----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 22:58:49]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.200640545675877 -4.770662255000000 0.000000000000000 b 5.200640545675877 4.770662255000000 0.000000000000000 c -1.467412745855653 0.000000000000000 5.454371573003499 Atomic positions (fractional): *1 O 0.33518911985435 0.36627774410766 0.47346074080338 15.999 2 O 0.63372225589234 0.66481088014565 0.02653925919662 15.999 3 O 0.66481088014565 0.63372225589234 0.52653925919662 15.999 4 O 0.36627774410766 0.33518911985435 0.97346074080338 15.999 *5 O 0.09085543999564 0.60289886838115 0.78143859252340 15.999 6 O 0.39710113161885 0.90914456000437 0.71856140747660 15.999 7 O 0.90914456000437 0.39710113161885 0.21856140747659 15.999 8 O 0.60289886838115 0.09085543999563 0.28143859252340 15.999 *9 O 0.18058669242045 0.03791603950066 0.12911688216233 15.999 10 O 0.96208396049934 0.81941330757955 0.37088311783767 15.999 11 O 0.81941330757955 0.96208396049934 0.87088311783767 15.999 12 O 0.03791603950066 0.18058669242045 0.62911688216233 15.999 *13 K 0.31156473364289 0.68843526635711 0.25000000000000 39.098 14 K 0.68843526635711 0.31156473364289 0.75000000000000 39.098 *15 Ge 0.62628231903659 0.80549117848746 0.79469727886780 72.640 16 Ge 0.37371768096341 0.19450882151254 0.20530272113220 72.640 17 Ge 0.19450882151254 0.37371768096341 0.70530272113220 72.640 18 Ge 0.80549117848746 0.62628231903659 0.29469727886780 72.640 *19 In 0.89658995708293 0.10341004291707 0.25000000000000 114.818 20 In 0.10341004291707 0.89658995708293 0.75000000000000 114.818 -------------------------------- unit cell --------------------------------- Lattice vectors: a 10.401281091351754 0.000000000000000 0.000000000000000 b 0.000000000000000 9.541324510000001 0.000000000000000 c -1.467412745855653 0.000000000000000 5.454371573003499 Atomic positions (fractional): *1 O 0.85073343198100 0.51554431212665 0.47346074080338 15.999 > 1 2 O 0.14926656801900 0.51554431212665 0.02653925919662 15.999 > 2 3 O 0.14926656801900 0.48445568787335 0.52653925919662 15.999 > 3 4 O 0.85073343198100 0.48445568787335 0.97346074080338 15.999 > 4 *5 O 0.84687715418839 0.75602171419276 0.78143859252340 15.999 > 5 6 O 0.15312284581161 0.75602171419276 0.71856140747660 15.999 > 6 7 O 0.15312284581161 0.24397828580724 0.21856140747659 15.999 > 7 8 O 0.84687715418839 0.24397828580724 0.28143859252340 15.999 > 8 *9 O 0.60925136596056 0.42866467354011 0.12911688216233 15.999 > 9 10 O 0.39074863403944 0.42866467354011 0.37088311783767 15.999 > 10 11 O 0.39074863403944 0.57133532645989 0.87088311783767 15.999 > 11 12 O 0.60925136596056 0.57133532645989 0.62911688216233 15.999 > 12 13 O 0.35073343198100 0.01554431212665 0.47346074080338 15.999 > 1 14 O 0.64926656801900 0.01554431212665 0.02653925919662 15.999 > 2 15 O 0.64926656801900 0.98445568787335 0.52653925919662 15.999 > 3 16 O 0.35073343198100 0.98445568787335 0.97346074080338 15.999 > 4 17 O 0.34687715418839 0.25602171419276 0.78143859252340 15.999 > 5 18 O 0.65312284581161 0.25602171419276 0.71856140747660 15.999 > 6 19 O 0.65312284581161 0.74397828580724 0.21856140747659 15.999 > 7 20 O 0.34687715418839 0.74397828580724 0.28143859252340 15.999 > 8 21 O 0.10925136596056 0.92866467354011 0.12911688216233 15.999 > 9 22 O 0.89074863403944 0.92866467354011 0.37088311783767 15.999 > 10 23 O 0.89074863403944 0.07133532645990 0.87088311783767 15.999 > 11 24 O 0.10925136596056 0.07133532645990 0.62911688216233 15.999 > 12 *25 K 0.00000000000000 0.68843526635711 0.25000000000000 39.098 > 13 26 K 0.00000000000000 0.31156473364289 0.75000000000000 39.098 > 14 27 K 0.50000000000000 0.18843526635711 0.25000000000000 39.098 > 13 28 K 0.50000000000000 0.81156473364289 0.75000000000000 39.098 > 14 *29 Ge 0.21588674876202 0.58960442972544 0.79469727886780 72.640 > 15 30 Ge 0.78411325123798 0.41039557027456 0.20530272113220 72.640 > 16 31 Ge 0.78411325123798 0.58960442972544 0.70530272113220 72.640 > 17 32 Ge 0.21588674876202 0.41039557027456 0.29469727886780 72.640 > 18 33 Ge 0.71588674876202 0.08960442972544 0.79469727886780 72.640 > 15 34 Ge 0.28411325123798 0.91039557027456 0.20530272113220 72.640 > 16 35 Ge 0.28411325123798 0.08960442972544 0.70530272113220 72.640 > 17 36 Ge 0.71588674876202 0.91039557027456 0.29469727886780 72.640 > 18 *37 In 0.00000000000000 0.10341004291707 0.25000000000000 114.818 > 19 38 In 0.00000000000000 0.89658995708293 0.75000000000000 114.818 > 20 39 In 0.50000000000000 0.60341004291707 0.25000000000000 114.818 > 19 40 In 0.50000000000000 0.39658995708293 0.75000000000000 114.818 > 20 -------------------------------- super cell -------------------------------- Lattice vectors: a 10.401281091351754 0.000000000000000 0.000000000000000 b 0.000000000000000 9.541324510000001 0.000000000000000 c -2.934825491711306 0.000000000000000 10.908743146006998 Atomic positions (fractional): *1 O 0.85073343198100 0.51554431212665 0.23673037040169 15.999 > 1 2 O 0.85073343198100 0.51554431212665 0.73673037040169 15.999 > 1 3 O 0.14926656801900 0.51554431212665 0.01326962959831 15.999 > 2 4 O 0.14926656801900 0.51554431212665 0.51326962959831 15.999 > 2 5 O 0.14926656801900 0.48445568787335 0.26326962959831 15.999 > 3 6 O 0.14926656801900 0.48445568787335 0.76326962959831 15.999 > 3 7 O 0.85073343198100 0.48445568787335 0.48673037040169 15.999 > 4 8 O 0.85073343198100 0.48445568787335 0.98673037040169 15.999 > 4 *9 O 0.84687715418839 0.75602171419276 0.39071929626170 15.999 > 5 10 O 0.84687715418839 0.75602171419276 0.89071929626170 15.999 > 5 11 O 0.15312284581161 0.75602171419276 0.35928070373830 15.999 > 6 12 O 0.15312284581161 0.75602171419276 0.85928070373830 15.999 > 6 13 O 0.15312284581161 0.24397828580724 0.10928070373830 15.999 > 7 14 O 0.15312284581161 0.24397828580724 0.60928070373830 15.999 > 7 15 O 0.84687715418839 0.24397828580724 0.14071929626170 15.999 > 8 16 O 0.84687715418839 0.24397828580724 0.64071929626170 15.999 > 8 *17 O 0.60925136596056 0.42866467354011 0.06455844108117 15.999 > 9 18 O 0.60925136596056 0.42866467354011 0.56455844108117 15.999 > 9 19 O 0.39074863403944 0.42866467354011 0.18544155891883 15.999 > 10 20 O 0.39074863403944 0.42866467354011 0.68544155891883 15.999 > 10 21 O 0.39074863403944 0.57133532645989 0.43544155891883 15.999 > 11 22 O 0.39074863403944 0.57133532645989 0.93544155891883 15.999 > 11 23 O 0.60925136596056 0.57133532645989 0.31455844108117 15.999 > 12 24 O 0.60925136596056 0.57133532645989 0.81455844108117 15.999 > 12 25 O 0.35073343198100 0.01554431212665 0.23673037040169 15.999 > 1 26 O 0.35073343198100 0.01554431212665 0.73673037040169 15.999 > 1 27 O 0.64926656801900 0.01554431212665 0.01326962959831 15.999 > 2 28 O 0.64926656801900 0.01554431212665 0.51326962959831 15.999 > 2 29 O 0.64926656801900 0.98445568787335 0.26326962959831 15.999 > 3 30 O 0.64926656801900 0.98445568787335 0.76326962959831 15.999 > 3 31 O 0.35073343198100 0.98445568787335 0.48673037040169 15.999 > 4 32 O 0.35073343198100 0.98445568787335 0.98673037040169 15.999 > 4 33 O 0.34687715418839 0.25602171419276 0.39071929626170 15.999 > 5 34 O 0.34687715418839 0.25602171419276 0.89071929626170 15.999 > 5 35 O 0.65312284581161 0.25602171419276 0.35928070373830 15.999 > 6 36 O 0.65312284581161 0.25602171419276 0.85928070373830 15.999 > 6 37 O 0.65312284581161 0.74397828580724 0.10928070373830 15.999 > 7 38 O 0.65312284581161 0.74397828580724 0.60928070373830 15.999 > 7 39 O 0.34687715418839 0.74397828580724 0.14071929626170 15.999 > 8 40 O 0.34687715418839 0.74397828580724 0.64071929626170 15.999 > 8 41 O 0.10925136596056 0.92866467354011 0.06455844108117 15.999 > 9 42 O 0.10925136596056 0.92866467354011 0.56455844108117 15.999 > 9 43 O 0.89074863403944 0.92866467354011 0.18544155891883 15.999 > 10 44 O 0.89074863403944 0.92866467354011 0.68544155891883 15.999 > 10 45 O 0.89074863403944 0.07133532645990 0.43544155891883 15.999 > 11 46 O 0.89074863403944 0.07133532645990 0.93544155891883 15.999 > 11 47 O 0.10925136596056 0.07133532645990 0.31455844108117 15.999 > 12 48 O 0.10925136596056 0.07133532645990 0.81455844108117 15.999 > 12 *49 K 0.00000000000000 0.68843526635711 0.12500000000000 39.098 > 13 50 K 0.00000000000000 0.68843526635711 0.62500000000000 39.098 > 13 51 K 0.00000000000000 0.31156473364289 0.37500000000000 39.098 > 14 52 K 0.00000000000000 0.31156473364289 0.87500000000000 39.098 > 14 53 K 0.50000000000000 0.18843526635711 0.12500000000000 39.098 > 13 54 K 0.50000000000000 0.18843526635711 0.62500000000000 39.098 > 13 55 K 0.50000000000000 0.81156473364289 0.37500000000000 39.098 > 14 56 K 0.50000000000000 0.81156473364289 0.87500000000000 39.098 > 14 *57 Ge 0.21588674876202 0.58960442972544 0.39734863943390 72.640 > 15 58 Ge 0.21588674876202 0.58960442972544 0.89734863943390 72.640 > 15 59 Ge 0.78411325123798 0.41039557027456 0.10265136056610 72.640 > 16 60 Ge 0.78411325123798 0.41039557027456 0.60265136056610 72.640 > 16 61 Ge 0.78411325123798 0.58960442972544 0.35265136056610 72.640 > 17 62 Ge 0.78411325123798 0.58960442972544 0.85265136056610 72.640 > 17 63 Ge 0.21588674876202 0.41039557027456 0.14734863943390 72.640 > 18 64 Ge 0.21588674876202 0.41039557027456 0.64734863943390 72.640 > 18 65 Ge 0.71588674876202 0.08960442972544 0.39734863943390 72.640 > 15 66 Ge 0.71588674876202 0.08960442972544 0.89734863943390 72.640 > 15 67 Ge 0.28411325123798 0.91039557027456 0.10265136056610 72.640 > 16 68 Ge 0.28411325123798 0.91039557027456 0.60265136056610 72.640 > 16 69 Ge 0.28411325123798 0.08960442972544 0.35265136056610 72.640 > 17 70 Ge 0.28411325123798 0.08960442972544 0.85265136056610 72.640 > 17 71 Ge 0.71588674876202 0.91039557027456 0.14734863943390 72.640 > 18 72 Ge 0.71588674876202 0.91039557027456 0.64734863943390 72.640 > 18 *73 In 0.00000000000000 0.10341004291707 0.12500000000000 114.818 > 19 74 In 0.00000000000000 0.10341004291707 0.62500000000000 114.818 > 19 75 In 0.00000000000000 0.89658995708293 0.37500000000000 114.818 > 20 76 In 0.00000000000000 0.89658995708293 0.87500000000000 114.818 > 20 77 In 0.50000000000000 0.60341004291707 0.12500000000000 114.818 > 19 78 In 0.50000000000000 0.60341004291707 0.62500000000000 114.818 > 19 79 In 0.50000000000000 0.39658995708293 0.37500000000000 114.818 > 20 80 In 0.50000000000000 0.39658995708293 0.87500000000000 114.818 > 20 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.5202881 0.0000000 0.0547029 0.0000000 3.6096902 0.0000000 0.0546864 0.0000000 3.5591719 -------------------------- Born effective charges -------------------------- 1 O -1.4318492 0.2371408 0.3196497 0.2197136 -1.7253167 -0.7644584 0.2789340 -0.8247465 -2.5473787 2 O -1.4318492 -0.2371408 0.3196497 -0.2197136 -1.7253167 0.7644584 0.2789340 0.8247465 -2.5473787 3 O -1.4318492 0.2371408 0.3196497 0.2197136 -1.7253167 -0.7644584 0.2789340 -0.8247465 -2.5473787 4 O -1.4318492 -0.2371408 0.3196497 -0.2197136 -1.7253167 0.7644584 0.2789340 0.8247465 -2.5473787 5 O -1.7126830 -0.8046942 -0.1495000 -0.6570434 -2.4186866 -0.1021729 -0.1191312 -0.0958375 -1.4311351 6 O -1.7126830 0.8046942 -0.1495000 0.6570434 -2.4186866 0.1021729 -0.1191312 0.0958375 -1.4311351 7 O -1.7126830 -0.8046942 -0.1495000 -0.6570434 -2.4186866 -0.1021729 -0.1191312 -0.0958375 -1.4311351 8 O -1.7126830 0.8046942 -0.1495000 0.6570434 -2.4186866 0.1021729 -0.1191312 0.0958375 -1.4311351 9 O -2.3443650 0.4236687 -0.2597050 0.2678942 -1.6307083 -0.2491680 -0.2449183 -0.2174987 -1.8471723 10 O -2.3443650 -0.4236687 -0.2597050 -0.2678942 -1.6307083 0.2491680 -0.2449183 0.2174987 -1.8471723 11 O -2.3443650 0.4236687 -0.2597050 0.2678942 -1.6307083 -0.2491680 -0.2449183 -0.2174987 -1.8471723 12 O -2.3443650 -0.4236687 -0.2597050 -0.2678942 -1.6307083 0.2491680 -0.2449183 0.2174987 -1.8471723 13 K 1.2298545 0.0000000 0.0151400 0.0000000 1.1828993 0.0000000 0.0303746 0.0000000 1.1851350 14 K 1.2298545 0.0000000 0.0151400 0.0000000 1.1828993 0.0000000 0.0303746 0.0000000 1.1851350 15 Ge 3.0848467 -0.6429280 -0.0064766 0.0027186 3.4134344 -0.0404525 0.0045860 0.1136593 3.6598882 16 Ge 3.0848467 -0.6429280 -0.0064766 0.0027186 3.4134344 -0.0404525 0.0045860 0.1136593 3.6598882 17 Ge 3.0848467 0.6429280 -0.0064766 -0.0027186 3.4134344 0.0404525 0.0045860 -0.1136593 3.6598882 18 Ge 3.0848467 0.6429280 -0.0064766 -0.0027186 3.4134344 0.0404525 0.0045860 -0.1136593 3.6598882 19 In 3.5782467 0.0000000 0.1769237 0.0000000 3.5396549 0.0000000 0.1306843 0.0000000 3.1464609 20 In 3.5782467 0.0000000 0.1769237 0.0000000 3.5396549 0.0000000 0.1306843 0.0000000 3.1464609 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 240/240 Permutation basis: 8772/8772 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1894 Number of blocks in projector: 1894 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 408 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 234 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 234 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 234 Use standard eigh solver. Tree of FC basis block matrices: - (1894, 1849), data: False |-- (234, 228), data: True |-- (234, 228), data: True |-- (234, 228), data: True |-- (392, 384), data: True |-- (392, 384), data: True |-- (408, 397), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 640 - Time: 2.202 Solver_block: 200 / 640 - Time: 2.191 Solver_block: 300 / 640 - Time: 2.194 Solver_block: 400 / 640 - Time: 2.196 Solver_block: 500 / 640 - Time: 2.191 Solver_block: 600 / 640 - Time: 2.189 Solver_block: 640 / 640 - Time: 0.937 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 14.148 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 240/240 Permutation basis: 8772/8772 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1894 Number of blocks in projector: 1894 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 408 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 234 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 234 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 234 Use standard eigh solver. Tree of FC basis block matrices: - (1894, 1849), data: False |-- (234, 228), data: True |-- (234, 228), data: True |-- (234, 228), data: True |-- (392, 384), data: True |-- (392, 384), data: True |-- (408, 397), data: True Max drift after symmetrization by symfc projector: 0.00000000 (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 2026-01-07 22:59:22]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 22:59:23]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.200640545675877 -4.770662255000000 0.000000000000000 b 5.200640545675877 4.770662255000000 0.000000000000000 c -1.467412745855653 0.000000000000000 5.454371573003499 Atomic positions (fractional): 1 O 0.33518911985435 0.36627774410766 0.47346074080338 15.999 2 O 0.63372225589234 0.66481088014565 0.02653925919662 15.999 3 O 0.66481088014565 0.63372225589234 0.52653925919662 15.999 4 O 0.36627774410766 0.33518911985435 0.97346074080338 15.999 5 O 0.09085543999564 0.60289886838115 0.78143859252340 15.999 6 O 0.39710113161885 0.90914456000437 0.71856140747660 15.999 7 O 0.90914456000437 0.39710113161885 0.21856140747659 15.999 8 O 0.60289886838115 0.09085543999563 0.28143859252340 15.999 9 O 0.18058669242045 0.03791603950066 0.12911688216233 15.999 10 O 0.96208396049934 0.81941330757955 0.37088311783767 15.999 11 O 0.81941330757955 0.96208396049934 0.87088311783767 15.999 12 O 0.03791603950066 0.18058669242045 0.62911688216233 15.999 13 K 0.31156473364289 0.68843526635711 0.25000000000000 39.098 14 K 0.68843526635711 0.31156473364289 0.75000000000000 39.098 15 Ge 0.62628231903659 0.80549117848746 0.79469727886780 72.640 16 Ge 0.37371768096341 0.19450882151254 0.20530272113220 72.640 17 Ge 0.19450882151254 0.37371768096341 0.70530272113220 72.640 18 Ge 0.80549117848746 0.62628231903659 0.29469727886780 72.640 19 In 0.89658995708293 0.10341004291707 0.25000000000000 114.818 20 In 0.10341004291707 0.89658995708293 0.75000000000000 114.818 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.401281091351754 0.000000000000000 0.000000000000000 b 0.000000000000000 9.541324510000001 0.000000000000000 c -2.934825491711306 0.000000000000000 10.908743146006998 Atomic positions (fractional): 1 O 0.85073343198100 0.51554431212665 0.23673037040169 15.999 > 1 2 O 0.85073343198100 0.51554431212665 0.73673037040169 15.999 > 1 3 O 0.14926656801900 0.51554431212665 0.01326962959831 15.999 > 3 4 O 0.14926656801900 0.51554431212665 0.51326962959831 15.999 > 3 5 O 0.14926656801900 0.48445568787335 0.26326962959831 15.999 > 5 6 O 0.14926656801900 0.48445568787335 0.76326962959831 15.999 > 5 7 O 0.85073343198100 0.48445568787335 0.48673037040169 15.999 > 7 8 O 0.85073343198100 0.48445568787335 0.98673037040169 15.999 > 7 9 O 0.84687715418839 0.75602171419276 0.39071929626170 15.999 > 9 10 O 0.84687715418839 0.75602171419276 0.89071929626170 15.999 > 9 11 O 0.15312284581161 0.75602171419276 0.35928070373830 15.999 > 11 12 O 0.15312284581161 0.75602171419276 0.85928070373830 15.999 > 11 13 O 0.15312284581161 0.24397828580724 0.10928070373830 15.999 > 13 14 O 0.15312284581161 0.24397828580724 0.60928070373830 15.999 > 13 15 O 0.84687715418839 0.24397828580724 0.14071929626170 15.999 > 15 16 O 0.84687715418839 0.24397828580724 0.64071929626170 15.999 > 15 17 O 0.60925136596056 0.42866467354011 0.06455844108117 15.999 > 17 18 O 0.60925136596056 0.42866467354011 0.56455844108117 15.999 > 17 19 O 0.39074863403944 0.42866467354011 0.18544155891883 15.999 > 19 20 O 0.39074863403944 0.42866467354011 0.68544155891883 15.999 > 19 21 O 0.39074863403944 0.57133532645989 0.43544155891883 15.999 > 21 22 O 0.39074863403944 0.57133532645989 0.93544155891883 15.999 > 21 23 O 0.60925136596056 0.57133532645989 0.31455844108117 15.999 > 23 24 O 0.60925136596056 0.57133532645989 0.81455844108117 15.999 > 23 25 O 0.35073343198100 0.01554431212665 0.23673037040169 15.999 > 1 26 O 0.35073343198100 0.01554431212665 0.73673037040169 15.999 > 1 27 O 0.64926656801900 0.01554431212665 0.01326962959831 15.999 > 3 28 O 0.64926656801900 0.01554431212665 0.51326962959831 15.999 > 3 29 O 0.64926656801900 0.98445568787335 0.26326962959831 15.999 > 5 30 O 0.64926656801900 0.98445568787335 0.76326962959831 15.999 > 5 31 O 0.35073343198100 0.98445568787335 0.48673037040169 15.999 > 7 32 O 0.35073343198100 0.98445568787335 0.98673037040169 15.999 > 7 33 O 0.34687715418839 0.25602171419276 0.39071929626170 15.999 > 9 34 O 0.34687715418839 0.25602171419276 0.89071929626170 15.999 > 9 35 O 0.65312284581161 0.25602171419276 0.35928070373830 15.999 > 11 36 O 0.65312284581161 0.25602171419276 0.85928070373830 15.999 > 11 37 O 0.65312284581161 0.74397828580724 0.10928070373830 15.999 > 13 38 O 0.65312284581161 0.74397828580724 0.60928070373830 15.999 > 13 39 O 0.34687715418839 0.74397828580724 0.14071929626170 15.999 > 15 40 O 0.34687715418839 0.74397828580724 0.64071929626170 15.999 > 15 41 O 0.10925136596056 0.92866467354011 0.06455844108117 15.999 > 17 42 O 0.10925136596056 0.92866467354011 0.56455844108117 15.999 > 17 43 O 0.89074863403944 0.92866467354011 0.18544155891883 15.999 > 19 44 O 0.89074863403944 0.92866467354011 0.68544155891883 15.999 > 19 45 O 0.89074863403944 0.07133532645990 0.43544155891883 15.999 > 21 46 O 0.89074863403944 0.07133532645990 0.93544155891883 15.999 > 21 47 O 0.10925136596056 0.07133532645990 0.31455844108117 15.999 > 23 48 O 0.10925136596056 0.07133532645990 0.81455844108117 15.999 > 23 49 K 0.00000000000000 0.68843526635711 0.12500000000000 39.098 > 49 50 K 0.00000000000000 0.68843526635711 0.62500000000000 39.098 > 49 51 K 0.00000000000000 0.31156473364289 0.37500000000000 39.098 > 51 52 K 0.00000000000000 0.31156473364289 0.87500000000000 39.098 > 51 53 K 0.50000000000000 0.18843526635711 0.12500000000000 39.098 > 49 54 K 0.50000000000000 0.18843526635711 0.62500000000000 39.098 > 49 55 K 0.50000000000000 0.81156473364289 0.37500000000000 39.098 > 51 56 K 0.50000000000000 0.81156473364289 0.87500000000000 39.098 > 51 57 Ge 0.21588674876202 0.58960442972544 0.39734863943390 72.640 > 57 58 Ge 0.21588674876202 0.58960442972544 0.89734863943390 72.640 > 57 59 Ge 0.78411325123798 0.41039557027456 0.10265136056610 72.640 > 59 60 Ge 0.78411325123798 0.41039557027456 0.60265136056610 72.640 > 59 61 Ge 0.78411325123798 0.58960442972544 0.35265136056610 72.640 > 61 62 Ge 0.78411325123798 0.58960442972544 0.85265136056610 72.640 > 61 63 Ge 0.21588674876202 0.41039557027456 0.14734863943390 72.640 > 63 64 Ge 0.21588674876202 0.41039557027456 0.64734863943390 72.640 > 63 65 Ge 0.71588674876202 0.08960442972544 0.39734863943390 72.640 > 57 66 Ge 0.71588674876202 0.08960442972544 0.89734863943390 72.640 > 57 67 Ge 0.28411325123798 0.91039557027456 0.10265136056610 72.640 > 59 68 Ge 0.28411325123798 0.91039557027456 0.60265136056610 72.640 > 59 69 Ge 0.28411325123798 0.08960442972544 0.35265136056610 72.640 > 61 70 Ge 0.28411325123798 0.08960442972544 0.85265136056610 72.640 > 61 71 Ge 0.71588674876202 0.91039557027456 0.14734863943390 72.640 > 63 72 Ge 0.71588674876202 0.91039557027456 0.64734863943390 72.640 > 63 73 In 0.00000000000000 0.10341004291707 0.12500000000000 114.818 > 73 74 In 0.00000000000000 0.10341004291707 0.62500000000000 114.818 > 73 75 In 0.00000000000000 0.89658995708293 0.37500000000000 114.818 > 75 76 In 0.00000000000000 0.89658995708293 0.87500000000000 114.818 > 75 77 In 0.50000000000000 0.60341004291707 0.12500000000000 114.818 > 73 78 In 0.50000000000000 0.60341004291707 0.62500000000000 114.818 > 73 79 In 0.50000000000000 0.39658995708293 0.37500000000000 114.818 > 75 80 In 0.50000000000000 0.39658995708293 0.87500000000000 114.818 > 75 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.5202881 0.0000000 0.0547029 0.0000000 3.6096902 0.0000000 0.0546864 0.0000000 3.5591719 -------------------------- Born effective charges -------------------------- 1 O -1.4318492 0.2371408 0.3196497 0.2197136 -1.7253167 -0.7644584 0.2789340 -0.8247465 -2.5473787 2 O -1.4318492 -0.2371408 0.3196497 -0.2197136 -1.7253167 0.7644584 0.2789340 0.8247465 -2.5473787 3 O -1.4318492 0.2371408 0.3196497 0.2197136 -1.7253167 -0.7644584 0.2789340 -0.8247465 -2.5473787 4 O -1.4318492 -0.2371408 0.3196497 -0.2197136 -1.7253167 0.7644584 0.2789340 0.8247465 -2.5473787 5 O -1.7126830 -0.8046942 -0.1495000 -0.6570434 -2.4186866 -0.1021729 -0.1191312 -0.0958375 -1.4311351 6 O -1.7126830 0.8046942 -0.1495000 0.6570434 -2.4186866 0.1021729 -0.1191312 0.0958375 -1.4311351 7 O -1.7126830 -0.8046942 -0.1495000 -0.6570434 -2.4186866 -0.1021729 -0.1191312 -0.0958375 -1.4311351 8 O -1.7126830 0.8046942 -0.1495000 0.6570434 -2.4186866 0.1021729 -0.1191312 0.0958375 -1.4311351 9 O -2.3443650 0.4236687 -0.2597050 0.2678942 -1.6307083 -0.2491680 -0.2449183 -0.2174987 -1.8471723 10 O -2.3443650 -0.4236687 -0.2597050 -0.2678942 -1.6307083 0.2491680 -0.2449183 0.2174987 -1.8471723 11 O -2.3443650 0.4236687 -0.2597050 0.2678942 -1.6307083 -0.2491680 -0.2449183 -0.2174987 -1.8471723 12 O -2.3443650 -0.4236687 -0.2597050 -0.2678942 -1.6307083 0.2491680 -0.2449183 0.2174987 -1.8471723 13 K 1.2298545 0.0000000 0.0151400 0.0000000 1.1828993 0.0000000 0.0303746 0.0000000 1.1851350 14 K 1.2298545 0.0000000 0.0151400 0.0000000 1.1828993 0.0000000 0.0303746 0.0000000 1.1851350 15 Ge 3.0848467 -0.6429280 -0.0064766 0.0027186 3.4134344 -0.0404525 0.0045860 0.1136593 3.6598882 16 Ge 3.0848467 -0.6429280 -0.0064766 0.0027186 3.4134344 -0.0404525 0.0045860 0.1136593 3.6598882 17 Ge 3.0848467 0.6429280 -0.0064766 -0.0027186 3.4134344 0.0404525 0.0045860 -0.1136593 3.6598882 18 Ge 3.0848467 0.6429280 -0.0064766 -0.0027186 3.4134344 0.0404525 0.0045860 -0.1136593 3.6598882 19 In 3.5782467 0.0000000 0.1769237 0.0000000 3.5396549 0.0000000 0.1306843 0.0000000 3.1464609 20 In 3.5782467 0.0000000 0.1769237 0.0000000 3.5396549 0.0000000 0.1306843 0.0000000 3.1464609 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Computing fc3[ 9, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Computing fc3[ 57, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000016 (xyx) 0.00000016 (xyx) 0.00000016 (xxy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000006 (xz) -0.00000006 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 22:59:38]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 22:59:38]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.200640545675877 -4.770662255000000 0.000000000000000 b 5.200640545675877 4.770662255000000 0.000000000000000 c -1.467412745855653 0.000000000000000 5.454371573003499 Atomic positions (fractional): 1 O 0.33518911985435 0.36627774410766 0.47346074080338 15.999 2 O 0.63372225589234 0.66481088014565 0.02653925919662 15.999 3 O 0.66481088014565 0.63372225589234 0.52653925919662 15.999 4 O 0.36627774410766 0.33518911985435 0.97346074080338 15.999 5 O 0.09085543999564 0.60289886838115 0.78143859252340 15.999 6 O 0.39710113161885 0.90914456000437 0.71856140747660 15.999 7 O 0.90914456000437 0.39710113161885 0.21856140747659 15.999 8 O 0.60289886838115 0.09085543999563 0.28143859252340 15.999 9 O 0.18058669242045 0.03791603950066 0.12911688216233 15.999 10 O 0.96208396049934 0.81941330757955 0.37088311783767 15.999 11 O 0.81941330757955 0.96208396049934 0.87088311783767 15.999 12 O 0.03791603950066 0.18058669242045 0.62911688216233 15.999 13 K 0.31156473364289 0.68843526635711 0.25000000000000 39.098 14 K 0.68843526635711 0.31156473364289 0.75000000000000 39.098 15 Ge 0.62628231903659 0.80549117848746 0.79469727886780 72.640 16 Ge 0.37371768096341 0.19450882151254 0.20530272113220 72.640 17 Ge 0.19450882151254 0.37371768096341 0.70530272113220 72.640 18 Ge 0.80549117848746 0.62628231903659 0.29469727886780 72.640 19 In 0.89658995708293 0.10341004291707 0.25000000000000 114.818 20 In 0.10341004291707 0.89658995708293 0.75000000000000 114.818 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.401281091351754 0.000000000000000 0.000000000000000 b 0.000000000000000 9.541324510000001 0.000000000000000 c -2.934825491711306 0.000000000000000 10.908743146006998 Atomic positions (fractional): 1 O 0.85073343198100 0.51554431212665 0.23673037040169 15.999 > 1 2 O 0.85073343198100 0.51554431212665 0.73673037040169 15.999 > 1 3 O 0.14926656801900 0.51554431212665 0.01326962959831 15.999 > 3 4 O 0.14926656801900 0.51554431212665 0.51326962959831 15.999 > 3 5 O 0.14926656801900 0.48445568787335 0.26326962959831 15.999 > 5 6 O 0.14926656801900 0.48445568787335 0.76326962959831 15.999 > 5 7 O 0.85073343198100 0.48445568787335 0.48673037040169 15.999 > 7 8 O 0.85073343198100 0.48445568787335 0.98673037040169 15.999 > 7 9 O 0.84687715418839 0.75602171419276 0.39071929626170 15.999 > 9 10 O 0.84687715418839 0.75602171419276 0.89071929626170 15.999 > 9 11 O 0.15312284581161 0.75602171419276 0.35928070373830 15.999 > 11 12 O 0.15312284581161 0.75602171419276 0.85928070373830 15.999 > 11 13 O 0.15312284581161 0.24397828580724 0.10928070373830 15.999 > 13 14 O 0.15312284581161 0.24397828580724 0.60928070373830 15.999 > 13 15 O 0.84687715418839 0.24397828580724 0.14071929626170 15.999 > 15 16 O 0.84687715418839 0.24397828580724 0.64071929626170 15.999 > 15 17 O 0.60925136596056 0.42866467354011 0.06455844108117 15.999 > 17 18 O 0.60925136596056 0.42866467354011 0.56455844108117 15.999 > 17 19 O 0.39074863403944 0.42866467354011 0.18544155891883 15.999 > 19 20 O 0.39074863403944 0.42866467354011 0.68544155891883 15.999 > 19 21 O 0.39074863403944 0.57133532645989 0.43544155891883 15.999 > 21 22 O 0.39074863403944 0.57133532645989 0.93544155891883 15.999 > 21 23 O 0.60925136596056 0.57133532645989 0.31455844108117 15.999 > 23 24 O 0.60925136596056 0.57133532645989 0.81455844108117 15.999 > 23 25 O 0.35073343198100 0.01554431212665 0.23673037040169 15.999 > 1 26 O 0.35073343198100 0.01554431212665 0.73673037040169 15.999 > 1 27 O 0.64926656801900 0.01554431212665 0.01326962959831 15.999 > 3 28 O 0.64926656801900 0.01554431212665 0.51326962959831 15.999 > 3 29 O 0.64926656801900 0.98445568787335 0.26326962959831 15.999 > 5 30 O 0.64926656801900 0.98445568787335 0.76326962959831 15.999 > 5 31 O 0.35073343198100 0.98445568787335 0.48673037040169 15.999 > 7 32 O 0.35073343198100 0.98445568787335 0.98673037040169 15.999 > 7 33 O 0.34687715418839 0.25602171419276 0.39071929626170 15.999 > 9 34 O 0.34687715418839 0.25602171419276 0.89071929626170 15.999 > 9 35 O 0.65312284581161 0.25602171419276 0.35928070373830 15.999 > 11 36 O 0.65312284581161 0.25602171419276 0.85928070373830 15.999 > 11 37 O 0.65312284581161 0.74397828580724 0.10928070373830 15.999 > 13 38 O 0.65312284581161 0.74397828580724 0.60928070373830 15.999 > 13 39 O 0.34687715418839 0.74397828580724 0.14071929626170 15.999 > 15 40 O 0.34687715418839 0.74397828580724 0.64071929626170 15.999 > 15 41 O 0.10925136596056 0.92866467354011 0.06455844108117 15.999 > 17 42 O 0.10925136596056 0.92866467354011 0.56455844108117 15.999 > 17 43 O 0.89074863403944 0.92866467354011 0.18544155891883 15.999 > 19 44 O 0.89074863403944 0.92866467354011 0.68544155891883 15.999 > 19 45 O 0.89074863403944 0.07133532645990 0.43544155891883 15.999 > 21 46 O 0.89074863403944 0.07133532645990 0.93544155891883 15.999 > 21 47 O 0.10925136596056 0.07133532645990 0.31455844108117 15.999 > 23 48 O 0.10925136596056 0.07133532645990 0.81455844108117 15.999 > 23 49 K 0.00000000000000 0.68843526635711 0.12500000000000 39.098 > 49 50 K 0.00000000000000 0.68843526635711 0.62500000000000 39.098 > 49 51 K 0.00000000000000 0.31156473364289 0.37500000000000 39.098 > 51 52 K 0.00000000000000 0.31156473364289 0.87500000000000 39.098 > 51 53 K 0.50000000000000 0.18843526635711 0.12500000000000 39.098 > 49 54 K 0.50000000000000 0.18843526635711 0.62500000000000 39.098 > 49 55 K 0.50000000000000 0.81156473364289 0.37500000000000 39.098 > 51 56 K 0.50000000000000 0.81156473364289 0.87500000000000 39.098 > 51 57 Ge 0.21588674876202 0.58960442972544 0.39734863943390 72.640 > 57 58 Ge 0.21588674876202 0.58960442972544 0.89734863943390 72.640 > 57 59 Ge 0.78411325123798 0.41039557027456 0.10265136056610 72.640 > 59 60 Ge 0.78411325123798 0.41039557027456 0.60265136056610 72.640 > 59 61 Ge 0.78411325123798 0.58960442972544 0.35265136056610 72.640 > 61 62 Ge 0.78411325123798 0.58960442972544 0.85265136056610 72.640 > 61 63 Ge 0.21588674876202 0.41039557027456 0.14734863943390 72.640 > 63 64 Ge 0.21588674876202 0.41039557027456 0.64734863943390 72.640 > 63 65 Ge 0.71588674876202 0.08960442972544 0.39734863943390 72.640 > 57 66 Ge 0.71588674876202 0.08960442972544 0.89734863943390 72.640 > 57 67 Ge 0.28411325123798 0.91039557027456 0.10265136056610 72.640 > 59 68 Ge 0.28411325123798 0.91039557027456 0.60265136056610 72.640 > 59 69 Ge 0.28411325123798 0.08960442972544 0.35265136056610 72.640 > 61 70 Ge 0.28411325123798 0.08960442972544 0.85265136056610 72.640 > 61 71 Ge 0.71588674876202 0.91039557027456 0.14734863943390 72.640 > 63 72 Ge 0.71588674876202 0.91039557027456 0.64734863943390 72.640 > 63 73 In 0.00000000000000 0.10341004291707 0.12500000000000 114.818 > 73 74 In 0.00000000000000 0.10341004291707 0.62500000000000 114.818 > 73 75 In 0.00000000000000 0.89658995708293 0.37500000000000 114.818 > 75 76 In 0.00000000000000 0.89658995708293 0.87500000000000 114.818 > 75 77 In 0.50000000000000 0.60341004291707 0.12500000000000 114.818 > 73 78 In 0.50000000000000 0.60341004291707 0.62500000000000 114.818 > 73 79 In 0.50000000000000 0.39658995708293 0.37500000000000 114.818 > 75 80 In 0.50000000000000 0.39658995708293 0.87500000000000 114.818 > 75 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.5202881 0.0000000 0.0547029 0.0000000 3.6096902 0.0000000 0.0546864 0.0000000 3.5591719 -------------------------- Born effective charges -------------------------- 1 O -1.4318492 0.2371408 0.3196497 0.2197136 -1.7253167 -0.7644584 0.2789340 -0.8247465 -2.5473787 2 O -1.4318492 -0.2371408 0.3196497 -0.2197136 -1.7253167 0.7644584 0.2789340 0.8247465 -2.5473787 3 O -1.4318492 0.2371408 0.3196497 0.2197136 -1.7253167 -0.7644584 0.2789340 -0.8247465 -2.5473787 4 O -1.4318492 -0.2371408 0.3196497 -0.2197136 -1.7253167 0.7644584 0.2789340 0.8247465 -2.5473787 5 O -1.7126830 -0.8046942 -0.1495000 -0.6570434 -2.4186866 -0.1021729 -0.1191312 -0.0958375 -1.4311351 6 O -1.7126830 0.8046942 -0.1495000 0.6570434 -2.4186866 0.1021729 -0.1191312 0.0958375 -1.4311351 7 O -1.7126830 -0.8046942 -0.1495000 -0.6570434 -2.4186866 -0.1021729 -0.1191312 -0.0958375 -1.4311351 8 O -1.7126830 0.8046942 -0.1495000 0.6570434 -2.4186866 0.1021729 -0.1191312 0.0958375 -1.4311351 9 O -2.3443650 0.4236687 -0.2597050 0.2678942 -1.6307083 -0.2491680 -0.2449183 -0.2174987 -1.8471723 10 O -2.3443650 -0.4236687 -0.2597050 -0.2678942 -1.6307083 0.2491680 -0.2449183 0.2174987 -1.8471723 11 O -2.3443650 0.4236687 -0.2597050 0.2678942 -1.6307083 -0.2491680 -0.2449183 -0.2174987 -1.8471723 12 O -2.3443650 -0.4236687 -0.2597050 -0.2678942 -1.6307083 0.2491680 -0.2449183 0.2174987 -1.8471723 13 K 1.2298545 0.0000000 0.0151400 0.0000000 1.1828993 0.0000000 0.0303746 0.0000000 1.1851350 14 K 1.2298545 0.0000000 0.0151400 0.0000000 1.1828993 0.0000000 0.0303746 0.0000000 1.1851350 15 Ge 3.0848467 -0.6429280 -0.0064766 0.0027186 3.4134344 -0.0404525 0.0045860 0.1136593 3.6598882 16 Ge 3.0848467 -0.6429280 -0.0064766 0.0027186 3.4134344 -0.0404525 0.0045860 0.1136593 3.6598882 17 Ge 3.0848467 0.6429280 -0.0064766 -0.0027186 3.4134344 0.0404525 0.0045860 -0.1136593 3.6598882 18 Ge 3.0848467 0.6429280 -0.0064766 -0.0027186 3.4134344 0.0404525 0.0045860 -0.1136593 3.6598882 19 In 3.5782467 0.0000000 0.1769237 0.0000000 3.5396549 0.0000000 0.1306843 0.0000000 3.1464609 20 In 3.5782467 0.0000000 0.1769237 0.0000000 3.5396549 0.0000000 0.1306843 0.0000000 3.1464609 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000016 (xyx) 0.00000016 (xyx) 0.00000016 (xxy) 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 ... [ 7 7 9 ] 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: 0.64, Number of G-points: 305, Lambda: 0.13 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/128) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 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 2.097 ( 0.000 0.000 0.000) 0.000 2.597 ( 0.000 0.000 0.000) 0.000 2.855 ( 0.000 0.000 0.000) 0.000 3.412 ( 0.000 0.000 0.000) 0.000 3.540 ( 0.000 0.000 0.000) 0.000 3.641 ( 0.000 0.000 0.000) 0.000 3.909 ( 0.000 0.000 0.000) 0.000 3.986 ( 0.000 0.000 0.000) 0.000 4.017 ( 0.000 0.000 0.000) 0.000 4.595 ( 0.000 0.000 0.000) 0.000 4.677 ( 0.000 0.000 0.000) 0.000 5.055 ( 0.000 0.000 0.000) 0.000 5.189 ( 0.000 0.000 0.000) 0.000 5.333 ( 0.000 0.000 0.000) 0.000 5.744 ( 0.000 0.000 0.000) 0.000 5.908 ( 0.000 0.000 0.000) 0.000 5.924 ( 0.000 0.000 0.000) 0.000 6.364 ( 0.000 0.000 0.000) 0.000 6.723 ( 0.000 0.000 0.000) 0.000 6.790 ( 0.000 0.000 0.000) 0.000 6.948 ( 0.000 0.000 0.000) 0.000 7.069 ( 0.000 0.000 0.000) 0.000 7.401 ( 0.000 0.000 0.000) 0.000 7.419 ( 0.000 0.000 0.000) 0.000 7.642 ( 0.000 0.000 0.000) 0.000 8.213 ( 0.000 0.000 0.000) 0.000 8.496 ( 0.000 0.000 0.000) 0.000 8.566 ( 0.000 0.000 0.000) 0.000 8.846 ( 0.000 0.000 0.000) 0.000 8.887 ( 0.000 0.000 0.000) 0.000 9.198 ( 0.000 0.000 0.000) 0.000 9.596 ( 0.000 0.000 0.000) 0.000 10.233 ( 0.000 0.000 0.000) 0.000 10.241 ( 0.000 0.000 0.000) 0.000 10.422 ( 0.000 0.000 0.000) 0.000 10.465 ( 0.000 0.000 0.000) 0.000 11.500 ( 0.000 0.000 0.000) 0.000 12.302 ( 0.000 0.000 0.000) 0.000 12.853 ( 0.000 0.000 0.000) 0.000 13.419 ( 0.000 0.000 0.000) 0.000 13.940 ( 0.000 0.000 0.000) 0.000 14.066 ( 0.000 0.000 0.000) 0.000 14.143 ( 0.000 0.000 0.000) 0.000 14.553 ( 0.000 0.000 0.000) 0.000 14.795 ( 0.000 0.000 0.000) 0.000 20.095 ( 0.000 0.000 0.000) 0.000 20.478 ( 0.000 0.000 0.000) 0.000 21.250 ( 0.000 0.000 0.000) 0.000 21.621 ( 0.000 0.000 0.000) 0.000 21.649 ( 0.000 0.000 0.000) 0.000 22.518 ( 0.000 0.000 0.000) 0.000 22.740 ( 0.000 0.000 0.000) 0.000 23.421 ( 0.000 0.000 0.000) 0.000 23.947 ( 0.000 0.000 0.000) 0.000 24.249 ( 0.000 0.000 0.000) 0.000 25.107 ( 0.000 0.000 0.000) 0.000 25.157 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/128) ======================= q-point: ( 0.14 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.554 ( 15.876 -19.881 12.987) 28.565 0.620 ( 20.065 -18.881 14.743) 31.248 1.208 ( 35.587 -43.128 6.797) 56.326 2.163 ( 4.820 -3.031 1.756) 5.958 2.587 ( -0.922 -2.037 -4.691) 5.196 2.852 ( -4.130 -2.841 -8.687) 10.030 3.350 ( -4.948 -1.249 -8.269) 9.717 3.597 ( 5.587 6.158 6.455) 10.527 3.808 ( -0.037 -3.548 3.903) 5.275 3.890 ( 1.511 -4.365 0.627) 4.662 3.987 ( -0.296 0.411 2.780) 2.826 4.125 ( 5.401 -6.303 -0.844) 8.343 4.629 ( -1.423 -6.463 -6.329) 9.157 4.729 ( -0.961 -7.720 2.640) 8.215 5.078 ( 3.505 3.878 -1.024) 5.327 5.187 ( 2.862 1.890 -3.606) 4.977 5.371 ( -0.724 -4.450 4.770) 6.564 5.802 ( 0.849 4.657 9.283) 10.420 5.929 ( 0.989 -0.600 -0.883) 1.455 6.072 ( 0.637 10.021 -6.543) 11.985 6.454 ( 14.462 14.290 -0.756) 20.345 6.693 ( -3.076 8.741 0.020) 9.267 6.747 ( -5.082 -4.806 5.063) 8.635 6.849 ( -1.458 10.871 2.459) 11.241 7.088 ( 3.734 -0.166 -4.433) 5.799 7.463 ( -0.345 -4.756 -1.297) 4.942 7.559 ( 0.624 9.656 22.158) 24.178 7.605 ( -1.738 3.540 0.554) 3.982 8.239 ( 0.579 -0.982 -0.210) 1.159 8.436 ( -6.501 -0.887 -0.171) 6.563 8.571 ( -2.237 -3.107 -1.729) 4.201 8.913 ( 4.168 2.194 3.578) 5.915 9.088 ( -9.633 0.062 9.546) 13.562 9.234 ( 0.911 0.243 -2.023) 2.232 9.518 ( -1.309 6.707 -2.943) 7.441 10.191 ( -5.998 7.722 0.156) 9.779 10.273 ( 0.278 -3.506 -5.415) 6.457 10.475 ( -0.857 -4.010 -1.701) 4.440 11.112 ( -33.325 -35.761 -19.925) 52.786 11.575 ( 3.890 -3.737 2.996) 6.170 12.310 ( 0.223 -0.382 1.647) 1.706 12.894 ( -0.547 2.488 12.008) 12.275 13.495 ( -5.122 -6.088 0.367) 7.965 14.036 ( -0.676 2.936 0.393) 3.038 14.131 ( -1.231 -0.045 -1.055) 1.622 14.189 ( 15.459 12.324 -6.409) 20.783 14.794 ( -4.460 -3.461 0.577) 5.674 15.074 ( -11.194 -14.855 -10.306) 21.265 20.093 ( -0.617 -0.065 -0.090) 0.626 21.268 ( 18.545 18.765 13.433) 29.605 21.283 ( 28.837 32.454 28.826) 52.113 21.624 ( -0.115 -0.113 1.488) 1.497 21.673 ( 12.499 5.471 -24.921) 28.411 22.531 ( -0.658 -2.120 0.526) 2.281 22.733 ( -1.001 -0.375 -0.900) 1.397 23.792 ( -10.443 -0.364 -4.396) 11.336 24.270 ( 1.439 -1.135 -0.876) 2.031 25.073 ( -2.324 -4.862 -0.066) 5.390 25.160 ( -1.064 -0.784 2.014) 2.409 25.384 ( -29.140 -28.502 -7.059) 41.369 ======================= Grid point 2 (3/128) ======================= q-point: ( 0.29 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.114 ( 13.856 -20.745 11.171) 27.333 1.218 ( 21.477 -15.526 13.129) 29.576 2.183 ( 14.093 -21.921 -3.392) 26.280 2.295 ( 4.096 -9.109 6.115) 11.711 2.607 ( 2.415 -0.023 -6.505) 6.939 2.823 ( 2.786 -10.939 -9.902) 15.015 3.304 ( -4.186 -2.515 -3.673) 6.110 3.429 ( -1.834 13.993 6.488) 15.533 3.936 ( 3.328 0.501 -0.682) 3.434 4.030 ( 0.217 -4.283 3.646) 5.629 4.049 ( 8.758 -7.347 3.493) 11.954 4.307 ( 5.599 -6.997 -0.513) 8.976 4.673 ( -3.090 -6.785 -9.818) 12.327 4.886 ( 0.742 -8.983 5.329) 10.471 5.063 ( 3.831 4.731 2.133) 6.451 5.183 ( 1.189 -0.691 -6.074) 6.227 5.454 ( -3.907 -5.919 9.347) 11.733 5.720 ( -2.795 8.214 1.926) 8.887 5.856 ( 5.505 12.955 -9.480) 16.971 5.992 ( -1.502 -3.821 3.587) 5.452 6.480 ( 0.511 6.509 0.178) 6.532 6.513 ( 6.168 5.495 -0.515) 8.277 6.650 ( -2.335 10.964 0.395) 11.217 6.729 ( -8.740 -2.644 5.859) 10.849 7.122 ( 0.741 0.543 -4.010) 4.114 7.393 ( -1.489 8.076 0.628) 8.236 7.507 ( -1.703 4.916 0.129) 5.204 7.581 ( -0.279 -1.543 6.212) 6.407 8.183 ( -5.156 2.071 -1.437) 5.739 8.442 ( -0.784 -4.978 0.731) 5.092 8.578 ( -3.521 -4.181 -2.964) 6.218 8.885 ( 1.483 7.270 5.799) 9.417 9.068 ( -3.013 -2.472 1.355) 4.126 9.181 ( -1.033 2.786 1.236) 3.218 9.422 ( 1.405 2.770 -4.124) 5.163 9.945 ( -7.689 11.009 -1.683) 13.533 10.319 ( -2.003 -5.028 -2.189) 5.838 10.503 ( 0.166 -1.889 -2.025) 2.774 11.138 ( -11.185 -14.611 -7.010) 19.691 11.690 ( 3.961 -1.914 3.706) 5.752 12.329 ( 0.266 -0.670 1.974) 2.102 12.891 ( 0.180 1.556 4.296) 4.573 13.523 ( -1.247 -3.243 -0.325) 3.490 13.981 ( -1.211 2.350 0.426) 2.678 14.107 ( -1.124 0.441 -0.987) 1.560 14.192 ( 5.240 3.514 -4.631) 7.826 14.775 ( -5.380 -2.725 0.956) 6.106 15.116 ( -0.158 -3.884 -2.474) 4.608 20.084 ( -0.536 0.014 -0.012) 0.536 21.274 ( 18.296 20.433 14.983) 31.253 21.327 ( 0.768 -2.250 2.140) 3.199 21.632 ( -0.427 -0.284 3.191) 3.232 21.668 ( 5.472 2.361 -12.750) 14.074 22.561 ( -0.755 -2.566 0.856) 2.808 22.723 ( -1.311 -1.171 -1.290) 2.180 23.611 ( -6.483 5.904 -2.340) 9.075 24.302 ( 1.511 -0.662 -0.760) 1.816 25.125 ( 0.156 -3.128 -0.502) 3.172 25.170 ( -0.418 -1.487 3.475) 3.803 25.374 ( -10.980 -9.521 -4.483) 15.209 ======================= Grid point 3 (4/128) ======================= q-point: ( 0.43 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.602 ( 9.683 -15.552 7.721) 19.881 1.729 ( 15.834 -9.117 8.799) 20.280 2.121 ( -6.679 9.746 -2.765) 12.134 2.388 ( -9.779 -2.464 -10.723) 14.720 2.624 ( 2.203 -1.153 -1.933) 3.149 3.207 ( 0.957 -4.768 -0.041) 4.863 3.244 ( 2.706 3.009 -0.881) 4.141 3.471 ( 13.170 -16.310 8.836) 22.749 3.893 ( -2.962 7.687 -4.006) 9.160 4.067 ( -0.760 -0.987 1.758) 2.155 4.236 ( 2.655 -2.934 -0.099) 3.958 4.484 ( 6.074 -6.474 2.131) 9.129 4.644 ( -5.123 0.357 -6.479) 8.267 4.997 ( 2.582 1.371 6.399) 7.035 5.019 ( -0.608 1.326 -2.110) 2.565 5.209 ( -1.053 -2.567 -3.943) 4.822 5.530 ( -1.983 2.905 3.461) 4.935 5.550 ( -5.564 -6.975 5.709) 10.592 5.757 ( 7.678 10.623 -8.457) 15.599 6.074 ( 1.218 -4.636 3.232) 5.781 6.304 ( -2.570 7.539 -1.240) 8.061 6.530 ( 1.895 2.366 -2.568) 3.973 6.593 ( -3.174 2.349 7.924) 8.853 6.727 ( 5.025 -8.269 -5.238) 11.002 6.971 ( -9.602 8.592 2.568) 13.138 7.311 ( 0.793 3.094 -1.480) 3.521 7.469 ( 2.739 -0.255 -2.829) 3.946 7.580 ( -2.425 1.477 4.733) 5.519 8.099 ( -2.456 0.684 -0.764) 2.662 8.491 ( -0.717 -2.106 -0.130) 2.228 8.588 ( -0.673 -2.022 -1.071) 2.385 8.842 ( 0.975 3.033 2.551) 4.081 8.969 ( -3.516 2.515 -1.760) 4.668 9.280 ( 4.838 -4.910 4.517) 8.242 9.414 ( 0.505 -0.767 -3.555) 3.672 9.674 ( -6.300 9.048 -1.187) 11.089 10.345 ( -1.088 -2.002 -0.636) 2.365 10.523 ( 0.515 -0.598 -0.921) 1.213 11.171 ( -2.975 -4.528 -1.940) 5.755 11.756 ( 1.552 -0.371 1.646) 2.292 12.346 ( 0.122 -0.383 0.853) 0.943 12.886 ( 0.104 0.641 1.139) 1.311 13.548 ( -0.164 -1.172 -0.225) 1.204 13.946 ( -0.530 0.807 0.248) 0.997 14.086 ( -0.479 0.295 -0.427) 0.706 14.194 ( 1.389 0.745 -1.857) 2.436 14.748 ( -2.224 -0.764 0.549) 2.415 15.153 ( 0.657 -0.942 -0.458) 1.236 20.079 ( -0.206 -0.007 0.011) 0.206 21.275 ( 5.343 5.926 4.398) 9.111 21.368 ( 0.358 -1.080 0.740) 1.357 21.644 ( -1.118 -0.611 5.365) 5.514 21.658 ( 2.593 1.207 -8.250) 8.732 22.585 ( -0.268 -1.017 0.472) 1.153 22.725 ( -0.623 -1.060 -0.636) 1.384 23.464 ( -2.409 3.384 -0.884) 4.247 24.322 ( 0.626 -0.181 -0.274) 0.707 25.142 ( -0.409 -0.475 -0.022) 0.627 25.234 ( 2.493 -1.857 2.734) 4.140 25.332 ( -5.056 -1.912 -3.061) 6.212 ======================= Grid point 8 (5/128) ======================= q-point: ( 0.14 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.882 ( 27.951 0.000 12.503) 30.620 0.908 ( 29.906 0.000 9.102) 31.260 1.508 ( 43.490 0.000 17.950) 47.049 2.249 ( 8.119 0.000 3.722) 8.931 2.506 ( -0.697 -0.000 -10.389) 10.413 2.815 ( 2.849 0.000 -6.895) 7.460 3.202 ( -4.574 -0.000 -12.819) 13.611 3.739 ( -1.564 -0.000 -0.084) 1.566 3.872 ( 8.711 0.000 8.544) 12.202 3.883 ( 7.774 0.000 4.967) 9.225 3.992 ( -1.167 -0.000 4.876) 5.014 4.197 ( 9.433 0.000 -0.502) 9.446 4.521 ( -1.766 -0.000 -9.894) 10.050 4.662 ( -1.560 -0.000 4.843) 5.088 5.158 ( 4.885 0.000 -6.132) 7.840 5.244 ( 4.073 0.000 -2.156) 4.609 5.340 ( -1.671 -0.000 7.630) 7.810 5.783 ( -4.672 -0.000 2.431) 5.267 5.918 ( -2.107 -0.000 2.505) 3.273 6.157 ( -2.022 -0.000 -3.382) 3.940 6.650 ( -4.136 -0.000 -1.915) 4.558 6.659 ( -4.947 -0.000 5.777) 7.605 6.798 ( 4.665 0.000 -12.161) 13.025 6.859 ( -4.496 -0.000 -7.934) 9.119 7.101 ( 0.788 0.000 -3.094) 3.193 7.427 ( 3.372 0.000 1.193) 3.577 7.599 ( -3.624 -0.000 1.750) 4.025 7.774 ( -14.061 -0.000 36.530) 39.143 8.272 ( 3.700 0.000 1.053) 3.847 8.280 ( -12.722 -0.000 1.558) 12.817 8.501 ( -2.740 -0.000 -2.399) 3.642 8.866 ( -0.398 -0.000 4.758) 4.775 9.085 ( -3.006 -0.000 14.910) 15.210 9.282 ( 2.140 0.000 -4.948) 5.391 9.506 ( -4.588 -0.000 -6.743) 8.156 10.139 ( -7.800 -0.000 -1.109) 7.879 10.219 ( 0.409 0.000 -16.409) 16.414 10.418 ( 0.068 0.000 -6.453) 6.453 10.446 ( 1.355 0.000 -1.040) 1.709 11.691 ( 10.094 0.000 5.079) 11.300 12.357 ( 2.232 0.000 5.545) 5.977 12.923 ( -1.227 -0.000 4.420) 4.587 13.449 ( 1.382 0.000 2.756) 3.083 13.997 ( -4.759 -0.000 -2.070) 5.190 14.134 ( 1.014 0.000 0.001) 1.014 14.386 ( -7.952 -0.000 -8.229) 11.443 14.617 ( 3.032 0.000 1.890) 3.573 15.001 ( 8.798 0.000 -2.871) 9.255 20.084 ( -0.569 -0.000 0.093) 0.577 21.289 ( 1.839 0.000 2.403) 3.026 21.600 ( -6.726 -0.000 18.781) 19.949 21.627 ( -1.258 -0.000 4.686) 4.852 22.076 ( -12.807 -0.000 -26.008) 28.991 22.665 ( -4.528 -0.000 -0.656) 4.575 23.015 ( 12.985 0.000 -2.309) 13.189 23.455 ( 2.407 0.000 -1.828) 3.023 23.988 ( -11.669 -0.000 -1.884) 11.820 25.014 ( 13.452 0.000 7.639) 15.470 25.091 ( -0.584 -0.000 -1.745) 1.840 25.182 ( 1.320 0.000 1.426) 1.943 ======================= Grid point 9 (6/128) ======================= q-point: ( 0.29 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.284 ( 25.829 -2.539 9.241) 27.549 1.450 ( 27.644 -9.107 13.086) 31.912 2.080 ( 8.756 -9.581 -3.574) 13.462 2.366 ( 6.554 0.602 5.696) 8.704 2.620 ( 9.688 -2.276 -2.713) 10.314 2.833 ( 15.681 -1.422 -4.868) 16.481 3.202 ( 2.481 -5.929 -7.123) 9.594 3.565 ( -6.866 8.694 -1.027) 11.126 3.993 ( -0.820 -0.692 5.573) 5.675 4.026 ( 6.012 0.070 4.755) 7.666 4.097 ( 10.612 -4.105 4.306) 12.166 4.344 ( 7.925 -2.192 1.005) 8.284 4.503 ( -0.687 -5.025 -11.372) 12.452 4.759 ( 0.862 -10.585 6.747) 12.582 5.163 ( 3.019 3.051 -4.893) 6.509 5.243 ( 2.843 5.515 -4.941) 7.932 5.377 ( -2.919 -2.664 11.692) 12.341 5.699 ( -8.133 1.769 -1.033) 8.387 5.901 ( -3.340 -2.839 0.380) 4.400 6.085 ( 3.237 5.526 -0.850) 6.461 6.525 ( -5.833 5.055 -1.716) 7.907 6.619 ( -5.825 -0.801 3.104) 6.649 6.654 ( -2.036 8.410 -10.892) 13.911 6.779 ( 3.001 6.187 -3.893) 7.901 7.110 ( -2.200 -0.922 -0.678) 2.480 7.494 ( 1.382 3.025 0.805) 3.422 7.525 ( -3.893 3.827 2.240) 5.901 7.597 ( -7.158 4.451 13.504) 15.919 8.119 ( -8.267 1.196 4.049) 9.283 8.365 ( 1.490 -4.175 0.713) 4.490 8.494 ( 0.572 -2.866 -1.111) 3.127 8.942 ( -4.215 -5.966 4.723) 8.699 9.056 ( 1.559 6.253 7.681) 10.026 9.206 ( -2.162 3.978 -3.573) 5.768 9.409 ( -3.903 -0.159 -6.713) 7.767 9.952 ( -10.113 7.054 -1.499) 12.421 10.212 ( -0.051 -4.050 -6.452) 7.618 10.432 ( -1.077 -4.970 -3.855) 6.381 10.654 ( -3.118 -20.949 -4.895) 21.738 11.836 ( 9.541 2.392 5.835) 11.436 12.397 ( 2.785 2.280 7.192) 8.043 12.913 ( 0.012 0.737 -1.819) 1.963 13.497 ( 1.498 -1.553 3.314) 3.954 13.927 ( -4.632 -1.019 -3.232) 5.739 14.140 ( 1.276 1.922 0.796) 2.441 14.238 ( -4.222 1.968 -3.175) 5.638 14.689 ( 0.623 -2.601 1.920) 3.293 15.109 ( 5.334 -1.395 -2.021) 5.872 20.079 ( -0.327 -0.001 0.357) 0.484 21.328 ( 0.955 -0.372 2.860) 3.038 21.522 ( -13.160 4.368 23.947) 27.672 21.628 ( -0.653 -0.323 2.140) 2.260 21.764 ( -0.407 6.186 -30.812) 31.430 22.611 ( -3.154 -1.593 0.423) 3.559 22.891 ( 14.717 20.460 2.317) 25.309 23.576 ( -3.450 -0.677 -2.601) 4.373 24.007 ( -11.382 -19.147 -3.459) 22.541 25.091 ( -0.490 -1.944 -1.848) 2.726 25.203 ( 4.846 0.159 3.699) 6.098 25.252 ( 7.154 -2.772 2.007) 7.930 ======================= Grid point 10 (7/128) ======================= q-point: ( 0.43 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.710 ( 20.318 -5.812 7.278) 22.352 1.923 ( 13.607 2.512 7.279) 15.634 2.137 ( 1.104 -7.071 -5.030) 8.748 2.351 ( 5.423 13.139 -3.493) 14.637 2.596 ( -0.920 -2.363 -4.268) 4.964 3.207 ( 4.858 0.006 -0.005) 4.858 3.301 ( 2.008 0.966 -2.292) 3.197 3.531 ( 16.788 -9.444 8.241) 20.951 4.007 ( 1.229 9.226 -1.281) 9.395 4.029 ( -2.084 -0.579 4.112) 4.646 4.259 ( 4.099 -2.390 -3.111) 5.674 4.483 ( 4.391 -5.586 3.373) 7.865 4.555 ( 2.123 -2.087 -3.495) 4.591 4.989 ( 0.866 -12.190 8.292) 14.768 5.102 ( -2.549 8.501 -7.828) 11.834 5.130 ( 0.828 3.506 -3.486) 5.013 5.416 ( -4.077 -3.165 14.046) 14.964 5.537 ( -5.359 3.087 -0.682) 6.222 5.890 ( -3.481 -1.412 -3.018) 4.819 6.096 ( 6.585 4.349 -4.294) 8.984 6.361 ( -4.034 5.850 -3.845) 8.079 6.473 ( -7.019 -0.153 -7.784) 10.482 6.558 ( -2.915 -0.091 0.332) 2.935 6.806 ( 10.689 0.814 -2.940) 11.116 7.004 ( -6.886 6.909 5.243) 11.074 7.338 ( -6.295 4.864 2.160) 8.244 7.467 ( -1.094 -0.785 -2.113) 2.506 7.595 ( -0.500 2.213 5.334) 5.796 8.054 ( -3.179 -1.347 3.521) 4.932 8.440 ( 1.018 -3.959 1.020) 4.213 8.577 ( 3.951 -2.420 0.778) 4.698 8.867 ( -5.164 3.470 -2.331) 6.644 9.021 ( 1.605 5.075 4.590) 7.029 9.241 ( 1.438 -7.895 3.680) 8.829 9.357 ( -3.274 -1.955 -5.080) 6.352 9.686 ( -9.467 7.898 -1.742) 12.451 10.267 ( 0.230 -5.099 -3.526) 6.204 10.479 ( -1.201 -4.539 -3.118) 5.636 10.876 ( -4.423 -17.787 -4.573) 18.890 11.909 ( 7.050 6.016 5.327) 10.690 12.421 ( 3.151 3.536 7.399) 8.785 12.889 ( 0.014 0.706 -4.985) 5.035 13.551 ( 1.702 -0.843 3.414) 3.907 13.884 ( -3.371 -2.436 -4.019) 5.784 14.115 ( -0.680 1.636 1.699) 2.455 14.189 ( -1.180 0.051 -0.248) 1.207 14.737 ( 2.025 -1.211 1.295) 2.692 15.165 ( 2.403 0.121 -1.172) 2.676 20.079 ( 0.088 -0.009 0.480) 0.488 21.239 ( -14.296 3.071 4.392) 15.268 21.409 ( -0.731 0.676 2.751) 2.925 21.633 ( -0.621 -0.560 1.450) 1.674 21.666 ( 1.635 0.949 -11.988) 12.136 22.635 ( -1.038 -4.560 1.331) 4.863 22.832 ( 11.454 13.542 1.937) 17.842 23.486 ( -1.719 3.842 -1.307) 4.408 24.097 ( -10.684 -14.111 -3.074) 17.964 25.111 ( -0.433 -2.375 -1.717) 2.962 25.251 ( 0.909 -0.483 1.247) 1.617 25.387 ( 10.168 1.765 2.887) 10.716 ======================= Grid point 11 (8/128) ======================= q-point: (-0.43 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.670 ( -12.607 13.611 -8.253) 20.305 1.905 ( 7.319 26.216 -3.271) 27.415 2.172 ( 11.136 -3.630 4.731) 12.632 2.551 ( 7.056 -3.968 4.713) 9.367 2.646 ( 9.681 -3.248 2.230) 10.452 3.134 ( -5.928 -1.182 -4.157) 7.336 3.307 ( 1.526 4.928 4.438) 6.806 3.616 ( -8.229 25.273 -5.775) 27.199 3.882 ( 4.147 -2.105 0.874) 4.732 4.062 ( 1.726 -1.166 3.645) 4.198 4.276 ( -1.570 2.772 -2.264) 3.908 4.543 ( 2.504 6.792 2.176) 7.559 4.647 ( 1.723 -7.428 3.611) 8.437 4.930 ( -3.978 2.369 -6.588) 8.052 5.093 ( 2.997 3.537 -0.397) 4.653 5.176 ( -0.487 -8.593 4.404) 9.668 5.426 ( -5.192 -3.280 4.473) 7.598 5.547 ( 0.061 -5.254 9.320) 10.699 5.791 ( 0.375 9.192 -8.220) 12.337 6.043 ( -3.717 -0.553 -7.333) 8.240 6.284 ( 2.512 0.467 -1.633) 3.032 6.387 ( -7.689 -3.808 -4.341) 9.616 6.583 ( 2.164 -0.983 -3.099) 3.905 6.856 ( 0.831 5.941 4.328) 7.397 7.003 ( 11.748 -5.944 -2.992) 13.502 7.236 ( -6.777 -1.480 4.112) 8.064 7.450 ( -2.468 0.805 1.864) 3.195 7.559 ( -0.664 0.006 -1.842) 1.958 8.098 ( 1.426 -3.949 3.338) 5.364 8.496 ( -0.308 -1.136 0.259) 1.205 8.662 ( 5.380 0.396 2.502) 5.947 8.787 ( -1.316 -0.589 -1.707) 2.234 9.020 ( 3.718 0.825 3.257) 5.011 9.239 ( -6.401 3.173 -4.881) 8.652 9.386 ( -4.226 -1.599 2.735) 5.281 9.591 ( 1.669 -9.652 -0.016) 9.796 10.339 ( 1.381 -4.176 -1.642) 4.695 10.501 ( -1.669 -2.009 -1.414) 2.970 11.040 ( -3.326 -13.723 -3.910) 14.652 11.893 ( 4.621 8.678 3.688) 10.501 12.432 ( 3.745 4.732 6.457) 8.838 12.860 ( -0.443 -0.208 -6.522) 6.541 13.589 ( 2.128 0.938 3.307) 4.043 13.877 ( -2.176 -3.760 -3.990) 5.898 14.100 ( -1.984 -0.594 2.926) 3.584 14.174 ( -0.250 1.093 1.216) 1.654 14.799 ( 4.237 -0.761 0.196) 4.309 15.173 ( 1.011 1.008 -0.081) 1.430 20.084 ( 0.381 -0.000 0.356) 0.522 20.995 ( -18.466 -0.754 -2.390) 18.635 21.399 ( 0.128 1.819 -0.206) 1.835 21.635 ( -0.214 -0.221 -1.250) 1.287 21.649 ( 0.226 0.031 -1.540) 1.557 22.701 ( 1.074 -2.295 1.994) 3.224 22.797 ( 8.103 10.132 1.105) 13.020 23.459 ( 1.977 -1.496 0.191) 2.487 24.122 ( -10.385 -10.393 -2.460) 14.897 25.136 ( 0.320 -1.720 -1.412) 2.248 25.244 ( -0.428 2.039 0.247) 2.098 25.517 ( 11.306 1.998 3.324) 11.953 ======================= Grid point 12 (9/128) ======================= q-point: (-0.29 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.197 ( -11.781 20.973 -6.781) 24.992 1.493 ( 3.585 32.700 -4.979) 33.271 2.306 ( 2.725 5.915 0.851) 6.568 2.509 ( -6.170 19.709 0.434) 20.656 2.673 ( -0.818 15.907 5.154) 16.741 3.041 ( 0.013 9.140 6.207) 11.048 3.213 ( 4.653 -12.086 -5.621) 14.118 3.379 ( -0.138 1.582 -1.198) 1.989 3.903 ( -0.360 -1.200 -1.117) 1.679 4.039 ( -3.710 5.992 2.872) 7.611 4.092 ( -4.710 9.997 -3.395) 11.560 4.441 ( 2.020 12.338 1.581) 12.602 4.763 ( 0.293 -2.975 2.703) 4.030 4.891 ( -1.586 -4.548 -2.985) 5.666 5.043 ( -0.039 7.413 1.960) 7.668 5.223 ( -0.771 2.977 0.002) 3.075 5.476 ( -2.935 -10.608 1.319) 11.085 5.610 ( -0.834 9.862 -4.226) 10.761 5.724 ( 2.855 -10.643 4.890) 12.056 6.027 ( 1.117 -1.808 -3.434) 4.039 6.326 ( -7.647 -2.512 -3.997) 8.987 6.371 ( 1.549 -8.436 -1.222) 8.663 6.585 ( 0.359 -0.818 1.890) 2.091 6.882 ( 9.862 2.794 -6.179) 11.968 7.097 ( -6.874 1.533 5.654) 9.031 7.313 ( 5.013 -9.552 1.655) 10.914 7.455 ( 0.367 -3.393 1.525) 3.738 7.549 ( -2.201 -1.670 -4.102) 4.945 8.210 ( 3.279 -3.871 2.642) 5.720 8.478 ( -1.284 0.596 -0.694) 1.577 8.697 ( 1.631 3.346 0.411) 3.745 8.822 ( 4.504 -0.098 1.509) 4.751 9.058 ( -5.475 -0.185 -2.800) 6.153 9.164 ( 5.697 -4.693 -0.344) 7.389 9.340 ( -5.652 -2.200 1.519) 6.253 9.840 ( 3.533 -14.059 1.093) 14.537 10.403 ( 2.872 0.573 -0.303) 2.944 10.492 ( -2.120 -1.709 0.368) 2.748 11.183 ( -0.680 -11.228 -1.908) 11.409 11.818 ( 3.122 9.069 1.915) 9.781 12.430 ( 4.273 5.789 4.650) 8.567 12.837 ( -1.061 -1.269 -6.315) 6.529 13.611 ( 3.401 2.163 2.172) 4.579 13.900 ( -2.163 -4.324 -2.356) 5.378 14.083 ( -4.403 -1.157 2.980) 5.441 14.163 ( 1.292 1.619 1.043) 2.319 14.853 ( 2.666 0.962 -0.699) 2.919 15.196 ( 3.597 -0.608 1.813) 4.074 20.092 ( 0.498 -0.090 0.158) 0.530 20.734 ( -19.881 -1.573 -5.629) 20.722 21.356 ( -0.362 3.128 -0.766) 3.241 21.629 ( 0.047 0.123 -1.033) 1.041 21.650 ( -0.399 -0.157 1.095) 1.176 22.721 ( 4.204 6.735 1.887) 8.161 22.757 ( 1.197 2.949 -0.043) 3.183 23.594 ( 5.251 -8.377 1.466) 9.995 24.118 ( -8.694 -8.213 -1.875) 12.106 25.157 ( 0.782 -0.446 -0.804) 1.207 25.194 ( -0.591 3.293 -0.080) 3.346 25.662 ( 11.004 0.864 3.138) 11.475 ======================= Grid point 13 (10/128) ======================= q-point: (-0.14 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.739 ( 0.000 24.622 0.000) 24.622 1.013 ( 0.000 33.762 0.000) 33.762 1.718 ( 0.000 53.910 0.000) 53.910 2.211 ( 0.000 7.654 0.000) 7.654 2.620 ( 0.000 1.752 0.000) 1.752 3.015 ( 0.000 6.560 0.000) 6.560 3.364 ( -0.000 -4.990 -0.000) 4.990 3.433 ( -0.000 -7.790 -0.000) 7.790 3.881 ( 0.000 6.406 0.000) 6.406 3.900 ( 0.000 3.177 0.000) 3.177 3.966 ( 0.000 0.071 0.000) 0.071 4.266 ( 0.000 12.284 0.000) 12.284 4.743 ( 0.000 5.389 0.000) 5.389 4.889 ( 0.000 11.497 0.000) 11.497 4.977 ( -0.000 -6.586 -0.000) 6.586 5.167 ( 0.000 1.910 0.000) 1.910 5.457 ( 0.000 7.741 0.000) 7.741 5.615 ( -0.000 -9.410 -0.000) 9.410 5.900 ( -0.000 -6.447 -0.000) 6.447 6.071 ( -0.000 -1.022 -0.000) 1.022 6.242 ( 0.000 0.016 0.000) 0.016 6.550 ( -0.000 -12.496 -0.000) 12.496 6.676 ( -0.000 -9.740 -0.000) 9.740 6.882 ( 0.000 7.297 0.000) 7.297 7.044 ( -0.000 -2.570 -0.000) 2.570 7.464 ( -0.000 -3.523 -0.000) 3.523 7.520 ( 0.000 1.492 0.000) 1.492 7.541 ( -0.000 -6.151 -0.000) 6.151 8.264 ( 0.000 0.992 0.000) 0.992 8.475 ( -0.000 -0.970 -0.000) 0.970 8.645 ( 0.000 4.194 0.000) 4.194 8.844 ( -0.000 -0.007 -0.000) 0.007 9.070 ( -0.000 -5.686 -0.000) 5.686 9.259 ( 0.000 1.233 0.000) 1.233 9.389 ( -0.000 -10.525 -0.000) 10.525 10.070 ( -0.000 -12.433 -0.000) 12.433 10.364 ( 0.000 5.747 0.000) 5.747 10.512 ( -0.000 -0.633 -0.000) 0.633 11.345 ( -0.000 -9.830 -0.000) 9.830 11.741 ( 0.000 5.359 0.000) 5.359 12.395 ( 0.000 5.276 0.000) 5.276 12.830 ( -0.000 -1.269 -0.000) 1.269 13.631 ( 0.000 1.092 0.000) 1.092 13.915 ( -0.000 -1.995 -0.000) 1.995 14.059 ( -0.000 -0.423 -0.000) 0.423 14.158 ( 0.000 1.087 0.000) 1.087 14.837 ( 0.000 2.303 0.000) 2.303 15.285 ( -0.000 -3.498 -0.000) 3.498 20.100 ( -0.000 -0.303 -0.000) 0.303 20.518 ( 0.000 2.724 0.000) 2.724 21.302 ( 0.000 3.095 0.000) 3.095 21.625 ( 0.000 0.207 0.000) 0.207 21.650 ( -0.000 -0.007 -0.000) 0.007 22.635 ( 0.000 7.559 0.000) 7.559 22.748 ( 0.000 0.463 0.000) 0.463 23.793 ( -0.000 -9.315 -0.000) 9.315 24.148 ( -0.000 -6.110 -0.000) 6.110 25.133 ( 0.000 3.537 0.000) 3.537 25.167 ( 0.000 0.171 0.000) 0.171 25.782 ( -0.000 -1.917 -0.000) 1.917 ======================= Grid point 16 (11/128) ======================= q-point: ( 0.29 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.695 ( 24.369 0.000 9.905) 26.305 1.733 ( 24.718 0.000 4.262) 25.083 2.060 ( -0.466 -0.000 -7.256) 7.271 2.422 ( 1.249 0.000 3.320) 3.547 2.855 ( 12.016 0.000 0.688) 12.035 3.131 ( 29.254 0.000 5.402) 29.749 3.186 ( 10.213 0.000 -7.247) 12.523 3.480 ( -10.489 -0.000 -5.542) 11.863 3.953 ( -4.623 -0.000 3.638) 5.883 4.152 ( 5.339 0.000 9.690) 11.064 4.262 ( 10.657 0.000 8.414) 13.578 4.418 ( 1.319 0.000 -13.271) 13.336 4.463 ( 9.534 0.000 1.185) 9.607 4.721 ( 3.664 0.000 6.228) 7.226 5.185 ( 0.729 0.000 -11.211) 11.235 5.307 ( 2.482 0.000 -4.764) 5.372 5.404 ( -0.256 -0.000 17.785) 17.787 5.572 ( -11.011 -0.000 -1.185) 11.075 5.813 ( -5.044 -0.000 -2.037) 5.440 6.137 ( 0.932 0.000 2.141) 2.335 6.461 ( -7.211 -0.000 -3.762) 8.133 6.537 ( -5.445 -0.000 -10.273) 11.626 6.602 ( -8.160 -0.000 -2.279) 8.472 6.861 ( 5.316 0.000 -11.310) 12.497 7.055 ( -3.378 -0.000 2.277) 4.074 7.452 ( -12.997 -0.000 4.797) 13.854 7.535 ( -8.541 -0.000 6.708) 10.860 7.599 ( 6.694 0.000 2.089) 7.013 8.060 ( -5.750 -0.000 10.596) 12.055 8.365 ( 1.884 0.000 0.870) 2.075 8.515 ( 5.750 0.000 0.588) 5.780 8.863 ( -2.763 -0.000 4.411) 5.205 9.147 ( 0.187 0.000 9.185) 9.187 9.185 ( -4.005 -0.000 -7.543) 8.540 9.288 ( -5.658 -0.000 -8.143) 9.915 9.855 ( -11.107 -0.000 -1.911) 11.270 10.172 ( 1.850 0.000 -5.958) 6.239 10.327 ( -3.332 -0.000 -3.946) 5.164 10.519 ( 3.643 0.000 -1.405) 3.904 12.008 ( 8.784 0.000 5.235) 10.225 12.486 ( 2.863 0.000 9.084) 9.524 12.905 ( 0.284 0.000 -6.426) 6.432 13.528 ( 1.933 0.000 5.639) 5.961 13.841 ( -3.953 -0.000 -4.730) 6.165 14.156 ( -6.156 -0.000 0.196) 6.159 14.181 ( 1.757 0.000 0.461) 1.816 14.709 ( 2.424 0.000 2.094) 3.203 15.167 ( 4.611 0.000 -2.170) 5.096 20.079 ( 0.038 0.000 0.710) 0.711 21.359 ( 1.501 0.000 2.421) 2.849 21.375 ( -20.849 -0.000 13.024) 24.582 21.625 ( -0.120 -0.000 0.221) 0.252 21.690 ( 0.848 0.000 -18.764) 18.783 22.531 ( -4.267 -0.000 -0.225) 4.273 23.296 ( 7.719 0.000 0.911) 7.773 23.495 ( 1.502 0.000 -2.920) 3.284 23.707 ( -7.500 -0.000 -1.198) 7.595 25.056 ( -0.750 -0.000 -2.336) 2.454 25.242 ( 1.867 0.000 1.990) 2.729 25.416 ( 11.726 0.000 3.679) 12.290 ======================= Grid point 17 (12/128) ======================= q-point: ( 0.43 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.946 ( 0.378 5.607 -7.016) 8.990 1.985 ( 12.553 -3.424 3.960) 13.601 2.219 ( 20.287 -10.495 6.857) 23.848 2.500 ( 4.710 -3.974 2.678) 6.719 2.773 ( 8.146 22.113 -3.716) 23.857 3.214 ( -11.503 3.171 -6.205) 13.449 3.357 ( 8.698 -0.688 0.102) 8.725 3.701 ( 24.252 -8.724 7.461) 26.831 3.944 ( -3.477 -6.128 0.893) 7.102 4.189 ( 1.889 6.204 8.270) 10.510 4.305 ( 2.886 7.177 -9.452) 12.214 4.464 ( 2.170 -4.239 6.528) 8.081 4.624 ( 9.189 -1.564 0.605) 9.340 4.863 ( 3.059 -5.893 5.308) 8.501 5.128 ( -1.142 0.834 -11.071) 11.161 5.214 ( -3.076 10.139 -1.684) 10.728 5.444 ( -2.774 1.330 9.967) 10.431 5.479 ( -1.211 -2.753 6.687) 7.333 5.756 ( -5.545 -2.692 -2.804) 6.772 6.168 ( 0.045 -0.718 -0.934) 1.179 6.317 ( -9.284 3.601 -11.024) 14.856 6.360 ( -4.243 0.800 -9.744) 10.658 6.533 ( -0.839 -0.722 0.530) 1.227 6.907 ( 5.384 -2.085 -8.620) 10.375 6.986 ( -5.772 2.851 4.092) 7.628 7.259 ( -14.167 0.112 5.969) 15.374 7.462 ( 0.147 3.411 0.323) 3.430 7.672 ( 3.066 2.579 2.772) 4.872 8.025 ( -3.154 0.268 8.069) 8.668 8.428 ( 3.623 -2.160 2.310) 4.809 8.624 ( 6.234 -1.838 0.917) 6.564 8.821 ( -5.221 1.342 -0.332) 5.401 9.136 ( 1.101 -0.920 -5.411) 5.598 9.145 ( -1.203 0.124 9.354) 9.432 9.242 ( -2.762 -4.035 -4.956) 6.962 9.641 ( -11.074 6.066 -2.439) 12.860 10.203 ( 1.719 -3.044 -3.985) 5.301 10.330 ( -3.634 -7.297 -3.129) 8.731 10.636 ( 1.564 -9.469 -1.592) 9.728 12.098 ( 5.969 4.055 3.965) 8.233 12.543 ( 2.885 2.095 9.548) 10.192 12.874 ( -0.041 0.666 -8.404) 8.431 13.584 ( 1.959 -0.772 6.361) 6.701 13.789 ( -2.734 -1.662 -5.828) 6.648 14.089 ( -3.930 -0.083 1.889) 4.361 14.200 ( 1.136 0.449 0.348) 1.270 14.757 ( 2.301 -1.262 1.551) 3.048 15.204 ( 2.460 0.791 -1.640) 3.060 20.084 ( 0.310 0.008 0.731) 0.794 21.092 ( -16.339 4.807 2.114) 17.162 21.400 ( 0.217 -1.603 1.731) 2.369 21.626 ( 0.055 -0.194 -0.247) 0.319 21.656 ( 0.769 0.265 -6.852) 6.900 22.525 ( -2.347 -5.570 0.378) 6.056 23.211 ( 7.220 15.347 0.970) 16.988 23.516 ( -0.295 2.176 -1.427) 2.618 23.745 ( -6.304 -13.394 -1.804) 14.913 25.058 ( -0.554 -2.404 -1.829) 3.071 25.272 ( 1.351 0.194 1.517) 2.041 25.561 ( 8.982 0.952 2.395) 9.344 ======================= Grid point 18 (13/128) ======================= q-point: (-0.43 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.722 ( -5.546 12.811 -4.992) 14.825 2.256 ( 9.084 -6.919 2.957) 11.795 2.446 ( 6.506 28.059 -1.068) 28.823 2.567 ( 5.018 -1.911 5.414) 7.625 2.741 ( 14.682 -9.237 -1.030) 17.376 3.005 ( -10.794 -0.016 -4.298) 11.618 3.406 ( 1.594 3.144 3.052) 4.662 3.888 ( -1.326 8.132 3.924) 9.126 3.944 ( -2.652 20.025 -6.736) 21.293 4.137 ( 9.392 -3.987 1.038) 10.256 4.283 ( 3.282 1.293 1.422) 3.803 4.530 ( -5.077 -5.913 3.365) 8.489 4.721 ( 5.473 3.038 3.849) 7.348 4.895 ( -1.822 4.904 -7.288) 8.971 5.080 ( -1.495 -3.762 8.206) 9.151 5.114 ( 0.369 -1.435 -6.821) 6.980 5.428 ( 0.227 2.096 6.081) 6.436 5.560 ( 2.730 0.878 10.622) 11.003 5.736 ( -4.444 -7.522 -3.583) 9.443 5.992 ( -5.722 7.229 -14.731) 17.378 6.223 ( -5.236 -3.398 -0.750) 6.287 6.339 ( 2.815 0.750 -3.668) 4.685 6.579 ( 0.930 -2.600 -0.415) 2.792 6.918 ( 0.934 0.422 0.233) 1.051 7.015 ( 4.401 -6.768 -3.292) 8.718 7.135 ( -8.371 -1.614 5.263) 10.019 7.435 ( 0.782 1.445 -1.153) 2.007 7.608 ( -1.177 7.447 2.187) 7.850 8.055 ( 0.021 -4.320 3.623) 5.638 8.494 ( 1.443 0.772 0.873) 1.855 8.697 ( -0.444 -1.754 -0.537) 1.888 8.792 ( 3.741 -2.121 1.803) 4.664 9.105 ( 1.810 3.792 1.498) 4.461 9.191 ( -1.501 -0.946 -2.544) 3.101 9.300 ( -3.292 -1.387 1.864) 4.029 9.443 ( -4.643 -5.925 -2.030) 7.796 10.277 ( 1.629 -5.194 -1.909) 5.769 10.391 ( -2.851 -7.176 -1.678) 7.902 10.800 ( -0.391 -11.851 -1.476) 11.949 12.081 ( 2.834 7.490 2.056) 8.268 12.574 ( 2.732 3.356 7.725) 8.855 12.828 ( -0.591 0.641 -7.369) 7.420 13.644 ( 2.146 -0.042 5.271) 5.692 13.774 ( -1.927 -3.598 -5.276) 6.670 14.059 ( -2.422 -0.498 1.868) 3.099 14.204 ( 0.691 0.893 0.406) 1.200 14.823 ( 2.270 -2.455 0.561) 3.390 15.203 ( 0.895 1.352 -0.572) 1.719 20.090 ( 0.288 0.020 0.385) 0.481 20.824 ( -10.709 5.832 -0.933) 12.230 21.417 ( -0.010 0.310 0.375) 0.487 21.628 ( 0.120 -0.138 -0.648) 0.674 21.645 ( 0.144 -0.049 -1.554) 1.561 22.621 ( -0.285 -8.085 0.681) 8.119 23.090 ( 4.988 13.152 0.934) 14.097 23.477 ( 0.735 1.415 -0.369) 1.637 23.833 ( -5.757 -10.488 -1.533) 12.062 25.093 ( -0.112 -3.261 -1.003) 3.414 25.275 ( 0.334 1.623 0.708) 1.802 25.661 ( 5.891 0.060 1.471) 6.073 ======================= Grid point 19 (14/128) ======================= q-point: (-0.29 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.419 ( 0.000 19.504 0.000) 19.504 2.017 ( 0.000 32.757 0.000) 32.757 2.390 ( -0.000 -0.420 -0.000) 0.420 2.621 ( 0.000 2.838 0.000) 2.838 2.947 ( -0.000 -7.535 -0.000) 7.535 2.961 ( 0.000 3.949 0.000) 3.949 3.365 ( 0.000 3.942 0.000) 3.942 3.417 ( 0.000 27.021 0.000) 27.021 3.882 ( -0.000 -0.052 -0.000) 0.052 4.176 ( 0.000 5.952 0.000) 5.952 4.177 ( 0.000 11.607 0.000) 11.607 4.642 ( -0.000 -10.848 -0.000) 10.848 4.676 ( 0.000 14.071 0.000) 14.071 4.813 ( -0.000 -3.910 -0.000) 3.910 5.115 ( 0.000 1.274 0.000) 1.274 5.194 ( -0.000 -7.283 -0.000) 7.283 5.398 ( 0.000 2.957 0.000) 2.957 5.620 ( -0.000 -5.698 -0.000) 5.698 5.744 ( 0.000 7.472 0.000) 7.472 5.919 ( -0.000 -9.280 -0.000) 9.280 6.227 ( -0.000 -2.760 -0.000) 2.760 6.329 ( 0.000 0.996 0.000) 0.996 6.600 ( 0.000 0.478 0.000) 0.478 6.956 ( -0.000 -2.125 -0.000) 2.125 7.085 ( 0.000 3.128 0.000) 3.128 7.201 ( -0.000 -11.738 -0.000) 11.738 7.428 ( -0.000 -0.802 -0.000) 0.802 7.511 ( 0.000 2.470 0.000) 2.470 8.155 ( -0.000 -6.647 -0.000) 6.647 8.472 ( 0.000 1.341 0.000) 1.341 8.720 ( -0.000 -0.752 -0.000) 0.752 8.903 ( -0.000 -5.084 -0.000) 5.084 9.014 ( 0.000 8.911 0.000) 8.911 9.167 ( -0.000 -0.370 -0.000) 0.370 9.255 ( -0.000 -2.231 -0.000) 2.231 9.639 ( -0.000 -15.604 -0.000) 15.604 10.380 ( -0.000 -6.464 -0.000) 6.464 10.439 ( -0.000 -2.295 -0.000) 2.295 10.977 ( -0.000 -13.071 -0.000) 13.071 11.978 ( 0.000 9.015 0.000) 9.015 12.555 ( 0.000 4.594 0.000) 4.594 12.802 ( -0.000 -0.226 -0.000) 0.226 13.664 ( 0.000 0.964 0.000) 0.964 13.812 ( -0.000 -4.517 -0.000) 4.517 14.049 ( -0.000 -0.257 -0.000) 0.257 14.195 ( 0.000 1.128 0.000) 1.128 14.872 ( -0.000 -1.093 -0.000) 1.093 15.202 ( -0.000 -0.709 -0.000) 0.709 20.094 ( -0.000 -0.090 -0.000) 0.090 20.647 ( 0.000 5.946 0.000) 5.946 21.396 ( 0.000 2.342 0.000) 2.342 21.629 ( 0.000 0.006 0.000) 0.006 21.646 ( -0.000 -0.201 -0.000) 0.201 22.720 ( -0.000 -4.241 -0.000) 4.241 22.940 ( 0.000 12.100 0.000) 12.100 23.517 ( -0.000 -5.741 -0.000) 5.741 23.922 ( -0.000 -8.574 -0.000) 8.574 25.136 ( -0.000 -2.499 -0.000) 2.499 25.241 ( 0.000 3.080 0.000) 3.080 25.722 ( -0.000 -1.574 -0.000) 1.574 ======================= Grid point 24 (15/128) ======================= q-point: ( 0.43 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.916 ( -1.730 -0.000 -3.904) 4.270 2.117 ( 2.709 0.000 -1.736) 3.217 2.421 ( 20.578 0.000 8.402) 22.227 2.604 ( 9.743 0.000 3.412) 10.323 3.002 ( -16.637 -0.000 -7.883) 18.410 3.069 ( 4.866 0.000 -0.883) 4.945 3.457 ( 5.965 0.000 0.760) 6.013 3.829 ( -2.643 -0.000 -1.182) 2.896 3.961 ( 17.412 0.000 4.015) 17.869 4.247 ( -1.567 -0.000 5.548) 5.765 4.387 ( 1.274 0.000 -7.746) 7.850 4.509 ( 3.093 0.000 10.297) 10.752 4.723 ( 7.140 0.000 0.590) 7.164 4.928 ( 4.736 0.000 2.885) 5.545 5.059 ( -4.191 -0.000 -2.853) 5.070 5.245 ( -6.556 -0.000 -8.185) 10.487 5.384 ( 3.901 0.000 2.143) 4.451 5.509 ( -1.739 -0.000 4.803) 5.108 5.726 ( 1.123 0.000 7.507) 7.591 6.128 ( -3.148 -0.000 1.533) 3.501 6.171 ( -8.909 -0.000 -16.602) 18.842 6.276 ( -2.657 -0.000 -4.182) 4.955 6.503 ( -1.118 -0.000 0.259) 1.147 6.905 ( 4.655 0.000 -9.001) 10.133 6.963 ( -3.474 -0.000 1.929) 3.973 7.079 ( -12.781 -0.000 7.322) 14.729 7.515 ( 1.813 0.000 0.037) 1.813 7.742 ( 2.219 0.000 0.794) 2.357 8.010 ( -3.207 -0.000 6.178) 6.961 8.499 ( 6.622 0.000 3.619) 7.546 8.672 ( 1.151 0.000 -1.249) 1.698 8.771 ( -3.055 -0.000 0.820) 3.163 9.062 ( -1.221 -0.000 -2.424) 2.714 9.177 ( 0.978 0.000 -1.768) 2.021 9.208 ( 0.539 0.000 2.778) 2.830 9.543 ( -8.839 -0.000 -2.235) 9.117 10.188 ( 0.972 0.000 -2.450) 2.636 10.218 ( -2.171 -0.000 -1.257) 2.508 10.590 ( 1.695 0.000 -0.763) 1.859 12.205 ( 3.160 0.000 2.126) 3.808 12.623 ( 1.784 0.000 7.649) 7.854 12.847 ( -0.243 -0.000 -7.432) 7.436 13.626 ( 1.373 0.000 7.724) 7.845 13.723 ( -1.602 -0.000 -7.128) 7.306 14.052 ( -2.121 -0.000 1.460) 2.575 14.216 ( 0.531 0.000 0.110) 0.542 14.774 ( 1.201 0.000 0.981) 1.551 15.232 ( 1.311 0.000 -1.103) 1.713 20.091 ( 0.280 0.000 0.525) 0.595 20.957 ( -9.435 -0.000 0.469) 9.446 21.395 ( 0.313 0.000 0.803) 0.862 21.626 ( 0.118 0.000 -0.049) 0.128 21.646 ( 0.278 0.000 -3.066) 3.078 22.450 ( -1.495 -0.000 0.208) 1.510 23.449 ( 3.159 0.000 0.105) 3.161 23.499 ( 0.290 0.000 -1.553) 1.580 23.561 ( -2.987 -0.000 0.034) 2.987 25.026 ( -0.365 -0.000 -1.051) 1.113 25.295 ( 0.930 0.000 0.912) 1.302 25.667 ( 4.633 0.000 1.173) 4.780 ======================= Grid point 25 (16/128) ======================= q-point: (-0.43 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.836 ( 0.000 7.623 0.000) 7.623 2.189 ( -0.000 -7.408 -0.000) 7.408 2.673 ( 0.000 1.442 0.000) 1.442 2.735 ( -0.000 -4.535 -0.000) 4.535 2.803 ( -0.000 -5.141 -0.000) 5.141 2.906 ( 0.000 21.698 0.000) 21.698 3.471 ( 0.000 3.151 0.000) 3.151 3.876 ( -0.000 -4.777 -0.000) 4.777 4.129 ( -0.000 -4.417 -0.000) 4.417 4.250 ( 0.000 16.898 0.000) 16.898 4.306 ( -0.000 -8.386 -0.000) 8.386 4.495 ( 0.000 7.728 0.000) 7.728 4.773 ( 0.000 1.290 0.000) 1.290 4.962 ( -0.000 -0.720 -0.000) 0.720 5.038 ( -0.000 -1.622 -0.000) 1.622 5.116 ( 0.000 6.326 0.000) 6.326 5.471 ( 0.000 1.022 0.000) 1.022 5.524 ( -0.000 -9.734 -0.000) 9.734 5.713 ( 0.000 7.041 0.000) 7.041 5.997 ( 0.000 5.694 0.000) 5.694 6.135 ( -0.000 -3.285 -0.000) 3.285 6.315 ( -0.000 -5.600 -0.000) 5.600 6.526 ( -0.000 -3.512 -0.000) 3.512 6.937 ( 0.000 0.388 0.000) 0.388 6.963 ( -0.000 -2.535 -0.000) 2.535 7.007 ( -0.000 -3.918 -0.000) 3.918 7.497 ( 0.000 3.842 0.000) 3.842 7.715 ( 0.000 5.693 0.000) 5.693 8.010 ( -0.000 -1.980 -0.000) 1.980 8.562 ( 0.000 3.539 0.000) 3.539 8.642 ( -0.000 -2.204 -0.000) 2.204 8.782 ( -0.000 -2.444 -0.000) 2.444 9.105 ( -0.000 -6.286 -0.000) 6.286 9.183 ( 0.000 3.982 0.000) 3.982 9.249 ( -0.000 -7.765 -0.000) 7.765 9.399 ( 0.000 8.383 0.000) 8.383 10.225 ( -0.000 -2.909 -0.000) 2.909 10.247 ( -0.000 -7.086 -0.000) 7.086 10.657 ( -0.000 -7.081 -0.000) 7.081 12.197 ( 0.000 4.422 0.000) 4.422 12.643 ( 0.000 1.274 0.000) 1.274 12.820 ( 0.000 0.955 0.000) 0.955 13.683 ( 0.000 0.265 0.000) 0.265 13.687 ( -0.000 -2.877 -0.000) 2.877 14.042 ( -0.000 -0.192 -0.000) 0.192 14.217 ( 0.000 0.340 0.000) 0.340 14.801 ( -0.000 -2.065 -0.000) 2.065 15.230 ( 0.000 1.209 0.000) 1.209 20.094 ( 0.000 0.042 0.000) 0.042 20.844 ( 0.000 5.632 0.000) 5.632 21.410 ( -0.000 -1.080 -0.000) 1.080 21.627 ( -0.000 -0.064 -0.000) 0.064 21.642 ( -0.000 -0.019 -0.000) 0.019 22.496 ( -0.000 -6.916 -0.000) 6.916 23.311 ( 0.000 12.037 0.000) 12.037 23.515 ( 0.000 2.654 0.000) 2.654 23.644 ( -0.000 -10.030 -0.000) 10.030 25.042 ( -0.000 -2.617 -0.000) 2.617 25.298 ( 0.000 0.782 0.000) 0.782 25.701 ( -0.000 -0.035 -0.000) 0.035 ======================= Grid point 49 (17/128) ======================= q-point: ( 0.00 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.567 ( 4.444 0.000 27.678) 28.032 0.627 ( 2.517 0.000 29.682) 29.789 1.157 ( 7.253 0.000 54.765) 55.244 2.136 ( 1.887 0.000 3.519) 3.993 2.692 ( -13.838 -0.000 3.263) 14.218 2.860 ( -5.884 -0.000 5.134) 7.809 3.270 ( -9.942 -0.000 -10.006) 14.105 3.590 ( 5.282 0.000 3.412) 6.288 3.716 ( 6.816 0.000 3.897) 7.851 3.918 ( 7.783 0.000 -0.097) 7.783 4.020 ( 3.031 0.000 2.906) 4.199 4.070 ( -7.707 -0.000 6.286) 9.946 4.518 ( -5.359 -0.000 -5.898) 7.969 4.764 ( 1.151 0.000 8.694) 8.770 5.023 ( -1.955 -0.000 -4.466) 4.875 5.026 ( 2.945 0.000 -13.277) 13.600 5.454 ( 3.281 0.000 9.872) 10.403 5.823 ( 9.165 0.000 -3.490) 9.807 5.967 ( 0.993 0.000 1.885) 2.130 6.227 ( -10.551 -0.000 6.651) 12.473 6.423 ( 1.438 0.000 1.086) 1.802 6.614 ( 8.244 0.000 -10.013) 12.970 6.824 ( -1.176 -0.000 3.105) 3.320 6.852 ( -4.837 -0.000 -5.888) 7.620 7.156 ( -4.963 -0.000 4.821) 6.919 7.389 ( 1.456 0.000 -0.898) 1.711 7.663 ( 1.113 0.000 1.659) 1.998 8.005 ( 21.634 0.000 -11.985) 24.732 8.190 ( 1.533 0.000 -2.220) 2.697 8.507 ( -1.792 -0.000 -6.168) 6.423 8.626 ( -5.805 -0.000 7.915) 9.816 8.837 ( 5.302 0.000 -0.602) 5.336 8.904 ( 15.590 0.000 0.309) 15.593 9.275 ( 0.457 0.000 6.677) 6.692 9.549 ( -3.847 -0.000 -3.722) 5.353 10.202 ( 0.470 0.000 -3.955) 3.983 10.359 ( -0.416 -0.000 -5.817) 5.832 10.512 ( -3.624 -0.000 3.402) 4.971 11.400 ( -35.982 -0.000 1.839) 36.029 11.434 ( 6.665 0.000 -5.365) 8.556 12.373 ( 1.602 0.000 6.902) 7.086 13.471 ( 0.948 0.000 4.423) 4.523 13.843 ( 40.279 0.000 1.125) 40.294 14.034 ( 0.929 0.000 -3.099) 3.235 14.088 ( -66.210 -0.000 -2.671) 66.264 14.151 ( -2.361 -0.000 0.754) 2.478 14.556 ( 2.053 0.000 0.270) 2.070 14.792 ( 2.067 0.000 -0.454) 2.116 20.085 ( 0.164 0.000 -0.869) 0.884 20.553 ( 29.676 0.000 -5.132) 30.116 21.297 ( 0.940 0.000 4.521) 4.617 21.723 ( -2.354 -0.000 9.009) 9.311 22.514 ( 2.633 0.000 -0.345) 2.655 22.739 ( -0.731 -0.000 -0.071) 0.734 23.405 ( -0.876 -0.000 -1.433) 1.680 23.562 ( -42.215 -0.000 -3.159) 42.333 24.240 ( 20.662 0.000 -0.196) 20.663 24.529 ( 5.684 0.000 4.716) 7.385 25.091 ( -0.526 -0.000 -1.426) 1.520 25.152 ( 0.768 0.000 -0.759) 1.080 ======================= Grid point 50 (18/128) ======================= q-point: ( 0.14 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.963 ( 9.108 -16.000 24.092) 30.321 1.091 ( 17.960 -19.498 21.205) 33.947 1.709 ( 22.136 -16.004 37.835) 46.665 2.259 ( 6.816 -5.784 7.136) 11.439 2.562 ( -9.824 -7.445 -2.432) 12.564 2.730 ( -6.429 8.849 0.534) 10.951 3.196 ( -7.040 -9.675 -4.411) 12.753 3.692 ( 5.246 2.338 2.414) 6.230 3.860 ( 5.404 -1.831 2.288) 6.147 3.965 ( -2.144 -1.114 6.281) 6.730 4.050 ( 2.897 -1.492 1.122) 3.446 4.115 ( 7.028 -4.382 2.164) 8.560 4.448 ( -5.644 -4.415 -9.335) 11.768 4.843 ( 1.686 -4.383 7.578) 8.915 5.013 ( 1.061 -1.665 -5.806) 6.133 5.040 ( 5.377 0.998 -7.376) 9.182 5.555 ( 2.672 -2.744 11.192) 11.829 5.849 ( 3.333 5.879 -4.901) 8.348 5.940 ( -3.770 4.219 1.802) 5.938 6.093 ( -4.134 5.150 5.984) 8.912 6.399 ( 5.147 4.842 -0.938) 7.128 6.705 ( -3.710 6.768 0.140) 7.719 6.740 ( 2.528 -3.292 -11.624) 12.343 6.778 ( -5.023 -0.926 -1.201) 5.247 7.101 ( -4.576 1.206 3.462) 5.864 7.440 ( 2.510 -1.579 -0.887) 3.095 7.632 ( -1.629 5.080 1.038) 5.435 7.864 ( 3.551 20.727 1.424) 21.077 8.222 ( 1.187 -0.243 -1.748) 2.127 8.438 ( -2.275 1.066 -3.514) 4.320 8.533 ( -7.525 -2.665 1.577) 8.137 8.950 ( 6.588 0.835 0.942) 6.707 9.068 ( 2.811 0.591 -4.577) 5.403 9.311 ( 1.325 1.199 8.351) 8.540 9.435 ( -4.190 4.885 -5.110) 8.218 10.147 ( -3.912 3.610 -4.223) 6.795 10.290 ( -4.436 4.958 1.391) 6.797 10.419 ( -3.693 -1.948 -2.750) 5.000 11.050 ( -28.511 -18.560 5.619) 34.481 11.572 ( 8.871 -3.188 -2.414) 9.730 12.420 ( 2.770 2.003 8.669) 9.318 13.251 ( -20.722 8.897 14.658) 26.896 13.550 ( -6.079 -3.049 3.884) 7.832 14.008 ( -2.589 0.556 -2.960) 3.971 14.076 ( 11.421 6.141 -2.678) 13.241 14.146 ( 1.207 1.103 1.074) 1.956 14.759 ( -5.090 -10.072 -4.204) 12.043 14.882 ( 6.577 -7.298 -4.683) 10.884 20.083 ( -0.105 0.003 -0.761) 0.769 20.889 ( 28.406 7.626 -21.238) 36.278 21.344 ( 1.436 -1.113 5.407) 5.704 21.718 ( -3.069 -0.292 7.551) 8.156 22.451 ( -15.786 31.575 32.308) 47.854 22.551 ( 7.606 6.730 2.559) 10.474 22.717 ( -1.931 0.035 -0.760) 2.076 23.708 ( -9.629 -6.789 -3.894) 12.409 24.308 ( -2.822 -2.395 4.878) 6.123 24.933 ( 3.246 -21.586 -17.314) 27.862 25.104 ( -1.061 -4.523 -4.579) 6.523 25.171 ( 0.601 -0.923 -0.841) 1.386 ======================= Grid point 51 (19/128) ======================= q-point: ( 0.29 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.434 ( 10.066 -16.917 18.960) 27.331 1.647 ( 15.409 -12.812 23.338) 30.761 2.214 ( 0.805 -13.994 4.130) 14.613 2.362 ( -5.204 7.293 -1.315) 9.055 2.554 ( 0.837 0.613 2.269) 2.495 2.814 ( 15.887 -18.561 8.757) 25.953 3.284 ( -2.229 -10.876 3.889) 11.764 3.583 ( -5.408 8.330 8.763) 13.244 3.897 ( 2.103 1.113 -1.987) 3.100 4.101 ( 1.543 -1.151 2.669) 3.291 4.147 ( 5.423 -6.727 4.568) 9.774 4.313 ( 9.418 -5.230 1.887) 10.937 4.441 ( -2.023 -7.580 -10.982) 13.496 4.930 ( 3.410 1.094 -5.615) 6.660 5.062 ( 4.746 4.497 -0.842) 6.591 5.110 ( -0.804 -13.077 4.026) 13.706 5.648 ( 0.258 4.063 -0.594) 4.115 5.711 ( -1.131 7.625 3.784) 8.587 5.780 ( -2.340 7.080 2.919) 8.008 6.059 ( -2.175 -3.670 2.319) 4.855 6.467 ( 4.602 -3.517 -0.606) 5.824 6.498 ( -5.842 9.098 -0.268) 10.815 6.564 ( -6.344 6.924 -7.215) 11.843 6.844 ( -5.312 -2.411 1.275) 5.971 7.036 ( 1.962 2.515 -2.740) 4.205 7.401 ( 1.074 9.387 0.106) 9.448 7.488 ( -3.366 6.222 -2.073) 7.371 7.749 ( 0.026 3.224 7.666) 8.317 8.165 ( -2.848 3.662 -0.950) 4.735 8.458 ( 2.165 -3.034 -0.282) 3.737 8.505 ( -4.033 -4.810 -2.544) 6.773 8.923 ( 1.007 8.371 -1.603) 8.582 9.022 ( -2.284 3.783 -2.237) 4.953 9.325 ( -0.020 -0.110 5.657) 5.658 9.358 ( 1.194 -0.334 2.287) 2.601 9.919 ( -8.622 10.709 -1.624) 13.844 10.255 ( -2.465 -4.689 -3.192) 6.184 10.427 ( 0.106 -3.315 -5.556) 6.470 11.060 ( -12.065 -15.153 -1.006) 19.395 11.704 ( 7.932 0.776 -1.993) 8.215 12.447 ( 2.698 4.008 9.222) 10.411 13.021 ( -11.265 0.380 6.569) 13.046 13.564 ( 0.862 -0.041 4.064) 4.155 13.948 ( -3.962 -0.621 -3.250) 5.162 14.114 ( 3.801 1.378 -0.253) 4.051 14.153 ( 2.568 1.669 2.243) 3.796 14.766 ( -3.693 -2.334 -1.658) 4.673 15.031 ( 4.114 -4.548 -5.135) 7.999 20.078 ( -0.009 0.173 -0.505) 0.534 20.987 ( 15.842 7.671 -20.614) 27.106 21.395 ( 0.603 -0.829 5.073) 5.176 21.705 ( -2.827 -0.191 6.204) 6.821 22.121 ( -8.675 9.561 28.798) 31.559 22.580 ( 4.381 2.745 1.007) 5.267 22.697 ( -1.886 -1.798 -1.357) 2.938 23.596 ( -6.262 3.534 0.851) 7.240 24.334 ( -2.862 -3.582 4.004) 6.087 25.108 ( 2.265 -4.415 -2.655) 5.628 25.135 ( -2.636 -7.245 -13.991) 15.975 25.198 ( 2.606 -0.482 -1.545) 3.067 ======================= Grid point 52 (20/128) ======================= q-point: ( 0.43 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.794 ( 2.388 -2.333 9.370) 9.947 1.948 ( -5.047 -0.855 8.606) 10.013 2.116 ( -0.040 6.154 2.258) 6.555 2.355 ( 0.466 -11.164 9.100) 14.410 2.673 ( 2.644 -5.418 5.955) 8.474 3.159 ( 6.866 -5.658 -1.792) 9.076 3.331 ( -6.558 4.213 7.322) 10.694 3.693 ( 7.955 -6.795 10.675) 14.947 3.832 ( -3.406 1.654 0.087) 3.788 4.116 ( -0.525 2.115 2.038) 2.983 4.254 ( 0.840 -2.818 2.095) 3.610 4.501 ( -0.735 -4.578 -6.960) 8.363 4.560 ( 9.604 -6.047 5.412) 12.573 4.876 ( -1.359 3.600 -10.330) 11.024 5.026 ( 1.374 3.608 1.330) 4.083 5.317 ( -0.884 -9.257 9.754) 13.476 5.453 ( 0.117 8.946 -7.855) 11.905 5.579 ( 3.229 12.425 -2.152) 13.017 5.840 ( -2.831 -8.375 9.894) 13.269 6.112 ( -3.279 -4.429 0.140) 5.513 6.297 ( -4.231 3.899 0.460) 5.771 6.376 ( -3.017 1.221 -9.237) 9.794 6.637 ( -0.969 -5.453 -2.505) 6.079 6.710 ( -0.530 2.924 2.568) 3.928 7.005 ( -2.070 5.527 -0.965) 5.981 7.319 ( 2.517 3.060 2.302) 4.582 7.391 ( 0.236 1.125 -3.513) 3.696 7.702 ( -3.238 4.216 5.769) 7.845 8.100 ( 0.246 1.544 0.475) 1.634 8.503 ( -0.515 -1.427 0.945) 1.788 8.563 ( 2.785 -2.666 -1.533) 4.149 8.804 ( -2.310 3.107 -3.682) 5.343 8.921 ( 2.337 5.400 -2.967) 6.589 9.357 ( -2.135 0.689 -0.646) 2.335 9.464 ( 4.483 -6.745 10.608) 13.347 9.645 ( -6.706 8.170 -2.050) 10.767 10.284 ( -0.825 -3.686 -4.734) 6.056 10.471 ( 0.965 -3.545 -4.105) 5.509 11.120 ( -5.870 -9.855 -2.578) 11.757 11.743 ( 5.783 5.318 -2.787) 8.336 12.440 ( 2.192 5.592 8.135) 10.112 12.933 ( -7.030 -2.255 3.206) 8.049 13.589 ( 1.777 1.468 3.842) 4.481 13.905 ( -3.108 -1.981 -3.514) 5.093 14.134 ( 1.024 0.889 3.426) 3.685 14.198 ( 3.238 -0.679 2.577) 4.194 14.735 ( -1.505 0.425 -1.703) 2.312 15.101 ( 1.985 -1.831 -4.447) 5.203 20.074 ( 0.270 0.318 -0.387) 0.569 20.975 ( 6.673 4.235 -19.506) 21.046 21.413 ( -0.857 0.559 3.677) 3.817 21.695 ( -2.103 -0.024 5.682) 6.059 22.048 ( -10.095 -2.299 24.320) 26.432 22.588 ( 4.942 4.866 0.103) 6.936 22.713 ( -0.329 -2.353 -0.533) 2.435 23.496 ( -2.696 1.414 4.048) 5.065 24.358 ( -3.514 -3.421 3.781) 6.193 25.107 ( -1.952 -1.412 -7.897) 8.257 25.181 ( 3.144 0.641 -5.984) 6.790 25.246 ( 4.137 -1.333 -1.786) 4.699 ======================= Grid point 53 (21/128) ======================= q-point: (-0.43 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.494 ( -12.279 18.364 -2.172) 22.197 1.720 ( -17.929 13.599 7.550) 23.736 2.214 ( 3.532 -4.918 5.108) 7.922 2.656 ( 8.705 -4.112 9.378) 13.440 2.796 ( -2.457 -5.358 18.370) 19.293 3.144 ( -3.790 3.818 -3.130) 6.224 3.358 ( 2.042 -5.146 3.359) 6.476 3.387 ( -14.594 21.288 5.265) 26.341 3.948 ( -3.176 -2.344 0.512) 3.980 4.068 ( 1.815 4.704 1.101) 5.161 4.269 ( -5.834 3.147 4.523) 8.025 4.458 ( -1.575 4.704 -0.754) 5.018 4.708 ( 2.177 -0.456 -5.110) 5.573 4.811 ( 2.344 -3.033 -3.909) 5.475 5.052 ( 0.987 -0.421 0.274) 1.107 5.267 ( -0.008 7.090 -4.177) 8.229 5.413 ( 0.286 6.974 0.029) 6.980 5.562 ( 2.889 -8.820 3.947) 10.086 5.929 ( -1.136 -4.280 0.898) 4.519 6.032 ( -7.938 -0.166 3.957) 8.871 6.349 ( 1.240 -2.169 -10.797) 11.082 6.359 ( -0.643 -8.385 3.511) 9.113 6.562 ( -1.277 -4.062 -0.122) 4.260 6.804 ( -3.059 6.994 2.393) 8.000 6.959 ( 9.685 -6.658 0.389) 11.760 7.365 ( 1.158 -2.427 3.340) 4.288 7.407 ( 1.965 -1.654 -5.765) 6.311 7.607 ( -3.798 3.041 4.309) 6.499 8.131 ( 4.788 -0.073 2.084) 5.222 8.493 ( -0.980 1.821 -0.819) 2.224 8.609 ( 4.321 2.434 0.961) 5.052 8.728 ( -0.468 1.966 -6.224) 6.544 8.967 ( 6.029 -3.520 -2.276) 7.343 9.230 ( -7.151 4.427 -1.223) 8.499 9.496 ( -2.670 0.897 2.036) 3.475 9.737 ( 7.046 -10.554 6.369) 14.198 10.306 ( 1.123 -1.102 -4.055) 4.349 10.514 ( 0.016 -2.254 -1.643) 2.789 11.175 ( -1.434 -5.586 -1.841) 6.054 11.695 ( 4.007 8.006 -3.724) 9.696 12.404 ( 1.808 6.086 6.262) 8.918 12.907 ( -4.700 -3.066 3.766) 6.758 13.592 ( 1.680 3.176 3.445) 4.978 13.901 ( -1.052 -3.125 -3.331) 4.687 14.148 ( 0.721 0.697 4.314) 4.429 14.263 ( 0.217 -2.518 4.660) 5.301 14.715 ( 2.646 1.863 -2.510) 4.095 15.113 ( 0.435 -0.035 -4.388) 4.410 20.073 ( 0.571 0.316 -0.442) 0.788 20.903 ( -1.617 0.293 -20.064) 20.131 21.384 ( -1.757 2.101 2.269) 3.557 21.692 ( -1.424 -0.002 6.141) 6.304 22.067 ( -13.569 -10.266 22.116) 27.904 22.579 ( 5.952 6.404 0.787) 8.779 22.739 ( 0.623 -0.617 0.831) 1.208 23.530 ( 1.853 -4.240 5.572) 7.243 24.364 ( -5.441 -3.779 3.610) 7.544 25.061 ( 2.134 2.718 -11.709) 12.208 25.166 ( 1.116 2.739 -0.772) 3.056 25.313 ( 6.779 2.035 -3.445) 7.872 ======================= Grid point 54 (22/128) ======================= q-point: (-0.29 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.023 ( -12.840 20.388 3.785) 24.389 1.253 ( -18.194 18.212 13.863) 29.238 2.243 ( -5.367 5.625 1.444) 7.908 2.348 ( -22.004 32.004 11.937) 40.632 2.828 ( -6.011 -3.086 14.318) 15.833 3.050 ( -1.318 7.801 7.299) 10.765 3.278 ( 5.728 -13.472 -0.599) 14.651 3.447 ( -0.603 -1.443 5.826) 6.032 3.884 ( -2.303 5.214 -5.057) 7.620 3.984 ( -3.694 3.532 -1.360) 5.289 4.060 ( -4.855 9.829 4.464) 11.837 4.321 ( -6.726 5.970 1.676) 9.148 4.721 ( 3.590 2.058 -5.858) 7.172 4.811 ( 0.954 7.555 -1.480) 7.758 5.018 ( -2.578 -1.265 -1.853) 3.418 5.210 ( -4.469 -2.215 -4.912) 7.000 5.329 ( 3.094 4.230 -2.344) 5.741 5.716 ( -2.179 -5.935 1.520) 6.502 5.946 ( 2.289 2.143 0.232) 3.145 6.067 ( -0.520 -8.774 10.340) 13.571 6.353 ( -2.207 -5.150 -10.362) 11.780 6.508 ( 1.895 -8.953 2.148) 9.400 6.665 ( 1.031 1.398 -0.968) 1.988 6.738 ( 0.527 -8.444 6.710) 10.798 7.170 ( 5.426 -2.648 0.613) 6.069 7.408 ( -0.598 -1.240 2.524) 2.875 7.438 ( 1.611 -2.154 -4.891) 5.582 7.570 ( -0.024 -0.349 2.419) 2.444 8.231 ( 5.465 -1.008 3.037) 6.333 8.421 ( 1.063 5.214 -1.462) 5.519 8.592 ( 2.157 3.794 -2.789) 5.179 8.762 ( 5.700 -2.438 -3.815) 7.279 8.976 ( -1.049 5.883 -5.401) 8.054 9.211 ( 0.827 -6.860 1.852) 7.154 9.485 ( -2.603 -3.553 0.954) 4.506 10.010 ( 6.300 -9.736 4.394) 12.401 10.318 ( 1.434 0.166 -2.174) 2.609 10.523 ( -0.443 0.229 0.432) 0.660 11.254 ( 3.770 -3.875 0.509) 5.430 11.604 ( 4.227 9.216 -2.467) 10.435 12.366 ( 1.704 4.797 5.102) 7.207 12.923 ( -1.665 -2.687 8.046) 8.645 13.569 ( 2.330 4.952 3.449) 6.468 13.941 ( 0.793 -3.691 -3.029) 4.840 14.162 ( 0.547 0.630 3.694) 3.787 14.300 ( -6.247 -5.375 5.146) 9.716 14.736 ( 6.415 2.776 -2.366) 7.380 15.090 ( 1.706 2.413 -5.484) 6.229 20.078 ( 0.782 0.138 -0.582) 0.984 20.763 ( -10.512 -2.376 -21.552) 24.096 21.330 ( -1.490 2.629 1.973) 3.609 21.701 ( -1.045 0.034 7.589) 7.660 22.156 ( -17.454 -20.527 21.197) 34.283 22.570 ( 5.998 6.420 3.666) 9.520 22.757 ( -0.016 -0.514 2.528) 2.580 23.691 ( 6.133 -6.049 5.495) 10.217 24.345 ( -8.431 -4.663 2.355) 9.919 25.002 ( 8.932 9.162 -13.579) 18.658 25.136 ( -0.036 2.014 0.209) 2.025 25.326 ( 8.791 8.848 -5.931) 13.811 ======================= Grid point 55 (23/128) ======================= q-point: (-0.14 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.631 ( -5.888 16.627 17.844) 25.091 0.849 ( -12.246 16.115 25.518) 32.570 1.423 ( -27.746 36.207 26.716) 52.863 2.178 ( -2.967 4.002 2.323) 5.497 2.797 ( -8.518 -1.283 13.397) 15.927 2.967 ( -4.662 4.336 1.815) 6.620 3.422 ( -6.415 -2.011 -4.633) 8.165 3.497 ( 3.006 -3.364 3.227) 5.547 3.733 ( 0.437 5.032 -1.930) 5.407 3.889 ( 3.468 8.866 0.444) 9.531 3.980 ( 2.302 1.333 1.066) 2.866 4.160 ( -8.657 1.446 5.064) 10.134 4.637 ( -1.875 5.974 -3.961) 7.409 4.746 ( 2.549 4.572 4.014) 6.597 5.012 ( -2.463 -5.018 -7.995) 9.755 5.120 ( -4.598 1.246 -7.911) 9.235 5.375 ( 5.179 0.241 4.160) 6.647 5.726 ( -0.758 -2.020 -0.414) 2.197 5.953 ( 2.393 2.318 2.369) 4.088 6.245 ( -4.077 -10.838 6.801) 13.429 6.362 ( -5.504 -6.951 -1.454) 8.985 6.603 ( 5.319 3.688 -7.496) 9.904 6.730 ( 2.572 -7.314 2.892) 8.275 6.904 ( -0.145 -5.101 0.905) 5.183 7.196 ( -3.156 -0.206 5.002) 5.918 7.402 ( 0.906 2.207 -1.356) 2.744 7.530 ( 9.191 -6.543 4.072) 11.994 7.629 ( 2.437 -3.561 3.154) 5.345 8.227 ( -0.750 3.502 -1.973) 4.089 8.482 ( 5.789 -2.858 3.525) 7.356 8.572 ( 3.389 2.390 -0.279) 4.156 8.824 ( -0.898 -0.851 -3.310) 3.533 8.885 ( 9.028 8.453 -7.698) 14.568 9.275 ( -2.330 -1.087 3.350) 4.223 9.543 ( -1.477 -6.222 -1.203) 6.508 10.183 ( 2.896 -2.537 -1.984) 4.331 10.346 ( 0.325 -3.756 -0.754) 3.845 10.507 ( -1.242 0.400 3.055) 3.322 11.378 ( 2.365 -4.645 -6.248) 8.137 11.572 ( 9.269 6.209 4.620) 12.075 12.350 ( 0.606 1.913 4.949) 5.340 13.085 ( 12.637 -8.388 21.156) 26.031 13.546 ( 6.846 7.610 4.688) 11.259 13.999 ( 1.255 -3.183 -3.033) 4.572 14.166 ( -0.986 0.104 2.266) 2.473 14.301 ( -15.770 -13.526 3.511) 21.070 14.770 ( 4.351 2.040 -1.285) 4.974 15.006 ( 1.767 12.850 -14.459) 19.424 20.085 ( 0.736 0.121 -0.799) 1.093 20.523 ( -14.917 -0.298 -14.986) 21.147 21.292 ( -0.348 1.695 2.981) 3.447 21.715 ( -1.327 0.154 9.114) 9.211 22.401 ( -10.652 -26.928 9.156) 30.372 22.630 ( 0.469 -10.945 15.740) 19.177 22.784 ( -5.263 -8.136 8.428) 12.843 23.891 ( 8.681 -3.520 5.484) 10.855 24.272 ( -11.158 -2.389 -4.971) 12.446 24.879 ( 19.263 31.515 -18.601) 41.355 25.109 ( 0.046 1.080 -1.271) 1.669 25.225 ( 4.114 12.598 -6.114) 14.595 ======================= Grid point 57 (24/128) ======================= q-point: ( 0.14 0.14 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.198 ( 21.981 0.000 17.489) 28.090 1.290 ( 22.421 0.000 23.247) 32.297 2.030 ( 11.174 0.000 23.574) 26.088 2.361 ( 9.655 0.000 6.758) 11.786 2.482 ( 14.006 0.000 10.980) 17.797 2.813 ( -1.894 -0.000 8.997) 9.194 2.949 ( -5.092 -0.000 -11.515) 12.590 3.757 ( -5.275 -0.000 2.809) 5.976 3.943 ( 7.505 0.000 -4.320) 8.660 3.956 ( 6.373 0.000 1.564) 6.562 4.093 ( 0.565 0.000 4.777) 4.810 4.217 ( 12.162 0.000 2.915) 12.506 4.329 ( -2.737 -0.000 -5.199) 5.875 4.828 ( -1.505 -0.000 11.046) 11.148 5.009 ( 2.174 0.000 -8.214) 8.497 5.105 ( 6.660 0.000 -7.735) 10.207 5.609 ( 1.533 0.000 14.487) 14.568 5.815 ( -6.826 -0.000 -1.044) 6.905 5.912 ( -4.627 -0.000 -4.110) 6.188 6.178 ( -0.422 -0.000 6.141) 6.156 6.524 ( 6.707 0.000 -6.822) 9.566 6.587 ( -8.723 -0.000 -14.024) 16.516 6.699 ( -8.379 -0.000 0.784) 8.416 6.736 ( 2.071 0.000 -2.232) 3.044 7.046 ( -3.024 -0.000 -1.448) 3.353 7.485 ( 5.282 0.000 3.664) 6.428 7.637 ( -3.933 -0.000 1.257) 4.129 7.980 ( -9.714 -0.000 -8.501) 12.908 8.264 ( 4.041 0.000 -1.949) 4.487 8.409 ( 0.082 0.000 -6.476) 6.476 8.412 ( -9.392 -0.000 7.981) 12.326 8.955 ( 1.543 0.000 4.083) 4.365 9.151 ( 1.274 0.000 -3.679) 3.894 9.346 ( -6.956 -0.000 -7.951) 10.564 9.380 ( -0.689 -0.000 11.228) 11.250 10.099 ( -7.256 -0.000 -3.276) 7.961 10.283 ( -2.473 -0.000 -3.646) 4.405 10.425 ( -0.228 -0.000 -1.734) 1.749 10.446 ( -22.253 -0.000 20.128) 30.006 11.704 ( 12.518 0.000 -2.804) 12.828 12.528 ( 4.054 0.000 10.903) 11.632 13.037 ( -15.970 -0.000 4.627) 16.626 13.566 ( 2.463 0.000 7.942) 8.315 13.927 ( -5.831 -0.000 -4.482) 7.354 14.138 ( 1.641 0.000 0.063) 1.642 14.256 ( 0.129 0.000 -3.702) 3.704 14.656 ( 3.479 0.000 1.922) 3.974 14.934 ( 8.069 0.000 -3.763) 8.903 20.081 ( 0.076 0.000 -0.373) 0.381 21.140 ( 14.409 0.000 -29.271) 32.626 21.380 ( 1.520 0.000 6.433) 6.611 21.699 ( -2.801 -0.000 6.028) 6.647 22.294 ( -22.555 -0.000 14.183) 26.644 22.649 ( -4.573 -0.000 -0.897) 4.661 23.136 ( 3.986 0.000 8.603) 9.481 23.409 ( 1.653 0.000 -2.599) 3.080 24.058 ( -15.536 -0.000 7.962) 17.457 24.971 ( 19.239 0.000 -7.756) 20.744 25.052 ( -1.196 -0.000 -2.004) 2.334 25.189 ( 2.247 0.000 -0.927) 2.431 ======================= Grid point 58 (25/128) ======================= q-point: ( 0.29 0.14 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.571 ( 19.168 -3.717 15.527) 24.946 1.788 ( 20.557 -12.037 18.758) 30.320 2.102 ( -2.449 -0.941 5.722) 6.295 2.505 ( 5.531 0.429 7.493) 9.323 2.611 ( -1.728 14.565 -0.034) 14.668 2.941 ( 21.987 -5.877 9.200) 24.548 3.157 ( 11.394 -15.718 9.432) 21.583 3.594 ( -10.694 3.843 4.899) 12.374 3.967 ( 2.823 0.007 -10.713) 11.078 4.074 ( 3.566 1.471 1.425) 4.113 4.207 ( 7.977 -1.730 5.708) 9.960 4.312 ( 2.933 -3.837 -3.015) 5.694 4.426 ( 9.765 -3.374 4.538) 11.284 4.928 ( -1.749 -9.203 5.618) 10.923 4.977 ( 2.308 1.949 -5.642) 6.400 5.166 ( 4.913 1.423 -2.874) 5.867 5.655 ( -8.029 3.847 -2.652) 9.289 5.687 ( -1.913 -0.960 12.563) 12.744 5.845 ( -4.262 -2.101 -5.522) 7.285 6.121 ( 1.816 9.413 2.472) 9.900 6.392 ( -8.330 0.257 -10.507) 13.411 6.510 ( -9.721 6.377 -1.533) 11.727 6.569 ( 2.667 1.235 -4.209) 5.134 6.760 ( -2.951 -2.458 0.561) 3.881 7.037 ( 0.223 -2.149 -5.178) 5.610 7.504 ( -2.561 5.422 0.103) 5.997 7.564 ( 0.014 7.153 0.115) 7.153 7.766 ( -7.887 1.205 3.230) 8.608 8.214 ( -1.577 6.738 1.395) 7.060 8.386 ( -2.182 -4.205 2.095) 5.180 8.459 ( 5.347 -3.462 -1.598) 6.568 8.964 ( -5.733 4.048 -1.070) 7.100 9.076 ( 1.223 1.974 -0.572) 2.391 9.269 ( -4.345 -3.300 -5.398) 7.675 9.382 ( -2.440 1.220 13.219) 13.497 9.908 ( -10.333 6.578 -3.489) 12.736 10.190 ( -2.778 2.077 3.584) 4.987 10.327 ( -1.163 -5.295 -6.572) 8.519 10.637 ( -5.831 -18.983 2.071) 19.966 11.847 ( 10.556 1.432 -3.668) 11.266 12.598 ( 3.427 3.353 11.980) 12.904 12.892 ( -7.385 -0.534 -0.419) 7.416 13.627 ( 2.633 0.938 8.662) 9.101 13.840 ( -5.503 -1.536 -4.973) 7.574 14.161 ( 2.043 0.516 0.591) 2.189 14.208 ( -1.838 1.253 0.433) 2.266 14.718 ( 1.430 -1.190 0.888) 2.061 15.037 ( 6.044 -1.833 -4.927) 8.010 20.081 ( 0.293 0.139 -0.012) 0.325 21.129 ( 4.637 4.118 -25.664) 26.402 21.420 ( 0.568 0.035 5.949) 5.977 21.688 ( -2.148 -0.285 5.177) 5.612 22.038 ( -19.490 1.113 19.095) 27.308 22.608 ( -3.468 -3.035 -0.625) 4.651 22.983 ( 11.760 20.680 5.765) 24.478 23.542 ( -2.406 -3.487 -0.750) 4.302 24.016 ( -13.188 -14.883 4.222) 20.329 25.046 ( -0.872 -2.106 -2.620) 3.473 25.189 ( 15.370 0.302 -6.867) 16.837 25.221 ( 2.426 -0.304 -1.298) 2.768 ======================= Grid point 59 (26/128) ======================= q-point: ( 0.43 0.14 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.854 ( 2.644 -1.614 5.907) 6.671 2.085 ( 8.161 9.815 9.998) 16.214 2.298 ( 15.449 -4.506 6.127) 17.220 2.337 ( 1.373 8.341 12.558) 15.138 2.627 ( 0.184 -5.438 6.439) 8.430 3.210 ( 9.933 -2.667 0.404) 10.293 3.325 ( -8.207 3.987 5.653) 10.733 3.736 ( 13.405 -11.074 9.990) 20.053 3.922 ( 1.697 9.519 -5.693) 11.220 4.082 ( -2.216 -2.929 1.081) 3.829 4.247 ( 0.533 -0.196 2.082) 2.158 4.498 ( 10.346 -1.649 -0.406) 10.485 4.618 ( 5.800 -4.015 6.997) 9.936 4.865 ( -2.871 3.674 -10.731) 11.700 5.065 ( -2.668 0.443 -0.492) 2.749 5.211 ( 1.498 -6.134 9.095) 11.072 5.475 ( -3.921 3.493 -3.630) 6.384 5.735 ( -3.258 -1.945 7.889) 8.754 5.784 ( -1.621 3.775 -6.356) 7.568 5.994 ( -3.797 1.338 -3.728) 5.487 6.296 ( -4.909 2.688 -5.966) 8.180 6.317 ( -1.760 -0.012 -0.290) 1.784 6.541 ( -4.500 0.380 -0.888) 4.602 6.770 ( 5.219 -0.959 -0.817) 5.369 7.026 ( -2.923 0.968 -2.791) 4.156 7.387 ( -1.548 3.879 -1.955) 4.612 7.406 ( -3.252 4.968 1.622) 6.155 7.729 ( -3.053 2.359 5.530) 6.743 8.133 ( 0.157 2.430 2.917) 3.800 8.445 ( -0.096 -3.666 -1.411) 3.929 8.594 ( 6.371 -2.985 0.871) 7.089 8.805 ( -3.096 3.381 -1.515) 4.828 9.033 ( 0.685 5.569 -2.045) 5.972 9.284 ( -3.796 -3.598 -2.337) 5.729 9.429 ( -0.555 -6.506 12.429) 14.039 9.636 ( -9.990 7.431 -3.388) 12.903 10.202 ( 0.872 -3.595 -2.521) 4.477 10.385 ( -0.450 -6.257 -5.656) 8.446 10.825 ( -4.365 -15.179 -0.826) 15.815 11.907 ( 7.171 4.925 -4.469) 9.780 12.604 ( 1.508 5.452 8.540) 10.243 12.840 ( -2.388 -1.030 1.807) 3.167 13.668 ( 2.176 2.035 6.981) 7.591 13.795 ( -3.580 -3.246 -4.186) 6.393 14.176 ( 0.121 0.505 3.362) 3.402 14.194 ( -1.232 -1.506 0.891) 2.140 14.746 ( 2.302 0.265 -0.423) 2.355 15.102 ( 3.377 -0.618 -4.925) 6.003 20.083 ( 0.420 0.291 0.027) 0.512 20.982 ( -3.651 4.347 -19.390) 20.204 21.432 ( -0.413 1.001 4.023) 4.166 21.688 ( -1.352 -0.329 5.303) 5.483 21.893 ( -13.171 -2.193 17.045) 21.652 22.644 ( -0.999 -5.598 -0.305) 5.695 22.900 ( 10.698 14.640 4.483) 18.679 23.506 ( -1.555 1.983 3.403) 4.235 24.078 ( -12.091 -13.781 1.105) 18.367 25.063 ( 0.112 -2.019 -3.363) 3.924 25.244 ( 1.964 0.835 -1.858) 2.830 25.342 ( 12.990 1.542 -6.102) 14.435 ======================= Grid point 60 (27/128) ======================= q-point: (-0.43 0.14 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.693 ( -9.587 13.578 8.610) 18.719 1.896 ( 4.902 28.836 3.081) 29.411 2.315 ( 6.725 1.778 7.615) 10.314 2.694 ( 6.818 -6.574 1.701) 9.623 2.776 ( 4.959 -7.484 17.313) 19.503 3.144 ( -8.177 5.650 4.119) 10.759 3.369 ( 4.657 -2.631 2.294) 5.820 3.606 ( -7.482 24.118 6.266) 26.018 3.895 ( -1.674 0.508 -0.226) 1.764 4.136 ( 2.049 -0.314 1.606) 2.622 4.273 ( -2.222 2.461 3.238) 4.634 4.550 ( 3.187 7.216 -4.082) 8.882 4.668 ( -1.901 -0.583 -3.858) 4.340 4.797 ( 2.441 -2.505 0.484) 3.531 5.024 ( -1.147 -1.587 -4.613) 5.012 5.309 ( -3.493 1.911 0.401) 4.002 5.426 ( -1.880 -2.647 -1.101) 3.429 5.589 ( 1.024 4.858 -2.904) 5.752 5.821 ( -1.046 -5.945 3.242) 6.852 5.973 ( -2.919 -2.309 6.761) 7.718 6.237 ( -3.056 -2.313 -6.360) 7.426 6.315 ( 0.498 -0.881 1.817) 2.079 6.524 ( 3.767 -2.562 -2.098) 5.015 6.880 ( -1.720 4.317 0.050) 4.648 6.979 ( 7.421 -6.032 -1.042) 9.620 7.339 ( -2.805 -1.156 5.697) 6.455 7.370 ( -0.260 -1.629 -6.374) 6.584 7.631 ( -3.695 5.010 5.124) 8.063 8.171 ( 2.582 -2.620 3.183) 4.864 8.442 ( -2.306 -0.947 -5.669) 6.193 8.714 ( 4.536 -0.085 2.501) 5.181 8.783 ( 3.307 1.666 1.742) 4.092 8.997 ( 4.755 -0.372 -4.368) 6.467 9.175 ( -8.523 4.571 -2.205) 9.919 9.438 ( -7.316 0.475 0.229) 7.335 9.649 ( 2.281 -13.002 6.962) 14.924 10.277 ( 3.218 -3.775 -4.420) 6.644 10.445 ( -0.847 -4.838 -3.441) 5.997 10.976 ( -2.076 -12.239 -2.128) 12.594 11.870 ( 4.233 7.705 -4.999) 10.113 12.549 ( -0.235 5.406 2.982) 6.178 12.863 ( 1.047 -0.611 8.275) 8.363 13.677 ( 1.107 2.152 3.976) 4.655 13.811 ( -0.690 -3.969 -1.910) 4.458 14.181 ( -4.372 -2.416 4.236) 6.550 14.197 ( -0.297 0.305 1.130) 1.207 14.784 ( 4.643 0.474 -1.471) 4.894 15.120 ( 2.279 0.408 -5.135) 5.633 20.084 ( 0.430 0.289 -0.253) 0.577 20.776 ( -8.824 3.095 -13.984) 16.822 21.410 ( -0.764 2.256 2.490) 3.446 21.700 ( -0.609 -0.154 6.685) 6.714 21.843 ( -10.083 -4.303 14.025) 17.802 22.717 ( 0.259 -3.895 -0.225) 3.910 22.850 ( 7.889 11.766 4.026) 14.727 23.521 ( 1.495 -2.739 6.029) 6.789 24.099 ( -11.501 -10.704 -0.096) 15.712 25.083 ( 1.826 -0.838 -4.232) 4.684 25.230 ( 0.963 2.719 -1.448) 3.227 25.464 ( 11.729 1.750 -7.274) 13.912 ======================= Grid point 61 (28/128) ======================= q-point: (-0.29 0.14 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.366 ( -6.062 19.873 19.111) 28.230 1.522 ( 5.359 31.477 7.082) 32.706 2.321 ( 0.867 7.660 1.202) 7.803 2.669 ( -13.431 33.015 13.165) 37.996 2.753 ( -5.291 -1.252 2.122) 5.837 3.039 ( -0.392 -2.582 -0.189) 2.618 3.357 ( 6.378 5.945 13.903) 16.410 3.439 ( -2.904 -2.834 6.229) 7.434 3.895 ( 1.635 -2.922 0.987) 3.491 4.016 ( -5.513 11.710 -3.777) 13.482 4.131 ( -4.323 6.351 6.176) 9.858 4.408 ( -0.178 11.776 -4.471) 12.598 4.716 ( 3.751 -5.044 -6.508) 9.048 4.850 ( -3.136 0.526 -1.662) 3.588 5.001 ( -0.253 2.461 -4.006) 4.709 5.151 ( -0.262 1.887 -10.847) 11.013 5.421 ( -1.541 1.367 1.338) 2.457 5.627 ( 1.187 -2.312 3.931) 4.713 5.926 ( -3.046 -6.897 8.210) 11.147 6.037 ( 3.443 -1.409 7.018) 7.943 6.219 ( -0.733 -4.212 -6.321) 7.631 6.406 ( 1.045 -7.314 4.085) 8.443 6.645 ( 1.284 -5.786 2.205) 6.323 6.770 ( 3.258 5.526 -2.960) 7.065 7.155 ( -0.565 -3.477 -0.232) 3.530 7.372 ( -0.853 -3.008 0.411) 3.154 7.392 ( 1.864 -5.698 -1.719) 6.237 7.574 ( -0.560 0.322 4.014) 4.065 8.263 ( 0.712 -3.016 2.009) 3.694 8.415 ( -0.267 -1.724 -4.976) 5.273 8.674 ( 1.419 5.384 -1.856) 5.869 8.882 ( 7.914 2.936 3.600) 9.177 8.971 ( -5.963 1.431 -4.969) 7.893 9.145 ( 5.469 -7.345 -2.130) 9.402 9.367 ( -6.731 -2.674 1.195) 7.341 9.897 ( 0.691 -13.576 4.255) 14.244 10.345 ( 3.910 0.128 -5.096) 6.425 10.478 ( -1.798 -3.507 -1.406) 4.184 11.137 ( 1.692 -10.855 -2.252) 11.214 11.773 ( 1.946 7.728 -5.222) 9.528 12.467 ( -1.692 4.420 0.615) 4.773 12.950 ( 3.664 -1.557 14.234) 14.780 13.677 ( 1.487 1.599 3.736) 4.327 13.864 ( 0.154 -3.855 -1.284) 4.067 14.130 ( -8.764 -2.102 0.577) 9.031 14.197 ( -0.160 0.877 2.910) 3.044 14.830 ( 3.843 1.443 -1.397) 4.336 15.130 ( 3.095 -0.031 -7.826) 8.415 20.086 ( 0.456 0.040 -0.611) 0.764 20.565 ( -7.393 3.247 -8.321) 11.595 21.370 ( -0.378 2.956 2.459) 3.864 21.722 ( -0.582 0.272 9.068) 9.090 21.848 ( -8.308 -6.979 13.788) 17.545 22.750 ( 0.116 -0.456 -0.036) 0.472 22.781 ( 2.538 9.301 3.876) 10.391 23.671 ( 3.146 -8.423 6.196) 10.919 24.096 ( -8.116 -8.037 -0.761) 11.448 25.107 ( 3.372 0.267 -4.658) 5.756 25.185 ( 0.099 3.532 -0.654) 3.593 25.541 ( 9.212 3.309 -12.485) 15.865 ======================= Grid point 62 (29/128) ======================= q-point: (-0.14 0.14 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.130 ( 1.740 19.513 26.170) 32.691 1.195 ( 7.950 28.174 15.770) 33.252 1.895 ( -3.771 38.984 17.050) 42.716 2.296 ( 2.984 11.708 8.701) 14.889 2.690 ( -7.819 -2.965 3.948) 9.247 2.905 ( -12.194 5.929 -7.491) 15.491 3.374 ( -2.320 3.689 3.993) 5.910 3.556 ( 5.009 -4.115 7.304) 9.766 3.834 ( 3.084 5.491 -1.725) 6.529 4.000 ( -4.069 -0.164 7.722) 8.730 4.008 ( 3.418 1.358 4.106) 5.513 4.201 ( 0.514 12.570 -4.568) 13.384 4.656 ( -6.083 6.798 -8.297) 12.331 4.838 ( 4.731 -0.053 -6.068) 7.695 4.951 ( 1.674 -0.401 -1.216) 2.108 5.117 ( 0.352 5.824 -2.121) 6.208 5.468 ( 7.198 -2.881 0.419) 7.765 5.676 ( -0.383 -4.095 4.797) 6.319 5.960 ( -6.474 -3.890 4.285) 8.684 6.105 ( -1.476 -1.339 3.004) 3.605 6.281 ( 3.534 -1.663 2.992) 4.920 6.573 ( 0.449 -11.511 1.707) 11.646 6.738 ( 0.441 -4.842 -1.841) 5.199 6.799 ( 4.050 -0.318 -2.434) 4.736 7.121 ( -6.910 -2.095 5.413) 9.024 7.404 ( 0.369 -4.632 -4.441) 6.428 7.530 ( 2.639 -5.817 -0.021) 6.388 7.618 ( 2.646 -1.971 6.230) 7.050 8.253 ( -2.065 1.208 -1.494) 2.821 8.446 ( -0.023 -2.160 -2.970) 3.673 8.647 ( -0.066 2.887 0.468) 2.925 8.819 ( 1.187 -0.287 -1.999) 2.342 9.039 ( 6.284 -0.909 -2.829) 6.951 9.275 ( 1.714 -0.160 2.479) 3.018 9.370 ( -3.850 -9.636 -1.420) 10.473 10.086 ( -2.355 -11.313 0.625) 11.572 10.325 ( -0.035 3.195 -3.308) 4.599 10.484 ( -1.950 -0.705 -2.446) 3.206 11.297 ( 0.829 -6.151 -3.512) 7.131 11.656 ( -2.244 6.258 -5.503) 8.630 12.389 ( -2.005 2.222 3.388) 4.521 13.127 ( 2.223 -7.987 18.479) 20.253 13.694 ( -4.696 -1.890 5.364) 7.376 13.896 ( 1.211 -0.626 -1.714) 2.190 14.042 ( -3.701 -0.411 -2.131) 4.291 14.175 ( -2.396 0.932 1.967) 3.237 14.833 ( 1.811 2.219 -0.531) 2.913 15.086 ( -1.923 5.154 -14.661) 15.659 20.088 ( -0.008 -0.040 -0.971) 0.972 20.515 ( 12.699 0.272 -2.362) 12.919 21.340 ( 0.557 2.476 3.709) 4.494 21.731 ( -2.322 0.471 9.191) 9.491 21.975 ( -4.426 -15.579 22.936) 28.078 22.666 ( -3.668 6.568 3.932) 8.489 22.745 ( -0.943 0.239 -0.313) 1.022 23.810 ( -6.367 -7.543 1.664) 10.010 24.167 ( 5.004 -5.928 1.627) 7.927 25.120 ( 1.230 3.741 -2.941) 4.914 25.136 ( 2.156 1.295 -2.488) 3.538 25.454 ( -0.877 11.055 -22.666) 25.234 ======================= Grid point 65 (30/128) ======================= q-point: ( 0.29 0.29 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.854 ( 16.587 0.000 6.861) 17.950 2.042 ( 20.052 0.000 19.521) 27.985 2.096 ( -1.981 -0.000 11.686) 11.853 2.535 ( 0.470 0.000 7.859) 7.873 2.907 ( 5.343 0.000 5.123) 7.402 3.072 ( 17.436 0.000 -3.880) 17.862 3.352 ( 7.608 0.000 12.182) 14.362 3.496 ( 3.574 0.000 9.131) 9.805 3.869 ( -3.809 -0.000 -12.700) 13.259 4.247 ( -1.367 -0.000 -1.863) 2.311 4.317 ( 6.445 0.000 6.476) 9.136 4.353 ( 18.786 0.000 0.571) 18.795 4.537 ( 6.809 0.000 5.518) 8.764 4.872 ( 0.661 0.000 5.043) 5.086 4.992 ( 0.868 0.000 -3.086) 3.205 5.250 ( 6.807 0.000 -1.070) 6.890 5.511 ( -13.550 -0.000 -5.450) 14.605 5.646 ( -7.029 -0.000 -3.942) 8.059 5.798 ( 1.236 0.000 7.024) 7.132 6.199 ( -9.504 -0.000 -15.404) 18.100 6.239 ( 0.222 0.000 7.750) 7.753 6.401 ( -11.048 -0.000 -2.478) 11.322 6.647 ( -7.213 -0.000 2.850) 7.756 6.651 ( 5.632 0.000 -7.368) 9.274 6.995 ( 0.062 0.000 -6.719) 6.720 7.505 ( -4.451 -0.000 -0.429) 4.472 7.589 ( -14.294 -0.000 1.022) 14.331 7.682 ( 5.131 0.000 4.239) 6.655 8.283 ( -5.930 -0.000 9.052) 10.822 8.324 ( 4.771 0.000 -5.088) 6.975 8.517 ( 7.208 0.000 -0.340) 7.216 8.929 ( -6.179 -0.000 1.363) 6.328 9.056 ( -3.657 -0.000 -4.294) 5.640 9.145 ( -1.700 -0.000 -4.589) 4.893 9.406 ( -3.855 -0.000 14.365) 14.874 9.800 ( -11.212 -0.000 -3.659) 11.794 10.213 ( -4.092 -0.000 9.057) 9.939 10.227 ( -1.250 -0.000 -5.548) 5.687 10.469 ( 3.832 0.000 -3.819) 5.410 11.981 ( 9.147 0.000 -6.548) 11.249 12.683 ( -1.136 -0.000 6.425) 6.525 12.834 ( 0.015 0.000 3.070) 3.070 13.702 ( 1.052 0.000 7.698) 7.769 13.742 ( -3.385 -0.000 -2.243) 4.061 14.164 ( -4.478 -0.000 0.205) 4.483 14.192 ( 1.687 0.000 0.382) 1.730 14.745 ( 1.961 0.000 1.273) 2.338 15.089 ( 5.656 0.000 -5.259) 7.723 20.088 ( 0.383 0.000 0.272) 0.470 21.074 ( -3.335 -0.000 -22.311) 22.559 21.445 ( -0.445 -0.000 5.841) 5.857 21.680 ( -1.281 -0.000 4.714) 4.885 21.876 ( -13.827 -0.000 17.110) 21.998 22.525 ( -3.650 -0.000 -0.401) 3.672 23.347 ( 5.637 0.000 3.605) 6.691 23.438 ( 1.860 0.000 -2.561) 3.165 23.767 ( -9.418 -0.000 6.873) 11.659 25.011 ( -0.456 -0.000 -1.921) 1.975 25.246 ( 2.254 0.000 -1.732) 2.842 25.379 ( 13.700 0.000 -6.240) 15.054 ======================= Grid point 66 (31/128) ======================= q-point: ( 0.43 0.29 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.951 ( 2.304 7.041 5.399) 9.167 2.216 ( 2.542 -7.407 16.088) 17.893 2.443 ( 17.465 -7.876 14.409) 23.972 2.623 ( 5.479 -1.692 9.419) 11.027 2.770 ( 8.688 24.419 3.617) 26.170 3.188 ( -14.484 0.891 4.171) 15.099 3.374 ( 10.253 -1.056 1.340) 10.395 3.817 ( 9.502 -8.018 -3.819) 13.006 3.861 ( 3.355 -5.861 -2.178) 7.096 4.161 ( -0.211 3.425 -1.943) 3.943 4.337 ( 4.141 8.957 6.190) 11.648 4.625 ( 0.729 -2.399 1.016) 2.705 4.678 ( 14.738 -2.635 8.642) 17.287 4.862 ( -0.084 4.188 -3.743) 5.618 5.027 ( 0.540 0.131 0.568) 0.795 5.213 ( -5.488 2.669 1.151) 6.210 5.438 ( 0.760 -3.692 0.044) 3.769 5.561 ( -6.522 -6.879 -9.020) 13.085 5.770 ( -5.565 4.339 -5.431) 8.905 6.030 ( -0.794 5.119 2.594) 5.793 6.211 ( -6.762 -0.392 -4.441) 8.099 6.310 ( -0.424 -0.805 5.041) 5.123 6.528 ( -1.637 2.325 -0.417) 2.874 6.764 ( 2.933 -6.182 -3.918) 7.885 6.963 ( -2.611 -0.502 -5.493) 6.102 7.366 ( -11.611 2.087 4.633) 12.674 7.443 ( -0.008 4.929 -1.595) 5.180 7.749 ( 0.773 0.629 3.493) 3.633 8.183 ( -4.736 3.778 6.273) 8.721 8.413 ( 4.573 -1.747 -4.357) 6.553 8.633 ( 4.950 -2.953 -0.034) 5.765 8.801 ( -3.976 2.310 -0.725) 4.655 9.036 ( -1.317 -2.175 -4.388) 5.072 9.179 ( 0.403 -4.547 -1.099) 4.695 9.390 ( -4.026 -0.125 13.645) 14.228 9.583 ( -10.395 6.311 -3.243) 12.586 10.192 ( 0.330 -1.548 -0.387) 1.629 10.255 ( -0.146 -4.634 -1.248) 4.801 10.603 ( 1.559 -10.743 -1.383) 10.943 12.035 ( 5.919 2.946 -8.543) 10.803 12.639 ( -3.270 1.106 -2.572) 4.305 12.887 ( 3.097 1.129 11.938) 12.385 13.668 ( -3.133 -1.588 -5.069) 6.167 13.774 ( 1.539 0.745 9.986) 10.132 14.111 ( -4.625 -1.404 -0.063) 4.834 14.211 ( 1.031 0.187 0.873) 1.364 14.774 ( 1.714 -0.604 0.108) 1.820 15.137 ( 4.118 0.517 -4.757) 6.313 20.092 ( 0.204 0.165 0.092) 0.278 20.900 ( -6.638 3.672 -15.199) 16.987 21.450 ( -1.069 0.398 4.259) 4.409 21.689 ( -0.466 -0.417 5.148) 5.186 21.789 ( -7.772 -0.238 13.571) 15.640 22.528 ( -2.102 -5.841 -0.173) 6.210 23.247 ( 5.516 13.775 2.315) 15.018 23.527 ( 0.626 -0.581 2.564) 2.702 23.759 ( -7.563 -9.839 3.383) 12.863 25.021 ( 0.319 -2.170 -1.754) 2.809 25.265 ( 1.487 0.142 -2.229) 2.683 25.509 ( 10.262 1.168 -6.738) 12.331 ======================= Grid point 67 (32/128) ======================= q-point: (-0.43 0.29 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.835 ( -2.085 11.889 12.372) 17.284 2.389 ( 0.778 -4.598 10.477) 11.468 2.480 ( 8.179 30.121 4.033) 31.471 2.692 ( -0.161 -0.734 -0.858) 1.140 2.847 ( 9.827 -5.371 18.821) 21.901 3.072 ( -7.410 -5.184 8.945) 12.720 3.396 ( -1.036 3.242 -2.709) 4.350 3.833 ( -2.608 8.953 -4.563) 10.381 3.938 ( 2.470 3.733 0.895) 4.565 4.192 ( 5.444 4.079 5.031) 8.460 4.319 ( 3.760 0.552 1.679) 4.155 4.514 ( -10.803 1.905 -6.455) 12.728 4.798 ( -0.565 2.012 1.195) 2.407 4.826 ( 8.268 9.109 4.074) 12.959 4.961 ( -1.552 -1.150 -7.221) 7.475 5.246 ( -1.805 -5.931 6.739) 9.157 5.357 ( -7.134 4.235 -15.970) 17.997 5.593 ( -1.636 0.649 -0.075) 1.762 5.695 ( 0.728 -10.954 0.569) 10.993 6.034 ( 4.379 3.015 12.758) 13.821 6.156 ( -2.075 -1.030 -3.484) 4.184 6.344 ( 2.289 -0.149 2.921) 3.714 6.554 ( 4.370 -1.680 -1.735) 4.993 6.857 ( -1.207 -2.311 -1.945) 3.253 6.954 ( 2.231 -5.962 -5.209) 8.226 7.249 ( -7.450 -2.520 4.366) 8.995 7.389 ( 2.052 3.793 -1.286) 4.500 7.689 ( -3.159 6.269 4.324) 8.245 8.132 ( -4.153 -3.084 3.507) 6.250 8.425 ( 2.313 2.443 -6.970) 7.739 8.705 ( -0.802 -3.933 0.917) 4.118 8.821 ( 1.504 -3.519 0.110) 3.829 9.039 ( 2.554 0.425 -5.197) 5.806 9.180 ( -0.078 5.117 0.873) 5.192 9.353 ( -7.528 4.164 0.230) 8.605 9.485 ( -1.834 -11.621 7.573) 13.992 10.266 ( 4.401 -3.759 -1.528) 5.986 10.330 ( -0.762 -6.259 -2.284) 6.706 10.786 ( 0.943 -11.651 0.372) 11.695 11.993 ( 2.524 5.867 -9.288) 11.272 12.558 ( -3.417 1.727 -4.388) 5.824 12.958 ( 2.862 1.379 14.930) 15.265 13.648 ( -2.356 -2.666 -3.743) 5.164 13.818 ( 1.811 0.307 6.926) 7.166 14.070 ( -5.030 -1.838 -1.042) 5.456 14.220 ( 0.172 0.481 1.781) 1.853 14.817 ( 1.912 -1.879 -1.129) 2.909 15.150 ( 2.690 1.558 -4.482) 5.454 20.090 ( -0.052 0.168 -0.389) 0.427 20.703 ( -4.362 5.415 -9.056) 11.417 21.437 ( -0.885 1.163 2.647) 3.023 21.718 ( -0.054 -1.005 6.899) 6.972 21.754 ( -4.690 -0.223 10.700) 11.684 22.619 ( -0.816 -7.947 -0.881) 8.037 23.125 ( 3.204 12.460 2.614) 13.128 23.538 ( 0.224 0.419 6.585) 6.602 23.827 ( -5.056 -9.591 0.782) 10.871 25.064 ( 1.367 -2.683 -1.870) 3.545 25.260 ( 0.306 1.197 -2.168) 2.496 25.581 ( 6.430 0.805 -8.546) 10.725 ======================= Grid point 68 (33/128) ======================= q-point: (-0.29 0.29 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.666 ( 1.173 16.272 19.754) 25.620 2.119 ( 3.084 31.206 8.995) 32.623 2.432 ( -2.070 2.276 4.015) 5.058 2.600 ( -8.421 -0.471 -3.137) 8.998 2.934 ( -5.409 9.981 6.247) 12.958 3.155 ( 6.551 5.658 4.938) 9.965 3.284 ( -10.144 -5.790 5.934) 13.101 3.623 ( 1.359 14.970 10.875) 18.553 3.909 ( 3.701 1.693 3.538) 5.392 4.116 ( -5.098 10.757 -2.658) 12.197 4.220 ( 1.037 6.021 2.103) 6.462 4.506 ( 1.751 -0.551 -8.556) 8.750 4.712 ( -2.791 2.873 0.447) 4.030 4.815 ( 2.957 2.734 -1.867) 4.439 4.996 ( 2.364 -4.163 -5.342) 7.173 5.128 ( -0.325 1.511 -18.579) 18.643 5.346 ( -3.599 -4.269 9.143) 10.713 5.608 ( -2.933 -3.960 2.294) 5.435 5.857 ( 0.876 -5.364 3.613) 6.527 6.088 ( 2.040 3.997 11.440) 12.289 6.202 ( 6.650 -4.220 -0.170) 7.878 6.383 ( 1.463 0.065 4.312) 4.554 6.602 ( -1.285 -0.663 -0.159) 1.455 6.875 ( 7.107 0.837 -5.086) 8.779 7.027 ( -6.474 -6.244 -5.490) 10.537 7.287 ( -2.761 -7.257 4.486) 8.967 7.364 ( 1.631 2.137 -1.926) 3.307 7.594 ( -0.910 1.265 5.320) 5.543 8.156 ( -4.610 -6.010 -0.032) 7.575 8.417 ( 3.455 0.219 -4.414) 5.610 8.723 ( -1.130 0.590 -0.626) 1.420 8.849 ( -5.396 -3.103 -3.739) 7.261 9.002 ( -0.233 2.227 -4.319) 4.865 9.171 ( 8.313 2.312 2.521) 8.989 9.280 ( -2.300 -1.199 3.107) 4.047 9.679 ( -2.821 -14.364 3.334) 15.013 10.381 ( 3.200 -1.959 -5.367) 6.549 10.386 ( 0.802 -4.276 -0.019) 4.351 10.996 ( 3.093 -12.426 2.035) 12.966 11.869 ( -0.533 7.493 -9.281) 11.940 12.465 ( -3.749 2.123 -2.920) 5.204 13.034 ( 0.888 -0.129 16.103) 16.128 13.641 ( -3.583 -2.262 -1.350) 4.448 13.872 ( 2.747 -0.863 3.482) 4.518 14.024 ( -2.789 -0.846 -2.621) 3.919 14.209 ( -1.318 1.119 2.170) 2.775 14.858 ( 0.249 -1.555 -1.644) 2.277 15.136 ( 1.404 1.575 -5.796) 6.168 20.085 ( -0.191 -0.077 -0.772) 0.799 20.592 ( 4.416 4.405 -5.108) 8.062 21.413 ( -0.380 1.869 2.415) 3.077 21.737 ( -4.119 -0.820 8.516) 9.495 21.777 ( 1.249 -1.308 11.612) 11.752 22.700 ( -0.941 -4.434 -1.909) 4.918 22.961 ( -2.184 11.828 2.305) 12.246 23.581 ( -3.105 -4.655 6.193) 8.346 23.944 ( 3.093 -8.546 2.083) 9.324 25.118 ( 2.164 -1.919 -1.960) 3.494 25.224 ( -0.320 2.406 -1.618) 2.917 25.582 ( 0.233 1.095 -12.449) 12.499 ======================= Grid point 69 (34/128) ======================= q-point: (-0.14 0.29 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.561 ( 7.857 16.982 22.766) 29.469 1.721 ( -1.248 26.437 16.357) 31.113 2.323 ( -0.880 7.521 2.428) 7.952 2.518 ( -3.324 0.638 -4.840) 5.907 2.616 ( -7.807 14.814 4.335) 17.297 2.959 ( 3.027 18.315 0.085) 18.564 3.442 ( -0.199 -6.920 15.210) 16.712 3.476 ( -5.982 5.867 6.698) 10.728 3.916 ( -1.428 3.579 0.852) 3.947 4.025 ( 4.374 -1.301 2.234) 5.081 4.171 ( 6.620 7.984 4.598) 11.345 4.365 ( -0.416 9.921 -5.015) 11.124 4.641 ( -3.979 5.104 -9.728) 11.684 4.860 ( 7.035 -2.872 -5.592) 9.435 4.971 ( 0.808 0.354 -3.266) 3.383 5.248 ( 5.241 3.648 0.477) 6.403 5.386 ( 1.196 -12.676 -0.771) 12.756 5.640 ( -3.065 -5.197 0.925) 6.104 5.852 ( -4.763 4.172 9.606) 11.505 6.112 ( 0.399 1.005 3.902) 4.049 6.371 ( 6.342 -4.262 1.699) 7.828 6.435 ( -0.157 -3.861 3.005) 4.895 6.572 ( -4.564 -3.029 -0.846) 5.543 6.944 ( 4.592 4.488 -6.098) 8.855 6.974 ( -5.785 -5.789 -0.404) 8.194 7.302 ( -3.178 -4.123 0.896) 5.282 7.423 ( -0.738 -6.853 -1.193) 6.995 7.662 ( 2.642 -2.530 6.159) 7.164 8.167 ( -4.207 -4.052 -1.735) 6.093 8.456 ( 2.959 0.407 -2.323) 3.784 8.652 ( -4.903 3.338 -3.064) 6.676 8.806 ( 1.027 -2.126 -0.802) 2.494 9.006 ( -2.641 -5.455 -5.768) 8.367 9.268 ( 3.571 -0.474 7.034) 7.903 9.315 ( 3.398 -0.622 0.816) 3.549 9.838 ( -5.613 -13.291 0.408) 14.434 10.359 ( -1.457 2.343 -4.308) 5.116 10.452 ( 2.215 -0.329 -3.683) 4.311 11.212 ( 1.396 -6.672 0.949) 6.882 11.708 ( -1.286 6.177 -7.288) 9.640 12.393 ( -2.061 0.652 2.606) 3.386 13.085 ( -5.436 -2.022 14.360) 15.488 13.592 ( -4.694 0.082 -0.082) 4.695 13.943 ( 2.579 -1.998 1.397) 3.549 14.028 ( 3.868 -0.546 -2.872) 4.849 14.165 ( -2.675 1.702 2.101) 3.803 14.845 ( -2.862 0.169 -1.840) 3.406 15.089 ( 0.615 3.315 -7.118) 7.876 20.080 ( -0.291 -0.165 -0.835) 0.899 20.700 ( 17.041 -2.409 -7.578) 18.805 21.394 ( 0.190 1.788 3.446) 3.887 21.723 ( -3.358 -0.232 7.377) 8.108 21.902 ( 2.068 -5.432 20.687) 21.488 22.687 ( -4.955 3.224 -1.487) 6.096 22.763 ( -3.335 5.677 0.761) 6.628 23.609 ( -6.902 -5.906 2.897) 9.535 24.181 ( 9.412 -7.982 4.354) 13.087 25.154 ( 0.475 0.503 -1.170) 1.359 25.180 ( 1.640 2.101 -1.651) 3.136 25.426 ( -7.990 6.025 -17.376) 20.052 ======================= Grid point 73 (35/128) ======================= q-point: ( 0.43 0.43 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.123 ( 3.326 0.000 2.245) 4.013 2.156 ( -2.549 -0.000 22.794) 22.936 2.669 ( 13.770 0.000 13.335) 19.168 2.726 ( 4.583 0.000 8.398) 9.567 2.971 ( -15.328 -0.000 6.769) 16.756 3.123 ( 3.355 0.000 5.710) 6.622 3.487 ( 5.304 0.000 1.966) 5.657 3.700 ( 2.870 0.000 -11.023) 11.390 3.998 ( 9.493 0.000 -0.210) 9.495 4.102 ( -3.125 -0.000 -8.559) 9.112 4.528 ( 2.623 0.000 10.612) 10.931 4.585 ( -4.335 -0.000 -3.576) 5.620 4.831 ( 5.860 0.000 7.622) 9.615 4.921 ( 1.527 0.000 1.758) 2.328 5.046 ( -8.796 -0.000 -8.290) 12.087 5.164 ( 8.271 0.000 7.890) 11.431 5.399 ( -3.320 -0.000 -10.967) 11.458 5.440 ( 1.928 0.000 -1.365) 2.362 5.695 ( -4.662 -0.000 -8.785) 9.945 6.086 ( -5.325 -0.000 -4.708) 7.108 6.142 ( 6.145 0.000 10.879) 12.495 6.321 ( -0.294 -0.000 7.470) 7.476 6.502 ( -2.709 -0.000 0.647) 2.785 6.749 ( 5.836 0.000 -5.355) 7.921 6.897 ( -2.867 -0.000 -7.301) 7.843 7.226 ( -11.908 -0.000 6.954) 13.790 7.498 ( 2.241 0.000 -1.407) 2.646 7.780 ( 0.582 0.000 2.164) 2.241 8.121 ( -9.866 -0.000 4.845) 10.991 8.484 ( 7.006 0.000 -6.139) 9.315 8.632 ( -1.491 -0.000 -1.963) 2.465 8.757 ( -1.826 -0.000 -1.768) 2.542 8.998 ( 1.646 0.000 -2.946) 3.374 9.167 ( 2.644 0.000 0.347) 2.666 9.381 ( -5.387 -0.000 12.187) 13.325 9.515 ( -5.772 -0.000 -0.289) 5.779 10.132 ( 0.481 0.000 -5.039) 5.062 10.280 ( 0.647 0.000 9.220) 9.243 10.545 ( 3.370 0.000 -3.754) 5.045 12.085 ( 3.420 0.000 -11.952) 12.432 12.585 ( -3.053 -0.000 -5.830) 6.581 12.986 ( 2.125 0.000 15.307) 15.454 13.596 ( -2.234 -0.000 -5.575) 6.006 13.830 ( -0.102 -0.000 10.409) 10.410 14.038 ( -3.444 -0.000 -2.782) 4.427 14.226 ( 0.476 0.000 1.401) 1.479 14.778 ( 0.157 0.000 -0.680) 0.698 15.181 ( 3.597 0.000 -3.737) 5.187 20.093 ( -0.236 -0.000 -0.290) 0.374 20.810 ( -3.219 -0.000 -11.680) 12.116 21.447 ( -1.785 -0.000 4.176) 4.542 21.697 ( -0.893 -0.000 5.535) 5.606 21.762 ( -3.065 -0.000 11.851) 12.240 22.450 ( -1.630 -0.000 -0.274) 1.652 23.474 ( 2.010 0.000 2.814) 3.458 23.483 ( 2.180 0.000 -0.042) 2.180 23.628 ( -4.605 -0.000 6.180) 7.707 25.006 ( 0.899 0.000 -0.868) 1.250 25.272 ( 0.777 0.000 -3.080) 3.177 25.599 ( 5.410 0.000 -7.393) 9.162 ======================= Grid point 74 (36/128) ======================= q-point: (-0.43 0.43 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.054 ( 1.882 9.713 13.439) 16.688 2.316 ( -2.941 -7.252 15.201) 17.097 2.610 ( -13.685 1.642 -1.449) 13.859 2.841 ( -10.420 -10.260 7.854) 16.599 2.971 ( 1.449 22.173 5.975) 23.009 3.026 ( 10.985 -0.972 18.373) 21.429 3.429 ( -2.216 5.700 -3.740) 7.169 3.843 ( 1.622 -3.856 -3.123) 5.220 3.965 ( 3.307 -0.329 -9.504) 10.068 4.204 ( -2.172 -11.956 -3.769) 12.722 4.400 ( -10.350 5.802 -6.838) 13.695 4.500 ( 2.699 10.977 11.557) 16.166 4.814 ( -4.614 3.626 3.508) 6.837 4.878 ( -3.239 -1.369 -9.187) 9.837 5.086 ( 6.498 3.334 8.319) 11.070 5.200 ( 2.378 3.497 4.626) 6.267 5.265 ( -4.419 3.282 -19.416) 20.181 5.519 ( -3.390 -6.265 -0.853) 7.175 5.661 ( 4.863 -0.421 4.964) 6.962 6.082 ( 3.157 -3.474 -3.442) 5.821 6.250 ( 6.440 3.884 13.536) 15.485 6.383 ( 4.140 -2.407 3.535) 5.953 6.532 ( 0.032 -4.009 2.111) 4.531 6.837 ( 0.564 -2.875 -7.629) 8.172 6.855 ( 4.517 -1.662 -6.071) 7.748 7.132 ( -6.465 -2.141 6.474) 9.397 7.482 ( 1.151 4.407 -0.705) 4.609 7.748 ( -2.561 4.635 2.622) 5.909 8.015 ( -7.078 -2.208 1.154) 7.504 8.465 ( -1.587 1.865 -7.599) 7.984 8.650 ( 2.619 -2.104 -1.317) 3.608 8.756 ( -1.985 -2.620 -2.788) 4.310 9.034 ( 1.619 -1.269 -3.745) 4.273 9.224 ( 1.068 -1.700 1.415) 2.456 9.348 ( -5.306 -2.503 8.918) 10.674 9.439 ( 3.687 7.154 3.507) 8.779 10.201 ( 3.125 -6.950 -4.289) 8.744 10.317 ( 1.299 0.094 7.830) 7.937 10.649 ( 1.667 -9.104 -0.238) 9.258 12.041 ( 0.511 3.183 -13.423) 13.805 12.513 ( -3.030 1.082 -6.018) 6.824 13.054 ( 0.091 0.720 15.978) 15.994 13.567 ( -1.614 -1.915 -4.634) 5.267 13.856 ( -0.536 -0.212 7.358) 7.380 13.998 ( -1.139 -0.613 -3.990) 4.195 14.233 ( -0.281 0.420 2.560) 2.610 14.783 ( -0.890 -1.985 -1.814) 2.832 15.198 ( 2.259 1.595 -2.943) 4.039 20.085 ( -0.521 0.029 -0.794) 0.950 20.735 ( 2.764 3.806 -9.027) 10.179 21.436 ( -1.737 -0.110 2.961) 3.434 21.703 ( -2.226 -0.687 6.417) 6.827 21.786 ( 0.789 0.667 11.637) 11.683 22.487 ( -0.366 -6.478 -0.834) 6.541 23.330 ( -0.723 12.101 2.059) 12.296 23.583 ( -1.023 2.333 6.701) 7.169 23.665 ( 1.032 -10.090 2.069) 10.351 25.040 ( 1.533 -2.285 -0.402) 2.781 25.261 ( -0.218 0.351 -3.392) 3.417 25.605 ( 0.480 0.580 -8.945) 8.977 ======================= Grid point 75 (37/128) ======================= q-point: (-0.29 0.43 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.992 ( 3.764 11.109 15.775) 19.658 2.271 ( -17.036 -0.406 4.766) 17.695 2.452 ( -9.773 4.485 -0.340) 10.759 2.651 ( -0.218 17.139 11.183) 20.465 2.812 ( -16.522 -6.795 8.280) 19.691 3.192 ( 2.298 2.055 9.191) 9.694 3.330 ( 3.759 4.602 -0.052) 5.942 3.780 ( -1.381 3.592 -6.035) 7.158 4.025 ( -1.266 -0.131 -0.986) 1.610 4.100 ( -10.099 2.606 -1.240) 10.504 4.368 ( 3.520 2.607 7.108) 8.349 4.461 ( 2.884 -1.490 0.242) 3.255 4.660 ( -7.241 5.009 -3.166) 9.357 4.886 ( 0.234 -8.410 -5.853) 10.249 5.022 ( 5.800 10.299 1.350) 11.897 5.079 ( -1.577 5.071 -18.658) 19.399 5.322 ( 3.216 -3.322 11.186) 12.104 5.514 ( -3.872 -1.990 1.830) 4.722 5.804 ( 3.417 -5.526 2.612) 7.003 6.197 ( 4.744 -3.244 -0.998) 5.833 6.315 ( 5.983 5.539 12.109) 14.598 6.450 ( 0.614 2.828 5.183) 5.936 6.589 ( 1.613 -1.759 1.953) 3.084 6.792 ( -5.621 -3.527 -10.007) 12.007 6.988 ( 9.724 -0.833 -7.401) 12.248 7.145 ( -4.759 -4.826 4.852) 8.335 7.429 ( 0.544 2.872 0.199) 2.929 7.633 ( -1.976 4.364 3.748) 6.082 8.009 ( -3.275 -5.297 -0.568) 6.254 8.425 ( 0.102 -1.816 -4.859) 5.188 8.684 ( -2.883 -0.824 -2.235) 3.740 8.750 ( 0.598 -1.827 -3.502) 3.994 8.995 ( -2.000 3.347 -5.795) 6.985 9.263 ( 1.471 -1.935 3.416) 4.193 9.374 ( 2.594 1.434 7.676) 8.228 9.487 ( 3.440 -3.848 1.900) 5.500 10.309 ( 0.168 -3.786 -1.318) 4.013 10.408 ( 5.010 -3.643 1.256) 6.321 10.855 ( 2.731 -13.667 4.496) 14.644 11.909 ( -2.341 5.818 -13.189) 14.604 12.429 ( -3.217 1.539 -3.934) 5.310 13.079 ( -3.118 0.854 14.395) 14.753 13.562 ( -1.856 -1.944 -2.887) 3.944 13.887 ( 0.286 -1.550 3.800) 4.114 14.006 ( 3.154 -0.788 -3.049) 4.457 14.218 ( -1.640 1.432 2.957) 3.672 14.792 ( -2.505 -2.850 -2.587) 4.593 15.176 ( 1.005 2.731 -3.040) 4.208 20.075 ( -0.436 -0.143 -1.003) 1.103 20.730 ( 9.794 3.300 -8.618) 13.457 21.424 ( -1.438 0.033 2.052) 2.506 21.704 ( -2.556 -0.694 6.513) 7.031 21.852 ( 3.014 0.319 14.710) 15.019 22.592 ( 0.088 -7.061 -2.108) 7.370 23.096 ( -6.475 13.660 1.931) 15.240 23.543 ( -2.593 1.908 5.945) 6.761 23.893 ( 7.460 -10.871 4.490) 13.928 25.103 ( 1.736 -2.805 -0.250) 3.308 25.234 ( -0.505 0.765 -3.057) 3.191 25.521 ( -5.167 1.694 -11.549) 12.765 ======================= Grid point 76 (38/128) ======================= q-point: (-0.14 0.43 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.946 ( 0.783 10.873 12.682) 16.723 1.984 ( -14.203 3.946 4.597) 15.441 2.188 ( -6.716 8.479 6.304) 12.519 2.524 ( -11.444 0.918 2.617) 11.775 2.704 ( 1.689 8.296 7.894) 11.576 3.172 ( 0.543 1.517 -1.422) 2.149 3.343 ( -1.648 0.892 8.260) 8.470 3.686 ( -1.132 2.926 0.298) 3.151 3.931 ( -4.410 7.493 6.787) 11.030 4.042 ( 1.570 -3.012 1.183) 3.597 4.340 ( -2.235 6.297 3.505) 7.545 4.503 ( 6.707 3.651 -0.854) 7.684 4.575 ( -2.779 -2.784 -3.110) 5.014 4.915 ( -1.240 1.808 -12.290) 12.484 4.967 ( 3.578 2.077 0.212) 4.143 5.170 ( 7.872 -15.304 -6.760) 18.490 5.393 ( 0.586 3.617 10.870) 11.471 5.504 ( -2.906 -3.302 -0.426) 4.419 5.911 ( 1.467 -0.956 2.739) 3.251 6.194 ( -1.358 6.279 6.004) 8.793 6.343 ( -1.493 2.446 3.839) 4.791 6.403 ( -0.382 -0.171 -2.725) 2.757 6.640 ( 4.982 2.006 2.314) 5.848 6.739 ( -5.780 -3.364 -5.500) 8.659 7.001 ( -4.308 -2.074 -5.287) 7.129 7.220 ( 4.149 -2.981 2.723) 5.789 7.393 ( 0.851 2.332 -0.816) 2.613 7.647 ( -0.330 -3.553 4.891) 6.054 8.058 ( -0.734 -4.440 -0.453) 4.523 8.470 ( 1.703 -2.908 -1.575) 3.720 8.615 ( -3.490 0.996 -2.247) 4.269 8.789 ( 1.680 -1.447 -2.686) 3.483 8.897 ( -1.605 1.174 -6.375) 6.678 9.332 ( 0.983 -2.814 1.153) 3.196 9.431 ( 6.264 4.154 9.196) 11.877 9.591 ( -2.236 -7.791 -0.511) 8.122 10.331 ( -0.864 -0.901 -2.597) 2.881 10.491 ( 3.063 0.531 -2.379) 3.915 11.130 ( 3.630 -10.569 4.610) 12.088 11.733 ( -2.525 4.804 -10.378) 11.712 12.374 ( -1.753 -0.530 1.394) 2.302 13.039 ( -6.797 1.467 9.578) 11.836 13.556 ( -0.577 -0.958 -0.174) 1.132 13.930 ( 0.352 -1.651 0.069) 1.690 14.081 ( 5.204 -0.905 0.637) 5.321 14.175 ( -1.121 1.936 2.598) 3.428 14.772 ( -3.789 -1.583 -2.483) 4.798 15.132 ( 0.834 2.675 -3.793) 4.716 20.071 ( -0.112 -0.272 -0.820) 0.872 20.841 ( 13.187 -1.294 -12.972) 18.543 21.413 ( -1.215 0.040 2.414) 2.703 21.702 ( -2.450 -0.382 6.152) 6.633 21.974 ( 3.618 -1.239 21.676) 22.011 22.641 ( -2.744 -0.523 -3.562) 4.527 22.800 ( -7.680 8.854 1.411) 11.805 23.509 ( -2.990 0.148 4.950) 5.784 24.204 ( 10.122 -9.649 5.579) 15.056 25.150 ( 0.129 -0.985 -0.003) 0.994 25.215 ( 1.081 0.336 -3.143) 3.341 25.327 ( -8.372 4.278 -13.787) 16.687 ======================= Grid point 81 (39/128) ======================= q-point: (-0.43 -0.43 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.190 ( -2.598 -0.000 5.110) 5.733 2.289 ( -2.366 -0.000 21.675) 21.804 2.347 ( -22.934 -0.000 6.058) 23.721 2.589 ( -15.208 -0.000 1.938) 15.331 3.160 ( -4.824 -0.000 8.186) 9.501 3.253 ( 11.918 0.000 15.487) 19.541 3.444 ( -2.651 -0.000 -1.109) 2.874 3.807 ( 2.656 0.000 -1.576) 3.089 3.862 ( -19.787 -0.000 -4.886) 20.381 4.028 ( 2.079 0.000 -11.452) 11.639 4.278 ( -6.257 -0.000 -10.962) 12.622 4.624 ( -1.454 -0.000 9.017) 9.133 4.761 ( -8.119 -0.000 3.791) 8.961 4.794 ( -5.036 -0.000 -7.350) 8.910 5.174 ( -1.989 -0.000 -19.565) 19.666 5.245 ( 10.937 0.000 11.159) 15.625 5.359 ( 1.069 0.000 4.069) 4.207 5.400 ( -0.369 -0.000 3.021) 3.043 5.736 ( 3.052 0.000 4.382) 5.340 6.095 ( 4.095 0.000 -1.174) 4.260 6.412 ( 2.968 0.000 8.095) 8.622 6.419 ( 5.881 0.000 -0.078) 5.882 6.551 ( 5.431 0.000 9.777) 11.184 6.807 ( 3.053 0.000 -12.266) 12.640 6.922 ( 8.831 0.000 -7.551) 11.619 7.089 ( -0.323 -0.000 7.936) 7.943 7.506 ( -2.742 -0.000 0.041) 2.743 7.757 ( -3.633 -0.000 1.681) 4.003 7.914 ( -3.501 -0.000 -1.594) 3.847 8.387 ( -4.299 -0.000 -6.860) 8.096 8.663 ( -3.760 -0.000 -1.812) 4.173 8.703 ( 3.575 0.000 -5.883) 6.884 9.054 ( 2.439 0.000 -1.147) 2.696 9.235 ( 3.469 0.000 3.094) 4.649 9.301 ( -4.764 -0.000 8.539) 9.779 9.602 ( 8.617 0.000 3.702) 9.379 10.184 ( 4.544 0.000 -3.156) 5.533 10.374 ( 0.355 0.000 13.962) 13.966 10.578 ( 0.332 0.000 -1.959) 1.987 12.002 ( -1.747 -0.000 -15.713) 15.810 12.462 ( -2.704 -0.000 -5.785) 6.386 13.098 ( -2.675 -0.000 14.497) 14.742 13.518 ( -1.085 -0.000 -3.945) 4.091 13.863 ( -0.831 -0.000 4.798) 4.869 13.992 ( 3.086 0.000 -3.703) 4.820 14.240 ( -1.185 -0.000 3.635) 3.824 14.739 ( -1.877 -0.000 -2.495) 3.122 15.223 ( 0.642 0.000 -2.026) 2.125 20.073 ( -0.573 -0.000 -1.129) 1.266 20.804 ( 8.211 0.000 -11.433) 14.076 21.414 ( -2.508 -0.000 2.577) 3.596 21.693 ( -1.973 -0.000 6.116) 6.427 21.866 ( 3.112 0.000 14.367) 14.700 22.442 ( 1.632 0.000 -0.524) 1.714 23.471 ( -4.069 -0.000 2.683) 4.874 23.542 ( 0.992 0.000 2.525) 2.713 23.634 ( 2.046 0.000 7.315) 7.595 25.045 ( 1.786 0.000 0.566) 1.874 25.241 ( -0.977 -0.000 -4.059) 4.175 25.548 ( -4.443 -0.000 -10.168) 11.096 ======================= Grid point 82 (40/128) ======================= q-point: (-0.29 -0.43 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.954 ( -22.606 1.904 2.552) 22.829 2.130 ( -24.664 -3.027 -1.474) 24.893 2.304 ( 1.271 1.652 16.125) 16.260 2.544 ( -8.444 -8.642 10.648) 16.105 2.943 ( -6.482 16.431 14.216) 22.674 3.321 ( -0.862 8.408 0.341) 8.459 3.418 ( -2.095 -1.179 7.042) 7.441 3.593 ( -16.702 -2.961 -2.433) 17.136 3.901 ( -0.156 -6.260 -1.875) 6.537 4.019 ( -0.664 -2.720 -6.758) 7.315 4.243 ( -3.212 -8.095 -7.370) 11.408 4.572 ( -7.253 5.106 6.014) 10.717 4.627 ( -3.732 0.716 -0.452) 3.826 4.748 ( -2.789 -5.488 -3.361) 7.014 5.069 ( 1.355 4.461 -15.502) 16.188 5.276 ( 3.180 9.855 3.706) 10.999 5.410 ( 1.380 0.022 13.822) 13.890 5.483 ( 6.221 -1.069 1.235) 6.432 5.806 ( 3.279 -2.418 2.240) 4.649 6.168 ( 0.323 -5.097 -0.642) 5.147 6.440 ( 1.418 1.339 -2.244) 2.973 6.482 ( 0.604 1.022 4.096) 4.264 6.666 ( 5.830 3.794 12.256) 14.093 6.807 ( 9.030 2.806 -11.782) 15.107 6.977 ( -1.970 0.573 -7.158) 7.446 7.179 ( 9.193 -0.458 2.959) 9.669 7.453 ( -0.743 0.963 0.842) 1.480 7.667 ( -4.555 3.379 1.751) 5.936 7.923 ( 1.265 -3.327 -1.042) 3.709 8.351 ( -0.754 -3.175 -4.907) 5.893 8.592 ( -5.878 -1.704 -2.278) 6.530 8.757 ( 4.115 -2.057 -6.423) 7.900 9.027 ( -0.474 4.342 -2.368) 4.968 9.266 ( -2.055 1.736 6.540) 7.072 9.350 ( 5.140 -3.579 4.308) 7.602 9.696 ( 10.167 6.041 3.531) 12.342 10.266 ( 2.097 -3.159 -1.071) 3.940 10.435 ( 2.716 -1.109 7.744) 8.281 10.694 ( 1.150 -13.709 6.145) 15.067 11.879 ( -4.068 3.118 -15.692) 16.508 12.396 ( -2.644 1.215 -4.009) 4.953 13.085 ( -5.028 1.097 11.085) 12.221 13.506 ( -0.938 -1.717 -2.318) 3.033 13.881 ( 0.782 -1.055 1.912) 2.320 14.058 ( 6.809 -0.511 -0.575) 6.853 14.222 ( -2.346 0.883 3.534) 4.333 14.713 ( -2.390 -1.476 -2.749) 3.931 15.200 ( -1.090 1.472 -2.010) 2.719 20.064 ( -0.169 -0.136 -1.107) 1.128 20.873 ( 10.881 1.936 -14.568) 18.286 21.393 ( -2.708 -0.973 1.545) 3.266 21.691 ( -1.883 -0.212 6.036) 6.327 21.978 ( 5.590 0.771 17.663) 18.542 22.513 ( 2.771 -4.466 -0.820) 5.319 23.227 ( -8.227 16.615 2.983) 18.778 23.580 ( -0.554 1.675 4.646) 4.970 23.832 ( 7.098 -13.424 7.028) 16.733 25.089 ( 1.618 -2.015 0.929) 2.746 25.211 ( -1.179 -0.265 -4.063) 4.238 25.406 ( -8.721 1.192 -12.230) 15.068 ======================= Grid point 83 (41/128) ======================= q-point: (-0.14 -0.43 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.643 ( -25.597 -3.066 0.198) 25.780 1.811 ( -23.312 -7.196 -1.061) 24.420 2.324 ( -2.744 6.810 5.154) 8.971 2.545 ( -1.135 -1.181 16.664) 16.745 2.821 ( -2.092 2.989 19.458) 19.798 3.188 ( 0.136 5.721 -3.127) 6.521 3.351 ( -19.140 -12.992 1.707) 23.196 3.453 ( -2.209 6.858 1.095) 7.288 3.963 ( -0.549 -5.498 -1.848) 5.826 4.025 ( -1.683 0.632 1.140) 2.129 4.293 ( -8.454 -8.079 0.516) 11.705 4.441 ( -3.137 0.290 0.659) 3.219 4.650 ( 3.573 -1.722 0.734) 4.034 4.825 ( -1.098 -6.071 -6.769) 9.158 5.004 ( 3.780 -0.090 -7.828) 8.694 5.209 ( 4.766 6.649 2.243) 8.483 5.397 ( -4.930 -0.784 4.176) 6.508 5.584 ( 7.518 5.193 6.489) 11.207 5.901 ( 2.959 -3.447 -1.010) 4.654 6.181 ( -8.428 -0.378 2.509) 8.802 6.394 ( 1.508 2.420 -9.409) 9.831 6.453 ( 0.667 5.423 4.259) 6.927 6.646 ( 1.479 7.237 3.887) 8.347 6.832 ( -8.842 0.781 -2.474) 9.215 6.895 ( 11.686 3.869 -1.732) 12.431 7.315 ( 7.877 0.012 -0.514) 7.894 7.443 ( 0.522 2.921 -0.744) 3.059 7.603 ( -3.000 -1.273 3.351) 4.674 8.026 ( 5.006 -3.552 1.098) 6.235 8.416 ( 1.467 -5.596 -1.534) 5.985 8.556 ( -2.289 -2.706 -1.483) 3.842 8.781 ( 0.579 1.333 -8.967) 9.084 8.956 ( 2.773 3.668 -1.510) 4.840 9.248 ( -3.627 -2.102 2.312) 4.787 9.465 ( 2.459 -2.020 3.607) 4.811 9.739 ( 9.617 8.276 4.613) 13.501 10.304 ( 0.190 -1.062 -0.673) 1.271 10.512 ( 1.606 -1.588 0.347) 2.285 11.027 ( 6.228 -15.547 9.767) 19.388 11.704 ( -4.362 3.401 -13.106) 14.225 12.344 ( -1.654 -0.452 0.285) 1.738 13.011 ( -6.196 2.511 6.719) 9.478 13.528 ( 0.039 -2.641 0.422) 2.674 13.921 ( 1.585 -0.795 -1.035) 2.053 14.140 ( 0.988 1.289 4.144) 4.451 14.215 ( 4.176 0.029 2.719) 4.983 14.695 ( -1.961 -1.812 -2.658) 3.768 15.147 ( -1.516 1.365 -2.979) 3.611 20.065 ( 0.325 -0.265 -0.799) 0.902 20.928 ( 8.315 0.902 -18.578) 20.374 21.381 ( -2.529 -1.534 1.340) 3.247 21.691 ( -1.781 -0.157 5.993) 6.254 22.121 ( 5.376 1.786 22.963) 23.652 22.587 ( -0.836 -0.969 -3.100) 3.353 22.838 ( -10.922 12.792 3.076) 17.100 23.554 ( 0.947 4.103 5.218) 6.705 24.204 ( 10.559 -12.833 7.329) 18.163 25.134 ( -0.137 -1.024 0.241) 1.061 25.154 ( -6.809 0.426 -11.680) 13.526 25.253 ( -1.083 -1.171 -5.883) 6.095 ======================= Grid point 89 (42/128) ======================= q-point: (-0.29 -0.29 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.624 ( -28.162 -0.000 0.801) 28.173 1.712 ( -29.551 -0.000 2.798) 29.683 2.334 ( -14.520 -0.000 16.372) 21.883 2.390 ( -3.674 -0.000 -0.194) 3.679 2.964 ( -17.241 -0.000 14.354) 22.435 3.158 ( -15.905 -0.000 6.263) 17.093 3.356 ( -3.157 -0.000 9.083) 9.616 3.632 ( 6.181 0.000 6.510) 8.977 3.856 ( 2.648 0.000 -4.255) 5.012 3.927 ( -4.124 -0.000 -11.366) 12.091 4.080 ( -6.548 -0.000 -7.913) 10.271 4.461 ( -10.772 -0.000 0.732) 10.797 4.602 ( -0.886 -0.000 0.395) 0.970 4.646 ( -3.431 -0.000 0.164) 3.435 5.108 ( 4.093 0.000 -7.729) 8.745 5.343 ( -3.934 -0.000 1.652) 4.267 5.423 ( -2.894 -0.000 4.380) 5.250 5.648 ( 9.912 0.000 8.261) 12.903 5.828 ( 2.272 0.000 1.108) 2.528 6.117 ( 0.374 0.000 -0.646) 0.747 6.444 ( 1.949 0.000 -9.628) 9.824 6.562 ( 3.532 0.000 6.125) 7.070 6.834 ( 5.379 0.000 8.967) 10.457 6.913 ( 10.590 0.000 -8.809) 13.775 6.963 ( -2.148 -0.000 -6.231) 6.591 7.300 ( 7.428 0.000 -1.572) 7.593 7.472 ( 3.197 0.000 0.995) 3.348 7.613 ( -7.036 -0.000 1.936) 7.298 7.954 ( 7.334 0.000 0.418) 7.346 8.301 ( 0.032 0.000 -5.065) 5.066 8.491 ( -3.918 -0.000 -1.713) 4.276 8.756 ( 2.328 0.000 -6.114) 6.542 9.023 ( -3.348 -0.000 -2.819) 4.377 9.334 ( 1.849 0.000 5.297) 5.611 9.426 ( 6.819 0.000 4.343) 8.084 9.897 ( 10.212 0.000 2.606) 10.539 10.275 ( 3.175 0.000 -0.708) 3.253 10.536 ( -2.593 -0.000 0.529) 2.646 10.567 ( 5.027 0.000 22.936) 23.481 11.776 ( -5.735 -0.000 -15.938) 16.939 12.360 ( -2.156 -0.000 -2.850) 3.574 13.054 ( -5.774 -0.000 7.958) 9.833 13.471 ( -1.032 -0.000 -1.195) 1.579 13.900 ( 2.632 0.000 0.119) 2.634 14.176 ( 10.056 0.000 2.590) 10.384 14.202 ( -3.090 -0.000 3.241) 4.478 14.662 ( -2.221 -0.000 -2.544) 3.377 15.172 ( -3.465 -0.000 -1.837) 3.922 20.061 ( 0.395 0.000 -0.961) 1.039 20.963 ( 9.118 0.000 -20.745) 22.661 21.347 ( -3.149 -0.000 1.151) 3.352 21.688 ( -1.632 -0.000 6.219) 6.430 22.152 ( 8.618 0.000 18.139) 20.082 22.535 ( 4.863 0.000 0.205) 4.867 23.345 ( -6.185 -0.000 6.119) 8.700 23.550 ( -1.934 -0.000 2.395) 3.078 23.825 ( 6.933 0.000 10.744) 12.786 25.098 ( 1.186 0.000 1.490) 1.904 25.176 ( -1.109 -0.000 -4.032) 4.182 25.216 ( -12.577 -0.000 -15.029) 19.597 ======================= Grid point 90 (43/128) ======================= q-point: (-0.14 -0.29 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.253 ( -30.946 2.749 3.023) 31.215 1.315 ( -27.237 -9.267 3.375) 28.967 2.219 ( -28.466 -21.863 10.810) 37.485 2.317 ( -6.076 0.184 0.197) 6.082 2.871 ( -7.780 -2.409 20.186) 21.767 3.001 ( -7.479 2.041 9.328) 12.129 3.356 ( 2.879 5.037 6.625) 8.806 3.565 ( -1.190 11.194 -1.494) 11.356 3.869 ( -1.197 -3.102 -5.506) 6.432 3.953 ( -0.669 -6.486 -2.249) 6.897 4.004 ( -10.737 -9.583 -4.010) 14.940 4.357 ( -7.528 -1.915 3.118) 8.370 4.632 ( 2.098 -4.080 -2.433) 5.193 4.679 ( -0.094 -7.055 0.158) 7.057 5.092 ( 2.371 5.920 -2.015) 6.688 5.292 ( -2.038 -1.102 -2.445) 3.368 5.342 ( -5.497 3.228 -0.220) 6.378 5.757 ( 3.511 1.374 4.016) 5.509 5.882 ( 1.532 -2.907 0.404) 3.311 6.133 ( 1.710 3.520 3.907) 5.530 6.434 ( 4.419 1.930 -11.969) 12.904 6.580 ( 2.723 5.662 3.258) 7.077 6.777 ( -6.913 8.491 -4.212) 11.732 6.838 ( 2.230 8.631 4.704) 10.079 7.073 ( 9.849 -1.349 -1.608) 10.070 7.381 ( 3.667 -1.576 -1.308) 4.200 7.491 ( -1.535 2.957 -0.605) 3.387 7.555 ( -0.696 -1.296 2.615) 3.000 8.108 ( 10.907 -0.832 3.114) 11.373 8.323 ( -0.913 -6.105 -3.689) 7.191 8.497 ( 2.134 -3.025 -0.870) 3.802 8.778 ( 2.263 -0.907 -8.842) 9.172 8.954 ( -3.224 -0.331 -2.452) 4.063 9.301 ( 0.088 6.541 3.269) 7.313 9.513 ( 3.329 1.325 2.488) 4.362 9.997 ( 9.416 5.522 2.930) 11.302 10.311 ( 1.708 0.826 0.331) 1.926 10.498 ( -0.590 -1.304 2.860) 3.199 10.938 ( 10.598 -17.238 21.923) 29.834 11.620 ( -5.800 1.487 -13.900) 15.135 12.323 ( -1.269 0.234 0.341) 1.335 12.988 ( -5.363 1.763 6.121) 8.326 13.482 ( -0.319 -3.248 0.873) 3.378 13.945 ( 3.403 0.050 -1.801) 3.850 14.163 ( -1.916 1.214 3.381) 4.071 14.329 ( 8.333 1.686 5.478) 10.114 14.642 ( -0.259 -2.408 -2.617) 3.566 15.106 ( -4.125 -0.342 -2.752) 4.970 20.067 ( 0.787 -0.108 -0.720) 1.072 20.950 ( 2.578 2.139 -25.379) 25.599 21.322 ( -2.663 -1.542 1.133) 3.279 21.691 ( -1.431 -0.016 6.712) 6.863 22.335 ( 9.129 1.443 17.928) 20.170 22.591 ( 1.274 3.010 -0.947) 3.403 22.947 ( -13.791 24.744 9.366) 29.836 23.645 ( 3.662 -1.212 4.106) 5.633 24.160 ( 11.862 -17.847 11.350) 24.250 24.968 ( -11.928 -1.567 -18.566) 22.123 25.120 ( -0.152 -0.827 0.416) 0.938 25.188 ( 0.576 -4.338 -2.981) 5.295 ======================= Grid point 97 (44/128) ======================= q-point: (-0.14 -0.14 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.891 ( -25.779 -0.000 12.563) 28.678 0.898 ( -29.832 -0.000 8.625) 31.054 1.517 ( -42.285 -0.000 18.309) 46.078 2.213 ( -7.052 -0.000 0.038) 7.052 2.835 ( -4.878 -0.000 18.562) 19.192 2.981 ( -5.533 -0.000 8.482) 10.128 3.449 ( 1.732 0.000 10.432) 10.574 3.666 ( -6.425 -0.000 -9.951) 11.845 3.700 ( -10.276 -0.000 -3.017) 10.709 3.803 ( 1.253 0.000 -3.176) 3.414 3.919 ( 3.657 0.000 -2.231) 4.284 4.244 ( -8.034 -0.000 4.618) 9.266 4.604 ( 0.576 0.000 -2.298) 2.369 4.654 ( 2.141 0.000 5.112) 5.542 5.161 ( -2.392 -0.000 -5.659) 6.144 5.186 ( -5.291 -0.000 -4.266) 6.796 5.318 ( 0.712 0.000 -0.604) 0.933 5.761 ( -1.568 -0.000 -1.597) 2.239 5.894 ( 2.303 0.000 1.567) 2.786 6.285 ( 6.287 0.000 8.728) 10.756 6.480 ( 6.434 0.000 -10.776) 12.551 6.642 ( -4.427 -0.000 -6.140) 7.569 6.765 ( -2.900 -0.000 -4.507) 5.359 6.936 ( 0.439 0.000 -0.290) 0.526 7.151 ( 5.460 0.000 1.744) 5.732 7.422 ( 5.582 0.000 6.691) 8.714 7.435 ( -5.674 -0.000 0.964) 5.755 7.601 ( 3.764 0.000 1.656) 4.112 8.222 ( -2.085 -0.000 -3.748) 4.289 8.312 ( 14.390 0.000 5.985) 15.585 8.514 ( 3.516 0.000 -1.097) 3.684 8.753 ( 1.861 0.000 -6.483) 6.745 8.897 ( -3.608 -0.000 -4.095) 5.458 9.333 ( -3.980 -0.000 1.678) 4.319 9.584 ( 2.259 0.000 0.908) 2.435 10.150 ( 6.035 0.000 -0.822) 6.091 10.358 ( 2.924 0.000 -2.568) 3.892 10.498 ( -0.373 -0.000 4.714) 4.729 11.097 ( 19.381 0.000 38.959) 43.514 11.500 ( -5.135 -0.000 -12.533) 13.544 12.319 ( -0.239 -0.000 2.392) 2.404 12.979 ( -0.792 -0.000 11.188) 11.216 13.447 ( -0.644 -0.000 1.618) 1.741 13.991 ( 3.679 0.000 -2.706) 4.567 14.162 ( -0.820 -0.000 2.920) 3.033 14.537 ( 12.709 0.000 5.762) 13.954 14.579 ( -2.371 -0.000 -1.921) 3.052 15.004 ( -7.531 -0.000 -4.216) 8.631 20.076 ( 0.879 0.000 -0.696) 1.121 20.837 ( -7.921 -0.000 -31.848) 32.818 21.284 ( -1.715 -0.000 1.846) 2.520 21.700 ( -1.261 -0.000 7.935) 8.034 22.473 ( 4.553 0.000 3.054) 5.482 22.678 ( 4.452 0.000 0.607) 4.493 23.415 ( 10.210 0.000 24.487) 26.530 23.479 ( -3.530 -0.000 0.440) 3.557 24.172 ( 10.766 0.000 16.214) 19.463 24.628 ( -20.924 -0.000 -24.329) 32.089 25.109 ( -0.438 -0.000 -0.660) 0.792 25.148 ( 0.350 0.000 -1.281) 1.328 ======================= Grid point 98 (45/128) ======================= q-point: ( 0.00 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.125 ( 2.745 0.000 26.992) 27.131 1.190 ( 1.584 0.000 25.305) 25.354 2.172 ( 10.177 0.000 42.217) 43.427 2.218 ( 2.899 0.000 3.867) 4.834 2.668 ( -19.744 -0.000 -1.131) 19.776 3.049 ( -0.061 -0.000 7.622) 7.622 3.077 ( -10.910 -0.000 -8.336) 13.730 3.659 ( 1.833 0.000 4.905) 5.236 3.744 ( 2.577 0.000 -1.651) 3.061 3.935 ( 9.023 0.000 2.004) 9.243 4.084 ( 4.064 0.000 3.447) 5.328 4.283 ( -10.260 -0.000 13.873) 17.255 4.392 ( -7.787 -0.000 -7.342) 10.702 4.764 ( 9.022 0.000 -9.497) 13.099 4.875 ( 0.031 0.000 -8.057) 8.058 5.039 ( -1.704 -0.000 16.088) 16.178 5.664 ( 6.225 0.000 9.355) 11.237 5.738 ( 6.695 0.000 -4.111) 7.856 5.927 ( -0.811 -0.000 -6.352) 6.404 6.355 ( 7.338 0.000 -14.754) 16.478 6.408 ( -8.258 -0.000 8.071) 11.547 6.479 ( -3.518 -0.000 6.954) 7.793 6.739 ( -6.321 -0.000 -5.004) 8.062 6.896 ( -2.377 -0.000 3.463) 4.200 7.234 ( -5.081 -0.000 3.034) 5.918 7.365 ( 4.139 0.000 -1.696) 4.474 7.646 ( 4.246 0.000 -5.854) 7.232 7.825 ( 5.466 0.000 -2.420) 5.977 8.125 ( 3.111 0.000 -4.310) 5.316 8.311 ( -1.958 -0.000 -12.578) 12.730 8.720 ( -7.518 -0.000 1.482) 7.663 8.831 ( 8.793 0.000 -0.013) 8.793 8.983 ( 10.859 0.000 7.221) 13.041 9.442 ( 2.904 0.000 9.274) 9.718 9.475 ( -6.574 -0.000 -3.281) 7.348 10.087 ( 1.644 0.000 -6.898) 7.091 10.208 ( -0.696 -0.000 -8.353) 8.382 10.536 ( -7.118 -0.000 -2.266) 7.470 11.347 ( 10.023 0.000 -1.881) 10.198 11.441 ( -18.899 -0.000 1.864) 18.991 12.575 ( 2.186 0.000 12.552) 12.741 13.560 ( 3.584 0.000 3.389) 4.932 13.847 ( 1.520 0.000 -1.575) 2.188 13.943 ( 1.561 0.000 -5.688) 5.899 14.050 ( -20.044 -0.000 -0.108) 20.045 14.171 ( -4.755 -0.000 1.108) 4.882 14.563 ( 4.278 0.000 0.492) 4.307 14.771 ( 1.827 0.000 -1.635) 2.452 20.067 ( 0.211 0.000 -0.653) 0.686 20.427 ( 11.462 0.000 -6.681) 13.267 21.426 ( 1.980 0.000 7.891) 8.136 21.929 ( -5.918 -0.000 9.570) 11.252 22.510 ( 6.048 0.000 0.313) 6.056 22.736 ( -1.645 -0.000 -0.297) 1.672 23.369 ( -1.560 -0.000 -1.966) 2.510 23.479 ( -16.162 -0.000 -4.541) 16.788 24.265 ( 17.931 0.000 3.020) 18.184 24.645 ( -9.388 -0.000 6.281) 11.295 25.049 ( -0.088 -0.000 -2.949) 2.950 25.119 ( 0.686 0.000 -2.483) 2.576 ======================= Grid point 99 (46/128) ======================= q-point: ( 0.14 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.450 ( 6.911 -15.475 22.425) 28.109 1.500 ( 16.131 -12.643 20.336) 28.872 2.291 ( 7.742 0.921 9.573) 12.346 2.437 ( -15.600 -3.249 2.218) 16.088 2.609 ( 13.371 -9.430 18.702) 24.849 2.775 ( -5.569 9.882 1.940) 11.508 3.243 ( 0.143 -11.739 8.775) 14.657 3.709 ( 1.464 -0.682 2.347) 2.849 3.859 ( 3.707 -11.184 -6.074) 13.256 4.055 ( 6.405 2.218 5.424) 8.681 4.172 ( -7.433 1.048 11.811) 13.995 4.180 ( 3.622 -3.525 2.560) 5.665 4.306 ( -1.689 -0.504 -4.652) 4.975 4.803 ( 3.020 2.991 -8.190) 9.227 4.901 ( 7.114 -2.588 -5.362) 9.277 5.130 ( -0.910 -6.541 14.249) 15.705 5.702 ( 4.730 7.890 -0.182) 9.201 5.812 ( 2.246 -0.713 3.159) 3.941 5.874 ( -5.485 -1.789 -7.383) 9.370 6.199 ( -4.873 9.556 0.959) 10.769 6.402 ( 4.545 1.409 -4.049) 6.248 6.544 ( -4.522 -6.051 2.257) 7.884 6.653 ( -1.511 0.937 -4.237) 4.595 6.800 ( -5.972 4.107 2.231) 7.584 7.166 ( -7.065 0.093 3.062) 7.701 7.419 ( 5.395 2.744 -1.734) 6.296 7.578 ( -1.103 7.746 -6.534) 10.193 7.842 ( 2.529 2.002 0.082) 3.226 8.154 ( 1.357 0.128 -5.847) 6.004 8.278 ( 1.949 -2.879 -9.092) 9.734 8.602 ( -7.926 1.023 2.858) 8.488 8.979 ( 7.281 -1.363 1.718) 7.604 9.040 ( 2.392 6.163 1.350) 6.747 9.323 ( -5.190 4.191 -4.045) 7.801 9.520 ( 2.524 0.591 10.211) 10.535 10.036 ( -2.752 2.771 -6.176) 7.307 10.218 ( 0.850 -3.293 -6.292) 7.153 10.375 ( -7.731 5.039 -3.590) 9.902 11.161 ( -18.501 -2.652 4.751) 19.285 11.525 ( 8.190 -3.577 -1.474) 9.058 12.647 ( 3.754 2.651 13.205) 13.982 13.424 ( -26.399 3.493 3.215) 26.822 13.628 ( 1.744 0.496 3.562) 3.997 13.917 ( -2.622 -0.330 -5.464) 6.069 14.082 ( 6.947 3.821 2.489) 8.310 14.169 ( 1.466 -1.486 1.048) 2.336 14.689 ( 1.646 -5.895 -2.068) 6.460 14.811 ( 4.049 -2.573 -3.660) 6.034 20.069 ( 0.298 0.059 -0.424) 0.521 20.560 ( 13.007 1.581 -12.596) 18.176 21.489 ( 1.771 -0.273 8.607) 8.792 21.877 ( -5.896 -0.326 6.697) 8.929 22.567 ( 2.104 0.393 1.643) 2.698 22.693 ( -3.529 -0.117 -1.328) 3.773 22.907 ( -5.159 25.018 13.410) 28.850 23.632 ( -6.073 -12.080 -3.633) 14.001 24.446 ( 3.526 1.612 7.282) 8.250 24.652 ( 0.810 -10.924 -7.991) 13.559 25.051 ( -0.377 -2.294 -2.644) 3.521 25.129 ( 1.218 -0.573 -3.102) 3.382 ======================= Grid point 100 (47/128) ======================= q-point: ( 0.29 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.839 ( 5.979 -13.561 20.018) 24.907 2.019 ( 12.815 -14.362 10.357) 21.857 2.219 ( -11.808 4.983 1.098) 12.863 2.449 ( 6.670 -1.244 8.541) 10.908 2.655 ( 0.631 0.107 6.877) 6.907 2.934 ( 6.533 -6.869 0.500) 9.493 3.490 ( 7.702 -5.561 9.558) 13.476 3.764 ( -0.122 -5.153 10.144) 11.378 3.942 ( -11.600 -1.089 3.773) 12.247 4.078 ( 1.352 -7.389 -1.390) 7.639 4.231 ( 4.889 -1.351 3.782) 6.327 4.271 ( 1.377 -2.370 -3.920) 4.784 4.429 ( 13.936 -6.102 9.487) 17.929 4.761 ( 0.130 1.180 -8.692) 8.772 5.036 ( 9.143 -0.008 -1.141) 9.213 5.302 ( -0.855 -11.150 12.379) 16.682 5.539 ( -3.414 12.454 -5.283) 13.952 5.733 ( -2.277 7.976 -1.675) 8.462 5.863 ( -4.124 -3.289 -4.708) 7.070 6.071 ( -2.512 -1.647 2.029) 3.625 6.410 ( -6.428 2.245 -4.010) 7.902 6.505 ( 0.044 -1.310 4.356) 4.549 6.521 ( -3.598 8.209 0.308) 8.968 6.802 ( 0.443 -4.181 -2.149) 4.721 7.026 ( -5.964 6.629 0.643) 8.940 7.399 ( 3.506 5.512 -0.371) 6.543 7.422 ( -2.848 5.588 -3.829) 7.348 7.843 ( -0.467 1.351 1.246) 1.896 8.115 ( -0.503 1.673 -4.245) 4.590 8.376 ( 6.120 -4.976 -5.005) 9.341 8.530 ( -4.430 -1.409 2.224) 5.153 8.874 ( -3.200 8.615 -2.416) 9.502 9.026 ( 0.837 8.497 2.315) 8.847 9.276 ( 2.116 -3.742 -3.151) 5.330 9.576 ( 1.794 0.259 10.833) 10.983 9.862 ( -8.979 7.645 -3.601) 12.331 10.201 ( -2.897 0.914 -2.525) 3.950 10.292 ( 0.891 -4.598 -6.776) 8.238 11.064 ( -11.366 -8.797 1.026) 14.409 11.645 ( 7.313 1.245 -3.111) 8.044 12.684 ( 3.705 6.222 13.614) 15.420 13.124 ( -17.591 -2.177 3.680) 18.103 13.662 ( 4.087 3.088 4.254) 6.659 13.856 ( -4.758 -1.655 -5.302) 7.314 14.133 ( 3.977 -0.037 2.140) 4.517 14.220 ( 2.777 -0.098 3.431) 4.415 14.720 ( -1.258 -0.761 -2.491) 2.892 14.916 ( 4.405 -3.894 -6.113) 8.482 20.070 ( 0.423 0.344 -0.126) 0.559 20.629 ( 8.880 2.517 -14.609) 17.280 21.530 ( -0.129 0.846 7.901) 7.947 21.835 ( -4.260 -0.582 5.361) 6.872 22.529 ( -13.048 -2.820 5.474) 14.428 22.664 ( 5.016 5.997 3.883) 8.729 22.678 ( 2.210 7.912 8.717) 11.978 23.642 ( -4.628 -1.381 3.285) 5.841 24.461 ( -6.487 -4.443 8.062) 11.261 24.786 ( 7.122 -2.574 -15.647) 17.384 25.093 ( 0.855 -3.918 -1.676) 4.346 25.145 ( 2.258 -0.144 -3.582) 4.237 ======================= Grid point 101 (48/128) ======================= q-point: ( 0.43 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.866 ( -9.077 12.953 -0.779) 15.836 2.144 ( -5.715 -10.846 12.880) 17.782 2.286 ( 2.737 7.150 12.230) 14.429 2.580 ( 5.438 -7.497 10.428) 13.947 2.788 ( 5.215 -6.823 2.668) 8.993 3.164 ( 10.798 -8.354 3.567) 14.111 3.517 ( -4.349 5.601 7.183) 10.094 3.798 ( -6.898 4.695 3.527) 9.059 3.938 ( -0.138 -6.083 4.103) 7.339 4.130 ( 0.243 2.746 0.298) 2.773 4.337 ( 0.238 -6.061 -0.660) 6.102 4.365 ( 6.764 -5.533 0.523) 8.755 4.671 ( -3.186 3.434 -6.276) 7.832 4.756 ( 7.887 -4.507 12.311) 15.300 5.092 ( -0.978 1.803 3.339) 3.919 5.268 ( 0.033 13.129 -9.888) 16.435 5.509 ( 0.022 -8.242 8.872) 12.110 5.564 ( -1.936 5.904 1.807) 6.471 5.813 ( -4.388 -3.919 -11.910) 13.284 6.169 ( 2.389 -5.738 4.210) 7.507 6.221 ( -9.234 3.011 -2.435) 10.013 6.387 ( -2.548 -0.284 6.200) 6.709 6.629 ( -1.454 -2.910 1.584) 3.618 6.718 ( -0.474 2.044 -1.448) 2.549 6.950 ( 2.293 3.369 -2.682) 4.878 7.303 ( -0.021 4.224 -3.494) 5.481 7.402 ( 0.450 -1.033 3.288) 3.476 7.780 ( -2.779 4.230 1.148) 5.190 8.101 ( 1.965 -0.325 -0.537) 2.062 8.488 ( -4.764 -1.378 -2.826) 5.708 8.531 ( 7.835 -1.854 -1.372) 8.167 8.767 ( 0.817 1.424 -0.868) 1.857 8.866 ( 0.717 11.433 -1.339) 11.533 9.340 ( -1.924 -1.054 -0.560) 2.264 9.580 ( -6.560 5.769 -3.507) 9.414 9.697 ( 3.006 -3.435 9.794) 10.805 10.183 ( -1.374 -3.348 -4.261) 5.591 10.375 ( 2.443 -5.402 -4.445) 7.410 11.075 ( -6.643 -8.495 -1.816) 10.936 11.665 ( 5.781 5.876 -4.305) 9.299 12.654 ( 1.033 8.311 12.088) 14.706 13.019 ( -8.449 -4.717 5.583) 11.172 13.673 ( 3.720 4.451 3.409) 6.728 13.812 ( -3.472 -2.971 -5.445) 7.109 14.199 ( 1.785 -1.464 3.329) 4.051 14.282 ( 3.185 -1.074 4.638) 5.728 14.687 ( -0.830 1.432 -2.761) 3.219 14.980 ( 2.011 -2.025 -7.120) 7.671 20.069 ( 0.489 0.594 -0.000) 0.769 20.626 ( 3.797 2.180 -14.453) 15.102 21.515 ( -2.130 2.332 6.153) 6.916 21.820 ( -2.351 -0.909 5.599) 6.140 22.416 ( -14.623 -5.419 7.415) 17.267 22.659 ( 10.744 11.063 9.279) 17.998 22.707 ( -0.747 -4.499 1.546) 4.816 23.625 ( -2.202 -0.929 8.081) 8.428 24.463 ( -9.755 -7.014 5.646) 13.275 24.803 ( 7.261 4.606 -16.171) 18.315 25.155 ( 1.770 -0.221 -0.175) 1.792 25.176 ( 3.840 -1.727 -4.916) 6.473 ======================= Grid point 102 (49/128) ======================= q-point: (-0.43 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.530 ( -9.148 15.191 5.054) 18.439 1.969 ( -13.127 13.280 16.012) 24.597 2.338 ( 0.257 -0.535 7.479) 7.502 2.793 ( 2.547 -6.609 6.726) 9.767 2.956 ( 3.218 -3.474 -5.289) 7.099 3.359 ( -5.826 0.293 21.630) 22.402 3.446 ( 1.364 3.459 5.469) 6.614 3.552 ( -7.032 10.890 7.749) 15.103 3.925 ( -3.786 2.228 -1.949) 4.806 4.045 ( 0.202 7.280 -3.366) 8.023 4.363 ( -2.076 0.688 -2.731) 3.499 4.457 ( -7.227 5.265 -0.732) 8.972 4.574 ( 2.731 -2.747 3.302) 5.090 4.875 ( 1.331 -0.372 7.820) 7.941 4.979 ( -3.198 5.349 -7.456) 9.718 5.090 ( -5.454 0.551 -10.606) 11.939 5.483 ( 0.437 8.983 5.087) 10.332 5.663 ( -0.025 -7.470 3.175) 8.117 5.860 ( 4.816 -8.201 -3.014) 9.976 6.086 ( -4.185 0.719 -3.316) 5.388 6.251 ( 0.407 -0.462 5.783) 5.815 6.481 ( -2.364 -6.265 6.536) 9.357 6.586 ( 0.149 -7.625 2.238) 7.948 6.846 ( -0.273 5.740 2.053) 6.102 6.931 ( 9.178 -7.349 -3.239) 12.196 7.288 ( 1.344 -1.985 -4.966) 5.514 7.445 ( 0.285 -1.794 3.326) 3.789 7.676 ( -3.330 3.932 1.719) 5.432 8.176 ( 5.213 -2.398 2.425) 6.230 8.424 ( -3.852 -1.244 -6.024) 7.258 8.619 ( 3.539 7.337 -0.160) 8.147 8.649 ( 4.584 7.878 -1.706) 9.273 8.901 ( 5.150 -5.326 -3.330) 8.123 9.217 ( -8.019 2.299 -0.164) 8.344 9.485 ( -1.379 -0.055 -1.821) 2.285 9.888 ( 5.626 -7.251 5.597) 10.749 10.214 ( -0.033 -3.678 -3.698) 5.216 10.471 ( 1.438 -4.920 -2.040) 5.517 11.115 ( -3.214 -7.180 -3.209) 8.496 11.617 ( 4.993 7.375 -3.746) 9.662 12.577 ( -0.727 6.848 10.177) 12.288 13.046 ( -1.779 -3.866 9.446) 10.361 13.657 ( 3.152 5.183 2.270) 6.477 13.815 ( -0.374 -3.515 -5.243) 6.323 14.238 ( -0.100 -0.373 4.429) 4.446 14.361 ( -0.721 -3.645 4.261) 5.653 14.657 ( 3.277 2.471 -2.867) 5.006 14.981 ( -0.209 -0.147 -8.275) 8.279 20.066 ( 0.511 0.556 -0.090) 0.760 20.564 ( -1.295 1.519 -13.257) 13.407 21.459 ( -2.517 3.132 4.924) 6.355 21.843 ( -0.321 -1.341 7.526) 7.651 22.345 ( -13.181 -7.815 3.887) 15.809 22.678 ( 7.005 6.714 5.880) 11.345 22.794 ( 0.303 -4.637 8.321) 9.531 23.686 ( 1.632 -3.494 9.169) 9.947 24.428 ( -14.076 -8.030 -0.072) 16.206 24.763 ( 10.956 9.196 -12.725) 19.145 25.159 ( 1.033 1.448 -0.931) 2.008 25.227 ( 4.480 1.366 -4.393) 6.421 ======================= Grid point 103 (50/128) ======================= q-point: (-0.29 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.226 ( -7.043 14.007 13.948) 20.984 1.654 ( -10.635 15.122 23.589) 29.970 2.314 ( -3.741 3.321 4.899) 7.002 2.635 ( -15.080 26.168 14.486) 33.496 2.940 ( -7.283 -6.665 -6.052) 11.579 3.175 ( -7.847 4.260 11.979) 14.940 3.456 ( -0.060 -0.708 8.771) 8.800 3.558 ( -0.394 0.815 5.498) 5.572 3.782 ( -0.665 7.764 -3.028) 8.360 3.974 ( 1.304 1.745 0.689) 2.285 4.146 ( -5.152 13.627 2.843) 14.843 4.398 ( -3.405 -0.296 2.468) 4.216 4.607 ( 1.169 1.060 -0.510) 1.658 4.758 ( -6.895 1.998 -7.081) 10.083 4.928 ( -4.615 -0.676 -6.239) 7.790 5.095 ( 0.619 -4.755 0.278) 4.804 5.348 ( 2.342 6.563 3.311) 7.715 5.741 ( -0.643 -0.795 0.121) 1.030 5.994 ( 2.109 3.171 2.438) 4.522 6.113 ( 6.234 -8.147 -9.351) 13.881 6.308 ( -2.954 -6.621 10.267) 12.569 6.569 ( -0.029 -4.859 2.916) 5.667 6.719 ( -1.602 -1.005 6.175) 6.458 6.806 ( 1.397 -6.301 -0.499) 6.473 7.156 ( 6.676 -5.427 -1.193) 8.686 7.343 ( 1.831 -4.415 -4.250) 6.396 7.465 ( -0.636 0.476 1.724) 1.898 7.618 ( 0.315 0.207 1.824) 1.863 8.268 ( -0.040 3.236 -1.074) 3.409 8.391 ( 1.442 -3.288 -2.826) 4.569 8.496 ( 5.222 4.436 -2.677) 7.356 8.717 ( 10.777 4.041 -2.140) 11.707 8.909 ( -4.541 2.847 -0.254) 5.366 9.236 ( 1.013 -9.181 0.367) 9.244 9.477 ( -1.852 -2.290 -0.582) 3.002 10.054 ( 4.098 -3.635 -1.583) 5.702 10.255 ( 0.603 -2.494 -3.369) 4.235 10.540 ( -0.841 -4.152 1.120) 4.381 11.175 ( 0.451 -4.937 -4.927) 6.990 11.586 ( 4.408 3.481 -0.775) 5.670 12.521 ( -1.028 3.801 10.047) 10.791 13.159 ( 4.665 -3.951 12.866) 14.245 13.632 ( 4.533 5.859 2.137) 7.710 13.860 ( 1.918 -3.223 -5.016) 6.263 14.245 ( -1.250 0.372 4.298) 4.491 14.373 ( -8.858 -5.697 1.693) 10.667 14.695 ( 7.458 2.123 -1.419) 7.883 14.913 ( -2.120 2.948 -10.858) 11.449 20.066 ( 0.510 0.287 -0.339) 0.676 20.454 ( -4.562 1.320 -10.179) 11.232 21.404 ( -1.236 2.731 5.116) 5.930 21.904 ( 0.856 -1.135 11.251) 11.341 22.324 ( -8.894 -9.534 -0.753) 13.060 22.698 ( 3.976 2.756 3.453) 5.944 22.907 ( -3.678 -8.482 13.156) 16.079 23.831 ( 6.608 -3.768 7.625) 10.770 24.293 ( -15.262 -2.697 -10.086) 18.491 24.754 ( 12.374 9.333 -5.016) 16.291 25.135 ( -0.196 2.300 -0.427) 2.348 25.212 ( 3.185 5.262 -5.341) 8.146 ======================= Grid point 104 (51/128) ======================= q-point: (-0.14 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.065 ( -2.467 6.549 22.614) 23.672 1.377 ( -10.760 17.144 25.487) 32.547 2.092 ( -9.328 14.443 30.307) 34.844 2.262 ( -0.556 9.207 8.484) 12.532 2.930 ( -6.864 -5.200 -3.480) 9.288 2.987 ( -16.971 -0.449 3.413) 17.317 3.346 ( -5.914 8.586 -4.475) 11.346 3.604 ( 3.115 -1.621 7.418) 8.208 3.743 ( 1.203 2.320 2.923) 3.922 3.920 ( 0.965 10.406 1.050) 10.504 4.012 ( 5.263 1.172 3.138) 6.239 4.348 ( -7.560 -0.284 12.629) 14.722 4.548 ( -6.549 2.742 -4.913) 8.634 4.690 ( 2.107 -3.947 -13.364) 14.093 4.887 ( 0.389 -0.322 -3.890) 3.923 5.065 ( -2.686 4.907 9.628) 11.135 5.474 ( 8.330 -6.234 3.698) 11.042 5.712 ( 2.067 3.460 -0.083) 4.031 5.963 ( 1.475 3.158 -2.924) 4.550 6.254 ( 4.278 -5.539 -8.940) 11.354 6.414 ( -5.338 -8.231 7.939) 12.620 6.556 ( -3.207 3.459 3.547) 5.902 6.798 ( -0.949 -5.939 2.148) 6.387 6.867 ( -0.823 -1.083 -1.278) 1.867 7.258 ( 1.349 -0.630 1.757) 2.303 7.361 ( -1.550 0.502 -2.852) 3.285 7.527 ( 6.730 -5.196 -3.400) 9.157 7.701 ( 4.520 -4.201 3.327) 7.011 8.155 ( 0.250 5.245 -4.745) 7.077 8.385 ( -2.004 -0.361 -10.646) 10.839 8.684 ( 12.166 -4.303 6.013) 14.237 8.774 ( 6.007 3.651 -3.089) 7.678 8.825 ( -0.904 0.604 4.096) 4.238 9.367 ( 1.173 -3.523 4.999) 6.227 9.503 ( -2.810 -5.172 -1.659) 6.115 10.091 ( 1.646 0.445 -6.478) 6.699 10.259 ( 0.274 0.870 -6.363) 6.428 10.579 ( -4.188 -4.297 1.562) 6.200 11.236 ( 4.666 -1.735 -4.630) 6.798 11.599 ( -2.540 -0.281 -0.418) 2.589 12.517 ( -0.347 0.523 11.312) 11.330 13.402 ( 9.151 -7.996 9.604) 15.489 13.651 ( 12.207 6.112 5.118) 14.579 13.914 ( 2.515 -2.127 -5.288) 6.230 14.218 ( -5.717 -1.173 2.483) 6.342 14.324 ( -15.518 -9.139 -0.948) 18.034 14.718 ( -4.702 11.471 -11.539) 16.937 14.749 ( 4.365 1.562 -0.975) 4.737 20.068 ( 0.332 0.143 -0.638) 0.733 20.365 ( 0.179 0.817 -4.971) 5.041 21.390 ( 0.654 1.361 6.420) 6.596 21.951 ( -2.520 0.073 12.715) 12.962 22.399 ( 1.948 -7.047 -2.903) 7.866 22.730 ( 1.629 -0.350 0.853) 1.872 23.079 ( -8.798 -21.975 11.165) 26.171 23.984 ( -8.823 14.620 -17.994) 24.807 24.028 ( 8.369 -3.172 7.984) 11.994 24.747 ( 4.488 8.339 2.361) 9.760 25.081 ( -0.663 2.813 -1.955) 3.489 25.145 ( 0.499 3.313 -3.507) 4.850 ======================= Grid point 106 (52/128) ======================= q-point: ( 0.14 0.14 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.571 ( 13.605 0.000 18.372) 22.861 1.742 ( 20.592 0.000 20.629) 29.147 2.265 ( -6.894 -0.000 6.124) 9.221 2.476 ( 13.923 0.000 2.346) 14.119 2.777 ( -5.983 -0.000 -3.506) 6.934 2.811 ( 12.260 0.000 11.148) 16.571 3.284 ( 9.619 0.000 34.282) 35.606 3.736 ( -0.213 -0.000 -11.683) 11.685 3.789 ( 5.008 0.000 -1.557) 5.245 4.029 ( -9.220 -0.000 7.877) 12.127 4.202 ( 4.765 0.000 4.079) 6.272 4.278 ( -0.157 -0.000 -1.720) 1.727 4.313 ( 13.458 0.000 6.473) 14.934 4.805 ( 0.074 0.000 -9.813) 9.813 4.979 ( 9.641 0.000 -4.226) 10.527 5.118 ( -1.376 -0.000 15.302) 15.363 5.741 ( -7.132 -0.000 -12.503) 14.394 5.749 ( -6.593 -0.000 -4.244) 7.841 5.837 ( 1.908 0.000 5.292) 5.626 6.290 ( -6.715 -0.000 -11.811) 13.586 6.323 ( 0.041 0.000 4.232) 4.232 6.520 ( 1.099 0.000 8.990) 9.057 6.651 ( 5.160 0.000 -5.832) 7.787 6.727 ( -10.633 -0.000 1.678) 10.764 7.062 ( -8.582 -0.000 3.010) 9.094 7.533 ( 7.644 0.000 0.213) 7.647 7.581 ( -4.186 -0.000 -7.357) 8.465 7.842 ( -3.151 -0.000 -1.737) 3.598 8.145 ( 1.073 0.000 -10.847) 10.900 8.290 ( 6.818 0.000 -3.802) 7.807 8.520 ( -6.703 -0.000 2.967) 7.330 9.034 ( 4.449 0.000 3.443) 5.625 9.140 ( -1.738 -0.000 2.238) 2.834 9.200 ( -9.813 -0.000 -6.227) 11.622 9.595 ( 1.763 0.000 9.886) 10.042 10.006 ( -6.296 -0.000 -5.462) 8.335 10.151 ( 0.762 0.000 -6.521) 6.566 10.347 ( -1.397 -0.000 -6.297) 6.450 10.832 ( -23.982 -0.000 15.111) 28.346 11.633 ( 10.376 0.000 -2.981) 10.795 12.786 ( 5.407 0.000 14.066) 15.070 13.095 ( -21.266 -0.000 1.712) 21.335 13.719 ( 5.216 0.000 4.572) 6.936 13.825 ( -6.267 -0.000 -4.121) 7.500 14.135 ( 2.027 0.000 -0.161) 2.033 14.234 ( 1.906 0.000 1.062) 2.182 14.692 ( 3.477 0.000 1.491) 3.783 14.837 ( 5.547 0.000 -5.782) 8.012 20.075 ( 0.628 0.000 0.014) 0.628 20.678 ( 9.669 0.000 -17.249) 19.774 21.543 ( 1.033 0.000 9.341) 9.397 21.822 ( -4.575 -0.000 4.845) 6.664 22.486 ( -11.712 -0.000 6.507) 13.399 22.626 ( -4.559 -0.000 -1.487) 4.795 23.282 ( 1.783 0.000 5.883) 6.148 23.356 ( 1.276 0.000 -2.355) 2.678 24.270 ( -16.643 -0.000 11.627) 20.302 24.809 ( 19.154 0.000 -6.674) 20.283 25.010 ( -1.027 -0.000 -2.360) 2.574 25.139 ( 2.320 0.000 -3.862) 4.506 ======================= Grid point 107 (53/128) ======================= q-point: ( 0.29 0.14 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.853 ( 8.623 -5.568 11.798) 15.638 2.139 ( 18.562 -5.154 14.846) 24.321 2.265 ( 4.176 2.224 9.052) 10.214 2.640 ( 9.403 8.879 4.095) 13.566 2.682 ( 0.270 -0.190 8.166) 8.172 2.999 ( 10.920 -3.036 1.311) 11.410 3.610 ( 7.415 -2.806 21.948) 23.336 3.724 ( -1.164 -4.859 2.203) 5.461 3.759 ( -8.259 -2.979 -1.072) 8.845 4.058 ( 8.985 0.149 -0.916) 9.033 4.243 ( 0.051 -0.985 -3.748) 3.875 4.340 ( 7.999 -0.807 5.533) 9.760 4.556 ( 11.390 -4.848 9.129) 15.381 4.756 ( 1.274 2.323 -9.083) 9.461 5.124 ( 6.710 -1.982 -1.010) 7.069 5.203 ( 0.303 -6.548 13.480) 14.989 5.531 ( -9.644 4.867 -8.774) 13.917 5.639 ( -8.842 -4.377 -11.902) 15.459 5.833 ( -3.490 2.522 -4.439) 6.185 6.100 ( -2.096 5.804 2.264) 6.573 6.346 ( -3.379 1.939 0.266) 3.905 6.495 ( -8.553 4.040 3.764) 10.181 6.585 ( 1.180 1.555 4.688) 5.078 6.739 ( 0.933 -3.139 -2.550) 4.150 6.973 ( -6.620 -1.794 0.704) 6.894 7.440 ( -3.596 5.912 -5.040) 8.560 7.565 ( 3.480 7.682 -0.238) 8.436 7.802 ( -3.814 -2.960 0.440) 4.848 8.128 ( 2.520 0.858 -8.406) 8.817 8.388 ( 5.019 -1.056 -1.771) 5.425 8.482 ( -0.242 -2.414 2.451) 3.449 8.923 ( -7.035 8.740 -3.071) 11.632 9.114 ( -1.012 0.182 3.813) 3.950 9.176 ( -2.611 -6.600 -2.950) 7.686 9.634 ( -0.274 0.936 10.084) 10.131 9.813 ( -9.845 5.892 -5.069) 12.543 10.184 ( -1.422 -3.148 -6.434) 7.302 10.242 ( 0.598 5.505 -0.478) 5.558 10.742 ( -12.012 -12.803 8.130) 19.347 11.746 ( 7.588 0.339 -5.100) 9.149 12.837 ( -7.987 2.221 7.470) 11.159 12.930 ( 0.451 -0.246 8.059) 8.075 13.722 ( -5.280 -2.045 -6.819) 8.864 13.799 ( 4.147 3.115 6.945) 8.668 14.170 ( 2.370 -0.175 0.905) 2.543 14.240 ( -1.819 -1.555 2.133) 3.206 14.725 ( 1.751 1.101 -0.211) 2.079 14.915 ( 5.645 -2.015 -6.741) 9.021 20.083 ( 0.638 0.290 0.306) 0.765 20.697 ( 4.530 1.778 -17.124) 17.802 21.571 ( -0.964 1.162 8.546) 8.679 21.793 ( -2.798 -0.687 4.032) 4.955 22.329 ( -15.214 -0.569 10.233) 18.344 22.587 ( -2.821 -3.035 -1.343) 4.356 23.102 ( 7.663 17.663 5.716) 20.084 23.549 ( -0.308 -7.954 1.507) 8.101 24.161 ( -14.871 -8.144 9.293) 19.335 24.953 ( 7.753 3.831 -6.834) 11.022 25.064 ( 8.302 -3.356 -3.916) 9.773 25.161 ( 2.600 -0.374 -4.278) 5.020 ======================= Grid point 108 (54/128) ======================= q-point: ( 0.43 0.14 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.975 ( 0.255 1.684 5.617) 5.869 2.228 ( 9.955 17.806 5.720) 21.187 2.483 ( 7.444 0.103 13.022) 14.999 2.643 ( 3.967 0.443 12.950) 13.552 2.800 ( 7.909 -3.759 7.593) 11.590 3.244 ( 12.970 -5.116 3.694) 14.423 3.503 ( -12.622 3.342 9.292) 16.026 3.811 ( 2.457 -2.547 -1.479) 3.835 3.874 ( -0.102 -4.204 -1.420) 4.439 4.144 ( 3.416 0.628 5.961) 6.899 4.285 ( 1.645 -3.057 1.051) 3.627 4.480 ( 12.026 3.022 -1.390) 12.478 4.635 ( -3.866 2.215 -6.537) 7.911 4.843 ( 5.730 -2.962 9.778) 11.714 5.086 ( -7.672 4.962 2.272) 9.415 5.334 ( -5.081 4.572 -10.867) 12.838 5.393 ( 0.515 -7.738 6.262) 9.968 5.597 ( -2.558 -6.056 -8.078) 10.415 5.681 ( -1.883 1.317 -2.443) 3.354 6.110 ( -1.293 -1.475 5.232) 5.587 6.170 ( -4.227 2.473 -4.213) 6.460 6.419 ( -0.749 2.605 8.847) 9.252 6.579 ( -6.050 2.101 5.044) 8.152 6.748 ( 4.369 -1.315 -2.664) 5.284 6.955 ( -2.114 -2.148 -1.642) 3.432 7.317 ( -1.989 3.774 -3.242) 5.358 7.466 ( -0.431 5.151 2.291) 5.654 7.789 ( -2.091 1.316 0.325) 2.492 8.133 ( 3.952 0.637 -3.276) 5.172 8.396 ( -4.453 -0.204 -1.902) 4.846 8.599 ( 7.554 -3.814 -1.055) 8.528 8.783 ( 0.557 0.708 -2.417) 2.579 9.012 ( -3.803 7.316 0.497) 8.261 9.256 ( -2.518 -4.433 -0.066) 5.099 9.544 ( -8.529 5.999 -4.405) 11.320 9.686 ( -1.790 -3.566 10.865) 11.574 10.130 ( 0.317 0.050 -5.076) 5.086 10.298 ( 1.216 -5.560 -1.979) 6.026 10.839 ( -4.771 -11.459 2.296) 12.623 11.782 ( 4.464 3.006 -6.696) 8.591 12.707 ( -8.563 0.676 3.372) 9.228 13.012 ( 5.631 2.185 13.023) 14.355 13.677 ( -4.160 -4.013 -5.528) 7.998 13.815 ( 3.838 4.602 4.159) 7.294 14.204 ( -0.783 -2.103 1.016) 2.464 14.259 ( -1.863 -2.539 3.925) 5.032 14.724 ( 2.580 1.862 -1.647) 3.583 14.975 ( 3.823 -0.406 -7.123) 8.094 20.085 ( 0.351 0.559 0.235) 0.701 20.633 ( -0.094 2.664 -14.536) 14.779 21.546 ( -2.323 2.491 6.760) 7.570 21.799 ( -0.795 -1.414 4.537) 4.819 22.187 ( -13.853 -2.154 11.233) 17.964 22.629 ( -0.635 -5.615 -1.014) 5.741 23.011 ( 8.325 13.073 6.428) 16.778 23.621 ( 0.113 -1.698 7.179) 7.378 24.134 ( -13.888 -10.180 4.281) 17.743 24.954 ( 4.913 3.207 -7.212) 9.297 25.183 ( 2.423 -0.521 -5.084) 5.656 25.210 ( 9.237 -0.508 -4.456) 10.268 ======================= Grid point 109 (55/128) ======================= q-point: (-0.43 0.14 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.884 ( 7.703 19.984 7.438) 22.672 2.046 ( -3.939 13.920 12.043) 18.823 2.493 ( 2.873 9.205 10.476) 14.238 2.744 ( -0.758 -2.944 3.455) 4.602 3.006 ( 8.008 -0.205 1.586) 8.166 3.346 ( -8.577 1.973 17.188) 19.310 3.499 ( 4.346 -4.866 7.130) 9.664 3.746 ( -0.785 11.033 5.109) 12.184 3.877 ( -1.316 0.583 -0.980) 1.741 4.144 ( -0.196 5.676 0.439) 5.696 4.331 ( 1.677 0.295 -6.673) 6.887 4.420 ( -7.928 3.569 2.115) 8.948 4.608 ( 4.064 2.483 -2.263) 5.273 4.881 ( -3.164 0.111 1.311) 3.427 4.953 ( -3.141 0.103 1.208) 3.367 5.030 ( -9.081 10.105 -15.518) 20.625 5.547 ( -2.161 -7.629 8.447) 11.585 5.646 ( 2.888 2.282 4.405) 5.741 5.782 ( 6.262 -9.093 -3.544) 11.596 6.050 ( -0.178 -1.148 -4.060) 4.223 6.247 ( -1.491 -2.472 8.898) 9.354 6.416 ( 0.209 -1.045 6.962) 7.043 6.517 ( 0.417 -2.206 1.845) 2.906 6.898 ( -1.861 -0.827 -3.952) 4.446 6.920 ( 5.511 -4.118 1.141) 6.973 7.249 ( -0.705 -0.367 -5.238) 5.298 7.450 ( -0.013 -0.444 4.473) 4.495 7.704 ( -2.756 4.772 1.654) 5.754 8.207 ( 5.005 -2.839 -0.239) 5.760 8.311 ( -5.124 -1.171 -5.629) 7.702 8.759 ( 5.356 -1.529 1.256) 5.709 8.799 ( -0.107 5.371 -1.771) 5.657 8.884 ( 4.609 -1.162 -5.844) 7.533 9.157 ( -7.440 5.759 1.059) 9.468 9.423 ( -4.115 -1.788 -0.386) 4.503 9.817 ( -0.695 -10.003 7.651) 12.613 10.160 ( 3.168 -2.680 -6.357) 7.592 10.385 ( -0.185 -5.733 -2.376) 6.208 10.962 ( -0.222 -9.038 0.861) 9.081 11.737 ( 2.025 5.049 -7.128) 8.967 12.608 ( -6.409 0.828 4.536) 7.895 13.115 ( 6.344 1.377 14.087) 15.510 13.686 ( -1.801 -4.389 -2.885) 5.553 13.813 ( 3.718 3.199 0.806) 4.971 14.198 ( -7.634 -3.932 -0.435) 8.598 14.282 ( -0.842 -0.466 5.087) 5.177 14.745 ( 4.921 1.049 -2.366) 5.560 14.979 ( 2.367 1.791 -8.077) 8.605 20.079 ( 0.077 0.522 -0.095) 0.536 20.520 ( -2.710 2.960 -10.753) 11.478 21.496 ( -1.904 3.001 5.581) 6.616 21.851 ( 1.565 -2.240 6.816) 7.343 22.095 ( -11.883 -3.893 9.771) 15.869 22.702 ( -0.451 -4.744 -1.203) 4.914 22.967 ( 5.731 9.795 7.669) 13.696 23.701 ( 2.433 -3.068 10.901) 11.583 24.100 ( -12.722 -8.464 -0.227) 15.282 24.949 ( 6.292 3.659 -8.310) 11.047 25.188 ( 1.127 0.883 -3.166) 3.474 25.300 ( 6.702 0.933 -6.871) 9.643 ======================= Grid point 110 (56/128) ======================= q-point: (-0.29 0.14 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.678 ( 12.516 28.503 9.844) 32.649 1.847 ( -5.034 12.850 23.189) 26.985 2.394 ( -1.973 9.481 6.238) 11.520 2.717 ( -8.869 -4.226 -3.654) 10.482 2.916 ( -3.492 19.393 8.152) 21.325 3.157 ( -14.580 7.917 8.613) 18.694 3.596 ( 4.727 1.447 9.468) 10.681 3.621 ( 1.287 8.868 9.065) 12.746 3.913 ( 2.527 9.142 -1.769) 9.649 3.978 ( -0.247 -3.626 2.472) 4.396 4.279 ( -1.461 9.527 0.434) 9.648 4.334 ( -5.743 -0.810 4.538) 7.365 4.569 ( 0.490 0.710 -7.817) 7.864 4.698 ( -7.147 5.649 -9.719) 13.321 4.876 ( 0.115 -0.583 -6.936) 6.962 5.068 ( 5.453 -7.698 4.902) 10.631 5.495 ( -2.016 9.429 4.601) 10.683 5.714 ( 0.152 -4.902 4.469) 6.635 6.030 ( 5.750 -9.571 -1.330) 11.244 6.066 ( 1.389 -0.016 -4.112) 4.340 6.245 ( -0.740 1.412 10.463) 10.584 6.503 ( -0.162 -5.078 4.353) 6.690 6.650 ( 1.813 -9.958 -1.038) 10.175 6.779 ( -3.518 5.002 2.605) 6.647 7.089 ( 0.003 -8.273 -4.822) 9.576 7.302 ( 4.231 -4.287 -2.476) 6.513 7.456 ( -2.803 -0.310 1.913) 3.408 7.650 ( 1.908 0.805 3.035) 3.675 8.255 ( -4.098 -1.832 -4.538) 6.383 8.327 ( 3.429 -3.241 -1.600) 4.982 8.631 ( 1.649 5.553 -2.407) 6.273 8.872 ( -1.282 2.190 -3.748) 4.526 8.929 ( 4.372 1.688 0.199) 4.691 9.099 ( 2.204 -7.315 -1.749) 7.838 9.417 ( -2.387 -2.043 4.155) 5.209 9.976 ( -1.919 -9.954 2.439) 10.427 10.220 ( 3.382 -1.562 -6.284) 7.305 10.435 ( -2.780 -4.681 -2.974) 6.204 11.115 ( 4.141 -6.953 0.426) 8.104 11.651 ( -0.262 4.197 -6.138) 7.440 12.543 ( -4.486 0.478 7.212) 8.506 13.255 ( 6.368 -1.508 13.890) 15.354 13.734 ( 1.414 -2.991 1.100) 3.486 13.835 ( 3.152 0.263 -1.777) 3.628 14.104 ( -12.799 -3.234 -2.544) 13.444 14.280 ( -1.746 1.052 4.790) 5.206 14.793 ( 4.260 0.684 -2.640) 5.058 14.929 ( 1.667 4.068 -10.298) 11.198 20.073 ( 0.046 0.213 -0.472) 0.520 20.416 ( -0.418 2.596 -6.614) 7.118 21.456 ( -0.457 2.660 5.790) 6.388 21.948 ( 1.331 -0.720 11.923) 12.019 22.066 ( -6.800 -8.695 6.016) 12.571 22.737 ( -1.078 -2.086 -1.248) 2.659 22.915 ( -0.828 6.168 9.305) 11.194 23.852 ( 0.639 -6.174 11.657) 13.207 24.051 ( -4.932 -4.844 -4.823) 8.430 24.957 ( 7.349 3.942 -9.010) 12.277 25.164 ( -0.039 2.107 -1.664) 2.685 25.296 ( 1.778 3.994 -9.360) 10.331 ======================= Grid point 111 (57/128) ======================= q-point: (-0.14 0.14 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.505 ( 14.207 23.897 15.164) 31.667 1.651 ( -3.508 19.187 23.715) 30.706 2.231 ( -1.757 7.344 11.242) 13.543 2.624 ( 3.697 17.793 17.904) 25.511 2.671 ( -10.647 -5.338 -0.183) 11.911 2.830 ( -14.794 7.315 -0.129) 16.504 3.440 ( -3.452 11.317 -1.631) 11.944 3.700 ( 2.763 1.218 8.737) 9.244 3.867 ( 8.900 4.591 5.529) 11.439 4.083 ( 0.040 11.168 -4.495) 12.039 4.115 ( 6.358 0.577 4.199) 7.641 4.247 ( -11.338 -1.516 14.322) 18.329 4.422 ( -6.872 2.456 -12.665) 14.617 4.709 ( 7.218 -2.053 -4.389) 8.694 4.876 ( 2.398 -0.384 -6.299) 6.751 5.205 ( 2.076 7.018 10.747) 13.002 5.466 ( 5.411 -8.083 -0.135) 9.728 5.776 ( 0.579 -1.014 4.241) 4.399 6.000 ( -4.016 3.144 -1.586) 5.341 6.155 ( -1.615 -4.204 -1.460) 4.735 6.316 ( 4.066 -2.564 1.347) 4.992 6.589 ( 0.643 -4.568 0.354) 4.627 6.689 ( -5.845 -0.378 0.494) 5.878 6.779 ( -0.892 -4.943 0.115) 5.024 7.184 ( -3.429 -7.974 0.555) 8.697 7.344 ( 0.130 -0.400 -1.041) 1.122 7.486 ( 1.313 -5.861 -4.498) 7.504 7.734 ( 5.357 -2.014 4.444) 7.246 8.192 ( -2.128 1.550 -4.697) 5.385 8.335 ( 0.552 1.650 -7.773) 7.965 8.683 ( -4.344 -2.306 2.976) 5.749 8.794 ( 4.933 -3.121 0.368) 5.849 8.989 ( 6.575 2.898 -1.794) 7.406 9.255 ( -0.057 -10.072 -3.576) 10.688 9.450 ( 0.510 -1.109 8.062) 8.154 10.053 ( -2.636 -4.392 -3.727) 6.335 10.243 ( 1.030 -0.351 -4.735) 4.859 10.425 ( -5.981 -3.728 -3.536) 7.885 11.247 ( 2.381 -2.788 -0.720) 3.737 11.564 ( -2.297 2.909 -3.632) 5.190 12.543 ( -0.792 -1.518 11.007) 11.140 13.423 ( 2.625 -5.480 10.297) 11.956 13.781 ( -14.644 -5.638 0.821) 15.713 13.878 ( 9.768 0.761 1.002) 9.848 13.969 ( -4.788 -0.798 -3.868) 6.207 14.231 ( -3.895 2.160 2.940) 5.336 14.796 ( -0.462 2.429 -5.782) 6.288 14.832 ( 3.719 7.029 -6.746) 10.428 20.069 ( -0.012 0.060 -0.681) 0.683 20.421 ( 8.213 0.166 -6.026) 10.188 21.452 ( 1.044 1.527 7.099) 7.336 21.937 ( -6.068 0.266 9.352) 11.152 22.291 ( 7.588 -14.246 7.440) 17.773 22.731 ( -1.750 -0.380 -1.163) 2.135 22.834 ( -9.398 -0.479 11.756) 15.058 23.841 ( -10.765 -0.618 0.011) 10.783 24.199 ( 13.244 -4.943 1.695) 14.238 24.919 ( 2.482 9.398 -10.937) 14.633 25.107 ( -1.082 3.492 -1.691) 4.028 25.178 ( -2.342 3.901 -6.207) 7.696 ======================= Grid point 114 (58/128) ======================= q-point: ( 0.29 0.29 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.995 ( 9.130 0.000 7.021) 11.517 2.318 ( 8.706 0.000 13.573) 16.126 2.486 ( 15.818 0.000 16.517) 22.870 2.732 ( 2.734 0.000 10.923) 11.259 3.009 ( 21.590 0.000 -3.356) 21.849 3.057 ( 5.326 0.000 8.209) 9.785 3.556 ( -16.372 -0.000 8.043) 18.241 3.614 ( -2.318 -0.000 -9.089) 9.380 3.814 ( 7.919 0.000 18.746) 20.350 4.163 ( -5.034 -0.000 -7.189) 8.776 4.303 ( 18.876 0.000 -5.712) 19.721 4.475 ( 8.991 0.000 8.609) 12.448 4.673 ( 7.529 0.000 8.947) 11.693 4.814 ( 6.049 0.000 -2.896) 6.707 5.193 ( -1.375 -0.000 14.360) 14.426 5.206 ( 7.769 0.000 -5.921) 9.768 5.369 ( -15.188 -0.000 -7.440) 16.912 5.412 ( -7.427 -0.000 -15.582) 17.261 5.754 ( -6.457 -0.000 -7.338) 9.775 6.128 ( 0.291 0.000 3.415) 3.427 6.310 ( -11.114 -0.000 -3.169) 11.557 6.447 ( -1.235 -0.000 8.663) 8.751 6.637 ( 1.084 0.000 7.210) 7.291 6.713 ( -2.679 -0.000 0.609) 2.748 6.855 ( -4.715 -0.000 -2.986) 5.581 7.436 ( -1.339 -0.000 -4.380) 4.580 7.642 ( -10.801 -0.000 3.296) 11.293 7.724 ( 5.186 0.000 -0.443) 5.204 8.160 ( 6.685 0.000 -10.746) 12.656 8.425 ( -4.057 -0.000 5.370) 6.730 8.493 ( 7.740 0.000 -2.430) 8.113 8.883 ( -8.694 -0.000 -5.442) 10.257 9.002 ( -6.074 -0.000 -0.836) 6.131 9.136 ( 1.138 0.000 2.813) 3.035 9.668 ( -1.490 -0.000 9.881) 9.993 9.710 ( -9.768 -0.000 -5.015) 10.980 10.105 ( -2.641 -0.000 -4.094) 4.872 10.356 ( 4.106 0.000 -7.204) 8.292 10.502 ( -7.898 -0.000 16.502) 18.295 11.816 ( 5.447 0.000 -8.091) 9.753 12.700 ( -9.231 -0.000 -0.084) 9.232 13.068 ( 6.198 0.000 14.975) 16.207 13.607 ( -4.695 -0.000 -7.007) 8.435 13.906 ( 3.388 0.000 6.046) 6.931 14.159 ( -6.168 -0.000 -0.647) 6.202 14.215 ( 2.681 0.000 3.056) 4.065 14.755 ( 0.864 0.000 -0.326) 0.924 14.964 ( 6.649 0.000 -6.703) 9.441 20.094 ( 0.301 0.000 0.426) 0.521 20.682 ( 0.617 0.000 -16.100) 16.112 21.589 ( -2.370 -0.000 8.105) 8.444 21.774 ( -0.985 -0.000 3.580) 3.713 22.173 ( -12.973 -0.000 11.831) 17.557 22.512 ( -2.987 -0.000 -0.862) 3.109 23.396 ( 2.869 0.000 -1.387) 3.187 23.444 ( 4.388 0.000 6.036) 7.462 23.966 ( -11.509 -0.000 11.939) 16.583 24.976 ( -0.095 -0.000 -1.844) 1.846 25.174 ( 2.322 0.000 -5.078) 5.583 25.212 ( 13.721 0.000 -8.891) 16.350 ======================= Grid point 115 (59/128) ======================= q-point: ( 0.43 0.29 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.081 ( 4.818 3.744 7.266) 9.488 2.546 ( 4.742 -6.627 14.566) 16.691 2.679 ( 11.522 9.139 6.897) 16.243 2.829 ( 7.413 9.129 9.459) 15.092 2.964 ( 9.199 6.163 12.809) 16.931 3.330 ( -5.186 -2.468 6.236) 8.478 3.417 ( 2.376 0.705 3.767) 4.509 3.658 ( -0.194 -14.785 -4.901) 15.577 3.875 ( -1.291 5.975 -0.692) 6.152 4.155 ( 0.017 -8.042 1.976) 8.281 4.421 ( 9.185 6.026 -2.132) 11.190 4.588 ( 0.671 2.347 2.715) 3.651 4.763 ( 7.920 11.083 -4.750) 14.427 4.875 ( 2.167 -1.633 3.476) 4.410 5.085 ( -4.743 3.537 6.708) 8.945 5.211 ( -9.724 0.403 -20.096) 22.329 5.284 ( -2.111 -4.857 5.746) 7.815 5.459 ( 6.117 -13.239 -1.326) 14.644 5.655 ( -2.082 1.514 0.855) 2.712 6.091 ( -8.708 4.009 -4.234) 10.480 6.170 ( 4.052 -0.258 1.818) 4.448 6.479 ( 0.333 0.491 9.809) 9.827 6.576 ( -5.178 4.842 7.090) 10.026 6.742 ( 1.620 -4.147 -2.936) 5.333 6.842 ( -3.659 -5.326 -1.152) 6.564 7.366 ( -1.474 5.886 -3.215) 6.867 7.492 ( -5.900 2.242 5.103) 8.116 7.786 ( 1.273 -0.409 -0.037) 1.338 8.208 ( 6.629 2.133 -7.932) 10.556 8.341 ( -7.338 2.301 2.618) 8.124 8.601 ( 2.894 -3.991 -3.975) 6.332 8.767 ( -1.947 -1.263 -3.135) 3.901 8.967 ( -2.962 -2.084 -2.057) 4.165 9.190 ( 0.494 -3.357 1.817) 3.849 9.521 ( -6.306 6.669 -2.449) 9.499 9.663 ( -4.418 0.778 12.005) 12.816 10.082 ( -1.427 -3.890 -6.362) 7.592 10.310 ( 3.541 4.200 -0.069) 5.494 10.638 ( -0.835 -12.040 7.055) 13.979 11.829 ( 2.484 1.131 -10.139) 10.500 12.596 ( -6.710 -0.568 -0.163) 6.736 13.190 ( 5.651 2.123 15.875) 16.984 13.552 ( -2.796 -3.026 -6.388) 7.601 13.924 ( 0.924 3.220 2.783) 4.355 14.085 ( -7.002 -3.006 -2.393) 7.987 14.270 ( 1.944 -0.377 5.911) 6.234 14.757 ( 0.682 -0.003 -1.909) 2.027 15.023 ( 5.654 0.917 -6.055) 8.334 20.093 ( -0.303 0.290 0.134) 0.440 20.606 ( -1.242 2.008 -13.000) 13.212 21.567 ( -2.940 1.470 6.893) 7.636 21.795 ( 0.747 -1.114 4.216) 4.424 22.059 ( -9.550 0.405 11.801) 15.186 22.516 ( -2.124 -5.437 -0.970) 5.917 23.305 ( 4.705 11.505 3.392) 12.885 23.612 ( 2.675 -5.900 5.244) 8.335 23.890 ( -9.932 -3.226 9.609) 14.190 24.981 ( 1.193 -0.699 -2.524) 2.878 25.185 ( 1.792 -0.357 -5.384) 5.686 25.330 ( 9.370 0.969 -9.486) 13.369 ======================= Grid point 116 (60/128) ======================= q-point: (-0.43 0.29 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.099 ( 2.548 5.543 13.027) 14.385 2.557 ( 12.149 26.483 2.673) 29.259 2.643 ( -1.918 2.754 10.168) 10.708 2.722 ( -6.846 5.586 6.170) 10.777 3.160 ( 9.484 1.401 5.241) 10.926 3.309 ( -7.904 -0.966 13.599) 15.759 3.449 ( -3.278 -5.108 9.695) 11.438 3.724 ( -2.092 -0.153 -5.620) 5.999 3.923 ( 5.301 -8.138 -1.096) 9.774 4.269 ( 1.491 1.618 -2.792) 3.555 4.359 ( -10.089 6.736 -3.356) 12.587 4.414 ( 5.889 9.066 7.634) 13.235 4.744 ( 4.077 2.140 -5.126) 6.891 4.823 ( -1.402 5.247 -10.926) 12.202 4.948 ( -5.627 6.473 -9.604) 12.877 5.011 ( -5.848 6.383 9.360) 12.750 5.417 ( -0.693 -9.483 7.953) 12.396 5.648 ( -0.990 -4.954 3.108) 5.931 5.745 ( 5.657 -6.670 3.629) 9.469 6.018 ( 2.432 -2.404 -4.913) 5.986 6.257 ( 5.051 -1.821 1.255) 5.514 6.469 ( -1.137 3.599 10.859) 11.497 6.552 ( 3.760 0.222 2.679) 4.622 6.790 ( -2.492 -5.790 -8.854) 10.869 6.888 ( -2.263 -4.131 3.098) 5.638 7.241 ( -1.444 2.686 -3.357) 4.535 7.458 ( -1.026 0.649 6.160) 6.279 7.753 ( -1.585 4.531 1.500) 5.029 8.199 ( -7.210 -0.492 2.886) 7.782 8.253 ( 4.901 0.351 -8.869) 10.139 8.680 ( -0.710 -7.859 -4.573) 9.120 8.771 ( -3.902 -1.366 -4.625) 6.203 8.953 ( 2.061 2.042 -2.298) 3.701 9.213 ( 1.293 3.453 1.773) 4.091 9.384 ( -0.707 3.408 3.598) 5.006 9.663 ( -6.054 -6.817 8.805) 12.674 10.147 ( 4.359 -4.715 -7.617) 9.962 10.328 ( 2.087 -0.572 -1.126) 2.439 10.839 ( 2.029 -10.833 5.285) 12.223 11.776 ( -0.199 2.884 -10.607) 10.994 12.527 ( -5.491 -0.967 1.811) 5.862 13.280 ( 4.188 2.235 14.962) 15.697 13.574 ( -1.140 -5.476 -3.058) 6.374 13.891 ( 0.520 2.097 -0.601) 2.243 14.020 ( -7.439 -2.575 -3.479) 8.607 14.310 ( 0.390 0.779 7.041) 7.095 14.770 ( 0.961 -1.555 -3.682) 4.111 15.038 ( 4.223 3.119 -5.911) 7.906 20.081 ( -0.626 0.267 -0.290) 0.740 20.510 ( -0.191 3.220 -9.353) 9.893 21.527 ( -2.239 1.869 5.921) 6.600 21.861 ( 1.625 -2.997 5.818) 6.743 21.987 ( -5.814 0.572 11.046) 12.496 22.586 ( -1.628 -7.165 -2.204) 7.671 23.203 ( 2.029 11.155 5.173) 12.462 23.742 ( 2.433 -1.775 12.403) 12.763 23.857 ( -6.922 -6.418 2.479) 9.759 25.006 ( 2.969 -0.365 -4.235) 5.184 25.190 ( 0.778 -0.231 -4.609) 4.679 25.369 ( 4.268 1.663 -10.551) 11.503 ======================= Grid point 117 (61/128) ======================= q-point: (-0.29 0.29 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.073 ( 1.631 9.603 18.806) 21.178 2.322 ( 9.020 27.401 9.676) 30.427 2.533 ( -12.846 4.375 3.182) 13.939 2.551 ( -0.525 6.123 1.449) 6.314 3.070 ( -17.333 8.890 5.548) 20.255 3.137 ( 0.064 9.237 -1.614) 9.378 3.611 ( 0.417 -7.844 17.416) 19.105 3.740 ( -5.696 1.889 -1.227) 6.126 3.961 ( 3.853 0.171 -0.188) 3.862 4.160 ( 3.344 7.029 4.506) 8.994 4.285 ( 1.685 4.637 5.224) 7.186 4.396 ( 1.398 6.327 1.661) 6.689 4.598 ( -5.737 6.356 -16.585) 18.665 4.719 ( 5.203 6.032 -1.321) 8.074 4.845 ( 1.017 0.601 -4.866) 5.007 5.011 ( 0.781 -8.552 6.110) 10.540 5.550 ( -1.806 -5.097 9.366) 10.815 5.645 ( -3.809 2.030 1.705) 4.641 5.919 ( 0.904 -9.816 2.103) 10.080 6.108 ( 6.337 0.003 -3.057) 7.036 6.357 ( 3.775 -0.146 7.116) 8.056 6.463 ( 0.476 1.445 2.552) 2.971 6.588 ( 0.763 1.330 -0.310) 1.564 6.799 ( -0.218 -1.968 -3.271) 3.824 6.893 ( -5.531 -6.918 -4.706) 10.030 7.274 ( 1.728 -5.875 -2.843) 6.752 7.438 ( -2.693 3.255 5.430) 6.880 7.694 ( 0.815 0.481 3.937) 4.049 8.141 ( -4.750 -3.004 -1.803) 5.903 8.331 ( 4.700 -2.972 -3.278) 6.455 8.660 ( -3.432 2.623 -5.573) 7.051 8.784 ( -3.093 -9.583 -3.524) 10.669 8.895 ( -2.467 3.870 -3.143) 5.563 9.208 ( 7.259 4.104 0.491) 8.354 9.411 ( 2.676 -0.402 8.698) 9.110 9.752 ( -6.450 -12.098 3.507) 14.152 10.242 ( 4.966 -1.705 -7.491) 9.148 10.353 ( 0.692 -0.974 -3.471) 3.670 11.063 ( 4.965 -9.772 4.274) 11.765 11.666 ( -2.377 3.908 -9.603) 10.637 12.493 ( -4.002 -1.789 5.621) 7.128 13.349 ( 0.537 0.108 13.011) 13.022 13.624 ( -4.957 -5.232 0.290) 7.213 13.895 ( 4.162 0.125 -1.636) 4.474 13.945 ( -3.904 -0.907 -4.105) 5.737 14.302 ( -1.911 2.357 6.194) 6.898 14.790 ( -0.335 -2.086 -5.284) 5.691 15.006 ( 3.320 4.869 -6.080) 8.467 20.069 ( -0.493 -0.030 -0.558) 0.745 20.460 ( 4.334 2.353 -7.279) 8.792 21.500 ( -1.150 1.407 5.875) 6.149 21.915 ( -5.921 -2.325 7.597) 9.909 22.025 ( 5.929 -2.854 11.075) 12.882 22.647 ( -1.862 -5.076 -3.105) 6.235 23.047 ( -3.962 10.939 6.397) 13.277 23.756 ( -7.808 -1.941 9.805) 12.684 24.000 ( 8.304 -7.783 3.624) 11.945 25.037 ( 4.396 0.604 -6.439) 7.820 25.177 ( -0.065 0.705 -2.968) 3.051 25.307 ( -2.237 3.423 -11.947) 12.628 ======================= Grid point 118 (62/128) ======================= q-point: (-0.14 0.29 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.995 ( 0.649 16.712 19.924) 26.013 2.061 ( 4.431 18.564 14.341) 23.873 2.343 ( -8.462 -0.520 -1.612) 8.630 2.487 ( 3.362 9.941 4.408) 11.382 2.708 ( -14.418 4.949 4.237) 15.822 3.006 ( 3.119 10.861 1.754) 11.435 3.537 ( -3.259 6.490 -1.954) 7.520 3.771 ( 1.776 0.819 14.647) 14.777 4.065 ( 1.288 2.383 7.066) 7.567 4.093 ( -7.494 -2.392 8.233) 11.387 4.265 ( 4.248 7.731 -4.700) 9.995 4.309 ( 9.217 8.573 10.774) 16.569 4.387 ( -1.155 8.304 -11.341) 14.103 4.757 ( 3.086 -0.787 -4.748) 5.717 4.899 ( 7.661 -2.108 -3.465) 8.668 5.260 ( 4.361 -14.263 3.611) 15.345 5.483 ( -1.824 9.409 7.277) 12.034 5.661 ( -5.061 -8.672 1.604) 10.168 5.982 ( -3.929 0.974 0.406) 4.069 6.139 ( 1.242 2.924 -1.636) 3.573 6.410 ( 5.067 -0.039 2.390) 5.602 6.452 ( -5.113 -3.941 -1.053) 6.541 6.552 ( -4.719 -1.178 -0.542) 4.894 6.829 ( 4.921 2.558 -2.785) 6.206 6.953 ( -6.214 -12.414 -1.087) 13.925 7.339 ( -3.462 -2.964 -0.987) 4.663 7.389 ( 1.034 -1.224 0.431) 1.659 7.775 ( 2.652 -3.418 3.832) 5.779 8.126 ( -2.670 -2.157 -2.534) 4.266 8.383 ( 4.028 2.332 -4.959) 6.801 8.610 ( -3.613 -0.504 -0.531) 3.687 8.789 ( 0.369 -1.496 -0.475) 1.612 8.901 ( -3.674 -10.453 -3.905) 11.748 9.263 ( 6.794 2.367 -1.959) 7.457 9.498 ( 3.327 -0.183 10.595) 11.107 9.841 ( -7.792 -11.355 -0.298) 13.774 10.254 ( 0.242 1.609 -5.230) 5.477 10.346 ( 1.073 1.261 -6.267) 6.482 11.225 ( -0.308 -1.452 0.464) 1.555 11.571 ( 0.889 0.220 -5.725) 5.798 12.532 ( -0.388 -4.123 10.500) 11.288 13.340 ( -12.255 -0.925 9.563) 15.572 13.594 ( -2.631 -1.922 0.172) 3.263 13.917 ( -0.669 -0.593 -4.978) 5.058 14.006 ( 8.725 -1.568 2.726) 9.275 14.240 ( -2.750 3.167 4.087) 5.856 14.771 ( -2.190 -0.254 -5.009) 5.472 14.952 ( 3.544 5.103 -6.006) 8.641 20.065 ( -0.126 -0.218 -0.512) 0.571 20.514 ( 9.306 -0.680 -9.487) 13.307 21.500 ( -0.303 0.338 6.746) 6.761 21.881 ( -5.316 -0.368 6.903) 8.720 22.273 ( 9.866 -9.728 12.701) 18.796 22.656 ( -3.924 -1.974 -1.843) 4.763 22.827 ( -8.813 8.822 6.932) 14.267 23.705 ( -7.382 -1.554 5.832) 9.535 24.282 ( 11.783 -7.827 4.848) 14.954 25.005 ( -1.607 7.115 -14.309) 16.061 25.144 ( -0.088 3.115 -2.073) 3.743 25.154 ( -2.628 1.371 -5.508) 6.255 ======================= Grid point 122 (63/128) ======================= q-point: ( 0.43 0.43 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.203 ( 4.057 0.000 5.409) 6.762 2.590 ( 0.729 0.000 15.420) 15.437 2.902 ( 0.406 0.000 10.171) 10.179 2.934 ( 0.947 0.000 11.664) 11.702 3.211 ( -6.082 -0.000 9.948) 11.660 3.317 ( 7.098 0.000 14.150) 15.830 3.442 ( -2.143 -0.000 -10.056) 10.282 3.523 ( 12.395 0.000 -2.321) 12.611 3.967 ( -3.839 -0.000 -4.175) 5.672 4.014 ( -0.051 -0.000 4.181) 4.181 4.451 ( -4.988 -0.000 -7.927) 9.366 4.722 ( 1.931 0.000 7.196) 7.451 4.751 ( -6.557 -0.000 -9.288) 11.369 4.984 ( -0.127 -0.000 3.641) 3.644 5.028 ( -5.596 -0.000 -19.725) 20.503 5.151 ( 8.151 0.000 11.411) 14.024 5.341 ( 4.600 0.000 9.440) 10.501 5.353 ( 3.886 0.000 -5.909) 7.072 5.695 ( 3.973 0.000 4.266) 5.830 6.000 ( -4.506 -0.000 -2.370) 5.092 6.235 ( 5.465 0.000 -2.442) 5.986 6.509 ( -1.111 -0.000 10.058) 10.119 6.570 ( -5.356 -0.000 1.949) 5.699 6.727 ( 2.523 0.000 4.010) 4.738 6.732 ( -2.837 -0.000 -4.740) 5.525 7.333 ( -8.708 -0.000 1.976) 8.929 7.495 ( 1.828 0.000 2.983) 3.498 7.805 ( 1.192 0.000 -0.075) 1.194 8.238 ( -12.980 -0.000 7.195) 14.841 8.287 ( 5.948 0.000 -12.208) 13.580 8.552 ( -1.393 -0.000 -6.671) 6.815 8.705 ( -1.488 -0.000 -3.232) 3.558 8.948 ( 3.182 0.000 -1.721) 3.618 9.180 ( 1.516 0.000 0.869) 1.747 9.533 ( -0.242 -0.000 1.977) 1.992 9.642 ( -7.675 -0.000 12.259) 14.463 10.006 ( 1.332 0.000 -6.588) 6.722 10.428 ( 4.977 0.000 -7.917) 9.351 10.554 ( 0.513 0.000 16.324) 16.332 11.812 ( 0.267 0.000 -12.961) 12.964 12.513 ( -4.718 -0.000 -0.742) 4.776 13.331 ( 3.070 0.000 17.750) 18.014 13.473 ( -1.314 -0.000 -7.034) 7.156 13.950 ( -5.546 -0.000 -5.366) 7.716 13.952 ( -1.696 -0.000 0.546) 1.782 14.322 ( 1.519 0.000 8.331) 8.468 14.741 ( -0.937 -0.000 -3.125) 3.263 15.090 ( 5.280 0.000 -5.037) 7.297 20.085 ( -0.955 -0.000 -0.235) 0.984 20.568 ( 0.210 0.000 -11.313) 11.315 21.558 ( -3.468 -0.000 6.462) 7.334 21.817 ( 1.026 0.000 5.050) 5.153 22.009 ( -4.673 -0.000 11.095) 12.039 22.438 ( -1.819 -0.000 -0.898) 2.029 23.497 ( 4.025 0.000 1.402) 4.262 23.570 ( 1.027 0.000 6.115) 6.200 23.812 ( -5.891 -0.000 12.134) 13.489 24.984 ( 1.637 0.000 -1.648) 2.323 25.182 ( 0.991 0.000 -5.430) 5.519 25.398 ( 4.735 0.000 -11.328) 12.278 ======================= Grid point 123 (64/128) ======================= q-point: (-0.43 -0.57 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.252 ( 3.015 2.691 8.303) 9.234 2.578 ( -11.584 -1.137 2.551) 11.916 2.725 ( -10.565 8.468 13.875) 19.387 3.027 ( -3.686 2.489 4.239) 6.144 3.133 ( -1.688 5.191 13.187) 14.273 3.347 ( 3.739 4.181 0.123) 5.611 3.456 ( 3.104 1.187 16.671) 16.999 3.746 ( -0.874 7.339 -5.002) 8.925 3.819 ( 5.344 -11.549 -3.596) 13.224 4.147 ( -7.757 -8.276 -2.417) 11.598 4.259 ( -8.035 -1.573 -4.903) 9.543 4.674 ( -1.562 4.240 -1.218) 4.680 4.686 ( -1.144 1.858 -6.556) 6.909 4.867 ( 0.232 6.556 -11.124) 12.914 4.937 ( -5.421 2.497 5.540) 8.143 5.207 ( 4.203 11.842 5.991) 13.921 5.357 ( 3.838 -3.090 7.206) 8.729 5.556 ( 0.726 -7.266 4.341) 8.495 5.776 ( 4.777 -0.630 5.240) 7.119 6.025 ( 5.933 -2.352 -1.105) 6.477 6.308 ( 6.537 -1.442 -5.528) 8.682 6.532 ( -1.602 -2.708 4.349) 5.367 6.561 ( -0.297 -3.845 -2.475) 4.583 6.674 ( 0.778 2.519 0.749) 2.741 6.817 ( 0.317 -3.606 1.496) 3.917 7.226 ( -4.520 1.681 2.191) 5.297 7.510 ( 1.060 2.641 4.270) 5.132 7.790 ( -1.752 2.496 0.635) 3.115 8.082 ( -10.466 -0.228 5.606) 11.875 8.281 ( 1.454 -0.098 -10.150) 10.254 8.559 ( 1.535 -4.074 -7.588) 8.749 8.683 ( -3.171 -1.297 -3.720) 5.057 8.989 ( 2.368 1.395 -0.602) 2.814 9.241 ( 3.284 -2.917 0.073) 4.393 9.528 ( 2.259 4.514 5.311) 7.327 9.547 ( -6.053 2.072 9.249) 11.247 10.089 ( 5.085 -6.426 -6.180) 10.264 10.409 ( 4.159 4.612 -2.369) 6.647 10.735 ( 2.517 -10.590 10.848) 15.368 11.744 ( -1.841 1.063 -13.845) 14.007 12.457 ( -3.803 -0.392 0.753) 3.896 13.384 ( -1.239 1.693 12.588) 12.762 13.477 ( -1.204 -3.966 -1.787) 4.513 13.892 ( 1.130 -0.142 -4.358) 4.505 13.922 ( -2.883 -0.448 -1.843) 3.451 14.356 ( -0.493 1.045 8.671) 8.748 14.722 ( -1.416 -1.610 -4.298) 4.803 15.118 ( 3.615 2.150 -4.761) 6.353 20.069 ( -1.042 0.008 -0.533) 1.171 20.534 ( 2.998 1.851 -9.923) 10.530 21.527 ( -3.430 0.403 5.687) 6.653 21.850 ( -1.346 -1.229 6.772) 7.013 22.017 ( 1.772 0.798 9.842) 10.032 22.462 ( -0.472 -5.231 -1.606) 5.492 23.400 ( -0.566 11.723 4.609) 12.609 23.713 ( -1.634 -7.413 3.071) 8.188 23.801 ( 1.147 -0.460 13.822) 13.877 25.016 ( 2.573 -1.184 -2.301) 3.649 25.173 ( 0.166 -0.400 -4.920) 4.939 25.374 ( -0.654 1.142 -12.509) 12.578 ======================= Grid point 124 (65/128) ======================= q-point: (-0.29 0.43 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.230 ( -6.915 2.765 9.299) 11.914 2.418 ( -12.425 7.795 7.251) 16.362 2.461 ( -13.559 -0.321 1.830) 13.686 2.857 ( 0.529 15.014 6.749) 16.470 3.045 ( -5.902 11.733 9.292) 16.088 3.236 ( -1.709 6.007 3.560) 7.189 3.536 ( -3.413 -0.799 8.167) 8.887 3.702 ( -0.414 -4.192 3.002) 5.172 3.971 ( -1.419 -1.277 -2.465) 3.118 4.076 ( -1.865 -8.529 -2.021) 8.962 4.368 ( 1.688 -6.492 -0.724) 6.747 4.507 ( -5.416 1.703 -12.206) 13.461 4.651 ( 1.039 5.821 6.059) 8.466 4.758 ( 2.596 6.255 -6.067) 9.093 4.900 ( -3.980 -5.124 7.779) 10.130 5.081 ( 7.231 14.875 5.362) 17.386 5.473 ( 0.738 -3.335 1.748) 3.837 5.642 ( -0.907 -2.211 10.428) 10.698 5.846 ( 0.863 -1.543 1.980) 2.655 6.146 ( 4.507 -3.173 -3.047) 6.299 6.412 ( 7.189 -0.031 -3.157) 7.852 6.519 ( -7.933 -1.832 -9.296) 12.357 6.607 ( 0.572 -3.877 5.942) 7.118 6.688 ( 3.715 4.955 5.434) 8.239 6.837 ( 0.821 -1.490 -6.512) 6.730 7.199 ( -0.240 -1.336 0.703) 1.529 7.491 ( -0.773 2.604 5.535) 6.165 7.716 ( -2.117 1.806 3.014) 4.103 8.032 ( -3.680 -3.365 2.731) 5.685 8.318 ( 2.895 -5.072 -5.333) 7.909 8.615 ( -3.010 -0.460 -6.170) 6.880 8.629 ( 0.748 -3.817 -5.671) 6.877 8.933 ( -1.717 5.995 -0.407) 6.249 9.312 ( 3.643 0.861 0.924) 3.856 9.507 ( -6.800 -8.540 2.379) 11.173 9.571 ( 8.170 5.290 8.489) 12.915 10.223 ( 3.697 -4.334 -5.683) 8.047 10.405 ( 4.474 2.700 -2.798) 5.928 10.993 ( 5.174 -11.500 8.571) 15.247 11.629 ( -3.654 2.339 -12.719) 13.439 12.434 ( -2.894 -1.938 4.452) 5.652 13.354 ( -7.427 1.177 10.879) 13.225 13.506 ( -1.103 -3.759 -2.742) 4.782 13.891 ( -1.214 -0.832 -3.211) 3.533 13.964 ( 8.206 -1.233 0.671) 8.325 14.333 ( -3.011 2.597 6.962) 8.017 14.716 ( -1.796 -2.510 -4.629) 5.564 15.091 ( 1.890 3.834 -5.078) 6.638 20.057 ( -0.567 -0.236 -0.560) 0.831 20.532 ( 6.040 1.552 -9.893) 11.695 21.501 ( -2.970 -0.290 5.198) 5.994 21.858 ( -3.375 -0.845 7.429) 8.204 22.122 ( 7.209 -1.669 10.268) 12.657 22.539 ( 0.221 -5.390 -2.825) 6.089 23.179 ( -6.697 13.700 6.237) 16.476 23.699 ( -4.756 1.047 8.221) 9.555 24.019 ( 9.132 -9.080 8.070) 15.198 25.063 ( 3.115 -0.973 -4.434) 5.506 25.160 ( -0.931 -0.322 -4.207) 4.321 25.254 ( -5.517 2.506 -12.204) 13.626 ======================= Grid point 125 (66/128) ======================= q-point: (-0.14 0.43 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.012 ( -22.423 0.909 1.599) 22.498 2.187 ( -6.531 -2.259 10.100) 12.238 2.368 ( -4.426 9.465 9.640) 14.217 2.664 ( -4.868 9.843 10.445) 15.155 2.834 ( 7.232 14.123 1.140) 15.908 3.175 ( 4.526 7.843 2.693) 9.447 3.492 ( -5.336 -2.430 2.673) 6.443 3.780 ( -6.611 -7.417 11.504) 15.200 4.032 ( 1.129 -3.211 0.416) 3.429 4.056 ( -4.570 0.846 -1.290) 4.824 4.393 ( 3.526 6.768 2.132) 7.924 4.435 ( -0.640 1.801 -7.137) 7.388 4.647 ( 0.614 -1.442 5.620) 5.835 4.712 ( 3.941 4.423 0.988) 6.006 5.046 ( 9.095 -0.778 -3.620) 9.820 5.053 ( -0.134 -7.729 6.803) 10.298 5.489 ( -3.988 -3.645 -0.114) 5.404 5.643 ( -0.732 6.558 11.308) 13.092 5.891 ( -1.478 -4.002 -5.304) 6.807 6.187 ( 0.639 0.035 -4.073) 4.123 6.351 ( -9.563 2.537 -2.123) 10.119 6.435 ( 1.713 5.218 3.582) 6.557 6.670 ( 6.489 7.530 0.997) 9.990 6.691 ( -5.358 -8.556 1.329) 10.182 6.867 ( 2.092 -3.409 -5.969) 7.185 7.239 ( 1.558 -2.699 -1.404) 3.418 7.441 ( -1.289 3.876 4.594) 6.147 7.734 ( -1.150 -4.027 2.706) 4.986 8.070 ( 0.513 -2.287 1.424) 2.743 8.436 ( 4.505 -3.633 -2.210) 6.195 8.567 ( -1.270 -0.002 -2.594) 2.888 8.685 ( -1.661 -7.500 -5.585) 9.498 8.819 ( 0.308 4.612 -1.716) 4.931 9.344 ( 1.322 -0.355 0.348) 1.412 9.565 ( -5.492 -8.626 -1.824) 10.388 9.644 ( 6.787 3.846 9.809) 12.533 10.251 ( -0.112 0.972 -4.385) 4.493 10.413 ( 4.352 3.415 -4.822) 7.338 11.204 ( 0.751 -2.282 2.075) 3.174 11.537 ( 0.626 -2.727 -7.798) 8.285 12.489 ( -0.346 -5.551 9.632) 11.123 13.213 ( -12.083 3.271 7.179) 14.430 13.564 ( 2.247 -3.623 0.169) 4.267 13.879 ( -0.944 -0.337 -4.247) 4.364 14.123 ( 9.344 -0.910 3.963) 10.190 14.266 ( -2.523 2.631 4.759) 5.995 14.705 ( -2.385 -1.761 -3.666) 4.715 15.030 ( 1.105 3.765 -6.087) 7.242 20.057 ( 0.065 -0.451 -0.345) 0.572 20.577 ( 6.847 -0.548 -12.047) 13.868 21.496 ( -2.437 -1.377 5.443) 6.120 21.844 ( -3.253 0.016 6.740) 7.484 22.340 ( 10.155 -6.231 11.313) 16.429 22.576 ( -2.739 -1.175 -2.104) 3.648 22.880 ( -9.907 11.977 7.388) 17.210 23.652 ( -3.752 1.269 8.479) 9.358 24.334 ( 11.281 -9.012 6.203) 15.715 24.968 ( -9.086 5.530 -16.025) 19.234 25.134 ( 1.326 -0.905 -2.401) 2.888 25.173 ( 1.062 0.808 -3.184) 3.453 ======================= Grid point 130 (67/128) ======================= q-point: (-0.43 -0.43 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.308 ( -1.819 -0.000 5.888) 6.163 2.335 ( -21.313 -0.000 1.796) 21.388 2.676 ( -20.767 -0.000 6.336) 21.712 2.841 ( -6.304 -0.000 17.235) 18.352 3.367 ( 4.303 0.000 11.179) 11.979 3.402 ( 3.637 0.000 -2.467) 4.395 3.598 ( -0.039 -0.000 16.452) 16.453 3.763 ( 5.965 0.000 -4.834) 7.678 3.795 ( -17.357 -0.000 0.346) 17.360 3.882 ( -3.005 -0.000 0.141) 3.008 4.097 ( -5.430 -0.000 -6.457) 8.437 4.573 ( -5.500 -0.000 -15.024) 15.999 4.661 ( -3.881 -0.000 -4.996) 6.326 4.892 ( -7.453 -0.000 9.194) 11.835 4.947 ( 3.252 0.000 -0.275) 3.264 5.343 ( 2.988 0.000 0.615) 3.050 5.469 ( 2.790 0.000 1.971) 3.416 5.543 ( 5.994 0.000 10.850) 12.395 5.868 ( 2.968 0.000 8.301) 8.815 6.088 ( 4.160 0.000 1.766) 4.519 6.322 ( -0.852 -0.000 -8.238) 8.282 6.443 ( 6.555 0.000 -16.682) 17.924 6.584 ( 3.262 0.000 7.651) 8.317 6.779 ( 5.251 0.000 6.093) 8.044 6.795 ( 1.287 0.000 -2.755) 3.041 7.224 ( 0.561 0.000 5.202) 5.232 7.547 ( -1.808 -0.000 4.243) 4.613 7.774 ( -3.537 -0.000 -0.871) 3.643 7.976 ( -6.620 -0.000 7.351) 9.892 8.224 ( -1.514 -0.000 -9.224) 9.347 8.539 ( 2.749 0.000 -9.685) 10.068 8.620 ( -2.519 -0.000 -2.057) 3.252 9.056 ( 2.692 0.000 1.353) 3.013 9.266 ( 5.487 0.000 -0.441) 5.505 9.459 ( -8.054 -0.000 6.021) 10.056 9.696 ( 7.683 0.000 5.277) 9.320 10.093 ( 6.302 0.000 -5.107) 8.112 10.500 ( 3.820 0.000 -5.967) 7.085 10.729 ( 3.166 0.000 19.310) 19.568 11.663 ( -3.021 -0.000 -15.608) 15.897 12.414 ( -2.764 -0.000 1.345) 3.074 13.384 ( -7.771 -0.000 12.303) 14.551 13.423 ( 1.028 0.000 -6.109) 6.195 13.878 ( -1.946 -0.000 -2.415) 3.101 13.944 ( 7.774 0.000 0.365) 7.782 14.375 ( -2.892 -0.000 8.089) 8.591 14.671 ( -1.583 -0.000 -4.080) 4.376 15.153 ( 1.554 0.000 -4.676) 4.927 20.053 ( -0.791 -0.000 -0.595) 0.990 20.566 ( 5.059 0.000 -11.229) 12.315 21.493 ( -4.424 -0.000 4.935) 6.627 21.844 ( -2.135 -0.000 7.693) 7.984 22.111 ( 5.809 0.000 8.542) 10.330 22.429 ( 2.113 0.000 -0.750) 2.242 23.556 ( -4.308 -0.000 5.123) 6.693 23.596 ( 1.372 0.000 2.654) 2.988 23.866 ( 2.274 0.000 15.175) 15.345 25.035 ( 2.781 0.000 -1.922) 3.381 25.150 ( -0.466 -0.000 -4.420) 4.444 25.289 ( -5.885 -0.000 -13.932) 15.123 ======================= Grid point 131 (68/128) ======================= q-point: (-0.29 -0.43 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.043 ( -21.496 -1.701 6.117) 22.415 2.167 ( -27.219 2.935 6.044) 28.036 2.446 ( -3.024 1.467 2.955) 4.476 2.856 ( -8.923 -4.846 10.474) 14.588 3.304 ( 3.625 14.762 3.870) 15.685 3.359 ( -6.338 8.503 16.881) 19.936 3.504 ( -14.680 -2.077 2.359) 15.013 3.598 ( -1.007 4.378 4.236) 6.174 3.898 ( -1.780 -5.925 1.107) 6.285 3.910 ( -0.007 -9.148 -4.988) 10.420 4.162 ( -3.859 -14.151 0.286) 14.671 4.455 ( 0.382 0.992 -14.021) 14.061 4.582 ( -6.565 -1.668 -3.691) 7.714 4.832 ( -5.750 0.243 12.137) 13.432 4.957 ( 5.701 5.953 1.995) 8.481 5.310 ( 0.055 5.750 -0.611) 5.783 5.472 ( -2.023 0.549 -1.369) 2.503 5.691 ( 6.728 -0.429 8.836) 11.114 5.894 ( 0.518 2.454 7.307) 7.725 6.141 ( 0.992 -2.808 -0.133) 2.981 6.260 ( -5.204 -3.556 -13.048) 14.490 6.541 ( 9.577 1.547 -6.526) 11.692 6.669 ( 4.681 0.398 6.081) 7.685 6.794 ( 0.921 0.401 -6.332) 6.411 6.855 ( 5.672 3.481 5.506) 8.637 7.258 ( 4.281 2.306 2.931) 5.678 7.518 ( -1.998 1.179 5.100) 5.603 7.699 ( -4.598 0.905 0.026) 4.687 7.984 ( 1.217 -2.326 6.805) 7.294 8.230 ( 1.234 -5.821 -6.967) 9.162 8.523 ( -3.603 -2.446 -5.527) 7.037 8.611 ( 2.379 -0.137 -6.073) 6.524 9.023 ( -0.835 5.632 1.624) 5.920 9.364 ( -4.606 2.256 2.436) 5.678 9.383 ( 6.249 -2.466 -0.725) 6.757 9.791 ( 8.611 4.028 4.952) 10.719 10.195 ( 4.588 -3.897 -4.762) 7.675 10.498 ( 3.178 2.875 -1.474) 4.532 10.952 ( 6.672 -9.471 16.474) 20.139 11.548 ( -4.136 1.028 -14.972) 15.566 12.395 ( -1.979 -0.893 4.124) 4.661 13.292 ( -9.038 1.656 8.742) 12.683 13.448 ( 1.666 -3.226 -4.151) 5.515 13.858 ( -0.013 -0.606 -3.134) 3.192 14.092 ( 10.969 -0.717 4.447) 11.858 14.334 ( -4.777 1.365 5.780) 7.622 14.649 ( -1.468 -1.310 -3.164) 3.725 15.125 ( -0.689 2.005 -5.232) 5.645 20.046 ( -0.113 -0.214 -0.445) 0.507 20.588 ( 5.314 0.705 -12.643) 13.732 21.455 ( -4.352 -1.020 4.292) 6.197 21.844 ( -2.151 0.050 8.023) 8.307 22.242 ( 8.059 -1.072 7.558) 11.101 22.494 ( 3.354 -2.704 -0.959) 4.413 23.332 ( -6.753 16.109 6.605) 18.674 23.684 ( -1.369 -2.398 4.780) 5.520 24.040 ( 7.709 -8.118 12.944) 17.114 25.063 ( -1.408 0.769 -7.073) 7.252 25.108 ( -4.102 0.180 -7.024) 8.136 25.149 ( -3.040 -1.735 -6.558) 7.434 ======================= Grid point 132 (69/128) ======================= q-point: (-0.14 -0.43 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.702 ( -27.776 2.959 5.969) 28.564 1.912 ( -16.914 -11.348 10.672) 22.995 2.408 ( -5.114 1.804 3.895) 6.677 2.817 ( -3.165 1.762 9.913) 10.554 3.077 ( 1.178 13.205 -5.238) 14.254 3.337 ( -0.581 2.013 20.738) 20.843 3.393 ( -11.234 -6.499 5.103) 13.946 3.548 ( -5.931 -0.607 8.569) 10.439 3.920 ( -4.389 -6.169 -3.103) 8.182 3.995 ( -1.423 -3.879 -4.990) 6.478 4.312 ( -5.437 -12.625 1.914) 13.879 4.475 ( 0.437 -3.734 -12.316) 12.877 4.540 ( 0.914 -0.082 5.716) 5.790 4.823 ( -2.637 -2.002 8.332) 8.966 4.970 ( 4.986 3.170 0.521) 5.932 5.204 ( -1.895 5.147 -3.262) 6.382 5.412 ( -5.259 -2.708 -0.392) 5.929 5.744 ( 1.611 4.450 2.813) 5.506 5.890 ( 2.730 3.258 1.763) 4.602 6.182 ( -8.033 -2.532 -6.999) 10.951 6.206 ( 4.044 -0.177 1.092) 4.193 6.552 ( 0.378 3.802 4.015) 5.542 6.686 ( 2.931 7.622 1.680) 8.337 6.780 ( -0.511 -2.501 -2.325) 3.453 6.902 ( 9.228 5.603 1.832) 10.950 7.290 ( 4.592 2.183 -1.854) 5.412 7.481 ( -1.818 2.632 3.286) 4.587 7.662 ( -3.111 -2.605 1.563) 4.348 8.096 ( 5.702 -1.315 5.485) 8.021 8.368 ( 2.663 -9.840 -3.341) 10.728 8.513 ( -1.032 -4.260 -3.116) 5.378 8.599 ( 0.341 1.221 -7.838) 7.940 8.934 ( 1.712 5.710 -0.124) 5.963 9.286 ( -4.674 0.399 0.966) 4.789 9.473 ( 2.641 -1.420 -1.836) 3.516 9.859 ( 8.357 5.136 5.111) 11.061 10.252 ( 1.295 -0.004 -3.490) 3.722 10.501 ( 3.008 2.592 -1.216) 4.153 11.206 ( 3.198 -2.105 5.316) 6.551 11.460 ( 0.614 -4.169 -8.376) 9.377 12.440 ( -0.183 -4.657 8.983) 10.120 13.158 ( -8.146 3.926 7.644) 11.840 13.532 ( 2.784 -5.010 -0.826) 5.791 13.860 ( 0.687 0.215 -4.123) 4.185 14.246 ( 1.464 1.478 5.443) 5.827 14.296 ( 5.527 -0.146 4.657) 7.228 14.637 ( -1.861 -1.628 -2.799) 3.735 15.047 ( -1.913 2.366 -6.656) 7.318 20.052 ( 0.433 -0.420 -0.238) 0.648 20.592 ( 2.880 -0.086 -13.836) 14.133 21.441 ( -3.533 -2.322 4.319) 6.044 21.843 ( -1.589 0.616 7.898) 8.079 22.423 ( 8.035 -4.575 3.983) 10.067 22.547 ( 0.191 0.770 1.253) 1.483 22.982 ( -9.907 16.105 10.753) 21.752 23.689 ( -0.002 2.319 7.426) 7.780 24.372 ( 11.883 -10.440 7.540) 17.523 24.821 ( -13.270 3.487 -16.037) 21.105 25.131 ( 1.158 -1.137 -1.235) 2.039 25.164 ( 1.777 -2.911 -3.949) 5.218 ======================= Grid point 138 (70/128) ======================= q-point: (-0.29 -0.29 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.721 ( -23.621 -0.000 10.066) 25.676 1.855 ( -29.400 -0.000 11.047) 31.407 2.400 ( -5.366 -0.000 1.025) 5.463 2.637 ( -20.405 -0.000 11.914) 23.628 3.166 ( -14.970 -0.000 1.266) 15.023 3.502 ( -10.731 -0.000 24.500) 26.747 3.535 ( 4.407 0.000 7.741) 8.908 3.681 ( 3.050 0.000 0.327) 3.067 3.721 ( -5.532 -0.000 -8.275) 9.954 3.820 ( -0.809 -0.000 1.118) 1.380 3.961 ( -7.297 -0.000 -3.825) 8.239 4.436 ( 3.481 0.000 -12.000) 12.494 4.470 ( -5.415 -0.000 0.819) 5.476 4.816 ( -4.242 -0.000 15.086) 15.671 5.094 ( 6.073 0.000 2.421) 6.537 5.299 ( -5.428 -0.000 -3.028) 6.215 5.380 ( -8.355 -0.000 -8.540) 11.947 5.766 ( 0.729 0.000 -1.176) 1.384 5.919 ( -2.122 -0.000 6.147) 6.503 6.168 ( 7.246 0.000 8.490) 11.162 6.193 ( 3.082 0.000 -13.726) 14.068 6.703 ( -1.452 -0.000 6.981) 7.131 6.725 ( 13.873 0.000 -7.055) 15.564 6.820 ( 1.104 0.000 -2.210) 2.471 6.975 ( 5.669 0.000 3.590) 6.710 7.347 ( 3.794 0.000 2.658) 4.632 7.536 ( 1.152 0.000 4.827) 4.962 7.621 ( -6.299 -0.000 -1.914) 6.584 8.060 ( 8.094 0.000 9.075) 12.160 8.166 ( 1.191 0.000 -8.099) 8.186 8.440 ( -2.040 -0.000 -3.813) 4.324 8.618 ( 1.800 0.000 -6.996) 7.224 9.023 ( -5.262 -0.000 2.568) 5.855 9.388 ( -0.110 -0.000 0.406) 0.420 9.452 ( 7.144 0.000 -1.279) 7.258 9.943 ( 7.706 0.000 0.734) 7.741 10.212 ( 4.495 0.000 -4.491) 6.354 10.548 ( 1.493 0.000 0.650) 1.629 11.071 ( 11.014 0.000 22.607) 25.147 11.440 ( -4.408 -0.000 -15.197) 15.824 12.385 ( -0.907 -0.000 5.693) 5.765 13.225 ( -7.250 -0.000 8.830) 11.425 13.430 ( 1.975 0.000 -3.721) 4.213 13.855 ( 2.014 0.000 -3.411) 3.962 14.269 ( 12.240 0.000 6.275) 13.754 14.292 ( -4.972 -0.000 4.024) 6.396 14.610 ( -1.643 -0.000 -2.127) 2.688 15.091 ( -3.450 -0.000 -6.012) 6.932 20.046 ( 0.480 0.000 -0.294) 0.563 20.598 ( 2.509 0.000 -14.631) 14.845 21.401 ( -4.124 -0.000 3.942) 5.705 21.854 ( -1.273 -0.000 9.124) 9.213 22.357 ( 6.771 0.000 3.410) 7.581 22.539 ( 5.467 0.000 0.141) 5.468 23.496 ( -1.439 -0.000 6.981) 7.128 23.590 ( -2.958 -0.000 1.486) 3.311 24.127 ( 7.644 0.000 16.561) 18.240 24.885 ( -15.110 -0.000 -14.570) 20.991 25.084 ( 1.353 0.000 -4.107) 4.325 25.112 ( 0.183 0.000 -1.189) 1.203 ======================= Grid point 139 (71/128) ======================= q-point: (-0.14 -0.29 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.407 ( -28.288 5.632 13.302) 31.763 1.569 ( -17.415 -8.892 18.876) 27.178 2.337 ( -5.848 -1.759 1.838) 6.378 2.504 ( -24.691 -19.054 14.644) 34.455 3.064 ( -5.717 -2.860 -1.369) 6.537 3.298 ( -9.605 10.791 11.152) 18.250 3.506 ( -0.141 8.337 12.966) 15.415 3.581 ( -3.340 2.039 3.133) 5.013 3.752 ( -4.437 -2.848 -6.057) 8.030 3.894 ( 2.633 -6.421 -2.557) 7.396 3.993 ( -7.764 -15.836 3.401) 17.961 4.425 ( -2.049 -0.575 -0.779) 2.266 4.504 ( 3.480 -5.410 -2.821) 7.024 4.818 ( -2.238 1.400 11.176) 11.484 5.077 ( -5.556 3.970 -4.777) 8.334 5.215 ( -6.485 3.060 -7.549) 10.412 5.245 ( 0.736 -2.087 0.661) 2.310 5.759 ( -2.386 -2.534 -4.421) 5.626 5.930 ( -0.066 -1.817 2.805) 3.343 6.168 ( 5.364 5.119 -9.276) 11.875 6.322 ( 7.392 2.752 10.068) 12.789 6.643 ( -1.972 4.668 2.596) 5.694 6.765 ( -2.326 3.810 4.216) 6.140 6.838 ( 5.481 2.848 -3.107) 6.914 7.084 ( 8.396 0.038 1.811) 8.589 7.378 ( 3.439 2.973 -0.908) 4.636 7.501 ( -3.545 2.357 0.463) 4.282 7.600 ( 0.185 -1.364 1.905) 2.351 8.207 ( 0.923 -5.166 -3.564) 6.343 8.250 ( 10.999 -2.335 6.013) 12.751 8.451 ( 2.092 -2.751 -4.492) 5.668 8.610 ( 2.318 0.156 -7.204) 7.569 8.950 ( -4.758 0.523 2.265) 5.296 9.335 ( 0.266 5.953 0.485) 5.979 9.513 ( 3.049 1.944 -1.642) 3.972 10.023 ( 6.307 1.580 -1.669) 6.713 10.259 ( 2.555 -0.882 -4.281) 5.063 10.565 ( 1.497 1.634 3.537) 4.174 11.274 ( 0.866 3.648 -2.012) 4.255 11.402 ( 7.385 -6.109 3.824) 10.319 12.424 ( 0.672 -2.213 9.563) 9.839 13.163 ( -2.931 3.075 10.403) 11.237 13.490 ( 2.730 -4.974 -0.896) 5.744 13.875 ( 2.673 0.614 -4.339) 5.134 14.247 ( -2.572 0.248 3.914) 4.690 14.446 ( 8.447 1.745 5.639) 10.305 14.589 ( -0.048 -1.648 -2.352) 2.872 14.993 ( -5.559 0.510 -8.049) 9.796 20.055 ( 0.707 -0.181 -0.259) 0.774 20.546 ( -2.158 0.021 -14.341) 14.502 21.380 ( -2.780 -1.650 4.312) 5.389 21.874 ( -0.315 0.644 10.294) 10.319 22.443 ( 2.103 -1.284 -2.306) 3.374 22.611 ( 4.916 0.821 1.942) 5.349 23.194 ( -6.977 23.003 11.172) 26.507 23.732 ( 3.936 -4.934 3.629) 7.280 24.396 ( 10.658 -12.350 4.657) 16.965 24.599 ( -16.156 2.476 -8.653) 18.494 25.104 ( -0.207 -2.992 -2.266) 3.759 25.131 ( 1.875 -1.978 -2.591) 3.760 ======================= Grid point 146 (72/128) ======================= q-point: (-0.14 -0.14 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.214 ( -22.042 -0.000 20.623) 30.185 1.304 ( -16.764 -0.000 24.729) 29.876 2.035 ( -23.070 -0.000 27.687) 36.039 2.243 ( -5.528 -0.000 2.666) 6.137 3.004 ( -1.197 -0.000 -0.525) 1.307 3.231 ( -17.272 -0.000 9.353) 19.642 3.433 ( -9.875 -0.000 -8.689) 13.153 3.672 ( -7.317 -0.000 2.510) 7.735 3.677 ( 0.835 0.000 7.570) 7.616 3.790 ( 1.698 0.000 2.906) 3.366 3.906 ( 6.504 0.000 1.048) 6.588 4.384 ( -4.757 -0.000 10.023) 11.094 4.516 ( 4.953 0.000 -4.161) 6.468 4.862 ( 0.142 0.000 9.275) 9.276 4.894 ( -12.086 -0.000 -18.413) 22.025 5.089 ( -6.974 -0.000 1.031) 7.050 5.388 ( 8.758 0.000 5.578) 10.383 5.677 ( -0.901 -0.000 -5.623) 5.695 5.926 ( 1.304 0.000 -0.923) 1.598 6.255 ( 6.424 0.000 -10.668) 12.454 6.488 ( 2.208 0.000 11.044) 11.262 6.606 ( -7.104 -0.000 2.509) 7.534 6.821 ( 1.825 0.000 5.553) 5.845 6.880 ( -0.027 -0.000 -4.330) 4.330 7.181 ( 6.823 0.000 1.670) 7.024 7.425 ( -5.894 -0.000 -2.559) 6.426 7.477 ( 6.630 0.000 -1.010) 6.706 7.663 ( 4.659 0.000 3.886) 6.067 8.121 ( 0.088 0.000 -6.200) 6.200 8.435 ( 0.771 0.000 -7.857) 7.895 8.495 ( 16.463 0.000 9.370) 18.943 8.622 ( 5.111 0.000 -4.988) 7.141 8.893 ( -5.697 -0.000 3.685) 6.785 9.376 ( -1.011 -0.000 2.659) 2.845 9.569 ( 1.266 0.000 -1.683) 2.106 10.077 ( 3.300 0.000 -6.226) 7.047 10.260 ( 1.598 0.000 -6.316) 6.515 10.617 ( 0.832 0.000 5.123) 5.190 11.248 ( -0.762 -0.000 -10.319) 10.347 11.548 ( 9.051 0.000 9.256) 12.946 12.461 ( 1.122 0.000 11.054) 11.110 13.280 ( 9.783 0.000 15.083) 17.978 13.472 ( 2.143 0.000 0.014) 2.143 13.907 ( 3.277 0.000 -5.124) 6.082 14.235 ( -1.361 -0.000 3.880) 4.112 14.536 ( -1.820 -0.000 -2.306) 2.938 14.624 ( 8.648 0.000 3.192) 9.218 14.834 ( -12.656 -0.000 -11.044) 16.797 20.062 ( 0.606 0.000 -0.441) 0.749 20.437 ( -5.679 -0.000 -10.832) 12.230 21.358 ( -0.984 -0.000 5.251) 5.343 21.920 ( -0.224 -0.000 12.704) 12.706 22.441 ( 0.364 0.000 -3.971) 3.988 22.690 ( 4.397 0.000 0.546) 4.430 23.476 ( -4.827 -0.000 -0.546) 4.858 23.668 ( 10.499 0.000 1.639) 10.626 24.200 ( -16.252 -0.000 -8.907) 18.533 24.578 ( 4.815 0.000 15.048) 15.799 25.064 ( 0.240 0.000 -3.191) 3.200 25.125 ( 0.528 0.000 -1.760) 1.837 ======================= Grid point 147 (73/128) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.647 ( 2.207 0.000 19.429) 19.554 1.657 ( 0.459 0.000 24.922) 24.927 2.266 ( 0.469 0.000 0.092) 0.478 2.560 ( -3.417 -0.000 -0.761) 3.500 2.839 ( -9.738 -0.000 10.195) 14.098 2.944 ( -8.183 -0.000 -4.358) 9.271 3.176 ( 12.421 0.000 7.315) 14.415 3.643 ( -2.704 -0.000 -8.284) 8.714 3.858 ( 0.026 0.000 15.841) 15.841 4.012 ( 9.536 0.000 5.764) 11.143 4.175 ( 2.345 0.000 4.486) 5.062 4.209 ( -0.866 -0.000 -7.424) 7.474 4.548 ( -10.850 -0.000 8.768) 13.950 4.682 ( 8.569 0.000 -0.567) 8.588 4.724 ( -2.489 -0.000 -3.626) 4.398 5.385 ( -3.814 -0.000 15.686) 16.143 5.704 ( 5.662 0.000 2.155) 6.059 5.706 ( -3.042 -0.000 -15.253) 15.554 5.798 ( 5.598 0.000 2.740) 6.232 6.050 ( 6.474 0.000 -13.210) 14.710 6.479 ( -6.892 -0.000 1.241) 7.003 6.653 ( -6.201 -0.000 -3.587) 7.163 6.741 ( -3.379 -0.000 14.736) 15.118 6.968 ( -4.455 -0.000 4.893) 6.617 7.255 ( 1.315 0.000 -3.146) 3.409 7.335 ( 1.541 0.000 0.662) 1.677 7.508 ( 1.636 0.000 -5.317) 5.563 7.850 ( 1.319 0.000 2.716) 3.019 7.949 ( 1.098 0.000 -15.471) 15.510 8.087 ( 2.642 0.000 -6.203) 6.742 8.738 ( -6.331 -0.000 1.010) 6.411 8.830 ( 10.479 0.000 -0.255) 10.482 9.144 ( 5.905 0.000 7.696) 9.700 9.413 ( -8.046 -0.000 -2.919) 8.559 9.638 ( 4.427 0.000 9.445) 10.431 9.944 ( 3.121 0.000 -6.615) 7.314 10.051 ( -0.332 -0.000 -6.101) 6.110 10.415 ( -8.248 -0.000 -8.859) 12.104 11.363 ( 9.281 0.000 2.688) 9.663 11.469 ( -12.754 -0.000 0.728) 12.774 12.865 ( 1.710 0.000 15.369) 15.464 13.582 ( 5.283 0.000 -1.981) 5.642 13.787 ( -16.633 -0.000 -3.342) 16.965 13.815 ( 3.935 0.000 -6.125) 7.281 14.085 ( 2.319 0.000 2.889) 3.705 14.189 ( -7.050 -0.000 0.481) 7.066 14.578 ( 6.069 0.000 1.067) 6.162 14.725 ( -0.544 -0.000 -2.780) 2.833 20.067 ( -0.001 -0.000 0.742) 0.742 20.294 ( 5.166 0.000 -6.248) 8.107 21.608 ( 3.209 0.000 9.673) 10.191 22.047 ( -8.392 -0.000 0.988) 8.450 22.546 ( 8.507 0.000 3.493) 9.196 22.725 ( -2.872 -0.000 -0.921) 3.016 23.333 ( -2.035 -0.000 -1.387) 2.463 23.392 ( -5.035 -0.000 -3.702) 6.250 24.373 ( 9.359 0.000 7.594) 12.052 24.775 ( -8.903 -0.000 6.246) 10.876 24.955 ( 0.741 0.000 -6.652) 6.693 25.059 ( 0.633 0.000 -3.163) 3.226 ======================= Grid point 148 (74/128) ======================= q-point: ( 0.14 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.840 ( 9.839 -8.527 16.317) 20.875 1.934 ( 6.347 -11.680 20.746) 24.639 2.292 ( 1.955 1.256 -4.981) 5.496 2.497 ( -5.393 -5.269 3.869) 8.474 2.812 ( -1.939 2.860 4.382) 5.581 2.866 ( -0.327 -1.809 3.431) 3.892 3.376 ( 11.868 0.197 -0.307) 11.873 3.672 ( 1.201 -9.385 -10.357) 14.028 3.918 ( -0.410 0.098 13.534) 13.541 4.155 ( 2.790 0.256 0.016) 2.802 4.255 ( 5.304 -0.335 6.780) 8.615 4.274 ( 9.785 -7.664 4.381) 13.178 4.412 ( -12.183 -0.324 9.358) 15.365 4.678 ( -0.867 0.176 -0.403) 0.972 4.834 ( 9.265 -3.128 -1.643) 9.916 5.419 ( -2.497 -3.712 11.507) 12.346 5.596 ( -7.693 -4.054 -18.904) 20.808 5.701 ( 0.911 6.487 2.476) 7.003 5.852 ( -0.249 0.509 -0.793) 0.975 6.096 ( 5.862 1.855 -6.914) 9.252 6.382 ( -2.381 1.946 2.746) 4.123 6.559 ( -3.886 1.332 -4.214) 5.885 6.748 ( -3.868 1.795 9.712) 10.607 6.884 ( -5.923 1.707 9.225) 11.095 7.234 ( -6.165 1.097 3.552) 7.199 7.356 ( 6.618 4.088 -4.552) 9.013 7.445 ( -0.685 4.503 -5.215) 6.924 7.820 ( 0.867 2.549 -6.298) 6.849 7.972 ( 0.485 -5.513 -7.239) 9.112 8.149 ( 5.884 -2.203 -4.623) 7.800 8.640 ( -7.488 -0.231 1.325) 7.608 8.995 ( 8.506 -3.483 -0.577) 9.209 9.094 ( -3.212 12.004 2.728) 12.722 9.266 ( -2.925 5.033 -1.082) 5.921 9.710 ( 1.411 0.139 6.946) 7.089 9.930 ( -1.561 1.039 -3.308) 3.802 10.104 ( 2.649 -4.850 -3.484) 6.532 10.248 ( -6.999 2.780 -8.176) 11.116 11.247 ( -13.078 2.336 3.668) 13.782 11.515 ( 6.616 -1.703 0.267) 6.837 12.939 ( 3.595 2.649 14.984) 15.635 13.444 ( -22.966 0.762 0.036) 22.978 13.633 ( 2.662 0.127 -5.015) 5.679 13.836 ( 0.744 0.493 -0.898) 1.266 14.130 ( -0.163 -0.657 1.197) 1.375 14.202 ( 6.304 -0.079 2.674) 6.848 14.669 ( 3.023 -1.026 -0.288) 3.205 14.721 ( 1.298 -2.286 -4.995) 5.644 20.072 ( 0.415 0.112 0.889) 0.988 20.346 ( 6.338 0.400 -8.776) 10.833 21.684 ( 2.164 0.554 10.232) 10.473 21.947 ( -6.429 -0.453 -0.302) 6.452 22.612 ( 1.975 2.869 2.291) 4.169 22.658 ( -3.295 0.169 -1.764) 3.741 23.108 ( -3.400 12.360 7.572) 14.889 23.552 ( 0.039 -12.709 -4.413) 13.453 24.515 ( 11.210 3.248 1.927) 11.830 24.681 ( -11.059 -3.218 7.872) 13.951 24.954 ( 1.000 -1.769 -7.373) 7.648 25.068 ( 0.765 -1.419 -2.383) 2.877 ======================= Grid point 149 (75/128) ======================= q-point: ( 0.29 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.038 ( -5.140 1.050 -3.336) 6.217 2.225 ( 2.383 -10.316 16.477) 19.585 2.378 ( 11.080 -8.643 10.156) 17.338 2.648 ( 4.273 -2.932 10.925) 12.092 2.790 ( -0.748 -0.210 4.264) 4.335 2.935 ( 7.803 -4.262 3.276) 9.476 3.501 ( 10.252 2.301 -5.182) 11.716 3.817 ( 0.022 -10.327 -8.187) 13.179 3.941 ( -2.027 -0.985 0.598) 2.332 4.168 ( -1.606 -2.130 3.525) 4.421 4.213 ( 1.325 5.512 -1.253) 5.806 4.375 ( -2.500 -3.621 8.460) 9.536 4.581 ( 4.792 -2.354 -6.105) 8.110 4.800 ( 8.620 -10.680 22.496) 26.352 4.992 ( 9.489 -0.144 -3.051) 9.968 5.404 ( -8.792 2.082 -7.959) 12.041 5.546 ( -4.530 -8.537 -4.657) 10.728 5.613 ( -4.513 -0.861 3.544) 5.803 5.766 ( -2.777 6.599 2.259) 7.507 6.118 ( 2.545 -1.668 -0.641) 3.110 6.355 ( -6.449 2.808 -1.330) 7.158 6.489 ( 5.083 1.021 -3.603) 6.313 6.634 ( -5.168 5.205 8.030) 10.876 6.873 ( -3.277 0.667 9.580) 10.147 7.046 ( -6.272 9.295 1.264) 11.285 7.337 ( 1.833 7.389 -4.712) 8.954 7.401 ( 0.933 -2.121 0.835) 2.463 7.780 ( 0.238 0.646 -7.613) 7.644 8.023 ( 0.165 -3.323 -3.592) 4.896 8.285 ( 8.575 -5.052 -4.179) 10.794 8.567 ( -5.748 -0.166 1.454) 5.931 8.826 ( -6.346 9.156 -2.501) 11.418 9.083 ( 2.328 11.770 2.265) 12.210 9.216 ( 4.033 -4.951 -2.667) 6.921 9.715 ( -3.549 1.836 1.343) 4.215 9.817 ( -5.669 3.915 -0.470) 6.905 10.139 ( -2.357 -0.984 -2.060) 3.282 10.209 ( 3.990 -3.604 -0.789) 5.434 11.096 ( -10.337 -2.658 2.000) 10.859 11.591 ( 5.387 2.371 -2.128) 6.258 12.980 ( 3.176 6.847 14.909) 16.711 13.192 ( -16.388 -4.139 3.464) 17.254 13.635 ( 2.237 0.577 -7.653) 7.994 13.807 ( -2.148 1.632 0.772) 2.806 14.186 ( 2.805 -2.506 2.941) 4.774 14.286 ( 4.575 -0.139 3.217) 5.595 14.670 ( -0.676 0.471 -2.814) 2.932 14.787 ( 3.167 -2.767 -6.001) 7.328 20.079 ( 0.545 0.463 1.112) 1.322 20.381 ( 4.989 0.829 -9.982) 11.190 21.704 ( -1.149 2.572 8.832) 9.270 21.891 ( -3.664 -1.517 -0.071) 3.966 22.538 ( -3.353 2.589 -1.741) 4.580 22.658 ( -0.168 -1.379 0.418) 1.450 22.971 ( -1.090 6.674 13.250) 14.876 23.686 ( 0.024 -6.482 -0.562) 6.507 24.554 ( -2.207 0.141 -4.183) 4.732 24.648 ( -0.485 0.677 8.292) 8.333 24.983 ( 3.152 -2.084 -8.736) 9.519 25.108 ( 1.477 -2.483 -0.408) 2.918 ======================= Grid point 150 (76/128) ======================= q-point: (-0.57 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.852 ( -6.357 7.888 -0.380) 10.138 2.418 ( -6.891 -8.714 12.871) 17.003 2.579 ( 1.202 9.061 15.697) 18.164 2.723 ( 8.731 -4.315 2.434) 10.039 2.852 ( 2.046 -3.029 7.311) 8.174 3.271 ( 13.428 -11.843 5.009) 18.592 3.540 ( 5.684 4.469 -2.767) 7.742 3.825 ( -4.748 -0.197 -1.913) 5.122 3.938 ( -4.328 -5.458 -2.552) 7.418 4.101 ( 1.285 8.738 -7.260) 11.433 4.282 ( 1.150 -4.380 3.730) 5.867 4.450 ( 2.484 -1.768 -1.230) 3.288 4.584 ( -2.073 -2.277 0.263) 3.090 4.952 ( 2.513 7.726 -13.029) 15.354 5.105 ( -7.046 -2.572 8.371) 11.240 5.200 ( -4.206 4.943 9.280) 11.325 5.556 ( 0.312 -3.097 -5.565) 6.376 5.654 ( -0.750 -1.241 1.044) 1.787 5.723 ( -1.712 -4.967 11.652) 12.782 6.153 ( -7.144 2.819 -0.090) 7.681 6.261 ( 3.187 -8.780 0.282) 9.345 6.521 ( 0.972 5.772 2.331) 6.300 6.637 ( 5.903 -5.191 1.328) 7.972 6.738 ( -8.482 3.220 6.550) 11.190 6.946 ( 2.620 5.794 1.539) 6.542 7.232 ( -0.750 3.533 -2.675) 4.494 7.453 ( -0.227 -2.568 0.867) 2.720 7.737 ( -0.493 2.049 -5.118) 5.535 8.086 ( 2.635 -4.524 -0.543) 5.264 8.425 ( -7.479 3.589 -2.971) 8.812 8.489 ( 10.210 -3.837 -2.785) 11.258 8.728 ( 0.011 -2.378 -2.219) 3.252 8.867 ( -0.708 16.694 -0.010) 16.709 9.338 ( 0.853 -3.282 0.054) 3.391 9.505 ( -8.618 6.392 -3.166) 11.187 9.809 ( 2.720 -1.888 0.592) 3.364 10.153 ( -1.649 -3.566 1.502) 4.206 10.326 ( 3.728 -4.869 0.163) 6.135 11.048 ( -5.924 -4.963 -0.845) 7.774 11.585 ( 3.954 5.062 -3.327) 7.234 12.904 ( -4.675 6.181 11.921) 14.218 13.168 ( -2.255 -3.998 8.874) 9.991 13.633 ( 3.188 0.576 -7.912) 8.549 13.749 ( -2.237 1.731 -0.523) 2.877 14.275 ( 2.183 -2.214 4.082) 5.131 14.363 ( 2.556 -2.038 3.241) 4.603 14.631 ( -0.648 1.729 -2.650) 3.230 14.824 ( 1.263 -1.234 -7.848) 8.044 20.080 ( 0.339 0.725 1.255) 1.488 20.382 ( 2.419 0.965 -9.723) 10.066 21.651 ( -3.132 3.806 6.881) 8.465 21.889 ( -1.063 -2.591 0.834) 2.922 22.450 ( -5.063 0.957 -0.367) 5.166 22.685 ( 1.632 -0.532 -0.531) 1.797 22.971 ( 0.416 0.138 15.132) 15.138 23.760 ( 0.616 -2.975 2.158) 3.726 24.462 ( -9.331 -1.393 -4.469) 10.440 24.668 ( 3.632 2.908 4.169) 6.248 25.028 ( 4.239 -1.120 -9.006) 10.017 25.167 ( 2.112 -1.306 0.659) 2.569 ======================= Grid point 151 (77/128) ======================= q-point: (-0.43 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.660 ( -5.451 8.100 6.732) 11.859 2.342 ( -9.520 7.619 19.259) 22.795 2.530 ( -0.509 5.505 11.386) 12.657 2.821 ( -0.285 -0.482 -4.856) 4.889 2.962 ( 0.651 -2.953 6.666) 7.320 3.537 ( 3.076 1.215 3.224) 4.619 3.569 ( 7.943 -0.516 0.191) 7.962 3.729 ( -9.893 3.623 6.780) 12.529 3.864 ( -2.599 8.417 -5.627) 10.453 3.989 ( -0.244 0.995 -0.590) 1.182 4.263 ( -0.022 2.756 -3.445) 4.412 4.399 ( -6.192 3.991 -3.749) 8.266 4.661 ( -1.007 -7.345 -2.167) 7.724 4.750 ( -4.795 6.889 -10.827) 13.700 5.020 ( -4.535 -1.499 6.259) 7.874 5.122 ( -5.322 5.050 12.977) 14.907 5.591 ( 0.401 3.558 -1.298) 3.809 5.624 ( 4.444 2.769 2.777) 5.928 5.864 ( -1.283 -8.835 1.826) 9.112 6.063 ( -1.739 2.086 0.467) 2.756 6.426 ( 1.569 -1.975 9.317) 9.653 6.544 ( 4.053 -8.330 -3.571) 9.928 6.655 ( -4.393 -1.553 5.742) 7.394 6.848 ( 2.604 -3.641 -2.265) 5.017 6.929 ( 6.695 -3.183 5.746) 9.380 7.216 ( -0.478 -2.659 -1.504) 3.093 7.468 ( -0.203 -0.422 -2.144) 2.195 7.667 ( -1.477 3.042 -2.252) 4.063 8.228 ( 4.092 -6.689 1.201) 7.933 8.275 ( -3.629 2.243 -6.387) 7.680 8.591 ( -0.166 14.249 -3.457) 14.663 8.632 ( 7.342 3.860 0.410) 8.305 8.852 ( 3.857 -9.756 -1.334) 10.575 9.227 ( -8.134 3.604 1.278) 8.988 9.454 ( 1.560 -1.118 -0.865) 2.105 9.900 ( 4.271 -3.247 -3.409) 6.357 10.190 ( -1.243 -2.868 0.634) 3.189 10.447 ( 1.410 -6.166 -0.392) 6.337 11.066 ( -1.387 -4.498 -1.544) 4.954 11.550 ( 3.067 3.558 -2.607) 5.372 12.808 ( -4.428 3.736 12.255) 13.555 13.259 ( 2.810 -2.276 10.461) 11.069 13.643 ( 6.579 4.459 -5.354) 9.583 13.708 ( -2.193 -2.414 -3.592) 4.851 14.328 ( 1.128 0.150 4.428) 4.572 14.418 ( -5.418 -4.981 1.123) 7.445 14.611 ( 4.540 2.007 -1.380) 5.152 14.796 ( -1.164 0.905 -9.184) 9.302 20.077 ( 0.012 0.644 1.239) 1.396 20.349 ( -0.190 0.943 -8.305) 8.360 21.575 ( -2.572 3.743 6.276) 7.746 21.954 ( 2.485 -4.188 2.544) 5.495 22.365 ( -7.039 -0.598 0.575) 7.087 22.708 ( 2.760 1.237 -0.393) 3.050 23.066 ( -0.694 -4.625 14.392) 15.133 23.815 ( 2.985 -0.653 -1.285) 3.315 24.319 ( -10.821 -0.319 -2.040) 11.017 24.699 ( 3.945 1.294 2.502) 4.847 25.061 ( 3.862 -0.007 -7.935) 8.825 25.190 ( 1.347 1.997 -0.060) 2.410 ======================= Grid point 152 (78/128) ======================= q-point: (-0.29 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.526 ( -4.445 5.141 14.503) 16.017 2.149 ( -8.733 12.261 23.203) 27.658 2.445 ( -3.742 6.850 8.074) 11.230 2.751 ( -3.351 3.482 -5.793) 7.544 2.914 ( -7.397 4.091 5.742) 10.219 3.390 ( -9.301 12.542 7.815) 17.461 3.467 ( -10.699 8.991 -5.296) 14.945 3.622 ( 4.519 -0.706 3.816) 5.956 3.830 ( 2.535 0.140 3.517) 4.338 4.021 ( 4.317 0.394 2.874) 5.201 4.119 ( -7.660 6.928 -9.252) 13.866 4.343 ( 2.290 -1.393 -0.360) 2.705 4.577 ( -5.375 0.959 -4.848) 7.302 4.700 ( -2.325 -1.244 -2.288) 3.491 4.900 ( -8.306 5.685 10.213) 14.339 5.220 ( 6.127 -7.695 7.198) 12.189 5.485 ( -2.407 5.865 10.249) 12.052 5.709 ( 7.095 1.758 -2.858) 7.848 5.920 ( -0.112 -0.620 -5.446) 5.483 6.002 ( 0.923 2.724 -5.042) 5.804 6.530 ( -0.801 -7.308 7.542) 10.533 6.595 ( -5.071 -0.557 0.899) 5.180 6.745 ( 3.538 -7.457 -2.958) 8.768 6.898 ( -1.720 -3.235 10.034) 10.682 7.161 ( 4.867 -8.070 2.032) 9.640 7.266 ( 1.779 -3.683 -3.320) 5.268 7.439 ( -1.453 1.296 -3.967) 4.419 7.641 ( 2.509 -1.253 0.003) 2.805 8.164 ( -2.318 3.780 -9.188) 10.202 8.261 ( -1.750 6.248 -5.843) 8.732 8.557 ( 9.943 -4.290 5.041) 11.945 8.678 ( 9.136 4.994 -1.261) 10.488 8.952 ( -4.966 -1.388 3.672) 6.330 9.223 ( 0.951 -11.051 -1.537) 11.197 9.493 ( 1.904 -0.642 2.431) 3.154 9.963 ( 3.255 0.095 -6.012) 6.837 10.192 ( -1.000 0.512 -2.743) 2.964 10.528 ( -2.605 -6.008 -3.073) 7.233 11.126 ( 3.421 -1.926 0.161) 3.929 11.562 ( 1.215 -1.825 -1.321) 2.560 12.768 ( -2.832 1.335 13.784) 14.135 13.383 ( 5.643 -1.709 7.833) 9.804 13.650 ( 8.125 5.072 0.047) 9.578 13.737 ( 1.563 -3.409 -6.846) 7.806 14.334 ( -4.558 -0.750 4.003) 6.112 14.372 ( -7.703 -3.451 -0.923) 8.491 14.663 ( 1.723 0.864 -5.552) 5.878 14.704 ( 0.737 3.384 -5.192) 6.241 20.072 ( -0.232 0.361 1.040) 1.125 20.296 ( -1.093 0.788 -6.085) 6.233 21.530 ( -0.368 2.576 6.993) 7.462 22.105 ( 6.492 -5.284 6.249) 10.446 22.277 ( -7.950 -1.786 -1.263) 8.245 22.723 ( 2.201 1.075 0.030) 2.449 23.168 ( -4.479 -6.838 11.528) 14.132 23.820 ( 4.269 5.107 -13.125) 14.716 24.198 ( -8.231 -1.459 8.550) 11.958 24.758 ( 3.635 -0.899 1.727) 4.124 25.074 ( 2.877 1.037 -6.463) 7.149 25.137 ( -0.780 5.173 -1.239) 5.376 ======================= Grid point 153 (79/128) ======================= q-point: (-0.14 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.512 ( -2.046 -0.971 20.445) 20.570 1.864 ( -11.100 17.419 21.799) 30.030 2.313 ( -3.687 4.622 4.393) 7.366 2.604 ( -0.262 7.365 5.122) 8.975 2.901 ( -0.956 -7.512 1.998) 7.832 3.077 ( -20.023 5.196 8.854) 22.501 3.209 ( -1.333 10.321 -6.284) 12.157 3.726 ( 2.138 1.025 -0.158) 2.376 3.832 ( 1.192 2.541 4.961) 5.700 3.922 ( -2.820 2.269 1.981) 4.126 4.100 ( 6.271 1.512 4.601) 7.923 4.318 ( -5.209 0.706 -8.777) 10.230 4.568 ( 4.374 -0.514 2.590) 5.109 4.646 ( -4.936 1.235 4.125) 6.550 4.788 ( -3.771 1.650 1.028) 4.243 5.388 ( -2.730 0.531 17.061) 17.286 5.518 ( 6.722 -7.169 2.639) 10.176 5.734 ( 7.298 5.849 0.934) 9.399 5.834 ( -1.052 4.804 -8.368) 9.706 6.015 ( 3.273 -2.769 -13.300) 13.973 6.541 ( -7.208 -3.335 1.084) 8.016 6.647 ( -1.326 -6.100 2.941) 6.901 6.799 ( -3.426 1.163 3.781) 5.233 6.955 ( -2.497 -3.756 8.226) 9.381 7.261 ( 1.620 0.341 -5.772) 6.004 7.309 ( 0.950 -0.777 1.747) 2.135 7.446 ( 2.031 -4.646 -3.482) 6.151 7.756 ( 4.239 -5.087 1.010) 6.699 8.032 ( 0.425 6.185 -8.165) 10.252 8.139 ( -1.288 2.823 -10.600) 11.045 8.718 ( 10.094 3.644 -0.809) 10.762 8.777 ( 3.593 -0.025 2.697) 4.493 8.966 ( 0.680 -8.013 7.405) 10.932 9.405 ( -1.486 -10.834 -1.925) 11.104 9.549 ( 3.668 0.370 6.688) 7.636 9.949 ( 2.183 2.440 -6.787) 7.535 10.126 ( -1.083 3.590 -5.997) 7.072 10.520 ( -6.313 -3.491 -6.753) 9.882 11.223 ( 7.102 -1.004 2.497) 7.595 11.581 ( -4.642 -2.393 -1.175) 5.353 12.792 ( -0.722 -0.593 15.175) 15.204 13.500 ( 5.638 -1.089 0.599) 5.774 13.752 ( 11.622 1.189 4.579) 12.548 13.781 ( 3.521 -1.220 -7.701) 8.555 14.224 ( -17.710 -5.687 -2.890) 18.823 14.314 ( -7.265 1.425 1.351) 7.525 14.550 ( 2.667 5.636 -4.969) 7.973 14.731 ( 1.992 0.468 -1.026) 2.289 20.067 ( -0.306 0.148 0.792) 0.862 20.267 ( 1.436 0.277 -4.719) 4.941 21.543 ( 1.978 1.003 8.364) 8.653 22.158 ( -8.385 0.195 4.202) 9.381 22.353 ( 10.088 -6.134 1.078) 11.856 22.736 ( 0.438 -0.222 -0.163) 0.517 23.238 ( -7.175 -9.911 5.742) 13.516 23.652 ( -1.141 12.289 -13.872) 18.567 24.232 ( 2.360 -2.249 11.723) 12.167 24.818 ( -0.407 -1.627 2.752) 3.223 25.017 ( -1.271 5.369 -4.263) 6.972 25.070 ( 0.818 0.932 -3.699) 3.901 ======================= Grid point 155 (80/128) ======================= q-point: ( 0.14 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.918 ( 5.305 0.000 14.969) 15.881 2.125 ( 18.100 0.000 16.688) 24.619 2.387 ( -1.740 -0.000 5.161) 5.446 2.432 ( 14.350 0.000 -4.244) 14.965 2.820 ( -0.817 -0.000 5.399) 5.461 2.938 ( 6.960 0.000 3.052) 7.600 3.558 ( 0.173 0.000 -5.279) 5.281 3.594 ( 15.444 0.000 -6.316) 16.686 4.012 ( 0.684 0.000 21.054) 21.066 4.107 ( -0.650 -0.000 -9.120) 9.144 4.208 ( -12.567 -0.000 7.553) 14.662 4.355 ( 5.916 0.000 5.006) 7.750 4.482 ( 14.322 0.000 5.629) 15.388 4.682 ( 0.967 0.000 5.579) 5.662 4.915 ( 8.509 0.000 -2.705) 8.928 5.385 ( -7.793 -0.000 -21.871) 23.217 5.399 ( -2.291 -0.000 10.143) 10.398 5.687 ( -9.598 -0.000 -0.800) 9.631 5.825 ( -3.120 -0.000 -2.670) 4.107 6.158 ( 2.261 0.000 -4.647) 5.168 6.401 ( 0.334 0.000 5.605) 5.615 6.526 ( 1.969 0.000 -5.646) 5.980 6.723 ( -8.112 -0.000 4.450) 9.252 6.862 ( -3.899 -0.000 16.277) 16.737 7.162 ( -7.927 -0.000 6.349) 10.156 7.438 ( -2.788 -0.000 -5.105) 5.817 7.481 ( 8.821 0.000 -5.169) 10.224 7.852 ( -2.768 -0.000 1.363) 3.086 7.867 ( 2.803 0.000 -15.472) 15.724 8.217 ( 8.060 0.000 -4.418) 9.191 8.550 ( -5.458 -0.000 0.401) 5.473 9.026 ( -1.779 -0.000 -5.481) 5.763 9.146 ( -3.485 -0.000 1.856) 3.948 9.228 ( -4.361 -0.000 5.847) 7.294 9.734 ( 0.180 0.000 2.277) 2.284 9.887 ( -6.925 -0.000 -6.302) 9.363 10.097 ( 3.268 0.000 3.280) 4.629 10.183 ( -0.377 -0.000 -8.731) 8.740 11.065 ( -16.299 -0.000 8.120) 18.209 11.601 ( 6.421 0.000 -0.209) 6.424 13.073 ( 3.264 0.000 12.039) 12.474 13.145 ( -18.351 -0.000 5.390) 19.126 13.618 ( -1.465 -0.000 -9.932) 10.040 13.857 ( 1.273 0.000 2.021) 2.388 14.146 ( 4.316 0.000 1.809) 4.679 14.280 ( 0.815 0.000 3.113) 3.218 14.702 ( 3.631 0.000 -7.311) 8.163 14.715 ( 2.702 0.000 0.692) 2.790 20.087 ( 0.836 0.000 1.182) 1.448 20.397 ( 5.565 0.000 -10.965) 12.297 21.751 ( 0.473 0.000 10.780) 10.791 21.863 ( -4.469 -0.000 -1.109) 4.605 22.585 ( -4.413 -0.000 -2.674) 5.160 22.593 ( -7.302 -0.000 4.196) 8.422 23.320 ( 1.191 0.000 -0.986) 1.546 23.389 ( 4.478 0.000 4.449) 6.313 24.488 ( -12.880 -0.000 9.147) 15.798 24.746 ( 12.614 0.000 1.316) 12.683 24.926 ( 0.947 0.000 -6.874) 6.939 25.058 ( 0.973 0.000 -3.229) 3.372 ======================= Grid point 156 (81/128) ======================= q-point: ( 0.29 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.049 ( 3.784 -0.420 7.710) 8.599 2.361 ( 12.032 8.791 4.747) 15.639 2.465 ( 10.771 -5.847 12.260) 17.335 2.726 ( 13.809 -6.273 3.189) 15.498 2.852 ( 3.781 1.418 8.249) 9.184 3.043 ( 9.472 -0.219 3.026) 9.946 3.620 ( 1.663 -7.986 -1.401) 8.276 3.695 ( 3.127 3.127 -6.403) 7.782 3.948 ( -2.360 6.534 -2.168) 7.277 4.102 ( -0.117 -2.714 3.074) 4.102 4.217 ( -0.879 -5.785 4.529) 7.400 4.439 ( 7.445 4.082 3.328) 9.120 4.611 ( 4.099 1.785 -4.174) 6.116 4.861 ( 8.789 -7.695 20.192) 23.327 5.067 ( 7.543 -4.967 -4.250) 9.982 5.207 ( -8.204 -1.733 -20.137) 21.813 5.410 ( -5.335 -1.928 -0.562) 5.701 5.529 ( -8.026 -1.629 7.510) 11.111 5.755 ( -4.864 0.447 -1.675) 5.164 6.138 ( 0.205 1.055 -1.260) 1.656 6.350 ( -7.354 7.060 2.300) 10.451 6.552 ( 5.362 0.149 -7.210) 8.986 6.631 ( -3.855 -0.013 9.399) 10.159 6.883 ( -3.806 0.802 15.756) 16.229 7.053 ( -7.881 2.465 5.420) 9.877 7.358 ( -2.277 2.744 -2.871) 4.578 7.526 ( 6.441 6.847 -3.797) 10.138 7.763 ( -0.812 1.326 -5.693) 5.902 7.944 ( 1.656 -6.285 -6.925) 9.497 8.325 ( 7.811 -1.913 -5.013) 9.477 8.513 ( -1.473 -1.030 0.590) 1.891 8.834 ( -8.830 7.039 -5.467) 12.546 9.157 ( -3.683 -2.742 1.233) 4.754 9.204 ( 0.064 0.461 4.011) 4.038 9.671 ( -7.573 4.598 -4.797) 10.074 9.782 ( -1.931 -1.475 -0.652) 2.516 10.118 ( -0.688 2.184 -0.385) 2.322 10.205 ( 2.592 -2.970 0.313) 3.954 10.922 ( -10.730 -2.769 8.315) 13.854 11.664 ( 3.549 0.479 -2.812) 4.553 12.921 ( -15.168 -2.285 4.423) 15.965 13.196 ( 6.770 3.166 14.122) 15.978 13.555 ( -3.938 -2.548 -9.653) 10.732 13.867 ( 2.733 3.093 -0.706) 4.188 14.222 ( 2.064 -0.074 4.376) 4.839 14.286 ( -1.515 -3.029 2.435) 4.171 14.701 ( 2.739 2.815 -2.674) 4.751 14.782 ( 4.136 -2.048 -5.488) 7.171 20.099 ( 0.582 0.397 1.345) 1.518 20.412 ( 3.310 0.716 -11.275) 11.773 21.754 ( -2.417 2.536 8.710) 9.388 21.826 ( -2.010 -1.428 -0.383) 2.495 22.474 ( -9.229 0.817 3.653) 9.960 22.561 ( -3.242 -4.016 -0.427) 5.179 23.212 ( 4.827 11.528 5.133) 13.511 23.590 ( 3.048 -8.721 1.671) 9.388 24.366 ( -12.996 -2.256 10.476) 16.844 24.839 ( 7.728 6.036 -3.385) 10.374 24.966 ( 4.952 -2.735 -7.015) 9.012 25.086 ( 2.026 -2.987 -2.077) 4.164 ======================= Grid point 157 (82/128) ======================= q-point: ( 0.43 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.073 ( 9.134 11.228 3.799) 14.964 2.360 ( 1.639 5.213 6.777) 8.706 2.733 ( 6.065 -1.625 10.491) 12.227 2.873 ( 3.088 2.345 8.860) 9.671 2.926 ( 10.007 3.664 6.167) 12.313 3.314 ( 13.257 -9.241 2.171) 16.305 3.612 ( -4.336 0.276 1.839) 4.718 3.741 ( -4.413 -5.559 -7.915) 10.632 3.844 ( 3.265 1.870 2.300) 4.409 4.226 ( 3.280 6.310 -6.812) 9.848 4.235 ( 4.168 -5.227 -0.261) 6.690 4.488 ( 4.378 0.186 1.693) 4.697 4.564 ( -2.400 5.866 0.640) 6.370 4.937 ( -10.946 4.804 -13.293) 17.878 5.029 ( -4.568 0.252 0.828) 4.649 5.231 ( 1.937 -2.947 7.508) 8.295 5.471 ( 3.407 -11.260 1.104) 11.816 5.607 ( 1.488 -3.798 8.301) 9.249 5.703 ( -2.045 -2.205 1.210) 3.242 6.097 ( -9.517 5.947 1.717) 11.353 6.177 ( 1.638 -5.660 -0.622) 5.925 6.581 ( 1.704 -0.219 -4.713) 5.016 6.682 ( 1.153 -1.649 9.487) 9.698 6.753 ( -6.146 9.466 10.224) 15.229 7.011 ( -0.817 -0.568 5.964) 6.046 7.250 ( -3.852 4.837 -3.781) 7.248 7.484 ( 3.284 3.869 -1.102) 5.194 7.742 ( 0.837 0.977 -5.003) 5.165 8.040 ( 2.725 -5.620 -3.837) 7.330 8.383 ( -3.847 3.483 -0.009) 5.189 8.523 ( 4.874 -4.315 -6.453) 9.166 8.709 ( 1.659 -0.953 -4.114) 4.537 9.021 ( -6.689 8.566 -0.061) 10.868 9.282 ( 0.264 -4.012 1.863) 4.432 9.468 ( -6.730 4.703 -2.647) 8.627 9.812 ( 1.859 -2.027 0.048) 2.751 10.076 ( -3.431 -1.439 1.740) 4.107 10.285 ( 0.353 -4.243 0.594) 4.299 10.914 ( -3.154 -5.057 4.668) 7.571 11.660 ( 1.263 2.351 -5.083) 5.741 12.807 ( -10.973 -3.182 6.828) 13.310 13.286 ( 6.840 3.596 12.460) 14.662 13.537 ( -1.864 -5.049 -7.786) 9.466 13.834 ( 2.528 4.889 -2.398) 6.003 14.226 ( -6.814 -4.898 0.733) 8.424 14.353 ( 2.727 -0.555 5.712) 6.354 14.682 ( 2.159 2.441 -2.363) 4.025 14.828 ( 4.090 0.657 -6.989) 8.125 20.099 ( -0.092 0.708 1.268) 1.456 20.385 ( 0.951 1.297 -9.995) 10.123 21.693 ( -3.206 3.752 7.163) 8.699 21.846 ( 0.662 -2.746 0.089) 2.826 22.353 ( -9.690 -0.003 5.324) 11.056 22.607 ( -1.536 -6.032 -0.973) 6.300 23.162 ( 5.761 8.550 8.366) 13.277 23.733 ( 2.853 -4.821 1.627) 5.833 24.264 ( -12.455 -2.218 9.330) 15.719 24.820 ( 5.330 5.367 -4.954) 9.042 25.033 ( 4.458 -1.420 -8.351) 9.572 25.171 ( 3.121 -2.776 -0.919) 4.277 ======================= Grid point 158 (83/128) ======================= q-point: (-0.43 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.993 ( 13.670 21.752 4.019) 26.003 2.343 ( -3.888 0.484 15.648) 16.131 2.692 ( -2.960 8.091 5.400) 10.168 2.832 ( -3.178 7.336 7.384) 10.883 3.047 ( 6.721 3.031 2.631) 7.828 3.523 ( -6.748 2.102 0.215) 7.072 3.610 ( 5.821 -7.035 3.232) 9.686 3.784 ( 2.113 -11.094 -2.295) 11.525 3.909 ( 6.378 7.613 5.349) 11.280 4.018 ( -4.240 12.908 -11.736) 17.954 4.328 ( 0.348 -1.034 -0.046) 1.092 4.359 ( -4.384 10.686 -3.340) 12.024 4.535 ( -2.319 -3.072 -5.955) 7.091 4.714 ( -4.447 2.162 -7.340) 8.850 4.999 ( -2.056 -0.986 11.851) 12.069 5.191 ( -5.758 7.477 13.203) 16.229 5.647 ( 4.666 -2.968 -6.326) 8.403 5.704 ( 2.560 -4.866 5.172) 7.548 5.747 ( 0.259 -0.292 4.982) 4.997 6.043 ( -0.011 -4.355 2.278) 4.915 6.342 ( 1.029 -12.744 0.641) 12.801 6.537 ( -2.141 7.043 2.269) 7.703 6.616 ( -2.234 -0.816 4.591) 5.170 6.797 ( 1.877 -3.959 0.418) 4.402 6.996 ( -2.119 1.499 3.432) 4.303 7.175 ( 0.753 -1.622 -0.310) 1.815 7.483 ( 2.366 1.726 -2.265) 3.703 7.695 ( -0.178 3.359 -2.496) 4.189 8.146 ( -0.274 -4.732 -4.009) 6.208 8.270 ( -0.246 0.564 1.014) 1.187 8.673 ( 0.577 -2.161 -8.473) 8.763 8.741 ( -0.963 -4.325 -4.424) 6.261 8.823 ( 5.063 6.901 0.433) 8.570 9.210 ( -6.133 6.556 3.276) 9.557 9.440 ( 1.654 -3.033 1.775) 3.884 9.889 ( 2.747 -3.910 -1.734) 5.083 10.092 ( -3.064 -5.360 1.307) 6.311 10.340 ( -2.310 -5.165 -2.083) 6.030 11.005 ( 2.476 -5.421 3.020) 6.681 11.603 ( -0.261 3.015 -5.787) 6.531 12.755 ( -7.743 -2.798 9.691) 12.716 13.374 ( 5.248 1.062 9.124) 10.579 13.598 ( 2.634 -5.039 -4.270) 7.111 13.791 ( 3.327 4.140 -3.075) 6.137 14.180 ( -11.979 -5.763 -0.933) 13.326 14.397 ( 1.331 1.523 6.325) 6.640 14.679 ( 2.361 0.589 -4.570) 5.177 14.822 ( 3.681 3.673 -6.486) 8.313 20.087 ( -0.587 0.636 1.056) 1.365 20.333 ( -0.240 1.561 -7.807) 7.965 21.626 ( -1.937 3.491 6.853) 7.931 21.934 ( 3.725 -4.909 0.918) 6.230 22.250 ( -8.701 -0.320 6.094) 10.628 22.668 ( -1.760 -5.318 -2.104) 5.984 23.158 ( 3.023 5.584 10.749) 12.484 23.837 ( 4.470 -2.639 -2.886) 5.940 24.161 ( -10.811 -1.110 10.715) 15.262 24.805 ( 5.228 3.575 -5.101) 8.132 25.075 ( 3.300 -0.889 -7.298) 8.058 25.218 ( 0.942 0.036 -2.147) 2.345 ======================= Grid point 159 (84/128) ======================= q-point: (-0.29 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.867 ( 13.298 21.652 8.795) 26.889 2.301 ( -3.816 9.043 19.979) 22.259 2.559 ( -3.192 8.121 8.061) 11.879 2.653 ( -9.131 2.910 -0.415) 9.593 2.990 ( -1.669 8.321 -0.657) 8.512 3.302 ( -16.891 6.067 6.061) 18.944 3.596 ( -6.566 14.398 -9.504) 18.459 3.794 ( 5.421 0.886 6.912) 8.829 3.943 ( 6.642 2.977 0.523) 7.298 3.970 ( 7.046 -1.104 -5.173) 8.810 4.154 ( 0.439 6.604 -5.581) 8.658 4.358 ( -1.504 1.153 2.689) 3.290 4.510 ( -0.088 -4.125 -1.358) 4.344 4.662 ( -0.708 1.135 -2.636) 2.956 4.915 ( -9.353 7.289 16.577) 20.381 5.228 ( 5.331 -7.159 9.455) 13.003 5.608 ( -0.546 8.939 5.957) 10.756 5.797 ( -2.174 -5.159 2.777) 6.250 5.855 ( 10.511 -3.125 -7.602) 13.343 6.066 ( -1.376 4.510 -3.034) 5.607 6.433 ( -3.558 -0.112 6.363) 7.291 6.538 ( -2.765 -4.259 -0.195) 5.081 6.610 ( -0.647 -7.778 -2.516) 8.200 6.850 ( -1.788 -3.785 3.145) 5.236 7.049 ( -1.581 -9.039 2.347) 9.472 7.268 ( 4.711 -3.945 -0.185) 6.147 7.435 ( -1.800 4.409 -3.726) 6.047 7.681 ( 4.150 -0.059 -0.719) 4.212 8.120 ( -1.461 0.147 -7.009) 7.161 8.310 ( -2.064 3.407 -1.647) 4.311 8.587 ( 3.348 -4.833 -1.162) 5.993 8.843 ( 2.830 3.593 0.665) 4.622 8.895 ( 1.233 -7.328 -2.816) 7.947 9.081 ( -1.171 0.352 -0.276) 1.253 9.527 ( 3.297 -1.919 6.171) 7.254 9.964 ( 1.092 -2.992 -3.553) 4.772 10.137 ( -1.099 -3.649 -1.297) 4.025 10.357 ( -5.182 -5.446 -4.531) 8.777 11.151 ( 5.482 -4.446 2.772) 7.583 11.536 ( -1.809 0.858 -4.977) 5.364 12.750 ( -4.504 -2.609 12.596) 13.629 13.461 ( 3.170 -1.448 4.327) 5.557 13.712 ( 5.756 -2.988 -2.349) 6.898 13.797 ( 5.235 1.420 -1.695) 5.683 14.062 ( -15.230 -4.540 -0.362) 15.897 14.381 ( -2.465 2.908 4.631) 5.998 14.676 ( 1.759 1.012 -8.083) 8.334 14.789 ( 3.706 4.317 -3.558) 6.711 20.075 ( -0.615 0.328 0.814) 1.072 20.289 ( 1.035 1.198 -5.885) 6.094 21.596 ( 0.129 2.267 7.611) 7.942 22.088 ( 1.220 -7.130 -2.193) 7.558 22.183 ( -1.790 -0.569 9.883) 10.060 22.697 ( -2.292 -3.561 -2.656) 4.998 23.136 ( -3.247 3.034 11.689) 12.505 23.870 ( 1.440 2.106 -12.524) 12.781 24.137 ( -1.662 -2.990 15.789) 16.155 24.817 ( 4.472 1.711 -4.378) 6.488 25.094 ( 2.131 0.203 -5.461) 5.866 25.170 ( -2.744 3.325 -3.494) 5.549 ======================= Grid point 160 (85/128) ======================= q-point: (-0.14 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.803 ( 13.349 16.571 14.071) 25.510 2.104 ( -4.467 17.790 19.987) 27.128 2.359 ( -5.452 5.985 1.018) 8.160 2.606 ( -3.910 -1.467 1.324) 4.381 2.836 ( -5.377 3.386 1.784) 6.600 2.995 ( -11.862 7.801 8.364) 16.478 3.346 ( 1.434 7.904 -5.536) 9.756 3.837 ( 2.376 8.024 -6.737) 10.743 3.920 ( 0.408 3.123 -1.102) 3.336 4.014 ( 11.637 3.445 7.422) 14.226 4.186 ( 4.201 -1.060 2.111) 4.820 4.300 ( -0.535 4.328 3.990) 5.911 4.548 ( -9.014 -0.076 7.970) 12.032 4.662 ( 5.125 0.091 0.428) 5.143 4.790 ( -0.606 2.796 2.317) 3.682 5.483 ( 5.457 -2.601 13.365) 14.669 5.496 ( -0.466 0.186 4.977) 5.002 5.827 ( -2.619 0.349 -0.229) 2.652 5.863 ( -4.682 5.780 -12.484) 14.532 6.003 ( 8.900 -1.351 -7.824) 11.926 6.403 ( -4.976 -0.626 4.137) 6.501 6.554 ( -1.635 -5.817 -3.837) 7.158 6.730 ( -3.844 -6.547 3.511) 8.365 6.882 ( -3.670 -2.377 9.530) 10.486 7.190 ( -1.231 -10.868 0.372) 10.944 7.321 ( -1.982 3.491 -3.448) 5.292 7.380 ( 2.844 -4.056 -2.970) 5.776 7.767 ( 4.763 -2.058 -2.653) 5.827 8.062 ( -0.282 3.101 -6.607) 7.304 8.179 ( 0.585 5.482 -6.533) 8.549 8.746 ( -7.265 -0.070 3.201) 7.940 8.844 ( 6.700 -9.461 3.789) 12.197 8.960 ( 6.643 1.770 -1.108) 6.963 9.173 ( -1.705 -11.278 -4.501) 12.262 9.629 ( 3.802 -1.114 8.916) 9.757 9.969 ( -1.228 0.228 -3.818) 4.017 10.144 ( 1.136 1.455 -4.272) 4.653 10.325 ( -7.732 -4.749 -6.250) 11.018 11.273 ( 1.459 -2.703 2.941) 4.253 11.497 ( -1.338 -0.581 -3.178) 3.497 12.811 ( -0.292 -3.297 14.735) 15.102 13.534 ( 2.035 -2.430 -0.343) 3.189 13.756 ( -12.375 -1.948 -1.576) 12.626 13.813 ( 2.171 -0.060 -5.062) 5.508 14.013 ( 3.972 -2.869 5.705) 7.520 14.273 ( -5.633 4.283 0.615) 7.103 14.656 ( 3.812 2.707 -4.482) 6.477 14.762 ( 1.346 2.822 -3.360) 4.590 20.068 ( -0.276 0.076 0.710) 0.766 20.293 ( 4.354 0.159 -6.161) 7.546 21.618 ( 1.786 0.634 8.942) 9.140 22.045 ( -7.532 -0.477 0.283) 7.553 22.398 ( 10.282 -8.279 5.434) 14.275 22.693 ( -2.983 -2.050 -2.581) 4.446 23.075 ( -8.492 -1.321 11.215) 14.129 23.744 ( -1.452 7.695 -9.379) 12.218 24.296 ( 7.937 -4.442 8.665) 12.562 24.814 ( -1.181 2.220 -0.958) 2.691 25.035 ( -3.696 4.211 -5.476) 7.835 25.089 ( 1.010 1.468 -2.834) 3.348 ======================= Grid point 163 (86/128) ======================= q-point: ( 0.29 0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.152 ( 5.411 0.000 8.683) 10.231 2.598 ( 10.530 0.000 12.191) 16.109 2.697 ( 14.669 0.000 5.652) 15.721 2.912 ( 19.355 0.000 -4.066) 19.777 2.951 ( 6.416 0.000 7.742) 10.055 3.169 ( 8.194 0.000 0.551) 8.212 3.527 ( -2.601 -0.000 -1.044) 2.803 3.647 ( -10.762 -0.000 2.076) 10.960 3.989 ( -1.637 -0.000 -7.948) 8.114 4.156 ( -0.409 -0.000 11.919) 11.926 4.188 ( 11.836 0.000 -3.377) 12.309 4.642 ( 11.690 0.000 6.373) 13.314 4.727 ( 8.001 0.000 -2.993) 8.542 4.933 ( -0.111 -0.000 10.013) 10.014 4.945 ( -6.354 -0.000 -16.368) 17.558 5.117 ( 1.954 0.000 -12.449) 12.601 5.292 ( -6.898 -0.000 3.621) 7.790 5.457 ( -3.106 -0.000 9.811) 10.291 5.707 ( -1.870 -0.000 0.969) 2.106 6.130 ( -0.495 -0.000 -3.310) 3.347 6.281 ( -12.645 -0.000 1.846) 12.779 6.575 ( 2.385 0.000 -9.362) 9.661 6.658 ( 1.200 0.000 12.928) 12.983 6.901 ( -3.815 -0.000 16.775) 17.203 6.961 ( -9.965 -0.000 7.791) 12.649 7.357 ( -0.328 -0.000 -3.565) 3.580 7.672 ( 6.732 0.000 -4.298) 7.987 7.716 ( -7.466 -0.000 4.305) 8.618 7.898 ( 7.411 0.000 -14.737) 16.495 8.392 ( 6.182 0.000 -8.167) 10.243 8.501 ( 0.241 0.000 1.915) 1.930 8.751 ( -6.992 -0.000 -6.683) 9.672 9.037 ( -10.160 -0.000 4.408) 11.075 9.209 ( 0.139 0.000 3.685) 3.688 9.598 ( -6.357 -0.000 -6.127) 8.829 9.752 ( 1.580 0.000 -0.868) 1.802 10.138 ( -5.182 -0.000 7.125) 8.811 10.194 ( 3.385 0.000 -7.826) 8.527 10.818 ( -6.173 -0.000 13.364) 14.721 11.684 ( 0.873 0.000 -4.714) 4.794 12.740 ( -10.835 -0.000 4.346) 11.675 13.372 ( 7.424 0.000 14.207) 16.030 13.437 ( -4.086 -0.000 -9.911) 10.721 13.919 ( 2.304 0.000 -3.850) 4.487 14.141 ( -9.440 -0.000 -0.948) 9.487 14.341 ( 5.466 0.000 8.391) 10.014 14.728 ( -1.010 -0.000 -2.347) 2.555 14.832 ( 7.790 0.000 -5.964) 9.811 20.111 ( -0.155 -0.000 1.336) 1.345 20.408 ( 1.497 0.000 -11.052) 11.153 21.764 ( -4.135 -0.000 8.753) 9.681 21.800 ( 0.654 0.000 -1.188) 1.356 22.362 ( -10.246 -0.000 6.925) 12.367 22.487 ( -2.195 -0.000 -1.704) 2.779 23.387 ( 4.104 0.000 0.702) 4.164 23.575 ( 4.680 0.000 5.865) 7.503 24.234 ( -11.053 -0.000 14.156) 17.960 24.911 ( 1.350 0.000 -5.570) 5.731 25.058 ( 10.086 0.000 -5.518) 11.497 25.063 ( 1.569 0.000 -4.800) 5.050 ======================= Grid point 164 (87/128) ======================= q-point: ( 0.43 0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.252 ( 4.777 -0.312 9.455) 10.597 2.709 ( 12.423 14.671 -1.647) 19.295 2.818 ( 2.825 1.179 11.734) 12.126 3.016 ( 6.100 7.453 6.040) 11.368 3.114 ( 10.116 -0.668 0.845) 10.173 3.367 ( 9.916 -6.626 -0.055) 11.926 3.461 ( -6.719 -3.504 -3.662) 8.416 3.623 ( -3.711 -6.703 2.869) 8.182 3.893 ( -0.583 3.509 3.404) 4.923 4.224 ( -0.207 -2.478 0.374) 2.514 4.338 ( 7.312 -1.749 -1.468) 7.660 4.585 ( -1.196 12.776 -9.810) 16.152 4.742 ( 6.228 9.260 6.643) 12.987 4.779 ( -11.882 2.157 -11.754) 16.852 4.966 ( -0.582 -1.638 1.840) 2.531 5.212 ( 6.077 -8.217 -2.575) 10.539 5.376 ( 2.148 -7.620 10.147) 12.870 5.526 ( -0.053 -8.761 5.289) 10.234 5.713 ( 2.578 0.224 2.313) 3.471 6.063 ( -8.143 5.390 2.436) 10.064 6.139 ( 0.008 -1.344 -2.821) 3.125 6.548 ( -1.758 -0.776 -8.262) 8.482 6.707 ( -1.206 0.791 9.112) 9.225 6.820 ( -6.619 3.396 14.313) 16.131 6.961 ( -3.757 -4.534 9.064) 10.808 7.287 ( -1.105 6.512 -4.250) 7.854 7.590 ( -0.572 5.131 3.477) 6.225 7.750 ( 2.250 -0.652 -3.429) 4.153 7.987 ( 5.730 -4.103 -10.960) 13.030 8.413 ( -1.197 2.968 -0.638) 3.263 8.462 ( -3.016 -0.561 -5.977) 6.718 8.683 ( -0.097 -2.364 -4.807) 5.357 8.963 ( -5.040 -1.890 1.704) 5.645 9.237 ( -1.654 -3.017 2.489) 4.247 9.485 ( 0.303 5.462 -1.310) 5.625 9.807 ( 2.325 -2.200 0.526) 3.244 10.029 ( -7.359 2.055 2.720) 8.111 10.231 ( 1.318 -2.340 -5.120) 5.781 10.853 ( -0.274 -3.686 11.518) 12.097 11.656 ( -1.326 0.357 -6.683) 6.823 12.651 ( -7.844 -2.561 5.724) 10.043 13.369 ( -1.655 -1.626 -7.842) 8.179 13.524 ( 7.422 0.313 12.198) 14.282 13.895 ( -0.289 2.756 -4.429) 5.224 14.030 ( -9.735 -3.838 -2.214) 10.696 14.434 ( 3.527 0.741 9.029) 9.722 14.693 ( -1.241 0.279 -4.345) 4.528 14.903 ( 6.645 1.484 -5.508) 8.758 20.104 ( -1.019 0.355 1.113) 1.550 20.376 ( 0.566 0.941 -9.652) 9.714 21.717 ( -3.959 2.106 7.544) 8.776 21.835 ( 2.870 -1.691 -0.385) 3.353 22.255 ( -8.233 0.546 7.446) 11.114 22.488 ( -2.427 -4.784 -1.757) 5.645 23.386 ( 4.974 7.633 4.600) 10.206 23.704 ( 3.091 -5.551 2.786) 6.937 24.150 ( -9.071 0.335 15.515) 17.975 24.902 ( 2.329 1.590 -5.552) 6.227 25.056 ( 3.152 0.659 -6.697) 7.431 25.171 ( 4.563 -2.293 -5.595) 7.575 ======================= Grid point 165 (88/128) ======================= q-point: (-0.43 0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.370 ( 3.588 -1.651 13.066) 13.650 2.588 ( 14.094 22.740 0.371) 26.756 2.722 ( -9.074 6.463 3.036) 11.547 2.934 ( -4.927 7.710 8.161) 12.261 3.202 ( 3.427 5.936 -2.059) 7.156 3.470 ( -5.856 1.835 3.614) 7.122 3.573 ( 3.008 -8.145 3.745) 9.456 3.628 ( 3.303 -6.244 -4.329) 8.285 3.993 ( 0.353 -6.096 5.632) 8.307 4.094 ( -4.866 8.286 -9.248) 13.337 4.376 ( -1.602 -1.528 -1.576) 2.717 4.435 ( 1.463 6.487 -13.231) 14.808 4.534 ( 1.710 10.060 -1.383) 10.298 4.709 ( 0.255 3.812 2.459) 4.543 5.015 ( 1.650 -1.859 11.641) 11.904 5.280 ( -3.854 7.085 13.803) 15.987 5.513 ( -1.574 -8.247 1.276) 8.492 5.719 ( 2.403 -8.004 3.360) 9.007 5.798 ( 6.626 -1.789 0.959) 6.930 5.984 ( 0.867 -1.889 2.359) 3.144 6.202 ( 1.873 -6.677 -3.869) 7.941 6.522 ( -2.552 -4.469 -9.379) 10.698 6.652 ( -0.481 5.770 5.492) 7.980 6.807 ( -2.924 -0.601 14.548) 14.851 6.935 ( -7.720 1.755 -1.042) 7.986 7.194 ( 1.563 1.440 0.837) 2.284 7.558 ( 2.035 3.444 1.815) 4.392 7.736 ( 0.548 2.657 -3.458) 4.395 8.078 ( 2.578 -3.788 -6.004) 7.552 8.276 ( -4.168 2.698 3.890) 6.308 8.525 ( -0.374 -9.599 -9.534) 13.534 8.656 ( -4.438 0.581 -6.321) 7.745 8.954 ( 2.468 2.082 1.925) 3.759 9.238 ( -1.577 1.608 0.439) 2.295 9.481 ( 5.637 1.579 5.072) 7.746 9.816 ( -6.861 -2.593 5.433) 9.128 10.010 ( 2.744 -4.284 -4.682) 6.914 10.254 ( 0.359 -1.843 -5.373) 5.692 10.983 ( 3.385 -5.564 7.898) 10.236 11.590 ( -2.717 1.251 -7.616) 8.183 12.636 ( -5.864 -4.197 8.704) 11.303 13.378 ( 0.285 -4.110 -6.442) 7.647 13.665 ( 6.985 0.375 11.330) 13.316 13.829 ( -1.964 0.769 -4.153) 4.658 13.951 ( -8.435 -3.015 -2.113) 9.203 14.469 ( 0.361 2.593 7.452) 7.899 14.666 ( -0.308 -0.814 -6.059) 6.121 14.924 ( 4.981 3.702 -5.295) 8.158 20.085 ( -1.283 0.329 0.901) 1.602 20.333 ( 1.071 1.523 -7.838) 8.056 21.664 ( -2.759 2.067 7.204) 7.986 21.923 ( 3.785 -3.525 0.106) 5.174 22.183 ( -4.844 0.322 8.068) 9.416 22.532 ( -2.495 -6.295 -3.017) 7.414 23.336 ( 1.593 8.610 7.720) 11.673 23.822 ( 2.275 -4.401 -2.644) 5.615 24.099 ( -5.319 0.440 17.904) 18.682 24.890 ( 3.748 2.324 -6.693) 8.015 25.076 ( 2.496 -0.905 -6.097) 6.650 25.204 ( -0.185 -0.625 -5.634) 5.672 ======================= Grid point 166 (89/128) ======================= q-point: (-0.29 0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.397 ( 4.177 13.717 10.686) 17.883 2.488 ( -0.248 11.862 5.437) 13.051 2.554 ( 4.116 2.848 6.207) 7.974 2.688 ( -13.170 10.863 7.777) 18.760 3.076 ( -2.315 9.771 -3.535) 10.645 3.211 ( -14.315 9.131 7.932) 18.740 3.578 ( -8.018 4.360 -12.521) 15.494 3.832 ( 8.001 -7.092 4.795) 11.718 3.944 ( 4.472 -2.718 -2.322) 5.725 4.170 ( -0.225 -3.355 -2.732) 4.333 4.223 ( 1.127 10.779 -11.920) 16.111 4.419 ( 0.628 -6.494 -1.739) 6.752 4.505 ( 10.110 9.908 7.020) 15.801 4.683 ( 0.131 0.377 -0.706) 0.810 5.050 ( -3.397 13.756 23.085) 27.087 5.201 ( 0.414 -6.846 10.716) 12.723 5.608 ( -2.913 -7.554 -0.381) 8.105 5.778 ( 0.022 4.119 6.649) 7.821 5.906 ( 1.025 -3.514 -2.637) 4.512 6.059 ( 3.965 -0.972 -2.276) 4.674 6.356 ( 0.359 -11.283 -3.747) 11.895 6.468 ( -2.951 2.387 -3.855) 5.410 6.602 ( 0.372 6.932 1.653) 7.136 6.769 ( -1.303 -2.408 -0.808) 2.855 6.899 ( -4.690 -7.029 5.985) 10.355 7.232 ( -0.633 -2.902 -0.316) 2.987 7.515 ( 0.789 5.965 1.408) 6.179 7.720 ( 2.438 -0.600 -2.171) 3.319 8.097 ( -0.073 0.138 -1.418) 1.427 8.292 ( -0.131 -2.288 -1.147) 2.563 8.533 ( -0.262 -1.807 -5.714) 5.999 8.681 ( -2.344 -12.327 -5.553) 13.721 8.915 ( -3.197 5.278 3.826) 7.261 9.195 ( 5.285 4.839 -1.945) 7.425 9.586 ( 5.482 -0.779 7.924) 9.667 9.810 ( -8.767 -8.884 1.747) 12.603 10.109 ( 5.153 -2.498 -4.729) 7.426 10.255 ( 0.058 -0.443 -5.651) 5.668 11.157 ( 4.949 -5.835 4.777) 9.020 11.496 ( -3.508 1.224 -7.156) 8.063 12.680 ( -3.413 -5.187 12.139) 13.635 13.439 ( 1.499 -4.468 -4.509) 6.522 13.698 ( -10.416 -1.334 3.950) 11.219 13.817 ( 2.365 0.398 -3.269) 4.054 13.939 ( 4.492 -2.056 4.589) 6.743 14.412 ( -3.448 4.516 2.936) 6.396 14.667 ( 0.932 -1.222 -5.029) 5.259 14.894 ( 3.209 4.934 -5.234) 7.876 20.070 ( -0.898 0.050 0.794) 1.200 20.313 ( 3.058 1.117 -6.880) 7.611 21.640 ( -1.533 0.725 7.578) 7.765 21.997 ( -1.890 -2.510 0.026) 3.142 22.217 ( 4.495 -3.060 8.243) 9.875 22.576 ( -2.195 -5.345 -3.943) 6.996 23.218 ( -4.518 8.793 9.973) 14.042 23.845 ( -1.883 -0.036 -3.444) 3.925 24.166 ( 3.682 -3.185 13.669) 14.510 24.886 ( 3.712 2.272 -6.856) 8.121 25.093 ( 0.204 -0.443 -5.238) 5.261 25.147 ( -2.997 1.557 -4.554) 5.670 ======================= Grid point 167 (90/128) ======================= q-point: (-0.14 0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.222 ( -10.661 7.670 -0.011) 13.134 2.346 ( 3.307 12.438 8.271) 15.299 2.387 ( 1.287 13.351 13.937) 19.343 2.652 ( 2.273 3.302 10.956) 11.666 2.829 ( -8.388 6.187 7.280) 12.713 2.990 ( -2.224 7.625 -1.085) 8.016 3.432 ( 2.753 2.882 -8.110) 9.037 3.966 ( 2.387 3.440 3.116) 5.220 4.001 ( 1.829 5.418 -13.481) 14.644 4.097 ( 0.435 -5.265 0.945) 5.367 4.173 ( 1.817 1.346 -1.480) 2.703 4.460 ( -4.674 2.133 8.251) 9.720 4.563 ( 9.543 5.039 -1.419) 10.885 4.731 ( 5.584 -0.892 5.618) 7.971 4.919 ( 3.839 9.353 14.332) 17.539 5.384 ( -2.118 -10.605 6.062) 12.397 5.643 ( -0.836 1.563 8.660) 8.840 5.722 ( -3.860 -1.060 1.708) 4.352 5.805 ( -7.886 6.092 -11.746) 15.404 6.104 ( 5.486 2.237 -2.961) 6.623 6.400 ( -2.260 -5.060 -2.583) 6.114 6.471 ( 0.503 7.537 -2.052) 7.828 6.549 ( -2.540 -9.691 4.612) 11.029 6.848 ( 0.239 -3.744 3.236) 4.954 6.971 ( -6.474 -10.328 3.118) 12.582 7.251 ( -0.804 -3.884 -4.451) 5.962 7.446 ( 0.812 5.161 2.819) 5.937 7.771 ( 1.848 -2.152 -4.795) 5.571 8.078 ( -0.713 1.778 -1.531) 2.452 8.268 ( 5.570 4.431 -5.694) 9.115 8.622 ( -4.407 -6.480 1.091) 7.912 8.798 ( -2.305 0.138 1.343) 2.671 8.846 ( -1.102 -14.411 -1.814) 14.566 9.214 ( 7.643 4.601 -3.002) 9.413 9.685 ( 2.274 -0.944 7.151) 7.563 9.827 ( -8.426 -8.328 -1.128) 11.901 10.169 ( 1.979 -0.333 -2.796) 3.442 10.226 ( 1.180 2.556 -4.588) 5.383 11.235 ( -4.122 0.764 0.540) 4.227 11.477 ( 3.374 -3.907 -3.547) 6.264 12.794 ( 0.411 -6.390 14.601) 15.943 13.444 ( -11.640 0.374 -0.067) 11.646 13.583 ( -2.182 -2.910 -1.421) 3.905 13.827 ( 0.283 -0.197 -2.439) 2.463 14.101 ( 8.689 -1.800 6.251) 10.854 14.291 ( -2.699 4.852 0.153) 5.555 14.679 ( 0.424 -0.724 -3.057) 3.170 14.834 ( 2.001 4.705 -5.958) 7.851 20.067 ( -0.166 -0.228 0.859) 0.904 20.335 ( 5.021 -0.066 -7.866) 9.333 21.657 ( -0.870 -1.103 8.298) 8.416 21.962 ( -4.345 0.326 0.480) 4.384 22.425 ( 7.847 -7.295 4.342) 11.561 22.605 ( -0.726 -3.588 -3.007) 4.738 23.040 ( -9.258 6.547 12.482) 16.863 23.778 ( -2.179 3.352 -1.160) 4.163 24.362 ( 8.978 -5.798 4.304) 11.521 24.825 ( -5.271 4.792 -1.976) 7.392 25.017 ( -1.029 1.710 -7.856) 8.106 25.120 ( 1.358 1.270 -1.227) 2.227 ======================= Grid point 171 (91/128) ======================= q-point: (-0.57 -0.57 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.329 ( 3.254 0.000 6.573) 7.335 2.794 ( -6.978 -0.000 4.583) 8.348 2.981 ( 3.238 0.000 -1.014) 3.393 3.166 ( 4.648 0.000 7.399) 8.738 3.272 ( -4.577 -0.000 -4.413) 6.358 3.380 ( 5.710 0.000 4.914) 7.533 3.434 ( 9.966 0.000 -4.011) 10.743 3.533 ( 6.952 0.000 7.106) 9.941 3.952 ( -0.925 -0.000 1.565) 1.818 4.170 ( -4.127 -0.000 7.045) 8.165 4.290 ( -9.674 -0.000 -7.756) 12.399 4.590 ( -9.200 -0.000 -14.559) 17.222 4.667 ( -0.217 -0.000 2.815) 2.824 4.909 ( 1.532 0.000 3.082) 3.441 5.033 ( 3.810 0.000 2.710) 4.675 5.243 ( 14.607 0.000 -4.183) 15.194 5.386 ( 0.232 0.000 11.251) 11.254 5.475 ( 3.109 0.000 2.408) 3.932 5.752 ( 2.924 0.000 0.059) 2.925 6.067 ( -1.812 -0.000 9.681) 9.849 6.116 ( 2.990 0.000 -8.457) 8.970 6.448 ( -7.124 -0.000 -7.208) 10.134 6.709 ( -4.968 -0.000 9.030) 10.307 6.790 ( -3.826 -0.000 4.042) 5.566 6.918 ( -2.978 -0.000 14.134) 14.444 7.318 ( -1.818 -0.000 -1.212) 2.185 7.629 ( -1.214 -0.000 8.848) 8.931 7.764 ( 1.895 0.000 -4.183) 4.593 8.003 ( 6.957 0.000 -15.500) 16.989 8.362 ( -0.856 -0.000 -11.492) 11.524 8.407 ( -11.611 -0.000 8.571) 14.432 8.629 ( -0.381 -0.000 -4.137) 4.155 8.937 ( 3.497 0.000 0.906) 3.613 9.193 ( -1.112 -0.000 0.117) 1.119 9.585 ( 5.610 0.000 2.799) 6.269 9.826 ( 1.263 0.000 2.311) 2.633 9.920 ( -9.730 -0.000 1.972) 9.927 10.229 ( 4.718 0.000 -10.952) 11.925 10.885 ( 1.736 0.000 14.915) 15.016 11.597 ( -3.274 -0.000 -8.067) 8.706 12.564 ( -5.234 -0.000 5.868) 7.863 13.297 ( -0.474 -0.000 -10.411) 10.422 13.685 ( 6.128 0.000 16.178) 17.300 13.845 ( -8.552 -0.000 -3.899) 9.399 13.895 ( -1.464 -0.000 -4.976) 5.187 14.512 ( 1.362 0.000 8.797) 8.902 14.651 ( -1.829 -0.000 -5.272) 5.580 14.983 ( 5.654 0.000 -5.394) 7.814 20.091 ( -1.657 -0.000 0.937) 1.904 20.360 ( 1.253 0.000 -8.995) 9.082 21.700 ( -4.600 -0.000 7.258) 8.593 21.871 ( 4.146 0.000 0.076) 4.146 22.196 ( -5.029 -0.000 7.285) 8.852 22.412 ( -1.812 -0.000 -1.643) 2.446 23.539 ( 5.022 0.000 2.749) 5.725 23.686 ( 0.085 0.000 4.432) 4.433 24.119 ( -5.217 -0.000 17.383) 18.149 24.921 ( 2.289 0.000 -5.057) 5.551 25.070 ( 1.497 0.000 -5.061) 5.278 25.179 ( 2.237 0.000 -9.226) 9.493 ======================= Grid point 172 (92/128) ======================= q-point: (-0.43 -0.57 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.412 ( 2.254 -3.003 6.817) 7.783 2.633 ( -14.959 1.457 3.848) 15.514 2.893 ( -3.921 8.129 0.327) 9.031 3.027 ( -9.173 9.911 0.615) 13.519 3.326 ( 5.695 -3.668 0.204) 6.778 3.403 ( -0.007 7.065 6.471) 9.581 3.591 ( 12.169 -4.306 2.122) 13.082 3.717 ( 1.601 8.711 2.560) 9.219 3.906 ( 0.168 -6.078 5.402) 8.134 4.022 ( -11.827 1.749 -8.275) 14.540 4.250 ( -3.585 -6.946 -0.516) 7.834 4.415 ( -6.585 0.615 -9.483) 11.562 4.667 ( -0.172 1.766 1.965) 2.647 4.856 ( 3.001 9.111 1.855) 9.771 5.061 ( 0.780 0.026 7.385) 7.426 5.388 ( -1.891 2.797 10.476) 11.007 5.434 ( 4.112 -2.827 1.567) 5.231 5.636 ( 4.111 -8.334 1.553) 9.421 5.819 ( 5.927 -2.327 -3.677) 7.353 6.085 ( 5.593 4.291 5.462) 8.918 6.158 ( 4.198 -2.235 -6.630) 8.159 6.351 ( -7.144 -4.458 -4.526) 9.560 6.685 ( -3.509 -3.112 2.467) 5.299 6.783 ( 0.901 0.558 3.594) 3.747 6.910 ( -4.608 2.755 10.635) 11.913 7.258 ( -0.233 4.319 2.756) 5.128 7.637 ( 0.343 2.578 6.581) 7.076 7.746 ( -0.955 0.893 -5.251) 5.411 8.047 ( 3.812 -3.036 -10.836) 11.882 8.247 ( -9.369 2.259 8.537) 12.875 8.366 ( 0.883 -5.575 -10.612) 12.020 8.611 ( -1.179 0.743 -3.382) 3.658 9.005 ( 3.193 0.965 2.077) 3.929 9.219 ( 2.120 -3.120 -2.305) 4.420 9.640 ( 3.168 4.106 5.522) 7.575 9.705 ( -9.202 2.181 6.002) 11.201 9.976 ( 5.768 -5.607 -4.323) 9.132 10.262 ( 5.921 0.476 -10.182) 11.789 11.001 ( 3.796 -3.229 12.917) 13.845 11.515 ( -4.419 -0.254 -8.599) 9.671 12.548 ( -3.684 -2.593 8.121) 9.287 13.293 ( 1.461 -3.705 -9.862) 10.636 13.680 ( -10.412 -0.133 5.940) 11.988 13.840 ( 1.236 1.043 -2.098) 2.649 13.888 ( 6.178 -1.350 4.947) 8.029 14.511 ( -2.934 1.682 2.560) 4.242 14.629 ( 0.010 -0.732 -1.451) 1.626 15.009 ( 3.580 2.222 -5.811) 7.178 20.071 ( -1.495 0.023 0.912) 1.751 20.347 ( 2.501 0.820 -8.270) 8.678 21.657 ( -4.659 0.306 6.744) 8.203 21.935 ( 2.687 -1.168 1.079) 3.123 22.181 ( -0.009 -0.031 6.618) 6.618 22.424 ( -0.170 -3.665 -2.178) 4.266 23.507 ( 0.032 9.261 5.662) 10.855 23.758 ( -0.094 -5.558 0.775) 5.612 24.135 ( -0.934 0.454 17.878) 17.908 24.932 ( 2.986 0.652 -6.072) 6.797 25.072 ( 1.238 -0.303 -4.758) 4.926 25.149 ( -2.684 -0.771 -8.550) 8.994 ======================= Grid point 173 (93/128) ======================= q-point: (-0.29 -0.57 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.422 ( -14.148 3.553 8.547) 16.907 2.521 ( 0.297 -4.228 7.036) 8.214 2.569 ( -22.283 7.020 6.352) 24.210 2.852 ( 3.134 8.387 -5.057) 10.283 3.237 ( -6.742 15.430 7.736) 18.531 3.347 ( 7.123 13.324 7.095) 16.691 3.497 ( -5.505 3.650 -5.082) 8.333 3.836 ( 4.696 -8.737 4.002) 10.696 3.919 ( -0.427 -3.553 -3.882) 5.279 4.032 ( -3.778 -3.996 -5.886) 8.055 4.265 ( 0.521 -5.021 -6.114) 7.928 4.378 ( 0.844 -0.505 -0.835) 1.290 4.637 ( -3.821 -1.939 1.711) 4.614 4.803 ( 8.275 8.414 2.153) 11.997 5.123 ( -3.258 -4.709 10.809) 12.232 5.291 ( -3.613 8.529 13.808) 16.627 5.506 ( -0.486 -2.523 2.602) 3.656 5.720 ( -3.680 -4.342 -4.073) 6.999 5.915 ( 3.433 2.466 3.722) 5.632 6.132 ( 3.676 -0.843 0.329) 3.785 6.253 ( 3.500 -5.878 -6.391) 9.362 6.354 ( 0.019 -3.797 -4.762) 6.090 6.713 ( -1.130 -3.746 -3.821) 5.469 6.764 ( 0.924 6.787 0.760) 6.892 6.831 ( -1.229 3.584 12.477) 13.040 7.221 ( 0.223 2.442 2.633) 3.598 7.597 ( -1.423 3.844 2.640) 4.876 7.710 ( -0.624 -0.881 -3.359) 3.529 8.101 ( 0.656 -0.582 2.357) 2.515 8.234 ( 1.433 -6.644 -1.303) 6.920 8.443 ( 0.214 -8.033 -8.304) 11.556 8.554 ( -0.846 2.130 -3.238) 3.967 8.961 ( -2.833 6.159 2.696) 7.296 9.296 ( 5.479 0.126 -2.233) 5.918 9.547 ( -11.081 -5.565 1.885) 12.543 9.728 ( 6.364 2.737 6.102) 9.232 10.114 ( 4.833 -4.252 -4.430) 7.814 10.299 ( 6.838 2.240 -6.814) 9.910 11.169 ( 5.358 -4.392 8.040) 10.613 11.419 ( -4.832 -0.013 -8.063) 9.400 12.604 ( -2.059 -5.370 11.709) 13.046 13.364 ( 2.495 -5.488 -8.073) 10.075 13.548 ( -10.710 0.657 4.940) 11.813 13.818 ( -0.443 -0.355 -2.981) 3.034 14.058 ( 10.343 -0.858 8.279) 13.276 14.421 ( -4.616 3.014 -0.957) 5.595 14.643 ( -0.074 -1.027 -0.323) 1.079 14.972 ( 1.271 3.964 -6.502) 7.721 20.060 ( -0.772 -0.198 0.999) 1.278 20.347 ( 3.678 0.731 -8.070) 8.899 21.624 ( -4.206 -1.002 6.540) 7.840 21.963 ( -1.033 -0.113 2.043) 2.292 22.267 ( 5.858 -3.059 4.988) 8.280 22.484 ( 1.442 -4.005 -2.591) 4.983 23.335 ( -5.678 11.486 8.630) 15.448 23.805 ( -1.419 -1.704 0.510) 2.275 24.228 ( 4.352 -2.367 12.300) 13.260 24.926 ( 0.581 2.043 -6.732) 7.059 25.038 ( -3.626 -0.097 -6.957) 7.845 25.116 ( 0.394 -1.525 -3.036) 3.420 ======================= Grid point 174 (94/128) ======================= q-point: (-0.14 -0.57 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.053 ( -21.615 6.520 2.125) 22.677 2.426 ( -6.672 -6.035 13.794) 16.468 2.570 ( -4.316 0.935 10.698) 11.574 2.770 ( 3.453 8.698 -5.025) 10.622 2.913 ( -4.604 13.571 12.473) 18.998 3.280 ( 11.000 14.738 6.955) 19.661 3.447 ( 2.117 -1.424 -5.526) 6.086 3.934 ( -6.846 -0.705 -6.176) 9.247 3.972 ( -1.029 -5.322 -1.435) 5.607 4.007 ( 0.090 -5.298 -0.878) 5.371 4.300 ( 2.550 2.112 -2.301) 4.032 4.435 ( 2.756 -1.722 -1.974) 3.803 4.634 ( -1.979 -0.296 2.569) 3.256 4.838 ( 8.056 1.006 -4.446) 9.256 5.151 ( -5.610 -1.739 15.562) 16.633 5.201 ( -5.295 0.835 7.125) 8.916 5.550 ( -0.998 -4.068 4.628) 6.242 5.674 ( -5.089 -1.629 -7.639) 9.322 5.855 ( -1.366 8.437 5.591) 10.213 6.178 ( 0.522 0.322 1.761) 1.864 6.309 ( -3.147 -2.308 -0.807) 3.985 6.417 ( 6.478 -1.630 -4.870) 8.267 6.684 ( 3.467 8.269 0.875) 9.009 6.783 ( -0.766 -4.138 1.152) 4.363 6.802 ( -1.694 -2.237 5.032) 5.761 7.210 ( 0.673 0.244 -0.069) 0.719 7.520 ( -2.112 3.844 1.700) 4.704 7.724 ( -0.523 -2.801 -3.645) 4.627 8.111 ( 1.518 2.640 2.350) 3.847 8.365 ( 5.360 -4.218 -4.536) 8.191 8.507 ( -1.307 1.048 -3.113) 3.535 8.608 ( 0.706 -15.840 -2.005) 15.982 8.816 ( -2.647 6.848 1.160) 7.433 9.340 ( 3.860 1.576 -0.912) 4.268 9.526 ( -9.208 -8.382 -1.675) 12.564 9.785 ( 4.359 2.209 3.559) 6.045 10.183 ( 1.787 -0.107 -1.998) 2.683 10.327 ( 6.354 3.995 -2.852) 8.029 11.205 ( -4.746 3.612 -1.828) 6.238 11.437 ( 4.472 -6.551 -1.980) 8.175 12.741 ( 0.221 -7.987 14.321) 16.399 13.328 ( -9.726 3.732 3.255) 10.914 13.527 ( 3.277 -5.457 -3.438) 7.234 13.803 ( -1.711 0.200 -2.513) 3.047 14.236 ( 8.895 0.085 6.654) 11.109 14.322 ( -1.297 2.482 -0.007) 2.801 14.646 ( -1.549 -1.086 -1.422) 2.367 14.889 ( -0.167 3.990 -7.577) 8.566 20.064 ( -0.004 -0.472 1.125) 1.220 20.364 ( 3.759 -0.141 -8.784) 9.556 21.622 ( -3.570 -2.672 6.653) 8.009 21.937 ( -1.866 1.465 1.738) 2.941 22.424 ( 3.940 -4.548 -0.049) 6.017 22.570 ( 4.367 -3.970 0.535) 5.926 23.097 ( -8.524 10.927 12.601) 18.730 23.790 ( -1.302 1.272 2.130) 2.802 24.397 ( 7.071 -5.408 0.733) 8.932 24.782 ( -10.236 4.600 -0.311) 11.227 25.015 ( 3.192 -0.026 -8.676) 9.244 25.145 ( 1.591 -0.667 -0.394) 1.770 ======================= Grid point 179 (95/128) ======================= q-point: (-0.43 -0.43 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.414 ( -0.746 -0.000 4.714) 4.773 2.419 ( -18.315 -0.000 6.516) 19.440 2.833 ( -22.811 -0.000 8.512) 24.348 2.922 ( -3.647 -0.000 -5.519) 6.615 3.374 ( 8.112 0.000 0.221) 8.115 3.572 ( 1.717 0.000 6.320) 6.549 3.700 ( 4.297 0.000 -0.073) 4.297 3.726 ( -14.379 -0.000 -0.219) 14.381 3.913 ( 5.722 0.000 0.580) 5.751 3.922 ( -0.088 -0.000 -0.073) 0.115 4.095 ( -8.251 -0.000 9.629) 12.681 4.271 ( -6.209 -0.000 -9.567) 11.405 4.636 ( -5.743 -0.000 3.182) 6.566 4.980 ( 3.693 0.000 1.330) 3.925 5.080 ( -1.665 -0.000 7.286) 7.474 5.403 ( -1.862 -0.000 7.190) 7.427 5.457 ( -2.346 -0.000 -2.691) 3.570 5.652 ( 6.566 0.000 0.101) 6.567 5.860 ( 7.507 0.000 -16.332) 17.975 6.139 ( -5.336 -0.000 -5.850) 7.919 6.230 ( 0.457 0.000 10.832) 10.842 6.263 ( 8.084 0.000 2.257) 8.393 6.644 ( 3.736 0.000 0.704) 3.802 6.839 ( 5.319 0.000 -0.053) 5.319 6.923 ( -4.339 -0.000 13.513) 14.192 7.317 ( 1.382 0.000 4.903) 5.094 7.679 ( -1.861 -0.000 8.425) 8.628 7.698 ( -3.197 -0.000 -6.670) 7.397 8.005 ( 1.517 0.000 -12.577) 12.669 8.176 ( -6.912 -0.000 11.107) 13.082 8.317 ( 3.352 0.000 -11.861) 12.326 8.592 ( -1.985 -0.000 -0.630) 2.082 9.101 ( 4.731 0.000 2.701) 5.448 9.218 ( 5.164 0.000 -4.074) 6.578 9.541 ( -12.722 -0.000 2.573) 12.980 9.794 ( 5.250 0.000 3.741) 6.447 9.999 ( 6.474 0.000 -3.697) 7.455 10.337 ( 9.129 0.000 -9.472) 13.155 11.093 ( 5.513 0.000 15.251) 16.217 11.412 ( -5.197 -0.000 -8.899) 10.306 12.521 ( -2.075 -0.000 9.041) 9.276 13.254 ( 2.920 0.000 -10.466) 10.866 13.562 ( -9.277 -0.000 5.600) 10.836 13.812 ( -1.320 -0.000 -3.330) 3.581 14.048 ( 10.577 0.000 9.370) 14.130 14.459 ( -4.932 -0.000 -3.494) 6.044 14.632 ( -0.431 -0.000 3.444) 3.471 15.037 ( 1.209 0.000 -6.631) 6.740 20.057 ( -1.024 -0.000 1.102) 1.504 20.362 ( 3.217 0.000 -8.630) 9.211 21.606 ( -5.788 -0.000 5.954) 8.304 21.961 ( 0.945 0.000 2.821) 2.976 22.228 ( 4.080 0.000 4.098) 5.783 22.410 ( 2.866 0.000 -1.177) 3.098 23.649 ( 0.907 0.000 2.597) 2.751 23.651 ( -3.828 -0.000 3.372) 5.101 24.209 ( 1.730 0.000 17.152) 17.239 24.955 ( 2.956 0.000 -6.125) 6.801 25.039 ( -7.031 -0.000 -9.204) 11.582 25.071 ( 0.851 0.000 -3.267) 3.376 ======================= Grid point 180 (96/128) ======================= q-point: (-0.29 -0.43 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.237 ( -16.142 -4.015 13.371) 21.342 2.359 ( -22.949 6.213 11.980) 26.623 2.498 ( -6.431 1.875 2.719) 7.230 2.867 ( -3.268 -1.163 -6.657) 7.507 3.415 ( -1.080 2.262 -2.136) 3.293 3.434 ( -12.581 8.473 5.171) 16.025 3.623 ( 4.348 1.172 5.202) 6.880 3.764 ( -3.271 7.230 6.868) 10.495 3.786 ( -2.413 -7.123 -6.460) 9.914 3.966 ( -3.038 0.303 2.017) 3.659 4.185 ( 2.470 -7.023 -4.558) 8.729 4.253 ( -4.049 -9.925 3.221) 11.193 4.583 ( -3.007 -0.596 4.404) 5.366 4.998 ( 4.679 5.109 1.246) 7.039 5.068 ( -4.503 -0.215 5.688) 7.258 5.309 ( -8.123 3.319 -1.222) 8.860 5.437 ( -4.211 -3.210 3.907) 6.580 5.681 ( 2.210 2.519 -7.824) 8.512 5.964 ( 3.036 -8.145 -9.511) 12.885 6.045 ( -5.045 0.128 0.167) 5.049 6.259 ( 2.801 0.154 8.632) 9.076 6.436 ( 13.036 0.449 -1.823) 13.171 6.725 ( 6.023 2.304 1.137) 6.548 6.852 ( -1.415 5.272 6.930) 8.821 6.942 ( 4.151 0.805 6.246) 7.543 7.317 ( 1.938 5.053 3.836) 6.634 7.606 ( -4.345 2.154 -2.463) 5.439 7.666 ( -2.586 -0.325 1.546) 3.030 8.063 ( 2.995 -9.095 -7.872) 12.396 8.175 ( 0.781 -0.809 9.867) 9.930 8.340 ( 1.655 -3.164 -11.175) 11.731 8.551 ( -2.494 0.640 -0.940) 2.741 9.076 ( 0.845 7.909 2.818) 8.438 9.335 ( 4.417 -4.021 -2.585) 6.509 9.387 ( -5.891 2.170 -0.176) 6.280 9.854 ( 4.502 1.188 0.627) 4.699 10.100 ( 4.951 -3.730 -4.162) 7.466 10.424 ( 8.959 1.974 -4.837) 10.371 11.249 ( 6.702 -0.741 11.065) 12.958 11.313 ( -4.450 -1.020 -7.522) 8.799 12.563 ( -0.601 -3.137 11.925) 12.345 13.300 ( 3.898 -4.009 -9.185) 10.753 13.461 ( -7.466 0.961 7.162) 10.390 13.796 ( 0.033 -0.354 -2.378) 2.404 14.231 ( 10.963 -0.070 8.450) 13.841 14.373 ( -4.534 0.593 -3.441) 5.723 14.629 ( -1.774 -0.027 2.221) 2.843 14.992 ( -1.499 2.164 -7.661) 8.100 20.053 ( -0.301 -0.187 1.294) 1.342 20.369 ( 2.838 0.277 -8.783) 9.234 21.558 ( -5.315 -1.308 5.622) 7.846 21.975 ( 0.218 0.894 3.840) 3.948 22.321 ( 5.353 -1.818 1.773) 5.925 22.478 ( 4.742 -1.996 -0.699) 5.193 23.466 ( -5.194 12.065 6.091) 14.479 23.744 ( -1.012 -5.219 0.276) 5.324 24.308 ( 3.796 -0.614 12.087) 12.684 24.875 ( -9.316 1.793 -4.936) 10.694 24.987 ( 2.549 -1.585 -7.271) 7.866 25.086 ( 0.640 -1.966 -2.095) 2.943 ======================= Grid point 181 (97/128) ======================= q-point: (-0.14 -0.43 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.872 ( -24.576 9.130 9.540) 27.899 2.227 ( -9.840 -10.178 19.422) 24.033 2.505 ( -4.916 -3.427 6.341) 8.724 2.832 ( 0.115 -0.791 -6.891) 6.937 3.124 ( -7.671 13.804 7.583) 17.519 3.409 ( -0.049 -4.751 0.067) 4.752 3.591 ( 2.088 7.906 4.301) 9.239 3.779 ( -3.559 -7.939 1.331) 8.801 3.850 ( -10.782 -2.745 2.414) 11.384 3.891 ( 3.130 -4.647 -2.341) 6.072 4.266 ( 1.458 -1.722 -6.412) 6.798 4.373 ( -4.396 -9.537 2.003) 10.691 4.629 ( 3.078 -3.252 2.506) 5.132 4.892 ( -6.579 6.109 -4.848) 10.203 5.061 ( 1.206 0.715 5.594) 5.767 5.148 ( -11.081 -0.797 1.292) 11.185 5.477 ( -3.069 -6.532 9.650) 12.050 5.629 ( 2.255 3.312 -9.099) 9.942 5.972 ( -0.440 4.693 1.693) 5.009 6.048 ( -5.098 -7.194 -4.032) 9.695 6.363 ( 5.952 0.843 9.226) 11.011 6.556 ( 10.458 4.448 -3.958) 12.034 6.723 ( -2.425 1.522 2.128) 3.567 6.804 ( 3.274 3.441 5.964) 7.624 6.961 ( 5.385 8.767 4.149) 11.094 7.268 ( 1.144 4.727 0.560) 4.896 7.514 ( -3.437 1.270 -1.963) 4.157 7.656 ( -1.764 -2.285 -1.411) 3.213 8.208 ( 4.248 -0.622 2.880) 5.170 8.285 ( 2.722 -5.405 -4.301) 7.424 8.388 ( -0.196 -9.798 -5.909) 11.444 8.527 ( 1.137 -0.907 -0.485) 1.533 8.957 ( 1.545 9.912 2.096) 10.248 9.288 ( -6.173 -1.251 -0.393) 6.310 9.429 ( 3.621 -0.564 -1.874) 4.116 9.891 ( 4.404 1.982 -1.884) 5.184 10.189 ( 2.485 -2.099 -2.452) 4.073 10.473 ( 6.360 4.333 -1.541) 7.849 11.182 ( -4.782 2.972 -4.590) 7.264 11.431 ( 6.692 -3.203 2.794) 7.928 12.687 ( 0.515 -6.329 14.371) 15.711 13.303 ( -4.065 3.175 4.481) 6.833 13.482 ( 4.549 -6.046 -2.443) 7.951 13.783 ( -0.882 1.092 -3.175) 3.471 14.311 ( -1.093 0.262 0.010) 1.124 14.405 ( 9.353 0.613 6.112) 11.190 14.599 ( -3.213 -0.282 -0.462) 3.259 14.885 ( -3.462 2.639 -8.970) 9.970 20.062 ( 0.125 -0.423 1.337) 1.407 20.365 ( 1.348 -0.160 -8.726) 8.831 21.547 ( -3.958 -2.873 5.797) 7.585 21.970 ( 0.950 2.583 3.662) 4.581 22.405 ( 0.854 -1.921 -1.616) 2.652 22.592 ( 5.855 -3.343 1.314) 6.869 23.217 ( -6.592 12.688 11.230) 18.181 23.788 ( 0.458 -1.757 -0.686) 1.941 24.394 ( 0.573 -2.389 -1.973) 3.151 24.711 ( -7.319 2.622 4.543) 9.005 25.027 ( 3.995 -1.145 -7.976) 8.994 25.132 ( 0.879 -3.245 -0.314) 3.376 ======================= Grid point 187 (98/128) ======================= q-point: (-0.29 -0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.045 ( -14.989 -0.000 20.684) 25.544 2.146 ( -25.605 -0.000 17.039) 30.756 2.438 ( -5.668 -0.000 3.029) 6.426 2.747 ( -7.940 -0.000 -2.104) 8.215 3.112 ( -17.533 -0.000 -4.664) 18.142 3.547 ( -4.821 -0.000 -8.637) 9.892 3.652 ( -5.039 -0.000 -2.507) 5.628 3.675 ( 7.414 0.000 4.911) 8.893 3.896 ( -7.907 -0.000 10.975) 13.527 3.908 ( -5.476 -0.000 6.681) 8.638 3.987 ( -5.649 -0.000 6.628) 8.709 4.244 ( 7.463 0.000 -5.245) 9.122 4.573 ( -0.821 -0.000 9.563) 9.598 4.994 ( -6.707 -0.000 -0.738) 6.748 5.042 ( -7.261 -0.000 -11.686) 13.758 5.219 ( 0.256 0.000 -2.169) 2.184 5.406 ( -3.531 -0.000 14.623) 15.043 5.677 ( -3.718 -0.000 -3.759) 5.287 5.863 ( 1.770 0.000 -11.935) 12.066 6.021 ( 0.846 0.000 -3.872) 3.963 6.366 ( 9.046 0.000 6.673) 11.241 6.630 ( 12.725 0.000 -2.907) 13.053 6.810 ( -1.681 -0.000 7.019) 7.217 6.939 ( 0.400 0.000 10.903) 10.911 7.024 ( 6.982 0.000 2.466) 7.405 7.402 ( 1.462 0.000 3.121) 3.446 7.522 ( -5.621 -0.000 -7.834) 9.642 7.669 ( -1.167 -0.000 8.398) 8.479 7.969 ( 2.741 0.000 -11.492) 11.814 8.271 ( 7.416 0.000 10.681) 13.003 8.292 ( 0.918 0.000 -11.087) 11.125 8.517 ( -1.627 -0.000 -2.319) 2.832 9.117 ( -5.696 -0.000 6.372) 8.547 9.371 ( 0.605 0.000 -1.576) 1.688 9.397 ( 8.283 0.000 -3.836) 9.128 9.899 ( 3.280 0.000 -4.724) 5.751 10.117 ( 3.767 0.000 -4.348) 5.752 10.545 ( 7.437 0.000 -1.739) 7.637 11.207 ( -4.585 -0.000 -7.270) 8.595 11.412 ( 9.387 0.000 10.864) 14.357 12.589 ( 1.103 0.000 13.615) 13.660 13.302 ( 5.719 0.000 -8.757) 10.459 13.414 ( -4.758 -0.000 9.606) 10.720 13.794 ( 0.956 0.000 -2.404) 2.587 14.310 ( -2.668 -0.000 -2.696) 3.793 14.411 ( 10.683 0.000 7.161) 12.861 14.601 ( -3.437 -0.000 1.488) 3.745 14.935 ( -4.838 -0.000 -8.999) 10.217 20.056 ( 0.087 0.000 1.436) 1.438 20.365 ( 0.862 0.000 -8.641) 8.683 21.500 ( -4.269 -0.000 5.611) 7.050 22.017 ( 1.999 0.000 5.722) 6.062 22.369 ( 2.926 0.000 -0.531) 2.974 22.538 ( 6.146 0.000 -0.351) 6.156 23.581 ( -1.496 -0.000 0.518) 1.584 23.616 ( -4.194 -0.000 1.260) 4.379 24.377 ( -0.346 -0.000 7.099) 7.107 24.753 ( -7.180 -0.000 2.944) 7.760 24.980 ( 2.137 0.000 -6.473) 6.816 25.070 ( 0.709 0.000 -2.665) 2.757 ======================= Grid point 188 (99/128) ======================= q-point: (-0.14 -0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.737 ( -23.048 10.706 17.428) 30.815 2.030 ( -11.398 -8.547 24.724) 28.535 2.403 ( -4.849 -3.564 5.066) 7.867 2.702 ( -8.422 -9.469 1.589) 12.772 2.981 ( -9.429 -5.570 -2.493) 11.231 3.374 ( -6.211 3.239 -3.216) 7.708 3.558 ( -10.921 -4.705 -3.182) 12.309 3.708 ( -5.620 8.301 6.343) 11.863 3.797 ( 1.706 1.658 7.037) 7.428 3.891 ( 3.555 -3.907 2.182) 5.715 4.095 ( -7.892 -12.859 4.508) 15.747 4.323 ( 6.289 1.361 -4.079) 7.618 4.617 ( -0.498 -1.109 6.057) 6.178 4.816 ( -10.904 0.988 -9.127) 14.254 4.921 ( -8.625 -4.082 -2.682) 9.912 5.237 ( 7.519 7.885 2.783) 11.245 5.418 ( -3.931 -1.717 16.541) 17.088 5.643 ( 0.106 -2.319 -5.493) 5.963 5.885 ( -0.542 -5.300 -6.273) 8.230 6.016 ( 2.359 1.849 -6.242) 6.925 6.508 ( 8.342 1.583 3.047) 9.021 6.732 ( -3.596 4.105 2.653) 6.068 6.744 ( 5.361 3.525 1.750) 6.651 6.930 ( -0.435 4.230 10.194) 11.045 7.136 ( 6.550 1.163 3.332) 7.440 7.351 ( -1.214 5.209 -2.465) 5.889 7.460 ( -2.438 -1.424 -3.553) 4.539 7.652 ( 1.251 3.929 2.701) 4.929 8.070 ( 1.068 -10.985 -7.211) 13.184 8.272 ( -0.488 -1.780 -12.049) 12.189 8.429 ( 10.893 1.935 8.503) 13.954 8.526 ( 3.692 -2.275 -1.342) 4.539 9.040 ( -5.125 2.737 6.067) 8.400 9.329 ( 3.380 7.219 -0.992) 8.033 9.476 ( 3.509 0.933 -1.440) 3.906 9.931 ( 3.047 -1.153 -6.438) 7.215 10.166 ( 1.712 -3.109 -4.324) 5.594 10.597 ( 3.634 2.987 -1.584) 4.964 11.137 ( -1.794 0.309 -4.101) 4.487 11.541 ( 6.455 2.153 4.368) 8.086 12.686 ( 1.242 -2.690 15.099) 15.387 13.341 ( 2.571 2.049 1.984) 3.840 13.464 ( 5.148 -4.791 2.841) 7.585 13.785 ( 0.406 1.265 -4.490) 4.683 14.299 ( 0.701 -0.969 1.024) 1.575 14.532 ( -3.458 1.956 1.253) 4.166 14.573 ( 6.962 -0.562 2.558) 7.439 14.798 ( -8.067 0.693 -10.556) 13.304 20.064 ( 0.067 -0.195 1.309) 1.325 20.333 ( -1.123 -0.190 -7.485) 7.571 21.489 ( -2.211 -1.650 6.212) 6.797 22.065 ( 4.057 2.444 7.039) 8.484 22.375 ( -2.091 0.081 -2.983) 3.644 22.636 ( 5.707 -1.775 0.544) 6.002 23.364 ( -5.282 13.127 6.080) 15.401 23.717 ( 1.066 -8.158 -6.511) 10.492 24.317 ( -8.548 0.440 1.556) 8.699 24.729 ( 1.155 2.029 8.589) 8.900 25.019 ( 2.888 -3.521 -6.149) 7.652 25.084 ( 0.157 -2.302 -1.976) 3.038 ======================= Grid point 195 (100/128) ======================= q-point: (-0.14 -0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.678 ( -16.337 -0.000 23.739) 28.817 1.785 ( -17.801 -0.000 20.602) 27.227 2.319 ( -4.979 -0.000 4.740) 6.874 2.509 ( -5.377 -0.000 14.923) 15.862 2.920 ( 4.215 0.000 -4.758) 6.356 3.254 ( -9.387 -0.000 -9.010) 13.011 3.296 ( -19.063 -0.000 2.748) 19.260 3.788 ( -5.332 -0.000 2.280) 5.799 3.805 ( -1.796 -0.000 1.303) 2.219 3.886 ( -3.937 -0.000 11.810) 12.449 3.965 ( 8.246 0.000 4.789) 9.536 4.409 ( 4.807 0.000 -11.165) 12.156 4.574 ( -10.164 -0.000 -6.174) 11.892 4.646 ( -1.871 -0.000 10.624) 10.788 4.827 ( -3.365 -0.000 -2.099) 3.966 5.396 ( -6.605 -0.000 19.854) 20.924 5.473 ( 12.207 0.000 1.800) 12.339 5.581 ( 0.873 0.000 -2.247) 2.410 5.825 ( 0.683 0.000 -7.433) 7.464 6.041 ( 3.174 0.000 -11.398) 11.832 6.602 ( 1.729 0.000 -2.808) 3.297 6.761 ( -5.078 -0.000 14.366) 15.237 6.783 ( 0.607 0.000 -4.916) 4.953 6.973 ( -1.763 -0.000 9.410) 9.573 7.229 ( 4.667 0.000 2.128) 5.129 7.322 ( -2.764 -0.000 -6.853) 7.389 7.453 ( 2.464 0.000 -0.739) 2.572 7.761 ( 2.529 0.000 5.975) 6.488 7.965 ( 2.679 0.000 -9.757) 10.118 8.196 ( -1.864 -0.000 -13.688) 13.815 8.566 ( 7.347 0.000 -1.258) 7.454 8.648 ( 12.162 0.000 6.160) 13.633 9.023 ( -4.006 -0.000 7.688) 8.670 9.446 ( 4.004 0.000 4.382) 5.935 9.527 ( 1.643 0.000 -2.484) 2.978 9.922 ( 2.270 0.000 -8.123) 8.434 10.127 ( -0.237 -0.000 -6.151) 6.155 10.626 ( -1.566 -0.000 -4.821) 5.068 11.142 ( 3.744 0.000 -0.111) 3.746 11.634 ( 1.262 0.000 1.226) 1.759 12.739 ( 0.435 0.000 15.529) 15.535 13.431 ( 6.723 0.000 -4.040) 7.844 13.543 ( 9.744 0.000 10.715) 14.483 13.788 ( 1.388 0.000 -6.730) 6.872 14.315 ( 0.336 0.000 3.973) 3.988 14.486 ( -2.524 -0.000 -2.581) 3.610 14.595 ( -15.579 -0.000 -11.248) 19.216 14.679 ( 5.321 0.000 1.753) 5.602 20.066 ( -0.181 -0.000 1.052) 1.067 20.285 ( -1.437 -0.000 -5.423) 5.611 21.489 ( 0.237 0.000 7.290) 7.294 22.177 ( 2.406 0.000 11.693) 11.938 22.334 ( -0.453 -0.000 -6.457) 6.473 22.697 ( 4.496 0.000 0.140) 4.498 23.465 ( -6.197 -0.000 -0.405) 6.210 23.555 ( -0.423 -0.000 -8.899) 8.909 24.231 ( -5.882 -0.000 9.043) 10.787 24.817 ( 1.765 0.000 8.503) 8.684 24.977 ( 0.983 0.000 -5.635) 5.720 25.067 ( 0.766 0.000 -3.825) 3.901 ======================= Grid point 196 (101/128) ======================= q-point: ( 0.00 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.982 ( 4.718 0.000 13.481) 14.282 2.114 ( -2.802 -0.000 18.332) 18.545 2.200 ( -2.658 -0.000 -5.856) 6.431 2.436 ( -0.634 -0.000 -11.164) 11.182 2.918 ( -2.498 -0.000 1.727) 3.037 2.940 ( -3.301 -0.000 2.044) 3.882 3.254 ( 2.355 0.000 2.845) 3.693 3.421 ( -0.357 -0.000 -11.975) 11.981 4.102 ( 11.655 0.000 2.817) 11.990 4.115 ( -5.478 -0.000 -0.775) 5.533 4.212 ( -0.404 -0.000 10.569) 10.577 4.277 ( 3.316 0.000 2.522) 4.165 4.653 ( -8.653 -0.000 3.737) 9.426 4.672 ( 8.280 0.000 -0.527) 8.297 4.806 ( 0.428 0.000 14.123) 14.129 5.276 ( -6.879 -0.000 -25.428) 26.342 5.639 ( -6.826 -0.000 9.883) 12.011 5.793 ( 7.963 0.000 -4.009) 8.915 5.809 ( 1.714 0.000 5.180) 5.456 5.875 ( 3.743 0.000 -4.008) 5.484 6.497 ( -0.538 -0.000 1.950) 2.023 6.574 ( -5.008 -0.000 -4.478) 6.718 6.973 ( -6.680 -0.000 8.151) 10.539 7.131 ( 8.313 0.000 -7.515) 11.206 7.193 ( -3.862 -0.000 16.729) 17.169 7.373 ( -1.494 -0.000 1.816) 2.351 7.436 ( -0.020 -0.000 -2.195) 2.195 7.586 ( 1.759 0.000 -18.452) 18.536 7.913 ( -1.249 -0.000 3.481) 3.698 7.991 ( 3.604 0.000 -4.118) 5.473 8.770 ( -8.188 -0.000 2.104) 8.454 8.812 ( 10.189 0.000 -1.635) 10.319 9.276 ( 6.145 0.000 5.028) 7.940 9.354 ( -7.854 -0.000 -2.991) 8.404 9.780 ( -0.468 -0.000 3.447) 3.479 9.836 ( 3.794 0.000 -3.675) 5.282 10.027 ( 5.068 0.000 5.277) 7.317 10.209 ( -8.325 -0.000 -10.598) 13.477 11.424 ( 8.526 0.000 2.816) 8.978 11.465 ( -9.603 -0.000 -1.105) 9.666 13.179 ( 0.591 0.000 14.925) 14.936 13.449 ( 1.584 0.000 -10.818) 10.933 13.735 ( 11.630 0.000 -1.565) 11.735 13.736 ( -16.731 -0.000 -1.443) 16.793 14.145 ( 7.408 0.000 2.618) 7.857 14.184 ( -8.283 -0.000 -1.092) 8.355 14.611 ( 6.047 0.000 2.162) 6.422 14.665 ( -3.738 -0.000 -2.998) 4.791 20.102 ( -0.683 -0.000 2.781) 2.863 20.180 ( 2.179 0.000 -4.801) 5.273 21.808 ( 4.746 0.000 9.564) 10.677 21.979 ( -6.781 -0.000 -6.675) 9.515 22.630 ( 6.774 0.000 3.979) 7.856 22.694 ( -4.531 -0.000 -2.221) 5.046 23.318 ( -2.016 -0.000 -0.001) 2.016 23.336 ( 0.309 0.000 -1.823) 1.849 24.564 ( 2.919 0.000 10.630) 11.023 24.781 ( 0.069 0.000 -10.080) 10.080 24.893 ( -5.550 -0.000 5.287) 7.665 24.988 ( 2.409 0.000 -3.994) 4.664 ======================= Grid point 197 (102/128) ======================= q-point: ( 0.14 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.052 ( -2.002 1.868 -1.158) 2.974 2.223 ( 11.895 -2.338 3.991) 12.763 2.305 ( 2.630 -11.304 14.425) 18.515 2.492 ( 3.344 -10.756 -5.518) 12.542 2.910 ( -1.244 0.078 5.109) 5.259 2.943 ( 0.593 -1.854 3.583) 4.077 3.328 ( 8.041 2.020 0.887) 8.338 3.467 ( 6.809 -5.766 -9.133) 12.768 3.999 ( -6.069 1.967 -1.227) 6.497 4.200 ( 3.610 3.423 -2.506) 5.570 4.260 ( -0.880 -0.977 0.651) 1.467 4.353 ( 6.321 -2.573 -1.290) 6.945 4.537 ( -8.933 -1.185 3.332) 9.608 4.802 ( 8.205 -0.712 -1.285) 8.335 4.988 ( 5.890 -7.923 25.445) 27.293 5.136 ( -6.422 -6.741 -22.198) 24.071 5.582 ( -6.400 0.032 4.802) 8.001 5.778 ( -2.497 1.575 3.086) 4.271 5.840 ( -2.202 -0.069 -1.385) 2.602 5.934 ( 7.807 -0.387 -9.543) 12.335 6.462 ( -1.823 3.555 2.531) 4.730 6.501 ( -0.908 2.626 1.646) 3.230 6.894 ( -6.556 1.520 7.376) 9.984 7.165 ( 0.893 5.913 6.428) 8.779 7.239 ( 5.209 -0.286 2.031) 5.598 7.310 ( -5.668 8.163 2.276) 10.195 7.384 ( -0.606 -1.173 -0.867) 1.580 7.564 ( 2.656 -1.170 -13.990) 14.288 7.938 ( -1.324 -3.648 0.808) 3.964 8.054 ( 5.432 -2.595 -4.641) 7.601 8.669 ( -8.749 -1.857 1.526) 9.073 8.944 ( 4.945 -2.564 -4.175) 6.961 9.122 ( -6.038 11.392 -0.055) 12.894 9.284 ( 3.299 9.653 2.346) 10.467 9.777 ( -3.542 -2.422 1.591) 4.577 9.865 ( -3.250 -0.740 -5.150) 6.135 10.087 ( -3.055 -1.865 -6.101) 7.073 10.152 ( 6.355 -1.192 7.901) 10.209 11.299 ( -10.776 2.265 1.040) 11.060 11.528 ( 6.349 1.516 0.955) 6.597 13.235 ( 2.185 1.830 13.382) 13.682 13.387 ( -3.463 3.114 -9.804) 10.854 13.520 ( -13.489 -3.414 -0.123) 13.915 13.846 ( 2.723 1.076 0.439) 2.961 14.136 ( 1.477 -2.200 0.127) 2.653 14.271 ( 8.109 0.566 3.545) 8.869 14.603 ( -3.698 -1.411 -5.264) 6.586 14.685 ( 3.506 0.028 0.824) 3.602 20.108 ( 0.114 0.126 2.598) 2.604 20.197 ( 3.101 0.036 -5.845) 6.616 21.866 ( -4.201 0.581 -3.047) 5.222 21.903 ( 2.101 0.177 7.088) 7.395 22.580 ( -5.735 2.702 -4.239) 7.627 22.683 ( 2.052 1.631 2.500) 3.622 23.250 ( -2.391 3.208 7.006) 8.068 23.452 ( 4.940 -7.268 -5.214) 10.219 24.618 ( 2.047 2.904 7.490) 8.290 24.752 ( 2.269 -0.293 -10.837) 11.076 24.848 ( -6.637 -1.599 6.635) 9.520 25.025 ( 2.181 -2.630 -2.058) 3.989 ======================= Grid point 198 (103/128) ======================= q-point: ( 0.29 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.945 ( -2.886 4.062 -5.847) 7.682 2.435 ( 4.230 -8.585 5.311) 10.946 2.612 ( 7.832 -9.293 10.575) 16.110 2.760 ( 7.491 -11.825 -1.887) 14.125 2.892 ( -0.875 2.673 5.215) 5.925 3.084 ( 7.409 -7.796 9.177) 14.138 3.410 ( 11.059 4.270 1.052) 11.902 3.672 ( 9.133 -7.055 -5.069) 12.605 3.891 ( -8.468 -2.732 -3.704) 9.638 4.087 ( -3.969 6.816 -7.179) 10.666 4.257 ( -0.842 -1.372 -0.724) 1.765 4.448 ( 4.699 1.153 -2.101) 5.275 4.514 ( -0.570 -3.860 1.444) 4.161 4.809 ( 2.397 6.235 -11.120) 12.972 5.191 ( -0.768 -12.269 -6.664) 13.983 5.304 ( -1.945 -8.950 16.004) 18.439 5.478 ( -2.070 -0.159 5.008) 5.421 5.729 ( -4.821 2.740 -0.841) 5.609 5.816 ( -2.303 -5.955 2.051) 6.707 6.024 ( 7.334 -3.006 -7.924) 11.208 6.403 ( -4.551 7.575 5.966) 10.662 6.432 ( 0.777 0.484 0.022) 0.916 6.844 ( -0.624 2.537 11.390) 11.686 7.059 ( -6.227 12.415 3.871) 14.419 7.065 ( 0.482 10.115 -0.933) 10.169 7.286 ( 0.884 1.995 4.127) 4.669 7.407 ( -1.804 -3.129 -1.491) 3.907 7.582 ( 2.681 -1.858 -9.530) 10.073 7.980 ( 0.329 -3.852 -0.880) 3.965 8.203 ( 7.449 -7.385 -3.316) 11.002 8.596 ( -7.483 0.142 1.452) 7.624 8.766 ( -8.863 7.348 -3.429) 12.013 9.098 ( 3.965 11.275 -1.053) 11.998 9.173 ( 4.249 -0.271 -1.067) 4.390 9.685 ( -9.926 3.608 -4.341) 11.419 9.792 ( -2.284 -1.034 0.175) 2.513 10.131 ( 1.236 -3.703 0.204) 3.909 10.276 ( 4.983 -1.231 6.720) 8.456 11.135 ( -9.094 1.237 1.461) 9.294 11.557 ( 3.803 3.635 -1.255) 5.408 13.228 ( -8.998 1.895 1.446) 9.308 13.289 ( 3.272 1.770 10.934) 11.550 13.458 ( -3.534 -3.290 -6.316) 7.950 13.796 ( -3.314 2.223 -2.527) 4.724 14.251 ( 7.313 -1.257 3.288) 8.116 14.363 ( 3.182 -0.766 4.725) 5.748 14.578 ( -0.792 -1.891 -6.144) 6.477 14.707 ( 0.756 0.505 -1.738) 1.961 20.117 ( 0.378 0.427 2.667) 2.727 20.216 ( 2.803 0.049 -6.311) 6.906 21.801 ( -2.645 -0.378 -3.536) 4.432 21.918 ( -1.708 2.471 7.095) 7.704 22.474 ( -1.409 1.953 -4.442) 5.053 22.682 ( -0.200 0.655 1.555) 1.699 23.226 ( -2.166 0.360 12.362) 12.556 23.590 ( 4.810 -4.421 -8.050) 10.368 24.590 ( -1.541 3.825 6.144) 7.399 24.756 ( 0.525 -1.526 -10.709) 10.829 24.817 ( -1.946 -0.265 5.245) 5.601 25.106 ( 2.498 -3.701 0.168) 4.468 ======================= Grid point 199 (104/128) ======================= q-point: (-0.57 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.837 ( -2.219 3.428 -1.510) 4.354 2.599 ( -1.622 -7.920 4.603) 9.303 2.829 ( -0.250 3.280 8.988) 9.571 2.839 ( 5.490 2.272 5.128) 7.849 2.954 ( 2.556 -6.074 -0.255) 6.595 3.363 ( 7.548 -7.691 6.901) 12.796 3.533 ( 8.862 1.244 3.500) 9.609 3.770 ( 2.255 -0.612 -1.673) 2.874 3.855 ( -7.524 -1.770 -7.260) 10.605 3.925 ( 0.681 1.692 -6.652) 6.897 4.302 ( 0.886 -5.219 -4.094) 6.692 4.434 ( 1.482 6.464 2.944) 7.255 4.583 ( -2.120 -4.880 -2.360) 5.821 4.670 ( -0.238 6.552 -10.515) 12.392 5.180 ( -8.449 1.778 3.843) 9.451 5.321 ( 0.447 -3.848 -2.038) 4.377 5.603 ( -3.301 4.494 -1.758) 5.846 5.705 ( 4.568 -8.571 11.373) 14.955 5.899 ( -3.199 -4.779 4.114) 7.072 6.176 ( 4.901 -4.848 -6.668) 9.591 6.218 ( -4.524 4.017 3.757) 7.122 6.489 ( 1.777 -4.489 1.921) 5.196 6.757 ( -1.287 9.902 4.452) 10.932 6.906 ( -0.137 10.203 -3.244) 10.707 6.974 ( 2.449 -2.642 12.332) 12.848 7.256 ( -3.033 1.211 4.426) 5.500 7.395 ( -1.546 -0.625 -6.937) 7.134 7.608 ( 1.753 -0.689 -5.755) 6.055 8.081 ( 3.500 -6.081 -0.007) 7.016 8.377 ( -7.812 7.006 -1.792) 10.645 8.439 ( 7.768 -7.158 -0.857) 10.598 8.691 ( -2.184 -4.789 -1.622) 5.508 8.851 ( -2.078 17.060 -0.992) 17.215 9.318 ( 5.516 -5.388 -2.173) 8.011 9.467 ( -8.727 5.976 -0.870) 10.613 9.791 ( 0.063 -0.928 -0.468) 1.041 10.190 ( 0.198 -2.067 1.252) 2.424 10.374 ( 2.725 -2.141 3.542) 4.955 11.039 ( -4.458 -0.911 0.007) 4.550 11.533 ( 1.893 3.246 -1.694) 4.122 13.112 ( -6.990 1.035 6.775) 9.790 13.356 ( 5.649 2.499 8.474) 10.486 13.456 ( -1.148 -4.038 -7.147) 8.289 13.706 ( -2.475 2.337 -3.757) 5.069 14.357 ( 6.675 1.837 3.485) 7.751 14.423 ( -3.538 -5.294 2.811) 6.960 14.578 ( 1.985 0.891 -2.405) 3.243 14.686 ( -0.793 0.479 -4.905) 4.992 20.123 ( -0.016 0.575 2.905) 2.961 20.223 ( 1.572 0.051 -5.974) 6.178 21.763 ( -2.052 2.002 2.042) 3.520 21.879 ( -1.105 -0.729 0.316) 1.361 22.435 ( -0.674 1.039 -1.257) 1.765 22.680 ( 0.303 -0.035 0.189) 0.359 23.269 ( -1.255 -2.254 14.094) 14.328 23.645 ( 2.963 -0.527 -11.040) 11.443 24.527 ( -4.099 2.543 8.855) 10.083 24.728 ( -2.494 -1.110 -3.616) 4.531 24.845 ( 4.098 -0.384 -4.467) 6.074 25.181 ( 1.649 -1.544 0.611) 2.340 ======================= Grid point 200 (105/128) ======================= q-point: (-0.43 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.778 ( -1.823 1.390 4.480) 5.032 2.664 ( -1.901 -1.487 1.578) 2.883 2.698 ( -6.693 7.155 10.417) 14.300 2.843 ( 0.450 9.280 9.349) 13.181 3.007 ( -2.806 -1.719 -4.009) 5.187 3.530 ( 2.437 4.049 -4.395) 6.454 3.586 ( 0.336 -0.050 0.373) 0.504 3.722 ( 4.946 1.380 -0.876) 5.209 3.823 ( -1.664 0.194 1.470) 2.229 3.891 ( -7.309 -2.930 -8.905) 11.888 4.224 ( -3.633 8.652 1.972) 9.589 4.422 ( 0.863 -0.028 4.930) 5.005 4.564 ( -6.657 -3.711 -3.922) 8.572 4.613 ( 1.800 -0.557 -3.154) 3.673 5.179 ( 4.334 -2.375 5.874) 7.676 5.303 ( -2.167 6.114 1.669) 6.698 5.509 ( 0.207 1.883 1.903) 2.685 5.837 ( 0.569 3.307 10.892) 11.397 5.872 ( -3.110 -0.752 -2.258) 3.916 6.053 ( -4.517 5.781 -0.082) 7.336 6.382 ( 7.439 -7.253 -9.970) 14.400 6.553 ( 1.877 1.005 0.231) 2.141 6.758 ( -3.407 -3.558 4.713) 6.817 6.818 ( 0.595 -9.968 0.144) 9.986 7.140 ( 5.608 -3.432 12.981) 14.551 7.204 ( -2.937 0.512 -3.852) 4.871 7.364 ( -0.169 -0.897 -4.894) 4.978 7.595 ( 0.241 1.646 -4.048) 4.376 8.116 ( -4.106 3.668 -4.553) 7.145 8.316 ( 4.200 -3.757 3.843) 6.821 8.495 ( -0.946 7.762 -5.070) 9.319 8.656 ( 4.441 6.073 1.668) 7.706 8.841 ( 2.838 -14.518 0.042) 14.793 9.267 ( -7.324 5.604 2.470) 9.547 9.452 ( 5.177 -2.956 0.542) 5.986 9.821 ( 2.293 -1.385 -3.278) 4.233 10.201 ( -0.868 0.508 0.109) 1.012 10.431 ( -0.882 -2.987 -1.671) 3.534 11.046 ( 1.958 -2.290 -0.581) 3.069 11.519 ( 0.453 -0.128 -0.389) 0.610 13.054 ( -4.287 0.587 10.682) 11.525 13.416 ( 7.993 5.356 2.257) 9.883 13.494 ( -0.607 -5.679 -6.524) 8.671 13.655 ( 1.008 0.820 -0.985) 1.631 14.400 ( -0.739 0.341 0.099) 0.820 14.427 ( -3.494 -2.223 2.099) 4.642 14.588 ( -1.121 0.019 -2.445) 2.690 14.649 ( 2.287 1.560 -2.772) 3.918 20.121 ( -0.705 0.429 3.165) 3.270 20.213 ( 0.181 0.069 -5.098) 5.102 21.702 ( -1.682 3.428 5.730) 6.885 21.940 ( 3.671 -5.024 -3.280) 7.034 22.397 ( -3.397 0.549 2.191) 4.079 22.692 ( 1.434 -0.097 -0.899) 1.695 23.342 ( -1.342 -2.679 12.012) 12.380 23.610 ( 1.071 2.477 -13.283) 13.555 24.478 ( -5.062 0.776 12.836) 13.820 24.713 ( -0.461 -1.607 -3.366) 3.758 24.893 ( 5.108 -0.197 -6.683) 8.414 25.190 ( -0.289 1.911 -0.206) 1.943 ======================= Grid point 201 (106/128) ======================= q-point: (-0.29 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.784 ( -1.380 -1.683 10.317) 10.544 2.487 ( -8.595 8.101 4.758) 12.734 2.621 ( -4.632 8.745 7.212) 12.245 2.677 ( -4.643 9.780 3.906) 11.509 2.944 ( -3.655 -0.391 -2.547) 4.471 3.276 ( -5.335 13.287 -9.398) 17.127 3.516 ( -12.952 1.090 -0.610) 13.012 3.697 ( -3.658 6.068 -4.515) 8.402 3.815 ( 3.370 -1.240 -2.665) 4.472 3.926 ( 4.736 -5.364 6.904) 9.944 4.156 ( 2.289 2.667 6.618) 7.493 4.418 ( -2.718 2.204 3.538) 4.977 4.524 ( -0.960 -1.721 -1.231) 2.323 4.650 ( -0.856 -2.549 1.921) 3.305 5.100 ( -6.010 11.268 5.130) 13.763 5.367 ( 10.386 -3.649 5.224) 12.185 5.587 ( 4.860 -3.343 2.160) 6.282 5.796 ( -1.581 1.654 4.523) 5.068 5.797 ( -1.178 7.768 -7.860) 11.113 5.881 ( -4.168 6.176 -0.013) 7.451 6.486 ( 1.504 -0.916 -4.965) 5.268 6.558 ( 0.096 -5.197 -7.016) 8.731 6.858 ( -3.141 -10.837 9.998) 15.075 7.055 ( 0.847 -12.902 2.955) 13.263 7.147 ( 0.369 1.095 -8.632) 8.709 7.265 ( 2.970 0.107 8.084) 8.613 7.385 ( -1.827 -3.912 -0.234) 4.324 7.572 ( 3.137 0.165 -6.905) 7.586 7.999 ( -1.943 3.138 -4.201) 5.592 8.185 ( -3.740 11.158 -1.763) 11.900 8.618 ( 9.058 -2.302 -0.024) 9.346 8.692 ( 8.951 -1.873 3.266) 9.710 9.037 ( -5.714 -4.807 4.234) 8.584 9.185 ( -0.881 -9.186 -1.734) 9.390 9.573 ( 6.714 -1.321 5.262) 8.632 9.849 ( 3.220 1.286 -4.638) 5.791 10.148 ( -1.961 3.651 -1.509) 4.410 10.422 ( -4.385 -2.709 -6.772) 8.510 11.144 ( 6.763 -2.136 0.652) 7.122 11.544 ( -1.643 -3.830 -0.161) 4.171 13.056 ( -2.223 -0.745 13.622) 13.823 13.433 ( 6.495 4.956 -2.248) 8.473 13.546 ( 2.356 -3.784 -9.992) 10.941 13.715 ( 6.146 -0.598 4.404) 7.585 14.315 ( -12.414 -3.448 -2.906) 13.207 14.449 ( 2.992 2.694 5.580) 6.881 14.491 ( -4.339 2.457 -7.461) 8.974 14.691 ( 2.723 -0.404 0.306) 2.770 20.115 ( -1.256 0.214 3.270) 3.510 20.192 ( -0.358 0.067 -4.224) 4.239 21.678 ( 0.978 2.116 7.176) 7.545 22.071 ( 3.782 -5.853 -6.576) 9.581 22.360 ( -2.138 -0.474 6.476) 6.836 22.711 ( 1.147 -0.394 -1.140) 1.664 23.379 ( -3.448 -1.090 8.211) 8.972 23.519 ( 0.240 3.955 -12.806) 13.405 24.462 ( -3.789 -0.187 14.524) 15.012 24.740 ( 1.142 -3.020 -4.489) 5.530 24.937 ( 4.689 0.391 -6.127) 7.725 25.117 ( -2.403 4.728 -0.838) 5.369 ======================= Grid point 202 (107/128) ======================= q-point: (-0.14 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.866 ( -0.277 -4.379 13.821) 14.501 2.247 ( -8.239 13.237 14.540) 21.320 2.350 ( -9.314 6.787 -1.629) 11.639 2.532 ( -0.418 6.428 -7.060) 9.557 2.929 ( -2.298 -2.380 0.543) 3.353 3.041 ( -3.578 6.213 -5.155) 8.830 3.306 ( -9.966 3.216 6.089) 12.113 3.531 ( -5.504 1.477 -14.419) 15.505 3.936 ( 10.853 1.315 5.510) 12.243 4.062 ( -0.599 -5.940 8.561) 10.437 4.203 ( 3.705 0.513 5.589) 6.725 4.313 ( -4.048 6.189 3.702) 8.270 4.579 ( 6.271 0.072 -1.117) 6.370 4.679 ( -1.934 -1.675 6.761) 7.229 4.888 ( -6.369 6.920 3.779) 10.135 5.480 ( -1.563 4.155 -17.699) 18.248 5.648 ( 4.978 -1.682 -1.484) 5.460 5.689 ( -3.561 -1.351 11.056) 11.693 5.772 ( 3.277 3.548 3.884) 6.198 5.837 ( 3.050 0.034 -2.568) 3.987 6.490 ( -0.317 -1.659 -3.268) 3.679 6.610 ( -3.046 -5.269 -4.808) 7.756 6.980 ( -3.096 -5.416 8.487) 10.533 7.100 ( 1.772 2.240 -7.251) 7.793 7.179 ( -3.951 -2.759 12.714) 13.597 7.342 ( 3.841 -2.242 0.015) 4.448 7.411 ( -2.237 -3.584 0.590) 4.265 7.605 ( 3.173 -2.180 -15.689) 16.154 7.941 ( -0.238 2.437 1.213) 2.732 8.014 ( -0.452 5.730 -2.644) 6.327 8.698 ( 10.073 3.151 -1.209) 10.623 8.851 ( -0.882 1.354 4.428) 4.714 9.083 ( 2.863 -10.482 3.880) 11.538 9.345 ( -3.324 -11.717 -3.362) 12.635 9.712 ( 6.977 -0.239 8.524) 11.017 9.836 ( 3.542 3.873 -4.086) 6.651 10.042 ( -1.649 4.894 -1.566) 5.397 10.344 ( -6.906 -1.434 -9.764) 12.045 11.283 ( 8.546 -1.271 2.392) 8.965 11.554 ( -5.483 -3.200 -1.431) 6.508 13.110 ( -0.782 -1.549 15.380) 15.477 13.446 ( 3.632 0.668 -6.183) 7.202 13.610 ( 8.484 0.097 -7.834) 11.548 13.828 ( 3.808 -0.976 2.409) 4.610 14.159 ( -11.141 -0.629 -2.423) 11.419 14.326 ( -9.517 1.481 -1.273) 9.716 14.519 ( 7.167 1.572 2.036) 7.614 14.707 ( -0.984 -0.188 -1.228) 1.585 20.106 ( -1.322 0.085 3.106) 3.377 20.177 ( 0.588 0.005 -4.039) 4.082 21.718 ( 3.528 0.636 8.480) 9.206 22.086 ( -5.148 -1.513 -7.876) 9.530 22.466 ( 7.767 -3.694 6.777) 10.950 22.722 ( -0.747 -1.037 -1.294) 1.819 23.343 ( -5.867 -0.424 4.689) 7.522 23.418 ( 0.632 4.702 -9.093) 10.256 24.492 ( -0.330 -0.674 13.274) 13.295 24.784 ( 0.662 -3.123 -6.655) 7.381 24.958 ( 1.675 1.547 -2.458) 3.353 25.000 ( -2.221 3.940 -1.559) 4.784 ======================= Grid point 204 (108/128) ======================= q-point: ( 0.14 0.14 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.148 ( 5.287 0.000 5.964) 7.970 2.347 ( 9.725 0.000 -0.231) 9.728 2.378 ( 10.620 0.000 0.842) 10.653 2.447 ( 10.801 0.000 2.850) 11.170 2.933 ( 1.347 0.000 4.564) 4.759 2.974 ( 4.199 0.000 1.056) 4.330 3.493 ( 6.987 0.000 -2.339) 7.368 3.511 ( 13.262 0.000 2.831) 13.560 3.920 ( -5.255 -0.000 -8.223) 9.759 4.195 ( -5.714 -0.000 -0.473) 5.733 4.273 ( -1.348 -0.000 -2.683) 3.002 4.380 ( 5.950 0.000 -4.254) 7.314 4.495 ( 3.599 0.000 3.032) 4.706 4.882 ( 6.001 0.000 -0.963) 6.078 4.936 ( -4.731 -0.000 -17.984) 18.596 5.108 ( 4.823 0.000 24.966) 25.427 5.503 ( -7.095 -0.000 2.458) 7.509 5.722 ( -7.293 -0.000 2.956) 7.869 5.780 ( -3.994 -0.000 -3.501) 5.311 6.004 ( 6.902 0.000 -10.258) 12.364 6.450 ( -1.887 -0.000 -1.039) 2.154 6.552 ( -1.188 -0.000 7.790) 7.880 6.844 ( -4.584 -0.000 9.362) 10.424 7.251 ( -2.757 -0.000 19.766) 19.957 7.274 ( -5.758 -0.000 0.729) 5.804 7.344 ( 9.516 0.000 -5.763) 11.125 7.375 ( -3.082 -0.000 -1.201) 3.307 7.543 ( 4.367 0.000 -15.110) 15.729 7.888 ( -2.337 -0.000 2.542) 3.453 8.091 ( 6.277 0.000 -7.906) 10.095 8.552 ( -6.004 -0.000 -0.001) 6.004 8.896 ( -6.601 -0.000 -6.472) 9.245 9.182 ( 1.586 0.000 0.686) 1.728 9.355 ( -4.544 -0.000 6.127) 7.628 9.732 ( -1.015 -0.000 -0.121) 1.022 9.737 ( -9.388 -0.000 -8.478) 12.650 10.044 ( 2.103 0.000 -3.874) 4.408 10.257 ( 4.231 0.000 10.219) 11.060 11.171 ( -10.410 -0.000 2.414) 10.686 11.614 ( 3.400 0.000 1.102) 3.574 13.201 ( -14.937 -0.000 5.298) 15.849 13.375 ( -0.892 -0.000 -13.770) 13.799 13.385 ( 1.967 0.000 13.024) 13.172 13.838 ( -2.427 -0.000 -3.630) 4.367 14.225 ( 9.690 0.000 5.942) 11.366 14.348 ( -1.573 -0.000 3.302) 3.658 14.552 ( 3.569 0.000 -6.983) 7.842 14.720 ( 0.978 0.000 -0.151) 0.990 20.125 ( 0.707 0.000 2.621) 2.715 20.217 ( 3.034 0.000 -6.860) 7.501 21.787 ( -3.225 -0.000 -5.865) 6.694 21.972 ( -0.167 -0.000 10.656) 10.658 22.511 ( -3.940 -0.000 -4.803) 6.212 22.659 ( -5.705 -0.000 2.348) 6.169 23.325 ( 1.452 0.000 1.717) 2.249 23.451 ( 7.174 0.000 1.516) 7.332 24.656 ( -5.246 -0.000 8.251) 9.778 24.729 ( 2.417 0.000 -11.819) 12.064 24.843 ( 2.669 0.000 6.621) 7.139 25.007 ( 0.441 0.000 -2.367) 2.408 ======================= Grid point 205 (109/128) ======================= q-point: ( 0.29 0.14 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.160 ( 11.293 13.243 1.387) 17.460 2.405 ( 3.701 -1.237 3.299) 5.110 2.683 ( 13.119 -5.867 1.928) 14.500 2.724 ( 13.478 -10.288 -1.348) 17.009 2.960 ( 2.243 1.874 1.216) 3.165 3.100 ( 7.358 -7.568 3.041) 10.985 3.601 ( -0.826 -5.544 -0.832) 5.667 3.664 ( 9.358 3.810 4.422) 11.029 3.831 ( 2.286 2.598 -3.185) 4.703 4.106 ( -2.501 1.892 -2.433) 3.969 4.201 ( -0.192 3.321 -7.221) 7.950 4.455 ( 2.866 -0.587 -2.159) 3.636 4.600 ( 8.717 0.761 1.315) 8.849 4.826 ( -2.337 1.811 -13.671) 13.987 5.016 ( 2.942 -10.614 -1.116) 11.070 5.197 ( -8.733 -2.430 7.515) 11.775 5.477 ( 1.703 -3.194 12.829) 13.330 5.676 ( -5.613 -3.740 0.608) 6.772 5.709 ( -1.890 0.750 -0.540) 2.104 6.044 ( 3.430 -1.303 -7.707) 8.536 6.434 ( 0.212 -0.264 -2.394) 2.418 6.456 ( -8.849 6.456 7.030) 13.016 6.887 ( 1.443 -1.474 14.833) 14.976 7.129 ( -6.200 7.505 0.832) 9.770 7.240 ( -3.150 7.412 14.196) 16.322 7.300 ( -3.855 0.319 -0.332) 3.882 7.412 ( 6.770 4.053 -7.633) 10.978 7.568 ( 4.271 -1.288 -9.826) 10.791 7.912 ( -1.071 -5.475 2.599) 6.155 8.175 ( 5.972 -4.694 -9.076) 11.835 8.515 ( -1.929 -1.533 -0.205) 2.472 8.718 ( -9.293 4.523 -5.760) 11.832 9.196 ( 1.837 0.880 1.608) 2.595 9.262 ( -3.935 6.131 1.566) 7.451 9.562 ( -9.213 0.677 -5.694) 10.852 9.745 ( -0.209 -2.145 -0.249) 2.169 10.088 ( 0.935 -2.872 -1.139) 3.228 10.328 ( 0.034 -0.612 8.766) 8.788 11.053 ( -6.558 1.055 4.284) 7.904 11.624 ( 0.414 1.939 -1.462) 2.464 13.043 ( -13.286 -3.049 7.235) 15.432 13.315 ( -2.812 -2.465 -12.074) 12.640 13.474 ( 5.820 2.421 10.975) 12.656 13.788 ( 0.013 1.831 -6.255) 6.517 14.289 ( -8.109 -2.632 1.202) 8.610 14.384 ( 8.375 0.142 7.743) 11.406 14.618 ( 7.535 1.186 -4.091) 8.656 14.707 ( -1.120 0.476 -2.747) 3.004 20.140 ( 0.314 0.419 2.715) 2.765 20.226 ( 2.092 0.111 -7.072) 7.375 21.748 ( -0.348 -1.001 -5.138) 5.246 21.951 ( -4.417 2.863 8.578) 10.065 22.460 ( -1.075 0.532 -3.367) 3.574 22.598 ( -7.055 -3.353 2.497) 8.200 23.324 ( 3.236 4.126 6.236) 8.147 23.587 ( 6.134 -3.021 -1.974) 7.116 24.588 ( -7.756 0.807 11.213) 13.658 24.726 ( 2.953 0.309 -10.570) 10.979 24.875 ( 3.687 3.507 0.513) 5.114 25.061 ( 1.488 -5.557 -0.828) 5.812 ======================= Grid point 206 (110/128) ======================= q-point: ( 0.43 0.14 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.110 ( 15.557 17.785 -0.648) 23.638 2.502 ( -0.178 -5.433 7.549) 9.302 2.898 ( 5.704 -4.442 -6.545) 9.752 2.923 ( -1.021 4.747 -0.870) 4.932 2.984 ( 10.936 -2.142 5.488) 12.422 3.389 ( 9.536 -8.470 4.888) 13.659 3.552 ( -9.958 -4.419 -6.654) 12.766 3.699 ( 3.404 3.405 6.052) 7.733 3.923 ( 7.657 0.626 4.441) 8.874 4.031 ( 4.448 10.897 -9.575) 15.173 4.174 ( -0.683 -6.195 -4.545) 7.714 4.463 ( -2.098 -1.402 -3.891) 4.637 4.613 ( -3.172 8.093 -0.613) 8.714 4.705 ( 1.942 4.976 -2.172) 5.766 5.124 ( -2.937 -1.647 5.726) 6.643 5.241 ( 3.995 -10.426 -3.073) 11.581 5.612 ( 0.716 0.871 -6.780) 6.873 5.672 ( 0.807 -7.767 12.730) 14.934 5.775 ( -0.364 -7.064 4.976) 8.648 6.125 ( 2.547 -8.024 -5.250) 9.921 6.225 ( -10.069 8.609 8.996) 16.014 6.440 ( -0.143 -2.021 -3.518) 4.059 6.857 ( -7.895 7.239 3.772) 11.356 7.036 ( 2.342 9.707 11.969) 15.587 7.088 ( -0.641 3.739 -0.406) 3.815 7.240 ( -3.777 0.976 7.235) 8.220 7.384 ( 2.912 3.371 -8.699) 9.773 7.610 ( 3.144 -0.525 -6.354) 7.109 8.026 ( 1.475 -7.130 2.429) 7.676 8.335 ( 3.984 -8.849 -6.301) 11.570 8.417 ( -5.009 5.608 -1.135) 7.605 8.620 ( 0.412 -2.452 -4.538) 5.174 9.016 ( -6.183 11.783 -0.327) 13.311 9.302 ( 4.643 -4.009 -0.063) 6.134 9.429 ( -5.464 2.301 -1.580) 6.135 9.784 ( 1.603 -1.499 -0.232) 2.207 10.127 ( -2.676 -3.741 1.619) 4.876 10.338 ( -4.782 -2.161 4.342) 6.811 11.011 ( -0.251 0.086 4.560) 4.567 11.570 ( -1.241 2.454 -3.909) 4.780 12.980 ( -9.514 -4.845 9.530) 14.312 13.296 ( -2.660 -5.859 -10.923) 12.677 13.555 ( 7.668 3.687 8.536) 12.052 13.736 ( 1.635 3.283 -6.478) 7.444 14.236 ( -9.326 -5.544 0.772) 10.877 14.495 ( 5.528 1.848 7.924) 9.837 14.626 ( -1.294 1.933 -3.408) 4.127 14.704 ( 5.371 1.618 -4.769) 7.363 20.140 ( -0.609 0.683 2.719) 2.869 20.219 ( 0.900 0.262 -6.332) 6.401 21.765 ( 1.744 -0.971 -2.652) 3.319 21.872 ( -3.174 2.063 5.138) 6.381 22.413 ( -3.920 0.609 0.733) 4.034 22.596 ( -4.323 -5.488 -0.065) 6.986 23.351 ( 3.813 3.060 9.833) 10.981 23.664 ( 4.396 0.395 -6.758) 8.071 24.515 ( -7.252 1.074 13.946) 15.756 24.713 ( 2.278 1.491 -7.831) 8.291 24.888 ( 4.364 0.638 -4.161) 6.064 25.153 ( 0.775 -4.001 -0.902) 4.174 ======================= Grid point 207 (111/128) ======================= q-point: (-0.43 0.14 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.057 ( 15.504 17.846 2.222) 23.744 2.607 ( -0.314 -4.360 7.070) 8.312 2.775 ( -5.637 9.152 7.181) 12.927 2.944 ( 0.050 1.411 -2.261) 2.666 3.034 ( -0.142 6.031 -2.933) 6.708 3.508 ( -2.322 -1.286 -4.686) 5.385 3.623 ( 8.986 -3.385 -0.599) 9.621 3.707 ( -3.865 -2.511 -0.156) 4.611 3.772 ( -7.197 11.835 -10.859) 17.601 4.014 ( 9.440 3.947 4.445) 11.155 4.225 ( -4.174 0.533 1.177) 4.370 4.404 ( -4.986 -0.386 -4.805) 6.935 4.480 ( -0.427 -0.985 4.091) 4.230 4.668 ( 2.503 5.813 2.661) 6.865 5.232 ( 5.936 -4.623 8.501) 11.352 5.361 ( 3.277 0.474 -0.235) 3.319 5.573 ( 0.609 4.049 1.815) 4.478 5.795 ( -0.966 -4.001 2.637) 4.888 5.880 ( -1.829 -2.174 8.062) 8.547 6.068 ( -2.366 2.452 -0.070) 3.408 6.297 ( 2.936 -10.909 -6.171) 12.873 6.488 ( -1.776 -7.314 -0.501) 7.543 6.693 ( -5.005 2.483 1.879) 5.895 6.795 ( -3.627 9.822 -4.655) 11.459 7.131 ( -3.515 -1.394 8.465) 9.271 7.273 ( 3.776 -0.444 8.523) 9.333 7.347 ( 3.546 2.040 -9.395) 10.247 7.613 ( 1.308 1.218 -4.421) 4.768 8.101 ( -2.289 1.156 0.077) 2.566 8.326 ( 3.485 -3.296 3.819) 6.131 8.486 ( -3.962 -0.984 -8.734) 9.641 8.652 ( -0.664 -10.398 -3.750) 11.073 8.843 ( 5.581 7.768 0.867) 9.604 9.266 ( -6.824 5.428 2.188) 8.990 9.478 ( 7.045 -4.514 1.635) 8.526 9.829 ( 3.155 -1.008 -2.244) 4.001 10.144 ( -4.248 -3.936 2.002) 6.127 10.307 ( -7.024 -4.035 -0.941) 8.155 11.074 ( 4.865 -1.791 3.568) 6.294 11.503 ( -2.333 0.918 -4.021) 4.738 12.984 ( -6.318 -4.575 12.054) 14.358 13.330 ( -1.525 -7.317 -10.420) 12.824 13.627 ( 7.995 4.676 1.691) 9.415 13.717 ( 4.386 1.117 -1.491) 4.765 14.186 ( -10.588 -4.880 2.071) 11.841 14.518 ( -2.854 1.867 0.593) 3.462 14.574 ( 2.851 2.704 -0.533) 3.966 14.728 ( 4.615 2.660 -3.116) 6.171 20.127 ( -1.268 0.559 2.779) 3.105 20.199 ( 0.219 0.399 -5.223) 5.243 21.758 ( -0.292 2.816 5.260) 5.973 21.904 ( 3.184 -4.409 -2.772) 6.104 22.355 ( -4.419 -0.023 4.060) 6.001 22.620 ( -3.707 -5.358 -2.371) 6.934 23.391 ( 1.449 2.437 11.438) 11.784 23.651 ( 3.718 3.814 -11.509) 12.681 24.469 ( -5.628 0.550 16.302) 17.255 24.700 ( 2.452 0.528 -6.858) 7.302 24.937 ( 5.054 -0.383 -5.255) 7.301 25.179 ( -1.752 -0.770 -1.800) 2.627 ======================= Grid point 208 (112/128) ======================= q-point: (-0.29 0.14 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.032 ( 14.219 14.731 7.233) 21.714 2.512 ( -8.016 8.629 -0.579) 11.792 2.712 ( 1.489 3.422 11.025) 11.640 2.785 ( -8.440 13.105 7.172) 17.159 2.921 ( -1.976 2.560 -4.235) 5.328 3.329 ( -10.446 10.626 -15.084) 21.203 3.426 ( -8.413 6.073 5.553) 11.769 3.602 ( 1.539 3.607 -16.465) 16.926 3.906 ( 6.423 -5.150 5.799) 10.070 4.099 ( 9.243 5.160 4.141) 11.367 4.176 ( -2.353 -2.269 4.492) 5.555 4.338 ( -3.671 -2.160 -4.466) 6.171 4.565 ( 2.668 -2.366 6.796) 7.675 4.636 ( 2.054 2.617 0.820) 3.426 5.231 ( -3.713 12.538 10.652) 16.866 5.470 ( 6.817 -4.401 12.943) 15.276 5.613 ( 4.851 -3.031 -4.816) 7.478 5.775 ( -2.487 5.718 -4.788) 7.862 5.855 ( -1.439 0.796 3.589) 3.948 5.960 ( -2.919 7.566 -3.780) 8.947 6.411 ( -0.550 -5.488 -3.741) 6.664 6.496 ( -3.306 3.016 -6.603) 7.977 6.674 ( -2.278 -12.581 8.711) 15.471 6.854 ( 0.914 -13.543 -3.363) 13.984 7.137 ( -0.187 -1.286 2.179) 2.537 7.287 ( -3.898 -0.973 -1.290) 4.219 7.389 ( 5.144 2.507 4.604) 7.345 7.602 ( 2.775 0.787 -6.117) 6.762 8.031 ( 0.811 3.783 -0.812) 3.954 8.244 ( -6.863 7.865 -4.206) 11.254 8.601 ( 7.360 -13.134 2.049) 15.195 8.838 ( -2.300 -13.422 -2.438) 13.834 8.865 ( 8.056 4.437 0.531) 9.212 9.087 ( -7.053 4.686 1.317) 8.570 9.654 ( 7.137 -3.495 6.011) 9.964 9.880 ( 2.823 -1.234 -3.922) 4.987 10.134 ( -2.839 -0.633 0.267) 2.921 10.261 ( -7.155 -3.990 -4.526) 9.359 11.210 ( 7.083 -3.213 2.558) 8.188 11.454 ( -4.038 -1.786 -2.908) 5.287 13.030 ( -3.336 -4.011 14.191) 15.120 13.376 ( -0.590 -5.525 -10.743) 12.095 13.668 ( 8.512 3.125 -2.884) 9.515 13.788 ( 2.694 -1.222 0.850) 3.078 14.115 ( -7.818 -2.099 5.158) 9.599 14.400 ( -6.667 2.837 -4.966) 8.784 14.592 ( 4.298 2.685 2.266) 5.552 14.726 ( 1.847 2.104 -2.823) 3.976 20.112 ( -1.402 0.304 2.875) 3.213 20.181 ( 0.732 0.331 -4.555) 4.625 21.753 ( 1.429 1.608 7.486) 7.789 21.994 ( 0.359 -4.180 -6.297) 7.566 22.359 ( 1.328 -2.460 7.262) 7.781 22.632 ( -4.161 -4.865 -3.633) 7.361 23.380 ( -3.929 3.032 12.063) 13.044 23.588 ( 4.932 5.620 -14.049) 15.915 24.468 ( -3.124 -0.594 15.876) 16.191 24.716 ( 2.973 -0.918 -7.203) 7.846 24.989 ( 4.657 0.377 -4.064) 6.192 25.116 ( -4.466 2.301 -1.963) 5.394 ======================= Grid point 209 (113/128) ======================= q-point: (-0.14 0.14 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.065 ( 12.020 10.102 11.388) 19.397 2.257 ( -9.347 5.816 -6.867) 12.975 2.472 ( -5.054 15.732 12.914) 20.972 2.645 ( 1.664 10.835 -2.395) 11.220 2.895 ( -1.179 -0.837 6.139) 6.307 3.050 ( -6.605 6.444 -3.965) 10.043 3.276 ( -3.464 1.795 3.806) 5.450 3.519 ( 5.575 5.722 -16.317) 18.168 4.034 ( 0.376 -0.515 6.173) 6.205 4.118 ( 4.285 1.751 -0.015) 4.629 4.224 ( -0.363 -3.608 4.473) 5.758 4.344 ( 3.003 1.333 -4.529) 5.595 4.624 ( -4.365 -1.629 5.692) 7.356 4.685 ( 7.675 -0.895 -0.400) 7.737 5.035 ( -0.253 14.324 18.051) 23.045 5.456 ( -6.544 10.695 -21.058) 24.508 5.630 ( -5.915 -2.651 7.900) 10.219 5.717 ( 6.753 -0.010 3.228) 7.485 5.849 ( -1.249 0.261 1.260) 1.793 5.887 ( 5.512 1.780 -3.788) 6.920 6.428 ( -2.549 -1.938 0.062) 3.203 6.470 ( -1.538 -5.498 -3.764) 6.839 6.863 ( -3.105 -9.274 9.151) 13.394 7.032 ( -0.311 -10.343 -2.562) 10.661 7.181 ( 2.858 -0.028 3.383) 4.428 7.253 ( -5.755 -6.358 -1.405) 8.690 7.408 ( 1.570 2.941 4.936) 5.957 7.598 ( 2.691 1.251 -11.805) 12.173 8.008 ( 1.784 4.028 0.991) 4.515 8.068 ( -0.553 4.562 -4.451) 6.397 8.819 ( -8.228 2.020 3.765) 9.271 8.882 ( 8.688 -0.581 -1.553) 8.845 8.975 ( 3.754 -10.265 3.636) 11.518 9.072 ( -2.604 -12.343 -5.231) 13.656 9.794 ( 2.449 -1.474 6.833) 7.407 9.899 ( 0.580 0.101 -3.675) 3.722 10.103 ( 1.936 2.778 1.067) 3.550 10.188 ( -6.328 -1.185 -6.403) 9.080 11.348 ( 0.362 -3.405 4.053) 5.306 11.428 ( -0.422 -2.798 -3.677) 4.640 13.119 ( -0.122 -3.752 14.961) 15.425 13.397 ( 0.207 -3.221 -11.581) 12.023 13.740 ( -9.805 -0.089 0.084) 9.805 13.755 ( 6.470 0.750 -1.289) 6.640 14.135 ( 5.111 -0.460 5.930) 7.842 14.239 ( -6.172 3.357 -3.836) 8.004 14.629 ( 4.235 1.053 1.448) 4.597 14.688 ( -1.497 1.892 -3.677) 4.398 20.103 ( -0.903 0.068 2.750) 2.895 20.180 ( 2.124 0.089 -4.789) 5.239 21.804 ( 2.831 -0.206 8.981) 9.419 21.969 ( -4.599 -0.768 -6.676) 8.143 22.520 ( 6.737 -5.813 5.872) 10.661 22.624 ( -4.418 -3.977 -4.268) 7.318 23.294 ( -7.150 2.519 10.679) 13.096 23.520 ( 5.297 6.630 -11.488) 14.282 24.521 ( 0.214 -2.170 12.204) 12.397 24.745 ( 2.681 -1.116 -8.294) 8.788 24.975 ( -6.071 3.363 1.149) 7.035 25.030 ( 2.984 2.066 -3.163) 4.814 ======================= Grid point 212 (114/128) ======================= q-point: ( 0.29 0.29 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.356 ( 2.774 0.000 11.193) 11.531 2.633 ( 11.858 0.000 -4.631) 12.730 2.806 ( 20.033 0.000 -7.387) 21.352 2.852 ( 16.683 0.000 -2.692) 16.899 3.018 ( 4.533 0.000 -2.078) 4.987 3.081 ( 1.256 0.000 1.676) 2.095 3.523 ( -3.730 -0.000 1.734) 4.113 3.734 ( -5.293 -0.000 5.098) 7.348 3.918 ( 6.058 0.000 0.880) 6.122 4.136 ( 6.883 0.000 -2.564) 7.345 4.268 ( 2.974 0.000 -0.239) 2.984 4.529 ( 4.526 0.000 -14.657) 15.340 4.673 ( 4.274 0.000 -0.845) 4.357 4.809 ( 5.644 0.000 -2.497) 6.171 4.937 ( -0.833 -0.000 -1.473) 1.692 5.072 ( -7.392 -0.000 6.264) 9.689 5.527 ( 1.141 0.000 12.094) 12.147 5.588 ( -4.866 -0.000 7.253) 8.735 5.697 ( 1.292 0.000 -3.320) 3.563 6.014 ( -1.388 -0.000 -8.039) 8.158 6.392 ( -10.472 -0.000 7.869) 13.099 6.421 ( 0.187 0.000 -4.438) 4.442 6.961 ( 0.241 0.000 15.232) 15.234 7.069 ( -9.601 -0.000 1.632) 9.739 7.251 ( -3.970 -0.000 4.987) 6.374 7.308 ( -2.606 -0.000 10.794) 11.104 7.545 ( 9.291 0.000 -12.628) 15.678 7.591 ( 5.397 0.000 -10.085) 11.438 7.836 ( -3.606 -0.000 7.841) 8.630 8.161 ( 3.575 0.000 -13.629) 14.090 8.512 ( 2.807 0.000 -0.390) 2.834 8.621 ( -5.705 -0.000 -6.413) 8.583 9.163 ( -11.398 -0.000 7.086) 13.421 9.275 ( 0.634 0.000 2.731) 2.804 9.453 ( -2.302 -0.000 -8.096) 8.417 9.733 ( 1.043 0.000 0.450) 1.136 10.072 ( 0.614 0.000 -3.562) 3.614 10.312 ( -6.616 -0.000 8.583) 10.837 11.024 ( -1.794 -0.000 6.844) 7.075 11.614 ( -2.655 -0.000 -2.653) 3.753 12.880 ( -10.671 -0.000 9.155) 14.060 13.199 ( -3.328 -0.000 -13.432) 13.838 13.619 ( 6.660 0.000 9.387) 11.510 13.792 ( 1.908 0.000 -7.991) 8.216 14.140 ( -9.833 -0.000 1.490) 9.945 14.524 ( 6.174 0.000 8.995) 10.910 14.664 ( -3.269 -0.000 -3.637) 4.890 14.728 ( 8.002 0.000 -4.248) 9.060 20.152 ( -0.663 -0.000 2.810) 2.887 20.224 ( 1.276 0.000 -7.216) 7.328 21.735 ( 2.383 0.000 -4.801) 5.360 21.933 ( -5.552 -0.000 7.496) 9.328 22.442 ( -1.124 -0.000 -2.725) 2.948 22.467 ( -8.285 -0.000 3.681) 9.066 23.430 ( 4.907 0.000 3.572) 6.069 23.649 ( 5.343 0.000 1.261) 5.490 24.531 ( -7.842 -0.000 14.474) 16.462 24.740 ( 4.012 0.000 -10.351) 11.102 24.984 ( 0.030 0.000 -3.849) 3.849 24.999 ( 4.710 0.000 -0.481) 4.734 ======================= Grid point 213 (115/128) ======================= q-point: ( 0.43 0.29 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.452 ( 2.067 -3.673 9.598) 10.482 2.648 ( 12.612 13.572 -3.564) 18.867 2.914 ( 5.817 4.557 -11.419) 13.602 2.956 ( 7.194 1.490 -10.874) 13.123 3.115 ( 2.962 0.483 8.508) 9.022 3.338 ( 9.814 -10.972 -1.072) 14.759 3.477 ( 0.539 -0.123 8.180) 8.199 3.732 ( -3.984 -4.957 3.496) 7.257 3.957 ( 1.339 0.512 1.543) 2.106 4.152 ( -0.068 6.510 -6.528) 9.220 4.273 ( 4.142 3.371 -6.116) 8.120 4.399 ( -3.462 4.806 -5.730) 8.241 4.631 ( -1.587 6.870 -0.653) 7.081 4.900 ( 2.389 7.453 6.525) 10.190 5.068 ( 9.093 -11.279 -0.704) 14.505 5.134 ( 4.691 -8.216 4.429) 10.446 5.529 ( -3.709 -4.714 -1.807) 6.265 5.658 ( 2.055 -3.833 11.484) 12.280 5.740 ( 1.735 -2.905 1.545) 3.720 5.982 ( -3.178 -4.962 -8.304) 10.182 6.257 ( -6.514 5.825 9.850) 13.168 6.403 ( -0.849 -0.150 -4.105) 4.195 6.857 ( -7.795 5.614 3.212) 10.129 7.006 ( -9.790 -2.407 0.151) 10.083 7.239 ( -3.917 0.464 13.786) 14.339 7.260 ( 2.918 7.929 8.889) 12.263 7.519 ( 6.934 8.650 -12.486) 16.697 7.626 ( 3.158 -0.076 -7.245) 7.904 7.920 ( -0.688 -9.167 5.545) 10.735 8.202 ( 1.795 -7.577 -12.013) 14.316 8.473 ( -1.921 7.155 -0.762) 7.447 8.583 ( 0.644 -1.346 -4.214) 4.470 9.027 ( -6.250 1.899 4.025) 7.673 9.281 ( -4.691 -2.957 1.629) 5.780 9.449 ( 7.918 2.796 -2.673) 8.812 9.785 ( 3.276 -2.567 -0.112) 4.163 10.054 ( -2.928 -0.157 -1.757) 3.419 10.221 ( -10.528 -1.668 4.475) 11.560 11.054 ( 2.344 0.188 7.863) 8.207 11.544 ( -3.903 0.972 -4.934) 6.365 12.825 ( -7.576 -4.204 10.864) 13.896 13.143 ( -1.673 -3.943 -13.184) 13.862 13.722 ( 5.984 1.487 4.947) 7.905 13.772 ( 1.498 1.893 -7.216) 7.609 14.054 ( -7.852 -3.106 5.928) 10.317 14.558 ( -3.293 0.724 -4.301) 5.465 14.642 ( 2.825 1.469 6.739) 7.454 14.800 ( 6.297 1.518 -4.661) 7.980 20.143 ( -1.607 0.388 2.792) 3.244 20.210 ( 0.855 0.238 -6.546) 6.605 21.777 ( 4.496 -1.137 -3.887) 6.051 21.873 ( -4.250 1.518 6.450) 7.872 22.363 ( -5.422 0.804 2.938) 6.219 22.451 ( -3.864 -4.632 -1.410) 6.194 23.493 ( 5.118 3.072 5.742) 8.282 23.710 ( 3.119 0.249 -1.823) 3.622 24.486 ( -6.371 0.430 16.376) 17.577 24.746 ( 3.443 1.404 -9.564) 10.261 24.947 ( 2.987 1.936 -3.782) 5.194 25.090 ( 0.762 -4.292 -2.783) 5.172 ======================= Grid point 214 (116/128) ======================= q-point: (-0.43 0.29 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.563 ( 3.644 3.401 3.496) 6.088 2.596 ( 10.628 9.349 2.120) 14.312 2.841 ( -5.491 1.894 5.449) 7.964 2.977 ( 3.109 8.221 -0.412) 8.799 3.041 ( -0.190 2.503 -11.000) 11.283 3.516 ( -3.339 2.785 -5.387) 6.923 3.588 ( 2.408 -3.949 8.042) 9.278 3.693 ( 0.917 1.512 5.788) 6.052 3.918 ( -1.252 12.856 -8.474) 15.448 4.035 ( -0.327 -7.984 -3.514) 8.729 4.220 ( -1.409 4.982 -1.819) 5.487 4.303 ( -3.929 -1.183 -5.065) 6.519 4.581 ( 7.305 4.952 4.893) 10.091 4.800 ( -2.229 7.080 4.036) 8.449 5.254 ( 3.303 -5.358 9.887) 11.721 5.408 ( 10.103 -6.178 -2.582) 12.120 5.597 ( -0.337 -2.847 5.197) 5.935 5.780 ( 1.840 -4.468 3.689) 6.079 5.813 ( 0.100 -4.243 2.671) 5.014 5.996 ( -6.197 -5.774 -4.750) 9.711 6.186 ( 1.862 -1.214 3.711) 4.326 6.376 ( -2.400 -1.617 -3.117) 4.253 6.710 ( -2.492 5.081 -0.506) 5.682 6.830 ( -8.235 4.948 -6.556) 11.631 7.144 ( -4.435 5.342 15.693) 17.160 7.294 ( -0.348 1.202 5.756) 5.891 7.473 ( 7.980 4.544 -7.893) 12.109 7.623 ( 0.847 0.357 -6.402) 6.468 8.065 ( 0.470 -6.337 4.453) 7.759 8.318 ( -2.052 -8.846 -8.542) 12.467 8.362 ( 0.476 2.827 2.376) 3.723 8.530 ( -3.628 0.564 -5.508) 6.620 9.006 ( 4.991 2.367 2.452) 6.044 9.231 ( -5.793 0.799 -0.658) 5.885 9.563 ( 10.554 -0.295 2.519) 10.854 9.848 ( 0.257 0.090 -1.125) 1.157 10.005 ( -5.479 -4.666 2.984) 7.791 10.152 ( -5.496 -3.734 -3.403) 7.466 11.137 ( 4.586 -1.117 7.020) 8.459 11.453 ( -4.123 0.807 -6.198) 7.487 12.864 ( -5.128 -6.318 13.027) 15.360 13.171 ( 0.503 -6.907 -12.798) 14.552 13.742 ( 1.989 1.574 -4.509) 5.173 13.772 ( 1.112 0.060 -0.362) 1.171 14.052 ( -2.433 -1.771 11.345) 11.737 14.462 ( -4.417 1.157 -8.450) 9.605 14.672 ( 1.740 2.590 7.143) 7.795 14.818 ( 4.075 3.107 -5.147) 7.263 20.123 ( -1.811 0.379 2.862) 3.408 20.195 ( 1.114 0.505 -5.637) 5.768 21.805 ( -1.249 1.634 5.657) 6.019 21.880 ( 3.295 -2.857 -3.107) 5.355 22.316 ( -2.752 -0.660 4.918) 5.675 22.466 ( -3.687 -5.345 -3.354) 7.309 23.510 ( 1.413 4.936 8.942) 10.311 23.711 ( 2.745 2.239 -7.340) 8.150 24.466 ( -4.573 0.434 17.089) 17.696 24.731 ( 3.528 1.613 -9.563) 10.320 24.979 ( 4.125 -0.583 -2.775) 5.006 25.115 ( -2.672 -2.131 -3.376) 4.804 ======================= Grid point 215 (117/128) ======================= q-point: (-0.29 0.29 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.501 ( 10.429 14.637 2.310) 18.120 2.523 ( -7.964 10.460 0.275) 13.150 2.802 ( -5.557 1.995 8.320) 10.202 2.843 ( -5.626 -0.667 8.600) 10.298 2.994 ( 8.040 12.084 -0.301) 14.517 3.243 ( -7.487 5.332 -15.204) 17.767 3.464 ( -8.956 12.378 12.271) 19.596 3.754 ( 7.241 8.198 -13.990) 17.758 3.937 ( 9.060 -7.177 5.286) 12.710 4.041 ( -7.666 -5.722 -4.584) 10.608 4.184 ( -0.161 1.089 2.312) 2.561 4.294 ( 3.566 -2.707 -7.510) 8.743 4.647 ( 5.680 3.721 5.482) 8.727 4.703 ( -1.528 2.535 0.299) 2.975 5.388 ( 1.147 -1.735 8.722) 8.967 5.531 ( -5.988 1.037 5.435) 8.153 5.581 ( 4.396 1.524 10.740) 11.704 5.821 ( -5.993 1.052 1.212) 6.205 5.891 ( 2.654 -0.545 -1.318) 3.013 5.935 ( 3.109 1.922 -10.641) 11.252 6.321 ( 1.370 -7.264 1.408) 7.525 6.388 ( -4.453 -7.433 -3.782) 9.455 6.625 ( 1.897 4.806 1.998) 5.540 6.705 ( -1.124 -3.567 -4.565) 5.901 7.104 ( -4.749 -0.836 11.326) 12.310 7.248 ( -1.491 2.220 -0.894) 2.819 7.508 ( 3.870 2.573 0.440) 4.668 7.610 ( 1.547 -0.410 -7.464) 7.634 8.122 ( 2.879 2.820 4.001) 5.679 8.231 ( -4.586 4.520 -5.382) 8.392 8.491 ( 3.551 -11.184 2.061) 11.914 8.573 ( -2.592 -12.399 -5.045) 13.635 9.017 ( -3.480 5.175 5.615) 8.391 9.126 ( 4.102 5.124 -4.681) 8.062 9.723 ( 6.308 -1.867 5.416) 8.521 9.805 ( -7.469 -4.549 -2.379) 9.063 10.075 ( 1.951 -3.951 1.399) 4.624 10.144 ( -0.144 -2.372 -4.809) 5.364 11.257 ( 4.329 -2.561 5.079) 7.149 11.366 ( -3.933 -0.414 -5.745) 6.975 12.960 ( -2.601 -6.674 14.688) 16.342 13.249 ( 1.974 -6.693 -12.805) 14.583 13.725 ( -6.761 -0.585 1.191) 6.890 13.766 ( 3.052 0.038 -2.479) 3.932 14.127 ( 4.877 -0.023 11.290) 12.299 14.341 ( -4.349 2.573 -8.821) 10.165 14.673 ( 0.672 2.085 4.569) 5.067 14.783 ( 1.548 3.955 -5.662) 7.078 20.107 ( -1.386 0.185 2.885) 3.206 20.189 ( 2.050 0.477 -5.138) 5.553 21.797 ( -1.543 -0.224 7.551) 7.710 21.934 ( 0.894 -1.367 -5.473) 5.711 22.367 ( 2.462 -3.851 6.534) 7.974 22.485 ( -2.087 -4.777 -5.049) 7.257 23.440 ( -4.550 6.416 11.595) 14.011 23.678 ( 3.991 3.640 -11.146) 12.386 24.475 ( -2.781 -0.509 14.978) 15.242 24.735 ( 4.406 0.451 -9.822) 10.774 25.026 ( -1.113 -0.064 -0.079) 1.118 25.069 ( -0.704 0.064 -3.343) 3.417 ======================= Grid point 216 (118/128) ======================= q-point: (-0.14 0.29 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.157 ( -15.393 9.346 -4.993) 18.687 2.462 ( 10.661 12.066 3.833) 16.551 2.671 ( -1.652 8.243 11.671) 14.384 2.853 ( 0.975 4.677 -1.219) 4.930 2.909 ( -1.472 5.427 8.724) 10.380 3.104 ( 4.024 10.626 5.861) 12.785 3.284 ( 0.319 1.469 1.808) 2.351 3.689 ( 8.305 7.160 -13.868) 17.679 4.021 ( -4.827 -2.184 -3.325) 6.255 4.079 ( -3.426 -3.196 1.953) 5.076 4.209 ( 4.725 -1.182 3.283) 5.874 4.377 ( 4.786 -2.474 -8.877) 10.384 4.619 ( -1.672 5.519 3.291) 6.640 4.709 ( 2.276 -4.171 -5.011) 6.906 5.361 ( 0.922 10.854 14.332) 18.002 5.485 ( -11.322 -3.529 5.383) 13.024 5.490 ( -0.115 10.532 -6.794) 12.534 5.753 ( -4.205 -4.113 -1.365) 6.039 5.868 ( 2.431 5.289 5.369) 7.919 5.991 ( 8.652 2.497 -6.525) 11.120 6.367 ( -3.859 -3.648 0.190) 5.313 6.411 ( 1.294 0.389 -0.371) 1.401 6.707 ( -0.578 -9.683 8.470) 12.877 6.844 ( 2.070 -13.176 -4.953) 14.227 7.072 ( -8.234 -2.666 5.789) 10.412 7.236 ( 1.520 -0.133 3.121) 3.474 7.481 ( -0.904 3.338 0.744) 3.538 7.608 ( 2.214 0.841 -9.352) 9.647 8.056 ( -2.028 4.733 -1.551) 5.378 8.191 ( 8.398 5.074 -0.526) 9.826 8.633 ( -8.208 -10.824 -0.435) 13.591 8.812 ( 4.507 -16.669 -0.079) 17.268 8.846 ( -8.100 3.689 1.872) 9.095 9.143 ( 8.924 5.423 -3.677) 11.071 9.755 ( -8.835 -5.695 -2.564) 10.820 9.811 ( -0.911 -1.580 2.228) 2.879 10.140 ( 1.843 -0.158 -0.462) 1.906 10.192 ( 6.003 0.495 1.490) 6.205 11.241 ( -7.801 -0.524 -0.351) 7.826 11.430 ( 5.663 -4.391 -0.764) 7.207 13.100 ( 0.380 -6.704 14.736) 16.194 13.306 ( 0.905 -3.370 -11.548) 12.063 13.601 ( -9.844 1.765 2.948) 10.427 13.806 ( 0.346 -1.212 -0.636) 1.412 14.228 ( 0.799 2.971 -2.894) 4.224 14.256 ( 6.894 -0.052 5.605) 8.885 14.659 ( -1.542 1.412 -0.152) 2.096 14.714 ( 0.695 3.039 -4.602) 5.558 20.103 ( -0.467 -0.108 2.744) 2.786 20.199 ( 2.836 0.192 -5.425) 6.124 21.819 ( -2.436 -2.179 6.225) 7.031 21.913 ( -0.805 0.699 -3.422) 3.584 22.467 ( -1.841 -4.297 -2.135) 5.139 22.567 ( 6.020 -5.013 1.334) 7.947 23.302 ( -7.325 5.824 13.197) 16.179 23.632 ( 4.257 4.374 -11.245) 12.794 24.519 ( -0.911 -2.620 10.204) 10.574 24.758 ( 4.802 0.231 -10.635) 11.671 24.919 ( -8.267 2.234 2.134) 8.825 25.100 ( 3.724 1.286 -0.435) 3.964 ======================= Grid point 220 (119/128) ======================= q-point: ( 0.43 0.43 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.463 ( 0.771 0.000 6.470) 6.515 2.705 ( -2.003 -0.000 -9.462) 9.672 3.008 ( 6.615 0.000 -12.839) 14.443 3.027 ( -5.668 -0.000 2.512) 6.199 3.381 ( 10.095 0.000 7.183) 12.390 3.409 ( 21.420 0.000 0.595) 21.429 3.510 ( 1.793 0.000 9.538) 9.705 3.617 ( -1.563 -0.000 1.224) 1.985 3.953 ( -5.456 -0.000 -2.354) 5.942 4.078 ( -12.278 -0.000 -10.098) 15.897 4.289 ( 2.484 0.000 1.679) 2.998 4.396 ( -4.225 -0.000 -4.529) 6.194 4.795 ( 0.909 0.000 8.221) 8.271 4.878 ( 2.866 0.000 -6.340) 6.958 5.164 ( 3.738 0.000 9.862) 10.546 5.213 ( 15.111 0.000 0.537) 15.120 5.432 ( -0.728 -0.000 -1.464) 1.635 5.670 ( -2.005 -0.000 13.520) 13.668 5.693 ( -4.617 -0.000 -4.601) 6.518 5.899 ( 2.663 0.000 -12.503) 12.784 6.300 ( 0.542 0.000 10.137) 10.152 6.381 ( -1.262 -0.000 0.055) 1.263 6.812 ( -6.766 -0.000 -2.205) 7.116 6.820 ( -11.105 -0.000 0.901) 11.141 7.250 ( -3.109 -0.000 15.853) 16.155 7.385 ( 0.687 0.000 10.417) 10.440 7.617 ( 1.747 0.000 -12.342) 12.465 7.672 ( 7.034 0.000 -14.653) 16.254 7.832 ( -1.607 -0.000 10.916) 11.034 8.112 ( 1.069 0.000 -12.370) 12.416 8.533 ( 2.262 0.000 -5.564) 6.006 8.545 ( -5.411 -0.000 4.287) 6.904 8.995 ( -0.044 -0.000 4.779) 4.779 9.182 ( -4.552 -0.000 -1.085) 4.680 9.626 ( 12.448 0.000 0.436) 12.456 9.811 ( 4.415 0.000 0.039) 4.416 10.026 ( 0.025 0.000 -7.603) 7.603 10.033 ( -16.122 -0.000 5.759) 17.120 11.131 ( 3.841 0.000 9.042) 9.824 11.465 ( -5.196 -0.000 -5.636) 7.666 12.747 ( -4.944 -0.000 11.611) 12.620 13.050 ( 0.109 0.000 -13.603) 13.603 13.763 ( -1.651 -0.000 -1.626) 2.317 13.778 ( 0.624 0.000 -6.058) 6.090 14.023 ( 1.089 0.000 14.521) 14.561 14.477 ( -4.530 -0.000 -8.880) 9.969 14.718 ( 1.374 0.000 8.582) 8.691 14.870 ( 4.713 0.000 -5.671) 7.374 20.129 ( -2.146 -0.000 2.974) 3.668 20.204 ( 1.397 0.000 -6.320) 6.473 21.828 ( 5.957 0.000 -3.921) 7.132 21.843 ( -5.057 -0.000 6.461) 8.205 22.312 ( -4.529 -0.000 4.279) 6.231 22.370 ( -1.597 -0.000 -2.587) 3.040 23.607 ( 4.783 0.000 3.670) 6.029 23.731 ( 0.153 0.000 -0.001) 0.153 24.477 ( -4.273 -0.000 16.773) 17.309 24.768 ( 3.072 0.000 -9.827) 10.296 24.984 ( 2.168 0.000 -3.455) 4.079 25.048 ( -0.366 -0.000 -3.527) 3.546 ======================= Grid point 221 (120/128) ======================= q-point: (-0.43 -0.57 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.532 ( 0.627 -4.372 5.940) 7.402 2.659 ( -4.500 -4.098 -4.591) 7.624 2.885 ( -6.064 6.419 4.625) 9.968 3.008 ( -1.986 5.414 -4.662) 7.416 3.360 ( 5.246 7.752 4.099) 10.218 3.439 ( -1.132 12.162 -1.813) 12.348 3.692 ( 9.445 -3.631 6.910) 12.253 3.786 ( 6.122 1.487 2.410) 6.745 3.859 ( -2.882 -6.973 -7.040) 10.320 3.887 ( -11.686 -2.084 -5.428) 13.053 4.231 ( -5.874 5.086 3.499) 8.521 4.334 ( 2.673 2.935 -3.975) 5.617 4.754 ( -0.932 3.524 6.080) 7.089 4.858 ( 1.834 6.127 -2.602) 6.904 5.243 ( -0.625 -3.504 9.728) 10.359 5.416 ( 5.105 -3.002 -5.042) 7.778 5.562 ( 2.268 -8.801 4.115) 9.977 5.651 ( -2.130 -10.463 -7.696) 13.162 5.700 ( -3.857 -3.476 8.568) 10.019 5.929 ( 6.211 -1.341 -11.618) 13.242 6.292 ( 1.193 6.464 8.475) 10.725 6.369 ( -0.177 2.632 1.582) 3.076 6.701 ( -5.833 -1.113 0.508) 5.960 6.754 ( 1.020 0.734 -3.816) 4.017 7.227 ( -5.121 5.084 17.375) 18.814 7.376 ( 0.105 5.083 7.801) 9.312 7.575 ( 0.121 0.647 -10.412) 10.433 7.631 ( 4.315 5.177 -9.957) 12.024 7.960 ( 0.460 -9.984 5.639) 11.476 8.146 ( 0.871 -7.245 -10.658) 12.917 8.415 ( -6.616 4.747 7.285) 10.926 8.535 ( 2.600 3.530 -4.519) 6.296 9.068 ( 2.208 -1.218 3.910) 4.653 9.152 ( -0.066 -2.818 -4.009) 4.901 9.744 ( 3.181 3.224 4.434) 6.339 9.785 ( -8.415 3.083 1.300) 9.056 9.935 ( 2.954 -4.970 1.232) 5.912 10.051 ( 4.570 -2.759 -9.282) 10.708 11.222 ( 4.812 0.098 8.700) 9.943 11.370 ( -5.203 0.038 -6.435) 8.276 12.773 ( -2.991 -4.299 13.189) 14.191 13.052 ( 2.266 -4.699 -13.426) 14.404 13.714 ( -4.673 -0.158 1.240) 4.838 13.765 ( 0.544 -0.041 -3.582) 3.623 14.129 ( 5.637 0.105 13.411) 14.548 14.379 ( -4.027 0.326 -10.677) 11.416 14.738 ( -0.769 1.580 7.338) 7.545 14.882 ( 2.419 2.004 -6.685) 7.386 20.112 ( -1.824 0.108 3.169) 3.658 20.203 ( 2.101 0.326 -5.796) 6.174 21.792 ( -5.315 -0.118 6.275) 8.224 21.900 ( 5.034 -0.692 -4.000) 6.467 22.295 ( -0.899 -1.079 4.609) 4.818 22.371 ( 0.475 -2.276 -3.043) 3.830 23.625 ( -0.027 4.978 5.783) 7.631 23.727 ( 0.408 -0.418 -3.717) 3.763 24.487 ( -2.578 0.798 15.902) 16.130 24.762 ( 3.420 0.975 -10.876) 11.443 25.004 ( 0.691 -0.521 -1.095) 1.396 25.032 ( -1.769 -1.965 -3.474) 4.366 ======================= Grid point 222 (121/128) ======================= q-point: (-0.29 -0.57 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.541 ( -10.180 10.184 3.701) 14.867 2.667 ( -4.472 -2.092 -1.160) 5.071 2.726 ( -6.413 -3.426 9.873) 12.262 2.805 ( -7.358 5.214 7.377) 11.651 3.183 ( 1.033 7.644 -12.053) 14.310 3.410 ( 9.636 11.122 3.965) 15.241 3.630 ( -3.170 14.266 11.269) 18.454 3.815 ( -4.785 -5.508 -6.271) 9.621 3.835 ( -3.441 2.418 -8.082) 9.111 3.931 ( 4.119 -8.563 5.181) 10.823 4.223 ( 2.476 -4.106 0.669) 4.841 4.309 ( 4.687 3.606 -5.442) 8.037 4.667 ( -5.584 1.517 -1.398) 5.953 4.833 ( 6.319 7.094 0.458) 9.511 5.296 ( -7.517 -5.679 6.533) 11.465 5.430 ( -3.875 -2.107 -5.352) 6.935 5.594 ( -9.594 -8.178 5.013) 13.567 5.687 ( -4.333 -2.039 6.688) 8.225 5.934 ( 8.741 -5.445 -0.962) 10.343 6.005 ( 5.768 -4.314 -9.347) 11.800 6.266 ( 0.355 1.985 -1.463) 2.491 6.325 ( 3.395 1.364 3.026) 4.748 6.664 ( 0.488 1.877 0.714) 2.066 6.765 ( 5.105 4.822 0.244) 7.026 7.124 ( -5.028 5.870 15.222) 17.072 7.302 ( -0.134 6.085 2.687) 6.654 7.530 ( -2.135 -0.178 -7.083) 7.400 7.608 ( 2.749 0.467 -6.474) 7.049 8.153 ( 2.444 -9.586 5.118) 11.138 8.197 ( -0.818 -0.256 -5.843) 5.906 8.368 ( -1.628 -7.238 2.186) 7.735 8.493 ( 2.741 4.113 -2.334) 5.466 9.016 ( -5.539 4.441 1.823) 7.330 9.243 ( 7.265 -0.171 -2.168) 7.583 9.578 ( -13.129 -3.117 0.813) 13.518 9.814 ( 2.623 1.554 2.545) 3.971 10.053 ( 3.763 -5.169 -1.774) 6.636 10.168 ( 10.476 -1.000 -4.912) 11.613 11.266 ( -5.032 1.227 -4.759) 7.034 11.329 ( 4.702 -1.477 5.065) 7.067 12.881 ( -1.278 -6.925 14.612) 16.220 13.140 ( 4.229 -6.903 -12.978) 15.295 13.642 ( -6.451 1.148 4.828) 8.138 13.776 ( 0.675 -0.851 -1.172) 1.598 14.260 ( 7.124 0.397 10.282) 12.515 14.286 ( -1.949 0.646 -9.957) 10.167 14.711 ( -2.269 2.077 5.067) 5.928 14.828 ( -0.129 3.568 -7.507) 8.313 20.102 ( -1.043 0.033 3.234) 3.399 20.209 ( 2.574 0.414 -5.435) 6.028 21.756 ( -5.082 -1.786 6.158) 8.181 21.936 ( 2.089 0.733 -4.088) 4.649 22.351 ( 1.386 -2.962 2.676) 4.225 22.435 ( 4.585 -3.502 -1.693) 6.013 23.517 ( -5.237 7.264 8.698) 12.484 23.715 ( 1.327 1.170 -7.780) 7.979 24.494 ( -2.163 0.931 12.957) 13.170 24.767 ( 4.843 0.357 -11.451) 12.438 24.952 ( -6.621 -0.025 -0.247) 6.626 25.080 ( 2.878 -2.318 -0.288) 3.707 ======================= Grid point 223 (122/128) ======================= q-point: (-0.14 -0.57 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.079 ( -18.473 12.853 0.172) 22.505 2.681 ( 2.807 3.382 -3.102) 5.379 2.724 ( -2.574 -3.160 13.774) 14.364 2.802 ( -5.192 -3.865 10.445) 12.288 3.054 ( 1.983 10.705 -2.515) 11.174 3.353 ( 1.651 3.639 4.049) 5.689 3.484 ( 7.819 14.375 10.326) 19.349 3.761 ( 1.669 0.850 -7.729) 7.953 3.838 ( -2.537 -7.315 -8.485) 11.486 4.044 ( -2.564 -0.192 1.566) 3.011 4.319 ( 2.585 -3.611 2.575) 5.133 4.326 ( 3.685 0.572 -6.611) 7.590 4.609 ( -1.223 -3.836 -7.213) 8.261 4.740 ( -0.582 9.408 -3.123) 9.930 5.260 ( -11.156 -4.731 3.977) 12.753 5.376 ( -4.488 -1.082 -2.461) 5.232 5.592 ( -6.230 -4.696 3.579) 8.584 5.709 ( 2.274 2.314 7.750) 8.402 5.960 ( -1.249 2.220 3.219) 4.105 6.152 ( 9.149 0.090 -6.843) 11.425 6.226 ( -3.425 -1.662 -2.868) 4.767 6.442 ( 4.058 -3.151 5.957) 7.867 6.709 ( 4.224 -0.062 -0.177) 4.228 6.734 ( 4.402 1.631 -0.724) 4.749 7.026 ( -5.245 4.459 12.971) 14.685 7.258 ( -0.247 1.159 3.325) 3.529 7.465 ( -3.081 0.297 -7.311) 7.939 7.616 ( 1.320 -0.044 -5.326) 5.488 8.133 ( 1.949 5.798 -1.427) 6.281 8.321 ( 0.512 -7.533 2.506) 7.955 8.439 ( 1.590 1.326 -3.495) 4.063 8.599 ( 1.438 -15.379 1.234) 15.495 8.843 ( -5.089 7.809 0.932) 9.367 9.307 ( 6.479 3.010 -2.002) 7.419 9.502 ( -10.283 -6.880 -0.903) 12.405 9.811 ( -0.173 1.180 0.116) 1.198 10.162 ( 3.296 -2.234 -0.409) 4.002 10.301 ( 8.703 0.156 -0.196) 8.707 11.147 ( -6.212 1.779 -3.450) 7.325 11.441 ( 4.339 -2.836 1.920) 5.528 13.038 ( -0.464 -7.687 13.395) 15.451 13.251 ( 4.602 -4.326 -9.081) 11.061 13.547 ( -5.349 2.638 5.197) 7.911 13.761 ( -3.512 0.086 -2.357) 4.231 14.260 ( 3.500 -0.729 -4.318) 5.606 14.390 ( 7.227 0.808 7.507) 10.451 14.649 ( -4.220 2.321 0.311) 4.826 14.735 ( -1.379 2.732 -6.463) 7.151 20.107 ( -0.260 -0.221 3.112) 3.130 20.218 ( 2.353 0.238 -5.549) 6.032 21.751 ( -4.228 -3.093 5.336) 7.478 21.914 ( 0.241 1.958 -3.122) 3.694 22.410 ( 1.254 -2.126 -1.407) 2.841 22.583 ( 6.023 -4.775 1.095) 7.764 23.357 ( -6.401 7.295 12.443) 15.781 23.675 ( 1.469 1.628 -10.867) 11.086 24.504 ( -2.210 -1.016 9.390) 9.700 24.789 ( 4.363 0.446 -13.355) 14.057 24.850 ( -6.124 1.282 4.279) 7.580 25.149 ( 2.645 -1.183 0.897) 3.033 ======================= Grid point 228 (123/128) ======================= q-point: (-0.43 -0.43 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.527 ( 0.323 0.000 7.113) 7.120 2.545 ( -5.083 -0.000 1.853) 5.411 2.820 ( -8.945 -0.000 1.161) 9.020 2.988 ( -12.358 -0.000 5.785) 13.645 3.407 ( 0.832 0.000 1.951) 2.121 3.548 ( -13.154 -0.000 -7.766) 15.276 3.670 ( -3.241 -0.000 -4.500) 5.546 3.676 ( -4.420 -0.000 -4.834) 6.550 3.906 ( 11.689 0.000 1.488) 11.784 3.906 ( 11.488 0.000 3.618) 12.044 4.251 ( -6.772 -0.000 3.729) 7.730 4.298 ( -4.714 -0.000 7.816) 9.128 4.735 ( -4.874 -0.000 5.846) 7.611 4.954 ( 3.035 0.000 -4.957) 5.812 5.191 ( -5.855 -0.000 3.661) 6.906 5.371 ( -11.654 -0.000 -6.966) 13.578 5.500 ( 9.199 0.000 -12.574) 15.580 5.607 ( 6.676 0.000 7.924) 10.362 5.656 ( -2.592 -0.000 5.639) 6.206 5.938 ( 2.894 0.000 -12.159) 12.499 6.381 ( -3.017 -0.000 2.210) 3.739 6.384 ( 1.888 0.000 3.040) 3.579 6.715 ( 7.122 0.000 6.007) 9.317 6.814 ( 8.130 0.000 -0.822) 8.172 7.260 ( -6.183 -0.000 18.549) 19.552 7.456 ( -0.008 -0.000 8.851) 8.851 7.511 ( -2.199 -0.000 -11.140) 11.355 7.704 ( 3.554 0.000 -16.792) 17.164 7.876 ( -2.149 -0.000 10.688) 10.902 8.069 ( 2.505 0.000 -12.187) 12.441 8.387 ( -5.311 -0.000 8.987) 10.439 8.586 ( -0.037 -0.000 -0.470) 0.472 9.112 ( 3.811 0.000 -5.987) 7.097 9.151 ( 6.289 0.000 2.009) 6.602 9.593 ( -15.956 -0.000 2.780) 16.196 9.828 ( -0.632 -0.000 -0.416) 0.757 9.955 ( 5.045 0.000 -0.185) 5.048 10.157 ( 14.935 0.000 -7.316) 16.631 11.273 ( -5.394 -0.000 -5.828) 7.941 11.331 ( 5.913 0.000 8.409) 10.280 12.762 ( -0.925 -0.000 13.865) 13.895 13.008 ( 4.121 0.000 -13.188) 13.817 13.662 ( -4.540 -0.000 5.080) 6.813 13.761 ( 0.545 0.000 -1.386) 1.489 14.269 ( 7.465 0.000 11.180) 13.443 14.289 ( -3.107 -0.000 -11.293) 11.712 14.749 ( -2.956 -0.000 6.220) 6.887 14.888 ( -0.034 -0.000 -7.949) 7.949 20.103 ( -1.251 -0.000 3.558) 3.771 20.216 ( 2.496 0.000 -5.642) 6.169 21.727 ( -6.380 -0.000 5.691) 8.550 21.949 ( 4.273 0.000 -3.508) 5.529 22.306 ( 1.824 0.000 3.592) 4.028 22.377 ( 3.720 0.000 -2.257) 4.352 23.669 ( -3.873 -0.000 -1.661) 4.214 23.702 ( 0.111 0.000 2.393) 2.395 24.527 ( -1.212 -0.000 13.765) 13.818 24.773 ( 3.579 0.000 -11.865) 12.393 24.944 ( -4.995 -0.000 -0.452) 5.016 25.025 ( 1.303 0.000 -0.916) 1.593 ======================= Grid point 229 (124/128) ======================= q-point: (-0.29 -0.43 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.544 ( -3.905 -4.721 11.173) 12.743 2.566 ( -9.504 6.834 3.827) 12.316 2.633 ( -13.992 4.591 14.478) 20.652 2.720 ( -9.034 -0.325 -2.175) 9.298 3.305 ( 1.980 2.333 -7.516) 8.115 3.418 ( -14.559 -1.880 -6.412) 16.019 3.639 ( -4.257 -2.629 -6.405) 8.128 3.728 ( 5.802 -7.202 2.401) 9.556 3.943 ( -3.008 10.957 7.097) 13.397 3.959 ( 3.662 6.419 4.791) 8.807 4.175 ( 0.233 -2.815 2.738) 3.933 4.340 ( -1.471 -4.627 2.738) 5.574 4.657 ( -1.925 5.228 0.297) 5.579 4.984 ( 3.312 2.028 -2.212) 4.469 5.067 ( -14.029 -5.126 -3.424) 15.324 5.252 ( -8.405 -4.618 -2.400) 9.886 5.517 ( 4.147 3.444 -3.927) 6.669 5.644 ( -1.931 -1.507 8.701) 9.039 5.847 ( 3.609 -12.020 0.615) 12.565 5.935 ( -0.686 -3.300 -10.256) 10.796 6.365 ( 1.504 -0.356 1.647) 2.258 6.410 ( 7.690 5.012 -3.818) 9.941 6.821 ( 8.516 5.339 6.059) 11.736 6.924 ( 8.685 3.483 3.764) 10.086 7.199 ( -5.649 4.594 16.169) 17.733 7.422 ( -2.824 5.130 2.340) 6.307 7.445 ( -1.053 0.474 -7.320) 7.411 7.629 ( 0.807 3.637 -9.735) 10.424 8.003 ( -0.578 -12.484 5.161) 13.521 8.106 ( 1.585 -5.822 -10.921) 12.477 8.370 ( 1.063 2.467 8.289) 8.713 8.547 ( -2.523 1.108 0.289) 2.771 9.095 ( 4.918 7.534 -1.685) 9.154 9.302 ( 6.777 -3.953 -0.712) 7.878 9.393 ( -11.624 0.996 1.683) 11.787 9.822 ( -0.577 -1.314 -2.872) 3.210 10.042 ( 4.391 -3.363 -1.195) 5.658 10.323 ( 12.644 1.160 -4.999) 13.646 11.182 ( -4.770 0.158 -5.342) 7.164 11.433 ( 5.986 1.430 6.506) 8.955 12.846 ( 0.718 -3.936 14.864) 15.394 13.073 ( 6.381 -5.044 -12.262) 14.714 13.615 ( -4.399 1.479 7.827) 9.100 13.765 ( -0.476 -0.087 -0.977) 1.090 14.228 ( -0.034 -0.850 -9.180) 9.220 14.409 ( 7.910 0.437 8.480) 11.604 14.707 ( -4.644 1.245 4.425) 6.535 14.821 ( -2.869 1.978 -8.899) 9.557 20.104 ( -0.653 -0.007 3.755) 3.811 20.227 ( 2.087 0.213 -5.366) 5.762 21.675 ( -5.455 -1.496 5.665) 8.006 21.979 ( 3.445 1.657 -3.197) 4.984 22.360 ( 2.479 -0.999 2.093) 3.394 22.458 ( 6.141 -2.748 -1.299) 6.852 23.560 ( -5.183 4.871 1.783) 7.333 23.696 ( -1.909 -0.239 -2.800) 3.398 24.532 ( -2.630 1.931 10.662) 11.150 24.787 ( 4.374 -0.418 -12.406) 13.161 24.878 ( -4.416 0.753 3.140) 5.470 25.061 ( 0.767 -3.364 -0.063) 3.451 ======================= Grid point 230 (125/128) ======================= q-point: (-0.14 -0.43 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.041 ( -19.892 15.652 6.189) 26.057 2.645 ( -6.243 -6.045 16.918) 19.019 2.671 ( 1.271 -4.286 -5.099) 6.781 2.686 ( -5.201 -6.595 10.733) 13.629 3.174 ( -7.611 7.005 -5.538) 11.733 3.387 ( 2.588 -7.343 0.613) 7.810 3.595 ( -2.955 -0.799 -5.203) 6.037 3.732 ( -2.529 4.893 1.617) 5.741 3.888 ( 1.649 5.881 3.319) 6.952 3.979 ( -0.297 -6.897 3.386) 7.689 4.161 ( -5.908 -2.106 -4.840) 7.923 4.394 ( 0.222 -2.130 1.495) 2.612 4.599 ( 3.180 2.183 -2.454) 4.572 4.778 ( -9.772 6.472 -5.276) 12.854 5.139 ( 0.821 -3.639 3.020) 4.800 5.233 ( -6.094 -7.540 2.262) 9.955 5.499 ( 0.086 0.937 -0.238) 0.970 5.715 ( 0.620 -4.693 8.557) 9.779 5.923 ( -2.461 -1.888 -6.485) 7.188 6.007 ( -4.038 -8.950 1.751) 9.974 6.407 ( 8.520 6.285 -7.213) 12.811 6.459 ( 6.743 -2.064 -2.702) 7.551 6.826 ( 3.354 7.359 6.391) 10.308 6.941 ( 5.229 10.063 6.046) 12.852 7.119 ( -1.357 5.259 11.750) 12.945 7.294 ( -3.450 4.414 -2.381) 6.087 7.400 ( -0.151 1.044 -5.958) 6.051 7.590 ( -0.444 -1.186 -5.008) 5.165 8.121 ( -2.285 -5.290 -6.596) 8.759 8.245 ( 0.399 -10.473 1.068) 10.535 8.393 ( 4.325 1.090 2.422) 5.076 8.543 ( 1.195 -2.359 2.344) 3.534 8.999 ( 3.689 12.839 1.538) 13.447 9.289 ( -7.278 -3.494 0.685) 8.102 9.409 ( 4.868 0.151 0.034) 4.871 9.824 ( 0.870 -0.011 -3.545) 3.651 10.152 ( 2.661 -4.287 -1.327) 5.217 10.425 ( 7.378 1.684 -3.477) 8.328 11.097 ( -2.823 1.746 -3.922) 5.138 11.496 ( 3.804 1.498 3.415) 5.327 12.986 ( 0.391 -5.166 13.477) 14.438 13.224 ( 7.992 -6.413 -8.270) 13.168 13.562 ( -2.176 2.859 7.452) 8.273 13.713 ( -3.650 1.771 -4.249) 5.875 14.272 ( 4.974 -3.234 -2.650) 6.498 14.528 ( 6.858 1.213 5.588) 8.929 14.612 ( -6.924 2.715 0.521) 7.455 14.702 ( -4.553 1.535 -7.731) 9.103 20.112 ( -0.433 -0.158 3.595) 3.625 20.226 ( 1.041 0.200 -5.169) 5.277 21.668 ( -3.616 -2.919 5.803) 7.434 21.971 ( 3.481 3.922 -3.244) 6.166 22.402 ( 0.213 -1.026 0.981) 1.435 22.600 ( 6.115 -4.050 -0.214) 7.338 23.420 ( -4.854 5.834 7.429) 10.620 23.645 ( -1.906 -0.096 -9.121) 9.319 24.498 ( -4.182 0.797 10.267) 11.115 24.772 ( -1.309 1.477 -5.464) 5.810 24.856 ( 3.187 0.406 -3.363) 4.651 25.136 ( 0.765 -4.241 0.665) 4.361 ======================= Grid point 236 (126/128) ======================= q-point: (-0.29 -0.29 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.491 ( -8.754 -0.000 19.497) 21.372 2.502 ( -20.477 -0.000 11.344) 23.409 2.553 ( -6.810 -0.000 13.812) 15.400 2.598 ( -4.113 -0.000 -9.112) 9.998 3.021 ( -14.676 -0.000 -3.449) 15.076 3.315 ( -4.781 -0.000 -13.557) 14.375 3.590 ( -2.853 -0.000 -3.468) 4.490 3.761 ( 8.725 0.000 2.541) 9.087 3.956 ( -6.991 -0.000 -1.427) 7.135 4.048 ( -6.948 -0.000 6.191) 9.306 4.227 ( 3.628 0.000 2.242) 4.265 4.231 ( -5.938 -0.000 14.454) 15.626 4.724 ( -0.750 -0.000 3.985) 4.055 4.772 ( -10.387 -0.000 -11.011) 15.137 4.970 ( -5.927 -0.000 -0.772) 5.977 5.185 ( 4.654 0.000 -3.514) 5.832 5.598 ( -2.771 -0.000 4.483) 5.270 5.652 ( 6.173 0.000 -7.367) 9.611 5.792 ( -1.031 -0.000 13.129) 13.169 5.855 ( -0.423 -0.000 -12.206) 12.213 6.402 ( 4.593 0.000 -0.994) 4.699 6.546 ( 8.968 0.000 -6.212) 10.909 7.001 ( 5.571 0.000 8.283) 9.982 7.101 ( 9.347 0.000 3.807) 10.093 7.210 ( -5.925 -0.000 15.873) 16.943 7.316 ( -6.236 -0.000 -11.133) 12.760 7.477 ( -2.628 -0.000 4.277) 5.020 7.681 ( 4.767 0.000 -17.165) 17.815 7.883 ( -2.373 -0.000 12.627) 12.848 8.040 ( 1.361 0.000 -12.033) 12.110 8.471 ( 6.066 0.000 8.602) 10.526 8.502 ( -3.000 -0.000 0.263) 3.012 9.267 ( -6.970 -0.000 7.384) 10.154 9.299 ( 10.080 0.000 -5.869) 11.664 9.337 ( 4.639 0.000 -1.089) 4.765 9.790 ( 0.444 0.000 -4.901) 4.921 10.053 ( 2.022 0.000 -1.475) 2.503 10.464 ( 8.421 0.000 -6.005) 10.343 11.116 ( -2.357 -0.000 -3.150) 3.934 11.552 ( 5.697 0.000 4.076) 7.005 12.898 ( 2.478 0.000 15.692) 15.886 13.093 ( 8.799 0.000 -11.080) 14.149 13.611 ( -2.555 -0.000 9.525) 9.861 13.744 ( -2.096 -0.000 -3.343) 3.946 14.214 ( 3.805 0.000 -5.338) 6.556 14.545 ( 7.055 0.000 5.645) 9.035 14.653 ( -6.492 -0.000 3.206) 7.241 14.739 ( -6.090 -0.000 -9.701) 11.454 20.110 ( -0.607 -0.000 4.019) 4.065 20.230 ( 0.860 0.000 -4.973) 5.047 21.621 ( -3.642 -0.000 6.050) 7.061 22.047 ( 5.670 0.000 -2.863) 6.352 22.385 ( 0.373 0.000 2.330) 2.360 22.519 ( 7.021 0.000 -1.600) 7.201 23.524 ( -4.181 -0.000 -4.912) 6.451 23.643 ( -5.190 -0.000 1.251) 5.339 24.528 ( -5.510 -0.000 9.379) 10.878 24.800 ( 4.511 0.000 -11.350) 12.214 24.880 ( -0.091 -0.000 6.534) 6.535 25.020 ( -0.905 -0.000 -2.054) 2.244 ======================= Grid point 237 (127/128) ======================= q-point: (-0.14 -0.29 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.049 ( -18.793 16.651 11.546) 27.636 2.483 ( -12.678 -7.530 13.658) 20.099 2.549 ( -6.387 -6.153 8.294) 12.142 2.591 ( -0.380 -5.482 -3.692) 6.620 3.001 ( -7.245 -7.793 0.962) 10.684 3.212 ( -4.803 -4.870 -9.357) 11.591 3.559 ( -2.911 -3.632 2.166) 5.134 3.761 ( -8.441 6.962 -2.316) 11.184 3.873 ( -1.195 -1.503 -1.020) 2.174 4.012 ( 2.896 0.226 9.360) 9.801 4.078 ( -6.366 5.922 -3.056) 9.216 4.349 ( -0.544 -5.829 6.197) 8.525 4.615 ( -5.725 0.395 -0.624) 5.772 4.705 ( -3.837 1.733 -1.535) 4.481 4.992 ( -2.541 -8.549 3.379) 9.538 5.268 ( 9.796 2.408 -0.579) 10.104 5.569 ( 2.138 2.797 2.985) 4.616 5.702 ( 1.181 -2.193 0.374) 2.519 5.826 ( -1.381 -2.327 -9.181) 9.571 5.847 ( -4.286 -5.478 6.123) 9.267 6.465 ( 4.376 -0.376 -4.116) 6.020 6.607 ( 7.201 3.845 -7.203) 10.887 7.006 ( -1.882 8.103 12.678) 15.163 7.149 ( 0.502 4.303 9.195) 10.165 7.170 ( 1.171 2.538 -8.472) 8.922 7.244 ( -2.239 -0.743 2.546) 3.471 7.451 ( -1.700 1.210 2.107) 2.965 7.599 ( 3.615 6.437 -11.165) 13.385 7.989 ( -2.239 -6.371 -0.277) 6.759 8.057 ( -0.390 -8.102 -4.920) 9.487 8.509 ( 2.823 -2.031 0.318) 3.492 8.594 ( 9.514 2.523 6.605) 11.854 9.165 ( -6.263 3.620 4.988) 8.787 9.296 ( 7.099 9.282 -2.049) 11.864 9.476 ( 5.926 -1.583 1.951) 6.437 9.802 ( 1.503 -2.340 -5.322) 6.005 10.098 ( 0.235 -4.475 -2.093) 4.946 10.498 ( 1.928 1.544 -7.305) 7.711 11.101 ( 2.331 0.806 -0.969) 2.650 11.595 ( 2.463 3.341 1.613) 4.453 13.002 ( 1.362 -1.457 14.898) 15.031 13.232 ( 10.460 -4.934 -7.711) 13.900 13.619 ( 0.921 2.222 6.490) 6.921 13.677 ( -2.281 1.048 -4.955) 5.555 14.301 ( 6.897 -2.479 -0.359) 7.338 14.538 ( -9.138 2.418 -1.940) 9.650 14.592 ( -7.757 -0.991 -6.401) 10.105 14.647 ( 4.306 1.439 3.134) 5.517 20.115 ( -0.925 -0.059 3.807) 3.918 20.214 ( -0.297 0.088 -4.468) 4.479 21.623 ( -1.098 -1.469 6.683) 6.930 22.094 ( 6.740 3.983 -4.310) 8.937 22.380 ( -2.831 -0.418 3.513) 4.531 22.633 ( 6.347 -2.549 -0.903) 6.899 23.437 ( -3.180 2.189 -1.264) 4.063 23.564 ( -5.519 -0.419 -3.696) 6.656 24.481 ( -5.387 0.538 11.790) 12.973 24.792 ( 1.786 3.107 -5.765) 6.788 24.899 ( 3.235 0.761 -2.264) 4.022 25.055 ( -0.855 -5.873 -0.580) 5.963 ======================= Grid point 244 (128/128) ======================= q-point: (-0.14 -0.14 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 5.87e-04 5.87e-04 5.87e-04 5.87e-04 1.25e-05 1.25e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.097 ( -18.166 -0.000 9.614) 20.553 2.127 ( -11.920 -0.000 18.531) 22.033 2.426 ( -8.619 -0.000 5.000) 9.964 2.511 ( 0.080 0.000 -9.033) 9.034 2.948 ( 2.682 0.000 3.452) 4.372 3.068 ( -6.133 -0.000 -8.416) 10.414 3.416 ( -12.599 -0.000 6.345) 14.107 3.698 ( -10.966 -0.000 -11.011) 15.540 3.804 ( 3.172 0.000 2.097) 3.802 4.094 ( 6.460 0.000 7.229) 9.694 4.173 ( -4.424 -0.000 14.156) 14.831 4.231 ( -1.146 -0.000 -1.787) 2.122 4.550 ( -1.233 -0.000 -0.830) 1.486 4.693 ( -1.586 -0.000 3.126) 3.505 4.906 ( -3.689 -0.000 1.630) 4.033 5.439 ( 11.170 0.000 -5.823) 12.597 5.640 ( 3.228 0.000 8.118) 8.736 5.651 ( -0.734 -0.000 -11.564) 11.587 5.757 ( -7.663 -0.000 14.458) 16.363 5.809 ( 3.405 0.000 -7.849) 8.556 6.501 ( 2.874 0.000 -5.320) 6.047 6.682 ( 2.140 0.000 -5.229) 5.650 7.070 ( -6.090 -0.000 14.657) 15.872 7.085 ( -1.253 -0.000 -12.395) 12.458 7.194 ( -2.966 -0.000 12.021) 12.381 7.319 ( 4.216 0.000 2.851) 5.090 7.431 ( 0.029 0.000 -1.631) 1.631 7.672 ( 3.164 0.000 -18.755) 19.020 7.913 ( -1.901 -0.000 8.772) 8.975 7.977 ( 0.202 0.000 -6.875) 6.878 8.553 ( 7.072 0.000 -0.200) 7.075 8.769 ( 8.311 0.000 6.012) 10.258 9.151 ( -2.958 -0.000 4.066) 5.028 9.461 ( 2.974 0.000 -4.171) 5.123 9.566 ( 8.668 0.000 7.517) 11.473 9.780 ( 1.714 0.000 -5.074) 5.356 10.033 ( -2.020 -0.000 -2.474) 3.194 10.466 ( -3.437 -0.000 -9.737) 10.326 11.174 ( 6.797 0.000 1.630) 6.990 11.635 ( -1.394 -0.000 -0.752) 1.584 13.067 ( 0.234 0.000 16.095) 16.097 13.322 ( 11.661 0.000 -6.164) 13.190 13.621 ( -1.186 -0.000 -9.861) 9.932 13.724 ( 6.519 0.000 7.276) 9.770 14.382 ( -13.690 -0.000 -9.285) 16.541 14.390 ( 8.143 0.000 1.503) 8.281 14.447 ( -9.370 -0.000 0.917) 9.414 14.708 ( 1.666 0.000 1.006) 1.946 20.112 ( -1.369 -0.000 3.587) 3.839 20.192 ( -0.558 -0.000 -3.906) 3.946 21.644 ( 1.711 0.000 7.691) 7.879 22.174 ( 1.031 0.000 -8.990) 9.049 22.381 ( 2.548 0.000 8.072) 8.465 22.691 ( 4.907 0.000 -0.845) 4.979 23.400 ( -1.936 -0.000 -5.730) 6.048 23.462 ( -7.387 -0.000 -0.017) 7.387 24.469 ( -3.154 -0.000 13.056) 13.431 24.831 ( 2.230 0.000 -8.446) 8.736 24.943 ( -0.199 -0.000 4.290) 4.295 24.971 ( 0.475 0.000 -5.566) 5.586 =================== 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 3/26460 10.0 837.152 1065.549 1271.467 0.000 432.671 0.000 3/26460 20.0 304.112 310.225 364.422 0.000 60.116 0.000 3/26460 30.0 133.457 134.712 148.792 0.000 18.909 0.000 3/26460 40.0 71.839 72.751 78.234 0.000 8.379 0.000 3/26460 50.0 45.184 45.861 48.974 0.000 4.733 0.000 3/26460 60.0 31.597 32.093 34.370 0.000 3.123 0.000 3/26460 70.0 23.780 24.146 26.041 0.000 2.270 0.000 3/26460 80.0 18.859 19.134 20.803 0.000 1.759 0.000 3/26460 90.0 15.542 15.753 17.262 0.000 1.424 0.000 3/26460 100.0 13.185 13.348 14.732 0.000 1.191 0.000 3/26460 110.0 11.438 11.565 12.845 0.000 1.020 0.000 3/26460 120.0 10.098 10.197 11.390 0.000 0.891 0.000 3/26460 130.0 9.042 9.118 10.236 0.000 0.791 0.000 3/26460 140.0 8.190 8.248 9.301 0.000 0.710 0.000 3/26460 150.0 7.489 7.532 8.528 0.000 0.644 0.000 3/26460 160.0 6.902 6.933 7.879 0.000 0.589 0.000 3/26460 170.0 6.404 6.425 7.327 0.000 0.543 0.000 3/26460 180.0 5.977 5.989 6.852 0.000 0.503 0.000 3/26460 190.0 5.606 5.610 6.439 0.000 0.468 0.000 3/26460 200.0 5.281 5.279 6.077 0.000 0.438 0.000 3/26460 210.0 4.994 4.986 5.756 0.000 0.411 0.000 3/26460 220.0 4.738 4.725 5.470 0.000 0.387 0.000 3/26460 230.0 4.509 4.492 5.213 0.000 0.365 0.000 3/26460 240.0 4.302 4.282 4.981 0.000 0.346 0.000 3/26460 250.0 4.114 4.091 4.771 0.000 0.328 0.000 3/26460 260.0 3.944 3.918 4.579 0.000 0.312 0.000 3/26460 270.0 3.787 3.759 4.404 0.000 0.298 0.000 3/26460 280.0 3.644 3.614 4.242 0.000 0.284 0.000 3/26460 290.0 3.511 3.480 4.093 0.000 0.272 0.000 3/26460 300.0 3.389 3.355 3.954 0.000 0.260 0.000 3/26460 310.0 3.275 3.240 3.826 0.000 0.250 0.000 3/26460 320.0 3.169 3.133 3.706 0.000 0.240 0.000 3/26460 330.0 3.070 3.033 3.594 0.000 0.231 0.000 3/26460 340.0 2.977 2.940 3.488 0.000 0.222 0.000 3/26460 350.0 2.890 2.852 3.390 0.000 0.214 0.000 3/26460 360.0 2.808 2.769 3.296 0.000 0.207 0.000 3/26460 370.0 2.731 2.692 3.209 0.000 0.200 0.000 3/26460 380.0 2.658 2.618 3.125 0.000 0.194 0.000 3/26460 390.0 2.589 2.549 3.047 0.000 0.188 0.000 3/26460 400.0 2.524 2.484 2.972 0.000 0.182 0.000 3/26460 410.0 2.462 2.421 2.901 0.000 0.176 0.000 3/26460 420.0 2.403 2.362 2.833 0.000 0.171 0.000 3/26460 430.0 2.346 2.306 2.769 0.000 0.166 0.000 3/26460 440.0 2.293 2.253 2.708 0.000 0.162 0.000 3/26460 450.0 2.242 2.202 2.649 0.000 0.157 0.000 3/26460 460.0 2.193 2.153 2.593 0.000 0.153 0.000 3/26460 470.0 2.146 2.107 2.539 0.000 0.149 0.000 3/26460 480.0 2.102 2.062 2.488 0.000 0.146 0.000 3/26460 490.0 2.059 2.019 2.438 0.000 0.142 0.000 3/26460 500.0 2.018 1.979 2.391 0.000 0.139 0.000 3/26460 510.0 1.978 1.939 2.345 0.000 0.135 0.000 3/26460 520.0 1.941 1.902 2.301 0.000 0.132 0.000 3/26460 530.0 1.904 1.865 2.259 0.000 0.129 0.000 3/26460 540.0 1.869 1.831 2.218 0.000 0.127 0.000 3/26460 550.0 1.835 1.797 2.179 0.000 0.124 0.000 3/26460 560.0 1.803 1.765 2.141 0.000 0.121 0.000 3/26460 570.0 1.771 1.734 2.104 0.000 0.119 0.000 3/26460 580.0 1.741 1.703 2.069 0.000 0.116 0.000 3/26460 590.0 1.712 1.674 2.035 0.000 0.114 0.000 3/26460 600.0 1.683 1.646 2.002 0.000 0.112 0.000 3/26460 610.0 1.656 1.619 1.970 0.000 0.110 0.000 3/26460 620.0 1.629 1.593 1.939 0.000 0.108 0.000 3/26460 630.0 1.604 1.568 1.909 0.000 0.106 0.000 3/26460 640.0 1.579 1.543 1.880 0.000 0.104 0.000 3/26460 650.0 1.555 1.519 1.851 0.000 0.102 0.000 3/26460 660.0 1.531 1.496 1.824 0.000 0.100 0.000 3/26460 670.0 1.509 1.474 1.798 0.000 0.099 0.000 3/26460 680.0 1.486 1.452 1.772 0.000 0.097 0.000 3/26460 690.0 1.465 1.431 1.747 0.000 0.095 0.000 3/26460 700.0 1.444 1.411 1.722 0.000 0.094 0.000 3/26460 710.0 1.424 1.391 1.699 0.000 0.092 0.000 3/26460 720.0 1.405 1.371 1.675 0.000 0.091 0.000 3/26460 730.0 1.385 1.352 1.653 0.000 0.089 0.000 3/26460 740.0 1.367 1.334 1.631 0.000 0.088 0.000 3/26460 750.0 1.349 1.316 1.610 0.000 0.087 0.000 3/26460 760.0 1.331 1.299 1.589 0.000 0.086 0.000 3/26460 770.0 1.314 1.282 1.569 0.000 0.084 0.000 3/26460 780.0 1.297 1.266 1.549 0.000 0.083 0.000 3/26460 790.0 1.281 1.250 1.530 0.000 0.082 0.000 3/26460 800.0 1.265 1.234 1.511 0.000 0.081 0.000 3/26460 810.0 1.250 1.219 1.493 0.000 0.080 0.000 3/26460 820.0 1.234 1.204 1.475 0.000 0.079 0.000 3/26460 830.0 1.220 1.189 1.458 0.000 0.078 0.000 3/26460 840.0 1.205 1.175 1.441 0.000 0.077 0.000 3/26460 850.0 1.191 1.161 1.424 0.000 0.076 0.000 3/26460 860.0 1.177 1.148 1.408 0.000 0.075 0.000 3/26460 870.0 1.164 1.135 1.392 0.000 0.074 0.000 3/26460 880.0 1.151 1.122 1.376 0.000 0.073 0.000 3/26460 890.0 1.138 1.109 1.361 0.000 0.072 0.000 3/26460 900.0 1.125 1.097 1.346 0.000 0.071 0.000 3/26460 910.0 1.113 1.085 1.332 0.000 0.070 0.000 3/26460 920.0 1.101 1.073 1.317 0.000 0.069 0.000 3/26460 930.0 1.089 1.062 1.304 0.000 0.068 0.000 3/26460 940.0 1.078 1.050 1.290 0.000 0.068 0.000 3/26460 950.0 1.067 1.039 1.277 0.000 0.067 0.000 3/26460 960.0 1.056 1.028 1.263 0.000 0.066 0.000 3/26460 970.0 1.045 1.018 1.251 0.000 0.065 0.000 3/26460 980.0 1.034 1.008 1.238 0.000 0.065 0.000 3/26460 990.0 1.024 0.997 1.226 0.000 0.064 0.000 3/26460 1000.0 1.014 0.987 1.214 0.000 0.063 0.000 3/26460 Thermal conductivity related properties were written into "kappa-m779.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 23:02:11]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|