28.699 ( 0.000 0.000 0.000) 0.000 29.182 ( 0.000 -0.000 0.000) 0.000 29.308 ( 0.000 0.000 0.000) 0.000 29.553 ( 0.000 0.000 0.000) 0.000 29.714 ( 0.000 0.000 0.000) 0.000 30.312 ( 0.000 0.000 0.000) 0.000 30.628 ( 0.000 -0.000 -0.000) 0.000 30.654 ( -0.000 0.000 0.000) 0.000 31.152 ( -0.000 -0.000 0.000) 0.000 31.481 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 312 (84/90) ======================= q-point: ( 0.12 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( -4.283 -1.468 -7.468) 8.733 1.518 ( 0.529 -0.853 7.009) 7.080 1.764 ( 6.066 6.697 -3.926) 9.852 2.348 ( -4.460 -9.017 0.382) 10.067 2.399 ( -4.256 -0.566 0.062) 4.294 2.590 ( 0.739 2.019 3.960) 4.507 2.762 ( 7.261 -6.870 -2.744) 10.366 2.858 ( -8.176 7.576 3.434) 11.663 3.090 ( 11.073 2.671 0.861) 11.423 3.262 ( 7.003 18.924 -2.901) 20.386 3.576 ( -1.813 -2.217 1.598) 3.280 3.868 ( -0.923 -2.056 -2.030) 3.033 4.097 ( -0.447 3.922 -0.308) 3.959 4.433 ( 9.846 13.474 1.749) 16.780 4.730 ( 2.088 4.534 1.801) 5.307 4.828 ( 0.056 -0.753 -0.905) 1.179 5.119 ( 5.459 2.528 -2.654) 6.575 5.268 ( 1.709 9.712 4.028) 10.652 6.039 ( 8.199 9.411 -3.851) 13.062 6.121 ( 0.099 11.701 4.393) 12.499 6.236 ( 8.759 9.007 -2.225) 12.759 6.326 ( 5.623 9.465 0.965) 11.052 7.479 ( -0.689 -1.564 -4.223) 4.556 7.716 ( -3.964 -9.718 0.427) 10.505 7.783 ( 1.372 5.675 4.327) 7.268 8.189 ( -3.528 -8.100 2.713) 9.243 8.312 ( -4.487 -5.209 -2.654) 7.370 8.627 ( -12.098 -19.594 -5.261) 23.621 8.993 ( -11.939 -17.499 -2.993) 21.394 9.322 ( 0.355 -4.916 0.744) 4.985 9.358 ( -2.420 -1.894 3.366) 4.558 9.736 ( -3.884 -22.803 3.777) 23.437 9.910 ( -11.927 -8.228 0.850) 14.515 10.900 ( -1.081 -7.347 -0.890) 7.479 11.047 ( -3.831 3.240 -0.360) 5.030 11.551 ( 6.546 4.214 0.234) 7.789 11.636 ( -8.995 -13.303 -1.248) 16.107 12.371 ( -13.155 -0.976 -1.189) 13.244 12.565 ( -2.255 -12.484 -0.017) 12.686 12.910 ( 13.571 1.136 0.631) 13.633 13.568 ( 2.277 15.388 0.446) 15.562 14.103 ( -0.552 4.546 0.024) 4.579 14.500 ( 13.127 16.638 1.590) 21.253 14.863 ( 6.700 13.904 -0.105) 15.434 15.147 ( 5.126 6.889 -1.302) 8.685 16.577 ( 0.831 1.363 -0.238) 1.614 17.750 ( -4.365 -9.142 -0.201) 10.132 18.926 ( -14.681 -14.014 -0.453) 20.301 19.189 ( 4.920 -1.738 -0.120) 5.219 20.884 ( -2.064 -4.826 0.693) 5.294 21.414 ( 8.674 23.058 0.474) 24.640 21.540 ( 5.021 2.551 -0.404) 5.646 22.480 ( 3.980 6.824 0.111) 7.901 26.781 ( 2.251 3.442 -0.035) 4.113 27.295 ( 10.558 17.902 -0.276) 20.785 27.502 ( -3.325 3.910 -0.304) 5.142 27.544 ( 7.291 3.754 -0.414) 8.212 27.964 ( 1.385 2.564 0.058) 2.915 28.526 ( -3.610 -8.980 2.282) 9.944 28.706 ( -2.003 -0.255 -0.981) 2.245 29.225 ( -2.486 -5.006 -1.110) 5.698 29.385 ( 1.970 3.690 -0.196) 4.187 29.820 ( -3.706 -5.685 -0.532) 6.807 29.845 ( -2.350 -5.487 1.128) 6.074 30.144 ( 2.218 4.363 1.159) 5.030 30.527 ( 1.454 2.535 -3.594) 4.633 30.571 ( 3.474 6.070 2.231) 7.341 30.848 ( -0.116 -0.329 0.443) 0.564 32.446 ( -12.671 -21.934 -0.047) 25.331 ======================= Grid point 314 (85/90) ======================= q-point: ( 0.25 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.344 ( -4.831 3.963 -1.488) 6.423 1.631 ( 7.980 1.195 1.267) 8.168 1.883 ( -2.174 8.583 1.500) 8.980 2.210 ( -2.206 -5.703 -1.516) 6.300 2.283 ( -7.127 -1.078 -3.804) 8.150 2.599 ( -1.233 0.217 2.975) 3.228 2.774 ( -7.470 5.243 5.402) 10.606 2.848 ( 9.025 -6.881 -3.891) 11.997 3.271 ( 7.315 0.823 1.583) 7.530 3.355 ( -1.606 -4.458 0.835) 4.811 3.710 ( 9.494 8.670 2.207) 13.045 3.860 ( 0.500 0.462 -1.375) 1.535 4.120 ( -4.770 10.904 -3.987) 12.552 4.693 ( 8.960 1.621 3.796) 9.865 4.765 ( 2.603 3.782 4.854) 6.681 4.984 ( 15.654 2.425 -3.964) 16.329 5.333 ( 6.045 13.046 -1.726) 14.482 5.440 ( 10.208 13.846 5.021) 17.920 6.169 ( 2.406 0.379 3.595) 4.343 6.279 ( 0.264 12.534 -3.573) 13.036 6.516 ( 9.700 7.675 -0.485) 12.379 6.575 ( 15.182 13.394 -1.820) 20.327 7.398 ( -8.948 -13.202 -5.177) 16.768 7.506 ( -1.390 -4.589 -3.620) 6.008 7.765 ( -12.554 -6.255 4.204) 14.643 8.058 ( -5.847 -5.428 -2.641) 8.404 8.114 ( -9.703 -9.222 3.286) 13.783 8.285 ( -2.456 -8.664 -8.406) 12.319 8.661 ( -9.650 -8.982 0.933) 13.216 9.128 ( -13.059 -11.287 0.775) 17.278 9.360 ( 4.684 -1.634 0.264) 4.967 9.438 ( -17.958 -2.310 7.483) 19.591 9.662 ( -2.406 -14.811 4.267) 15.600 10.854 ( 3.171 -4.677 -0.679) 5.691 10.920 ( -13.760 1.376 1.350) 13.895 11.373 ( -9.733 -3.088 -3.206) 10.702 11.770 ( 18.029 -11.482 0.551) 21.382 12.094 ( -12.626 -1.222 -2.807) 12.992 12.413 ( 7.798 -22.712 -0.097) 24.014 13.282 ( 10.425 19.161 1.571) 21.870 13.654 ( -14.742 24.846 0.877) 28.904 14.148 ( 7.067 -7.369 -0.391) 10.217 14.818 ( 10.397 9.882 2.907) 14.636 15.087 ( 6.565 7.882 -0.121) 10.259 15.332 ( 6.823 6.328 -2.587) 9.659 16.667 ( 5.503 7.417 -1.137) 9.305 17.532 ( -10.859 -9.586 -1.279) 14.542 18.569 ( -6.313 -19.333 -0.608) 20.346 19.296 ( 1.060 11.163 0.216) 11.216 20.758 ( 0.296 -16.727 1.062) 16.763 21.490 ( -12.049 19.171 -0.882) 22.661 21.924 ( 21.818 6.556 1.296) 22.818 22.623 ( 4.552 6.227 -0.324) 7.720 26.870 ( 3.732 4.058 -0.025) 5.513 27.408 ( -2.199 -2.291 0.061) 3.176 27.461 ( -0.286 -1.212 -0.364) 1.297 27.925 ( 16.024 18.102 -2.996) 24.360 28.018 ( 1.128 3.712 0.498) 3.912 28.428 ( 0.040 -2.914 4.716) 5.544 28.660 ( -4.355 2.168 -0.751) 4.922 29.132 ( 0.415 -9.717 -2.621) 10.073 29.419 ( -2.354 2.965 -0.587) 3.832 29.706 ( -5.177 -2.625 3.742) 6.906 29.748 ( -1.907 -5.376 -1.177) 5.825 30.231 ( 3.264 3.608 0.950) 4.957 30.558 ( 1.291 -1.372 -3.901) 4.332 30.696 ( 1.998 7.711 2.938) 8.490 30.878 ( 4.686 1.842 -0.874) 5.110 31.979 ( -17.371 -20.138 0.338) 26.597 ======================= Grid point 316 (86/90) ======================= q-point: ( 0.38 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.392 ( 0.315 11.343 0.450) 11.356 1.721 ( 0.641 0.694 -3.993) 4.104 1.867 ( -3.928 3.143 2.863) 5.788 2.161 ( -5.339 2.426 -1.659) 6.095 2.192 ( -0.363 0.433 -3.679) 3.722 2.567 ( -1.956 -1.462 2.577) 3.550 2.703 ( -2.893 -0.386 -0.224) 2.928 2.948 ( 8.061 -1.903 -1.415) 8.403 3.252 ( -3.355 -2.473 5.719) 7.077 3.358 ( 0.391 -0.673 -0.304) 0.836 3.850 ( 1.406 -0.298 2.022) 2.481 3.884 ( 3.359 -1.022 11.048) 11.592 4.170 ( -4.337 15.775 -7.799) 18.125 4.764 ( 4.105 -6.389 0.251) 7.598 4.934 ( 9.593 2.605 0.584) 9.957 5.211 ( 10.331 -9.005 1.103) 13.749 5.492 ( 0.117 10.606 0.781) 10.636 5.851 ( 13.225 12.649 2.369) 18.453 6.172 ( 0.438 3.832 2.794) 4.763 6.316 ( -4.130 4.031 -3.283) 6.640 6.670 ( 2.641 2.966 -1.451) 4.228 6.994 ( 13.741 7.179 -7.168) 17.081 7.056 ( -8.705 -10.928 -1.084) 14.013 7.309 ( -14.286 -6.996 -1.298) 15.960 7.573 ( 3.313 -4.279 -4.101) 6.790 7.900 ( -6.669 -4.126 1.034) 7.910 7.978 ( -2.008 0.809 3.231) 3.889 8.246 ( -2.392 0.169 -5.981) 6.444 8.512 ( 1.551 -7.025 -0.556) 7.216 8.853 ( -11.123 0.770 1.220) 11.216 9.136 ( -18.889 6.710 6.447) 21.056 9.441 ( 3.283 -5.386 1.893) 6.585 9.529 ( 6.258 -11.147 3.772) 13.328 10.723 ( -9.621 4.760 0.020) 10.734 10.899 ( 4.107 0.644 0.469) 4.183 11.248 ( -3.929 -0.234 -0.722) 4.001 11.814 ( 11.499 -27.605 -3.285) 30.084 12.012 ( 3.039 -4.446 0.355) 5.398 12.401 ( 10.028 -12.333 -0.891) 15.920 13.540 ( 0.355 11.409 0.402) 11.421 13.591 ( -21.603 30.389 2.174) 37.348 14.187 ( 6.440 -7.039 0.326) 9.546 15.059 ( 8.587 6.952 2.417) 11.310 15.212 ( 2.432 2.092 0.168) 3.213 15.416 ( -1.235 -0.459 -1.631) 2.097 16.888 ( 9.430 11.181 -1.952) 14.757 17.218 ( -16.862 -6.186 -2.132) 18.087 18.404 ( 10.118 -20.899 -0.842) 23.234 19.386 ( -8.203 17.331 0.449) 19.179 20.622 ( 7.518 -22.178 1.043) 23.441 21.476 ( -12.542 21.394 -0.568) 24.806 22.245 ( 11.537 -0.774 1.237) 11.629 22.716 ( 0.768 3.096 -0.478) 3.225 26.958 ( 1.728 2.652 -0.056) 3.165 27.324 ( -2.775 -1.327 -0.027) 3.076 27.456 ( 2.402 -4.391 -0.069) 5.005 28.056 ( -0.455 3.222 1.248) 3.485 28.218 ( 3.538 6.109 -3.974) 8.101 28.475 ( -3.357 8.461 4.038) 9.958 28.631 ( 3.812 -1.002 -1.617) 4.260 29.079 ( 4.646 -9.107 -2.889) 10.624 29.364 ( -5.164 0.173 1.745) 5.454 29.612 ( -3.531 0.514 3.535) 5.023 29.700 ( -0.156 -1.765 -1.237) 2.162 30.307 ( 1.784 2.291 0.086) 2.905 30.547 ( 1.632 -4.806 -2.135) 5.507 30.755 ( -2.899 7.554 2.130) 8.367 31.061 ( 11.096 3.972 -1.999) 11.954 31.540 ( -12.957 -14.047 1.177) 19.146 ======================= Grid point 318 (87/90) ======================= q-point: (-0.50 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.463 ( -4.307 7.004 -1.254) 8.318 1.685 ( -5.372 0.109 -6.918) 8.760 1.911 ( 3.748 8.932 0.842) 9.723 2.066 ( -5.742 -1.142 -3.530) 6.837 2.255 ( 3.760 3.707 -0.192) 5.283 2.532 ( 1.821 -2.468 -2.515) 3.966 2.675 ( -2.106 1.792 1.828) 3.315 3.067 ( 7.395 -2.845 -0.178) 7.926 3.182 ( -3.855 0.125 4.182) 5.690 3.310 ( -1.708 -3.589 3.116) 5.051 3.839 ( -0.692 -1.250 12.368) 12.450 3.897 ( -0.911 -1.755 4.784) 5.177 4.247 ( -6.537 15.600 -6.350) 18.067 4.745 ( 2.535 -7.386 -0.776) 7.847 4.996 ( -2.039 -4.256 -3.026) 5.606 5.053 ( -9.016 -20.000 -1.207) 21.971 5.529 ( -5.387 4.788 7.541) 10.432 5.790 ( -17.750 -3.953 -2.950) 18.422 6.260 ( -0.817 -0.599 0.334) 1.067 6.407 ( 1.277 11.870 -5.090) 12.978 6.660 ( -5.759 1.117 -0.329) 5.875 6.804 ( -7.378 -11.719 5.931) 15.065 7.176 ( 9.012 -2.283 -0.668) 9.321 7.292 ( 12.548 8.299 -9.132) 17.599 7.591 ( -1.887 -2.525 -1.703) 3.583 7.867 ( 4.474 0.957 3.976) 6.062 8.099 ( 13.514 6.818 0.206) 15.138 8.229 ( -3.313 2.729 -4.737) 6.392 8.594 ( 11.961 3.920 -2.497) 12.832 8.724 ( -1.723 -2.497 1.118) 3.233 9.005 ( -6.151 11.166 3.426) 13.201 9.365 ( 1.770 -7.703 5.500) 9.629 9.677 ( 11.038 -0.737 0.109) 11.063 10.709 ( -0.334 5.476 -1.762) 5.762 11.011 ( 3.774 10.168 0.953) 10.888 11.217 ( -0.548 0.379 0.219) 0.701 11.798 ( 20.232 -25.438 -2.222) 32.579 11.970 ( 0.342 -10.722 0.733) 10.753 12.442 ( 6.972 -11.358 -1.684) 13.433 13.407 ( -23.248 17.908 1.298) 29.374 13.667 ( -4.856 16.368 0.420) 17.078 14.231 ( 3.890 -3.112 1.580) 5.226 15.133 ( -10.448 -1.842 -0.903) 10.648 15.233 ( 3.146 -1.794 2.052) 4.162 15.316 ( -5.588 -1.354 0.139) 5.752 16.893 ( -15.701 -2.910 -1.966) 16.089 17.178 ( 13.019 9.713 -1.518) 16.314 18.478 ( 19.373 -17.091 -1.228) 25.863 19.336 ( -15.727 15.106 0.206) 21.808 20.621 ( 14.917 -17.102 1.175) 22.724 21.490 ( -10.904 21.965 -0.250) 24.524 22.245 ( -5.194 -10.595 0.460) 11.808 22.712 ( -3.284 0.775 0.169) 3.379 26.946 ( -3.732 -0.652 -0.077) 3.789 27.334 ( 2.558 2.374 0.088) 3.491 27.465 ( 3.786 -4.254 0.119) 5.696 28.060 ( -2.298 2.236 0.709) 3.284 28.266 ( -3.682 4.425 1.935) 6.073 28.326 ( -11.715 -3.819 -3.872) 12.915 28.744 ( 1.649 4.377 -1.836) 5.024 29.075 ( 5.521 -10.790 -1.017) 12.163 29.341 ( 1.582 4.649 3.429) 5.989 29.614 ( 0.989 3.284 -0.658) 3.492 29.699 ( 1.664 -0.820 1.085) 2.149 30.310 ( -2.624 -0.219 1.108) 2.857 30.546 ( 3.246 -3.809 -2.714) 5.693 30.762 ( -4.639 6.770 0.679) 8.235 31.051 ( -9.293 -8.193 1.152) 12.442 31.543 ( 18.576 4.238 -0.403) 19.057 ======================= Grid point 320 (88/90) ======================= q-point: (-0.38 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.437 ( -2.268 2.089 -4.208) 5.216 1.575 ( -4.081 -4.208 -2.127) 6.236 1.897 ( -11.290 5.169 -5.769) 13.691 2.152 ( 10.887 3.275 0.454) 11.378 2.353 ( 4.466 0.820 -1.393) 4.749 2.605 ( 6.372 1.127 -3.424) 7.321 2.649 ( -4.640 5.658 3.643) 8.174 3.028 ( -1.055 -15.668 7.283) 17.311 3.126 ( -5.383 5.724 -0.057) 7.858 3.342 ( 5.872 0.466 2.765) 6.507 3.741 ( -11.089 -4.870 5.017) 13.109 3.853 ( -0.901 0.242 2.984) 3.127 4.200 ( -10.109 5.612 -3.044) 11.956 4.711 ( -10.894 -11.490 -0.011) 15.833 4.750 ( 1.208 1.469 -2.659) 3.269 4.869 ( -6.161 -3.079 -2.249) 7.246 5.340 ( -19.559 -1.246 0.022) 19.599 5.465 ( -11.649 -2.015 6.253) 13.374 6.194 ( -5.814 -3.684 -2.587) 7.352 6.380 ( -11.153 7.108 -6.313) 14.655 6.465 ( -15.640 -12.615 1.405) 20.142 6.524 ( -11.889 0.699 5.245) 13.014 7.421 ( 14.406 -0.667 -1.930) 14.550 7.483 ( 4.005 0.090 -0.873) 4.100 7.778 ( 14.444 7.633 3.090) 16.627 7.981 ( 8.142 4.245 3.510) 9.830 8.226 ( 1.973 3.022 -8.816) 9.526 8.297 ( 14.603 -7.363 -3.533) 16.731 8.745 ( 8.701 -2.497 0.811) 9.089 9.089 ( 29.399 13.394 0.288) 32.308 9.152 ( 6.816 13.140 1.532) 14.882 9.366 ( 2.556 1.223 4.910) 5.669 9.815 ( 9.134 -5.650 0.247) 10.743 10.771 ( 4.282 1.925 -1.502) 4.929 11.113 ( -1.987 0.078 -2.673) 3.332 11.304 ( 8.974 9.046 2.714) 13.027 11.789 ( -1.092 -19.324 -0.926) 19.377 12.088 ( 21.940 5.168 0.317) 22.543 12.421 ( 8.264 -16.613 -2.089) 18.672 13.153 ( -24.740 12.857 1.379) 27.915 13.712 ( -9.375 15.219 0.091) 17.875 14.216 ( 0.575 -9.602 1.104) 9.683 14.818 ( -17.645 -5.992 1.077) 18.666 15.119 ( -10.677 -3.979 0.183) 11.395 15.268 ( -5.720 2.100 -0.233) 6.097 16.664 ( -9.039 -0.878 -1.118) 9.151 17.497 ( 14.972 6.390 -0.575) 16.289 18.678 ( 20.899 -12.449 -1.143) 24.353 19.215 ( -12.155 11.502 -0.130) 16.735 20.752 ( 13.716 -7.780 1.248) 15.818 21.522 ( -9.686 19.370 0.051) 21.657 21.911 ( -17.301 -16.513 -0.174) 23.917 22.620 ( -7.523 -0.646 0.518) 7.568 26.861 ( -5.012 -0.645 -0.063) 5.054 27.394 ( 1.194 0.885 0.162) 1.495 27.499 ( 3.526 -1.844 0.035) 3.979 27.916 ( -25.742 -4.429 -2.067) 26.202 28.022 ( -3.819 0.601 0.259) 3.875 28.366 ( 6.188 2.818 1.415) 6.945 28.731 ( -3.368 0.514 -0.819) 3.504 29.120 ( 8.847 -5.097 -1.243) 10.285 29.415 ( -0.626 4.013 1.427) 4.305 29.697 ( 5.233 3.269 -3.993) 7.349 29.748 ( 5.118 -0.750 4.182) 6.652 30.236 ( -4.766 -1.298 1.837) 5.270 30.557 ( 0.554 -1.680 -3.898) 4.281 30.704 ( -8.260 1.745 1.021) 8.504 30.870 ( -3.295 -2.802 1.687) 4.642 31.980 ( 26.062 4.925 -0.361) 26.526 ======================= Grid point 330 (89/90) ======================= q-point: ( 0.25 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.469 ( 0.512 6.314 0.457) 6.351 1.719 ( 5.336 7.632 -3.652) 10.003 1.967 ( -5.408 -1.459 -0.055) 5.601 2.171 ( 8.617 3.376 -5.014) 10.526 2.270 ( -3.984 -0.717 -2.938) 5.002 2.517 ( 0.726 -7.752 -2.190) 8.088 2.680 ( -4.707 -7.053 -2.418) 8.817 2.992 ( -0.893 12.803 9.764) 16.125 3.261 ( 2.592 -4.709 -0.607) 5.410 3.266 ( 3.823 0.050 5.179) 6.438 3.799 ( 0.222 2.155 14.274) 14.437 3.874 ( -0.057 0.729 2.274) 2.389 4.381 ( 0.164 12.252 -6.618) 13.926 4.729 ( -2.787 2.660 -2.292) 4.484 4.829 ( 9.070 -0.391 2.610) 9.446 4.927 ( 2.373 -2.285 -4.779) 5.805 5.624 ( 3.680 9.760 10.005) 14.453 5.728 ( 11.841 15.702 -0.214) 19.668 6.213 ( 0.037 5.574 2.459) 6.093 6.509 ( -8.105 10.557 -4.817) 14.154 6.606 ( 7.294 -0.033 -2.521) 7.717 6.790 ( 14.328 7.780 -1.051) 16.338 7.116 ( -10.504 -11.504 -1.781) 15.680 7.442 ( 0.512 -14.408 -10.659) 17.929 7.505 ( -10.714 -2.506 -2.637) 11.315 7.894 ( -2.360 -7.934 6.601) 10.587 8.045 ( -9.537 -7.728 -4.460) 13.060 8.290 ( 2.937 6.095 -5.106) 8.476 8.585 ( -8.061 4.607 1.575) 9.418 8.893 ( 7.499 -11.303 4.813) 14.393 9.203 ( 6.692 -11.935 3.055) 14.021 9.320 ( 2.310 -5.130 3.852) 6.819 9.531 ( -18.545 -4.228 3.604) 19.360 10.797 ( 5.607 -0.061 -0.768) 5.659 11.047 ( -16.344 10.455 -0.126) 19.402 11.223 ( 3.388 -10.361 -1.966) 11.077 11.573 ( -2.764 -10.437 0.295) 10.801 11.840 ( -6.286 -19.297 -0.195) 20.296 12.299 ( 0.120 6.633 -1.884) 6.897 13.590 ( 9.706 13.457 0.871) 16.615 13.959 ( 12.344 -6.255 0.439) 13.846 14.104 ( -11.109 12.055 1.889) 16.502 15.009 ( 3.700 11.165 2.585) 12.043 15.236 ( 1.447 5.948 -0.524) 6.144 15.368 ( 4.636 -1.884 -0.316) 5.014 16.869 ( 7.443 12.959 -2.826) 15.209 17.326 ( -3.274 -11.206 -2.305) 11.900 18.231 ( -13.622 -15.067 -1.453) 20.364 19.538 ( 10.688 13.719 0.294) 17.393 20.427 ( -9.994 -16.719 1.197) 19.515 21.789 ( 3.916 9.150 -0.211) 9.955 22.049 ( 4.991 7.572 1.059) 9.131 22.723 ( 2.333 3.656 -0.038) 4.337 26.947 ( 2.914 3.683 -0.023) 4.696 27.375 ( -3.035 -1.175 0.044) 3.255 27.391 ( -1.545 -4.718 -0.137) 4.966 28.077 ( 0.751 1.796 1.656) 2.555 28.251 ( 3.886 13.233 -4.514) 14.511 28.406 ( 11.475 2.326 2.156) 11.905 28.764 ( -6.786 7.032 -0.055) 9.772 28.929 ( -2.069 -11.092 -3.399) 11.784 29.416 ( -0.121 -2.081 2.578) 3.315 29.625 ( -3.618 -6.059 4.105) 8.165 29.707 ( 0.827 1.252 -2.104) 2.584 30.304 ( 1.991 3.913 1.236) 4.561 30.507 ( -2.019 -3.590 -2.804) 4.983 30.881 ( 2.384 10.699 1.257) 11.033 30.914 ( 5.219 2.225 -0.572) 5.702 31.588 ( -11.359 -19.426 0.350) 22.506 ======================= Grid point 332 (90/90) ======================= q-point: ( 0.38 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( -0.534 1.781 4.571) 4.935 1.830 ( -2.936 6.313 -6.273) 9.372 1.896 ( 0.371 0.840 -2.275) 2.454 2.239 ( -3.724 7.382 -2.514) 8.642 2.256 ( -3.434 4.544 -2.960) 6.419 2.477 ( -2.162 -7.407 -2.940) 8.257 2.560 ( 10.271 -9.558 -3.772) 14.528 3.105 ( -3.789 13.243 7.396) 15.635 3.222 ( -1.217 -0.655 3.050) 3.348 3.303 ( -0.249 -4.905 4.838) 6.894 3.831 ( 0.334 -0.737 12.781) 12.807 3.865 ( 1.689 -1.644 10.028) 10.301 4.482 ( -2.816 10.529 -9.112) 14.206 4.706 ( -1.655 4.831 -2.173) 5.550 4.866 ( 0.359 -10.828 -3.342) 11.338 4.939 ( 6.818 -10.319 -2.326) 12.584 5.710 ( -5.555 9.897 10.206) 15.263 5.879 ( 1.909 -4.417 8.909) 10.126 6.395 ( -11.035 4.061 -2.230) 11.968 6.450 ( 6.956 15.554 -6.434) 18.213 6.631 ( 2.000 -7.218 -3.618) 8.318 6.891 ( -6.030 -0.743 0.102) 6.076 7.063 ( 6.947 -9.595 -6.819) 13.668 7.195 ( -1.937 2.839 -7.124) 7.910 7.572 ( 1.723 4.044 -3.719) 5.758 7.810 ( 0.274 -7.712 -0.787) 7.756 7.844 ( 6.684 -7.237 1.560) 9.974 8.348 ( -1.025 2.506 -6.707) 7.232 8.659 ( -1.199 23.797 3.693) 24.112 8.885 ( -16.960 -2.505 3.196) 17.440 9.134 ( 8.898 -13.828 5.935) 17.482 9.235 ( -6.076 2.281 4.972) 8.176 9.414 ( 12.346 -7.524 1.916) 14.584 10.842 ( -7.411 5.872 -0.896) 9.498 10.997 ( 6.930 4.478 0.278) 8.255 11.299 ( 2.891 9.226 -0.133) 9.669 11.356 ( -4.578 -15.875 -2.087) 16.653 11.685 ( 12.709 -21.788 0.321) 25.226 12.370 ( -0.526 2.484 -1.418) 2.908 13.750 ( -3.560 9.286 -0.124) 9.946 13.892 ( -5.328 -1.406 0.593) 5.542 14.182 ( 0.310 6.911 3.231) 7.635 15.165 ( 2.158 3.125 2.027) 4.305 15.241 ( -1.751 -0.467 0.064) 1.814 15.372 ( -1.528 -1.033 0.040) 1.844 17.097 ( 1.715 5.510 -3.558) 6.780 17.142 ( -7.127 1.531 -3.159) 7.945 18.048 ( 9.600 -13.527 -1.527) 16.657 19.734 ( -11.400 17.873 0.582) 21.208 20.211 ( 11.583 -19.334 0.988) 22.559 21.857 ( -9.335 16.743 0.224) 19.171 22.147 ( 5.073 -8.947 0.947) 10.329 22.758 ( -0.776 1.189 -0.195) 1.433 26.993 ( -0.968 1.030 0.032) 1.414 27.323 ( 0.300 1.174 -0.038) 1.212 27.369 ( 1.794 -3.966 -0.049) 4.354 28.089 ( -0.125 0.366 2.283) 2.315 28.335 ( -1.411 4.808 -1.469) 5.222 28.589 ( -15.616 1.990 -2.225) 15.899 28.682 ( 11.220 8.054 -2.316) 14.004 28.873 ( 4.681 -12.528 -2.407) 13.589 29.402 ( -3.344 4.473 4.753) 7.333 29.547 ( 3.596 -5.675 4.683) 8.190 29.725 ( -1.197 1.985 -2.671) 3.537 30.358 ( -1.544 2.877 0.222) 3.273 30.454 ( 2.437 -4.303 -1.293) 5.112 30.921 ( -4.882 9.289 -0.087) 10.494 31.072 ( 1.608 -4.055 -1.251) 4.537 31.326 ( 3.892 -6.308 1.672) 7.598 =================== 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 3/35328 10.0 271.915 271.915 313.525 0.000 -0.000 0.000 3/35328 20.0 51.587 51.587 62.412 0.000 -0.000 0.000 3/35328 30.0 24.021 24.021 27.608 0.000 -0.000 0.000 3/35328 40.0 15.039 15.039 16.788 0.000 -0.000 0.000 3/35328 50.0 10.831 10.831 11.838 0.000 -0.000 0.000 3/35328 60.0 8.479 8.479 9.079 0.000 -0.000 0.000 3/35328 70.0 7.018 7.018 7.348 0.000 -0.000 0.000 3/35328 80.0 6.043 6.043 6.172 0.000 -0.000 0.000 3/35328 90.0 5.360 5.360 5.326 0.000 -0.000 0.000 3/35328 100.0 4.861 4.861 4.690 0.000 -0.000 0.000 3/35328 110.0 4.483 4.483 4.196 0.000 -0.000 0.000 3/35328 120.0 4.187 4.187 3.799 0.000 -0.000 0.000 3/35328 130.0 3.950 3.950 3.475 0.000 -0.000 0.000 3/35328 140.0 3.753 3.753 3.204 0.000 -0.000 0.000 3/35328 150.0 3.585 3.585 2.975 0.000 -0.000 0.000 3/35328 160.0 3.440 3.440 2.778 0.000 -0.000 0.000 3/35328 170.0 3.312 3.312 2.607 0.000 -0.000 0.000 3/35328 180.0 3.196 3.196 2.457 0.000 -0.000 0.000 3/35328 190.0 3.091 3.091 2.324 0.000 -0.000 0.000 3/35328 200.0 2.994 2.994 2.206 0.000 -0.000 0.000 3/35328 210.0 2.904 2.904 2.100 0.000 -0.000 0.000 3/35328 220.0 2.820 2.820 2.004 0.000 -0.000 0.000 3/35328 230.0 2.741 2.741 1.917 0.000 -0.000 0.000 3/35328 240.0 2.667 2.667 1.838 0.000 -0.000 0.000 3/35328 250.0 2.597 2.597 1.766 0.000 -0.000 0.000 3/35328 260.0 2.530 2.530 1.700 0.000 -0.000 0.000 3/35328 270.0 2.467 2.467 1.639 0.000 -0.000 0.000 3/35328 280.0 2.406 2.406 1.582 0.000 -0.000 0.000 3/35328 290.0 2.349 2.349 1.530 0.000 -0.000 0.000 3/35328 300.0 2.294 2.294 1.481 0.000 -0.000 0.000 3/35328 310.0 2.241 2.241 1.435 0.000 -0.000 0.000 3/35328 320.0 2.191 2.191 1.392 0.000 -0.000 0.000 3/35328 330.0 2.142 2.142 1.352 0.000 -0.000 0.000 3/35328 340.0 2.096 2.096 1.315 0.000 -0.000 0.000 3/35328 350.0 2.051 2.051 1.279 0.000 -0.000 0.000 3/35328 360.0 2.008 2.008 1.246 0.000 -0.000 0.000 3/35328 370.0 1.967 1.967 1.214 0.000 -0.000 0.000 3/35328 380.0 1.928 1.928 1.184 0.000 -0.000 0.000 3/35328 390.0 1.889 1.889 1.155 0.000 -0.000 0.000 3/35328 400.0 1.853 1.853 1.128 0.000 -0.000 0.000 3/35328 410.0 1.817 1.817 1.102 0.000 -0.000 0.000 3/35328 420.0 1.783 1.783 1.078 0.000 -0.000 0.000 3/35328 430.0 1.750 1.750 1.054 0.000 -0.000 0.000 3/35328 440.0 1.718 1.718 1.032 0.000 -0.000 0.000 3/35328 450.0 1.687 1.687 1.011 0.000 -0.000 0.000 3/35328 460.0 1.657 1.657 0.990 0.000 -0.000 0.000 3/35328 470.0 1.628 1.628 0.970 0.000 -0.000 0.000 3/35328 480.0 1.600 1.600 0.951 0.000 -0.000 0.000 3/35328 490.0 1.573 1.573 0.933 0.000 -0.000 0.000 3/35328 500.0 1.547 1.547 0.916 0.000 -0.000 0.000 3/35328 510.0 1.521 1.521 0.899 0.000 -0.000 0.000 3/35328 520.0 1.496 1.496 0.883 0.000 -0.000 0.000 3/35328 530.0 1.473 1.473 0.867 0.000 -0.000 0.000 3/35328 540.0 1.449 1.449 0.852 0.000 -0.000 0.000 3/35328 550.0 1.427 1.427 0.837 0.000 -0.000 0.000 3/35328 560.0 1.405 1.405 0.823 0.000 -0.000 0.000 3/35328 570.0 1.384 1.384 0.810 0.000 -0.000 0.000 3/35328 580.0 1.363 1.363 0.796 0.000 -0.000 0.000 3/35328 590.0 1.343 1.343 0.784 0.000 -0.000 0.000 3/35328 600.0 1.323 1.323 0.771 0.000 -0.000 0.000 3/35328 610.0 1.304 1.304 0.759 0.000 -0.000 0.000 3/35328 620.0 1.286 1.286 0.748 0.000 -0.000 0.000 3/35328 630.0 1.268 1.268 0.737 0.000 -0.000 0.000 3/35328 640.0 1.250 1.250 0.726 0.000 -0.000 0.000 3/35328 650.0 1.233 1.233 0.715 0.000 -0.000 0.000 3/35328 660.0 1.217 1.217 0.705 0.000 -0.000 0.000 3/35328 670.0 1.200 1.200 0.695 0.000 -0.000 0.000 3/35328 680.0 1.185 1.185 0.685 0.000 -0.000 0.000 3/35328 690.0 1.169 1.169 0.676 0.000 -0.000 0.000 3/35328 700.0 1.154 1.154 0.667 0.000 -0.000 0.000 3/35328 710.0 1.139 1.139 0.658 0.000 -0.000 0.000 3/35328 720.0 1.125 1.125 0.649 0.000 -0.000 0.000 3/35328 730.0 1.111 1.111 0.640 0.000 -0.000 0.000 3/35328 740.0 1.097 1.097 0.632 0.000 -0.000 0.000 3/35328 750.0 1.084 1.084 0.624 0.000 -0.000 0.000 3/35328 760.0 1.071 1.071 0.616 0.000 -0.000 0.000 3/35328 770.0 1.058 1.058 0.609 0.000 -0.000 0.000 3/35328 780.0 1.046 1.046 0.601 0.000 -0.000 0.000 3/35328 790.0 1.034 1.034 0.594 0.000 -0.000 0.000 3/35328 800.0 1.022 1.022 0.587 0.000 -0.000 0.000 3/35328 810.0 1.010 1.010 0.580 0.000 -0.000 0.000 3/35328 820.0 0.999 0.999 0.573 0.000 -0.000 0.000 3/35328 830.0 0.988 0.988 0.566 0.000 -0.000 0.000 3/35328 840.0 0.977 0.977 0.560 0.000 -0.000 0.000 3/35328 850.0 0.966 0.966 0.554 0.000 -0.000 0.000 3/35328 860.0 0.956 0.956 0.547 0.000 -0.000 0.000 3/35328 870.0 0.946 0.946 0.541 0.000 -0.000 0.000 3/35328 880.0 0.936 0.936 0.535 0.000 -0.000 0.000 3/35328 890.0 0.926 0.926 0.530 0.000 -0.000 0.000 3/35328 900.0 0.916 0.916 0.524 0.000 -0.000 0.000 3/35328 910.0 0.907 0.907 0.518 0.000 -0.000 0.000 3/35328 920.0 0.898 0.898 0.513 0.000 -0.000 0.000 3/35328 930.0 0.888 0.888 0.508 0.000 -0.000 0.000 3/35328 940.0 0.880 0.880 0.502 0.000 -0.000 0.000 3/35328 950.0 0.871 0.871 0.497 0.000 -0.000 0.000 3/35328 960.0 0.862 0.862 0.492 0.000 -0.000 0.000 3/35328 970.0 0.854 0.854 0.487 0.000 -0.000 0.000 3/35328 980.0 0.846 0.846 0.483 0.000 -0.000 0.000 3/35328 990.0 0.838 0.838 0.478 0.000 -0.000 0.000 3/35328 1000.0 0.830 0.830 0.473 0.000 -0.000 0.000 3/35328 Thermal conductivity related properties were written into "kappa-m888.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 04:52:58]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|