----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 20:33:19]------------------------- 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 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.057036666691109 -2.970773775000000 0.000000000000000 b 4.057036666691109 2.970773775000000 0.000000000000000 c -1.698116713594387 0.000000000000000 8.088197743153524 Atomic positions (fractional): *1 Sr 0.83595356721698 0.16404643278302 0.75000000000000 87.620 2 Sr 0.16404643278302 0.83595356721698 0.25000000000000 87.620 *3 H 0.27853796567129 0.33022120848734 0.55461805856119 1.008 4 H 0.66977879151266 0.72146203432871 0.94538194143881 1.008 5 H 0.72146203432871 0.66977879151266 0.44538194143880 1.008 6 H 0.33022120848734 0.27853796567129 0.05461805856119 1.008 *7 H 0.20997152840999 0.60884632932264 0.86620913041560 1.008 8 H 0.60884632932264 0.20997152840999 0.36620913041560 1.008 9 H 0.39115367067736 0.79002847159001 0.63379086958440 1.008 10 H 0.79002847159001 0.39115367067736 0.13379086958440 1.008 *11 O 0.18125977798146 0.16369974271868 0.54541137053811 15.999 12 O 0.83630025728132 0.81874022201854 0.95458862946189 15.999 13 O 0.81874022201854 0.83630025728132 0.45458862946189 15.999 14 O 0.16369974271868 0.18125977798146 0.04541137053811 15.999 *15 O 0.35026972371170 0.01568968987058 0.68410229113273 15.999 16 O 0.98431031012942 0.64973027628830 0.81589770886727 15.999 17 O 0.64973027628830 0.98431031012942 0.31589770886727 15.999 18 O 0.01568968987058 0.35026972371170 0.18410229113273 15.999 *19 O 0.48814530402874 0.54820823908575 0.91931198509507 15.999 20 O 0.45179176091425 0.51185469597126 0.58068801490493 15.999 21 O 0.51185469597126 0.45179176091425 0.08068801490493 15.999 22 O 0.54820823908575 0.48814530402874 0.41931198509507 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 8.114073333382217 0.000000000000000 0.000000000000000 b 0.000000000000000 5.941547550000000 0.000000000000000 c -1.698116713594387 0.000000000000000 8.088197743153524 Atomic positions (fractional): *1 Sr 0.50000000000000 0.66404643278302 0.75000000000000 87.620 > 1 2 Sr 0.50000000000000 0.33595356721698 0.25000000000000 87.620 > 2 3 Sr 0.00000000000000 0.16404643278302 0.75000000000000 87.620 > 1 4 Sr 0.00000000000000 0.83595356721698 0.25000000000000 87.620 > 2 *5 H 0.30437958707932 0.02584162140803 0.55461805856119 1.008 > 3 6 H 0.69562041292068 0.02584162140803 0.94538194143881 1.008 > 4 7 H 0.69562041292068 0.97415837859197 0.44538194143880 1.008 > 5 8 H 0.30437958707932 0.97415837859197 0.05461805856119 1.008 > 6 *9 H 0.40940892886631 0.19943740045632 0.86620913041560 1.008 > 7 10 H 0.40940892886631 0.80056259954368 0.36620913041560 1.008 > 8 11 H 0.59059107113369 0.19943740045632 0.63379086958440 1.008 > 9 12 H 0.59059107113369 0.80056259954368 0.13379086958440 1.008 > 10 13 H 0.80437958707932 0.52584162140803 0.55461805856119 1.008 > 3 14 H 0.19562041292068 0.52584162140803 0.94538194143881 1.008 > 4 15 H 0.19562041292068 0.47415837859198 0.44538194143880 1.008 > 5 16 H 0.80437958707932 0.47415837859198 0.05461805856119 1.008 > 6 17 H 0.90940892886631 0.69943740045632 0.86620913041560 1.008 > 7 18 H 0.90940892886631 0.30056259954367 0.36620913041560 1.008 > 8 19 H 0.09059107113369 0.69943740045632 0.63379086958440 1.008 > 9 20 H 0.09059107113369 0.30056259954367 0.13379086958440 1.008 > 10 *21 O 0.17247976035007 0.99121998236861 0.54541137053811 15.999 > 11 22 O 0.82752023964993 0.99121998236861 0.95458862946189 15.999 > 12 23 O 0.82752023964993 0.00878001763139 0.45458862946189 15.999 > 13 24 O 0.17247976035007 0.00878001763139 0.04541137053811 15.999 > 14 *25 O 0.18297970679114 0.83270998307944 0.68410229113273 15.999 > 15 26 O 0.81702029320886 0.83270998307944 0.81589770886727 15.999 > 16 27 O 0.81702029320886 0.16729001692056 0.31589770886727 15.999 > 17 28 O 0.18297970679114 0.16729001692056 0.18410229113273 15.999 > 18 *29 O 0.51817677155724 0.03003146752851 0.91931198509507 15.999 > 19 30 O 0.48182322844276 0.03003146752851 0.58068801490493 15.999 > 20 31 O 0.48182322844276 0.96996853247149 0.08068801490493 15.999 > 21 32 O 0.51817677155724 0.96996853247149 0.41931198509507 15.999 > 22 33 O 0.67247976035007 0.49121998236861 0.54541137053811 15.999 > 11 34 O 0.32752023964993 0.49121998236861 0.95458862946189 15.999 > 12 35 O 0.32752023964993 0.50878001763139 0.45458862946189 15.999 > 13 36 O 0.67247976035007 0.50878001763139 0.04541137053811 15.999 > 14 37 O 0.68297970679114 0.33270998307944 0.68410229113273 15.999 > 15 38 O 0.31702029320886 0.33270998307944 0.81589770886727 15.999 > 16 39 O 0.31702029320886 0.66729001692056 0.31589770886727 15.999 > 17 40 O 0.68297970679114 0.66729001692056 0.18410229113273 15.999 > 18 41 O 0.01817677155724 0.53003146752851 0.91931198509507 15.999 > 19 42 O 0.98182322844276 0.53003146752851 0.58068801490493 15.999 > 20 43 O 0.98182322844276 0.46996853247149 0.08068801490493 15.999 > 21 44 O 0.01817677155724 0.46996853247149 0.41931198509507 15.999 > 22 -------------------------------- super cell -------------------------------- Lattice vectors: a 8.114073333382217 0.000000000000000 0.000000000000000 b 0.000000000000000 11.883095100000000 0.000000000000000 c -1.698116713594387 0.000000000000000 8.088197743153524 Atomic positions (fractional): *1 Sr 0.50000000000000 0.33202321639151 0.75000000000000 87.620 > 1 2 Sr 0.50000000000000 0.83202321639151 0.75000000000000 87.620 > 1 3 Sr 0.50000000000000 0.16797678360849 0.25000000000000 87.620 > 2 4 Sr 0.50000000000000 0.66797678360849 0.25000000000000 87.620 > 2 5 Sr 0.00000000000000 0.08202321639151 0.75000000000000 87.620 > 1 6 Sr 0.00000000000000 0.58202321639151 0.75000000000000 87.620 > 1 7 Sr 0.00000000000000 0.41797678360849 0.25000000000000 87.620 > 2 8 Sr 0.00000000000000 0.91797678360849 0.25000000000000 87.620 > 2 *9 H 0.30437958707932 0.01292081070401 0.55461805856119 1.008 > 3 10 H 0.30437958707932 0.51292081070401 0.55461805856119 1.008 > 3 11 H 0.69562041292068 0.01292081070401 0.94538194143881 1.008 > 4 12 H 0.69562041292068 0.51292081070401 0.94538194143881 1.008 > 4 13 H 0.69562041292068 0.48707918929599 0.44538194143880 1.008 > 5 14 H 0.69562041292068 0.98707918929599 0.44538194143880 1.008 > 5 15 H 0.30437958707932 0.48707918929599 0.05461805856119 1.008 > 6 16 H 0.30437958707932 0.98707918929599 0.05461805856119 1.008 > 6 *17 H 0.40940892886631 0.09971870022816 0.86620913041560 1.008 > 7 18 H 0.40940892886631 0.59971870022816 0.86620913041560 1.008 > 7 19 H 0.40940892886631 0.40028129977184 0.36620913041560 1.008 > 8 20 H 0.40940892886631 0.90028129977184 0.36620913041560 1.008 > 8 21 H 0.59059107113369 0.09971870022816 0.63379086958440 1.008 > 9 22 H 0.59059107113369 0.59971870022816 0.63379086958440 1.008 > 9 23 H 0.59059107113369 0.40028129977184 0.13379086958440 1.008 > 10 24 H 0.59059107113369 0.90028129977184 0.13379086958440 1.008 > 10 25 H 0.80437958707932 0.26292081070401 0.55461805856119 1.008 > 3 26 H 0.80437958707932 0.76292081070401 0.55461805856119 1.008 > 3 27 H 0.19562041292068 0.26292081070401 0.94538194143881 1.008 > 4 28 H 0.19562041292068 0.76292081070401 0.94538194143881 1.008 > 4 29 H 0.19562041292068 0.23707918929599 0.44538194143880 1.008 > 5 30 H 0.19562041292068 0.73707918929599 0.44538194143880 1.008 > 5 31 H 0.80437958707932 0.23707918929599 0.05461805856119 1.008 > 6 32 H 0.80437958707932 0.73707918929599 0.05461805856119 1.008 > 6 33 H 0.90940892886631 0.34971870022816 0.86620913041560 1.008 > 7 34 H 0.90940892886631 0.84971870022816 0.86620913041560 1.008 > 7 35 H 0.90940892886631 0.15028129977184 0.36620913041560 1.008 > 8 36 H 0.90940892886631 0.65028129977184 0.36620913041560 1.008 > 8 37 H 0.09059107113369 0.34971870022816 0.63379086958440 1.008 > 9 38 H 0.09059107113369 0.84971870022816 0.63379086958440 1.008 > 9 39 H 0.09059107113369 0.15028129977184 0.13379086958440 1.008 > 10 40 H 0.09059107113369 0.65028129977184 0.13379086958440 1.008 > 10 *41 O 0.17247976035007 0.49560999118431 0.54541137053811 15.999 > 11 42 O 0.17247976035007 0.99560999118431 0.54541137053811 15.999 > 11 43 O 0.82752023964993 0.49560999118431 0.95458862946189 15.999 > 12 44 O 0.82752023964993 0.99560999118431 0.95458862946189 15.999 > 12 45 O 0.82752023964993 0.00439000881569 0.45458862946189 15.999 > 13 46 O 0.82752023964993 0.50439000881569 0.45458862946189 15.999 > 13 47 O 0.17247976035007 0.00439000881569 0.04541137053811 15.999 > 14 48 O 0.17247976035007 0.50439000881569 0.04541137053811 15.999 > 14 *49 O 0.18297970679114 0.41635499153972 0.68410229113273 15.999 > 15 50 O 0.18297970679114 0.91635499153972 0.68410229113273 15.999 > 15 51 O 0.81702029320886 0.41635499153972 0.81589770886727 15.999 > 16 52 O 0.81702029320886 0.91635499153972 0.81589770886727 15.999 > 16 53 O 0.81702029320886 0.08364500846028 0.31589770886727 15.999 > 17 54 O 0.81702029320886 0.58364500846028 0.31589770886727 15.999 > 17 55 O 0.18297970679114 0.08364500846028 0.18410229113273 15.999 > 18 56 O 0.18297970679114 0.58364500846028 0.18410229113273 15.999 > 18 *57 O 0.51817677155724 0.01501573376425 0.91931198509507 15.999 > 19 58 O 0.51817677155724 0.51501573376425 0.91931198509507 15.999 > 19 59 O 0.48182322844276 0.01501573376425 0.58068801490493 15.999 > 20 60 O 0.48182322844276 0.51501573376425 0.58068801490493 15.999 > 20 61 O 0.48182322844276 0.48498426623575 0.08068801490493 15.999 > 21 62 O 0.48182322844276 0.98498426623575 0.08068801490493 15.999 > 21 63 O 0.51817677155724 0.48498426623575 0.41931198509507 15.999 > 22 64 O 0.51817677155724 0.98498426623575 0.41931198509507 15.999 > 22 65 O 0.67247976035007 0.24560999118431 0.54541137053811 15.999 > 11 66 O 0.67247976035007 0.74560999118431 0.54541137053811 15.999 > 11 67 O 0.32752023964993 0.24560999118431 0.95458862946189 15.999 > 12 68 O 0.32752023964993 0.74560999118431 0.95458862946189 15.999 > 12 69 O 0.32752023964993 0.25439000881569 0.45458862946189 15.999 > 13 70 O 0.32752023964993 0.75439000881569 0.45458862946189 15.999 > 13 71 O 0.67247976035007 0.25439000881569 0.04541137053811 15.999 > 14 72 O 0.67247976035007 0.75439000881569 0.04541137053811 15.999 > 14 73 O 0.68297970679114 0.16635499153972 0.68410229113273 15.999 > 15 74 O 0.68297970679114 0.66635499153972 0.68410229113273 15.999 > 15 75 O 0.31702029320886 0.16635499153972 0.81589770886727 15.999 > 16 76 O 0.31702029320886 0.66635499153972 0.81589770886727 15.999 > 16 77 O 0.31702029320886 0.33364500846028 0.31589770886727 15.999 > 17 78 O 0.31702029320886 0.83364500846028 0.31589770886727 15.999 > 17 79 O 0.68297970679114 0.33364500846028 0.18410229113273 15.999 > 18 80 O 0.68297970679114 0.83364500846028 0.18410229113273 15.999 > 18 81 O 0.01817677155724 0.26501573376425 0.91931198509507 15.999 > 19 82 O 0.01817677155724 0.76501573376425 0.91931198509507 15.999 > 19 83 O 0.98182322844276 0.26501573376425 0.58068801490493 15.999 > 20 84 O 0.98182322844276 0.76501573376425 0.58068801490493 15.999 > 20 85 O 0.98182322844276 0.23498426623575 0.08068801490493 15.999 > 21 86 O 0.98182322844276 0.73498426623575 0.08068801490493 15.999 > 21 87 O 0.01817677155724 0.23498426623575 0.41931198509507 15.999 > 22 88 O 0.01817677155724 0.73498426623575 0.41931198509507 15.999 > 22 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.9264185 0.0000000 -0.0980513 0.0000000 2.9315761 0.0000000 -0.0980513 0.0000000 2.9736114 -------------------------- Born effective charges -------------------------- 1 Sr 2.4222606 0.0000000 -0.1015002 0.0000000 2.4706831 0.0000000 0.0406858 0.0000000 2.4679422 2 Sr 2.4222606 0.0000000 -0.1015002 0.0000000 2.4706831 0.0000000 0.0406858 0.0000000 2.4679422 3 H 2.0301760 0.2020815 0.1638920 0.3739962 0.3265368 0.0750759 -0.1664002 -0.0026364 0.2312217 4 H 2.0301760 -0.2020815 0.1638920 -0.3739962 0.3265368 -0.0750759 -0.1664002 0.0026364 0.2312217 5 H 2.0301760 0.2020815 0.1638920 0.3739962 0.3265368 0.0750759 -0.1664002 -0.0026364 0.2312217 6 H 2.0301760 -0.2020815 0.1638920 -0.3739962 0.3265368 -0.0750759 -0.1664002 0.0026364 0.2312217 7 H 0.9099477 -0.8042578 0.3489540 -0.9172267 1.4392530 -0.5053403 0.3095411 -0.4083741 0.4016414 8 H 0.9099477 0.8042578 0.3489540 0.9172267 1.4392530 0.5053403 0.3095411 0.4083741 0.4016414 9 H 0.9099477 0.8042578 0.3489540 0.9172267 1.4392530 0.5053403 0.3095411 0.4083741 0.4016414 10 H 0.9099477 -0.8042578 0.3489540 -0.9172267 1.4392530 -0.5053403 0.3095411 -0.4083741 0.4016414 11 O -1.5354282 -0.1839575 0.0206478 -0.2144398 -0.5491495 -0.1437749 0.0938157 -0.2445183 -0.6940555 12 O -1.5354282 0.1839575 0.0206478 0.2144398 -0.5491495 0.1437749 0.0938157 0.2445183 -0.6940555 13 O -1.5354282 -0.1839575 0.0206478 -0.2144398 -0.5491495 -0.1437749 0.0938157 -0.2445183 -0.6940555 14 O -1.5354282 0.1839575 0.0206478 0.2144398 -0.5491495 0.1437749 0.0938157 0.2445183 -0.6940555 15 O -1.0917060 -0.1932928 -0.2033242 -0.2123936 -1.2131087 -0.3909801 -0.1514086 -0.2114600 -0.5045549 16 O -1.0917060 0.1932928 -0.2033242 0.2123936 -1.2131087 0.3909801 -0.1514086 0.2114600 -0.5045549 17 O -1.0917060 -0.1932928 -0.2033242 -0.2123936 -1.2131087 -0.3909801 -0.1514086 -0.2114600 -0.5045549 18 O -1.0917060 0.1932928 -0.2033242 0.2123936 -1.2131087 0.3909801 -0.1514086 0.2114600 -0.5045549 19 O -1.5241198 0.4244931 -0.2794195 0.5858044 -1.2388732 0.0808671 -0.1058910 0.0118070 -0.6682238 20 O -1.5241198 -0.4244931 -0.2794195 -0.5858044 -1.2388732 -0.0808671 -0.1058910 -0.0118070 -0.6682238 21 O -1.5241198 0.4244931 -0.2794195 0.5858044 -1.2388732 0.0808671 -0.1058910 0.0118070 -0.6682238 22 O -1.5241198 -0.4244931 -0.2794195 -0.5858044 -1.2388732 -0.0808671 -0.1058910 -0.0118070 -0.6682238 ---------------------------------------------------------------------------- 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: 264/264 Permutation basis: 10686/10686 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2279 Number of blocks in projector: 2279 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: 488 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 480 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 480 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 277 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 277 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 277 Use standard eigh solver. Tree of FC basis block matrices: - (2279, 2230), data: False |-- (277, 271), data: True |-- (277, 271), data: True |-- (277, 271), data: True |-- (480, 470), data: True |-- (480, 470), data: True |-- (488, 477), data: True ----- Solver_atoms: 1 -- 88 / 88 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 720 - Time: 0.626 Solver_block: 200 / 720 - Time: 0.525 Solver_block: 300 / 720 - Time: 0.528 Solver_block: 400 / 720 - Time: 0.518 Solver_block: 500 / 720 - Time: 0.525 Solver_block: 600 / 720 - Time: 0.522 Solver_block: 700 / 720 - Time: 0.517 Solver_block: 720 / 720 - Time: 0.197 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 4.040 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (yy) 0.00000000 (yy) Permutation basis: 264/264 Permutation basis: 10686/10686 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2279 Number of blocks in projector: 2279 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: 488 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 480 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 480 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 277 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 277 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 277 Use standard eigh solver. Tree of FC basis block matrices: - (2279, 2230), data: False |-- (277, 271), data: True |-- (277, 271), data: True |-- (277, 271), data: True |-- (480, 470), data: True |-- (480, 470), data: True |-- (488, 477), 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 2026-01-08 20:33:47]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 20:33:48]------------------------- 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 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.057036666691109 -2.970773775000000 0.000000000000000 b 4.057036666691109 2.970773775000000 0.000000000000000 c -1.698116713594387 0.000000000000000 8.088197743153524 Atomic positions (fractional): 1 Sr 0.83595356721698 0.16404643278302 0.75000000000000 87.620 2 Sr 0.16404643278302 0.83595356721698 0.25000000000000 87.620 3 H 0.27853796567129 0.33022120848734 0.55461805856119 1.008 4 H 0.66977879151266 0.72146203432871 0.94538194143881 1.008 5 H 0.72146203432871 0.66977879151266 0.44538194143880 1.008 6 H 0.33022120848734 0.27853796567129 0.05461805856119 1.008 7 H 0.20997152840999 0.60884632932264 0.86620913041560 1.008 8 H 0.60884632932264 0.20997152840999 0.36620913041560 1.008 9 H 0.39115367067736 0.79002847159001 0.63379086958440 1.008 10 H 0.79002847159001 0.39115367067736 0.13379086958440 1.008 11 O 0.18125977798146 0.16369974271868 0.54541137053811 15.999 12 O 0.83630025728132 0.81874022201854 0.95458862946189 15.999 13 O 0.81874022201854 0.83630025728132 0.45458862946189 15.999 14 O 0.16369974271868 0.18125977798146 0.04541137053811 15.999 15 O 0.35026972371170 0.01568968987058 0.68410229113273 15.999 16 O 0.98431031012942 0.64973027628830 0.81589770886727 15.999 17 O 0.64973027628830 0.98431031012942 0.31589770886727 15.999 18 O 0.01568968987058 0.35026972371170 0.18410229113273 15.999 19 O 0.48814530402874 0.54820823908575 0.91931198509507 15.999 20 O 0.45179176091425 0.51185469597126 0.58068801490493 15.999 21 O 0.51185469597126 0.45179176091425 0.08068801490493 15.999 22 O 0.54820823908575 0.48814530402874 0.41931198509507 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 8.114073333382217 0.000000000000000 0.000000000000000 b 0.000000000000000 11.883095100000000 0.000000000000000 c -1.698116713594387 0.000000000000000 8.088197743153524 Atomic positions (fractional): 1 Sr 0.50000000000000 0.33202321639151 0.75000000000000 87.620 > 1 2 Sr 0.50000000000000 0.83202321639151 0.75000000000000 87.620 > 1 3 Sr 0.50000000000000 0.16797678360849 0.25000000000000 87.620 > 3 4 Sr 0.50000000000000 0.66797678360849 0.25000000000000 87.620 > 3 5 Sr 0.00000000000000 0.08202321639151 0.75000000000000 87.620 > 1 6 Sr 0.00000000000000 0.58202321639151 0.75000000000000 87.620 > 1 7 Sr 0.00000000000000 0.41797678360849 0.25000000000000 87.620 > 3 8 Sr 0.00000000000000 0.91797678360849 0.25000000000000 87.620 > 3 9 H 0.30437958707932 0.01292081070401 0.55461805856119 1.008 > 9 10 H 0.30437958707932 0.51292081070401 0.55461805856119 1.008 > 9 11 H 0.69562041292068 0.01292081070401 0.94538194143881 1.008 > 11 12 H 0.69562041292068 0.51292081070401 0.94538194143881 1.008 > 11 13 H 0.69562041292068 0.48707918929599 0.44538194143880 1.008 > 13 14 H 0.69562041292068 0.98707918929599 0.44538194143880 1.008 > 13 15 H 0.30437958707932 0.48707918929599 0.05461805856119 1.008 > 15 16 H 0.30437958707932 0.98707918929599 0.05461805856119 1.008 > 15 17 H 0.40940892886631 0.09971870022816 0.86620913041560 1.008 > 17 18 H 0.40940892886631 0.59971870022816 0.86620913041560 1.008 > 17 19 H 0.40940892886631 0.40028129977184 0.36620913041560 1.008 > 19 20 H 0.40940892886631 0.90028129977184 0.36620913041560 1.008 > 19 21 H 0.59059107113369 0.09971870022816 0.63379086958440 1.008 > 21 22 H 0.59059107113369 0.59971870022816 0.63379086958440 1.008 > 21 23 H 0.59059107113369 0.40028129977184 0.13379086958440 1.008 > 23 24 H 0.59059107113369 0.90028129977184 0.13379086958440 1.008 > 23 25 H 0.80437958707932 0.26292081070401 0.55461805856119 1.008 > 9 26 H 0.80437958707932 0.76292081070401 0.55461805856119 1.008 > 9 27 H 0.19562041292068 0.26292081070401 0.94538194143881 1.008 > 11 28 H 0.19562041292068 0.76292081070401 0.94538194143881 1.008 > 11 29 H 0.19562041292068 0.23707918929599 0.44538194143880 1.008 > 13 30 H 0.19562041292068 0.73707918929599 0.44538194143880 1.008 > 13 31 H 0.80437958707932 0.23707918929599 0.05461805856119 1.008 > 15 32 H 0.80437958707932 0.73707918929599 0.05461805856119 1.008 > 15 33 H 0.90940892886631 0.34971870022816 0.86620913041560 1.008 > 17 34 H 0.90940892886631 0.84971870022816 0.86620913041560 1.008 > 17 35 H 0.90940892886631 0.15028129977184 0.36620913041560 1.008 > 19 36 H 0.90940892886631 0.65028129977184 0.36620913041560 1.008 > 19 37 H 0.09059107113369 0.34971870022816 0.63379086958440 1.008 > 21 38 H 0.09059107113369 0.84971870022816 0.63379086958440 1.008 > 21 39 H 0.09059107113369 0.15028129977184 0.13379086958440 1.008 > 23 40 H 0.09059107113369 0.65028129977184 0.13379086958440 1.008 > 23 41 O 0.17247976035007 0.49560999118431 0.54541137053811 15.999 > 41 42 O 0.17247976035007 0.99560999118431 0.54541137053811 15.999 > 41 43 O 0.82752023964993 0.49560999118431 0.95458862946189 15.999 > 43 44 O 0.82752023964993 0.99560999118431 0.95458862946189 15.999 > 43 45 O 0.82752023964993 0.00439000881569 0.45458862946189 15.999 > 45 46 O 0.82752023964993 0.50439000881569 0.45458862946189 15.999 > 45 47 O 0.17247976035007 0.00439000881569 0.04541137053811 15.999 > 47 48 O 0.17247976035007 0.50439000881569 0.04541137053811 15.999 > 47 49 O 0.18297970679114 0.41635499153972 0.68410229113273 15.999 > 49 50 O 0.18297970679114 0.91635499153972 0.68410229113273 15.999 > 49 51 O 0.81702029320886 0.41635499153972 0.81589770886727 15.999 > 51 52 O 0.81702029320886 0.91635499153972 0.81589770886727 15.999 > 51 53 O 0.81702029320886 0.08364500846028 0.31589770886727 15.999 > 53 54 O 0.81702029320886 0.58364500846028 0.31589770886727 15.999 > 53 55 O 0.18297970679114 0.08364500846028 0.18410229113273 15.999 > 55 56 O 0.18297970679114 0.58364500846028 0.18410229113273 15.999 > 55 57 O 0.51817677155724 0.01501573376425 0.91931198509507 15.999 > 57 58 O 0.51817677155724 0.51501573376425 0.91931198509507 15.999 > 57 59 O 0.48182322844276 0.01501573376425 0.58068801490493 15.999 > 59 60 O 0.48182322844276 0.51501573376425 0.58068801490493 15.999 > 59 61 O 0.48182322844276 0.48498426623575 0.08068801490493 15.999 > 61 62 O 0.48182322844276 0.98498426623575 0.08068801490493 15.999 > 61 63 O 0.51817677155724 0.48498426623575 0.41931198509507 15.999 > 63 64 O 0.51817677155724 0.98498426623575 0.41931198509507 15.999 > 63 65 O 0.67247976035007 0.24560999118431 0.54541137053811 15.999 > 41 66 O 0.67247976035007 0.74560999118431 0.54541137053811 15.999 > 41 67 O 0.32752023964993 0.24560999118431 0.95458862946189 15.999 > 43 68 O 0.32752023964993 0.74560999118431 0.95458862946189 15.999 > 43 69 O 0.32752023964993 0.25439000881569 0.45458862946189 15.999 > 45 70 O 0.32752023964993 0.75439000881569 0.45458862946189 15.999 > 45 71 O 0.67247976035007 0.25439000881569 0.04541137053811 15.999 > 47 72 O 0.67247976035007 0.75439000881569 0.04541137053811 15.999 > 47 73 O 0.68297970679114 0.16635499153972 0.68410229113273 15.999 > 49 74 O 0.68297970679114 0.66635499153972 0.68410229113273 15.999 > 49 75 O 0.31702029320886 0.16635499153972 0.81589770886727 15.999 > 51 76 O 0.31702029320886 0.66635499153972 0.81589770886727 15.999 > 51 77 O 0.31702029320886 0.33364500846028 0.31589770886727 15.999 > 53 78 O 0.31702029320886 0.83364500846028 0.31589770886727 15.999 > 53 79 O 0.68297970679114 0.33364500846028 0.18410229113273 15.999 > 55 80 O 0.68297970679114 0.83364500846028 0.18410229113273 15.999 > 55 81 O 0.01817677155724 0.26501573376425 0.91931198509507 15.999 > 57 82 O 0.01817677155724 0.76501573376425 0.91931198509507 15.999 > 57 83 O 0.98182322844276 0.26501573376425 0.58068801490493 15.999 > 59 84 O 0.98182322844276 0.76501573376425 0.58068801490493 15.999 > 59 85 O 0.98182322844276 0.23498426623575 0.08068801490493 15.999 > 61 86 O 0.98182322844276 0.73498426623575 0.08068801490493 15.999 > 61 87 O 0.01817677155724 0.23498426623575 0.41931198509507 15.999 > 63 88 O 0.01817677155724 0.73498426623575 0.41931198509507 15.999 > 63 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.9264185 0.0000000 -0.0980513 0.0000000 2.9315761 0.0000000 -0.0980513 0.0000000 2.9736114 -------------------------- Born effective charges -------------------------- 1 Sr 2.4222606 0.0000000 -0.1015002 0.0000000 2.4706831 0.0000000 0.0406858 0.0000000 2.4679422 2 Sr 2.4222606 0.0000000 -0.1015002 0.0000000 2.4706831 0.0000000 0.0406858 0.0000000 2.4679422 3 H 2.0301760 0.2020815 0.1638920 0.3739962 0.3265368 0.0750759 -0.1664002 -0.0026364 0.2312217 4 H 2.0301760 -0.2020815 0.1638920 -0.3739962 0.3265368 -0.0750759 -0.1664002 0.0026364 0.2312217 5 H 2.0301760 0.2020815 0.1638920 0.3739962 0.3265368 0.0750759 -0.1664002 -0.0026364 0.2312217 6 H 2.0301760 -0.2020815 0.1638920 -0.3739962 0.3265368 -0.0750759 -0.1664002 0.0026364 0.2312217 7 H 0.9099477 -0.8042578 0.3489540 -0.9172267 1.4392530 -0.5053403 0.3095411 -0.4083741 0.4016414 8 H 0.9099477 0.8042578 0.3489540 0.9172267 1.4392530 0.5053403 0.3095411 0.4083741 0.4016414 9 H 0.9099477 0.8042578 0.3489540 0.9172267 1.4392530 0.5053403 0.3095411 0.4083741 0.4016414 10 H 0.9099477 -0.8042578 0.3489540 -0.9172267 1.4392530 -0.5053403 0.3095411 -0.4083741 0.4016414 11 O -1.5354282 -0.1839575 0.0206478 -0.2144398 -0.5491495 -0.1437749 0.0938157 -0.2445183 -0.6940555 12 O -1.5354282 0.1839575 0.0206478 0.2144398 -0.5491495 0.1437749 0.0938157 0.2445183 -0.6940555 13 O -1.5354282 -0.1839575 0.0206478 -0.2144398 -0.5491495 -0.1437749 0.0938157 -0.2445183 -0.6940555 14 O -1.5354282 0.1839575 0.0206478 0.2144398 -0.5491495 0.1437749 0.0938157 0.2445183 -0.6940555 15 O -1.0917060 -0.1932928 -0.2033242 -0.2123936 -1.2131087 -0.3909801 -0.1514086 -0.2114600 -0.5045549 16 O -1.0917060 0.1932928 -0.2033242 0.2123936 -1.2131087 0.3909801 -0.1514086 0.2114600 -0.5045549 17 O -1.0917060 -0.1932928 -0.2033242 -0.2123936 -1.2131087 -0.3909801 -0.1514086 -0.2114600 -0.5045549 18 O -1.0917060 0.1932928 -0.2033242 0.2123936 -1.2131087 0.3909801 -0.1514086 0.2114600 -0.5045549 19 O -1.5241198 0.4244931 -0.2794195 0.5858044 -1.2388732 0.0808671 -0.1058910 0.0118070 -0.6682238 20 O -1.5241198 -0.4244931 -0.2794195 -0.5858044 -1.2388732 -0.0808671 -0.1058910 -0.0118070 -0.6682238 21 O -1.5241198 0.4244931 -0.2794195 0.5858044 -1.2388732 0.0808671 -0.1058910 0.0118070 -0.6682238 22 O -1.5241198 -0.4244931 -0.2794195 -0.5858044 -1.2388732 -0.0808671 -0.1058910 -0.0118070 -0.6682238 ---------------------------------------------------------------------------- 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] [-0.0021 0.0000 0.0098] [ 0.0021 0.0000 -0.0098] Computing fc3[ 9, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0021 0.0000 0.0098] [ 0.0021 0.0000 -0.0098] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0021 0.0000 0.0098] [ 0.0021 0.0000 -0.0098] Computing fc3[ 41, 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] [-0.0021 0.0000 0.0098] [ 0.0021 0.0000 -0.0098] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0021 0.0000 0.0098] [ 0.0021 0.0000 -0.0098] 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] [-0.0021 0.0000 0.0098] [ 0.0021 0.0000 -0.0098] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000001 (yyy) 0.00000001 (yyy) 0.00000001 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000001 (zx) -0.00000001 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 20:34:06]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 20:34:06]------------------------- 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 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.057036666691109 -2.970773775000000 0.000000000000000 b 4.057036666691109 2.970773775000000 0.000000000000000 c -1.698116713594387 0.000000000000000 8.088197743153524 Atomic positions (fractional): 1 Sr 0.83595356721698 0.16404643278302 0.75000000000000 87.620 2 Sr 0.16404643278302 0.83595356721698 0.25000000000000 87.620 3 H 0.27853796567129 0.33022120848734 0.55461805856119 1.008 4 H 0.66977879151266 0.72146203432871 0.94538194143881 1.008 5 H 0.72146203432871 0.66977879151266 0.44538194143880 1.008 6 H 0.33022120848734 0.27853796567129 0.05461805856119 1.008 7 H 0.20997152840999 0.60884632932264 0.86620913041560 1.008 8 H 0.60884632932264 0.20997152840999 0.36620913041560 1.008 9 H 0.39115367067736 0.79002847159001 0.63379086958440 1.008 10 H 0.79002847159001 0.39115367067736 0.13379086958440 1.008 11 O 0.18125977798146 0.16369974271868 0.54541137053811 15.999 12 O 0.83630025728132 0.81874022201854 0.95458862946189 15.999 13 O 0.81874022201854 0.83630025728132 0.45458862946189 15.999 14 O 0.16369974271868 0.18125977798146 0.04541137053811 15.999 15 O 0.35026972371170 0.01568968987058 0.68410229113273 15.999 16 O 0.98431031012942 0.64973027628830 0.81589770886727 15.999 17 O 0.64973027628830 0.98431031012942 0.31589770886727 15.999 18 O 0.01568968987058 0.35026972371170 0.18410229113273 15.999 19 O 0.48814530402874 0.54820823908575 0.91931198509507 15.999 20 O 0.45179176091425 0.51185469597126 0.58068801490493 15.999 21 O 0.51185469597126 0.45179176091425 0.08068801490493 15.999 22 O 0.54820823908575 0.48814530402874 0.41931198509507 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 8.114073333382217 0.000000000000000 0.000000000000000 b 0.000000000000000 11.883095100000000 0.000000000000000 c -1.698116713594387 0.000000000000000 8.088197743153524 Atomic positions (fractional): 1 Sr 0.50000000000000 0.33202321639151 0.75000000000000 87.620 > 1 2 Sr 0.50000000000000 0.83202321639151 0.75000000000000 87.620 > 1 3 Sr 0.50000000000000 0.16797678360849 0.25000000000000 87.620 > 3 4 Sr 0.50000000000000 0.66797678360849 0.25000000000000 87.620 > 3 5 Sr 0.00000000000000 0.08202321639151 0.75000000000000 87.620 > 1 6 Sr 0.00000000000000 0.58202321639151 0.75000000000000 87.620 > 1 7 Sr 0.00000000000000 0.41797678360849 0.25000000000000 87.620 > 3 8 Sr 0.00000000000000 0.91797678360849 0.25000000000000 87.620 > 3 9 H 0.30437958707932 0.01292081070401 0.55461805856119 1.008 > 9 10 H 0.30437958707932 0.51292081070401 0.55461805856119 1.008 > 9 11 H 0.69562041292068 0.01292081070401 0.94538194143881 1.008 > 11 12 H 0.69562041292068 0.51292081070401 0.94538194143881 1.008 > 11 13 H 0.69562041292068 0.48707918929599 0.44538194143880 1.008 > 13 14 H 0.69562041292068 0.98707918929599 0.44538194143880 1.008 > 13 15 H 0.30437958707932 0.48707918929599 0.05461805856119 1.008 > 15 16 H 0.30437958707932 0.98707918929599 0.05461805856119 1.008 > 15 17 H 0.40940892886631 0.09971870022816 0.86620913041560 1.008 > 17 18 H 0.40940892886631 0.59971870022816 0.86620913041560 1.008 > 17 19 H 0.40940892886631 0.40028129977184 0.36620913041560 1.008 > 19 20 H 0.40940892886631 0.90028129977184 0.36620913041560 1.008 > 19 21 H 0.59059107113369 0.09971870022816 0.63379086958440 1.008 > 21 22 H 0.59059107113369 0.59971870022816 0.63379086958440 1.008 > 21 23 H 0.59059107113369 0.40028129977184 0.13379086958440 1.008 > 23 24 H 0.59059107113369 0.90028129977184 0.13379086958440 1.008 > 23 25 H 0.80437958707932 0.26292081070401 0.55461805856119 1.008 > 9 26 H 0.80437958707932 0.76292081070401 0.55461805856119 1.008 > 9 27 H 0.19562041292068 0.26292081070401 0.94538194143881 1.008 > 11 28 H 0.19562041292068 0.76292081070401 0.94538194143881 1.008 > 11 29 H 0.19562041292068 0.23707918929599 0.44538194143880 1.008 > 13 30 H 0.19562041292068 0.73707918929599 0.44538194143880 1.008 > 13 31 H 0.80437958707932 0.23707918929599 0.05461805856119 1.008 > 15 32 H 0.80437958707932 0.73707918929599 0.05461805856119 1.008 > 15 33 H 0.90940892886631 0.34971870022816 0.86620913041560 1.008 > 17 34 H 0.90940892886631 0.84971870022816 0.86620913041560 1.008 > 17 35 H 0.90940892886631 0.15028129977184 0.36620913041560 1.008 > 19 36 H 0.90940892886631 0.65028129977184 0.36620913041560 1.008 > 19 37 H 0.09059107113369 0.34971870022816 0.63379086958440 1.008 > 21 38 H 0.09059107113369 0.84971870022816 0.63379086958440 1.008 > 21 39 H 0.09059107113369 0.15028129977184 0.13379086958440 1.008 > 23 40 H 0.09059107113369 0.65028129977184 0.13379086958440 1.008 > 23 41 O 0.17247976035007 0.49560999118431 0.54541137053811 15.999 > 41 42 O 0.17247976035007 0.99560999118431 0.54541137053811 15.999 > 41 43 O 0.82752023964993 0.49560999118431 0.95458862946189 15.999 > 43 44 O 0.82752023964993 0.99560999118431 0.95458862946189 15.999 > 43 45 O 0.82752023964993 0.00439000881569 0.45458862946189 15.999 > 45 46 O 0.82752023964993 0.50439000881569 0.45458862946189 15.999 > 45 47 O 0.17247976035007 0.00439000881569 0.04541137053811 15.999 > 47 48 O 0.17247976035007 0.50439000881569 0.04541137053811 15.999 > 47 49 O 0.18297970679114 0.41635499153972 0.68410229113273 15.999 > 49 50 O 0.18297970679114 0.91635499153972 0.68410229113273 15.999 > 49 51 O 0.81702029320886 0.41635499153972 0.81589770886727 15.999 > 51 52 O 0.81702029320886 0.91635499153972 0.81589770886727 15.999 > 51 53 O 0.81702029320886 0.08364500846028 0.31589770886727 15.999 > 53 54 O 0.81702029320886 0.58364500846028 0.31589770886727 15.999 > 53 55 O 0.18297970679114 0.08364500846028 0.18410229113273 15.999 > 55 56 O 0.18297970679114 0.58364500846028 0.18410229113273 15.999 > 55 57 O 0.51817677155724 0.01501573376425 0.91931198509507 15.999 > 57 58 O 0.51817677155724 0.51501573376425 0.91931198509507 15.999 > 57 59 O 0.48182322844276 0.01501573376425 0.58068801490493 15.999 > 59 60 O 0.48182322844276 0.51501573376425 0.58068801490493 15.999 > 59 61 O 0.48182322844276 0.48498426623575 0.08068801490493 15.999 > 61 62 O 0.48182322844276 0.98498426623575 0.08068801490493 15.999 > 61 63 O 0.51817677155724 0.48498426623575 0.41931198509507 15.999 > 63 64 O 0.51817677155724 0.98498426623575 0.41931198509507 15.999 > 63 65 O 0.67247976035007 0.24560999118431 0.54541137053811 15.999 > 41 66 O 0.67247976035007 0.74560999118431 0.54541137053811 15.999 > 41 67 O 0.32752023964993 0.24560999118431 0.95458862946189 15.999 > 43 68 O 0.32752023964993 0.74560999118431 0.95458862946189 15.999 > 43 69 O 0.32752023964993 0.25439000881569 0.45458862946189 15.999 > 45 70 O 0.32752023964993 0.75439000881569 0.45458862946189 15.999 > 45 71 O 0.67247976035007 0.25439000881569 0.04541137053811 15.999 > 47 72 O 0.67247976035007 0.75439000881569 0.04541137053811 15.999 > 47 73 O 0.68297970679114 0.16635499153972 0.68410229113273 15.999 > 49 74 O 0.68297970679114 0.66635499153972 0.68410229113273 15.999 > 49 75 O 0.31702029320886 0.16635499153972 0.81589770886727 15.999 > 51 76 O 0.31702029320886 0.66635499153972 0.81589770886727 15.999 > 51 77 O 0.31702029320886 0.33364500846028 0.31589770886727 15.999 > 53 78 O 0.31702029320886 0.83364500846028 0.31589770886727 15.999 > 53 79 O 0.68297970679114 0.33364500846028 0.18410229113273 15.999 > 55 80 O 0.68297970679114 0.83364500846028 0.18410229113273 15.999 > 55 81 O 0.01817677155724 0.26501573376425 0.91931198509507 15.999 > 57 82 O 0.01817677155724 0.76501573376425 0.91931198509507 15.999 > 57 83 O 0.98182322844276 0.26501573376425 0.58068801490493 15.999 > 59 84 O 0.98182322844276 0.76501573376425 0.58068801490493 15.999 > 59 85 O 0.98182322844276 0.23498426623575 0.08068801490493 15.999 > 61 86 O 0.98182322844276 0.73498426623575 0.08068801490493 15.999 > 61 87 O 0.01817677155724 0.23498426623575 0.41931198509507 15.999 > 63 88 O 0.01817677155724 0.73498426623575 0.41931198509507 15.999 > 63 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.9264185 0.0000000 -0.0980513 0.0000000 2.9315761 0.0000000 -0.0980513 0.0000000 2.9736114 -------------------------- Born effective charges -------------------------- 1 Sr 2.4222606 0.0000000 -0.1015002 0.0000000 2.4706831 0.0000000 0.0406858 0.0000000 2.4679422 2 Sr 2.4222606 0.0000000 -0.1015002 0.0000000 2.4706831 0.0000000 0.0406858 0.0000000 2.4679422 3 H 2.0301760 0.2020815 0.1638920 0.3739962 0.3265368 0.0750759 -0.1664002 -0.0026364 0.2312217 4 H 2.0301760 -0.2020815 0.1638920 -0.3739962 0.3265368 -0.0750759 -0.1664002 0.0026364 0.2312217 5 H 2.0301760 0.2020815 0.1638920 0.3739962 0.3265368 0.0750759 -0.1664002 -0.0026364 0.2312217 6 H 2.0301760 -0.2020815 0.1638920 -0.3739962 0.3265368 -0.0750759 -0.1664002 0.0026364 0.2312217 7 H 0.9099477 -0.8042578 0.3489540 -0.9172267 1.4392530 -0.5053403 0.3095411 -0.4083741 0.4016414 8 H 0.9099477 0.8042578 0.3489540 0.9172267 1.4392530 0.5053403 0.3095411 0.4083741 0.4016414 9 H 0.9099477 0.8042578 0.3489540 0.9172267 1.4392530 0.5053403 0.3095411 0.4083741 0.4016414 10 H 0.9099477 -0.8042578 0.3489540 -0.9172267 1.4392530 -0.5053403 0.3095411 -0.4083741 0.4016414 11 O -1.5354282 -0.1839575 0.0206478 -0.2144398 -0.5491495 -0.1437749 0.0938157 -0.2445183 -0.6940555 12 O -1.5354282 0.1839575 0.0206478 0.2144398 -0.5491495 0.1437749 0.0938157 0.2445183 -0.6940555 13 O -1.5354282 -0.1839575 0.0206478 -0.2144398 -0.5491495 -0.1437749 0.0938157 -0.2445183 -0.6940555 14 O -1.5354282 0.1839575 0.0206478 0.2144398 -0.5491495 0.1437749 0.0938157 0.2445183 -0.6940555 15 O -1.0917060 -0.1932928 -0.2033242 -0.2123936 -1.2131087 -0.3909801 -0.1514086 -0.2114600 -0.5045549 16 O -1.0917060 0.1932928 -0.2033242 0.2123936 -1.2131087 0.3909801 -0.1514086 0.2114600 -0.5045549 17 O -1.0917060 -0.1932928 -0.2033242 -0.2123936 -1.2131087 -0.3909801 -0.1514086 -0.2114600 -0.5045549 18 O -1.0917060 0.1932928 -0.2033242 0.2123936 -1.2131087 0.3909801 -0.1514086 0.2114600 -0.5045549 19 O -1.5241198 0.4244931 -0.2794195 0.5858044 -1.2388732 0.0808671 -0.1058910 0.0118070 -0.6682238 20 O -1.5241198 -0.4244931 -0.2794195 -0.5858044 -1.2388732 -0.0808671 -0.1058910 -0.0118070 -0.6682238 21 O -1.5241198 0.4244931 -0.2794195 0.5858044 -1.2388732 0.0808671 -0.1058910 0.0118070 -0.6682238 22 O -1.5241198 -0.4244931 -0.2794195 -0.5858044 -1.2388732 -0.0808671 -0.1058910 -0.0118070 -0.6682238 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000001 (yyy) 0.00000001 (yyy) 0.00000001 (yyy) 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 ... [ 11 11 6 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.72, Number of G-points: 307, Lambda: 0.13 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/204) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 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 2.473 ( 0.000 0.000 0.000) 0.000 2.708 ( 0.000 0.000 0.000) 0.000 3.417 ( 0.000 0.000 0.000) 0.000 3.726 ( 0.000 0.000 0.000) 0.000 3.782 ( 0.000 0.000 0.000) 0.000 4.169 ( 0.000 0.000 0.000) 0.000 4.375 ( 0.000 0.000 0.000) 0.000 4.640 ( 0.000 0.000 0.000) 0.000 4.683 ( 0.000 0.000 0.000) 0.000 5.056 ( 0.000 0.000 0.000) 0.000 5.110 ( 0.000 0.000 0.000) 0.000 5.594 ( 0.000 0.000 0.000) 0.000 5.780 ( 0.000 0.000 0.000) 0.000 5.946 ( 0.000 0.000 0.000) 0.000 6.712 ( 0.000 0.000 0.000) 0.000 6.889 ( 0.000 0.000 0.000) 0.000 7.013 ( 0.000 0.000 0.000) 0.000 7.227 ( 0.000 0.000 0.000) 0.000 7.246 ( 0.000 0.000 0.000) 0.000 7.429 ( 0.000 0.000 0.000) 0.000 7.638 ( 0.000 0.000 0.000) 0.000 7.981 ( 0.000 0.000 0.000) 0.000 8.148 ( 0.000 0.000 0.000) 0.000 8.450 ( 0.000 0.000 0.000) 0.000 8.502 ( 0.000 0.000 0.000) 0.000 11.680 ( 0.000 0.000 0.000) 0.000 11.927 ( 0.000 0.000 0.000) 0.000 12.917 ( 0.000 0.000 0.000) 0.000 13.217 ( 0.000 0.000 0.000) 0.000 13.336 ( 0.000 0.000 0.000) 0.000 13.393 ( 0.000 0.000 0.000) 0.000 13.961 ( 0.000 0.000 0.000) 0.000 14.404 ( 0.000 0.000 0.000) 0.000 26.844 ( 0.000 0.000 0.000) 0.000 26.874 ( 0.000 0.000 0.000) 0.000 26.933 ( 0.000 0.000 0.000) 0.000 27.031 ( 0.000 0.000 0.000) 0.000 28.075 ( 0.000 0.000 0.000) 0.000 28.255 ( 0.000 0.000 0.000) 0.000 33.855 ( 0.000 0.000 0.000) 0.000 34.021 ( 0.000 0.000 0.000) 0.000 34.148 ( 0.000 0.000 0.000) 0.000 34.177 ( 0.000 0.000 0.000) 0.000 35.200 ( 0.000 0.000 0.000) 0.000 35.856 ( 0.000 0.000 0.000) 0.000 37.024 ( 0.000 0.000 0.000) 0.000 37.290 ( 0.000 0.000 0.000) 0.000 41.585 ( 0.000 0.000 0.000) 0.000 42.128 ( 0.000 0.000 0.000) 0.000 42.832 ( 0.000 0.000 0.000) 0.000 43.224 ( 0.000 0.000 0.000) 0.000 44.838 ( 0.000 0.000 0.000) 0.000 45.184 ( 0.000 0.000 0.000) 0.000 45.253 ( 0.000 0.000 0.000) 0.000 46.039 ( 0.000 0.000 0.000) 0.000 49.447 ( 0.000 0.000 0.000) 0.000 49.528 ( 0.000 0.000 0.000) 0.000 50.363 ( 0.000 0.000 0.000) 0.000 50.389 ( 0.000 0.000 0.000) 0.000 61.528 ( 0.000 0.000 0.000) 0.000 61.538 ( 0.000 0.000 0.000) 0.000 67.260 ( 0.000 0.000 0.000) 0.000 68.369 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/204) ======================= q-point: ( 0.09 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.493 ( 16.997 -19.463 0.047) 25.840 0.534 ( 13.788 -24.122 0.728) 27.794 1.173 ( 47.983 -38.798 -0.121) 61.706 2.504 ( 1.627 -2.910 -1.832) 3.805 2.733 ( 3.517 -0.435 1.745) 3.951 3.520 ( -11.029 4.752 1.679) 12.126 3.598 ( 8.748 11.574 8.920) 17.031 3.973 ( 11.246 4.726 1.497) 12.290 4.176 ( 0.547 -2.057 -1.006) 2.354 4.419 ( 4.482 4.638 -5.204) 8.288 4.595 ( 4.826 0.161 -13.977) 14.787 4.763 ( 4.317 0.494 11.473) 12.268 5.125 ( 9.625 6.925 12.239) 17.041 5.198 ( 2.911 -4.218 1.583) 5.364 5.604 ( -0.786 -2.065 -1.144) 2.488 5.869 ( -8.385 -5.231 2.024) 10.088 6.189 ( 13.178 10.326 -6.525) 17.968 6.723 ( -0.819 -1.521 1.380) 2.211 6.921 ( -2.417 2.356 1.173) 3.573 7.021 ( -1.821 -1.430 0.079) 2.317 7.172 ( -7.046 1.809 -0.618) 7.301 7.215 ( 2.283 2.689 -4.377) 5.621 7.493 ( -2.669 -6.581 0.970) 7.167 7.706 ( 8.631 -0.537 1.267) 8.740 7.966 ( 2.200 2.367 -2.493) 4.082 8.176 ( 0.029 -2.910 0.924) 3.053 8.446 ( 2.181 1.836 0.281) 2.865 8.709 ( -15.607 -13.478 -3.093) 20.852 11.823 ( 10.264 6.124 0.648) 11.969 12.546 ( -15.082 17.380 -0.358) 23.015 13.077 ( 16.719 14.499 -0.321) 22.132 13.420 ( -16.544 -18.693 1.026) 24.983 13.741 ( 12.396 -0.799 -3.797) 12.989 14.085 ( 21.004 -17.430 -1.340) 27.327 14.301 ( -8.446 4.226 -1.123) 9.510 16.215 ( 64.922 31.490 11.844) 73.122 26.852 ( 1.009 0.664 0.408) 1.275 26.919 ( -2.265 -0.311 0.786) 2.418 26.949 ( -0.312 -1.050 -0.654) 1.276 27.037 ( 0.104 -0.559 -0.088) 0.576 28.068 ( -0.424 0.568 0.060) 0.711 28.245 ( -0.446 0.922 -0.012) 1.024 33.826 ( -3.396 0.396 -0.101) 3.420 34.065 ( 1.560 0.329 0.913) 1.838 34.157 ( 1.200 -0.866 -0.256) 1.502 34.305 ( 12.812 3.710 -4.957) 14.229 35.277 ( 9.804 6.091 -1.783) 11.679 35.922 ( -3.149 -2.249 -2.481) 4.597 37.055 ( 1.234 -2.835 0.565) 3.143 37.290 ( -0.136 -0.202 -0.308) 0.392 41.828 ( 19.466 9.679 6.902) 22.808 42.923 ( 6.569 -2.459 1.572) 7.188 43.268 ( 3.304 -9.231 -10.972) 14.715 44.862 ( 1.842 -3.337 -3.862) 5.426 45.176 ( 0.769 0.437 2.187) 2.359 45.314 ( 11.108 -1.744 -4.618) 12.156 45.965 ( -6.542 3.391 3.161) 8.018 46.895 ( -19.491 -25.279 19.690) 37.505 49.498 ( 3.736 0.887 0.800) 3.922 50.356 ( 0.627 1.441 -1.112) 1.925 50.374 ( -1.972 0.035 -0.654) 2.078 54.106 ( -52.025 -42.299 108.971) 127.947 61.465 ( 2.918 10.444 3.291) 11.332 64.520 ( 282.850 190.615 -136.623) 367.429 67.229 ( -8.133 -1.762 -0.257) 8.326 68.434 ( 3.963 -5.368 -1.009) 6.748 ======================= Grid point 2 (3/204) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.973 ( 16.071 -18.801 0.811) 24.747 1.042 ( 13.081 -22.272 0.186) 25.830 2.207 ( 36.355 -31.850 1.050) 48.345 2.581 ( 3.398 -4.122 -3.426) 6.347 2.804 ( 5.146 -1.613 1.523) 5.604 3.343 ( -8.128 3.275 -1.642) 8.915 3.573 ( 6.408 4.008 3.585) 8.365 3.909 ( 0.173 9.311 0.487) 9.326 4.211 ( 1.863 0.453 -2.862) 3.445 4.378 ( -2.258 0.451 -1.633) 2.823 4.689 ( 13.718 3.230 -2.369) 14.291 4.782 ( 0.719 1.543 0.778) 1.872 5.221 ( 16.982 2.348 8.649) 19.202 5.298 ( -0.201 -6.478 -1.879) 6.748 5.615 ( -4.212 -1.058 0.697) 4.398 5.854 ( -1.327 -1.464 -1.144) 2.283 6.196 ( 6.745 1.293 -3.583) 7.746 6.725 ( -2.590 0.877 3.448) 4.400 6.822 ( -2.392 5.651 0.173) 6.139 6.989 ( -5.305 -0.171 2.049) 5.690 7.143 ( -2.768 -4.153 0.410) 5.008 7.200 ( 3.696 1.871 -4.390) 6.036 7.562 ( -1.112 -5.362 0.685) 5.519 7.793 ( 3.971 -0.377 1.480) 4.255 7.973 ( 6.630 2.219 -2.300) 7.360 8.229 ( 0.969 -2.779 0.887) 3.073 8.463 ( 5.431 1.046 0.745) 5.581 8.734 ( -8.908 -8.222 -2.125) 12.308 11.833 ( 0.931 2.735 -1.313) 3.174 12.164 ( -7.637 14.121 1.067) 16.090 13.065 ( 18.788 13.101 -2.832) 23.079 13.476 ( -23.868 -11.024 1.700) 26.345 13.654 ( -6.969 0.340 0.842) 7.028 14.131 ( -8.750 1.859 -1.028) 9.004 14.857 ( 40.529 -27.004 -5.612) 49.023 16.540 ( 38.664 6.802 7.606) 39.988 26.856 ( 0.664 0.179 0.350) 0.772 26.900 ( -1.641 -0.001 0.513) 1.719 26.960 ( -0.089 -0.829 -0.516) 0.980 27.048 ( 0.158 -0.767 -0.141) 0.796 28.050 ( -0.724 0.973 0.078) 1.215 28.219 ( -0.710 1.512 -0.045) 1.671 33.783 ( -2.917 0.567 0.115) 2.974 34.044 ( -1.547 0.741 0.156) 1.722 34.245 ( 6.094 -2.730 1.074) 6.764 34.378 ( 8.653 1.047 -3.412) 9.360 35.293 ( 5.544 2.945 0.371) 6.289 35.913 ( -1.248 -0.520 -2.202) 2.583 37.129 ( 1.451 -4.155 0.974) 4.508 37.294 ( -0.003 -0.485 -0.413) 0.637 41.955 ( 5.924 -5.689 3.693) 9.005 42.941 ( -1.097 3.040 0.923) 3.361 43.634 ( 23.001 -20.260 -13.671) 33.562 44.950 ( 3.658 -5.011 -2.734) 6.780 45.169 ( -0.090 0.505 -0.575) 0.770 45.500 ( 15.557 -1.291 -4.170) 16.158 45.878 ( -3.476 -1.475 3.691) 5.280 47.140 ( -2.324 -17.071 8.171) 19.068 49.539 ( 2.400 -1.555 0.313) 2.877 50.332 ( 0.772 1.103 -3.225) 3.495 50.357 ( -0.258 0.332 -0.036) 0.422 54.485 ( -15.449 -28.635 47.348) 57.450 61.327 ( 9.749 16.751 6.278) 20.373 64.434 ( 127.358 90.180 -60.343) 167.313 67.126 ( -15.875 -2.262 0.406) 16.041 68.601 ( 6.054 -8.882 -1.971) 10.928 ======================= Grid point 3 (4/204) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.428 ( 15.183 -17.277 1.985) 23.086 1.502 ( 11.433 -19.552 -0.066) 22.650 2.644 ( 3.270 -2.854 -3.187) 5.385 2.878 ( 2.100 -9.936 -10.697) 14.750 2.913 ( 13.608 -9.031 10.857) 19.612 3.249 ( 0.584 1.588 -2.042) 2.652 3.665 ( 4.090 -3.397 4.076) 6.699 3.766 ( 6.136 8.445 -1.882) 10.607 4.203 ( 0.585 0.182 -3.186) 3.244 4.355 ( -1.766 -0.178 1.873) 2.581 4.654 ( -1.882 6.490 2.934) 7.367 4.813 ( 8.479 4.152 -3.620) 10.112 5.313 ( -3.073 -3.268 -2.011) 4.916 5.518 ( -2.965 5.203 0.789) 6.040 5.534 ( 21.363 -5.303 2.999) 22.215 5.902 ( 1.887 -3.184 -1.583) 4.025 6.270 ( 3.292 -3.857 -3.176) 5.983 6.637 ( -2.694 6.033 4.683) 8.099 6.745 ( -1.530 1.770 -1.107) 2.588 6.949 ( -5.879 -2.176 3.625) 7.241 7.180 ( -1.904 -2.512 -0.442) 3.183 7.229 ( 5.436 -0.868 -3.268) 6.402 7.644 ( 0.461 -5.443 0.847) 5.528 7.825 ( 1.228 -0.505 -1.474) 1.984 8.019 ( 7.535 2.250 1.241) 7.961 8.280 ( 1.992 -1.287 0.141) 2.375 8.553 ( 9.187 -2.015 1.034) 9.462 8.745 ( -7.030 -5.407 -1.729) 9.035 11.657 ( -10.603 10.909 -1.629) 15.300 12.029 ( 3.683 2.996 1.248) 4.909 12.997 ( -6.412 10.102 -2.588) 12.242 13.282 ( 4.574 9.996 1.762) 11.133 13.685 ( -17.285 -16.067 0.711) 23.610 14.041 ( -5.005 -0.142 -0.268) 5.014 15.686 ( 36.927 -24.222 -4.966) 44.441 16.862 ( 25.006 0.860 5.379) 25.592 26.863 ( 0.484 -0.148 0.387) 0.637 26.887 ( -0.891 -0.023 0.245) 0.924 26.969 ( -0.195 -0.702 -0.372) 0.818 27.062 ( 0.204 -0.730 -0.149) 0.773 28.025 ( -0.812 1.089 0.057) 1.359 28.186 ( -0.716 1.590 -0.070) 1.745 33.746 ( -1.985 0.724 0.179) 2.120 34.028 ( -1.531 -0.721 0.295) 1.718 34.338 ( 5.193 -0.334 -0.349) 5.216 34.461 ( 6.997 -1.325 -1.246) 7.229 35.310 ( 3.746 1.881 1.066) 4.325 35.900 ( -0.535 0.143 -1.931) 2.009 37.206 ( 0.710 -3.602 1.002) 3.806 37.305 ( 0.393 -0.856 -0.258) 0.977 42.135 ( -0.692 -12.394 2.573) 12.677 42.865 ( -0.669 4.915 -0.844) 5.032 44.192 ( 24.244 -16.312 -8.940) 30.558 45.082 ( 4.976 -6.017 -2.450) 8.184 45.189 ( 3.214 -3.272 -1.505) 4.827 45.574 ( 3.900 4.452 1.446) 6.093 46.052 ( 13.584 -12.032 -2.036) 18.260 47.377 ( 1.343 -12.258 3.976) 12.957 49.595 ( 1.975 -2.291 0.181) 3.030 50.336 ( -1.343 -1.301 -0.212) 1.881 50.381 ( 8.733 -0.457 -4.167) 9.687 54.741 ( -17.718 -15.247 23.136) 32.888 61.251 ( 19.323 15.445 8.067) 26.020 64.345 ( 71.223 52.306 -32.650) 94.205 66.952 ( -20.382 -1.936 1.129) 20.504 68.806 ( 5.543 -9.203 -2.250) 10.977 ======================= Grid point 4 (5/204) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.844 ( 14.476 -14.113 2.886) 20.423 1.889 ( 7.965 -16.413 1.131) 18.279 2.664 ( 1.713 3.555 -4.918) 6.306 2.908 ( -7.367 -5.329 -10.712) 14.051 3.090 ( 3.704 -0.707 7.206) 8.133 3.320 ( 6.746 -2.756 2.581) 7.731 3.576 ( -6.620 2.991 1.916) 7.513 3.893 ( 11.857 3.167 -2.669) 12.559 4.252 ( 3.692 -4.639 -1.518) 6.120 4.344 ( -1.908 -0.346 2.383) 3.073 4.541 ( -1.388 5.544 1.016) 5.805 4.792 ( 3.163 4.993 -1.347) 6.062 5.303 ( -4.716 -2.303 -2.453) 5.794 5.405 ( -1.922 4.017 1.803) 4.804 5.866 ( 19.234 -2.680 -0.105) 19.420 5.954 ( -0.326 -3.830 -0.874) 3.942 6.347 ( 1.701 -2.536 -2.462) 3.923 6.542 ( -1.622 4.079 3.849) 5.838 6.733 ( 2.077 -0.512 -1.303) 2.505 6.931 ( -5.613 -2.339 3.469) 7.001 7.177 ( -1.751 -0.652 -1.103) 2.169 7.331 ( 8.140 -3.207 -2.317) 9.050 7.714 ( -2.807 -3.183 3.278) 5.363 7.842 ( 1.686 -0.915 -3.336) 3.848 8.088 ( 7.978 0.270 1.330) 8.093 8.307 ( 1.599 0.566 -0.086) 1.699 8.722 ( 10.298 -4.295 0.991) 11.202 8.731 ( -6.043 -2.874 -1.114) 6.783 11.360 ( -9.626 10.935 -0.872) 14.595 12.057 ( 3.059 -0.070 0.737) 3.147 12.664 ( -18.729 8.635 -0.562) 20.632 13.300 ( 17.681 8.691 -0.078) 19.702 13.710 ( -16.888 -12.177 0.376) 20.824 14.017 ( -2.174 -1.626 0.145) 2.719 16.358 ( 26.399 -17.440 -3.496) 31.832 17.075 ( 12.677 0.806 3.621) 13.208 26.872 ( 0.213 -0.330 0.420) 0.575 26.882 ( -0.203 -0.025 -0.008) 0.204 26.975 ( -0.232 -0.453 -0.241) 0.563 27.074 ( 0.197 -0.523 -0.114) 0.570 28.001 ( -0.644 0.857 0.026) 1.072 28.157 ( -0.507 1.178 -0.061) 1.284 33.718 ( -1.143 0.609 0.125) 1.301 34.030 ( -1.054 -1.165 0.380) 1.617 34.374 ( 3.122 0.971 -1.259) 3.504 34.556 ( 4.853 -1.961 0.176) 5.237 35.323 ( 2.239 1.157 0.976) 2.703 35.889 ( -0.202 0.308 -1.346) 1.395 37.254 ( 0.027 -1.940 0.594) 2.029 37.326 ( 0.553 -1.110 0.039) 1.240 42.314 ( -3.747 -13.165 1.938) 13.824 42.780 ( 1.602 6.409 -1.323) 6.738 44.520 ( 9.383 -4.133 -3.962) 10.992 45.183 ( 3.650 -2.624 -2.389) 5.091 45.382 ( 7.740 -8.574 1.092) 11.602 45.548 ( 1.923 0.779 0.898) 2.260 46.422 ( 17.023 -11.475 -3.100) 20.762 47.553 ( 1.384 -7.644 1.858) 7.987 49.648 ( 1.321 -1.986 0.103) 2.388 50.335 ( -0.766 -0.325 0.363) 0.908 50.582 ( 17.736 -7.223 -4.876) 19.762 54.634 ( -26.898 -0.125 10.433) 28.851 61.326 ( 22.014 8.674 6.911) 24.650 64.282 ( 38.685 28.677 -16.982) 51.062 66.756 ( -18.291 -1.292 1.154) 18.373 68.977 ( 3.532 -6.656 -1.708) 7.726 ======================= Grid point 5 (6/204) ======================= q-point: ( 0.45 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.141 ( 6.044 -6.634 -0.406) 8.983 2.195 ( 6.872 -10.818 5.859) 14.092 2.549 ( -3.462 6.425 -6.390) 9.700 2.855 ( -3.337 0.757 -3.451) 4.860 3.139 ( 0.873 -0.948 1.500) 1.978 3.407 ( 2.090 0.247 2.378) 3.176 3.539 ( -1.542 -3.586 1.562) 4.205 3.874 ( 2.312 5.258 -2.247) 6.168 4.316 ( -0.376 -0.505 -1.455) 1.585 4.370 ( 2.019 -2.098 4.067) 5.001 4.457 ( -1.229 3.539 -2.735) 4.639 4.775 ( 1.342 0.445 0.542) 1.514 5.282 ( -1.791 -0.590 -0.954) 2.113 5.358 ( -0.224 1.327 0.758) 1.544 5.942 ( 1.118 0.601 -0.299) 1.304 6.076 ( 4.200 -2.805 -0.376) 5.065 6.367 ( 0.261 0.166 -0.864) 0.917 6.502 ( -0.016 1.088 1.534) 1.880 6.784 ( 2.877 -1.503 -0.995) 3.395 6.902 ( -3.621 -0.112 1.746) 4.021 7.168 ( -0.691 -0.317 -0.552) 0.940 7.483 ( 7.641 -3.716 -1.646) 8.655 7.685 ( -4.636 1.051 2.194) 5.235 7.868 ( 0.413 -0.826 -0.689) 1.152 8.183 ( 5.313 -1.543 -0.346) 5.544 8.298 ( -0.084 1.449 0.174) 1.462 8.696 ( -3.204 -0.561 -0.271) 3.264 8.877 ( 4.905 -2.568 0.371) 5.549 11.149 ( -4.202 4.829 -0.296) 6.408 12.088 ( 1.195 -0.428 0.421) 1.338 12.404 ( -8.115 3.679 -0.289) 8.915 13.355 ( 8.131 3.725 -0.127) 8.945 13.698 ( -7.537 -4.662 0.131) 8.863 14.025 ( -0.694 -1.026 0.101) 1.242 16.764 ( 11.009 -7.672 -1.718) 13.528 17.138 ( 2.273 1.787 1.760) 3.385 26.878 ( -0.109 -0.295 0.353) 0.472 26.881 ( 0.177 0.116 -0.204) 0.294 26.977 ( -0.107 -0.153 -0.087) 0.206 27.081 ( 0.083 -0.190 -0.043) 0.211 27.987 ( -0.246 0.326 0.006) 0.408 28.140 ( -0.180 0.431 -0.024) 0.468 33.703 ( -0.373 0.234 0.043) 0.443 34.036 ( -0.383 -0.541 0.179) 0.687 34.383 ( 1.048 0.500 -0.577) 1.297 34.617 ( 1.727 -0.801 0.173) 1.911 35.330 ( 0.748 0.401 0.384) 0.932 35.881 ( -0.048 0.142 -0.485) 0.507 37.273 ( -0.040 -0.554 0.173) 0.582 37.345 ( 0.208 -0.513 0.074) 0.558 42.446 ( -2.798 -7.413 1.035) 7.990 42.706 ( 1.902 4.799 -0.884) 5.238 44.592 ( 1.760 -0.236 -1.130) 2.104 45.244 ( 1.843 -1.314 -1.276) 2.598 45.451 ( -0.151 0.915 2.172) 2.362 45.660 ( 3.921 -4.430 -0.786) 5.968 46.686 ( 7.040 -4.271 -1.176) 8.317 47.646 ( 0.444 -2.628 0.562) 2.724 49.681 ( 0.440 -0.793 0.028) 0.907 50.333 ( -0.198 -0.060 0.136) 0.248 50.886 ( 12.347 -6.057 -2.315) 13.946 54.331 ( -15.905 3.881 3.157) 16.673 61.447 ( 9.874 2.408 2.692) 10.514 64.253 ( 12.605 9.284 -5.338) 16.540 66.619 ( -7.614 -0.462 0.477) 7.643 69.071 ( 1.173 -2.399 -0.629) 2.743 ======================= Grid point 12 (7/204) ======================= q-point: ( 0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.627 ( 28.160 0.000 -1.656) 28.209 0.738 ( 31.845 0.000 0.893) 31.857 1.517 ( 61.639 0.000 -0.121) 61.640 2.549 ( 6.971 0.000 -0.663) 7.003 2.786 ( 5.424 0.000 1.757) 5.702 3.373 ( -14.508 -0.000 -1.022) 14.544 3.797 ( -4.475 -0.000 11.459) 12.301 4.108 ( -4.280 -0.000 -1.928) 4.694 4.214 ( 13.255 0.000 -6.694) 14.849 4.503 ( 8.232 0.000 -10.648) 13.459 4.547 ( 3.664 0.000 -2.683) 4.541 4.807 ( 1.234 0.000 7.148) 7.254 5.182 ( 5.733 0.000 5.042) 7.635 5.283 ( -4.050 -0.000 8.539) 9.450 5.642 ( 4.064 0.000 -0.143) 4.066 5.768 ( -1.217 -0.000 1.752) 2.134 6.367 ( 1.281 0.000 -5.635) 5.779 6.701 ( -1.599 -0.000 1.577) 2.246 6.863 ( -3.761 -0.000 2.946) 4.777 6.988 ( -2.091 -0.000 -0.527) 2.156 7.097 ( -8.801 -0.000 -0.702) 8.829 7.239 ( 0.664 0.000 -6.872) 6.904 7.426 ( -0.821 -0.000 2.563) 2.691 7.740 ( 5.108 0.000 1.217) 5.250 8.007 ( 3.372 0.000 -4.095) 5.304 8.155 ( 0.772 0.000 1.197) 1.424 8.491 ( 3.191 0.000 0.561) 3.240 8.534 ( 2.450 0.000 2.087) 3.218 12.248 ( 25.981 0.000 -4.895) 26.438 12.520 ( -18.093 -0.000 -2.985) 18.337 12.862 ( -15.973 -0.000 3.498) 16.351 13.758 ( 11.385 0.000 -3.241) 11.837 13.928 ( 27.870 0.000 2.460) 27.979 14.098 ( 23.689 0.000 -1.282) 23.724 14.162 ( -13.762 -0.000 -3.352) 14.164 17.000 ( 9.084 0.000 -1.367) 9.187 26.870 ( -0.529 -0.000 0.514) 0.737 26.895 ( -0.650 -0.000 0.535) 0.842 26.924 ( -0.546 -0.000 -0.411) 0.683 27.033 ( 0.161 0.000 -0.157) 0.225 28.064 ( -0.932 -0.000 0.033) 0.933 28.244 ( -0.876 -0.000 -0.028) 0.877 33.789 ( -3.347 -0.000 0.060) 3.347 34.125 ( -2.844 -0.000 -1.462) 3.198 34.177 ( 10.172 0.000 2.465) 10.466 34.427 ( 5.984 0.000 -5.893) 8.398 35.435 ( 2.926 0.000 -6.348) 6.990 35.852 ( 0.107 0.000 -2.059) 2.062 37.057 ( 2.427 0.000 1.374) 2.789 37.286 ( -0.332 -0.000 -0.300) 0.448 42.219 ( 13.095 0.000 -4.365) 13.803 43.071 ( 21.283 0.000 -1.391) 21.329 43.494 ( 21.138 0.000 -10.943) 23.803 44.845 ( 4.242 0.000 -6.950) 8.142 45.204 ( 0.002 0.000 3.015) 3.015 45.467 ( 20.864 0.000 -5.299) 21.526 45.869 ( -13.005 -0.000 10.453) 16.686 46.591 ( 7.863 0.000 26.498) 27.640 49.676 ( 13.028 0.000 -3.056) 13.382 50.369 ( 0.932 0.000 -0.611) 1.115 50.425 ( 4.174 0.000 -1.068) 4.308 53.377 ( -27.198 -0.000 106.929) 110.334 61.619 ( 4.698 0.000 10.527) 11.528 67.088 ( -14.094 -0.000 -1.838) 14.213 67.352 ( -35.782 -0.000 -85.158) 92.370 69.223 ( 54.396 0.000 -110.931) 123.550 ======================= Grid point 13 (8/204) ======================= q-point: ( 0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.011 ( 25.227 -9.125 -0.744) 26.836 1.105 ( 29.510 -3.515 0.135) 29.719 2.273 ( 39.870 -16.209 0.528) 43.042 2.636 ( 11.341 1.020 -2.994) 11.774 2.848 ( 4.418 -0.415 -1.465) 4.672 3.253 ( -8.013 -2.558 0.805) 8.450 3.717 ( -1.722 5.604 7.582) 9.584 4.014 ( -2.417 5.112 -2.364) 6.129 4.232 ( -0.837 0.103 -8.177) 8.221 4.450 ( 7.307 9.289 2.450) 12.070 4.770 ( 0.640 -1.334 1.726) 2.273 4.849 ( 13.784 -2.041 -4.178) 14.548 5.251 ( 3.733 -0.210 0.591) 3.785 5.343 ( 4.366 -6.728 5.958) 9.992 5.659 ( 6.789 4.305 0.803) 8.079 5.790 ( -0.609 -3.521 0.500) 3.608 6.310 ( 2.348 5.573 -3.550) 7.012 6.691 ( -3.377 -1.600 2.189) 4.331 6.820 ( -7.403 0.944 3.481) 8.235 6.932 ( -5.149 1.473 -0.311) 5.364 7.059 ( -2.228 -4.566 0.081) 5.081 7.230 ( 0.876 -0.015 -5.357) 5.428 7.465 ( -1.107 -4.989 2.882) 5.867 7.812 ( 3.101 -1.526 -0.945) 3.583 8.030 ( 3.048 0.018 -2.538) 3.966 8.205 ( 2.737 -3.144 0.702) 4.227 8.532 ( 4.658 0.130 0.936) 4.753 8.591 ( 1.878 -2.254 1.318) 3.216 12.133 ( -8.034 18.032 -0.382) 19.744 12.444 ( 22.869 12.809 -3.513) 26.446 12.871 ( -17.840 -17.917 1.419) 25.324 13.512 ( -5.569 24.348 0.460) 24.981 13.980 ( -4.927 2.218 -2.869) 6.118 14.037 ( 26.667 15.790 1.072) 31.009 14.865 ( 39.413 -28.617 -4.090) 48.878 17.023 ( 17.589 8.448 0.834) 19.530 26.863 ( -0.408 0.115 0.616) 0.748 26.887 ( -0.774 0.080 0.175) 0.798 26.932 ( -0.750 -1.490 -0.506) 1.743 27.039 ( 0.103 -0.538 -0.216) 0.589 28.049 ( -1.146 0.377 0.036) 1.207 28.226 ( -1.184 0.817 -0.050) 1.439 33.756 ( -2.539 -0.022 0.203) 2.547 34.066 ( -1.364 2.779 -0.750) 3.186 34.312 ( 9.925 -0.917 2.775) 10.346 34.472 ( 6.190 0.907 -4.390) 7.642 35.418 ( 4.413 4.174 -1.552) 6.270 35.869 ( -0.633 -2.104 -2.911) 3.647 37.107 ( 2.492 -2.028 1.881) 3.723 37.283 ( -0.346 -0.382 -0.498) 0.717 42.255 ( 23.774 17.137 -1.113) 29.328 43.333 ( 27.692 16.553 -0.579) 32.267 43.644 ( 27.731 -9.321 -12.014) 31.626 44.922 ( 4.930 -4.206 -5.776) 8.681 45.196 ( 1.319 1.810 1.406) 2.644 45.703 ( 23.288 2.417 -5.864) 24.136 45.776 ( -9.279 -3.526 6.945) 12.115 46.910 ( 7.718 -16.577 11.116) 21.399 49.732 ( 15.417 10.340 -1.907) 18.661 50.377 ( 2.044 1.595 -0.111) 2.595 50.424 ( 7.854 5.231 -2.445) 9.748 53.724 ( -24.446 -43.320 54.609) 73.867 61.636 ( 5.200 7.522 13.399) 16.222 66.287 ( -16.687 51.742 -60.265) 81.164 66.943 ( -15.864 -1.061 -1.123) 15.939 69.113 ( 51.543 38.378 -40.677) 76.054 ======================= Grid point 14 (9/204) ======================= q-point: ( 0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.434 ( 22.259 -11.019 0.472) 24.842 1.501 ( 24.965 -7.801 -1.195) 26.183 2.656 ( 7.255 -2.723 -1.211) 7.844 2.771 ( 1.648 -2.811 -10.507) 11.000 2.981 ( 14.346 -6.172 7.370) 17.269 3.277 ( 3.408 -2.062 -1.614) 4.298 3.650 ( -6.154 1.543 7.270) 9.649 3.954 ( 8.728 2.865 -3.060) 9.682 4.207 ( -0.013 0.284 -5.264) 5.271 4.388 ( 1.942 6.974 4.212) 8.375 4.707 ( -1.824 5.036 1.844) 5.665 4.965 ( 6.281 2.455 -4.696) 8.218 5.277 ( 2.236 2.289 0.217) 3.207 5.486 ( 0.489 -2.288 1.143) 2.604 5.732 ( 12.213 -1.333 3.139) 12.680 5.892 ( 8.659 -4.185 -1.498) 9.733 6.269 ( 1.611 1.011 -3.732) 4.189 6.676 ( -5.107 1.562 5.620) 7.752 6.709 ( -5.071 -0.039 -0.943) 5.158 6.876 ( -4.018 -0.482 1.972) 4.502 7.126 ( 0.787 -3.920 -0.903) 4.099 7.246 ( 2.245 -1.960 -3.767) 4.804 7.549 ( -1.142 -6.237 2.861) 6.957 7.845 ( 3.201 0.573 -2.894) 4.353 8.069 ( 1.188 -2.055 0.087) 2.375 8.290 ( 3.882 -2.212 -0.027) 4.468 8.603 ( 3.964 -2.132 1.947) 4.904 8.651 ( 4.810 -1.496 -0.272) 5.044 11.763 ( -11.778 15.255 -0.186) 19.274 12.468 ( 25.506 18.396 -1.363) 31.477 12.940 ( -20.713 -18.115 0.158) 27.517 13.042 ( -15.846 19.017 1.274) 24.786 13.915 ( 7.451 7.550 -1.364) 10.695 14.125 ( 29.712 14.710 0.440) 33.157 15.700 ( 35.394 -25.144 -3.906) 43.592 17.134 ( 14.689 3.006 1.687) 15.088 26.860 ( -0.583 -0.300 0.716) 0.971 26.881 ( -0.166 -0.040 -0.124) 0.211 26.945 ( -0.742 -1.417 -0.406) 1.650 27.050 ( -0.030 -0.840 -0.233) 0.872 28.028 ( -1.113 0.706 0.023) 1.318 28.196 ( -1.247 1.177 -0.073) 1.716 33.732 ( -1.816 0.100 0.229) 1.833 34.021 ( -0.637 1.376 -0.137) 1.522 34.418 ( 7.464 1.193 0.923) 7.615 34.527 ( 6.491 -0.168 -2.048) 6.809 35.407 ( 4.176 3.704 0.456) 5.600 35.881 ( -0.473 -1.127 -2.712) 2.975 37.171 ( 1.379 -2.666 1.804) 3.502 37.290 ( -0.141 -1.048 -0.464) 1.155 42.280 ( 24.442 14.401 0.925) 28.384 43.277 ( 26.382 23.789 -3.401) 35.687 44.224 ( 29.201 -16.418 -6.760) 34.175 45.045 ( 5.695 -6.266 -4.394) 9.539 45.210 ( 5.527 0.619 0.114) 5.563 45.679 ( -1.920 3.534 4.226) 5.834 46.028 ( 18.997 -9.608 -4.244) 21.707 47.242 ( 7.754 -12.561 4.537) 15.443 49.737 ( 13.571 9.345 -0.638) 16.490 50.364 ( 3.175 2.997 0.798) 4.439 50.490 ( 13.668 0.566 -4.584) 14.427 54.150 ( -25.812 -32.758 26.158) 49.230 61.600 ( 4.518 7.862 13.512) 16.272 65.318 ( -17.364 35.158 -36.880) 53.830 66.790 ( -11.770 0.425 1.877) 11.927 69.109 ( 38.992 21.218 -19.645) 48.544 ======================= Grid point 15 (10/204) ======================= q-point: ( 0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.843 ( 18.982 -11.436 0.339) 22.164 1.875 ( 20.774 -7.613 -0.485) 22.130 2.720 ( -5.947 -0.720 -11.348) 12.832 2.767 ( 7.595 -0.829 -0.040) 7.641 3.163 ( 4.707 0.440 8.934) 10.108 3.364 ( 7.113 -2.699 -1.071) 7.683 3.518 ( -11.483 2.844 2.705) 12.136 4.087 ( 10.491 0.109 -3.270) 10.989 4.192 ( 0.408 0.457 -2.540) 2.613 4.313 ( -3.601 0.819 3.737) 5.254 4.611 ( -0.155 6.327 -0.434) 6.344 4.922 ( 0.592 5.761 -1.421) 5.963 5.238 ( -2.431 1.646 0.512) 2.980 5.494 ( 6.768 4.527 0.408) 8.153 5.875 ( 1.118 -5.820 0.237) 5.931 6.041 ( 10.409 1.742 -0.018) 10.554 6.313 ( 2.677 -3.968 -3.621) 6.002 6.565 ( -5.730 3.193 3.852) 7.607 6.729 ( 0.751 -3.315 -0.024) 3.399 6.865 ( -0.730 -0.881 2.480) 2.731 7.169 ( 2.354 -0.639 -3.791) 4.508 7.336 ( 4.548 -4.975 -1.126) 6.834 7.625 ( -2.526 -4.730 3.491) 6.398 7.866 ( 3.857 0.758 -3.336) 5.155 8.116 ( 0.215 -2.863 0.523) 2.918 8.342 ( 2.351 0.452 0.542) 2.454 8.661 ( 1.915 -1.148 0.196) 2.242 8.774 ( 8.980 -3.340 0.522) 9.595 11.410 ( -13.367 11.751 -0.176) 17.799 12.457 ( 22.354 17.541 -0.399) 28.417 12.624 ( -11.557 13.528 0.956) 17.818 12.966 ( -23.449 -16.766 0.477) 28.830 13.905 ( 10.151 6.530 -0.483) 12.079 14.243 ( 33.828 16.911 -0.078) 37.819 16.366 ( 24.845 -17.780 -2.571) 30.660 17.219 ( 6.333 2.798 1.332) 7.050 26.862 ( -0.557 -0.556 0.685) 1.043 26.883 ( 0.165 -0.137 -0.263) 0.340 26.956 ( -0.571 -1.150 -0.270) 1.313 27.061 ( -0.227 -0.911 -0.209) 0.962 28.005 ( -0.855 0.739 0.003) 1.130 28.165 ( -1.069 1.044 -0.070) 1.496 33.714 ( -1.142 0.226 0.146) 1.173 34.008 ( -0.390 -0.241 0.240) 0.518 34.448 ( 4.527 2.906 -1.487) 5.581 34.604 ( 5.916 -0.234 0.560) 5.947 35.395 ( 3.152 3.441 0.992) 4.771 35.882 ( -0.219 -0.357 -2.060) 2.102 37.222 ( 0.149 -2.335 1.063) 2.570 37.309 ( -0.013 -1.509 -0.030) 1.510 42.365 ( 22.009 9.168 1.349) 23.880 43.214 ( 27.235 22.659 -3.743) 35.626 44.579 ( 10.908 -2.068 -3.511) 11.644 45.207 ( 7.353 -3.116 -4.238) 9.042 45.341 ( 8.941 -6.759 3.015) 11.607 45.639 ( 5.202 4.126 3.016) 7.293 46.392 ( 13.922 -12.891 -3.520) 19.297 47.486 ( 7.096 -7.529 1.680) 10.481 49.751 ( 11.231 6.937 -0.083) 13.201 50.366 ( 3.863 2.384 1.045) 4.658 50.704 ( 21.237 -4.045 -5.488) 22.305 54.239 ( -27.128 -13.621 11.981) 32.634 61.554 ( -3.004 3.986 10.432) 11.564 64.608 ( -31.334 14.438 -20.621) 40.193 66.697 ( -1.325 2.224 3.690) 4.508 69.197 ( 29.687 13.653 -12.394) 34.948 ======================= Grid point 16 (11/204) ======================= q-point: ( 0.45 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.133 ( 11.586 -4.002 -2.507) 12.511 2.237 ( 18.231 -9.026 4.297) 20.791 2.591 ( -3.582 6.159 -10.612) 12.782 2.864 ( 5.297 0.187 2.396) 5.817 3.181 ( 1.962 1.954 5.087) 5.792 3.352 ( -10.423 -0.599 2.622) 10.764 3.506 ( 6.352 -2.237 0.497) 6.753 4.022 ( 0.192 9.940 -4.044) 10.733 4.226 ( -3.518 -5.744 -2.474) 7.176 4.330 ( -2.088 -3.330 3.234) 5.090 4.496 ( -2.224 6.012 -3.981) 7.546 4.850 ( 1.662 4.728 3.340) 6.023 5.200 ( -3.724 -1.373 0.247) 3.976 5.503 ( 9.174 6.558 0.039) 11.277 5.940 ( 0.074 -1.591 -0.332) 1.627 6.078 ( 0.516 -0.286 -0.283) 0.654 6.367 ( 0.697 -0.714 -1.427) 1.741 6.482 ( -5.730 0.201 2.031) 6.083 6.797 ( 2.214 -1.553 0.934) 2.861 6.891 ( 3.557 -0.033 1.242) 3.768 7.198 ( 5.223 0.902 -5.383) 7.554 7.456 ( -0.094 -4.934 0.925) 5.020 7.650 ( -0.887 -1.375 2.524) 3.008 7.893 ( 4.118 0.821 -2.676) 4.979 8.151 ( -3.479 -3.084 0.445) 4.671 8.329 ( -0.550 2.551 1.565) 3.042 8.701 ( 4.890 0.219 -0.880) 4.974 8.899 ( 4.073 -1.277 0.374) 4.285 11.140 ( -10.169 4.461 0.160) 11.105 12.395 ( -1.152 4.264 -0.812) 4.491 12.454 ( 22.602 17.804 1.954) 28.838 12.936 ( -25.091 -14.935 0.183) 29.200 13.934 ( 11.251 5.512 -0.129) 12.529 14.354 ( 35.106 19.340 -0.440) 40.083 16.762 ( 10.146 -7.699 -0.662) 12.753 17.182 ( -3.136 4.267 -0.019) 5.295 26.867 ( -0.522 -0.577 0.579) 0.969 26.886 ( 0.194 -0.066 -0.374) 0.427 26.966 ( -0.331 -0.830 -0.104) 0.900 27.070 ( -0.479 -0.787 -0.155) 0.934 27.989 ( -0.421 0.410 -0.010) 0.588 28.142 ( -0.746 0.518 -0.038) 0.909 33.702 ( -0.434 0.064 0.051) 0.441 34.016 ( -0.284 -1.085 0.311) 1.164 34.437 ( 2.852 3.311 -1.447) 4.604 34.652 ( 3.344 1.265 0.836) 3.672 35.375 ( 1.896 3.113 0.776) 3.726 35.879 ( -0.081 -0.083 -1.204) 1.210 37.252 ( -0.365 -1.657 0.243) 1.714 37.331 ( -0.241 -1.310 0.314) 1.369 42.484 ( 19.330 6.559 1.383) 20.460 43.172 ( 29.505 23.155 -3.941) 37.712 44.626 ( 2.116 1.888 -1.281) 3.111 45.279 ( 5.495 1.265 -3.533) 6.654 45.465 ( -0.294 -1.055 3.622) 3.784 45.717 ( 12.355 1.964 2.342) 12.728 46.639 ( 1.321 -7.117 -0.961) 7.302 47.640 ( 5.824 -2.796 0.151) 6.462 49.770 ( 9.324 5.877 0.179) 11.023 50.377 ( 4.680 2.906 1.007) 5.601 50.967 ( 12.857 -1.145 -3.678) 13.422 54.158 ( -10.827 -7.520 4.309) 13.869 61.420 ( -19.514 0.399 5.059) 20.163 64.053 ( -45.912 -2.627 -9.139) 46.886 66.723 ( 11.844 3.325 4.304) 13.033 69.276 ( 22.892 11.920 -8.352) 27.127 ======================= Grid point 17 (12/204) ======================= q-point: (-0.45 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.167 ( -3.034 6.347 -2.259) 7.389 2.415 ( 4.212 14.144 -6.546) 16.144 2.533 ( 10.701 -5.031 3.323) 12.283 2.904 ( 5.141 -0.535 4.995) 7.188 3.188 ( 1.969 3.196 2.371) 4.440 3.310 ( -6.623 -4.979 0.769) 8.321 3.573 ( 3.438 1.332 1.272) 3.900 3.874 ( -1.718 5.311 -3.450) 6.562 4.261 ( -3.935 -3.661 -0.431) 5.392 4.333 ( -5.416 -2.831 -1.124) 6.213 4.404 ( -2.105 0.286 -2.904) 3.598 4.814 ( 1.298 4.035 4.186) 5.957 5.204 ( -2.848 -4.160 0.225) 5.046 5.497 ( 7.861 6.404 -0.804) 10.172 5.912 ( -5.559 1.959 0.394) 5.907 6.073 ( -1.152 1.026 0.111) 1.546 6.362 ( -1.023 0.247 1.077) 1.506 6.443 ( -4.462 -2.730 -1.186) 5.364 6.795 ( -1.182 2.419 2.048) 3.383 6.963 ( 8.294 0.229 -0.674) 8.324 7.228 ( 6.327 2.296 -5.362) 8.606 7.416 ( -10.944 1.174 2.523) 11.292 7.706 ( 4.012 -1.835 0.671) 4.463 7.911 ( 3.556 2.198 -1.715) 4.518 8.098 ( -10.149 0.112 1.157) 10.215 8.294 ( -0.414 0.842 1.262) 1.572 8.763 ( 6.606 0.264 -0.658) 6.644 8.866 ( -6.134 4.129 -0.360) 7.403 11.092 ( 0.157 -5.707 0.611) 5.742 12.393 ( 14.232 9.133 -1.159) 16.950 12.506 ( 20.968 4.767 2.669) 21.668 12.868 ( -25.187 -13.332 -0.117) 28.498 13.980 ( 10.914 4.751 -0.003) 11.903 14.428 ( 34.973 22.267 -0.800) 41.468 16.759 ( -12.245 8.169 2.572) 14.943 17.073 ( -6.962 0.921 -3.093) 7.674 26.869 ( -0.610 -0.395 0.420) 0.839 26.887 ( 0.228 0.091 -0.481) 0.540 26.974 ( -0.186 -0.491 0.074) 0.530 27.074 ( -0.651 -0.533 -0.080) 0.846 27.985 ( 0.057 -0.161 -0.017) 0.172 28.134 ( -0.381 -0.256 0.007) 0.459 33.704 ( 0.337 -0.347 -0.019) 0.484 34.032 ( -0.080 -1.047 0.102) 1.055 34.408 ( 1.347 3.136 -0.506) 3.450 34.640 ( 0.246 3.151 0.441) 3.191 35.347 ( 0.634 2.572 0.192) 2.656 35.879 ( -0.007 -0.218 -0.285) 0.359 37.267 ( -0.345 -0.860 -0.223) 0.953 37.341 ( -0.553 -0.447 0.274) 0.762 42.585 ( 16.447 7.610 1.375) 18.175 43.150 ( 33.345 24.192 -4.472) 41.439 44.600 ( -0.894 2.235 1.104) 2.648 45.277 ( 1.290 3.215 -1.263) 3.687 45.455 ( -0.575 1.441 -0.227) 1.568 45.753 ( 4.999 8.193 3.302) 10.150 46.622 ( -11.696 1.333 1.555) 11.874 47.701 ( 3.998 1.948 -0.807) 4.520 49.775 ( 7.697 6.186 0.086) 9.875 50.385 ( 4.899 3.496 0.957) 6.095 50.896 ( -9.215 10.961 0.732) 14.338 54.366 ( 15.465 -14.118 -1.812) 21.018 61.132 ( -35.122 -3.567 -0.130) 35.303 63.606 ( -57.799 -15.846 -0.251) 59.932 66.868 ( 21.012 3.824 3.708) 21.676 69.294 ( 17.401 13.355 -5.461) 22.605 ======================= Grid point 18 (13/204) ======================= q-point: (-0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.920 ( -9.264 13.767 -2.356) 16.760 2.168 ( 2.324 21.015 -3.565) 21.442 2.661 ( 5.102 0.203 3.015) 5.929 3.043 ( 7.558 -3.315 6.199) 10.322 3.105 ( -2.135 6.750 -2.050) 7.370 3.295 ( -2.721 1.999 1.091) 3.548 3.587 ( 4.135 0.615 0.934) 4.284 3.796 ( -5.617 1.787 -1.259) 6.027 4.221 ( -6.918 -0.775 0.753) 7.002 4.340 ( 0.080 -1.475 -2.308) 2.740 4.417 ( -3.907 -7.325 -3.793) 9.127 4.772 ( -0.911 3.196 5.309) 6.263 5.274 ( -0.101 -7.296 0.005) 7.297 5.465 ( -0.208 4.808 -1.464) 5.030 5.732 ( -12.918 6.802 0.634) 14.613 6.027 ( 1.065 4.534 0.727) 4.714 6.355 ( -1.242 -0.169 1.510) 1.963 6.462 ( -2.063 -4.844 -2.622) 5.881 6.739 ( -1.106 2.766 2.229) 3.721 7.036 ( 7.949 2.422 -2.623) 8.714 7.230 ( 0.647 2.855 -1.455) 3.269 7.288 ( -3.521 1.590 -0.041) 3.864 7.751 ( -0.250 0.211 0.406) 0.522 7.875 ( -1.510 3.977 4.087) 5.899 7.989 ( -5.491 0.565 -3.142) 6.352 8.288 ( -1.134 -0.308 0.542) 1.294 8.671 ( -11.974 5.640 -1.053) 13.278 8.827 ( 5.382 0.644 0.444) 5.439 11.292 ( 8.953 -11.934 0.832) 14.942 12.392 ( 20.538 15.597 0.311) 25.791 12.760 ( 0.681 -3.306 3.549) 4.898 12.818 ( 0.611 -14.438 -2.181) 14.615 14.030 ( 9.230 3.597 0.039) 9.907 14.447 ( 33.891 25.473 -1.327) 42.417 16.323 ( -28.701 17.558 3.608) 33.839 16.915 ( -16.491 3.079 -4.167) 17.286 26.866 ( -0.708 -0.064 0.133) 0.723 26.888 ( 0.498 0.036 -0.447) 0.670 26.976 ( -0.311 -0.164 0.222) 0.416 27.072 ( -0.604 -0.186 -0.007) 0.632 27.994 ( 0.390 -0.748 -0.031) 0.844 28.142 ( -0.046 -1.090 0.046) 1.092 33.721 ( 1.166 -0.828 -0.061) 1.431 34.045 ( 0.385 -0.460 -0.235) 0.644 34.369 ( -0.357 2.671 0.573) 2.755 34.566 ( -2.579 4.764 0.029) 5.417 35.313 ( -0.522 1.922 -0.413) 2.034 35.885 ( 0.082 -0.537 0.500) 0.738 37.270 ( 0.015 0.199 -0.386) 0.435 37.331 ( -0.911 0.686 0.069) 1.143 42.600 ( 13.451 13.367 1.025) 18.991 43.168 ( 36.811 23.157 -5.422) 43.826 44.517 ( -6.497 5.908 4.679) 9.951 45.216 ( -1.200 4.029 0.459) 4.229 45.384 ( -6.990 3.886 -1.318) 8.106 45.623 ( 1.791 11.343 2.097) 11.674 46.377 ( -18.011 7.853 3.489) 19.956 47.665 ( 2.055 6.624 -1.582) 7.114 49.751 ( 5.959 6.888 -0.392) 9.116 50.373 ( -0.182 2.621 1.222) 2.898 50.602 ( -3.348 13.022 3.868) 13.991 54.747 ( 10.989 -11.355 -8.219) 17.812 60.826 ( -33.608 -10.712 -2.789) 35.384 63.221 ( -69.451 -25.217 7.151) 74.233 67.066 ( 22.778 4.160 2.466) 23.285 69.226 ( 12.430 16.105 -3.326) 20.614 ======================= Grid point 19 (14/204) ======================= q-point: (-0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.566 ( -9.024 18.039 -1.232) 20.208 1.827 ( 2.270 25.542 -2.347) 25.749 2.683 ( 1.988 2.153 3.360) 4.458 2.917 ( -5.704 9.421 -9.797) 14.740 3.078 ( -2.803 16.322 9.206) 18.947 3.244 ( 2.723 -2.709 3.408) 5.135 3.613 ( -7.590 3.787 -1.020) 8.543 3.691 ( 4.695 -1.712 -1.574) 5.240 4.191 ( -1.591 -1.364 1.749) 2.729 4.361 ( 0.842 -1.771 -0.566) 2.041 4.503 ( -4.029 -8.520 -3.237) 9.965 4.699 ( -10.849 0.191 5.031) 11.960 5.241 ( -19.454 3.830 -2.637) 20.002 5.435 ( 2.462 -9.193 0.691) 9.542 5.568 ( 4.786 8.236 -0.430) 9.535 5.954 ( -0.909 5.609 0.823) 5.742 6.317 ( -1.658 4.224 1.669) 4.835 6.534 ( -0.439 -7.686 -3.386) 8.410 6.727 ( 0.626 -0.987 2.565) 2.819 7.049 ( 4.601 3.222 -4.359) 7.110 7.177 ( -3.406 0.847 3.461) 4.929 7.276 ( 5.139 3.550 -2.987) 6.923 7.671 ( -6.902 2.792 2.613) 7.890 7.841 ( 0.524 1.461 1.726) 2.321 7.927 ( -2.898 1.387 -2.338) 3.974 8.275 ( -1.275 0.258 -0.372) 1.353 8.474 ( -10.042 2.337 -0.925) 10.351 8.865 ( 3.880 1.357 1.235) 4.292 11.620 ( 12.723 -13.881 0.792) 18.847 12.382 ( 24.581 19.179 1.071) 31.196 12.691 ( -19.496 -9.230 0.442) 21.575 13.219 ( 24.922 -9.947 1.099) 26.856 14.077 ( 6.053 1.411 -0.060) 6.216 14.395 ( 30.445 28.194 -2.441) 41.567 15.636 ( -38.179 23.338 5.123) 45.039 16.581 ( -27.901 6.100 -5.563) 29.097 26.857 ( -0.671 0.156 -0.095) 0.695 26.897 ( 0.991 -0.210 -0.413) 1.094 26.972 ( -0.673 0.090 0.332) 0.756 27.066 ( -0.375 0.213 0.040) 0.433 28.014 ( 0.455 -1.151 -0.051) 1.239 28.165 ( 0.190 -1.743 0.058) 1.754 33.754 ( 1.929 -1.220 -0.059) 2.283 34.055 ( 1.250 0.043 -0.499) 1.347 34.318 ( -2.111 2.543 1.175) 3.508 34.445 ( -4.551 5.379 0.003) 7.046 35.275 ( -1.484 1.325 -0.730) 2.119 35.899 ( 0.221 -0.828 0.933) 1.267 37.252 ( 0.285 2.664 -0.415) 2.711 37.307 ( -1.073 0.561 0.005) 1.211 42.471 ( 10.106 20.910 -0.002) 23.224 43.226 ( 33.629 20.229 -7.217) 39.902 44.236 ( -15.843 16.587 11.076) 25.472 45.142 ( -1.073 5.154 1.259) 5.413 45.205 ( -6.443 4.345 0.772) 7.809 45.517 ( -1.775 4.367 -0.229) 4.719 46.067 ( -12.490 8.800 2.818) 15.536 47.546 ( 1.307 10.374 -2.513) 10.754 49.706 ( 5.337 6.680 -0.598) 8.571 50.311 ( -5.094 -0.141 2.404) 5.634 50.502 ( 13.685 11.532 3.661) 18.266 54.804 ( -15.313 -2.932 -16.777) 22.903 60.775 ( -11.309 -17.157 -2.231) 20.669 62.826 ( -83.295 -30.611 13.930) 89.829 67.239 ( 18.188 4.445 1.309) 18.769 69.067 ( 7.810 18.367 -1.864) 20.045 ======================= Grid point 20 (15/204) ======================= q-point: (-0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.171 ( -6.492 21.660 -0.236) 22.613 1.436 ( 3.763 29.166 -1.773) 29.461 2.430 ( -17.375 37.023 -1.901) 40.941 2.675 ( 3.261 3.779 3.643) 6.179 2.804 ( -4.848 7.996 -0.690) 9.376 3.377 ( 7.384 -5.012 1.825) 9.109 3.493 ( -3.409 1.553 -1.675) 4.104 3.808 ( 4.573 -3.304 -1.241) 5.776 4.206 ( 0.158 -0.412 0.913) 1.014 4.363 ( -11.023 1.056 3.817) 11.713 4.494 ( -6.153 -5.502 3.950) 9.150 4.636 ( -8.559 -7.296 -5.435) 12.491 5.049 ( -5.976 0.844 -2.674) 6.601 5.474 ( 4.367 10.217 1.555) 11.219 5.626 ( 2.855 -7.609 -1.662) 8.295 5.857 ( -2.173 2.876 0.824) 3.698 6.204 ( -2.491 7.189 1.356) 7.729 6.667 ( 1.376 -9.416 -3.287) 10.067 6.764 ( -0.106 -1.348 2.643) 2.969 7.043 ( 2.766 1.278 -3.102) 4.348 7.147 ( -2.259 -0.354 2.550) 3.425 7.253 ( 3.753 5.009 -1.268) 6.386 7.590 ( -4.024 0.079 1.898) 4.450 7.793 ( -0.629 5.695 -3.280) 6.602 7.889 ( -2.868 -1.640 2.615) 4.214 8.251 ( -0.419 1.346 -0.878) 1.660 8.385 ( -4.474 -1.255 -0.331) 4.658 8.882 ( 2.898 1.661 1.387) 3.617 11.986 ( 12.402 -14.765 0.601) 19.292 12.341 ( 24.994 24.091 0.599) 34.719 12.644 ( -16.796 -12.157 0.721) 20.746 13.630 ( 24.431 -5.536 3.096) 25.241 14.112 ( -1.105 -0.416 -2.017) 2.337 14.243 ( 17.935 25.073 -3.844) 31.066 14.844 ( -32.057 27.266 7.060) 42.673 16.109 ( -31.983 8.063 -6.341) 33.588 26.848 ( -0.493 0.141 -0.141) 0.532 26.915 ( 1.520 -0.470 -0.472) 1.659 26.960 ( -1.095 0.235 0.427) 1.199 27.057 ( -0.144 0.562 0.043) 0.582 28.037 ( 0.275 -1.267 -0.053) 1.298 28.197 ( 0.232 -1.974 0.035) 1.988 33.798 ( 2.070 -1.438 0.008) 2.521 34.074 ( 2.542 0.004 -0.692) 2.635 34.248 ( -2.562 3.462 0.911) 4.402 34.312 ( -5.660 4.283 0.577) 7.121 35.237 ( -1.919 0.923 -0.568) 2.204 35.919 ( 0.364 -0.985 0.852) 1.352 37.190 ( -0.270 4.941 -0.320) 4.959 37.297 ( -0.313 0.015 0.085) 0.325 42.198 ( 3.438 23.511 -0.970) 23.781 43.212 ( 14.947 16.601 -7.633) 23.606 43.831 ( -3.357 21.876 13.904) 26.137 45.020 ( -1.289 7.112 1.152) 7.319 45.171 ( 0.389 -0.784 0.338) 0.938 45.394 ( -9.412 3.746 2.067) 10.339 45.902 ( -1.597 2.160 -0.664) 2.767 47.381 ( 2.263 12.373 -3.136) 12.963 49.664 ( 5.385 7.010 -0.233) 8.842 50.300 ( -1.282 -1.918 1.525) 2.766 50.500 ( 12.626 10.364 3.013) 16.610 54.523 ( -23.245 -0.909 -22.716) 32.514 61.056 ( 15.665 -14.883 -1.263) 21.645 62.325 ( -94.770 -28.688 19.058) 100.835 67.331 ( 9.694 4.483 0.561) 10.695 68.844 ( 3.798 18.243 -0.888) 18.656 ======================= Grid point 21 (16/204) ======================= q-point: (-0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.774 ( -0.000 24.368 -0.000) 24.368 1.003 ( -0.000 31.368 -0.000) 31.368 1.607 ( -0.000 49.787 -0.000) 49.787 2.617 ( -0.000 8.359 -0.000) 8.359 2.710 ( -0.000 0.033 -0.000) 0.033 3.433 ( -0.000 1.676 -0.000) 1.676 3.567 ( 0.000 -8.760 0.000) 8.760 3.829 ( -0.000 0.235 -0.000) 0.235 4.198 ( -0.000 1.130 -0.000) 1.130 4.287 ( 0.000 -4.187 0.000) 4.187 4.592 ( 0.000 -4.058 0.000) 4.058 4.631 ( 0.000 -3.358 0.000) 3.358 5.021 ( 0.000 -0.631 0.000) 0.631 5.330 ( -0.000 10.984 -0.000) 10.984 5.661 ( -0.000 3.147 -0.000) 3.147 5.915 ( 0.000 -9.201 0.000) 9.201 6.070 ( -0.000 7.338 -0.000) 7.338 6.756 ( -0.000 1.749 -0.000) 1.749 6.822 ( 0.000 -9.157 0.000) 9.157 7.050 ( -0.000 0.470 -0.000) 0.470 7.159 ( 0.000 -2.721 0.000) 2.721 7.215 ( -0.000 2.344 -0.000) 2.344 7.588 ( 0.000 -2.096 0.000) 2.096 7.661 ( -0.000 8.743 -0.000) 8.743 7.914 ( 0.000 -2.814 0.000) 2.814 8.218 ( -0.000 2.539 -0.000) 2.539 8.395 ( 0.000 -2.628 0.000) 2.628 8.884 ( -0.000 1.183 -0.000) 1.183 12.110 ( -0.000 24.144 -0.000) 24.144 12.350 ( 0.000 -18.782 0.000) 18.782 12.729 ( 0.000 -12.735 0.000) 12.735 13.834 ( -0.000 16.894 -0.000) 16.894 13.870 ( -0.000 7.633 -0.000) 7.633 14.229 ( -0.000 27.263 -0.000) 27.263 14.238 ( 0.000 -6.685 0.000) 6.685 15.718 ( -0.000 10.196 -0.000) 10.196 26.843 ( -0.000 0.026 -0.000) 0.026 26.940 ( 0.000 -0.864 0.000) 0.864 26.944 ( -0.000 0.544 -0.000) 0.544 27.047 ( -0.000 0.732 -0.000) 0.732 28.057 ( 0.000 -1.075 0.000) 1.075 28.227 ( 0.000 -1.666 0.000) 1.666 33.835 ( 0.000 -1.303 0.000) 1.303 34.097 ( -0.000 0.506 -0.000) 0.506 34.186 ( -0.000 2.505 -0.000) 2.505 34.202 ( -0.000 3.165 -0.000) 3.165 35.208 ( -0.000 0.723 -0.000) 0.723 35.939 ( 0.000 -0.981 0.000) 0.981 37.109 ( -0.000 4.892 -0.000) 4.892 37.294 ( -0.000 0.141 -0.000) 0.141 41.877 ( -0.000 18.534 -0.000) 18.534 43.039 ( -0.000 12.804 -0.000) 12.804 43.543 ( -0.000 18.974 -0.000) 18.974 44.919 ( -0.000 5.179 -0.000) 5.179 45.183 ( -0.000 0.915 -0.000) 0.915 45.275 ( -0.000 2.179 -0.000) 2.179 45.924 ( 0.000 -4.160 0.000) 4.160 47.215 ( -0.000 11.123 -0.000) 11.123 49.588 ( -0.000 7.578 -0.000) 7.578 50.329 ( 0.000 -2.032 0.000) 2.032 50.452 ( -0.000 5.781 -0.000) 5.781 54.389 ( 0.000 -3.476 0.000) 3.476 61.456 ( 0.000 -5.271 0.000) 5.271 61.863 ( 0.000 -15.881 0.000) 15.881 67.321 ( -0.000 3.752 -0.000) 3.752 68.609 ( -0.000 14.580 -0.000) 14.580 ======================= Grid point 24 (17/204) ======================= q-point: ( 0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.242 ( 27.061 0.000 -0.697) 27.070 1.416 ( 27.514 0.000 0.715) 27.523 2.525 ( 22.080 0.000 0.966) 22.101 2.846 ( 23.289 0.000 -5.899) 24.025 2.849 ( -0.829 -0.000 -10.341) 10.375 3.158 ( -3.272 -0.000 8.667) 9.264 3.712 ( -8.616 -0.000 9.147) 12.566 4.022 ( -0.709 -0.000 -1.983) 2.105 4.188 ( -1.616 -0.000 -6.506) 6.704 4.630 ( 2.669 0.000 2.089) 3.389 4.805 ( 2.388 0.000 2.518) 3.470 4.973 ( 15.366 0.000 -6.925) 16.854 5.272 ( 3.987 0.000 -3.169) 5.094 5.407 ( 13.154 0.000 6.323) 14.595 5.766 ( 7.030 0.000 -0.207) 7.033 5.772 ( 1.976 0.000 3.415) 3.945 6.361 ( -0.316 -0.000 -2.464) 2.484 6.617 ( -7.605 -0.000 1.842) 7.824 6.745 ( -6.707 -0.000 2.583) 7.187 6.932 ( -1.746 -0.000 -0.287) 1.769 6.972 ( -0.721 -0.000 0.947) 1.190 7.214 ( -0.927 -0.000 -3.423) 3.546 7.428 ( 0.669 0.000 1.829) 1.948 7.845 ( 5.145 0.000 -2.301) 5.636 8.057 ( 1.370 0.000 -2.595) 2.934 8.213 ( 3.740 0.000 2.755) 4.645 8.584 ( 4.657 0.000 0.602) 4.696 8.639 ( 6.413 0.000 1.014) 6.493 12.138 ( -16.140 -0.000 -2.138) 16.281 12.504 ( -16.150 -0.000 3.769) 16.584 12.737 ( 8.507 0.000 -1.798) 8.695 13.532 ( -27.394 -0.000 -2.637) 27.521 14.036 ( 24.780 0.000 -0.312) 24.782 14.815 ( 38.132 0.000 1.097) 38.148 14.904 ( 42.211 0.000 -4.037) 42.404 17.205 ( 8.941 0.000 -2.849) 9.384 26.856 ( -0.917 -0.000 0.709) 1.159 26.881 ( -0.603 -0.000 -0.062) 0.606 26.913 ( -0.172 -0.000 -0.475) 0.505 27.035 ( -0.004 -0.000 -0.262) 0.262 28.038 ( -1.227 -0.000 0.013) 1.227 28.217 ( -1.531 -0.000 -0.074) 1.533 33.729 ( -2.209 -0.000 0.187) 2.216 34.067 ( -1.767 -0.000 -0.763) 1.925 34.436 ( 10.868 0.000 3.677) 11.473 34.527 ( 4.726 0.000 -4.427) 6.476 35.484 ( 2.892 0.000 -1.206) 3.134 35.844 ( 0.421 0.000 -3.099) 3.127 37.127 ( 2.491 0.000 2.469) 3.508 37.273 ( -0.567 -0.000 -0.509) 0.762 42.774 ( 37.185 0.000 -4.090) 37.409 43.735 ( 36.865 0.000 -1.382) 36.891 43.899 ( 18.438 0.000 -10.103) 21.025 44.919 ( 4.666 0.000 -6.948) 8.370 45.236 ( 2.320 0.000 2.981) 3.777 45.643 ( -9.907 -0.000 6.871) 12.056 46.043 ( 30.511 0.000 -9.251) 31.882 46.932 ( 14.782 0.000 9.919) 17.802 49.993 ( 13.997 0.000 -3.805) 14.504 50.431 ( 6.258 0.000 -1.838) 6.522 50.654 ( 20.300 0.000 -5.459) 21.021 53.233 ( -17.603 -0.000 47.164) 50.342 61.732 ( -3.680 -0.000 16.250) 16.661 65.996 ( -59.663 -0.000 -36.482) 69.933 66.697 ( -17.130 -0.000 -2.063) 17.253 69.824 ( 33.751 0.000 -52.294) 62.240 ======================= Grid point 25 (18/204) ======================= q-point: ( 0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.578 ( 24.955 -4.941 -0.090) 25.440 1.717 ( 23.504 -2.289 -0.202) 23.616 2.717 ( 7.926 0.076 -3.163) 8.534 2.768 ( 2.137 1.380 -9.829) 10.153 3.080 ( 12.785 -1.873 2.511) 13.164 3.244 ( 3.841 -6.204 1.428) 7.435 3.599 ( -11.733 2.071 8.134) 14.426 4.028 ( 3.420 -0.023 -0.403) 3.444 4.180 ( 0.314 -1.414 -3.639) 3.917 4.575 ( 0.285 8.525 2.226) 8.815 4.806 ( 3.682 3.866 1.712) 5.607 5.003 ( 0.239 4.015 -6.668) 7.787 5.365 ( 4.000 0.630 -0.805) 4.129 5.557 ( 13.788 0.065 3.462) 14.216 5.786 ( 2.146 2.195 1.928) 3.624 5.952 ( 14.694 -7.321 -0.562) 16.427 6.308 ( -1.051 3.915 -2.476) 4.750 6.563 ( -8.162 -4.542 3.221) 9.880 6.672 ( -5.152 1.505 0.455) 5.387 6.889 ( 2.605 2.625 0.420) 3.722 7.065 ( 3.290 -5.885 0.828) 6.793 7.212 ( -0.859 -2.469 -1.733) 3.137 7.477 ( 2.207 -3.311 0.453) 4.005 7.898 ( 5.718 0.556 -3.574) 6.766 8.050 ( -0.917 -0.056 -0.097) 0.924 8.296 ( 4.419 -2.738 2.587) 5.807 8.644 ( 5.205 -0.434 1.011) 5.320 8.722 ( 8.423 0.028 -0.472) 8.437 11.813 ( -18.016 12.787 -0.912) 22.112 12.437 ( -21.559 -13.529 2.083) 25.537 12.740 ( -1.976 3.537 0.054) 4.052 13.173 ( -16.623 8.782 -1.956) 18.902 14.255 ( 31.664 14.320 -0.543) 34.756 14.899 ( 41.171 24.737 0.633) 48.035 15.706 ( 35.649 -24.597 -2.156) 43.365 17.281 ( 7.237 0.949 -2.496) 7.714 26.849 ( -0.756 -0.233 0.678) 1.042 26.877 ( -0.360 -0.172 -0.194) 0.444 26.919 ( -0.165 -0.932 -0.368) 1.016 27.037 ( -0.198 -0.500 -0.276) 0.604 28.023 ( -1.151 0.307 0.000) 1.191 28.193 ( -1.621 0.605 -0.094) 1.733 33.709 ( -1.913 -0.306 0.157) 1.944 34.037 ( -0.811 1.343 -0.229) 1.585 34.531 ( 6.519 2.360 -0.548) 6.954 34.586 ( 6.923 -1.146 -0.069) 7.018 35.496 ( 3.020 2.297 0.093) 3.796 35.853 ( 0.316 -1.142 -2.993) 3.219 37.164 ( 1.435 -1.049 2.366) 2.959 37.271 ( -0.501 -0.717 -0.487) 1.001 42.990 ( 40.211 24.387 -1.379) 47.048 43.912 ( 22.078 18.223 -5.477) 29.146 44.319 ( 33.474 -14.600 -3.480) 36.685 44.992 ( 3.220 -5.259 -5.244) 8.095 45.306 ( 9.364 -1.399 1.978) 9.672 45.604 ( -5.912 -5.015 5.807) 9.686 46.278 ( 26.995 7.182 -8.591) 29.225 47.211 ( 14.924 -8.825 5.150) 18.086 50.068 ( 13.929 7.882 -2.112) 16.143 50.503 ( 11.363 3.684 -1.686) 12.064 50.771 ( 25.760 12.989 -5.704) 29.408 53.438 ( -17.976 -31.631 28.129) 45.988 61.653 ( -13.680 1.943 15.639) 20.869 65.092 ( -62.502 13.437 -26.286) 69.123 66.591 ( -11.625 -7.032 -0.073) 13.587 69.875 ( 32.836 21.742 -33.968) 52.007 ======================= Grid point 26 (19/204) ======================= q-point: ( 0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.928 ( 20.649 -6.754 0.278) 21.727 2.017 ( 19.323 -5.600 -1.941) 20.211 2.673 ( 1.686 2.932 -8.854) 9.477 2.865 ( 8.993 -0.338 -0.968) 9.051 3.224 ( 4.274 -1.753 8.373) 9.563 3.359 ( 2.847 -4.798 -3.551) 6.613 3.434 ( -12.134 2.659 3.841) 13.002 4.070 ( -0.106 -1.304 -0.671) 1.471 4.223 ( 2.160 -2.799 -0.517) 3.573 4.416 ( -1.100 11.233 1.720) 11.417 4.751 ( 3.069 10.191 -1.878) 10.808 4.923 ( -4.195 -0.663 -3.430) 5.459 5.304 ( -0.982 7.222 3.674) 8.162 5.711 ( 15.250 6.407 -0.624) 16.554 5.794 ( -0.640 -5.369 1.120) 5.521 6.137 ( 1.709 0.775 1.083) 2.167 6.272 ( 1.532 -2.813 -4.303) 5.364 6.534 ( -7.317 1.129 5.682) 9.333 6.668 ( 3.547 -5.086 -1.939) 6.497 6.917 ( 7.002 1.531 0.238) 7.172 7.175 ( 4.341 -2.656 -2.144) 5.523 7.282 ( 1.438 -5.897 0.917) 6.139 7.564 ( 3.541 -3.412 -0.081) 4.918 7.935 ( 6.267 2.084 -3.844) 7.642 8.051 ( -3.157 -2.678 1.685) 4.470 8.373 ( 2.766 -0.363 2.581) 3.801 8.718 ( 6.916 0.071 0.217) 6.919 8.829 ( 8.526 -1.726 -0.663) 8.724 11.400 ( -20.344 11.571 -0.208) 23.406 12.392 ( -25.335 -14.398 1.300) 29.169 12.582 ( -8.296 6.938 -0.570) 10.830 12.984 ( 2.011 5.688 -0.233) 6.037 14.332 ( 32.793 21.272 -0.232) 39.089 15.006 ( 41.168 22.471 0.795) 46.908 16.368 ( 24.654 -17.297 -1.171) 30.140 17.304 ( 1.694 2.824 -1.791) 3.749 26.849 ( -0.513 -0.478 0.614) 0.932 26.877 ( -0.232 -0.384 -0.247) 0.512 26.933 ( -0.091 -1.149 -0.254) 1.180 27.043 ( -0.500 -0.805 -0.256) 0.982 28.005 ( -0.910 0.484 -0.010) 1.031 28.165 ( -1.444 0.770 -0.090) 1.639 33.696 ( -1.555 -0.482 0.090) 1.630 34.014 ( -0.020 0.953 0.195) 0.973 34.539 ( 3.820 2.949 -2.598) 5.481 34.678 ( 6.630 0.261 1.975) 6.923 35.485 ( 2.658 3.364 0.707) 4.345 35.865 ( 0.138 -0.892 -2.387) 2.552 37.198 ( 0.319 -1.435 1.474) 2.082 37.282 ( -0.469 -1.484 -0.048) 1.558 43.024 ( 38.692 26.948 0.251) 47.153 43.865 ( 25.360 20.082 -5.039) 32.739 44.672 ( 9.807 -0.053 -3.202) 10.317 45.164 ( 6.255 -10.076 -1.976) 12.023 45.437 ( 8.732 2.124 1.438) 9.101 45.754 ( 13.425 -7.789 7.037) 17.041 46.434 ( 17.627 2.088 -7.493) 19.267 47.496 ( 12.819 -6.215 2.042) 14.392 50.080 ( 15.926 11.752 -0.773) 19.807 50.549 ( 16.353 9.780 0.386) 19.058 50.923 ( 24.956 2.486 -5.969) 25.780 53.721 ( -17.828 -23.393 13.595) 32.402 61.443 ( -26.267 0.714 11.958) 28.869 64.149 ( -65.030 8.328 -17.538) 67.867 66.646 ( -0.712 -8.537 3.054) 9.095 69.829 ( 30.981 21.782 -21.090) 43.348 ======================= Grid point 27 (20/204) ======================= q-point: ( 0.45 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.217 ( 12.427 -4.340 -1.683) 13.270 2.296 ( 14.092 -6.856 -2.405) 15.855 2.646 ( 5.851 3.148 -4.847) 8.224 2.971 ( 9.648 0.488 2.687) 10.027 3.219 ( -7.649 4.269 5.444) 10.313 3.271 ( -4.040 0.670 3.300) 5.260 3.516 ( 5.167 -7.397 -4.135) 9.925 4.038 ( -5.654 1.088 -1.646) 5.989 4.250 ( 0.072 8.240 1.686) 8.411 4.277 ( 0.691 -0.372 0.059) 0.787 4.572 ( -3.719 9.491 -5.064) 11.382 4.914 ( 0.841 0.356 1.511) 1.766 5.192 ( -2.694 4.948 3.505) 6.635 5.693 ( 2.915 5.732 -0.321) 6.439 5.920 ( 4.863 -2.845 -0.946) 5.713 6.079 ( -2.627 2.052 1.594) 3.695 6.324 ( -2.023 -3.884 -3.124) 5.380 6.440 ( -4.421 3.087 3.130) 6.234 6.795 ( 4.317 -3.143 0.502) 5.363 6.988 ( 9.812 1.412 -0.420) 9.922 7.252 ( 5.165 -1.482 -4.066) 6.738 7.368 ( -1.572 -3.344 0.944) 3.814 7.656 ( 5.875 -1.626 0.625) 6.128 7.964 ( 6.345 1.974 -3.746) 7.628 8.052 ( -5.742 -2.611 2.617) 6.829 8.371 ( -0.416 2.848 3.084) 4.219 8.788 ( 7.722 1.419 -1.445) 7.983 8.928 ( 3.354 -0.422 -0.167) 3.384 11.062 ( -15.181 4.152 0.349) 15.742 12.323 ( -26.928 -14.774 0.722) 30.723 12.450 ( 1.559 3.210 -0.582) 3.616 12.968 ( 8.045 5.010 0.455) 9.488 14.365 ( 32.518 21.853 0.021) 39.178 15.122 ( 39.915 22.365 0.538) 45.757 16.759 ( 10.347 -7.464 0.410) 12.765 17.202 ( -6.804 6.319 -2.150) 9.531 26.854 ( -0.417 -0.551 0.517) 0.863 26.881 ( -0.222 -0.440 -0.290) 0.572 26.950 ( 0.131 -1.003 -0.112) 1.018 27.048 ( -0.889 -0.937 -0.221) 1.310 27.989 ( -0.516 0.374 -0.016) 0.638 28.140 ( -1.100 0.528 -0.059) 1.222 33.690 ( -1.010 -0.634 0.020) 1.192 34.009 ( 0.286 0.054 0.351) 0.456 34.521 ( 2.801 3.548 -2.205) 5.030 34.726 ( 4.259 2.167 1.688) 5.068 35.456 ( 1.908 3.971 0.742) 4.467 35.871 ( 0.025 -0.424 -1.588) 1.644 37.224 ( -0.102 -1.558 0.413) 1.615 37.302 ( -0.742 -1.766 0.449) 1.968 43.057 ( 35.925 23.440 0.794) 42.904 43.849 ( 28.250 19.670 -5.281) 34.826 44.680 ( 1.191 3.061 -1.319) 3.540 45.335 ( 4.822 -3.806 -4.814) 7.804 45.459 ( 1.247 1.502 4.026) 4.474 46.019 ( 22.632 5.709 8.082) 24.701 46.547 ( 2.357 -2.349 -5.108) 6.096 47.690 ( 9.803 -2.192 0.542) 10.059 50.066 ( 15.039 12.544 0.030) 19.584 50.589 ( 18.807 11.359 1.699) 22.037 51.118 ( 12.939 3.266 -4.878) 14.209 53.895 ( -3.990 -17.005 5.522) 18.319 61.089 ( -39.748 -0.079 6.456) 40.269 63.323 ( -67.649 -2.205 -9.683) 68.374 66.835 ( 10.082 -7.354 4.833) 13.383 69.800 ( 26.348 19.162 -13.385) 35.221 ======================= Grid point 28 (21/204) ======================= q-point: ( 0.55 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.246 ( -1.336 6.899 -3.706) 7.944 2.488 ( 5.247 -2.229 -3.399) 6.637 2.741 ( 16.433 1.540 -0.293) 16.507 2.981 ( 0.450 5.048 3.964) 6.434 3.200 ( 2.155 -4.751 2.182) 5.655 3.233 ( -2.172 0.836 5.118) 5.622 3.650 ( 4.908 -3.059 -2.898) 6.469 3.920 ( -3.181 5.793 -1.832) 6.858 4.186 ( 0.730 1.158 -1.519) 2.044 4.231 ( -7.353 1.728 1.924) 7.794 4.417 ( -1.434 4.204 -5.113) 6.773 4.911 ( 2.176 3.860 4.686) 6.449 5.130 ( -3.094 -0.822 0.905) 3.327 5.616 ( -3.575 4.280 -1.609) 5.804 5.892 ( -5.598 3.375 1.116) 6.631 6.108 ( 6.355 -0.142 0.561) 6.382 6.328 ( -6.252 -3.011 -0.212) 6.942 6.370 ( -0.329 2.141 -0.037) 2.167 6.837 ( 1.631 1.875 1.540) 2.923 7.089 ( 11.048 1.190 -1.020) 11.158 7.293 ( -4.498 -1.356 -0.525) 4.727 7.349 ( 3.744 3.415 -4.842) 7.009 7.737 ( 4.252 -0.230 2.450) 4.913 7.995 ( 5.559 2.789 -2.326) 6.640 8.001 ( -6.874 -0.139 1.924) 7.139 8.314 ( -2.080 2.729 2.873) 4.475 8.843 ( 6.283 1.146 -1.388) 6.536 8.862 ( -7.801 5.724 -0.668) 9.699 10.993 ( -0.682 -6.725 0.764) 6.802 12.252 ( -26.512 -15.053 0.708) 30.495 12.527 ( 11.256 -3.358 -1.152) 11.803 13.004 ( 11.937 4.967 1.063) 12.973 14.395 ( 31.860 21.529 0.146) 38.452 15.210 ( 37.990 23.621 0.271) 44.736 16.763 ( -11.904 9.768 2.999) 15.688 17.000 ( -10.045 3.313 -4.186) 11.375 26.858 ( -0.442 -0.428 0.383) 0.725 26.884 ( -0.170 -0.377 -0.342) 0.536 26.965 ( 0.243 -0.588 0.049) 0.638 27.051 ( -1.120 -1.020 -0.173) 1.525 27.983 ( -0.093 -0.013 -0.017) 0.095 28.125 ( -0.706 -0.015 -0.017) 0.707 33.694 ( -0.311 -0.946 -0.020) 0.996 34.018 ( 0.249 -0.630 0.258) 0.725 34.485 ( 1.961 4.077 -1.317) 4.712 34.712 ( 1.647 4.339 1.063) 4.762 35.412 ( 1.085 4.127 0.442) 4.290 35.874 ( -0.017 -0.286 -0.771) 0.822 37.245 ( -0.099 -1.340 -0.247) 1.367 37.319 ( -0.930 -1.463 0.586) 1.830 43.106 ( 32.345 21.079 1.082) 38.623 43.867 ( 30.068 19.131 -6.497) 36.226 44.638 ( 0.035 3.054 1.365) 3.346 45.351 ( 1.311 3.928 -5.177) 6.629 45.456 ( -1.657 0.683 3.514) 3.945 46.097 ( 18.527 16.545 6.692) 25.724 46.501 ( -10.945 1.049 -1.351) 11.078 47.786 ( 6.514 1.604 -0.295) 6.715 50.033 ( 12.042 11.776 0.002) 16.843 50.593 ( 10.913 13.259 2.014) 17.291 51.043 ( 4.744 13.352 -0.879) 14.197 54.231 ( 7.570 -20.018 -0.157) 21.402 60.632 ( -42.381 -2.358 1.619) 42.478 62.659 ( -68.241 -12.045 -3.271) 69.373 67.089 ( 15.610 -4.495 4.580) 16.878 69.755 ( 20.398 18.210 -8.211) 28.550 ======================= Grid point 29 (22/204) ======================= q-point: (-0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.038 ( -5.177 12.738 -2.625) 13.998 2.431 ( -0.240 11.330 -1.963) 11.501 2.809 ( 8.610 6.871 0.026) 11.016 3.056 ( 5.663 -5.211 1.471) 7.835 3.145 ( -2.568 3.278 -1.592) 4.459 3.342 ( 5.390 -0.929 9.122) 10.636 3.701 ( 0.775 0.414 -2.071) 2.249 3.817 ( 5.313 7.702 -0.877) 9.398 4.113 ( -8.049 -0.854 0.886) 8.143 4.229 ( -1.441 -6.152 -2.723) 6.880 4.359 ( 0.526 2.351 -3.917) 4.599 4.851 ( -1.708 6.923 5.912) 9.263 5.158 ( -1.255 -6.069 -0.638) 6.230 5.424 ( -16.785 6.171 -1.697) 17.964 5.793 ( 0.578 4.863 0.890) 4.978 6.138 ( 4.694 5.565 0.281) 7.286 6.312 ( -2.947 -3.109 0.503) 4.313 6.363 ( -2.331 -2.644 -0.580) 3.572 6.801 ( 0.636 4.346 1.930) 4.797 7.152 ( 4.049 3.361 -3.802) 6.492 7.214 ( -3.659 0.334 2.470) 4.427 7.374 ( 9.713 3.523 -5.935) 11.915 7.738 ( -4.118 1.742 3.196) 5.496 7.921 ( -1.248 3.470 5.603) 6.708 8.007 ( 4.017 2.886 -4.583) 6.742 8.272 ( -2.041 0.356 1.355) 2.475 8.623 ( -13.589 7.174 -1.165) 15.411 8.885 ( 3.841 0.654 -0.503) 3.929 11.211 ( 10.146 -12.530 0.686) 16.137 12.199 ( -24.217 -15.146 1.017) 28.581 12.743 ( 13.181 -4.487 -2.475) 14.142 13.116 ( 17.272 0.616 2.360) 17.444 14.417 ( 31.458 22.096 0.312) 38.444 15.237 ( 33.231 25.955 -0.416) 42.168 16.290 ( -27.873 19.807 2.513) 34.286 16.787 ( -17.421 6.027 -3.303) 18.728 26.858 ( -0.450 -0.161 0.201) 0.518 26.888 ( 0.069 -0.394 -0.338) 0.523 26.971 ( -0.045 -0.083 0.160) 0.186 27.055 ( -0.871 -0.965 -0.098) 1.304 27.988 ( 0.175 -0.513 -0.021) 0.542 28.125 ( -0.339 -0.745 0.018) 0.819 33.713 ( 0.386 -1.422 -0.030) 1.474 34.033 ( 0.107 -0.944 0.037) 0.951 34.434 ( 1.057 4.460 -0.344) 4.597 34.637 ( -0.502 6.370 0.429) 6.405 35.359 ( 0.356 3.872 0.050) 3.889 35.878 ( 0.006 -0.489 -0.101) 0.499 37.262 ( 0.073 -0.956 -0.430) 1.050 37.325 ( -0.889 -0.389 0.406) 1.052 43.120 ( 27.469 22.169 1.303) 35.323 43.890 ( 27.261 18.581 -8.938) 34.180 44.581 ( -0.454 6.338 5.479) 8.391 45.244 ( -6.499 4.459 -3.602) 8.665 45.390 ( -3.059 5.151 2.469) 6.480 45.969 ( 12.044 22.826 2.184) 25.900 46.298 ( -14.523 5.279 3.025) 15.746 47.787 ( 3.499 5.381 -0.785) 6.466 49.963 ( 6.954 11.483 -0.834) 13.450 50.408 ( -7.922 8.565 1.759) 11.799 50.998 ( 29.545 18.600 3.470) 35.084 54.493 ( -15.037 -15.566 -5.207) 22.260 60.354 ( -18.344 -9.702 -0.380) 20.755 62.123 ( -68.177 -17.395 1.093) 70.370 67.316 ( 14.767 -1.062 3.068) 15.120 69.648 ( 13.626 19.039 -4.471) 23.835 ======================= Grid point 30 (23/204) ======================= q-point: (-0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.757 ( -3.840 16.360 -1.123) 16.842 2.189 ( 0.154 18.676 -1.013) 18.705 2.779 ( 3.418 5.650 0.927) 6.668 2.995 ( -2.384 7.307 -4.950) 9.142 3.223 ( 3.767 -4.151 3.130) 6.420 3.342 ( 3.461 12.914 6.164) 14.722 3.600 ( -7.752 3.632 -2.412) 8.894 3.844 ( 15.522 5.311 -0.555) 16.415 4.117 ( -1.717 -5.969 1.831) 6.475 4.326 ( -1.300 -8.780 -2.441) 9.205 4.335 ( 0.621 0.094 -2.630) 2.704 4.622 ( -17.762 11.565 4.631) 21.695 5.140 ( -9.891 4.994 -1.625) 11.199 5.285 ( -0.044 -10.441 0.051) 10.441 5.744 ( 3.598 5.965 0.123) 6.968 6.060 ( 0.897 8.023 0.251) 8.077 6.343 ( 0.018 -0.616 0.893) 1.085 6.397 ( -2.365 -6.601 -1.225) 7.118 6.756 ( 1.012 2.476 1.598) 3.116 7.105 ( 0.440 2.697 -2.416) 3.648 7.197 ( -0.144 1.863 0.751) 2.014 7.404 ( 7.361 4.738 -3.275) 9.347 7.637 ( -5.769 3.089 2.603) 7.043 7.884 ( 0.586 3.103 3.441) 4.671 7.971 ( 1.088 4.436 -2.270) 5.101 8.259 ( -0.844 -0.465 -0.324) 1.017 8.404 ( -8.765 3.020 -0.641) 9.293 8.906 ( 1.631 0.504 0.138) 1.712 11.547 ( 11.579 -13.529 0.135) 17.808 12.193 ( -17.652 -15.281 1.333) 23.385 12.878 ( 9.939 3.379 -2.128) 10.712 13.401 ( 17.974 -9.421 2.389) 20.433 14.417 ( 30.533 24.232 0.732) 38.987 15.082 ( 5.766 27.336 -3.252) 28.126 15.653 ( -17.869 25.152 4.482) 31.177 16.415 ( -22.480 10.337 -3.261) 24.956 26.854 ( -0.324 0.141 0.030) 0.355 26.897 ( 0.372 -0.622 -0.246) 0.765 26.967 ( -0.407 0.240 0.177) 0.505 27.060 ( -0.354 -0.549 -0.023) 0.653 28.001 ( 0.186 -0.949 -0.021) 0.968 28.140 ( -0.068 -1.482 0.026) 1.484 33.745 ( 0.731 -1.897 -0.017) 2.033 34.050 ( 0.124 -1.145 -0.131) 1.160 34.370 ( 0.127 4.704 0.292) 4.715 34.516 ( -1.414 7.697 0.015) 7.825 35.304 ( -0.151 3.348 -0.174) 3.356 35.889 ( 0.044 -0.831 0.216) 0.860 37.275 ( 0.502 -0.460 -0.309) 0.748 37.309 ( -0.923 1.337 0.174) 1.634 43.010 ( 17.626 27.237 0.982) 32.457 43.806 ( 10.230 18.976 -9.364) 23.504 44.431 ( 1.622 15.471 8.714) 17.830 45.113 ( -7.116 -1.149 -1.556) 7.375 45.266 ( -1.053 8.089 1.359) 8.270 45.730 ( 5.194 20.307 -0.327) 20.963 46.074 ( -8.281 7.002 3.226) 11.315 47.703 ( 1.428 8.525 -0.895) 8.690 49.854 ( 2.218 7.850 -0.783) 8.195 50.276 ( -3.332 1.244 1.357) 3.807 51.048 ( 30.049 23.383 4.296) 38.317 54.346 ( -34.712 -9.431 -8.105) 36.872 60.571 ( 20.427 -16.152 -0.629) 26.049 61.650 ( -65.688 -17.912 3.574) 68.180 67.450 ( 8.942 1.996 1.328) 9.258 69.451 ( 6.480 20.387 -1.801) 21.468 ======================= Grid point 31 (24/204) ======================= q-point: (-0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.456 ( -0.000 19.666 -0.000) 19.666 1.866 ( -0.000 23.945 -0.000) 23.945 2.733 ( -0.000 2.631 -0.000) 2.631 2.810 ( -0.000 17.162 -0.000) 17.162 3.019 ( -0.000 25.448 -0.000) 25.448 3.319 ( 0.000 -5.877 0.000) 5.877 3.518 ( -0.000 2.542 -0.000) 2.542 3.903 ( -0.000 3.967 -0.000) 3.967 4.189 ( 0.000 -2.309 0.000) 2.309 4.292 ( -0.000 7.553 -0.000) 7.553 4.389 ( 0.000 -6.919 0.000) 6.919 4.451 ( 0.000 -8.463 0.000) 8.463 5.042 ( -0.000 2.250 -0.000) 2.250 5.467 ( 0.000 -12.372 0.000) 12.372 5.658 ( -0.000 8.756 -0.000) 8.756 5.936 ( -0.000 7.810 -0.000) 7.810 6.301 ( -0.000 5.571 -0.000) 5.571 6.515 ( 0.000 -9.731 0.000) 9.731 6.755 ( 0.000 -0.684 0.000) 0.684 7.070 ( -0.000 1.757 -0.000) 1.757 7.161 ( -0.000 2.322 -0.000) 2.322 7.358 ( -0.000 5.686 -0.000) 5.686 7.570 ( -0.000 1.399 -0.000) 1.399 7.862 ( -0.000 0.281 -0.000) 0.281 7.890 ( -0.000 6.132 -0.000) 6.132 8.259 ( -0.000 0.129 -0.000) 0.129 8.341 ( 0.000 -0.402 0.000) 0.402 8.908 ( -0.000 0.470 -0.000) 0.470 11.833 ( 0.000 -14.162 0.000) 14.162 12.316 ( 0.000 -14.689 0.000) 14.689 12.826 ( -0.000 13.446 -0.000) 13.446 13.724 ( 0.000 -14.103 0.000) 14.103 14.252 ( -0.000 25.399 -0.000) 25.399 14.610 ( -0.000 20.697 -0.000) 20.697 15.178 ( -0.000 30.790 -0.000) 30.790 16.076 ( -0.000 12.090 -0.000) 12.090 26.848 ( -0.000 0.274 -0.000) 0.274 26.912 ( 0.000 -0.866 0.000) 0.866 26.959 ( -0.000 0.417 -0.000) 0.417 27.062 ( -0.000 0.060 -0.000) 0.060 28.019 ( 0.000 -1.218 0.000) 1.218 28.167 ( 0.000 -1.964 0.000) 1.964 33.781 ( 0.000 -2.045 0.000) 2.045 34.071 ( 0.000 -1.421 0.000) 1.421 34.298 ( -0.000 4.590 -0.000) 4.590 34.385 ( -0.000 7.746 -0.000) 7.746 35.256 ( -0.000 2.547 -0.000) 2.547 35.904 ( 0.000 -1.103 0.000) 1.103 37.259 ( -0.000 3.897 -0.000) 3.897 37.289 ( 0.000 -0.555 0.000) 0.555 42.656 ( -0.000 30.442 -0.000) 30.442 43.542 ( -0.000 18.556 -0.000) 18.556 44.195 ( -0.000 20.213 -0.000) 20.213 45.125 ( 0.000 -4.171 0.000) 4.171 45.135 ( -0.000 8.316 -0.000) 8.316 45.483 ( -0.000 13.710 -0.000) 13.710 45.940 ( -0.000 4.971 -0.000) 4.971 47.563 ( -0.000 10.529 -0.000) 10.529 49.778 ( -0.000 4.701 -0.000) 4.701 50.266 ( 0.000 -1.392 0.000) 1.392 50.878 ( -0.000 22.264 -0.000) 22.264 54.222 ( 0.000 -7.495 0.000) 7.495 61.230 ( 0.000 -9.038 0.000) 9.038 61.243 ( 0.000 -23.050 0.000) 23.050 67.455 ( -0.000 4.088 -0.000) 4.088 69.169 ( -0.000 20.524 -0.000) 20.524 ======================= Grid point 36 (25/204) ======================= q-point: ( 0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.824 ( 24.582 0.000 0.404) 24.586 1.922 ( 16.414 0.000 -0.155) 16.415 2.770 ( 1.714 0.000 -12.181) 12.301 2.820 ( 10.191 0.000 -1.698) 10.332 3.208 ( 8.927 0.000 -6.333) 10.945 3.226 ( 2.527 0.000 9.936) 10.252 3.489 ( -13.544 -0.000 7.582) 15.522 4.057 ( 2.080 0.000 1.055) 2.332 4.177 ( 2.645 0.000 -2.881) 3.910 4.610 ( -5.302 -0.000 0.868) 5.373 4.836 ( 0.169 0.000 0.789) 0.807 5.053 ( -2.834 -0.000 -3.670) 4.637 5.442 ( 8.781 0.000 -2.161) 9.043 5.635 ( 1.004 0.000 5.542) 5.632 5.954 ( 9.580 0.000 -2.460) 9.891 5.985 ( 10.693 0.000 0.104) 10.693 6.329 ( -1.284 -0.000 -1.553) 2.015 6.440 ( -5.273 -0.000 4.790) 7.124 6.643 ( -1.751 -0.000 -1.676) 2.423 6.972 ( 6.364 0.000 -0.104) 6.364 7.087 ( 9.940 0.000 1.581) 10.065 7.163 ( -2.874 -0.000 1.403) 3.198 7.505 ( 7.199 0.000 -3.341) 7.936 7.964 ( 5.261 0.000 -0.451) 5.281 8.038 ( -0.326 -0.000 -2.141) 2.165 8.336 ( 5.034 0.000 4.143) 6.520 8.699 ( 5.330 0.000 0.428) 5.347 8.825 ( 9.755 0.000 -1.241) 9.834 11.695 ( -23.676 -0.000 -1.861) 23.749 12.055 ( -24.897 -0.000 2.388) 25.011 12.740 ( -3.486 -0.000 1.741) 3.896 12.996 ( -17.291 -0.000 -2.352) 17.450 14.776 ( 34.814 0.000 -0.154) 34.814 15.630 ( 32.873 0.000 1.562) 32.910 15.822 ( 38.950 0.000 -1.006) 38.963 17.343 ( 4.625 0.000 -4.338) 6.341 26.841 ( -0.555 -0.000 0.615) 0.828 26.871 ( -0.269 -0.000 -0.249) 0.366 26.912 ( 0.132 0.000 -0.258) 0.290 27.030 ( -0.339 -0.000 -0.287) 0.444 28.013 ( -1.040 -0.000 -0.005) 1.040 28.178 ( -1.743 -0.000 -0.118) 1.747 33.685 ( -1.810 -0.000 0.085) 1.812 34.038 ( -0.749 -0.000 0.023) 0.749 34.592 ( 2.909 0.000 -4.052) 4.988 34.675 ( 8.691 0.000 3.509) 9.372 35.544 ( 2.351 0.000 0.412) 2.387 35.844 ( 0.781 0.000 -2.863) 2.968 37.176 ( 0.797 0.000 2.428) 2.556 37.257 ( -0.594 -0.000 -0.543) 0.805 43.670 ( 37.509 0.000 -0.691) 37.515 44.241 ( 16.640 0.000 -7.015) 18.059 44.580 ( 34.472 0.000 -1.124) 34.490 44.956 ( 1.235 0.000 -3.473) 3.686 45.382 ( 10.278 0.000 5.688) 11.747 45.534 ( -0.824 -0.000 1.685) 1.876 46.627 ( 24.007 0.000 -10.306) 26.126 47.349 ( 18.991 0.000 5.164) 19.681 50.247 ( 11.159 0.000 -0.713) 11.182 50.699 ( 20.543 0.000 -4.434) 21.016 51.295 ( 38.450 0.000 -11.468) 40.124 53.061 ( -12.529 -0.000 27.978) 30.655 61.454 ( -29.542 -0.000 14.797) 33.041 64.353 ( -74.147 -0.000 -19.936) 76.781 66.432 ( -4.347 -0.000 0.435) 4.369 70.253 ( 21.909 0.000 -30.010) 37.157 ======================= Grid point 37 (26/204) ======================= q-point: ( 0.36 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.076 ( 13.987 -1.623 -0.131) 14.081 2.128 ( 18.580 -4.251 -0.500) 19.067 2.751 ( 4.530 2.937 -9.763) 11.156 2.945 ( 9.320 -2.093 -2.273) 9.819 3.258 ( 1.939 -0.838 4.807) 5.251 3.298 ( -1.253 -2.379 1.659) 3.159 3.349 ( -9.312 1.254 3.759) 10.121 4.071 ( 0.224 0.706 0.587) 0.945 4.224 ( 4.785 -1.090 -1.672) 5.184 4.502 ( -6.017 4.450 0.715) 7.518 4.849 ( -3.148 -1.609 -0.699) 3.604 4.923 ( -1.764 8.720 -2.373) 9.207 5.430 ( 1.007 7.897 2.656) 8.393 5.700 ( -2.183 -5.294 1.717) 5.978 5.952 ( 7.409 5.636 -2.162) 9.557 6.102 ( -1.520 -3.027 -0.537) 3.429 6.275 ( 0.249 2.919 -1.316) 3.212 6.490 ( -0.364 -2.469 6.440) 6.906 6.656 ( 5.287 -2.710 -3.822) 7.064 7.038 ( 7.744 1.716 -0.605) 7.955 7.167 ( 1.068 -2.622 2.313) 3.656 7.252 ( 9.649 -3.555 0.084) 10.284 7.608 ( 11.058 -1.065 -4.994) 12.180 7.979 ( -4.731 -1.466 4.272) 6.541 8.063 ( 10.370 3.593 -4.089) 11.712 8.405 ( 2.901 -0.714 4.190) 5.146 8.779 ( 6.613 -1.931 0.120) 6.890 8.922 ( 8.986 0.951 -1.772) 9.208 11.308 ( -25.244 9.820 -0.566) 27.093 11.881 ( -27.790 -12.443 0.896) 30.462 12.630 ( -3.743 7.270 0.621) 8.200 12.908 ( -7.215 -6.119 -0.671) 9.484 15.025 ( 32.216 14.582 -0.031) 35.363 15.771 ( 34.431 19.195 1.715) 39.458 16.400 ( 25.941 -14.605 0.271) 29.771 17.351 ( 0.840 2.660 -4.162) 5.011 26.840 ( -0.320 -0.270 0.535) 0.679 26.869 ( -0.154 -0.184 -0.247) 0.344 26.919 ( 0.224 -0.752 -0.173) 0.804 27.027 ( -0.559 -0.358 -0.263) 0.714 28.000 ( -0.833 0.221 -0.008) 0.862 28.156 ( -1.563 0.374 -0.115) 1.612 33.670 ( -1.573 -0.461 0.028) 1.639 34.027 ( -0.254 0.609 0.288) 0.720 34.600 ( 2.329 1.431 -3.375) 4.343 34.767 ( 6.745 0.618 2.828) 7.340 35.554 ( 1.891 1.892 0.640) 2.751 35.852 ( 0.643 -0.613 -2.323) 2.487 37.190 ( 0.143 -0.542 1.767) 1.854 37.257 ( -0.616 -0.880 -0.275) 1.109 43.845 ( 30.609 21.122 0.793) 37.197 44.327 ( 18.716 10.718 -6.151) 22.428 44.797 ( 7.722 4.582 -4.544) 10.063 45.088 ( 8.691 -7.531 3.098) 11.910 45.539 ( 4.240 1.725 -1.330) 4.766 45.719 ( 17.506 -17.801 7.831) 26.166 46.764 ( 19.265 9.156 -9.185) 23.223 47.598 ( 16.884 -2.861 3.033) 17.391 50.347 ( 12.140 4.110 0.160) 12.817 50.957 ( 30.894 2.649 -5.423) 31.478 51.459 ( 35.672 26.003 -6.344) 44.597 53.239 ( -7.313 -24.100 16.664) 30.199 61.086 ( -41.253 -0.248 11.639) 42.864 63.417 ( -75.357 5.121 -14.732) 76.954 66.507 ( 3.113 -9.648 2.434) 10.426 70.320 ( 19.305 11.145 -21.141) 30.722 ======================= Grid point 38 (27/204) ======================= q-point: ( 0.45 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.243 ( 7.656 -4.563 -0.837) 8.952 2.385 ( 15.059 -2.845 -1.490) 15.397 2.749 ( 5.416 1.306 -6.810) 8.799 3.073 ( 8.807 -2.016 0.040) 9.035 3.170 ( -10.667 2.795 5.077) 12.140 3.281 ( -1.818 1.750 6.644) 7.107 3.401 ( 1.758 -7.748 -4.862) 9.315 4.037 ( -1.322 2.750 0.190) 3.057 4.280 ( 3.244 1.173 0.284) 3.461 4.380 ( -2.273 4.495 0.258) 5.044 4.673 ( -5.358 10.636 -3.870) 12.522 4.912 ( 1.729 -1.685 0.619) 2.492 5.298 ( -0.754 9.465 3.694) 10.188 5.690 ( -6.962 -0.292 -0.227) 6.972 5.936 ( -2.887 0.554 -0.609) 3.002 6.113 ( 4.075 0.996 0.951) 4.301 6.256 ( -0.644 -0.267 -1.835) 1.963 6.477 ( 0.130 2.958 2.305) 3.753 6.797 ( 6.125 -4.456 -0.596) 7.598 7.089 ( 3.058 -0.991 0.339) 3.232 7.243 ( 4.084 -1.395 0.708) 4.374 7.383 ( 7.987 -0.852 -3.518) 8.769 7.741 ( 11.201 0.150 -2.552) 11.489 7.958 ( -4.308 -2.083 2.353) 5.333 8.109 ( 10.713 5.382 -1.042) 12.034 8.413 ( -1.343 2.379 4.271) 5.070 8.882 ( 6.711 -0.428 -0.879) 6.782 8.973 ( 3.444 2.298 -1.545) 4.419 10.942 ( -16.803 3.878 0.418) 17.250 11.781 ( -27.943 -14.946 0.071) 31.689 12.534 ( 3.278 3.549 0.017) 4.832 12.947 ( -3.831 -6.211 0.155) 7.299 15.109 ( 32.075 20.167 -0.155) 37.888 15.867 ( 33.663 18.901 1.916) 38.654 16.775 ( 11.521 -6.294 1.120) 13.176 17.230 ( -6.366 8.533 -3.894) 11.336 26.844 ( -0.223 -0.413 0.419) 0.629 26.871 ( -0.204 -0.323 -0.210) 0.436 26.938 ( 0.504 -1.112 -0.085) 1.223 27.025 ( -0.956 -0.517 -0.229) 1.110 27.988 ( -0.516 0.256 -0.010) 0.576 28.134 ( -1.177 0.418 -0.082) 1.252 33.665 ( -1.185 -0.866 -0.012) 1.468 34.018 ( 0.181 0.457 0.379) 0.620 34.587 ( 1.842 2.387 -2.493) 3.913 34.815 ( 4.416 2.257 2.046) 5.365 35.533 ( 1.357 3.275 0.597) 3.595 35.862 ( 0.304 -0.514 -1.579) 1.688 37.207 ( 0.196 -1.020 0.725) 1.267 37.266 ( -0.993 -1.496 0.234) 1.811 43.829 ( 28.587 22.949 1.426) 36.687 44.337 ( 17.695 12.335 -6.215) 22.448 44.762 ( 4.278 5.693 -1.161) 7.216 45.273 ( 3.520 -6.444 1.183) 7.437 45.542 ( 3.929 3.506 -1.529) 5.483 46.154 ( 9.348 -12.374 9.854) 18.374 46.765 ( 15.803 13.319 -8.395) 22.308 47.794 ( 11.968 -0.611 1.505) 12.077 50.381 ( 11.302 8.772 0.289) 14.310 51.248 ( 45.212 16.048 -2.156) 48.024 51.360 ( 12.911 20.618 -2.980) 24.509 53.593 ( 1.928 -22.085 7.031) 23.257 60.614 ( -45.695 -0.107 7.004) 46.228 62.502 ( -71.725 1.441 -9.383) 72.351 66.772 ( 8.375 -14.179 3.790) 16.898 70.284 ( 17.272 14.612 -13.499) 26.345 ======================= Grid point 39 (28/204) ======================= q-point: ( 0.55 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.315 ( 1.076 3.859 -1.665) 4.339 2.532 ( 8.270 -1.457 -2.188) 8.678 2.832 ( 5.406 -5.122 -5.063) 9.005 3.034 ( -5.294 3.185 2.605) 6.705 3.222 ( 6.662 -3.979 7.111) 10.525 3.234 ( 0.426 3.477 3.867) 5.217 3.530 ( -1.165 -9.391 -6.452) 11.453 3.978 ( 0.319 3.548 0.202) 3.568 4.218 ( -5.057 5.084 1.991) 7.442 4.312 ( 1.566 6.543 -0.103) 6.729 4.495 ( 2.923 7.226 -4.288) 8.896 4.965 ( 2.048 -1.882 1.131) 3.003 5.161 ( -0.357 8.279 2.859) 8.766 5.567 ( -11.274 2.863 -1.369) 11.712 5.876 ( -4.402 0.988 1.150) 4.656 6.171 ( 4.831 -1.034 0.155) 4.942 6.242 ( -2.517 -0.661 -0.107) 2.605 6.436 ( 1.991 4.555 -0.194) 4.975 6.882 ( 2.665 0.029 1.347) 2.986 7.142 ( -1.075 -3.814 0.703) 4.025 7.265 ( 2.082 3.058 -2.050) 4.230 7.461 ( 9.100 1.012 -5.273) 10.566 7.795 ( 0.239 1.729 3.064) 3.526 7.980 ( 4.983 0.115 -0.549) 5.014 8.131 ( 8.869 5.991 -0.487) 10.714 8.339 ( -3.860 3.719 4.145) 6.776 8.861 ( -9.222 6.886 -1.039) 11.556 8.933 ( 4.872 2.659 -1.572) 5.769 10.885 ( 1.170 -7.678 0.861) 7.814 11.715 ( -25.815 -15.927 -0.160) 30.334 12.604 ( 10.064 -2.478 -0.326) 10.370 13.005 ( -3.162 -6.544 0.438) 7.281 15.151 ( 32.769 21.313 -0.400) 39.092 15.947 ( 31.799 19.804 2.402) 37.539 16.824 ( -5.477 9.982 3.231) 11.835 16.940 ( -13.214 8.533 -5.659) 16.716 26.849 ( -0.216 -0.397 0.278) 0.530 26.874 ( -0.243 -0.444 -0.181) 0.538 26.961 ( 0.885 -0.828 0.041) 1.213 27.021 ( -1.384 -0.818 -0.206) 1.621 27.982 ( -0.174 0.064 -0.009) 0.185 28.118 ( -0.723 0.175 -0.037) 0.745 33.671 ( -0.657 -1.264 -0.025) 1.425 34.018 ( 0.314 0.028 0.284) 0.424 34.557 ( 1.335 3.253 -1.492) 3.820 34.805 ( 2.138 4.320 1.237) 4.976 35.489 ( 0.809 4.160 0.389) 4.256 35.867 ( 0.066 -0.324 -0.841) 0.904 37.228 ( 0.501 -1.080 -0.108) 1.196 37.281 ( -1.255 -1.944 0.569) 2.383 43.807 ( 26.759 21.195 1.841) 34.185 44.317 ( 12.115 10.282 -6.996) 17.362 44.740 ( 8.642 6.389 1.676) 10.877 45.342 ( -3.109 -0.928 -2.003) 3.813 45.513 ( 2.487 4.459 0.478) 5.128 46.317 ( -4.673 -3.144 9.015) 10.630 46.677 ( 14.670 18.304 -5.978) 24.208 47.893 ( 7.206 1.996 0.530) 7.496 50.343 ( 10.011 11.362 0.082) 15.143 50.997 ( -3.508 29.109 0.507) 29.324 51.538 ( 47.884 16.592 -0.794) 50.683 53.940 ( -4.483 -19.465 1.643) 20.042 60.180 ( -31.536 -2.570 2.678) 31.754 61.755 ( -64.213 -5.782 -4.422) 64.625 67.100 ( 9.590 -13.044 3.450) 16.554 70.198 ( 13.364 16.056 -7.619) 22.236 ======================= Grid point 40 (29/204) ======================= q-point: (-0.36 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.175 ( -1.906 11.016 -1.586) 11.292 2.562 ( 2.012 6.483 -0.362) 6.797 2.934 ( 1.712 -3.713 -4.335) 5.959 3.007 ( -1.049 -1.769 0.945) 2.263 3.186 ( 2.296 2.966 3.906) 5.415 3.402 ( 7.942 -4.204 7.021) 11.404 3.606 ( -4.565 -5.827 -5.935) 9.487 3.950 ( 2.883 2.177 -0.487) 3.645 4.055 ( -7.581 4.551 1.296) 8.937 4.249 ( 2.754 3.853 0.146) 4.738 4.460 ( 7.276 5.899 -3.324) 9.939 4.986 ( 2.468 7.977 3.777) 9.164 5.071 ( -1.843 -1.007 -0.222) 2.112 5.339 ( -14.047 6.640 -1.535) 15.613 5.835 ( -0.728 0.810 0.750) 1.322 6.220 ( -0.990 -1.390 -0.325) 1.737 6.252 ( 2.233 -2.057 0.854) 3.154 6.364 ( -0.178 6.225 -0.598) 6.256 6.870 ( -0.095 3.243 1.530) 3.587 7.171 ( -0.952 -1.467 0.437) 1.803 7.220 ( 0.169 2.549 -2.897) 3.862 7.529 ( 8.698 2.470 -3.848) 9.827 7.738 ( -3.959 2.830 3.234) 5.843 8.026 ( 7.568 4.389 1.384) 8.857 8.110 ( 3.379 5.920 -0.569) 6.840 8.266 ( -1.621 1.922 1.709) 3.040 8.588 ( -13.063 8.637 -1.302) 15.714 8.936 ( 2.236 1.804 -0.593) 2.934 11.141 ( 11.460 -13.033 0.646) 17.367 11.698 ( -20.436 -16.580 -0.101) 26.317 12.790 ( 9.557 -5.193 -0.778) 10.904 13.097 ( -1.473 -9.746 0.766) 9.886 15.192 ( 32.407 20.994 -0.520) 38.616 15.922 ( 16.637 26.220 3.120) 31.209 16.380 ( -11.099 22.755 -1.250) 25.348 16.689 ( -17.434 7.312 -1.535) 18.968 26.852 ( -0.170 -0.258 0.130) 0.335 26.879 ( -0.129 -0.570 -0.133) 0.599 26.976 ( 0.574 0.210 0.095) 0.619 27.024 ( -0.963 -1.561 -0.128) 1.838 27.983 ( 0.025 -0.270 -0.008) 0.271 28.113 ( -0.302 -0.302 -0.004) 0.427 33.689 ( -0.141 -1.699 -0.017) 1.705 34.025 ( 0.172 -0.380 0.105) 0.430 34.510 ( 0.712 4.067 -0.550) 4.165 34.738 ( 0.439 6.355 0.488) 6.389 35.429 ( 0.332 4.489 0.137) 4.504 35.871 ( -0.003 -0.369 -0.259) 0.450 37.248 ( 0.322 -0.913 -0.297) 1.013 37.300 ( -0.766 -1.760 0.410) 1.962 43.766 ( 20.971 21.125 1.943) 29.830 44.246 ( 3.996 9.554 -6.509) 12.232 44.760 ( 12.167 8.137 3.279) 15.000 45.200 ( -12.203 5.772 -2.792) 13.785 45.467 ( 0.865 4.842 1.522) 5.149 46.242 ( -7.796 3.148 3.176) 8.988 46.491 ( 10.164 23.984 -0.814) 26.061 47.900 ( 3.050 4.503 -0.042) 5.439 50.261 ( 9.510 14.662 -0.685) 17.489 50.498 ( -11.940 19.361 1.028) 22.770 51.788 ( 46.196 23.371 2.154) 51.816 53.992 ( -28.578 -13.032 -1.996) 31.472 60.128 ( 4.449 -11.991 0.660) 12.807 61.213 ( -52.666 -9.783 -1.164) 53.579 67.368 ( 6.519 -8.432 1.868) 10.821 70.045 ( 7.355 17.766 -3.154) 19.486 ======================= Grid point 41 (30/204) ======================= q-point: (-0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.967 ( -0.000 13.952 -0.000) 13.952 2.417 ( -0.000 12.297 -0.000) 12.297 2.910 ( -0.000 7.400 -0.000) 7.400 3.025 ( 0.000 -1.033 0.000) 1.033 3.210 ( 0.000 -1.555 0.000) 1.555 3.530 ( 0.000 -2.179 0.000) 2.179 3.555 ( -0.000 5.490 -0.000) 5.490 3.955 ( 0.000 -0.427 0.000) 0.427 4.020 ( 0.000 -5.092 0.000) 5.092 4.247 ( 0.000 -1.230 0.000) 1.230 4.418 ( -0.000 6.086 -0.000) 6.086 4.751 ( -0.000 18.756 -0.000) 18.756 5.143 ( 0.000 -7.580 0.000) 7.580 5.156 ( -0.000 5.171 -0.000) 5.171 5.819 ( -0.000 1.949 -0.000) 1.949 6.198 ( -0.000 7.269 -0.000) 7.269 6.287 ( 0.000 -2.888 0.000) 2.888 6.321 ( 0.000 -3.080 0.000) 3.080 6.814 ( -0.000 3.786 -0.000) 3.786 7.155 ( -0.000 3.306 -0.000) 3.306 7.202 ( 0.000 -0.603 0.000) 0.603 7.528 ( -0.000 4.581 -0.000) 4.581 7.662 ( -0.000 3.774 -0.000) 3.774 7.979 ( -0.000 7.387 -0.000) 7.387 8.044 ( -0.000 4.188 -0.000) 4.188 8.248 ( 0.000 -0.028 0.000) 0.028 8.399 ( -0.000 4.692 -0.000) 4.692 8.927 ( -0.000 0.996 -0.000) 0.996 11.431 ( 0.000 -12.778 0.000) 12.778 11.823 ( 0.000 -17.265 0.000) 17.265 12.911 ( 0.000 -3.367 0.000) 3.367 13.284 ( 0.000 -13.822 0.000) 13.822 15.187 ( -0.000 16.308 -0.000) 16.308 15.357 ( -0.000 40.761 -0.000) 40.761 16.043 ( -0.000 25.275 -0.000) 25.275 16.405 ( -0.000 8.800 -0.000) 8.800 26.853 ( 0.000 -0.037 0.000) 0.037 26.888 ( 0.000 -0.714 0.000) 0.714 26.972 ( -0.000 0.479 -0.000) 0.479 27.043 ( 0.000 -1.323 0.000) 1.323 27.990 ( 0.000 -0.632 0.000) 0.632 28.121 ( 0.000 -0.920 0.000) 0.920 33.717 ( 0.000 -2.028 0.000) 2.028 34.034 ( 0.000 -0.799 0.000) 0.799 34.446 ( -0.000 4.724 -0.000) 4.724 34.631 ( -0.000 7.732 -0.000) 7.732 35.363 ( -0.000 4.260 -0.000) 4.260 35.878 ( 0.000 -0.596 0.000) 0.596 37.263 ( 0.000 -0.985 0.000) 0.985 37.314 ( 0.000 -0.348 0.000) 0.348 43.556 ( -0.000 25.438 -0.000) 25.438 44.071 ( -0.000 14.125 -0.000) 14.125 44.688 ( -0.000 13.011 -0.000) 13.011 45.041 ( -0.000 0.584 -0.000) 0.584 45.382 ( -0.000 7.017 -0.000) 7.017 46.126 ( -0.000 5.728 -0.000) 5.728 46.153 ( -0.000 27.054 -0.000) 27.054 47.829 ( -0.000 6.728 -0.000) 6.728 50.040 ( -0.000 16.071 -0.000) 16.071 50.290 ( -0.000 3.625 -0.000) 3.625 51.689 ( -0.000 28.271 -0.000) 28.271 53.937 ( 0.000 -10.735 0.000) 10.735 60.536 ( 0.000 -21.984 0.000) 21.984 60.950 ( 0.000 -8.069 0.000) 8.069 67.495 ( 0.000 -2.846 0.000) 2.846 69.797 ( -0.000 19.678 -0.000) 19.678 ======================= Grid point 48 (31/204) ======================= q-point: ( 0.36 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.173 ( 8.266 0.000 -0.947) 8.320 2.323 ( 18.904 0.000 0.813) 18.921 2.782 ( 1.268 0.000 -9.590) 9.673 3.013 ( 7.765 0.000 -3.459) 8.501 3.198 ( -10.282 -0.000 4.541) 11.240 3.307 ( 0.228 0.000 8.566) 8.569 3.314 ( 0.412 0.000 -0.902) 0.991 4.084 ( 0.442 0.000 0.048) 0.445 4.289 ( 8.606 0.000 -2.585) 8.986 4.444 ( -8.629 -0.000 -0.346) 8.636 4.806 ( -3.528 -0.000 0.680) 3.593 4.940 ( -4.359 -0.000 -0.817) 4.435 5.524 ( -1.263 -0.000 1.644) 2.073 5.616 ( -2.982 -0.000 1.387) 3.289 5.958 ( -7.765 -0.000 0.847) 7.811 6.122 ( 7.204 0.000 -5.702) 9.187 6.312 ( -0.387 -0.000 1.537) 1.585 6.498 ( 2.142 0.000 6.051) 6.419 6.688 ( 7.022 0.000 -4.033) 8.097 7.067 ( -2.584 -0.000 2.073) 3.313 7.217 ( 8.999 0.000 1.055) 9.061 7.359 ( 11.840 0.000 -2.222) 12.046 7.741 ( 15.977 0.000 -8.098) 17.913 7.916 ( -6.369 -0.000 5.420) 8.363 8.250 ( 17.086 0.000 -1.816) 17.183 8.429 ( 0.054 0.000 5.281) 5.281 8.831 ( 6.422 0.000 -0.141) 6.423 9.023 ( 7.399 0.000 -2.068) 7.683 11.107 ( -25.610 -0.000 -0.452) 25.614 11.456 ( -27.397 -0.000 0.659) 27.405 12.696 ( -1.029 -0.000 1.892) 2.154 12.740 ( -6.012 -0.000 -1.774) 6.269 15.439 ( 23.019 0.000 0.311) 23.021 16.264 ( 22.275 0.000 2.009) 22.365 16.568 ( 26.358 0.000 1.004) 26.377 17.376 ( 0.546 0.000 -4.664) 4.696 26.837 ( -0.123 -0.000 0.439) 0.456 26.867 ( 0.063 0.000 -0.223) 0.232 26.915 ( 0.197 0.000 -0.098) 0.220 27.018 ( -0.518 -0.000 -0.229) 0.567 27.993 ( -0.671 -0.000 -0.003) 0.671 28.142 ( -1.382 -0.000 -0.116) 1.387 33.650 ( -1.312 -0.000 -0.011) 1.312 34.028 ( -0.264 -0.000 0.369) 0.454 34.624 ( 1.518 0.000 -2.910) 3.282 34.849 ( 5.442 0.000 2.400) 5.948 35.587 ( 1.278 0.000 0.614) 1.418 35.851 ( 0.770 0.000 -1.902) 2.052 37.189 ( -0.299 -0.000 1.618) 1.645 37.244 ( -0.417 -0.000 -0.397) 0.576 44.226 ( 12.647 0.000 1.527) 12.739 44.591 ( 15.104 0.000 -5.815) 16.185 44.832 ( -2.410 -0.000 -5.255) 5.781 45.259 ( 16.443 0.000 6.850) 17.813 45.607 ( 6.652 0.000 -3.720) 7.621 45.772 ( 19.493 0.000 7.754) 20.978 46.988 ( 12.200 0.000 -8.468) 14.851 47.778 ( 15.772 0.000 2.748) 16.009 50.519 ( 12.427 0.000 0.861) 12.457 51.316 ( 34.056 0.000 -8.325) 35.059 52.179 ( 42.924 0.000 -10.996) 44.310 52.999 ( -1.198 -0.000 20.903) 20.938 60.606 ( -46.817 -0.000 9.752) 47.822 62.581 ( -73.598 -0.000 -11.786) 74.536 66.485 ( 6.240 0.000 2.466) 6.710 70.529 ( 12.522 0.000 -16.150) 20.435 ======================= Grid point 49 (32/204) ======================= q-point: ( 0.45 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.279 ( 8.192 -2.218 0.131) 8.488 2.516 ( 12.664 -0.553 -0.105) 12.676 2.749 ( -2.671 -0.180 -8.354) 8.772 3.081 ( -3.837 -0.219 -1.040) 3.981 3.123 ( 0.907 -2.648 4.018) 4.897 3.295 ( -0.741 1.255 4.798) 5.015 3.354 ( 1.673 -1.938 0.046) 2.561 4.073 ( 0.810 2.208 -0.348) 2.378 4.331 ( -5.961 1.903 0.508) 6.278 4.393 ( 7.451 0.141 -3.127) 8.082 4.724 ( -5.532 4.522 0.556) 7.167 4.904 ( -0.862 -0.732 0.417) 1.205 5.437 ( -0.702 7.019 1.733) 7.264 5.597 ( -6.177 -0.936 -0.170) 6.250 5.878 ( -6.091 -0.164 0.980) 6.172 6.178 ( 5.668 0.783 -4.568) 7.322 6.284 ( -0.290 2.745 2.322) 3.607 6.520 ( 0.875 0.806 2.441) 2.716 6.797 ( 6.277 -3.961 -1.317) 7.538 7.049 ( -3.116 -1.465 2.331) 4.158 7.314 ( 6.949 0.021 -0.100) 6.950 7.464 ( 8.289 0.275 -4.455) 9.414 7.839 ( -2.012 1.484 3.172) 4.039 7.935 ( 12.281 -2.393 -5.907) 13.836 8.363 ( 9.315 6.766 3.259) 11.965 8.439 ( 4.003 2.184 3.217) 5.581 8.921 ( 4.818 -1.728 -0.479) 5.140 9.055 ( 2.564 3.174 -2.100) 4.589 10.812 ( -15.691 2.613 0.498) 15.915 11.270 ( -24.752 -11.455 -0.163) 27.275 12.620 ( 2.099 3.370 -0.010) 3.970 12.787 ( -4.298 -6.938 0.151) 8.163 15.599 ( 17.952 7.427 0.135) 19.428 16.406 ( 20.615 9.273 2.201) 22.711 16.843 ( 12.813 -2.295 0.995) 13.055 17.303 ( -2.557 7.835 -3.959) 9.143 26.838 ( -0.049 -0.196 0.306) 0.367 26.867 ( 0.029 0.042 -0.153) 0.161 26.925 ( 0.318 -1.023 -0.050) 1.072 27.012 ( -0.604 -0.003 -0.174) 0.628 27.986 ( -0.422 0.112 -0.002) 0.437 28.126 ( -0.965 0.213 -0.082) 0.991 33.641 ( -0.918 -0.534 -0.025) 1.062 34.025 ( -0.056 0.221 0.335) 0.405 34.624 ( 1.029 1.081 -1.990) 2.487 34.894 ( 3.489 1.455 1.616) 4.112 35.586 ( 0.799 1.807 0.455) 2.028 35.857 ( 0.481 -0.263 -1.239) 1.355 37.195 ( -0.138 -0.863 0.951) 1.291 37.242 ( -0.540 -0.460 -0.171) 0.730 44.278 ( 10.206 7.489 1.690) 12.772 44.590 ( 3.987 9.708 -4.486) 11.414 44.880 ( 5.376 -3.771 -3.176) 7.295 45.347 ( 9.590 6.010 5.220) 12.463 45.641 ( 5.891 3.376 -3.562) 7.667 46.090 ( 10.077 -9.636 6.709) 15.473 47.036 ( 8.497 5.451 -6.417) 11.962 47.929 ( 10.265 0.521 1.643) 10.409 50.610 ( 10.042 5.153 0.724) 11.311 51.608 ( 20.701 6.128 -7.494) 22.853 52.290 ( 42.034 31.032 -1.114) 52.260 53.321 ( 6.570 -21.045 9.077) 23.842 60.128 ( -40.810 -1.183 6.399) 41.326 61.760 ( -61.674 3.400 -7.980) 62.281 66.657 ( 6.654 -11.327 2.480) 13.369 70.562 ( 9.103 6.634 -10.082) 15.116 ======================= Grid point 50 (33/204) ======================= q-point: ( 0.55 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.403 ( 7.103 1.418 2.274) 7.592 2.578 ( 2.176 -1.236 -4.360) 5.027 2.733 ( -3.612 -3.413 -3.361) 5.999 3.019 ( -2.875 0.682 1.490) 3.309 3.240 ( 4.398 -4.584 5.554) 8.438 3.293 ( 0.701 -0.277 2.586) 2.693 3.397 ( -0.294 -3.191 -4.835) 5.801 4.047 ( 2.623 3.367 -0.165) 4.271 4.221 ( -6.862 3.095 0.688) 7.559 4.419 ( 3.510 5.793 -1.702) 6.984 4.612 ( 0.322 4.068 0.326) 4.094 4.933 ( -0.011 -2.995 0.321) 3.013 5.335 ( 3.759 8.593 1.331) 9.473 5.491 ( -9.071 3.228 -0.703) 9.654 5.835 ( -2.998 -0.503 0.606) 3.099 6.204 ( 3.291 0.924 -3.250) 4.717 6.244 ( -1.179 1.978 2.762) 3.596 6.516 ( 1.667 2.219 0.171) 2.780 6.899 ( 2.299 -1.922 0.801) 3.102 7.059 ( -1.955 -3.535 0.685) 4.097 7.339 ( 1.935 3.501 -1.467) 4.261 7.535 ( 5.852 -0.889 -3.393) 6.823 7.789 ( -4.013 0.755 3.678) 5.496 8.088 ( 12.692 0.183 -6.763) 14.382 8.299 ( -5.557 3.882 6.342) 9.283 8.450 ( 12.706 10.146 1.519) 16.330 8.864 ( -9.170 7.615 -1.221) 11.982 9.018 ( 2.527 2.982 -1.129) 4.069 10.789 ( 2.992 -8.627 0.772) 9.164 11.215 ( -19.828 -14.075 -0.419) 24.319 12.668 ( 7.391 -2.172 -0.138) 7.705 12.833 ( -6.280 -7.081 0.219) 9.467 15.646 ( 13.719 9.325 -0.233) 16.590 16.492 ( 20.241 9.966 3.080) 22.771 16.877 ( -4.079 5.411 -0.638) 6.806 17.045 ( -5.304 18.394 -2.435) 19.298 26.842 ( -0.049 -0.290 0.149) 0.330 26.867 ( -0.068 -0.115 -0.078) 0.154 26.952 ( 0.586 -1.674 0.017) 1.774 27.002 ( -0.780 0.203 -0.124) 0.816 27.981 ( -0.153 0.077 -0.002) 0.171 28.115 ( -0.460 0.230 -0.034) 0.516 33.646 ( -0.445 -1.037 -0.017) 1.128 34.023 ( 0.085 0.151 0.185) 0.253 34.605 ( 0.574 2.063 -0.949) 2.342 34.888 ( 1.498 3.305 0.776) 3.710 35.554 ( 0.384 3.263 0.223) 3.293 35.862 ( 0.140 -0.247 -0.548) 0.617 37.218 ( 0.634 -1.504 0.208) 1.645 37.243 ( -1.031 -0.898 0.122) 1.373 44.269 ( 11.814 10.607 2.542) 16.079 44.450 ( -3.040 6.847 -4.224) 8.601 44.979 ( 9.642 1.742 -1.039) 9.853 45.341 ( 1.655 5.272 1.991) 5.874 45.617 ( 2.905 5.349 -1.989) 6.404 46.242 ( -1.184 -2.908 4.084) 5.151 46.997 ( 5.979 9.097 -3.020) 11.297 47.996 ( 4.722 1.969 0.650) 5.158 50.592 ( 6.203 8.802 0.280) 10.772 51.402 ( -2.016 28.911 -1.504) 29.020 52.445 ( 50.316 20.207 -0.951) 54.230 53.585 ( -12.606 -13.239 2.993) 18.524 59.847 ( -17.540 -6.539 2.687) 18.911 61.112 ( -40.550 2.973 -3.721) 40.829 66.950 ( 4.506 -16.550 1.664) 17.233 70.494 ( 5.513 10.768 -4.541) 12.922 ======================= Grid point 51 (34/204) ======================= q-point: (-0.36 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.325 ( -0.000 9.737 -0.000) 9.737 2.672 ( -0.000 4.347 -0.000) 4.347 2.751 ( 0.000 -12.992 0.000) 12.992 3.010 ( 0.000 -0.262 0.000) 0.262 3.260 ( -0.000 3.161 -0.000) 3.161 3.413 ( 0.000 -3.186 0.000) 3.186 3.432 ( 0.000 -9.469 0.000) 9.469 4.018 ( -0.000 3.262 -0.000) 3.262 4.097 ( -0.000 6.682 -0.000) 6.682 4.329 ( -0.000 5.787 -0.000) 5.787 4.578 ( -0.000 3.467 -0.000) 3.467 4.985 ( 0.000 -3.565 0.000) 3.565 5.235 ( -0.000 11.966 -0.000) 11.966 5.333 ( -0.000 5.419 -0.000) 5.419 5.828 ( 0.000 -0.483 0.000) 0.483 6.204 ( -0.000 0.578 -0.000) 0.578 6.233 ( 0.000 -1.221 0.000) 1.221 6.470 ( -0.000 5.479 -0.000) 5.479 6.907 ( -0.000 1.597 -0.000) 1.597 7.117 ( 0.000 -4.510 0.000) 4.510 7.274 ( -0.000 4.725 -0.000) 4.725 7.586 ( 0.000 -0.753 0.000) 0.753 7.751 ( -0.000 1.675 -0.000) 1.675 8.154 ( -0.000 2.705 -0.000) 2.705 8.192 ( -0.000 3.800 -0.000) 3.800 8.380 ( -0.000 10.602 -0.000) 10.602 8.629 ( -0.000 9.680 -0.000) 9.680 8.985 ( -0.000 2.893 -0.000) 2.893 11.028 ( 0.000 -13.417 0.000) 13.417 11.301 ( 0.000 -15.867 0.000) 15.867 12.785 ( 0.000 -3.764 0.000) 3.764 12.909 ( 0.000 -10.288 0.000) 10.288 15.593 ( -0.000 10.171 -0.000) 10.171 16.479 ( -0.000 28.894 -0.000) 28.894 16.598 ( -0.000 3.901 -0.000) 3.901 16.717 ( -0.000 19.543 -0.000) 19.543 26.847 ( 0.000 -0.310 0.000) 0.310 26.870 ( 0.000 -0.384 0.000) 0.384 26.987 ( 0.000 -2.108 0.000) 2.108 26.989 ( -0.000 0.590 -0.000) 0.590 27.980 ( 0.000 -0.066 0.000) 0.066 28.110 ( -0.000 0.054 -0.000) 0.054 33.663 ( 0.000 -1.476 0.000) 1.476 34.023 ( 0.000 -0.031 0.000) 0.031 34.568 ( -0.000 3.080 -0.000) 3.080 34.832 ( -0.000 5.128 -0.000) 5.128 35.498 ( -0.000 4.203 -0.000) 4.203 35.866 ( 0.000 -0.266 0.000) 0.266 37.240 ( 0.000 -0.449 0.000) 0.449 37.261 ( 0.000 -2.495 0.000) 2.495 44.163 ( -0.000 15.492 -0.000) 15.492 44.338 ( -0.000 4.002 -0.000) 4.002 45.008 ( -0.000 5.801 -0.000) 5.801 45.209 ( -0.000 9.203 -0.000) 9.203 45.549 ( -0.000 4.895 -0.000) 4.895 46.237 ( -0.000 1.184 -0.000) 1.184 46.849 ( -0.000 15.447 -0.000) 15.447 47.981 ( -0.000 3.409 -0.000) 3.409 50.493 ( -0.000 8.860 -0.000) 8.860 50.861 ( -0.000 34.871 -0.000) 34.871 52.491 ( -0.000 22.665 -0.000) 22.665 53.602 ( 0.000 -10.367 0.000) 10.367 59.956 ( 0.000 -15.210 0.000) 15.210 60.818 ( -0.000 0.566 -0.000) 0.566 67.225 ( 0.000 -14.619 0.000) 14.619 70.329 ( -0.000 14.423 -0.000) 14.423 ======================= Grid point 60 (35/204) ======================= q-point: ( 0.45 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.352 ( 7.490 0.000 1.067) 7.566 2.633 ( 7.491 0.000 0.226) 7.494 2.676 ( -6.059 -0.000 -6.004) 8.530 3.027 ( -4.076 -0.000 0.901) 4.174 3.122 ( 1.923 0.000 0.244) 1.939 3.330 ( -0.416 -0.000 4.237) 4.257 3.337 ( 1.044 0.000 -0.450) 1.137 4.110 ( 2.664 0.000 -0.686) 2.751 4.257 ( -7.104 -0.000 0.159) 7.106 4.502 ( 10.110 0.000 -3.464) 10.687 4.693 ( -6.616 -0.000 2.344) 7.019 4.882 ( -1.109 -0.000 0.377) 1.172 5.469 ( -2.379 -0.000 0.768) 2.500 5.547 ( -2.378 -0.000 -0.448) 2.420 5.823 ( -3.492 -0.000 0.874) 3.599 6.234 ( 4.396 0.000 -4.214) 6.089 6.307 ( -1.127 -0.000 2.721) 2.945 6.535 ( 0.260 0.000 1.575) 1.596 6.820 ( 3.890 0.000 -0.922) 3.998 7.015 ( -1.887 -0.000 1.772) 2.589 7.376 ( 3.934 0.000 0.007) 3.934 7.537 ( 5.401 0.000 -4.186) 6.833 7.801 ( -4.922 -0.000 4.560) 6.710 8.078 ( 15.762 0.000 -8.558) 17.935 8.357 ( -8.784 -0.000 6.567) 10.967 8.672 ( 16.243 0.000 1.554) 16.317 8.956 ( 3.702 0.000 -0.419) 3.726 9.083 ( -1.701 -0.000 -1.735) 2.430 10.669 ( -11.186 -0.000 0.482) 11.196 10.953 ( -13.969 -0.000 -0.292) 13.972 12.659 ( -1.350 -0.000 -0.741) 1.540 12.696 ( 0.086 0.000 0.811) 0.816 15.787 ( 7.789 0.000 0.191) 7.791 16.621 ( 8.287 0.000 1.289) 8.387 16.975 ( 9.163 0.000 0.646) 9.185 17.348 ( -0.790 -0.000 -2.387) 2.515 26.837 ( 0.008 0.000 0.162) 0.162 26.869 ( 0.097 0.000 -0.084) 0.128 26.918 ( 0.091 0.000 -0.022) 0.094 27.008 ( -0.268 -0.000 -0.090) 0.283 27.983 ( -0.232 -0.000 0.000) 0.232 28.119 ( -0.526 -0.000 -0.049) 0.528 33.629 ( -0.482 -0.000 -0.018) 0.483 34.026 ( -0.067 -0.000 0.196) 0.207 34.637 ( 0.476 0.000 -1.056) 1.158 34.939 ( 1.835 0.000 0.843) 2.020 35.607 ( 0.362 0.000 0.249) 0.440 35.857 ( 0.321 0.000 -0.658) 0.732 37.186 ( -0.260 -0.000 0.558) 0.615 37.236 ( -0.145 -0.000 -0.143) 0.203 44.386 ( 2.843 0.000 0.641) 2.915 44.760 ( -1.655 -0.000 -1.506) 2.238 44.796 ( 4.873 0.000 -1.860) 5.216 45.492 ( 3.808 0.000 2.523) 4.569 45.729 ( 3.794 0.000 -1.751) 4.178 46.152 ( 8.971 0.000 3.662) 9.690 47.122 ( 3.169 0.000 -3.706) 4.876 48.026 ( 5.299 0.000 0.896) 5.374 50.745 ( 5.822 0.000 0.534) 5.847 51.859 ( 12.817 0.000 -5.164) 13.818 52.940 ( 22.548 0.000 -4.672) 23.027 53.241 ( 11.301 0.000 9.743) 14.921 59.741 ( -25.564 -0.000 3.759) 25.839 61.218 ( -36.155 -0.000 -4.580) 36.444 66.627 ( 3.808 0.000 1.295) 4.022 70.664 ( 4.086 0.000 -5.139) 6.565 ======================= Grid point 61 (36/204) ======================= q-point: (-0.45 -0.55 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.447 ( 0.000 -5.278 0.000) 5.278 2.571 ( -0.000 5.719 -0.000) 5.719 2.693 ( 0.000 -1.426 0.000) 1.426 3.006 ( 0.000 -0.055 0.000) 0.055 3.175 ( 0.000 -5.341 0.000) 5.341 3.307 ( -0.000 1.452 -0.000) 1.452 3.370 ( 0.000 -1.625 0.000) 1.625 4.116 ( -0.000 2.262 -0.000) 2.262 4.200 ( -0.000 0.973 -0.000) 0.973 4.539 ( -0.000 5.010 -0.000) 5.010 4.633 ( -0.000 0.542 -0.000) 0.542 4.892 ( 0.000 -1.976 0.000) 1.976 5.443 ( -0.000 1.698 -0.000) 1.698 5.496 ( -0.000 4.669 -0.000) 4.669 5.809 ( 0.000 -0.586 0.000) 0.586 6.246 ( -0.000 1.272 -0.000) 1.272 6.276 ( -0.000 2.805 -0.000) 2.805 6.539 ( -0.000 0.082 -0.000) 0.082 6.872 ( 0.000 -3.326 0.000) 3.326 7.013 ( 0.000 -1.030 0.000) 1.030 7.391 ( -0.000 1.392 -0.000) 1.392 7.558 ( -0.000 0.345 -0.000) 0.345 7.775 ( -0.000 0.244 -0.000) 0.244 8.191 ( -0.000 0.014 -0.000) 0.014 8.270 ( -0.000 1.492 -0.000) 1.492 8.716 ( -0.000 7.963 -0.000) 7.963 8.914 ( -0.000 7.178 -0.000) 7.178 9.060 ( -0.000 0.772 -0.000) 0.772 10.670 ( 0.000 -7.932 0.000) 7.932 10.928 ( 0.000 -7.108 0.000) 7.108 12.682 ( 0.000 -4.056 0.000) 4.056 12.707 ( 0.000 -1.248 0.000) 1.248 15.804 ( -0.000 3.496 -0.000) 3.496 16.664 ( -0.000 0.821 -0.000) 0.821 16.977 ( -0.000 6.633 -0.000) 6.633 17.254 ( -0.000 11.085 -0.000) 11.085 26.839 ( 0.000 -0.153 0.000) 0.153 26.868 ( -0.000 0.178 -0.000) 0.178 26.930 ( 0.000 -1.321 0.000) 1.321 27.004 ( -0.000 0.296 -0.000) 0.296 27.981 ( -0.000 0.056 -0.000) 0.056 28.115 ( -0.000 0.160 -0.000) 0.160 33.631 ( 0.000 -0.555 0.000) 0.555 34.026 ( -0.000 0.097 -0.000) 0.097 34.631 ( -0.000 0.988 -0.000) 0.988 34.937 ( -0.000 1.711 -0.000) 1.711 35.596 ( -0.000 1.789 -0.000) 1.789 35.860 ( 0.000 -0.128 0.000) 0.128 37.196 ( 0.000 -1.321 0.000) 1.321 37.235 ( -0.000 0.004 -0.000) 0.004 44.397 ( -0.000 0.679 -0.000) 0.679 44.589 ( -0.000 12.868 -0.000) 12.868 44.947 ( 0.000 -8.389 0.000) 8.389 45.470 ( -0.000 5.716 -0.000) 5.716 45.715 ( -0.000 4.235 -0.000) 4.235 46.219 ( 0.000 -1.333 0.000) 1.333 47.111 ( -0.000 3.265 -0.000) 3.265 48.048 ( -0.000 1.076 -0.000) 1.076 50.737 ( -0.000 5.201 -0.000) 5.201 51.778 ( -0.000 18.411 -0.000) 18.411 52.995 ( -0.000 9.071 -0.000) 9.071 53.360 ( 0.000 -4.495 0.000) 4.495 59.638 ( 0.000 -5.293 0.000) 5.293 60.956 ( -0.000 5.504 -0.000) 5.504 66.747 ( 0.000 -11.901 0.000) 11.901 70.640 ( -0.000 5.372 -0.000) 5.372 ======================= Grid point 123 (37/204) ======================= q-point: ( 0.00 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.511 ( -3.756 -0.000 24.633) 24.918 0.565 ( -15.183 -0.000 27.213) 31.162 0.835 ( -2.441 -0.000 39.565) 39.640 2.367 ( 2.265 0.000 -9.648) 9.910 2.547 ( 5.951 0.000 -14.373) 15.556 3.610 ( 2.078 0.000 -12.227) 12.403 3.674 ( 27.900 0.000 -0.809) 27.911 3.836 ( -5.785 -0.000 3.070) 6.549 4.256 ( 14.690 0.000 6.161) 15.930 4.329 ( -7.341 -0.000 -12.239) 14.272 4.551 ( -18.303 -0.000 6.288) 19.353 4.957 ( 1.110 0.000 10.565) 10.623 5.162 ( 3.430 0.000 4.700) 5.819 5.540 ( 17.983 0.000 -4.261) 18.481 5.590 ( 32.308 0.000 1.759) 32.356 5.734 ( 2.345 0.000 -4.115) 4.737 6.146 ( -34.068 -0.000 1.793) 34.115 6.656 ( 3.519 0.000 -5.465) 6.500 6.888 ( 2.145 0.000 0.216) 2.156 7.002 ( -0.140 -0.000 -1.045) 1.055 7.249 ( -1.722 -0.000 0.423) 1.773 7.411 ( 0.486 0.000 -1.649) 1.720 7.624 ( -29.224 -0.000 0.457) 29.228 7.641 ( 3.380 0.000 0.236) 3.388 8.025 ( -5.204 -0.000 4.004) 6.566 8.405 ( -18.706 -0.000 -1.009) 18.733 8.436 ( -9.823 -0.000 -0.895) 9.864 8.494 ( 2.779 0.000 -0.741) 2.876 11.916 ( 131.081 0.000 0.848) 131.084 11.935 ( -8.244 -0.000 0.689) 8.273 13.066 ( 15.797 0.000 -2.365) 15.973 13.124 ( 18.642 0.000 -5.616) 19.469 13.420 ( 21.798 0.000 2.308) 21.920 13.424 ( -22.578 -0.000 5.053) 23.137 13.988 ( 2.917 0.000 2.690) 3.968 14.378 ( -0.740 -0.000 -2.536) 2.642 26.854 ( 2.362 0.000 -0.001) 2.362 26.870 ( 0.453 0.000 -0.374) 0.587 26.943 ( -0.478 -0.000 0.836) 0.963 27.026 ( 0.200 0.000 -0.524) 0.561 28.087 ( -0.189 -0.000 1.142) 1.157 28.243 ( 0.132 0.000 -1.141) 1.149 33.870 ( -0.956 -0.000 1.398) 1.694 34.034 ( 2.894 0.000 1.163) 3.119 34.128 ( 4.695 0.000 -3.024) 5.584 34.180 ( -18.097 -0.000 -0.594) 18.107 35.254 ( -3.950 -0.000 4.367) 5.888 35.810 ( -1.017 -0.000 -4.229) 4.350 37.047 ( 0.638 0.000 2.135) 2.228 37.276 ( -0.426 -0.000 -1.390) 1.453 42.130 ( -4.940 -0.000 0.248) 4.946 42.290 ( 193.198 0.000 -2.523) 193.214 42.870 ( 29.677 0.000 3.354) 29.866 43.203 ( -13.280 -0.000 -2.026) 13.434 45.065 ( 21.622 0.000 0.425) 21.626 45.142 ( 3.060 0.000 -2.101) 3.712 45.347 ( -5.060 -0.000 7.027) 8.659 45.998 ( 1.341 0.000 -3.987) 4.207 49.535 ( -3.076 -0.000 0.696) 3.154 49.620 ( 71.290 0.000 -0.539) 71.292 50.364 ( 0.734 0.000 0.077) 0.738 50.387 ( -0.640 -0.000 -0.248) 0.687 61.560 ( 9.976 0.000 3.022) 10.424 61.963 (-130.062 -0.000 -2.898) 130.094 67.333 ( -3.281 -0.000 6.883) 7.625 68.293 ( 3.482 0.000 -7.199) 7.997 ======================= Grid point 124 (38/204) ======================= q-point: ( 0.09 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.698 ( 7.333 -14.858 16.114) 23.112 0.758 ( 3.805 -18.070 18.623) 26.227 1.428 ( 34.396 -28.595 22.079) 49.882 2.379 ( 5.116 0.097 -9.579) 10.860 2.603 ( 6.556 -1.821 -13.367) 14.999 3.472 ( -8.951 3.688 -7.431) 12.205 3.690 ( 4.463 9.243 1.408) 10.360 3.985 ( 12.672 -1.489 -3.159) 13.144 4.257 ( -3.698 2.203 -4.999) 6.597 4.350 ( -5.112 0.003 9.111) 10.447 4.437 ( 13.858 3.123 2.365) 14.401 4.932 ( -3.523 2.958 5.425) 7.113 5.221 ( 1.479 -1.072 1.483) 2.353 5.415 ( 9.414 18.183 10.193) 22.873 5.564 ( -2.417 -5.849 -2.102) 6.668 5.862 ( -10.668 -1.148 -4.736) 11.729 6.069 ( 12.179 0.681 -1.754) 12.323 6.703 ( 3.922 -1.451 -3.674) 5.566 6.901 ( 0.147 2.039 -0.769) 2.184 7.016 ( -0.728 -2.982 -0.765) 3.164 7.169 ( -5.897 1.606 0.816) 6.166 7.237 ( -8.956 3.667 2.868) 10.094 7.507 ( -0.531 -3.633 0.632) 3.726 7.734 ( 10.027 -1.560 0.928) 10.190 7.955 ( -3.812 2.463 1.724) 4.855 8.238 ( -1.553 -2.192 4.424) 5.176 8.436 ( 2.807 1.167 -1.275) 3.296 8.643 ( -7.413 -9.909 -3.001) 12.734 11.840 ( 4.488 4.122 0.947) 6.167 12.535 ( -16.321 13.427 -0.647) 21.145 13.042 ( 21.197 19.545 -2.405) 28.933 13.446 ( -14.632 -21.241 -0.592) 25.799 13.585 ( 29.742 -6.831 -11.806) 32.720 14.075 ( 11.762 -8.692 0.721) 14.643 14.227 ( -7.267 0.747 -5.387) 9.077 15.282 ( 100.926 -38.824 -54.078) 120.904 26.858 ( 0.870 0.531 0.145) 1.029 26.911 ( 0.164 -1.832 -1.631) 2.458 26.938 ( -0.793 -0.268 0.555) 1.004 27.026 ( -0.007 -0.303 -0.693) 0.756 28.080 ( -0.671 0.569 1.100) 1.408 28.230 ( -0.320 0.907 -1.265) 1.589 33.838 ( -3.528 0.391 1.193) 3.745 34.068 ( -3.119 0.717 -1.149) 3.401 34.148 ( 6.847 -2.697 0.635) 7.386 34.216 ( 9.365 -0.273 -3.403) 9.968 35.297 ( 5.406 0.762 3.966) 6.748 35.821 ( -1.565 -2.668 -6.303) 7.021 37.089 ( 1.721 -2.619 2.505) 4.012 37.273 ( -0.042 -0.253 -1.424) 1.447 41.954 ( 9.643 6.757 5.036) 12.807 42.895 ( 13.994 -10.437 -8.382) 19.365 43.034 ( -8.935 0.854 -7.168) 11.486 44.678 ( 14.944 -16.252 -15.054) 26.722 45.225 ( 2.766 4.102 -0.510) 4.974 45.231 ( 9.997 -1.059 -0.816) 10.086 45.896 ( 4.248 -3.484 -9.077) 10.610 46.458 ( 47.726 -42.861 -35.816) 73.469 49.515 ( 1.737 0.216 0.846) 1.944 50.299 ( 2.197 3.551 -4.459) 6.108 50.369 ( -0.849 0.023 -0.018) 0.849 52.354 ( 179.680 -84.196 -133.054) 238.908 61.478 ( 17.094 12.435 -4.963) 21.714 61.907 ( 61.132 -10.230 -25.299) 66.946 67.305 ( -11.347 -4.141 6.503) 13.718 68.345 ( -1.420 -8.020 -6.880) 10.661 ======================= Grid point 125 (39/204) ======================= q-point: ( 0.18 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.090 ( 11.657 -17.057 9.573) 22.770 1.169 ( 7.304 -21.198 11.714) 25.297 2.272 ( 25.687 -22.364 1.722) 34.102 2.465 ( 9.883 -6.473 -4.363) 12.594 2.687 ( 6.253 -6.079 -10.896) 13.956 3.335 ( -2.408 4.424 -0.709) 5.086 3.631 ( 4.264 4.208 2.557) 6.514 4.025 ( 1.689 7.857 6.213) 10.158 4.122 ( -5.119 1.344 -1.885) 5.618 4.421 ( 1.362 -1.696 3.024) 3.725 4.596 ( 19.856 0.328 -2.192) 19.979 4.830 ( -3.706 5.795 1.805) 7.112 5.256 ( -2.274 -4.707 -1.908) 5.564 5.369 ( 13.482 7.757 4.834) 16.288 5.609 ( -6.222 -2.753 -1.884) 7.060 5.790 ( 0.744 -0.931 -4.357) 4.517 6.149 ( 4.735 -0.769 -0.792) 4.862 6.748 ( 2.172 0.085 -1.182) 2.474 6.818 ( -1.700 6.374 -0.237) 6.601 7.043 ( -4.796 -2.774 2.817) 6.216 7.125 ( 0.506 0.431 -2.498) 2.585 7.168 ( -3.969 -3.541 1.454) 5.515 7.552 ( 1.084 -2.125 -1.179) 2.661 7.847 ( -0.268 -0.999 3.312) 3.470 7.922 ( 8.048 1.025 -2.406) 8.462 8.283 ( -0.320 -2.659 3.883) 4.717 8.469 ( 5.487 -0.025 -0.155) 5.489 8.682 ( -5.160 -5.823 -2.686) 8.231 11.824 ( 1.463 5.044 0.513) 5.277 12.174 ( -10.704 10.397 -0.174) 14.923 13.014 ( 21.019 15.152 -1.644) 25.963 13.517 ( -19.106 -7.146 1.539) 20.457 13.648 ( -10.426 -5.627 -1.273) 11.916 14.105 ( -7.394 0.545 -1.319) 7.530 14.729 ( 42.207 -25.925 -6.614) 49.973 16.305 ( 48.608 -11.411 -23.938) 55.371 26.863 ( 0.646 0.101 0.230) 0.693 26.909 ( -1.594 -0.142 0.283) 1.625 26.948 ( 0.145 -0.997 -0.555) 1.150 27.034 ( 0.242 -0.756 -1.066) 1.329 28.061 ( -0.991 1.013 0.982) 1.724 28.204 ( -0.480 1.430 -1.277) 1.977 33.796 ( -2.960 0.697 1.082) 3.228 34.027 ( -2.351 -0.204 -1.716) 2.918 34.258 ( 7.274 -0.102 -0.545) 7.295 34.326 ( 8.631 -2.278 -0.532) 8.942 35.345 ( 4.177 1.240 4.611) 6.344 35.824 ( -0.658 -1.411 -5.937) 6.138 37.165 ( 1.864 -3.399 2.291) 4.503 37.278 ( 0.025 -0.845 -1.134) 1.414 42.040 ( 1.772 -6.949 4.143) 8.282 42.912 ( -7.221 0.991 -4.526) 8.580 43.375 ( 30.123 -20.855 -9.421) 37.830 44.877 ( 3.797 -7.354 -4.369) 9.358 45.171 ( 0.241 3.183 0.651) 3.257 45.415 ( 15.037 -2.616 -3.792) 15.727 45.897 ( -1.558 -2.339 -0.936) 2.962 47.099 ( 10.304 -18.612 -9.973) 23.495 49.550 ( 1.552 -1.864 0.646) 2.510 50.257 ( 2.640 3.004 -3.729) 5.468 50.358 ( -1.031 0.068 0.028) 1.033 54.199 ( 54.885 -34.678 -64.403) 91.448 61.440 ( 24.923 21.510 2.142) 32.991 62.772 ( 93.385 9.976 -62.517) 112.821 67.218 ( -18.283 -3.865 7.127) 20.000 68.480 ( -1.584 -13.726 -8.316) 16.127 ======================= Grid point 126 (40/204) ======================= q-point: ( 0.27 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.507 ( 12.539 -16.882 6.112) 21.900 1.599 ( 7.630 -20.466 8.683) 23.505 2.491 ( 5.800 -1.003 -11.644) 13.048 2.650 ( -1.014 -7.878 -10.773) 13.384 3.080 ( 16.258 -15.700 5.480) 23.256 3.269 ( 2.179 4.546 3.512) 6.143 3.702 ( 12.213 -0.570 0.102) 12.227 3.868 ( -6.081 8.705 11.142) 15.392 4.112 ( 0.951 -2.211 -5.231) 5.758 4.425 ( -1.152 1.216 3.060) 3.488 4.688 ( -4.159 6.835 0.838) 8.045 4.762 ( 12.493 3.265 -0.701) 12.932 5.269 ( -4.380 -2.670 -2.122) 5.551 5.503 ( -3.403 4.068 -2.306) 5.783 5.551 ( 21.655 -2.235 -1.394) 21.815 5.863 ( 2.208 -4.339 -1.726) 5.165 6.218 ( 1.575 -4.171 -1.917) 4.853 6.700 ( -1.873 6.130 1.227) 6.527 6.735 ( 0.361 2.550 0.058) 2.576 7.022 ( -5.739 -2.005 2.744) 6.669 7.149 ( 2.868 -1.714 -2.066) 3.928 7.214 ( -3.005 -5.243 1.700) 6.277 7.615 ( 4.230 -3.703 -2.839) 6.298 7.823 ( -1.172 1.518 0.730) 2.052 8.029 ( 8.199 -0.825 -0.132) 8.241 8.319 ( -0.073 -1.118 3.250) 3.438 8.567 ( 8.965 -2.322 0.357) 9.267 8.698 ( -4.407 -4.117 -2.648) 6.587 11.638 ( -8.461 12.403 -0.119) 15.015 12.047 ( 1.126 1.325 0.366) 1.777 12.962 ( -0.412 11.595 -0.616) 11.619 13.308 ( 3.197 11.417 0.588) 11.871 13.696 ( -21.288 -18.955 0.359) 28.506 14.039 ( -4.270 -0.541 0.069) 4.305 15.583 ( 39.537 -24.666 -4.745) 46.841 16.804 ( 27.286 -5.467 -9.580) 29.431 26.870 ( 0.553 -0.006 0.131) 0.569 26.896 ( -1.171 -0.222 0.713) 1.389 26.961 ( -0.062 -0.803 -0.425) 0.910 27.047 ( 0.387 -0.826 -1.150) 1.467 28.034 ( -1.061 1.144 0.835) 1.769 28.173 ( -0.461 1.484 -1.126) 1.919 33.757 ( -2.118 0.897 0.861) 2.456 34.013 ( -1.459 -1.019 -1.664) 2.436 34.318 ( 5.006 0.517 -1.270) 5.190 34.461 ( 7.669 -2.535 1.086) 8.150 35.375 ( 2.712 1.443 4.974) 5.846 35.825 ( 0.140 -0.806 -5.124) 5.189 37.231 ( 0.698 -2.525 1.294) 2.922 37.297 ( 0.594 -1.416 -0.510) 1.618 42.198 ( -2.834 -12.703 3.201) 13.403 42.815 ( -3.602 2.579 -3.713) 5.780 44.051 ( 30.359 -19.360 -3.681) 36.195 45.027 ( 4.446 -7.042 -2.996) 8.851 45.169 ( 4.206 -1.940 -0.261) 4.639 45.560 ( 8.713 1.858 -2.275) 9.194 46.020 ( 8.661 -10.454 -0.928) 13.607 47.387 ( 4.470 -11.776 -2.681) 12.878 49.603 ( 1.350 -2.554 0.506) 2.933 50.285 ( 8.687 -0.829 -3.459) 9.387 50.346 ( -0.675 0.200 -0.017) 0.705 54.752 ( 2.339 -14.202 -21.272) 25.684 61.437 ( 30.279 20.054 8.397) 37.276 63.338 ( 69.866 15.946 -51.353) 88.163 67.051 ( -21.828 -1.957 7.285) 23.094 68.669 ( -0.976 -14.778 -9.623) 17.662 ======================= Grid point 127 (41/204) ======================= q-point: ( 0.36 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.897 ( 10.677 -14.567 4.432) 18.597 1.998 ( 7.306 -17.810 7.150) 20.535 2.463 ( -1.656 2.465 -13.100) 13.432 2.752 ( 2.627 -5.775 -5.417) 8.343 3.228 ( 2.087 3.382 6.710) 7.799 3.396 ( 6.217 -7.792 3.360) 10.519 3.676 ( -3.656 8.476 7.082) 11.635 3.844 ( 5.377 1.687 -1.187) 5.759 4.188 ( 3.054 -5.294 -3.884) 7.242 4.401 ( -0.819 -0.215 1.343) 1.588 4.535 ( -4.215 6.805 0.348) 8.012 4.798 ( 6.202 4.383 0.943) 7.653 5.254 ( -1.824 -1.055 -2.329) 3.141 5.396 ( -4.024 2.335 -2.320) 5.199 5.850 ( 19.170 -1.759 -1.261) 19.292 5.936 ( 0.869 -4.557 -0.747) 4.699 6.294 ( 1.461 -3.642 -2.627) 4.723 6.597 ( -1.700 4.982 1.457) 5.462 6.722 ( 2.580 0.372 0.136) 2.610 6.983 ( -5.414 -0.183 1.251) 5.560 7.201 ( -5.169 -5.227 3.143) 7.995 7.289 ( 6.922 -3.379 -1.291) 7.810 7.741 ( 4.878 -5.768 -2.921) 8.099 7.782 ( -0.537 2.788 0.048) 2.839 8.115 ( 5.233 -0.527 1.052) 5.364 8.330 ( 0.596 0.741 2.330) 2.516 8.694 ( -4.179 -2.414 -2.296) 5.345 8.731 ( 9.908 -4.166 -0.143) 10.749 11.347 ( -8.660 11.343 -0.329) 14.275 12.070 ( 2.737 -0.044 0.399) 2.766 12.660 ( -16.913 9.336 0.257) 19.320 13.302 ( 18.956 9.971 0.289) 21.421 13.717 ( -19.704 -13.951 0.270) 24.144 14.023 ( -2.366 -1.838 0.348) 3.017 16.290 ( 28.644 -17.858 -2.810) 33.871 17.063 ( 12.530 -1.637 -4.289) 13.344 26.874 ( 0.407 0.131 -0.129) 0.446 26.894 ( -0.674 -0.421 1.019) 1.292 26.969 ( -0.116 -0.531 -0.326) 0.634 27.061 ( 0.406 -0.658 -1.060) 1.312 28.009 ( -0.849 0.895 0.713) 1.425 28.146 ( -0.269 1.078 -0.941) 1.456 33.727 ( -1.312 0.728 0.682) 1.648 34.012 ( -0.691 -0.887 -1.960) 2.260 34.356 ( 2.901 -0.095 -0.296) 2.917 34.568 ( 5.196 -1.505 0.818) 5.472 35.385 ( 1.199 1.482 4.852) 5.213 35.829 ( 0.587 -0.731 -4.236) 4.338 37.263 ( -0.205 -1.299 0.250) 1.339 37.326 ( 0.765 -1.180 -0.062) 1.408 42.363 ( -4.277 -12.612 2.481) 13.547 42.732 ( -0.943 4.007 -3.064) 5.131 44.478 ( 11.680 -5.977 0.398) 13.127 45.128 ( 2.676 -2.985 -2.874) 4.932 45.394 ( 12.595 -10.940 0.404) 16.688 45.566 ( 1.726 3.121 0.463) 3.596 46.358 ( 16.542 -12.292 -2.691) 20.784 47.565 ( 2.045 -7.255 -0.750) 7.574 49.654 ( 0.982 -2.068 0.395) 2.323 50.336 ( 0.122 0.558 -0.389) 0.691 50.494 ( 17.483 -8.156 -2.886) 19.507 54.684 ( -21.398 1.496 -5.804) 22.222 61.532 ( 25.886 13.449 12.277) 31.649 63.671 ( 45.210 9.750 -36.861) 59.142 66.846 ( -18.666 0.301 6.664) 19.822 68.843 ( -1.210 -12.111 -10.091) 15.810 ======================= Grid point 128 (42/204) ======================= q-point: ( 0.45 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.170 ( 4.863 -6.357 2.769) 8.469 2.239 ( -2.500 -0.524 -3.653) 4.457 2.432 ( 2.173 -9.175 -1.298) 9.518 2.841 ( 5.214 -1.899 0.681) 5.591 3.213 ( 0.344 2.844 5.050) 5.806 3.479 ( -1.077 3.230 4.158) 5.374 3.590 ( 1.479 3.524 3.465) 5.159 3.833 ( -1.657 -3.051 -1.293) 3.705 4.257 ( 0.840 -2.085 -3.447) 4.115 4.395 ( -3.307 4.061 -2.032) 5.618 4.446 ( 0.295 -2.991 1.970) 3.593 4.795 ( 3.736 3.543 0.753) 5.204 5.258 ( 0.644 -1.001 -1.341) 1.793 5.329 ( -1.875 1.322 -3.148) 3.895 5.936 ( 1.752 0.060 -0.216) 1.767 6.066 ( 4.632 -3.260 -0.436) 5.681 6.337 ( 1.782 -0.684 -2.109) 2.845 6.521 ( -1.778 2.770 0.509) 3.331 6.776 ( 4.799 -1.110 -0.030) 4.925 6.912 ( -4.548 2.082 -0.193) 5.005 7.220 ( -6.284 -4.914 4.826) 9.324 7.439 ( 8.777 -3.049 -2.236) 9.557 7.721 ( -1.880 3.737 0.775) 4.255 7.846 ( 0.297 -3.742 -1.096) 3.911 8.179 ( 3.933 -1.072 -0.061) 4.077 8.322 ( 0.826 1.909 2.084) 2.944 8.672 ( -2.700 -1.072 -1.991) 3.522 8.872 ( 4.559 -2.057 -0.792) 5.064 11.142 ( -3.370 4.885 -0.282) 5.941 12.092 ( 1.287 0.601 -0.104) 1.424 12.410 ( -7.232 3.681 0.804) 8.155 13.359 ( 10.393 5.145 0.522) 11.609 13.700 ( -10.316 -6.372 0.062) 12.125 14.029 ( -1.174 -1.117 0.242) 1.638 16.734 ( 14.171 -8.584 -1.194) 16.611 17.119 ( -0.079 1.798 -3.244) 3.710 26.875 ( 0.333 0.308 -0.210) 0.500 26.895 ( -0.593 -0.300 0.989) 1.191 26.974 ( 0.057 -0.262 -0.223) 0.349 27.070 ( 0.264 -0.324 -0.947) 1.035 27.994 ( -0.413 0.336 0.647) 0.838 28.131 ( 0.026 0.370 -0.813) 0.893 33.709 ( -0.544 0.307 0.577) 0.850 34.012 ( 0.084 -0.112 -2.322) 2.326 34.386 ( 0.825 -0.951 0.828) 1.507 34.622 ( 1.924 -0.091 0.263) 1.944 35.380 ( -0.281 1.188 4.366) 4.533 35.841 ( 0.756 -0.977 -3.345) 3.566 37.273 ( -0.300 -0.341 -0.159) 0.481 37.343 ( 0.386 -0.215 -0.184) 0.478 42.476 ( -0.355 -3.398 1.841) 3.881 42.669 ( -2.845 -0.693 -2.546) 3.880 44.597 ( 2.806 -1.570 1.707) 3.640 45.187 ( 1.658 -2.388 -3.633) 4.653 45.509 ( -1.595 2.678 2.769) 4.169 45.654 ( 7.380 -4.046 0.284) 8.421 46.649 ( 9.157 -5.338 -2.103) 10.806 47.649 ( -0.203 -2.390 -0.284) 2.416 49.685 ( 0.431 -0.682 0.344) 0.877 50.329 ( 0.486 0.650 -0.481) 0.944 50.835 ( 13.979 -8.870 -2.198) 16.701 54.353 ( -16.624 6.641 -1.142) 17.938 61.599 ( 7.139 7.463 11.755) 15.647 63.909 ( 21.380 -2.132 -25.735) 33.525 66.691 ( -6.431 2.386 5.853) 9.017 68.952 ( -2.078 -7.385 -10.001) 12.605 ======================= Grid point 129 (43/204) ======================= q-point: (-0.45 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.060 ( -7.851 9.117 -6.365) 13.611 2.184 ( -5.831 5.204 3.589) 8.600 2.624 ( 1.308 -7.922 1.174) 8.114 2.965 ( 6.685 -3.218 3.601) 8.247 3.145 ( -1.536 6.364 2.598) 7.044 3.407 ( -3.910 2.263 2.958) 5.400 3.532 ( 5.426 5.988 1.105) 8.156 3.931 ( -5.010 -10.387 3.819) 12.148 4.273 ( 0.851 0.673 -3.178) 3.358 4.335 ( -1.411 -0.909 -1.106) 2.010 4.469 ( -4.691 -2.085 -2.158) 5.569 4.793 ( 4.000 1.457 2.070) 4.733 5.288 ( -3.841 -4.904 -2.300) 6.640 5.304 ( 6.248 3.456 -2.322) 7.508 5.947 ( -0.920 -0.832 0.105) 1.245 6.081 ( -4.065 2.172 0.224) 4.614 6.364 ( 2.128 -0.834 -1.901) 2.973 6.469 ( -2.844 0.572 -0.697) 2.983 6.820 ( -2.366 1.703 2.075) 3.578 6.849 ( 4.248 1.425 -2.496) 5.129 7.232 ( -4.506 -2.953 4.794) 7.211 7.489 ( -1.781 3.259 -1.319) 3.942 7.655 ( 1.201 2.415 -0.306) 2.714 7.867 ( -1.121 -1.276 -0.697) 1.835 8.189 ( -3.844 1.592 0.061) 4.161 8.319 ( 0.424 -0.437 2.149) 2.233 8.681 ( 3.220 -0.508 -1.719) 3.685 8.859 ( -4.998 2.986 -1.168) 5.939 11.153 ( 5.058 -4.988 0.009) 7.103 12.078 ( -0.563 1.238 -0.477) 1.441 12.419 ( 8.458 -3.371 1.051) 9.166 13.364 ( -6.703 -2.761 0.693) 7.282 13.695 ( 5.477 3.430 -0.120) 6.464 14.026 ( 0.340 0.952 0.148) 1.022 16.803 ( -8.106 6.550 2.053) 10.622 17.048 ( -5.082 -0.260 -6.561) 8.303 26.871 ( 0.289 0.514 -0.227) 0.632 26.893 ( -0.680 -0.080 0.783) 1.040 26.978 ( 0.289 0.020 -0.056) 0.295 27.071 ( 0.054 0.092 -0.910) 0.916 27.993 ( 0.095 -0.336 0.635) 0.725 28.132 ( 0.362 -0.437 -0.784) 0.968 33.708 ( 0.219 -0.186 0.534) 0.607 34.006 ( 0.807 0.667 -2.404) 2.622 34.405 ( -1.211 -1.306 1.338) 2.228 34.616 ( -1.569 1.085 0.041) 1.908 35.366 ( -1.648 0.521 3.724) 4.106 35.860 ( 0.720 -1.221 -2.586) 2.949 37.267 ( -0.101 0.773 -0.343) 0.852 37.341 ( -0.070 0.634 -0.244) 0.683 42.436 ( 5.679 11.453 0.211) 12.786 42.704 ( -6.928 -10.128 -1.073) 12.317 44.638 ( -0.273 -1.342 3.129) 3.415 45.215 ( -0.290 -1.303 -3.857) 4.081 45.448 ( -2.986 2.507 1.756) 4.276 45.682 ( -1.124 4.949 1.195) 5.214 46.689 ( -3.790 3.612 -0.928) 5.318 47.629 ( -2.155 3.096 -0.877) 3.873 49.684 ( -0.414 0.944 0.303) 1.074 50.325 ( 0.924 0.741 -0.552) 1.307 50.913 ( -9.513 2.588 0.056) 9.859 54.245 ( 9.830 1.876 -4.393) 10.929 61.493 ( -15.438 2.685 7.115) 17.210 64.102 ( -4.045 -17.408 -18.791) 25.933 66.679 ( 10.622 3.911 5.841) 12.738 68.970 ( -3.388 -1.900 -9.788) 10.530 ======================= Grid point 130 (44/204) ======================= q-point: (-0.36 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.780 ( -10.643 12.369 -1.667) 16.403 1.950 ( -11.746 12.673 5.430) 18.113 2.679 ( -1.237 -0.138 -2.785) 3.050 2.901 ( -8.844 6.542 -10.969) 15.535 3.147 ( 9.413 4.245 10.983) 15.075 3.356 ( -4.512 -0.220 6.056) 7.556 3.579 ( 6.481 -1.981 1.456) 6.932 3.950 ( -16.013 -3.307 3.016) 16.626 4.239 ( -0.795 1.483 -1.093) 2.007 4.334 ( 1.198 0.467 0.007) 1.286 4.482 ( -0.241 -6.404 -3.697) 7.398 4.853 ( 0.559 -3.357 3.774) 5.081 5.315 ( 3.003 -2.035 -6.044) 7.049 5.349 ( 3.513 -0.898 0.991) 3.759 5.855 ( -20.094 4.190 -0.913) 20.546 5.968 ( 0.495 3.601 0.344) 3.651 6.389 ( 0.058 0.160 0.269) 0.318 6.450 ( -0.436 -2.119 -3.321) 3.963 6.768 ( -1.734 0.799 1.370) 2.350 6.873 ( 5.396 2.794 -1.203) 6.194 7.229 ( -2.507 -0.400 3.384) 4.230 7.370 ( -5.914 3.200 1.176) 6.826 7.641 ( 3.466 3.934 -3.325) 6.208 7.881 ( 0.520 -1.022 0.148) 1.156 8.074 ( -9.696 1.817 0.243) 9.868 8.331 ( -1.571 -0.703 2.093) 2.709 8.692 ( -9.052 3.493 -1.805) 9.869 8.738 ( 5.739 2.955 -0.318) 6.462 11.377 ( 10.481 -11.338 0.553) 15.451 12.045 ( -2.718 0.628 -0.354) 2.812 12.680 ( 20.213 -8.060 0.850) 21.777 13.306 ( -18.335 -8.316 0.457) 20.138 13.703 ( 15.582 11.602 -0.244) 19.429 14.018 ( 2.182 1.449 0.226) 2.629 16.425 ( -25.473 16.527 2.635) 30.479 16.923 ( -14.231 2.216 -10.029) 17.550 26.865 ( 0.222 0.583 -0.194) 0.653 26.887 ( -0.512 0.053 0.477) 0.702 26.979 ( 0.376 0.316 0.144) 0.512 27.064 ( -0.085 0.485 -0.986) 1.102 28.008 ( 0.487 -0.881 0.668) 1.208 28.148 ( 0.680 -1.118 -0.864) 1.568 33.722 ( 1.034 -0.574 0.560) 1.309 34.001 ( 1.383 0.906 -2.184) 2.739 34.397 ( -3.196 -0.157 0.681) 3.272 34.563 ( -4.696 0.912 0.721) 4.838 35.347 ( -2.896 -0.447 3.174) 4.320 35.881 ( 0.573 -1.218 -2.162) 2.547 37.243 ( 0.112 2.281 -0.310) 2.304 37.325 ( -0.511 0.864 -0.122) 1.011 42.291 ( 5.287 15.034 -0.140) 15.938 42.782 ( -5.624 -9.289 -1.059) 10.910 44.622 ( -6.165 2.021 5.561) 8.545 45.203 ( -2.215 0.030 -1.822) 2.868 45.354 ( -5.385 5.553 -0.433) 7.747 45.540 ( -4.743 5.489 0.025) 7.255 46.463 ( -13.663 11.794 0.315) 18.052 47.498 ( -4.130 9.028 -2.985) 10.367 49.650 ( -1.424 2.050 0.248) 2.508 50.325 ( 1.672 0.900 -0.477) 1.958 50.661 ( -16.918 6.072 2.041) 18.091 54.322 ( 14.785 10.869 -17.043) 25.044 61.263 ( -25.488 -4.158 1.011) 25.845 64.266 ( -30.108 -34.731 -17.314) 49.117 66.822 ( 22.261 4.366 7.160) 23.788 68.888 ( -5.006 3.433 -9.940) 11.647 ======================= Grid point 131 (45/204) ======================= q-point: (-0.27 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.444 ( -12.095 14.878 4.143) 19.617 1.583 ( -15.260 16.852 7.048) 23.802 2.604 ( -3.791 7.621 -8.221) 11.833 2.663 ( -8.052 4.700 -11.827) 15.060 3.079 ( -7.675 13.465 8.710) 17.778 3.343 ( -2.138 -1.651 6.542) 7.078 3.616 ( -3.590 4.404 -1.123) 5.792 3.835 ( -8.082 -9.785 4.082) 13.332 4.240 ( -0.608 -1.014 1.520) 1.925 4.394 ( 5.830 -2.184 4.863) 7.900 4.578 ( -0.224 -5.798 -4.067) 7.086 4.883 ( -5.960 -3.232 2.958) 7.397 5.329 ( -6.235 3.727 -1.051) 7.340 5.403 ( -0.999 -0.198 -7.840) 7.906 5.524 ( -10.609 2.111 0.446) 10.826 5.915 ( -1.849 3.285 -0.363) 3.787 6.346 ( -3.973 2.204 3.856) 5.959 6.514 ( 3.107 -4.723 -6.691) 8.759 6.776 ( 1.879 -1.003 1.451) 2.577 6.897 ( 5.341 0.980 -0.997) 5.521 7.195 ( -0.986 3.188 1.032) 3.493 7.299 ( -4.066 -0.681 2.888) 5.033 7.590 ( 3.041 6.013 -3.486) 7.586 7.877 ( -4.218 1.372 3.070) 5.394 7.980 ( -5.255 -3.266 -2.369) 6.625 8.308 ( -3.714 0.631 2.420) 4.478 8.530 ( -8.536 2.096 -0.984) 8.844 8.763 ( 8.333 5.405 -0.121) 9.933 11.696 ( 12.872 -11.585 1.815) 17.412 12.002 ( -5.807 -2.390 -1.200) 6.393 13.058 ( 16.206 -9.023 2.972) 18.785 13.242 ( -12.899 -10.266 -1.879) 16.592 13.669 ( 15.756 15.802 -0.646) 22.324 14.048 ( 5.174 -0.147 0.334) 5.187 15.775 ( -36.260 23.175 3.136) 43.147 16.589 ( -27.834 6.711 -18.831) 34.269 26.858 ( -0.021 0.402 -0.059) 0.407 26.884 ( 0.172 0.106 0.006) 0.202 26.977 ( 0.285 0.573 0.338) 0.723 27.051 ( -0.078 0.750 -1.152) 1.377 28.032 ( 0.648 -1.128 0.744) 1.498 28.175 ( 0.904 -1.471 -1.031) 2.011 33.751 ( 1.992 -0.720 0.693) 2.228 34.003 ( 1.752 0.327 -1.896) 2.602 34.333 ( -4.976 2.475 -0.697) 5.601 34.500 ( -7.048 -1.017 2.002) 7.397 35.331 ( -4.127 -1.698 2.903) 5.324 35.897 ( 0.440 -0.837 -2.273) 2.461 37.196 ( -0.204 3.779 0.141) 3.787 37.307 ( -0.520 0.542 -0.031) 0.752 42.104 ( 1.827 14.344 -0.246) 14.462 42.852 ( -3.865 -7.152 -1.849) 8.337 44.382 ( -18.828 14.495 8.652) 25.287 45.126 ( -6.488 5.200 1.388) 8.430 45.216 ( -2.238 1.586 0.532) 2.794 45.482 ( -1.361 -2.309 -7.378) 7.850 46.086 ( -13.306 15.538 0.735) 20.470 47.236 ( -6.189 16.610 -8.436) 19.631 49.596 ( -1.986 2.399 0.241) 3.124 50.335 ( 2.848 1.067 -0.187) 3.047 50.451 ( -9.536 1.971 1.671) 9.880 53.964 ( -6.068 37.016 -44.174) 57.951 61.134 ( -17.066 -11.933 -2.986) 21.037 64.400 ( -59.604 -53.836 -23.942) 83.810 67.046 ( 23.836 3.703 9.421) 25.896 68.712 ( -5.936 7.909 -10.937) 14.745 ======================= Grid point 132 (46/204) ======================= q-point: (-0.18 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.084 ( -12.165 16.386 11.202) 23.280 1.145 ( -17.400 18.284 9.543) 26.984 2.206 ( -26.611 21.906 -1.695) 34.509 2.553 ( -1.361 4.459 -7.460) 8.797 2.700 ( -12.853 10.765 -3.606) 17.149 3.389 ( 3.511 -1.934 2.003) 4.481 3.536 ( -4.496 -0.777 0.591) 4.601 3.968 ( -3.779 -10.441 4.129) 11.847 4.242 ( -2.571 -0.498 1.720) 3.133 4.508 ( 2.567 -1.354 7.639) 8.172 4.611 ( -2.394 -2.633 -4.701) 5.896 4.820 ( -14.864 -2.773 0.239) 15.123 5.071 ( -11.213 1.035 -3.753) 11.869 5.333 ( 0.987 7.434 1.046) 7.572 5.580 ( 4.357 -1.929 -2.887) 5.571 5.840 ( -0.530 3.387 -2.121) 4.031 6.286 ( -7.020 -2.021 4.903) 8.798 6.601 ( 3.897 -2.824 -7.953) 9.296 6.827 ( 3.192 -1.122 0.810) 3.479 6.966 ( 4.649 -2.241 -0.381) 5.175 7.140 ( 2.344 3.640 0.044) 4.329 7.300 ( -3.975 -3.923 4.472) 7.155 7.522 ( 3.805 6.527 -2.620) 7.997 7.790 ( -8.795 -0.119 0.824) 8.834 8.007 ( -1.452 -3.439 0.921) 3.845 8.246 ( -3.845 1.927 2.030) 4.756 8.447 ( -4.343 -0.613 -0.404) 4.405 8.759 ( 10.437 8.631 0.071) 13.544 11.873 ( -1.970 0.195 2.413) 3.121 12.133 ( 7.290 -17.441 -1.893) 18.998 13.115 ( -19.537 -10.764 1.790) 22.378 13.466 ( 27.080 9.741 0.709) 28.788 13.611 ( 5.390 0.010 -3.374) 6.359 14.137 ( 7.506 -2.003 -0.587) 7.790 14.952 ( -41.049 27.310 2.902) 49.389 15.964 ( -44.872 15.969 -40.664) 62.626 26.852 ( -0.359 0.081 0.055) 0.373 26.888 ( 1.068 0.282 -0.613) 1.263 26.969 ( 0.079 0.804 0.424) 0.912 27.035 ( 0.036 0.799 -1.263) 1.495 28.058 ( 0.574 -1.033 0.872) 1.468 28.206 ( 0.956 -1.379 -1.205) 2.066 33.792 ( 3.119 -0.637 0.997) 3.336 34.022 ( 1.592 -0.912 -1.825) 2.588 34.222 ( -5.172 3.599 -1.165) 6.408 34.440 ( -9.529 -2.497 2.153) 10.084 35.322 ( -5.818 -3.526 2.842) 7.373 35.903 ( 0.433 0.011 -3.144) 3.174 37.129 ( -0.710 4.130 0.963) 4.300 37.296 ( -0.332 0.271 -0.133) 0.449 41.903 ( -4.658 9.250 -0.941) 10.399 42.897 ( -4.140 -4.781 -3.062) 7.026 43.877 ( -18.968 22.196 8.533) 30.418 44.983 ( -6.145 4.508 -0.631) 7.648 45.191 ( -2.425 0.155 1.485) 2.847 45.486 ( -4.656 -2.196 -13.814) 14.742 45.747 ( -1.800 16.200 -3.580) 16.689 46.768 ( -8.443 31.655 -22.575) 39.786 49.538 ( -2.001 2.174 0.230) 2.964 50.355 ( 2.935 0.798 -0.030) 3.042 50.376 ( -2.711 0.007 0.006) 2.711 52.777 ( -28.771 73.549 -88.750) 118.801 61.224 ( -2.767 -13.630 -3.453) 14.330 64.393 (-103.903 -70.962 -46.197) 134.036 67.255 ( 16.738 2.834 10.843) 20.144 68.483 ( -3.031 10.742 -12.129) 16.483 ======================= Grid point 133 (47/204) ======================= q-point: (-0.09 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.711 ( -16.714 14.551 15.786) 27.208 0.755 ( -10.266 14.109 21.554) 27.732 1.402 ( -41.386 29.175 18.747) 53.994 2.425 ( -3.438 4.134 -8.977) 10.464 2.551 ( 1.725 1.971 -14.435) 14.671 3.478 ( 1.348 -2.061 3.806) 4.533 3.521 ( 4.544 -1.045 -3.563) 5.869 3.996 ( -16.423 -3.971 0.665) 16.909 4.194 ( -1.189 1.707 0.886) 2.261 4.461 ( -7.251 1.512 -8.573) 11.329 4.590 ( -12.190 -9.261 2.808) 15.564 4.840 ( 4.387 -5.147 10.638) 12.605 5.072 ( 6.208 -2.998 6.319) 9.352 5.208 ( -0.926 7.670 1.549) 7.879 5.597 ( -0.358 1.285 -1.749) 2.200 5.799 ( 5.948 5.686 -4.755) 9.504 6.280 ( -12.557 -9.210 2.926) 15.846 6.640 ( 3.448 0.273 -7.043) 7.846 6.874 ( 2.963 0.102 -1.173) 3.189 7.010 ( 1.130 0.827 -0.987) 1.713 7.186 ( 6.007 -2.270 1.058) 6.508 7.370 ( -1.562 -8.497 4.231) 9.619 7.486 ( 4.572 1.402 2.035) 5.197 7.696 ( -9.089 -1.084 0.337) 9.160 8.037 ( -3.542 -3.153 4.116) 6.280 8.203 ( 0.854 0.391 2.488) 2.660 8.433 ( -1.731 -1.542 -0.549) 2.382 8.740 ( 15.048 12.527 -0.901) 19.601 11.814 ( -12.756 -3.725 -0.167) 13.290 12.547 ( 14.622 -20.286 -0.312) 25.008 13.040 ( -18.418 -2.467 -4.193) 19.049 13.414 ( 3.540 9.421 -0.664) 10.086 13.723 ( -6.615 6.168 -13.125) 15.940 14.114 ( -28.303 21.921 -1.607) 35.835 14.207 ( -4.525 11.926 -14.736) 19.490 14.673 ( -58.210 56.300 -59.593) 100.546 26.848 ( -0.506 -0.082 0.082) 0.519 26.890 ( 1.442 1.494 -1.533) 2.580 26.954 ( -0.277 1.098 0.411) 1.205 27.025 ( 0.294 0.365 -0.878) 0.995 28.078 ( 0.307 -0.637 1.047) 1.263 28.231 ( 0.818 -0.902 -1.199) 1.709 33.842 ( 3.509 -0.466 1.413) 3.811 34.044 ( -0.867 -0.767 -1.184) 1.656 34.128 ( -0.890 2.324 -2.436) 3.483 34.366 ( -15.247 -4.777 0.239) 15.979 35.317 ( -10.179 -6.146 1.825) 12.030 35.883 ( -0.023 2.282 -5.453) 5.911 37.069 ( -0.504 2.926 1.698) 3.420 37.288 ( -0.656 0.040 -0.599) 0.889 41.711 ( -13.180 2.965 -2.558) 13.749 42.869 ( -7.367 -0.349 -3.955) 8.369 43.413 ( -1.897 23.649 -0.135) 23.725 44.520 ( -27.377 85.743 -74.287) 116.704 45.116 ( -1.445 22.202 -13.410) 25.977 45.168 ( 0.739 9.566 -9.421) 13.447 45.479 ( -0.007 15.027 1.703) 15.123 46.091 ( -5.079 18.244 -10.438) 21.624 49.488 ( -2.152 1.541 0.109) 2.649 50.342 ( -1.891 6.908 -9.024) 11.521 50.370 ( 4.632 4.197 -1.546) 6.439 50.734 ( -37.914 93.295 -73.202) 124.499 61.413 ( 6.000 -7.757 -1.485) 9.919 63.730 (-175.069 -52.476 -77.549) 198.536 67.350 ( 4.948 4.019 8.370) 10.521 68.313 ( 5.202 8.129 -9.465) 13.518 ======================= Grid point 135 (48/204) ======================= q-point: ( 0.09 0.09 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.741 ( 19.267 0.000 12.437) 22.933 0.905 ( 23.001 0.000 13.961) 26.906 1.733 ( 46.498 0.000 18.923) 50.201 2.451 ( 8.563 0.000 -8.385) 11.985 2.616 ( 3.635 0.000 -16.009) 16.416 3.391 ( -6.627 -0.000 -0.360) 6.636 3.821 ( 1.606 0.000 -4.434) 4.716 4.071 ( 3.549 0.000 -7.395) 8.202 4.286 ( -12.465 -0.000 15.343) 19.769 4.286 ( 20.430 0.000 -7.971) 21.930 4.598 ( 7.907 0.000 5.967) 9.906 4.891 ( -5.586 -0.000 1.790) 5.866 5.309 ( 5.944 0.000 4.898) 7.702 5.378 ( -12.544 -0.000 0.256) 12.547 5.631 ( -0.363 -0.000 -1.224) 1.277 5.764 ( 1.647 0.000 -1.658) 2.337 6.239 ( 9.299 0.000 -5.127) 10.619 6.705 ( 1.067 0.000 -1.118) 1.545 6.902 ( -1.883 -0.000 0.821) 2.055 6.965 ( -2.302 -0.000 -1.468) 2.730 7.098 ( -8.188 -0.000 0.797) 8.226 7.182 ( -4.555 -0.000 -0.281) 4.563 7.488 ( 0.772 0.000 3.350) 3.438 7.769 ( 2.733 0.000 1.568) 3.150 7.953 ( 0.436 0.000 -0.970) 1.064 8.194 ( 0.136 0.000 2.531) 2.534 8.491 ( 3.669 0.000 -0.819) 3.760 8.567 ( 3.011 0.000 1.100) 3.206 12.186 ( 28.440 0.000 -1.161) 28.464 12.482 ( -17.007 -0.000 -0.620) 17.018 12.906 ( -17.567 -0.000 0.568) 17.576 13.721 ( 21.180 0.000 -0.249) 21.181 13.930 ( 38.813 0.000 -5.607) 39.216 14.030 ( -19.779 -0.000 -6.818) 20.921 14.097 ( 13.952 0.000 1.082) 13.994 15.968 ( 81.550 0.000 -65.632) 104.680 26.876 ( 0.138 0.000 -0.012) 0.139 26.887 ( 0.179 0.000 -0.956) 0.973 26.925 ( -1.188 -0.000 0.547) 1.307 27.020 ( -0.034 -0.000 -0.836) 0.837 28.076 ( -1.210 -0.000 1.113) 1.644 28.228 ( -0.685 -0.000 -1.409) 1.567 33.804 ( -3.322 -0.000 1.340) 3.582 34.053 ( -1.481 -0.000 -4.426) 4.667 34.242 ( 11.553 0.000 3.816) 12.167 34.312 ( 8.403 0.000 -4.904) 9.730 35.384 ( 5.799 0.000 1.865) 6.092 35.772 ( -0.203 -0.000 -5.367) 5.371 37.105 ( 3.139 0.000 3.088) 4.404 37.269 ( -0.133 -0.000 -1.512) 1.518 42.114 ( 11.000 0.000 -5.959) 12.510 42.976 ( 21.520 0.000 -7.653) 22.840 43.290 ( 18.635 0.000 -8.528) 20.494 44.674 ( 11.312 0.000 -9.722) 14.916 45.310 ( -0.970 -0.000 6.963) 7.030 45.368 ( 17.266 0.000 -4.255) 17.782 45.843 ( -2.739 -0.000 -8.148) 8.596 46.546 ( 35.097 0.000 -18.725) 39.780 49.629 ( 10.783 0.000 -1.664) 10.911 50.348 ( 0.642 0.000 -1.536) 1.665 50.405 ( 2.999 0.000 -0.833) 3.112 53.071 ( 97.451 0.000 -97.108) 137.574 61.893 ( 13.553 0.000 16.212) 21.131 62.968 ( 155.825 0.000 -146.541) 213.906 67.126 ( -16.499 -0.000 5.535) 17.403 68.257 ( 2.841 0.000 -11.421) 11.769 ======================= Grid point 136 (49/204) ======================= q-point: ( 0.18 0.09 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.080 ( 20.928 -8.967 7.590) 24.000 1.221 ( 23.530 -3.222 10.415) 25.933 2.341 ( 28.379 -10.167 3.307) 30.326 2.519 ( 7.178 1.154 -8.900) 11.492 2.655 ( 10.333 -6.481 -10.110) 15.842 3.356 ( -0.819 -0.053 5.256) 5.319 3.790 ( 6.252 5.905 0.189) 8.602 4.067 ( -0.813 -0.901 -6.960) 7.065 4.136 ( -9.187 5.495 12.322) 16.322 4.496 ( 12.170 4.592 -0.019) 13.008 4.747 ( 12.302 -4.396 1.315) 13.130 4.834 ( -3.382 1.369 0.123) 3.651 5.241 ( 0.430 1.086 -1.434) 1.850 5.434 ( -0.951 -4.478 1.573) 4.840 5.642 ( 9.844 2.907 -2.425) 10.547 5.774 ( 1.030 -0.428 -1.748) 2.073 6.245 ( 3.653 5.105 -2.498) 6.756 6.718 ( -3.114 -2.455 0.864) 4.059 6.863 ( -3.822 3.114 -0.057) 4.930 6.937 ( -5.255 -2.897 0.637) 6.034 7.061 ( -2.619 -3.839 0.506) 4.674 7.143 ( -0.637 0.453 -2.892) 2.996 7.523 ( 0.275 -2.500 2.416) 3.487 7.806 ( -1.625 -2.565 0.797) 3.139 7.983 ( 4.870 -0.775 -1.877) 5.277 8.240 ( 2.292 -2.530 2.415) 4.182 8.532 ( 5.497 0.025 -0.939) 5.577 8.611 ( 1.583 -1.180 0.530) 2.045 12.140 ( -10.562 16.324 1.014) 19.469 12.409 ( 28.644 14.371 0.430) 32.050 12.887 ( -18.367 -17.231 -0.051) 25.185 13.515 ( -9.562 21.170 -0.584) 23.237 13.912 ( 9.138 7.939 -3.139) 12.505 14.058 ( 18.405 10.267 0.966) 21.097 14.778 ( 41.313 -26.701 -4.390) 49.386 16.583 ( 39.061 -8.054 -35.281) 53.248 26.872 ( 0.242 0.254 0.027) 0.352 26.889 ( -1.191 -0.381 0.087) 1.254 26.924 ( -0.690 -1.199 -0.125) 1.389 27.023 ( 0.168 -0.530 -1.113) 1.244 28.060 ( -1.423 0.419 1.003) 1.791 28.210 ( -0.918 0.722 -1.420) 1.838 33.773 ( -2.627 0.064 1.401) 2.978 34.018 ( -0.646 1.310 -3.463) 3.758 34.361 ( 7.911 1.645 -0.975) 8.139 34.405 ( 9.801 -1.381 0.875) 9.936 35.432 ( 4.560 1.728 3.056) 5.755 35.778 ( 0.160 -1.906 -5.528) 5.850 37.161 ( 2.803 -1.481 3.100) 4.434 37.265 ( -0.126 -0.392 -1.348) 1.409 42.207 ( 22.161 10.945 -3.382) 24.947 43.283 ( 24.504 22.362 -4.308) 33.453 43.412 ( 33.576 -17.187 -9.253) 38.837 44.808 ( 5.165 -6.516 -5.326) 9.875 45.264 ( 1.511 5.838 4.852) 7.740 45.577 ( 21.428 0.095 -6.066) 22.270 45.805 ( -6.128 -3.693 -2.187) 7.482 46.944 ( 14.707 -15.006 -5.888) 21.821 49.701 ( 13.687 7.370 -1.093) 15.584 50.349 ( 3.442 1.507 -2.551) 4.542 50.393 ( 4.893 5.290 -0.429) 7.218 53.842 ( 14.751 -36.667 -39.581) 55.935 61.978 ( 13.113 11.438 19.205) 25.915 63.905 ( 89.978 17.266 -124.715) 154.752 66.971 ( -18.241 -3.468 4.991) 19.227 68.361 ( 15.423 -4.036 -21.537) 26.795 ======================= Grid point 137 (50/204) ======================= q-point: ( 0.27 0.09 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.478 ( 19.356 -10.975 4.650) 22.731 1.576 ( 20.806 -7.677 7.737) 23.488 2.517 ( -1.720 -1.876 -13.519) 13.757 2.572 ( 11.822 -1.529 -7.278) 13.967 3.048 ( 16.436 -13.217 2.241) 21.210 3.363 ( 0.903 2.333 6.969) 7.404 3.832 ( 4.796 1.257 6.528) 8.198 3.946 ( -3.062 5.862 5.130) 8.370 4.102 ( 2.972 -0.130 -4.603) 5.481 4.471 ( 0.981 6.381 2.215) 6.826 4.733 ( -3.739 5.160 1.768) 6.613 4.884 ( 3.886 0.156 -2.548) 4.650 5.283 ( 6.072 2.314 0.188) 6.500 5.465 ( 0.413 -0.158 -3.466) 3.494 5.766 ( 13.184 -1.351 -0.055) 13.253 5.845 ( 9.088 -3.749 -2.577) 10.163 6.204 ( 0.770 1.542 -2.387) 2.944 6.709 ( -5.666 -1.651 0.920) 5.973 6.752 ( -3.023 3.915 1.675) 5.222 6.932 ( -5.650 -3.328 3.004) 7.212 7.093 ( -1.226 -1.830 -2.259) 3.155 7.177 ( 3.934 -3.823 -2.402) 5.989 7.584 ( 1.392 -4.180 0.137) 4.408 7.818 ( -0.662 -0.670 0.724) 1.188 8.056 ( 2.742 -2.762 -1.184) 4.068 8.316 ( 4.015 -1.578 2.204) 4.845 8.623 ( 7.407 -2.649 -0.551) 7.886 8.638 ( 1.344 -0.480 -0.470) 1.503 11.767 ( -12.498 15.165 0.572) 19.659 12.463 ( 28.203 19.882 0.942) 34.519 12.923 ( -20.769 -12.117 -1.601) 24.098 13.077 ( -18.401 10.358 1.690) 21.183 13.896 ( 11.693 8.923 -0.310) 14.712 14.133 ( 28.108 14.217 0.301) 31.500 15.628 ( 38.124 -24.840 -2.946) 45.598 16.957 ( 20.336 -5.809 -16.498) 26.823 26.874 ( 0.232 -0.110 -0.079) 0.268 26.881 ( -1.081 -0.339 0.660) 1.311 26.937 ( -0.618 -1.410 -0.290) 1.567 27.034 ( 0.178 -0.903 -1.178) 1.495 28.037 ( -1.359 0.758 0.862) 1.779 28.181 ( -0.973 1.046 -1.257) 1.903 33.748 ( -1.972 0.342 1.204) 2.336 33.992 ( -0.197 0.449 -2.466) 2.514 34.399 ( 5.509 2.064 -2.140) 6.260 34.537 ( 9.065 -0.743 2.473) 9.425 35.453 ( 3.366 2.432 3.982) 5.754 35.798 ( 0.566 -1.584 -5.001) 5.277 37.212 ( 0.841 -1.497 1.754) 2.455 37.279 ( 0.527 -1.487 -0.478) 1.648 42.278 ( 23.000 11.397 -1.113) 25.693 43.199 ( 25.823 22.965 -3.328) 34.717 44.111 ( 33.921 -18.784 -3.709) 38.952 44.966 ( 6.119 -7.863 -3.390) 10.525 45.238 ( 6.581 2.982 2.358) 7.600 45.700 ( 6.425 4.831 -1.747) 8.226 45.935 ( 11.388 -12.625 -3.904) 17.445 47.271 ( 9.001 -11.645 -1.445) 14.789 49.728 ( 12.892 7.933 -0.252) 15.140 50.375 ( 2.926 1.619 -0.464) 3.376 50.403 ( 12.621 2.082 -2.753) 13.085 54.287 ( -14.005 -27.999 -13.301) 34.015 61.960 ( 8.180 12.430 20.726) 25.515 64.060 ( 32.185 15.476 -74.033) 82.196 66.850 ( -12.601 -2.163 4.709) 13.625 68.577 ( 21.145 -3.332 -24.404) 32.462 ======================= Grid point 138 (51/204) ======================= q-point: ( 0.36 0.09 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.851 ( 15.863 -10.185 2.912) 19.075 1.953 ( 18.010 -10.871 6.060) 21.893 2.471 ( -0.570 2.356 -12.569) 12.801 2.735 ( 11.149 -4.360 -2.906) 12.319 3.335 ( 2.708 -0.311 2.293) 3.562 3.338 ( 5.172 -4.314 4.473) 8.085 3.678 ( -14.363 5.837 11.363) 19.222 4.024 ( 10.151 3.103 -2.396) 10.881 4.125 ( 2.149 -0.638 -3.967) 4.557 4.380 ( -3.882 1.586 1.232) 4.371 4.599 ( -3.579 7.321 1.084) 8.221 4.891 ( 1.226 0.776 -2.164) 2.605 5.267 ( 0.847 4.444 2.016) 4.953 5.461 ( 7.757 4.565 -3.615) 9.699 5.875 ( 0.600 -4.495 -0.175) 4.538 6.028 ( 12.120 1.678 -1.096) 12.285 6.243 ( 2.979 -5.174 -3.164) 6.756 6.615 ( -5.751 3.176 1.445) 6.727 6.749 ( 2.074 -1.638 1.308) 2.949 6.929 ( -3.630 -2.077 3.115) 5.214 7.096 ( -1.091 -1.567 -2.536) 3.175 7.304 ( 6.808 -5.049 -1.859) 8.678 7.678 ( 0.206 -5.909 0.647) 5.948 7.815 ( 1.425 1.406 -0.456) 2.053 8.115 ( 0.575 -2.835 -0.537) 2.942 8.375 ( 4.075 0.870 2.342) 4.780 8.651 ( 1.031 0.024 -1.073) 1.488 8.772 ( 8.640 -4.089 -0.764) 9.589 11.411 ( -13.268 11.966 0.243) 17.869 12.454 ( 21.483 17.750 0.110) 27.868 12.636 ( -10.824 11.927 0.185) 16.108 12.981 ( -23.812 -16.023 0.891) 28.715 13.903 ( 11.412 6.983 0.366) 13.384 14.244 ( 33.769 17.172 0.167) 37.885 16.324 ( 27.263 -17.808 -1.336) 32.591 17.139 ( 7.346 -1.357 -8.200) 11.093 26.876 ( -0.075 -0.193 -0.273) 0.343 26.881 ( -0.508 -0.514 1.010) 1.241 26.951 ( -0.474 -1.202 -0.288) 1.324 27.047 ( 0.015 -1.004 -1.079) 1.474 28.013 ( -1.054 0.786 0.742) 1.510 28.153 ( -0.820 0.914 -1.041) 1.610 33.725 ( -1.270 0.479 0.946) 1.655 33.987 ( -0.089 -0.573 -2.125) 2.203 34.416 ( 4.152 2.187 -1.199) 4.843 34.633 ( 6.572 0.530 1.815) 6.839 35.452 ( 2.044 2.956 4.345) 5.639 35.814 ( 0.827 -0.994 -4.309) 4.499 37.237 ( -0.477 -1.468 0.229) 1.561 37.312 ( 0.542 -1.663 0.317) 1.778 42.377 ( 20.857 7.682 -0.335) 22.229 43.144 ( 26.769 22.131 -2.310) 34.809 44.537 ( 11.945 -3.935 -0.227) 12.579 45.131 ( 5.903 -3.100 -3.336) 7.455 45.401 ( 13.810 -7.111 2.802) 15.784 45.678 ( 7.045 5.876 0.606) 9.194 46.308 ( 14.224 -15.572 -3.968) 21.461 47.499 ( 6.651 -6.996 -0.461) 9.665 49.752 ( 11.142 6.459 0.137) 12.880 50.381 ( 4.274 2.539 0.167) 4.974 50.603 ( 20.225 -4.505 -3.443) 21.005 54.335 ( -23.731 -10.818 -3.267) 26.284 61.866 ( -5.307 9.121 19.272) 21.972 63.915 ( -4.906 3.555 -42.773) 43.200 66.794 ( 0.417 1.436 5.610) 5.806 68.798 ( 21.031 -1.266 -22.164) 30.580 ======================= Grid point 139 (52/204) ======================= q-point: ( 0.45 0.09 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.131 ( 8.577 -6.027 2.510) 10.779 2.321 ( 13.709 -10.955 3.974) 17.993 2.375 ( 3.358 7.785 -9.842) 12.990 2.903 ( 9.676 -1.176 0.717) 9.773 3.300 ( 0.953 4.503 5.024) 6.813 3.482 ( -12.511 0.491 11.292) 16.860 3.512 ( 3.677 -6.223 -0.599) 7.253 3.937 ( 1.045 11.440 -4.043) 12.178 4.167 ( -2.052 -5.108 -3.124) 6.330 4.368 ( -3.610 -3.244 -0.749) 4.910 4.440 ( -4.502 7.126 0.322) 8.435 4.891 ( 2.845 1.819 -0.155) 3.380 5.207 ( -2.680 1.597 0.541) 3.167 5.474 ( 10.741 6.827 -2.567) 12.983 5.933 ( 0.414 -2.013 -0.250) 2.070 6.066 ( 0.519 -0.080 -0.771) 0.933 6.333 ( 1.845 -2.472 -1.998) 3.676 6.510 ( -6.115 2.222 0.993) 6.581 6.828 ( 5.900 -1.115 1.677) 6.234 6.917 ( -0.511 1.169 0.370) 1.329 7.120 ( 0.352 -2.697 -1.022) 2.906 7.453 ( 4.585 -4.677 -1.254) 6.668 7.716 ( -4.520 -0.986 3.513) 5.809 7.832 ( 4.472 0.039 -2.816) 5.285 8.152 ( -1.564 -2.518 -0.380) 2.988 8.384 ( 1.486 3.040 3.433) 4.820 8.666 ( 3.602 0.164 -2.426) 4.346 8.892 ( 3.563 -1.143 -0.988) 3.870 11.143 ( -9.606 4.545 0.088) 10.628 12.375 ( 3.059 7.338 -0.984) 8.011 12.492 ( 18.050 14.216 1.430) 23.021 12.943 ( -25.483 -14.836 0.456) 29.491 13.937 ( 11.568 5.700 0.445) 12.904 14.352 ( 35.448 19.814 0.294) 40.611 16.754 ( 13.087 -8.455 -0.040) 15.581 17.122 ( -4.694 3.322 -5.309) 7.826 26.878 ( 0.060 -0.139 -0.204) 0.254 26.884 ( -0.646 -0.392 0.947) 1.212 26.963 ( -0.192 -0.944 -0.229) 0.990 27.058 ( -0.268 -0.870 -0.965) 1.327 27.996 ( -0.579 0.438 0.666) 0.985 28.132 ( -0.537 0.422 -0.870) 1.106 33.711 ( -0.514 0.258 0.780) 0.969 33.994 ( 0.012 -0.978 -2.269) 2.471 34.421 ( 2.794 2.093 0.019) 3.491 34.672 ( 3.494 2.187 0.934) 4.226 35.430 ( 0.740 3.215 4.343) 5.453 35.828 ( 0.896 -0.846 -3.650) 3.852 37.251 ( -0.735 -1.345 -0.288) 1.559 37.337 ( 0.057 -1.012 0.205) 1.034 42.500 ( 18.531 5.504 -0.038) 19.332 43.105 ( 28.464 22.944 -1.971) 36.613 44.624 ( 2.760 0.272 1.171) 3.011 45.197 ( 4.392 0.086 -4.003) 5.943 45.540 ( -0.777 0.767 3.146) 3.330 45.756 ( 15.676 2.898 1.060) 15.976 46.613 ( 4.533 -8.952 -1.263) 10.113 47.633 ( 4.693 -2.435 -0.698) 5.333 49.775 ( 9.327 5.778 0.268) 10.975 50.392 ( 5.735 3.521 0.289) 6.736 50.889 ( 13.744 -3.720 -3.173) 14.587 54.204 ( -11.960 -4.412 -0.196) 12.749 61.622 ( -25.815 5.564 14.085) 29.929 63.678 ( -30.013 -9.417 -25.294) 40.364 66.852 ( 15.016 4.472 7.537) 17.387 68.970 ( 18.915 2.147 -18.873) 26.806 ======================= Grid point 140 (53/204) ======================= q-point: (-0.45 0.09 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.134 ( -4.514 7.660 -1.849) 9.081 2.309 ( 6.896 8.676 -2.142) 11.287 2.584 ( 9.666 -4.040 1.837) 10.636 3.000 ( 5.336 -0.562 1.607) 5.601 3.209 ( -4.193 3.850 2.763) 6.327 3.439 ( 1.084 2.290 8.419) 8.792 3.625 ( 0.494 -2.882 5.209) 5.973 3.795 ( -1.532 2.440 -4.469) 5.317 4.221 ( -2.910 -6.739 -2.830) 7.867 4.302 ( -4.168 3.843 -0.946) 5.748 4.352 ( -6.308 -2.455 -2.779) 7.317 4.895 ( 3.801 3.145 2.840) 5.693 5.174 ( -3.567 -2.658 -3.069) 5.404 5.475 ( 8.692 6.578 -1.101) 10.956 5.916 ( -5.081 1.942 0.081) 5.440 6.063 ( -1.080 0.036 -0.838) 1.367 6.367 ( 0.776 -1.238 -1.822) 2.336 6.420 ( -5.777 0.370 0.371) 5.800 6.845 ( -0.798 3.034 1.801) 3.618 6.942 ( 8.219 1.379 -1.113) 8.408 7.169 ( 1.021 -2.318 0.375) 2.560 7.460 ( -8.955 1.134 1.317) 9.122 7.708 ( 3.852 0.623 -0.311) 3.915 7.867 ( 2.918 0.242 -1.860) 3.468 8.126 ( -7.342 0.313 0.841) 7.396 8.348 ( -0.155 2.620 3.904) 4.705 8.724 ( 6.412 -0.684 -3.053) 7.134 8.848 ( -6.432 4.197 -1.207) 7.774 11.100 ( 0.635 -5.715 0.093) 5.751 12.370 ( 15.470 8.492 -0.897) 17.670 12.548 ( 18.919 4.505 1.077) 19.478 12.872 ( -24.888 -12.853 0.407) 28.014 13.985 ( 10.908 4.814 0.380) 11.929 14.425 ( 35.399 22.892 0.536) 42.160 16.808 ( -11.650 7.886 1.859) 14.190 16.970 ( -7.062 1.098 -6.175) 9.445 26.879 ( 0.096 0.220 -0.225) 0.329 26.883 ( -0.734 -0.320 0.863) 1.177 26.973 ( -0.030 -0.634 -0.083) 0.640 27.063 ( -0.488 -0.589 -0.938) 1.210 27.991 ( -0.077 -0.151 0.641) 0.664 28.125 ( -0.209 -0.301 -0.797) 0.877 33.711 ( 0.306 -0.200 0.716) 0.804 34.004 ( 0.269 -0.798 -2.519) 2.656 34.414 ( 1.235 1.906 1.022) 2.491 34.648 ( 0.263 3.860 0.217) 3.875 35.393 ( -0.385 3.049 4.122) 5.142 35.844 ( 0.789 -1.012 -3.084) 3.341 37.260 ( -0.541 -0.835 -0.396) 1.071 37.344 ( -0.309 -0.047 -0.028) 0.313 42.607 ( 16.026 6.559 0.538) 17.325 43.071 ( 31.241 24.188 -2.444) 39.586 44.640 ( 0.629 0.322 2.610) 2.704 45.212 ( 1.609 1.048 -4.152) 4.575 45.483 ( -1.906 4.366 2.176) 5.237 45.802 ( 5.799 8.561 1.065) 10.395 46.658 ( -7.261 0.642 1.656) 7.475 47.672 ( 2.611 2.515 -1.787) 4.042 49.779 ( 7.350 6.229 0.250) 9.638 50.402 ( 6.719 4.470 0.650) 8.096 50.890 ( -7.157 7.064 -1.381) 10.150 54.300 ( 9.942 -8.186 -3.979) 13.479 61.206 ( -41.127 0.844 7.080) 41.741 63.426 ( -47.022 -20.504 -15.857) 53.693 67.014 ( 23.518 5.919 9.649) 26.100 69.059 ( 16.085 6.793 -15.859) 23.588 ======================= Grid point 141 (54/204) ======================= q-point: (-0.36 0.09 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.907 ( -5.858 13.049 0.922) 14.333 2.144 ( 1.788 18.352 1.459) 18.496 2.685 ( 3.958 0.327 -0.495) 4.002 2.917 ( -4.720 8.850 -9.563) 13.858 3.251 ( 3.597 -4.559 9.424) 11.069 3.413 ( 3.298 7.194 6.741) 10.395 3.639 ( 3.388 2.211 4.143) 5.790 3.762 ( -10.027 -1.564 -2.060) 10.355 4.219 ( -4.510 -0.928 -0.332) 4.617 4.305 ( 0.361 -3.667 -1.516) 3.985 4.333 ( -4.061 -7.480 -3.231) 9.103 4.883 ( 0.279 3.159 4.894) 5.831 5.211 ( -0.824 -7.086 -6.176) 9.436 5.449 ( -0.823 4.672 -0.162) 4.746 5.735 ( -11.922 7.453 -0.151) 14.060 6.030 ( 0.734 3.759 -0.427) 3.854 6.387 ( -0.785 -0.310 0.667) 1.075 6.388 ( -1.821 -3.060 -3.150) 4.754 6.793 ( 0.288 2.952 2.020) 3.588 6.984 ( 5.562 3.526 -1.673) 6.795 7.209 ( 1.824 -0.872 0.749) 2.156 7.325 ( -8.353 1.538 2.181) 8.769 7.733 ( 4.323 2.798 -2.322) 5.649 7.890 ( 1.915 -0.356 -1.217) 2.297 7.996 ( -9.184 3.783 2.457) 10.232 8.323 ( -1.622 0.936 2.865) 3.423 8.644 ( -11.422 5.541 -1.399) 12.772 8.809 ( 5.141 -0.864 -2.112) 5.625 11.302 ( 8.874 -12.085 0.046) 14.993 12.401 ( 23.896 16.282 0.543) 28.921 12.754 ( -20.208 -16.473 -2.988) 26.242 12.841 ( 18.454 -2.468 3.011) 18.860 14.033 ( 9.054 3.604 0.276) 9.749 14.441 ( 33.931 26.247 0.793) 42.905 16.370 ( -29.100 16.197 0.229) 33.304 16.797 ( -15.725 5.994 -5.954) 17.850 26.872 ( -0.449 0.362 0.314) 0.657 26.884 ( 0.051 -0.126 0.173) 0.220 26.980 ( -0.190 -0.303 0.105) 0.373 27.061 ( -0.462 -0.206 -1.017) 1.136 28.001 ( 0.267 -0.750 0.665) 1.037 28.133 ( 0.101 -1.078 -0.832) 1.365 33.728 ( 1.193 -0.723 0.749) 1.583 34.012 ( 0.714 -0.387 -2.597) 2.721 34.392 ( -0.497 2.040 1.391) 2.519 34.566 ( -2.675 4.883 -0.061) 5.568 35.350 ( -1.251 2.510 3.884) 4.790 35.861 ( 0.548 -1.189 -2.800) 3.091 37.263 ( 0.014 0.111 -0.281) 0.302 37.331 ( -0.696 0.929 -0.103) 1.166 42.632 ( 13.467 13.175 1.792) 18.925 43.065 ( 32.749 22.319 -3.923) 39.825 44.624 ( -2.667 3.017 5.210) 6.585 45.186 ( -1.659 0.781 -3.514) 3.964 45.376 ( -4.657 5.792 0.858) 7.482 45.641 ( -2.088 12.979 -0.600) 13.160 46.472 ( -12.712 8.513 4.972) 16.087 47.603 ( 0.565 8.022 -4.131) 9.041 49.750 ( 5.382 6.760 0.292) 8.646 50.397 ( 2.124 3.783 1.124) 4.482 50.655 ( -2.536 10.773 0.520) 11.079 54.459 ( 0.916 -0.194 -17.171) 17.197 60.812 ( -34.835 -7.605 1.443) 35.685 63.170 ( -61.173 -28.936 -11.131) 68.581 67.218 ( 23.666 6.055 11.301) 26.916 69.043 ( 12.777 11.874 -13.440) 22.020 ======================= Grid point 142 (55/204) ======================= q-point: (-0.27 0.09 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.621 ( -6.210 16.390 6.491) 18.691 1.833 ( 0.735 23.903 2.906) 24.091 2.655 ( -4.117 7.083 -8.923) 12.114 2.705 ( 2.644 8.284 -7.124) 11.241 3.250 ( -6.989 17.783 6.916) 20.320 3.352 ( 1.402 -1.884 6.238) 6.665 3.585 ( -9.754 3.598 -1.672) 10.530 3.708 ( 5.232 -3.680 2.900) 7.024 4.221 ( -1.226 -1.705 1.572) 2.623 4.385 ( 2.812 -6.876 2.361) 7.794 4.438 ( -2.351 -8.288 -2.757) 9.046 4.794 ( -13.541 2.912 3.964) 14.407 5.174 ( -18.701 4.131 -4.235) 19.615 5.377 ( 3.170 -7.609 -4.847) 9.562 5.586 ( 5.040 7.630 1.601) 9.283 5.956 ( -1.671 5.330 -0.737) 5.634 6.351 ( -3.109 2.686 1.615) 4.415 6.445 ( 1.479 -5.657 -4.688) 7.494 6.791 ( 1.980 -0.241 2.887) 3.508 6.971 ( 2.972 2.526 -2.766) 4.782 7.238 ( 3.093 1.767 -0.525) 3.600 7.247 ( -4.239 0.433 3.122) 5.282 7.699 ( 0.362 4.366 -0.494) 4.409 7.835 ( -7.060 3.223 -0.871) 7.809 7.929 ( 1.989 -0.132 1.649) 2.587 8.282 ( -4.159 0.840 0.707) 4.301 8.466 ( -7.915 2.046 0.510) 8.191 8.860 ( 3.310 -0.019 -1.777) 3.757 11.627 ( 11.826 -14.353 -0.173) 18.598 12.414 ( 30.258 22.386 1.919) 37.688 12.683 ( -26.478 -14.854 -1.208) 30.384 13.235 ( 27.888 -8.002 0.254) 29.014 14.076 ( 5.572 1.729 -0.002) 5.834 14.374 ( 28.203 28.843 0.605) 40.345 15.704 ( -36.663 21.557 0.537) 42.534 16.392 ( -26.997 12.712 -10.707) 31.703 26.861 ( -0.531 0.398 0.482) 0.820 26.890 ( 0.777 -0.100 -0.195) 0.807 26.978 ( -0.618 -0.054 0.288) 0.684 27.054 ( -0.203 0.230 -1.147) 1.187 28.021 ( 0.348 -1.166 0.742) 1.426 28.155 ( 0.331 -1.676 -0.959) 1.960 33.763 ( 2.013 -1.189 0.904) 2.506 34.021 ( 1.383 -0.155 -2.494) 2.856 34.342 ( -1.806 3.322 0.839) 3.873 34.449 ( -5.201 4.222 0.350) 6.708 35.309 ( -1.809 1.779 3.831) 4.595 35.878 ( 0.220 -1.178 -3.021) 3.250 37.249 ( 0.515 2.430 0.115) 2.486 37.306 ( -0.981 0.655 -0.100) 1.183 42.503 ( 11.078 22.234 3.023) 25.024 43.088 ( 26.738 17.826 -5.726) 32.642 44.448 ( -10.467 13.395 9.020) 19.245 45.149 ( -2.829 0.463 -1.749) 3.358 45.207 ( -5.676 6.091 0.088) 8.327 45.457 ( -2.243 5.719 -5.150) 8.016 46.186 ( -9.876 12.804 7.628) 17.879 47.421 ( 0.264 14.105 -9.063) 16.768 49.708 ( 5.375 6.350 0.736) 8.352 50.338 ( -5.363 0.096 0.325) 5.374 50.573 ( 16.241 12.397 2.208) 20.550 54.102 ( -26.907 18.729 -44.078) 54.933 60.747 ( -7.988 -15.447 -0.307) 17.393 62.866 ( -75.911 -33.815 -9.091) 83.598 67.392 ( 17.321 5.434 12.414) 21.992 68.922 ( 9.464 16.013 -11.609) 21.926 ======================= Grid point 143 (56/204) ======================= q-point: (-0.18 0.09 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.297 ( -7.006 19.340 11.840) 23.734 1.471 ( 4.089 27.109 5.162) 27.897 2.351 ( -7.867 22.770 -6.995) 25.085 2.645 ( 4.656 5.849 -6.891) 10.167 2.782 ( -13.641 20.312 0.707) 24.477 3.411 ( 2.130 -3.161 -0.160) 3.815 3.503 ( 0.360 1.873 3.545) 4.026 3.841 ( 2.977 -4.428 3.929) 6.626 4.228 ( -1.530 -0.439 1.080) 1.924 4.455 ( -16.845 0.795 3.020) 17.132 4.496 ( -16.039 -2.452 -6.683) 17.548 4.581 ( 5.570 -9.465 5.169) 12.138 5.030 ( -0.696 0.456 0.746) 1.117 5.490 ( 3.766 6.569 -1.148) 7.659 5.573 ( 4.229 -4.732 -2.299) 6.750 5.843 ( -3.340 3.662 -1.903) 5.309 6.250 ( -4.883 4.874 3.009) 7.527 6.559 ( 3.973 -6.097 -6.406) 9.695 6.829 ( -0.378 -1.569 3.091) 3.487 6.986 ( 4.279 -0.487 -2.508) 4.984 7.204 ( -3.130 -0.277 2.211) 3.842 7.239 ( 2.984 2.983 0.598) 4.262 7.627 ( -3.885 1.657 1.496) 4.481 7.723 ( -0.366 5.663 -3.086) 6.460 7.953 ( -2.125 -1.840 3.366) 4.386 8.233 ( -1.548 0.267 -1.269) 2.020 8.401 ( -2.834 -0.126 2.180) 3.578 8.875 ( 1.097 0.699 -2.106) 2.475 11.989 ( 11.357 -15.899 -0.324) 19.541 12.373 ( 25.000 25.511 2.337) 35.795 12.654 ( -16.637 -13.620 0.173) 21.502 13.648 ( 24.851 -5.056 -2.518) 25.485 14.052 ( -3.931 9.974 -2.408) 10.988 14.203 ( 11.209 15.576 -0.352) 19.193 14.958 ( -26.911 27.518 3.452) 38.644 15.785 ( -24.898 21.317 -21.240) 39.057 26.852 ( -0.328 0.312 0.535) 0.701 26.904 ( 1.493 -0.097 -0.584) 1.606 26.969 ( -1.111 0.078 0.436) 1.196 27.044 ( 0.081 0.600 -1.220) 1.362 28.046 ( 0.198 -1.309 0.881) 1.590 28.185 ( 0.400 -1.889 -1.122) 2.233 33.811 ( 2.063 -1.528 1.189) 2.829 34.039 ( 2.457 -0.233 -2.430) 3.463 34.256 ( -1.130 5.290 -0.127) 5.411 34.329 ( -7.879 2.215 0.896) 8.234 35.275 ( -1.787 1.111 4.113) 4.620 35.886 ( -0.210 -0.866 -3.941) 4.040 37.197 ( 0.073 4.563 0.912) 4.654 37.294 ( -0.413 0.086 -0.336) 0.539 42.231 ( 5.185 25.067 4.171) 25.935 43.060 ( 14.267 14.136 -7.212) 21.340 44.084 ( -9.624 20.826 10.600) 25.273 45.025 ( -3.423 7.407 -1.335) 8.268 45.164 ( -1.405 -1.288 -1.041) 2.172 45.349 ( -7.674 1.197 -7.074) 10.505 45.945 ( -1.600 10.198 5.076) 11.504 47.140 ( 5.872 22.480 -19.276) 30.189 49.679 ( 6.130 6.755 1.716) 9.281 50.304 ( -3.253 -1.818 -1.180) 3.909 50.572 ( 13.273 12.469 3.505) 18.546 53.196 ( -14.559 42.089 -85.043) 95.999 61.044 ( 15.602 -14.638 0.152) 21.395 62.425 ( -88.946 -30.746 -7.779) 94.431 67.482 ( 6.909 4.835 12.431) 15.021 68.728 ( 6.826 17.239 -10.000) 21.066 ======================= Grid point 144 (57/204) ======================= q-point: (-0.09 0.09 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.938 ( -4.217 21.673 13.390) 25.822 1.127 ( 1.441 26.491 12.005) 29.120 1.748 ( -1.380 40.380 12.228) 42.214 2.466 ( -3.880 8.639 -10.993) 14.510 2.606 ( 5.425 4.022 -10.375) 12.380 3.473 ( -2.496 -5.513 -7.295) 9.479 3.561 ( 6.315 -1.696 7.325) 9.819 3.873 ( 1.379 0.753 3.041) 3.423 4.203 ( 0.249 -1.114 -1.035) 1.540 4.324 ( -7.426 -6.690 3.300) 10.526 4.429 ( -3.106 2.779 -3.637) 5.531 4.806 ( 4.807 -9.136 7.218) 12.596 5.092 ( 5.900 -4.668 5.719) 9.451 5.344 ( -1.878 10.336 1.743) 10.648 5.645 ( 2.025 2.930 -1.808) 3.995 5.835 ( 1.351 -6.142 -6.754) 9.229 6.120 ( -6.378 4.801 4.081) 8.966 6.662 ( 5.179 -2.000 -6.950) 8.895 6.856 ( -1.441 -3.489 1.863) 4.209 7.038 ( 3.273 0.691 -1.267) 3.577 7.188 ( -4.206 -2.183 2.002) 5.144 7.239 ( -0.224 -0.726 2.226) 2.352 7.580 ( -5.284 -0.546 -0.564) 5.342 7.650 ( 8.319 6.337 -0.939) 10.500 7.956 ( -4.614 -2.745 3.617) 6.473 8.234 ( 2.179 0.697 0.778) 2.417 8.402 ( 0.205 -1.162 1.244) 1.715 8.840 ( -3.849 2.271 -4.085) 6.055 12.145 ( -5.083 22.667 3.447) 23.485 12.362 ( 5.559 -18.853 1.148) 19.689 12.707 ( -6.099 -10.388 -1.898) 12.194 13.580 ( -0.533 18.876 -19.487) 27.135 13.976 ( 13.572 5.321 4.724) 15.324 14.214 ( 0.608 -3.406 -1.939) 3.966 14.254 ( -21.960 30.486 2.499) 37.654 15.249 ( 30.486 37.467 -32.698) 58.330 26.849 ( 0.228 0.110 0.495) 0.556 26.920 ( 1.680 0.332 -1.289) 2.144 26.954 ( -1.433 0.220 0.547) 1.549 27.033 ( 0.223 0.657 -1.045) 1.255 28.068 ( -0.095 -1.142 1.047) 1.552 28.213 ( 0.207 -1.633 -1.221) 2.050 33.849 ( -0.585 -1.355 1.331) 1.988 34.073 ( 3.553 -0.174 -2.057) 4.109 34.184 ( 2.847 4.216 -0.662) 5.131 34.201 ( -8.328 2.442 0.256) 8.682 35.259 ( 0.086 0.746 4.716) 4.775 35.875 ( -1.022 0.197 -5.642) 5.737 37.130 ( 0.293 4.436 1.799) 4.796 37.285 ( -0.287 0.435 -0.879) 1.022 41.942 ( 4.220 17.627 6.245) 19.171 42.964 ( 9.119 12.053 -7.366) 16.814 43.578 ( -29.507 21.787 3.413) 36.837 44.848 ( -0.948 10.735 -9.530) 14.386 45.169 ( 3.303 1.107 -1.212) 3.689 45.226 ( -3.889 1.619 -5.035) 6.564 45.886 ( 5.739 2.681 -2.929) 6.979 46.788 ( 24.793 37.115 -34.685) 56.526 49.613 ( -0.679 7.790 2.470) 8.200 50.297 ( -2.797 -1.681 -3.664) 4.906 50.456 ( -6.462 6.606 0.500) 9.254 52.382 ( 89.942 78.547 -120.736) 169.813 61.448 ( 20.929 -6.269 0.871) 21.865 61.803 ( -68.068 -12.536 -4.000) 69.329 67.449 ( -3.996 4.971 9.986) 11.849 68.522 ( 3.564 14.037 -8.054) 16.572 ======================= Grid point 147 (58/204) ======================= q-point: ( 0.18 0.18 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.296 ( 24.722 0.000 6.003) 25.441 1.503 ( 23.996 0.000 7.583) 25.165 2.521 ( 14.344 0.000 -3.481) 14.761 2.533 ( -1.268 -0.000 -17.710) 17.755 2.779 ( 23.664 0.000 1.819) 23.734 3.363 ( 0.004 0.000 8.766) 8.766 3.895 ( 1.967 0.000 5.765) 6.091 4.050 ( 1.977 0.000 -7.121) 7.391 4.076 ( -9.383 -0.000 9.791) 13.561 4.739 ( 1.735 0.000 7.768) 7.959 4.798 ( 9.932 0.000 -4.408) 10.867 4.835 ( 8.596 0.000 -4.307) 9.615 5.196 ( -0.424 -0.000 -4.058) 4.080 5.515 ( 13.230 0.000 3.349) 13.647 5.734 ( 8.426 0.000 -3.006) 8.946 5.790 ( 1.528 0.000 -1.543) 2.172 6.308 ( 0.235 0.000 -2.513) 2.524 6.638 ( -7.045 -0.000 1.198) 7.146 6.801 ( -6.983 -0.000 1.521) 7.146 6.914 ( -0.787 -0.000 -1.389) 1.597 6.998 ( -0.051 -0.000 1.664) 1.664 7.132 ( -0.102 -0.000 -3.866) 3.867 7.504 ( -1.029 -0.000 4.724) 4.835 7.787 ( 2.151 0.000 -2.471) 3.276 8.026 ( 3.838 0.000 -0.939) 3.951 8.270 ( 5.030 0.000 2.865) 5.788 8.582 ( 4.727 0.000 -0.984) 4.829 8.643 ( 4.328 0.000 -0.518) 4.359 12.118 ( -16.378 -0.000 0.172) 16.379 12.535 ( -16.587 -0.000 -0.872) 16.610 12.782 ( 11.654 0.000 6.350) 13.272 13.451 ( -26.008 -0.000 -5.166) 26.516 14.081 ( 24.478 0.000 4.606) 24.908 14.802 ( 39.586 0.000 -2.479) 39.664 14.853 ( 44.097 0.000 -0.647) 44.101 16.800 ( 26.533 0.000 -31.724) 41.357 26.872 ( -0.716 -0.000 0.715) 1.012 26.876 ( -0.572 -0.000 -0.489) 0.753 26.908 ( -0.294 -0.000 0.039) 0.296 27.018 ( 0.139 0.000 -1.229) 1.237 28.049 ( -1.502 -0.000 0.983) 1.795 28.199 ( -1.213 -0.000 -1.481) 1.915 33.748 ( -2.430 -0.000 1.637) 2.930 34.016 ( -0.202 -0.000 -3.784) 3.789 34.441 ( 5.346 0.000 -3.782) 6.549 34.520 ( 10.711 0.000 4.382) 11.573 35.500 ( 3.737 0.000 2.796) 4.668 35.757 ( 1.102 0.000 -4.961) 5.082 37.189 ( 2.356 0.000 3.299) 4.053 37.255 ( -0.410 -0.000 -1.373) 1.433 42.700 ( 40.762 0.000 -2.470) 40.837 43.623 ( 37.984 0.000 -9.082) 39.055 43.742 ( 21.798 0.000 -4.788) 22.318 44.798 ( 5.525 0.000 -4.886) 7.375 45.353 ( 2.796 0.000 8.197) 8.660 45.677 ( -7.517 -0.000 -2.194) 7.831 45.859 ( 27.292 0.000 -8.618) 28.620 46.999 ( 17.241 0.000 -2.190) 17.380 49.940 ( 15.589 0.000 -1.271) 15.641 50.389 ( 4.851 0.000 -2.237) 5.342 50.573 ( 14.899 0.000 -2.740) 15.149 53.533 ( -0.877 -0.000 -17.245) 17.267 62.168 ( -2.288 -0.000 26.294) 26.394 64.393 ( 22.891 0.000 -104.012) 106.501 66.751 ( -16.364 -0.000 7.429) 17.971 68.588 ( 38.555 0.000 -45.430) 59.585 ======================= Grid point 148 (59/204) ======================= q-point: ( 0.27 0.18 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.620 ( 23.754 -4.316 4.426) 24.545 1.775 ( 20.401 -1.359 5.904) 21.282 2.479 ( 1.884 1.281 -13.900) 14.086 2.660 ( 10.721 -2.082 -6.096) 12.507 3.064 ( 13.469 -6.830 0.700) 15.118 3.392 ( -0.035 -0.460 8.031) 8.045 3.828 ( -13.539 2.918 13.375) 19.254 4.025 ( 4.856 1.952 -1.284) 5.388 4.113 ( 3.611 -2.920 -1.354) 4.838 4.660 ( 0.006 10.443 4.461) 11.356 4.793 ( 2.641 4.295 -2.788) 5.761 4.885 ( -0.865 2.037 -3.525) 4.162 5.317 ( 7.030 -5.297 -3.475) 9.463 5.618 ( 13.250 5.934 1.948) 14.648 5.789 ( 0.798 0.270 -1.471) 1.695 5.925 ( 14.947 -7.028 -2.118) 16.652 6.255 ( -0.698 4.470 -2.620) 5.228 6.593 ( -5.866 -4.145 1.309) 7.301 6.725 ( -8.229 0.326 2.740) 8.679 6.893 ( 2.390 1.491 -0.073) 2.818 7.062 ( 2.436 -2.580 -1.290) 3.776 7.151 ( 3.026 -3.345 -3.146) 5.500 7.527 ( -1.082 -3.144 3.494) 4.823 7.824 ( 4.525 -0.245 -2.522) 5.186 8.058 ( 1.829 -0.304 0.306) 1.879 8.357 ( 6.088 -1.617 3.299) 7.111 8.645 ( 4.620 -1.247 -1.017) 4.892 8.696 ( 6.803 0.271 -1.872) 7.061 11.806 ( -18.281 11.988 0.256) 21.863 12.452 ( -21.615 -13.183 -0.652) 25.326 12.789 ( -2.796 5.990 4.552) 8.026 13.124 ( -14.910 6.378 -2.725) 16.444 14.292 ( 32.105 16.462 4.003) 36.301 14.907 ( 42.342 24.166 0.130) 48.753 15.676 ( 38.175 -23.662 -0.578) 44.917 17.021 ( 15.300 -4.900 -20.454) 26.009 26.867 ( -0.855 -0.255 0.876) 1.251 26.870 ( -0.306 -0.198 -0.373) 0.521 26.914 ( -0.081 -0.862 -0.086) 0.870 27.020 ( 0.029 -0.560 -1.233) 1.354 28.032 ( -1.389 0.346 0.900) 1.691 28.177 ( -1.303 0.512 -1.370) 1.959 33.727 ( -2.214 -0.185 1.608) 2.743 34.000 ( 0.322 0.863 -3.175) 3.306 34.477 ( 4.549 1.313 -2.735) 5.468 34.642 ( 8.924 0.056 3.532) 9.598 35.530 ( 2.890 1.703 3.208) 4.641 35.773 ( 1.356 -1.324 -4.409) 4.799 37.214 ( 0.559 0.052 1.808) 1.894 37.260 ( 0.069 -1.387 -0.351) 1.433 42.959 ( 42.069 23.787 -1.228) 48.344 43.815 ( 22.603 16.996 -3.285) 28.470 44.219 ( 35.478 -16.360 -5.628) 39.472 44.912 ( 6.829 -6.959 -2.663) 10.107 45.391 ( 8.341 3.400 5.394) 10.499 45.677 ( -2.863 -8.416 2.394) 9.207 46.087 ( 25.637 5.695 -9.563) 27.949 47.255 ( 15.308 -7.277 -0.685) 16.964 50.047 ( 15.905 7.793 0.220) 17.713 50.458 ( 9.454 0.916 -2.713) 9.878 50.673 ( 21.881 10.678 -3.546) 24.604 53.679 ( -11.372 -24.998 -5.479) 28.004 62.086 ( -16.838 4.163 26.237) 31.452 64.114 ( -20.005 6.782 -63.927) 67.327 66.680 ( -8.003 -6.236 9.260) 13.736 68.901 ( 42.018 5.121 -48.047) 64.033 ======================= Grid point 149 (60/204) ======================= q-point: ( 0.36 0.18 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.954 ( 20.488 -4.882 2.598) 21.222 2.039 ( 15.256 -5.481 4.247) 16.757 2.481 ( 5.245 0.442 -9.627) 10.971 2.811 ( 11.580 -3.276 -3.991) 12.679 3.275 ( 5.524 -7.457 -1.282) 9.368 3.399 ( -0.445 1.490 6.378) 6.565 3.624 ( -15.541 5.263 12.469) 20.608 4.051 ( 1.400 0.370 -1.401) 2.015 4.202 ( 3.848 -2.673 -0.914) 4.773 4.469 ( -1.233 13.471 1.432) 13.603 4.684 ( -2.114 8.699 -1.924) 9.156 4.866 ( -0.723 -1.997 -3.131) 3.783 5.355 ( 0.773 4.829 0.911) 4.975 5.690 ( 14.902 6.908 -1.229) 16.471 5.805 ( -1.269 -4.283 -0.064) 4.467 6.144 ( 4.222 0.374 -0.482) 4.266 6.190 ( 1.091 -2.595 -3.492) 4.486 6.594 ( -4.949 2.245 0.361) 5.446 6.693 ( 0.439 -6.850 4.197) 8.045 6.923 ( 5.128 0.740 0.402) 5.197 7.100 ( 3.825 -0.095 -4.474) 5.887 7.280 ( 5.223 -6.045 -1.178) 8.075 7.586 ( -0.785 -4.894 1.720) 5.246 7.873 ( 6.252 1.455 -1.500) 6.592 8.083 ( -0.152 -1.539 1.077) 1.885 8.442 ( 4.627 0.334 3.978) 6.111 8.696 ( 5.179 1.008 -2.272) 5.744 8.802 ( 8.032 -3.205 -1.842) 8.842 11.402 ( -20.163 11.297 0.385) 23.115 12.394 ( -25.929 -14.128 -1.078) 29.548 12.593 ( -8.556 7.965 1.475) 11.782 12.987 ( 2.436 4.354 0.487) 5.013 14.353 ( 33.020 22.706 2.101) 40.128 15.024 ( 42.025 22.923 0.795) 47.877 16.358 ( 26.784 -16.854 0.412) 31.649 17.153 ( 4.433 -1.731 -11.767) 12.693 26.866 ( -0.608 -0.458 0.753) 1.071 26.872 ( -0.261 -0.441 -0.100) 0.522 26.928 ( -0.000 -1.098 -0.189) 1.114 27.028 ( -0.242 -0.899 -1.091) 1.434 28.013 ( -1.104 0.535 0.801) 1.465 28.151 ( -1.160 0.641 -1.161) 1.761 33.712 ( -1.814 -0.277 1.419) 2.320 33.987 ( 0.644 0.595 -2.722) 2.860 34.493 ( 3.867 2.086 -1.519) 4.649 34.727 ( 6.586 1.224 2.435) 7.128 35.530 ( 1.894 2.842 3.517) 4.902 35.799 ( 1.268 -1.199 -3.841) 4.219 37.217 ( -0.351 -0.437 0.147) 0.580 37.288 ( -0.132 -1.916 0.603) 2.013 43.014 ( 39.495 26.433 -1.154) 47.538 43.788 ( 25.137 19.696 -1.784) 31.985 44.610 ( 10.082 -2.752 -2.332) 10.708 45.125 ( 8.133 -6.770 -1.707) 10.719 45.477 ( 6.702 -0.661 1.797) 6.970 45.908 ( 21.094 -4.520 7.886) 22.969 46.258 ( 15.377 -2.691 -9.097) 18.068 47.510 ( 12.468 -5.185 -0.701) 13.522 50.078 ( 16.948 11.992 0.644) 20.771 50.542 ( 15.234 5.897 -1.280) 16.385 50.810 ( 23.717 2.794 -4.105) 24.231 53.866 ( -15.755 -18.981 -0.357) 24.670 61.795 ( -32.964 4.795 21.643) 39.725 63.561 ( -42.575 1.503 -37.216) 56.567 66.795 ( 3.498 -8.114 11.614) 14.593 69.141 ( 37.734 8.209 -39.695) 55.380 ======================= Grid point 150 (61/204) ======================= q-point: ( 0.45 0.18 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.201 ( 11.367 -1.278 0.678) 11.459 2.287 ( 8.846 -7.092 0.981) 11.380 2.541 ( 12.157 0.349 -4.310) 12.903 3.001 ( 12.172 -3.493 -0.130) 12.664 3.349 ( -7.445 4.898 5.615) 10.534 3.392 ( -2.791 -1.815 3.701) 4.978 3.462 ( -2.009 -3.839 4.117) 5.977 4.020 ( -2.983 2.609 -0.077) 3.964 4.227 ( 4.951 9.439 -2.547) 10.958 4.291 ( -3.085 1.457 -0.999) 3.555 4.503 ( -5.809 8.203 -0.244) 10.055 4.897 ( 1.260 -2.347 -3.404) 4.323 5.250 ( -2.633 6.486 1.769) 7.220 5.688 ( 4.321 6.299 0.030) 7.639 5.899 ( 3.742 -3.823 -0.985) 5.440 6.088 ( -0.036 3.642 -0.801) 3.729 6.271 ( -1.954 -5.092 -2.034) 5.821 6.486 ( -5.296 3.432 1.494) 6.485 6.836 ( 3.320 -4.413 3.423) 6.497 6.980 ( 8.456 1.367 -0.552) 8.583 7.143 ( 6.315 0.425 -5.210) 8.198 7.395 ( -1.569 -4.376 0.919) 4.739 7.664 ( 2.797 -3.793 -0.135) 4.715 7.908 ( 6.015 2.637 -1.102) 6.660 8.099 ( -2.092 -1.399 1.600) 2.983 8.457 ( 1.062 3.250 5.017) 6.071 8.734 ( 6.854 1.601 -3.626) 7.917 8.909 ( 2.850 -0.936 -1.584) 3.393 11.071 ( -14.685 4.127 0.452) 15.261 12.313 ( -26.016 -14.366 -1.477) 29.755 12.457 ( 0.155 3.092 1.000) 3.254 12.982 ( 7.745 4.569 0.752) 9.023 14.374 ( 32.369 22.463 0.801) 39.408 15.141 ( 40.898 22.995 1.217) 46.935 16.772 ( 12.529 -7.888 0.984) 14.838 17.097 ( -7.071 4.492 -7.363) 11.153 26.869 ( -0.574 -0.543 0.842) 1.154 26.876 ( -0.245 -0.397 -0.125) 0.483 26.946 ( 0.237 -1.061 -0.248) 1.115 27.035 ( -0.655 -0.998 -0.926) 1.511 27.997 ( -0.672 0.414 0.722) 1.070 28.129 ( -0.867 0.416 -0.965) 1.363 33.703 ( -1.176 -0.425 1.232) 1.756 33.984 ( 0.685 -0.055 -2.640) 2.727 34.494 ( 3.140 2.686 -0.287) 4.142 34.759 ( 3.930 3.006 1.360) 5.131 35.503 ( 0.870 3.656 3.736) 5.299 35.818 ( 1.127 -0.783 -3.400) 3.666 37.224 ( -0.407 -1.053 -0.363) 1.186 37.313 ( -0.653 -1.745 0.495) 1.928 43.058 ( 36.638 23.076 -0.817) 43.307 43.774 ( 26.925 19.863 -1.373) 33.487 44.665 ( 2.295 1.130 0.047) 2.558 45.244 ( 4.995 -0.613 -3.786) 6.298 45.535 ( 0.222 -1.025 3.111) 3.283 46.134 ( 26.897 13.570 1.006) 30.144 46.482 ( 1.796 -11.958 0.621) 12.108 47.680 ( 9.329 -1.402 -1.444) 9.543 50.069 ( 15.138 12.684 0.239) 19.752 50.618 ( 20.459 10.201 0.864) 22.878 51.011 ( 12.893 1.387 -4.551) 13.743 53.968 ( -5.248 -13.345 1.002) 14.375 61.306 ( -47.574 4.831 13.850) 49.784 62.992 ( -54.087 -7.829 -20.770) 58.464 67.031 ( 12.203 -6.270 13.934) 19.555 69.311 ( 31.988 9.752 -30.918) 45.544 ======================= Grid point 151 (62/204) ======================= q-point: (-0.45 0.18 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.202 ( -1.202 6.359 -0.739) 6.514 2.446 ( 7.914 -0.367 -0.423) 7.933 2.719 ( 13.624 -1.070 -0.728) 13.685 3.096 ( 4.961 5.151 3.048) 7.775 3.196 ( -6.361 2.525 4.630) 8.263 3.455 ( 1.485 -6.704 10.422) 12.481 3.557 ( 0.163 -6.196 -5.183) 8.080 3.911 ( 1.134 9.038 1.059) 9.170 4.130 ( 1.274 3.558 -3.643) 5.249 4.253 ( -6.124 1.203 -0.449) 6.257 4.338 ( -2.927 4.168 -1.728) 5.378 4.944 ( 2.395 -1.615 -2.275) 3.677 5.132 ( -3.898 3.725 -0.153) 5.393 5.607 ( -4.292 4.929 0.725) 6.576 5.909 ( -3.465 2.823 0.713) 4.526 6.093 ( 6.922 0.962 -2.073) 7.289 6.298 ( -4.079 -3.722 -1.992) 5.870 6.394 ( -3.065 2.319 1.710) 4.207 6.886 ( 1.324 1.393 2.738) 3.345 7.066 ( 9.193 1.575 -1.162) 9.399 7.201 ( 7.287 0.574 -4.427) 8.546 7.358 ( -9.847 -0.025 2.384) 10.131 7.758 ( 6.294 -1.103 -1.253) 6.512 7.920 ( 3.022 2.207 -1.240) 3.942 8.076 ( -2.985 1.275 2.240) 3.944 8.403 ( -1.716 4.218 5.601) 7.219 8.788 ( 6.902 0.451 -3.860) 7.921 8.838 ( -8.324 5.697 -1.528) 10.202 11.005 ( -0.361 -6.578 0.351) 6.597 12.246 ( -26.990 -15.926 -1.249) 31.363 12.517 ( 11.230 -1.951 0.206) 11.400 13.023 ( 11.641 4.053 0.684) 12.346 14.397 ( 31.459 21.550 0.046) 38.132 15.234 ( 39.309 24.506 1.863) 46.360 16.795 ( -16.862 11.521 -1.619) 20.486 16.903 ( -4.646 0.653 -2.963) 5.549 26.871 ( -0.755 -0.390 0.901) 1.239 26.879 ( -0.032 -0.281 -0.204) 0.349 26.963 ( 0.343 -0.738 -0.177) 0.833 27.039 ( -0.927 -1.024 -0.867) 1.631 27.990 ( -0.222 0.010 0.686) 0.721 28.116 ( -0.523 -0.082 -0.857) 1.007 33.706 ( -0.404 -0.774 1.124) 1.423 33.990 ( 0.589 -0.563 -2.771) 2.889 34.479 ( 2.233 3.230 0.764) 4.000 34.729 ( 1.295 5.031 0.434) 5.213 35.458 ( 0.016 4.054 3.857) 5.596 35.833 ( 0.956 -0.665 -3.059) 3.273 37.237 ( -0.184 -1.205 -0.454) 1.301 37.328 ( -0.896 -1.213 0.210) 1.522 43.118 ( 33.456 20.719 -0.096) 39.352 43.772 ( 27.239 19.845 -1.986) 33.760 44.670 ( 2.049 1.139 1.704) 2.898 45.251 ( 1.027 2.628 -4.202) 5.062 45.523 ( -1.612 2.614 2.902) 4.226 46.118 ( 13.101 17.237 -4.240) 22.062 46.584 ( -3.750 -1.366 8.417) 9.315 47.754 ( 6.087 2.443 -2.691) 7.090 50.031 ( 11.386 11.897 -0.228) 16.469 50.651 ( 12.120 14.053 3.425) 18.871 50.990 ( 7.504 9.198 -4.178) 12.584 54.193 ( 3.041 -14.109 -3.159) 14.775 60.718 ( -47.533 1.410 6.261) 47.965 62.501 ( -59.606 -15.786 -10.907) 62.618 67.294 ( 14.954 -2.939 14.899) 21.313 69.407 ( 25.705 11.870 -23.784) 36.977 ======================= Grid point 152 (63/204) ======================= q-point: (-0.36 0.18 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.040 ( -3.099 10.917 2.639) 11.651 2.422 ( 2.396 11.512 1.102) 11.810 2.797 ( 7.550 4.610 -1.123) 8.917 3.014 ( -0.135 8.835 -4.891) 10.100 3.207 ( 1.274 -4.855 8.069) 9.502 3.560 ( 1.451 1.107 9.034) 9.216 3.619 ( -4.430 -4.905 -5.194) 8.406 3.822 ( 9.734 9.646 1.463) 13.782 4.111 ( -4.835 -2.343 -1.471) 5.571 4.178 ( -2.176 -3.752 -1.121) 4.479 4.299 ( 0.812 0.744 -1.952) 2.241 4.942 ( -2.134 4.650 2.392) 5.648 5.089 ( -1.782 -4.330 -5.575) 7.281 5.412 ( -16.307 5.932 0.440) 17.358 5.817 ( 0.934 5.905 1.470) 6.157 6.119 ( 4.655 4.776 -2.109) 6.995 6.303 ( -2.737 -3.605 -1.356) 4.725 6.363 ( -2.073 -0.893 0.670) 2.354 6.861 ( 0.783 3.885 3.307) 5.161 7.078 ( 1.654 3.962 -3.095) 5.293 7.247 ( -1.802 -0.846 -0.726) 2.119 7.295 ( 6.713 2.279 0.194) 7.092 7.795 ( -0.219 2.040 1.439) 2.506 7.904 ( 1.581 1.724 -3.425) 4.147 8.024 ( 1.126 4.273 3.041) 5.365 8.331 ( -3.706 2.866 4.073) 6.208 8.597 ( -12.980 6.740 -0.860) 14.651 8.845 ( 4.629 -0.199 -3.292) 5.684 11.221 ( 10.197 -12.265 0.210) 15.951 12.193 ( -25.351 -16.180 -1.507) 30.112 12.719 ( 14.723 -2.988 0.237) 15.025 13.146 ( 15.992 -0.798 0.411) 16.018 14.417 ( 31.164 21.726 -0.337) 37.992 15.261 ( 34.233 27.753 2.702) 44.153 16.291 ( -29.039 17.419 -2.835) 33.981 16.721 ( -15.925 8.261 -2.121) 18.065 26.868 ( -0.707 -0.050 0.740) 1.025 26.884 ( 0.234 -0.323 -0.084) 0.408 26.973 ( -0.037 -0.254 -0.013) 0.257 27.043 ( -0.670 -0.934 -0.950) 1.491 27.995 ( 0.061 -0.507 0.698) 0.865 28.116 ( -0.191 -0.758 -0.854) 1.158 33.724 ( 0.326 -1.304 1.104) 1.739 34.000 ( 0.531 -0.840 -2.909) 3.074 34.447 ( 1.057 3.795 1.424) 4.189 34.640 ( -0.774 6.796 -0.204) 6.842 35.402 ( -0.557 3.940 3.951) 5.607 35.846 ( 0.711 -0.749 -2.925) 3.102 37.254 ( 0.214 -0.998 -0.298) 1.064 37.329 ( -0.908 -0.188 -0.011) 0.927 43.151 ( 29.038 21.842 1.409) 36.363 43.752 ( 23.437 19.950 -3.839) 31.017 44.679 ( 2.660 2.958 4.005) 5.645 45.168 ( -5.794 3.306 -3.583) 7.573 45.433 ( -2.955 6.338 1.831) 7.228 45.891 ( 1.413 19.492 -7.054) 20.777 46.504 ( -5.039 8.022 13.394) 16.405 47.729 ( 3.457 6.648 -4.721) 8.856 49.954 ( 6.524 11.134 -0.040) 12.905 50.449 ( -9.128 9.067 2.030) 13.025 51.043 ( 34.331 16.197 0.362) 37.962 54.255 ( -21.446 -5.157 -15.770) 27.115 60.374 ( -18.945 -7.896 2.214) 20.644 62.073 ( -62.973 -20.031 -5.434) 66.305 67.505 ( 12.022 0.241 14.692) 18.986 69.403 ( 18.815 14.979 -18.307) 30.225 ======================= Grid point 153 (64/204) ======================= q-point: (-0.27 0.18 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.825 ( -2.462 14.599 7.444) 16.571 2.201 ( 1.258 18.839 2.093) 18.997 2.753 ( 1.888 8.638 -3.788) 9.619 2.875 ( 5.328 9.066 -6.214) 12.214 3.289 ( -3.263 -3.504 3.487) 5.923 3.457 ( -7.121 14.072 1.889) 15.884 3.571 ( -1.056 -0.051 1.977) 2.242 3.848 ( 14.497 5.666 0.868) 15.589 4.150 ( -0.425 -5.594 0.677) 5.651 4.265 ( -1.899 -7.521 -1.036) 7.826 4.323 ( 1.477 -3.702 -0.099) 3.987 4.705 ( -20.551 11.197 3.066) 23.603 5.085 ( -4.677 1.613 -3.845) 6.266 5.260 ( -1.144 -6.716 -1.919) 7.078 5.761 ( 3.575 6.168 1.484) 7.282 6.045 ( 0.593 7.635 -1.660) 7.836 6.352 ( -1.946 -0.133 -0.959) 2.174 6.356 ( 0.355 -5.480 -1.399) 5.666 6.818 ( -1.423 1.968 3.918) 4.609 7.036 ( 3.450 3.127 -3.891) 6.068 7.223 ( -2.205 0.616 1.512) 2.744 7.350 ( 8.493 3.577 -1.611) 9.355 7.704 ( -7.075 3.567 3.593) 8.700 7.893 ( 4.541 4.083 -3.797) 7.191 7.973 ( -1.437 3.891 3.640) 5.518 8.247 ( -4.002 1.475 -1.471) 4.512 8.424 ( -5.532 1.919 2.991) 6.575 8.877 ( 1.929 -0.031 -2.941) 3.517 11.553 ( 12.038 -13.195 0.454) 17.867 12.176 ( -19.937 -15.909 -2.785) 25.658 12.883 ( 12.950 2.795 2.472) 13.477 13.412 ( 14.811 -9.730 -1.405) 17.777 14.425 ( 31.773 23.660 -0.073) 39.615 15.055 ( 0.686 30.874 0.867) 30.893 15.712 ( -13.153 21.554 0.666) 25.259 16.312 ( -21.122 14.284 -5.646) 26.116 26.862 ( -0.484 0.207 0.695) 0.872 26.894 ( 0.645 -0.462 -0.080) 0.798 26.970 ( -0.602 0.058 0.123) 0.617 27.048 ( -0.108 -0.490 -1.070) 1.182 28.009 ( 0.080 -0.968 0.759) 1.232 28.130 ( 0.068 -1.441 -0.940) 1.722 33.757 ( 0.636 -1.853 1.163) 2.279 34.015 ( 0.730 -1.087 -2.953) 3.231 34.392 ( -0.358 4.387 1.592) 4.681 34.512 ( -1.508 7.803 -0.479) 7.962 35.347 ( -0.761 3.375 4.160) 5.410 35.858 ( 0.371 -0.798 -3.188) 3.307 37.270 ( 0.754 -0.457 -0.096) 0.887 37.311 ( -0.929 1.235 0.025) 1.546 43.063 ( 18.327 27.315 3.970) 33.132 43.639 ( 13.797 20.312 -6.544) 25.412 44.593 ( -3.271 11.688 7.051) 14.037 45.062 ( -5.321 -1.864 -3.490) 6.631 45.288 ( -2.749 8.262 0.873) 8.751 45.605 ( 1.086 15.736 -8.666) 17.998 46.306 ( -7.305 12.599 15.621) 21.357 47.614 ( 3.073 10.736 -7.773) 13.606 49.860 ( 3.157 7.453 1.267) 8.192 50.287 ( -5.400 1.775 -0.299) 5.692 51.152 ( 31.120 22.975 5.378) 39.054 53.824 ( -31.434 6.342 -37.905) 49.650 60.575 ( 19.433 -15.185 1.041) 24.684 61.667 ( -63.229 -20.384 -1.941) 66.462 67.614 ( 4.929 2.598 13.914) 14.988 69.282 ( 11.553 18.001 -14.104) 25.621 ======================= Grid point 154 (65/204) ======================= q-point: (-0.18 0.18 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.571 ( -1.363 18.560 10.459) 21.347 1.909 ( 1.969 22.683 4.082) 23.131 2.595 ( 2.456 11.431 -9.409) 15.007 2.810 ( 7.559 8.613 -4.870) 12.452 3.024 ( -8.691 25.861 1.915) 27.350 3.308 ( -5.605 -3.360 -1.641) 6.738 3.589 ( 2.968 1.205 6.960) 7.662 3.935 ( 4.986 3.156 2.962) 6.603 4.176 ( -9.993 -2.686 -1.483) 10.453 4.227 ( -1.132 3.388 -4.564) 5.796 4.405 ( -0.288 -3.370 1.554) 3.722 4.517 ( 2.726 -7.477 4.626) 9.205 5.048 ( 2.475 0.937 0.615) 2.717 5.414 ( 1.302 -11.215 -4.809) 12.272 5.676 ( -0.927 8.319 1.552) 8.513 5.915 ( -0.039 7.904 -1.918) 8.133 6.298 ( -1.556 4.335 -0.115) 4.607 6.479 ( 3.399 -7.931 -3.116) 9.174 6.786 ( -4.130 -0.709 2.555) 4.908 7.044 ( 5.050 1.282 -2.268) 5.682 7.189 ( -1.463 1.793 2.251) 3.229 7.348 ( 3.515 5.063 -0.887) 6.227 7.591 ( -4.605 2.361 2.010) 5.552 7.851 ( 3.136 5.348 -1.785) 6.452 7.908 ( -4.210 0.625 2.406) 4.889 8.232 ( 2.978 -0.172 -2.347) 3.795 8.389 ( -0.692 0.202 4.287) 4.348 8.874 ( -0.496 0.555 -3.218) 3.303 11.850 ( 0.730 -14.121 1.642) 14.235 12.248 ( -3.463 -13.309 -5.724) 14.896 12.901 ( 2.526 11.252 6.484) 13.230 13.656 ( -7.101 -10.932 -6.306) 14.481 14.277 ( -3.157 24.096 2.220) 24.403 14.570 ( 16.046 21.400 -3.493) 26.975 15.223 ( -16.789 30.184 4.110) 34.783 15.968 ( 12.892 16.395 -9.570) 22.947 26.856 ( -0.091 0.277 0.685) 0.745 26.911 ( 0.760 -0.620 -0.120) 0.988 26.960 ( -0.666 0.260 0.154) 0.732 27.049 ( 0.246 0.131 -1.149) 1.183 28.028 ( -0.114 -1.274 0.859) 1.541 28.156 ( 0.161 -1.888 -1.070) 2.177 33.794 ( -0.269 -2.057 1.219) 2.407 34.038 ( 1.176 -1.516 -2.864) 3.447 34.312 ( -1.879 4.808 1.169) 5.293 34.381 ( 0.545 7.691 -0.362) 7.719 35.306 ( -0.253 2.393 4.606) 5.197 35.862 ( -0.046 -0.630 -3.968) 4.018 37.264 ( 0.319 3.361 0.404) 3.400 37.289 ( -0.068 -0.285 -0.051) 0.298 42.708 ( -1.981 30.026 5.040) 30.510 43.475 ( 16.801 19.687 -6.218) 26.618 44.257 ( -20.978 19.258 5.772) 29.056 45.076 ( 0.679 0.600 -4.481) 4.572 45.149 ( -1.043 4.219 0.777) 4.415 45.391 ( 0.857 10.791 -6.796) 12.782 46.071 ( -5.884 10.338 11.075) 16.253 47.450 ( 5.987 13.827 -10.823) 18.552 49.804 ( 0.901 4.593 2.590) 5.350 50.243 ( -2.276 -1.071 -2.409) 3.483 50.915 ( -11.796 23.384 3.969) 26.490 53.539 ( 38.007 12.956 -57.655) 70.260 61.171 ( 42.844 -13.992 -1.924) 45.112 61.286 ( -53.638 -16.957 0.859) 56.261 67.596 ( -4.595 4.136 12.628) 14.060 69.055 ( 4.726 19.248 -10.709) 22.527 ======================= Grid point 155 (66/204) ======================= q-point: (-0.09 0.18 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.290 ( 2.529 20.979 10.198) 23.463 1.542 ( -3.113 26.746 8.350) 28.192 2.416 ( 11.418 19.968 -6.919) 24.020 2.591 ( 1.826 20.301 -0.062) 20.383 2.747 ( 7.253 8.829 -5.968) 12.891 3.305 ( -5.751 -5.794 -4.827) 9.484 3.592 ( -1.047 1.848 6.820) 7.143 3.891 ( -2.500 -4.716 5.760) 7.852 4.158 ( -2.393 -0.868 -3.364) 4.219 4.334 ( 18.471 -1.312 -0.389) 18.522 4.440 ( 1.560 -0.016 0.444) 1.622 4.711 ( 2.585 -9.640 2.008) 10.181 5.123 ( 9.351 -2.487 3.874) 10.423 5.442 ( -7.246 7.318 -1.571) 10.418 5.618 ( -0.400 -6.674 -2.791) 7.245 5.818 ( 2.052 5.403 -2.318) 6.227 6.196 ( -0.355 6.659 0.542) 6.690 6.643 ( 5.704 -7.194 -4.324) 10.148 6.770 ( -3.983 -3.045 2.107) 5.438 7.087 ( 3.548 -0.488 -0.913) 3.696 7.133 ( -4.164 2.347 2.891) 5.586 7.276 ( -1.821 5.270 0.815) 5.635 7.556 ( 1.033 0.295 -1.226) 1.630 7.828 ( 7.894 4.446 -1.103) 9.127 7.873 ( -4.210 -1.744 2.262) 5.087 8.273 ( 3.420 0.137 0.653) 3.485 8.413 ( 3.119 -0.265 2.813) 4.208 8.823 ( -3.777 2.635 -4.149) 6.198 11.970 ( -17.239 -11.494 -0.842) 20.736 12.354 ( -13.689 12.682 1.978) 18.766 12.623 ( 4.769 -2.692 -1.393) 5.651 13.546 ( -13.973 -6.015 -4.815) 15.956 14.128 ( -1.766 -1.996 -0.069) 2.666 14.350 ( -24.719 29.638 6.105) 39.073 14.677 ( 34.052 26.703 -8.853) 44.170 16.026 ( 41.835 15.515 -11.961) 46.194 26.856 ( 0.408 0.140 0.562) 0.709 26.922 ( -0.749 -0.425 0.088) 0.865 26.953 ( 0.493 0.436 -0.201) 0.688 27.044 ( 0.332 0.612 -1.145) 1.340 28.048 ( -0.453 -1.347 0.955) 1.713 28.184 ( -0.020 -1.901 -1.181) 2.238 33.810 ( -2.407 -1.437 1.100) 3.012 34.060 ( -1.092 -0.858 -1.995) 2.431 34.231 ( 1.480 3.707 -0.459) 4.018 34.308 ( 4.956 5.550 0.166) 7.442 35.298 ( 1.593 0.858 5.099) 5.411 35.854 ( -0.483 -0.004 -5.142) 5.165 37.208 ( 0.527 4.242 1.289) 4.464 37.290 ( 0.236 0.472 -0.535) 0.751 42.266 ( -3.893 21.289 5.431) 22.313 43.366 ( 9.308 20.186 4.269) 22.635 43.531 ( -29.547 25.067 -11.562) 40.435 44.974 ( 1.480 8.026 -3.841) 9.020 45.151 ( -1.078 -1.102 -1.323) 2.032 45.324 ( 10.152 4.015 -3.588) 11.492 45.946 ( -0.387 4.384 3.143) 5.408 47.282 ( 9.086 15.959 -11.760) 21.807 49.690 ( -6.632 7.817 2.355) 10.518 50.235 ( -1.349 -1.276 -4.738) 5.089 50.462 ( -12.668 8.715 -0.558) 15.387 53.917 ( 87.053 20.253 -67.469) 111.984 61.087 ( -18.179 -14.596 1.403) 23.355 61.898 ( 59.828 -8.320 -14.466) 62.112 67.449 ( -13.714 4.695 10.387) 17.832 68.766 ( -0.799 17.851 -8.084) 19.612 ======================= Grid point 159 (67/204) ======================= q-point: ( 0.27 0.27 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.870 ( 23.742 0.000 4.269) 24.123 1.971 ( 13.773 0.000 4.845) 14.600 2.508 ( 6.069 0.000 -12.543) 13.934 2.738 ( 9.567 0.000 -5.920) 11.250 3.144 ( 9.207 0.000 0.037) 9.207 3.409 ( 0.674 0.000 7.365) 7.396 3.710 ( -16.292 -0.000 13.287) 21.023 4.101 ( 4.500 0.000 -4.483) 6.352 4.105 ( 1.720 0.000 3.462) 3.866 4.684 ( -8.349 -0.000 5.928) 10.239 4.819 ( 0.971 0.000 -2.630) 2.803 4.954 ( -0.835 -0.000 -5.689) 5.750 5.380 ( 13.783 0.000 -3.719) 14.276 5.703 ( -2.142 -0.000 0.871) 2.312 5.915 ( 6.690 0.000 -1.152) 6.788 5.970 ( 11.620 0.000 -1.480) 11.714 6.281 ( 0.172 0.000 -3.069) 3.074 6.511 ( -0.701 -0.000 2.712) 2.801 6.651 ( -6.018 -0.000 1.740) 6.265 6.961 ( 6.037 0.000 -0.820) 6.093 7.099 ( 7.913 0.000 -0.439) 7.925 7.140 ( 2.565 0.000 -3.296) 4.176 7.503 ( 0.173 0.000 2.790) 2.796 7.899 ( 9.889 0.000 -2.835) 10.288 8.068 ( -0.609 -0.000 2.163) 2.247 8.423 ( 6.375 0.000 4.328) 7.706 8.689 ( 5.235 0.000 -1.457) 5.434 8.778 ( 8.388 0.000 -3.137) 8.955 11.681 ( -23.501 -0.000 0.468) 23.505 12.073 ( -25.146 -0.000 -0.730) 25.157 12.804 ( -4.767 -0.000 4.308) 6.425 12.941 ( -16.002 -0.000 -2.899) 16.262 14.844 ( 33.891 0.000 6.634) 34.535 15.630 ( 34.050 0.000 -1.735) 34.094 15.844 ( 40.822 0.000 3.463) 40.969 17.087 ( 11.634 0.000 -19.004) 22.282 26.858 ( -0.699 -0.000 0.931) 1.164 26.864 ( -0.238 -0.000 -0.410) 0.474 26.909 ( 0.237 0.000 0.046) 0.241 27.013 ( -0.072 -0.000 -1.252) 1.254 28.022 ( -1.264 -0.000 0.893) 1.548 28.163 ( -1.400 -0.000 -1.353) 1.947 33.705 ( -2.188 -0.000 1.751) 2.802 34.003 ( 0.371 0.000 -3.211) 3.233 34.528 ( 3.782 0.000 -2.123) 4.337 34.745 ( 7.648 0.000 3.115) 8.258 35.579 ( 2.081 0.000 3.029) 3.676 35.771 ( 1.881 0.000 -3.858) 4.292 37.228 ( 0.006 0.000 2.364) 2.364 37.240 ( -0.354 -0.000 -1.214) 1.264 43.670 ( 39.322 0.000 1.439) 39.348 44.168 ( 17.027 0.000 0.050) 17.027 44.418 ( 30.123 0.000 -12.480) 32.606 44.944 ( 11.899 0.000 0.962) 11.938 45.541 ( -3.165 -0.000 -1.188) 3.380 45.558 ( 12.237 0.000 11.001) 16.455 46.423 ( 25.031 0.000 -9.158) 26.654 47.394 ( 18.673 0.000 -0.437) 18.678 50.264 ( 13.477 0.000 2.742) 13.753 50.604 ( 17.188 0.000 -4.714) 17.822 51.111 ( 34.659 0.000 -6.700) 35.301 53.363 ( -7.440 -0.000 0.975) 7.504 61.872 ( -36.130 -0.000 25.556) 44.255 63.633 ( -47.245 -0.000 -47.141) 66.741 66.594 ( -1.613 -0.000 15.660) 15.743 69.307 ( 41.862 0.000 -52.876) 67.441 ======================= Grid point 160 (68/204) ======================= q-point: ( 0.36 0.27 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.119 ( 9.978 -1.969 4.214) 11.009 2.152 ( 20.194 -2.081 3.028) 20.525 2.550 ( 7.203 0.764 -9.148) 11.668 2.858 ( 9.261 -3.843 -5.749) 11.558 3.246 ( 4.288 -2.873 -0.050) 5.162 3.428 ( 0.108 1.042 6.113) 6.203 3.542 ( -14.793 2.468 12.608) 19.593 4.092 ( 1.062 2.291 0.462) 2.567 4.177 ( 3.056 -2.913 -1.789) 4.585 4.567 ( -8.008 3.830 5.206) 10.291 4.814 ( -3.371 6.085 -1.994) 7.237 4.841 ( 1.957 3.080 -6.144) 7.146 5.452 ( 3.288 5.391 -0.617) 6.345 5.712 ( -3.159 -4.584 -0.637) 5.603 5.909 ( 6.144 5.034 -1.624) 8.107 6.084 ( -1.622 -5.367 -0.996) 5.694 6.245 ( 2.361 4.798 -1.911) 5.678 6.579 ( -2.928 1.390 -1.040) 3.404 6.636 ( 6.706 -6.336 5.203) 10.592 7.027 ( 8.250 1.594 -0.387) 8.412 7.152 ( 6.338 0.571 -3.510) 7.267 7.246 ( 5.027 -4.746 -0.856) 6.966 7.547 ( 4.259 -2.458 -0.672) 4.963 8.008 ( 11.418 3.064 -0.747) 11.846 8.063 ( -0.336 -0.748 3.222) 3.325 8.504 ( 4.218 -0.227 5.281) 6.762 8.757 ( 6.225 -1.115 -2.393) 6.762 8.865 ( 8.483 0.119 -3.479) 9.170 11.311 ( -24.655 9.393 0.756) 26.395 11.880 ( -28.327 -12.058 -0.967) 30.802 12.646 ( -5.017 8.242 0.765) 9.679 12.904 ( -6.190 -7.208 0.380) 9.508 15.080 ( 31.329 16.367 5.078) 35.709 15.793 ( 34.851 18.445 0.194) 39.432 16.425 ( 27.186 -13.529 2.442) 30.464 17.157 ( 5.094 -0.063 -13.621) 14.542 26.855 ( -0.533 -0.270 0.882) 1.065 26.863 ( -0.082 -0.255 -0.307) 0.407 26.917 ( 0.303 -0.629 0.005) 0.698 27.012 ( -0.269 -0.435 -1.134) 1.244 28.009 ( -1.031 0.250 0.842) 1.354 28.142 ( -1.237 0.302 -1.210) 1.757 33.688 ( -1.933 -0.369 1.707) 2.605 33.996 ( 0.530 0.468 -3.078) 3.158 34.555 ( 3.271 1.092 -0.979) 3.585 34.820 ( 5.699 0.974 2.138) 6.164 35.591 ( 1.256 1.721 2.967) 3.653 35.792 ( 1.804 -0.774 -3.302) 3.841 37.216 ( -0.333 0.593 0.222) 0.715 37.255 ( -0.667 -1.768 0.409) 1.933 43.855 ( 32.646 22.356 0.390) 39.569 44.253 ( 17.727 10.934 -0.955) 20.850 44.661 ( 8.319 -2.745 -7.134) 11.297 45.152 ( 13.300 -2.399 2.380) 13.723 45.519 ( 1.921 0.201 -0.850) 2.110 45.909 ( 17.117 -17.737 9.850) 26.544 46.586 ( 21.883 9.263 -7.267) 24.849 47.618 ( 16.490 -1.930 -1.066) 16.637 50.383 ( 13.262 5.308 3.577) 14.726 50.835 ( 26.365 -0.125 -6.212) 27.088 51.332 ( 37.523 20.583 -5.330) 43.128 53.459 ( -5.645 -17.194 3.591) 18.449 61.427 ( -49.008 2.213 21.056) 53.386 62.919 ( -58.708 1.146 -31.813) 66.784 66.726 ( 4.284 -9.094 19.093) 21.577 69.581 ( 36.325 5.807 -45.585) 58.576 ======================= Grid point 161 (69/204) ======================= q-point: ( 0.45 0.27 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.270 ( 7.436 -3.008 2.967) 8.553 2.374 ( 13.732 -0.153 0.734) 13.752 2.619 ( 6.933 -2.684 -4.583) 8.733 3.037 ( 9.167 -7.306 -4.122) 12.426 3.311 ( -3.944 -2.878 -0.775) 4.944 3.354 ( -5.975 4.330 8.877) 11.544 3.433 ( -2.703 1.155 8.117) 8.633 4.052 ( -0.502 3.278 0.839) 3.420 4.244 ( 3.370 -1.344 -2.962) 4.684 4.430 ( -5.038 5.692 3.754) 8.478 4.606 ( -1.511 13.005 -2.355) 13.303 4.863 ( 1.422 -2.253 -5.291) 5.924 5.341 ( -1.656 8.241 0.256) 8.409 5.692 ( -7.671 -0.388 0.563) 7.701 5.914 ( 1.189 0.326 -1.348) 1.827 6.122 ( -1.827 -3.168 -0.117) 3.659 6.217 ( 4.349 2.749 -1.887) 5.480 6.503 ( -2.223 3.487 0.136) 4.138 6.825 ( 6.412 -5.106 3.457) 8.896 7.089 ( 6.218 0.723 -0.452) 6.276 7.225 ( 8.338 0.187 -3.442) 9.023 7.322 ( -0.986 -1.831 -0.604) 2.165 7.673 ( 9.853 -3.560 -3.656) 11.096 8.005 ( -1.678 1.867 2.414) 3.483 8.129 ( 10.770 3.811 2.057) 11.608 8.523 ( -0.202 2.658 6.243) 6.788 8.833 ( 7.541 1.008 -3.899) 8.549 8.928 ( 2.584 0.672 -2.526) 3.675 10.956 ( -16.313 3.798 0.842) 16.770 11.769 ( -28.233 -14.898 -1.117) 31.942 12.538 ( 2.906 3.663 0.328) 4.687 12.955 ( -3.904 -6.368 0.561) 7.490 15.137 ( 31.592 21.882 2.747) 38.529 15.899 ( 34.305 18.467 0.938) 38.971 16.803 ( 11.846 -6.138 1.602) 13.437 17.092 ( -4.370 6.693 -8.723) 11.832 26.857 ( -0.517 -0.422 0.842) 1.075 26.867 ( -0.090 -0.353 -0.181) 0.407 26.935 ( 0.596 -1.027 -0.170) 1.199 27.012 ( -0.691 -0.601 -0.920) 1.298 27.997 ( -0.683 0.291 0.780) 1.076 28.122 ( -0.900 0.330 -1.036) 1.411 33.681 ( -1.472 -0.733 1.596) 2.292 33.989 ( 0.685 0.356 -3.049) 3.146 34.564 ( 2.780 2.028 0.199) 3.447 34.848 ( 3.427 2.634 1.109) 4.462 35.571 ( 0.482 2.995 3.033) 4.289 35.814 ( 1.470 -0.656 -2.879) 3.299 37.211 ( 0.006 -0.274 -0.289) 0.398 37.274 ( -1.199 -1.935 0.420) 2.315 43.844 ( 30.571 23.565 -0.136) 38.599 44.259 ( 16.136 12.666 -1.008) 20.538 44.721 ( 5.494 1.599 -2.114) 6.100 45.277 ( 5.496 -0.401 -0.801) 5.569 45.545 ( 2.212 0.136 1.521) 2.688 46.318 ( 2.906 -12.500 2.823) 13.140 46.649 ( 23.511 12.076 0.173) 26.432 47.788 ( 11.749 0.193 -2.062) 11.930 50.407 ( 11.674 10.479 2.210) 15.843 51.137 ( 28.470 1.595 -7.467) 29.476 51.331 ( 31.107 28.492 -0.062) 42.183 53.705 ( 0.308 -17.285 2.847) 17.520 60.834 ( -52.851 4.329 13.634) 54.753 62.199 ( -60.891 -3.864 -18.582) 63.780 67.016 ( 6.804 -13.161 19.952) 24.852 69.743 ( 30.518 9.083 -36.210) 48.218 ======================= Grid point 162 (70/204) ======================= q-point: ( 0.55 0.27 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.304 ( 2.358 6.427 0.178) 6.848 2.523 ( 9.358 -2.763 1.724) 9.909 2.760 ( 4.996 -5.803 -1.126) 7.739 3.168 ( -6.007 0.276 7.719) 9.784 3.257 ( 6.763 4.358 2.613) 8.459 3.338 ( -1.423 -7.528 -7.430) 10.672 3.447 ( -2.739 -4.203 7.205) 8.779 3.996 ( 0.240 3.750 0.971) 3.881 4.243 ( -2.999 4.267 -0.366) 5.228 4.312 ( -0.947 4.743 0.798) 4.902 4.417 ( 5.956 11.643 -2.735) 13.361 4.911 ( 1.645 -3.411 -6.091) 7.172 5.197 ( -1.026 8.145 0.407) 8.220 5.563 ( -12.001 3.236 0.839) 12.457 5.899 ( -2.981 0.033 1.231) 3.225 6.159 ( 0.714 -2.590 -1.336) 3.001 6.233 ( 2.972 0.626 -0.836) 3.150 6.429 ( -0.374 4.401 -0.462) 4.441 6.933 ( 3.675 -0.315 3.534) 5.109 7.144 ( 2.961 -1.225 -1.378) 3.488 7.242 ( -4.260 2.283 0.121) 4.835 7.351 ( 9.650 0.635 -4.113) 10.509 7.811 ( 7.072 -1.164 -2.409) 7.562 7.957 ( -1.750 1.439 0.567) 2.335 8.172 ( 10.101 6.498 2.726) 12.316 8.457 ( -3.756 4.551 6.935) 9.106 8.827 ( -9.626 6.883 -1.956) 11.994 8.876 ( 6.308 2.129 -3.925) 7.728 10.902 ( 1.303 -7.509 0.640) 7.648 11.697 ( -26.110 -15.978 -1.367) 30.641 12.604 ( 9.916 -2.229 0.266) 10.166 13.014 ( -3.368 -6.741 0.371) 7.545 15.158 ( 32.596 22.553 1.039) 39.651 15.997 ( 33.603 19.304 2.111) 38.810 16.784 ( -16.642 13.500 -7.905) 22.841 16.892 ( -2.447 4.122 2.420) 5.370 26.860 ( -0.564 -0.404 0.761) 1.030 26.871 ( -0.085 -0.420 -0.056) 0.432 26.959 ( 0.987 -0.866 -0.281) 1.343 27.010 ( -1.160 -0.829 -0.747) 1.609 27.990 ( -0.317 0.089 0.740) 0.809 28.108 ( -0.503 0.114 -0.917) 1.052 33.686 ( -0.882 -1.128 1.492) 2.068 33.987 ( 0.710 -0.007 -3.116) 3.196 34.555 ( 2.144 2.956 1.174) 3.835 34.820 ( 1.243 4.643 0.181) 4.810 35.527 ( -0.181 3.865 3.220) 5.034 35.830 ( 1.180 -0.396 -2.623) 2.903 37.222 ( 0.455 -0.829 -0.435) 1.041 37.290 ( -1.447 -1.965 0.216) 2.449 43.837 ( 29.219 21.351 0.710) 36.196 44.222 ( 11.008 11.691 -1.749) 16.153 44.758 ( 9.079 3.542 0.405) 9.754 45.281 ( -1.150 2.823 -3.106) 4.352 45.555 ( 0.594 1.925 2.850) 3.490 46.328 ( -6.281 4.152 -7.234) 10.441 46.748 ( 15.925 9.354 11.623) 21.822 47.864 ( 7.159 2.762 -3.241) 8.330 50.350 ( 10.216 12.897 0.578) 16.463 50.990 ( -6.645 23.657 -1.095) 24.598 51.514 ( 53.614 16.471 -1.354) 56.104 53.938 ( -8.131 -13.808 -1.810) 16.126 60.283 ( -35.290 1.163 6.770) 35.952 61.607 ( -57.844 -9.921 -8.988) 59.373 67.330 ( 5.561 -11.668 18.730) 22.757 69.817 ( 24.077 11.576 -27.813) 38.565 ======================= Grid point 163 (71/204) ======================= q-point: (-0.36 0.27 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.190 ( 0.510 9.715 2.961) 10.169 2.584 ( 2.993 6.641 2.498) 7.701 2.878 ( 4.187 -4.160 -1.071) 5.999 3.107 ( -4.512 4.448 6.077) 8.779 3.219 ( 3.162 1.898 0.950) 3.808 3.437 ( -5.446 -7.710 -6.938) 11.714 3.555 ( 2.807 -6.010 5.034) 8.327 3.956 ( 1.332 2.622 0.502) 2.984 4.088 ( -6.656 4.317 2.087) 8.204 4.254 ( 2.845 4.337 0.499) 5.211 4.385 ( 11.397 6.829 -3.788) 13.816 4.960 ( 0.154 -1.940 -6.653) 6.932 5.071 ( -0.912 7.672 0.992) 7.790 5.331 ( -13.771 6.395 0.475) 15.191 5.869 ( -1.520 0.943 2.542) 3.109 6.194 ( -0.320 -1.883 -2.198) 2.911 6.264 ( 3.253 -0.258 0.042) 3.263 6.350 ( -1.492 4.537 -0.566) 4.810 6.924 ( -2.126 3.510 3.650) 5.492 7.150 ( 2.767 4.206 -3.643) 6.214 7.194 ( -1.281 -2.521 1.388) 3.150 7.443 ( 10.020 1.754 -3.575) 10.782 7.804 ( -4.747 2.481 2.685) 5.991 7.967 ( 6.500 1.238 -4.678) 8.103 8.165 ( 5.627 8.083 3.880) 10.586 8.348 ( -5.128 4.667 4.904) 8.492 8.563 ( -11.693 7.533 -0.465) 13.917 8.896 ( 3.793 1.565 -3.321) 5.279 11.155 ( 11.616 -12.847 0.661) 17.332 11.673 ( -21.067 -16.579 -2.124) 26.892 12.790 ( 10.391 -5.178 0.825) 11.639 13.103 ( -2.436 -9.805 -0.222) 10.106 15.187 ( 32.960 21.836 0.086) 39.537 16.001 ( 15.859 28.374 4.387) 32.800 16.288 ( -11.926 16.916 -7.224) 21.922 16.682 ( -15.631 10.335 0.723) 18.753 26.860 ( -0.517 -0.266 0.649) 0.871 26.878 ( 0.082 -0.533 0.085) 0.546 26.974 ( 0.535 0.116 -0.226) 0.592 27.014 ( -0.672 -1.503 -0.761) 1.814 27.990 ( -0.107 -0.261 0.735) 0.787 28.104 ( -0.121 -0.318 -0.883) 0.946 33.703 ( -0.346 -1.585 1.411) 2.150 33.990 ( 0.627 -0.405 -3.169) 3.256 34.525 ( 1.227 3.954 1.792) 4.511 34.738 ( -0.264 6.508 -0.511) 6.533 35.467 ( -0.649 4.206 3.480) 5.497 35.841 ( 0.942 -0.289 -2.569) 2.751 37.242 ( 0.689 -0.990 -0.212) 1.225 37.303 ( -1.202 -1.625 -0.133) 2.026 43.820 ( 22.270 21.144 3.008) 30.856 44.137 ( 7.208 11.663 -3.661) 14.191 44.813 ( 10.382 5.003 2.063) 11.707 45.142 ( -9.480 5.965 -2.625) 11.504 45.501 ( -1.566 5.146 1.762) 5.661 46.107 ( -4.594 11.975 -10.294) 16.446 46.716 ( 3.853 13.956 16.088) 21.643 47.852 ( 3.600 5.326 -4.635) 7.925 50.248 ( 9.325 15.403 -0.471) 18.011 50.524 ( -12.745 17.801 1.256) 21.929 51.841 ( 49.728 20.894 2.656) 54.004 53.821 ( -31.867 -4.569 -13.298) 34.831 60.176 ( 3.979 -10.024 3.693) 11.400 61.158 ( -49.924 -12.353 -3.865) 51.575 67.558 ( 1.070 -7.257 16.390) 17.956 69.788 ( 16.318 14.572 -20.952) 30.293 ======================= Grid point 164 (72/204) ======================= q-point: (-0.27 0.27 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.045 ( 1.417 12.439 7.281) 14.483 2.446 ( 0.272 12.369 2.765) 12.677 2.906 ( 0.926 9.147 -1.464) 9.310 3.011 ( 2.842 2.313 -2.625) 4.507 3.221 ( -5.106 -1.485 1.302) 5.474 3.450 ( -7.064 -1.534 -1.863) 7.465 3.609 ( 3.515 1.741 1.476) 4.191 3.961 ( 2.018 -0.972 0.352) 2.268 4.052 ( -4.220 -4.176 2.889) 6.602 4.254 ( 1.577 -1.218 0.837) 2.161 4.403 ( 9.798 6.073 -1.536) 11.629 4.734 ( -10.563 16.316 -2.140) 19.555 5.070 ( 3.947 -3.337 -3.690) 6.351 5.190 ( 0.280 1.863 0.533) 1.958 5.840 ( -1.039 2.285 2.133) 3.294 6.172 ( 0.417 6.562 -2.470) 7.024 6.283 ( 0.075 -1.894 -0.264) 1.914 6.318 ( -0.028 -2.588 -0.346) 2.611 6.838 ( -3.402 3.480 2.210) 5.344 7.127 ( 3.729 3.461 -2.541) 5.687 7.222 ( 1.380 -0.187 1.806) 2.281 7.487 ( 5.572 3.287 -2.955) 7.112 7.700 ( -5.385 3.660 2.644) 7.028 7.996 ( 5.542 2.910 -3.624) 7.233 8.010 ( -10.249 7.569 2.765) 13.038 8.275 ( 2.947 3.429 0.985) 4.628 8.425 ( -0.221 2.952 3.182) 4.346 8.896 ( 1.124 1.112 -2.968) 3.363 11.445 ( -1.029 -12.932 1.441) 13.052 11.781 ( 0.265 -16.599 -3.823) 17.036 12.943 ( 2.150 -4.267 2.913) 5.596 13.262 ( -2.275 -13.093 -2.103) 13.454 15.187 ( -0.208 18.051 0.175) 18.053 15.342 ( -0.451 38.686 -1.456) 38.716 16.059 ( -4.911 24.228 1.675) 24.778 16.376 ( 6.643 10.732 -2.727) 12.913 26.860 ( -0.317 -0.089 0.576) 0.663 26.890 ( 0.317 -0.683 0.227) 0.787 26.970 ( -0.199 0.382 -0.157) 0.458 27.033 ( 0.316 -1.184 -0.876) 1.507 27.998 ( -0.136 -0.647 0.758) 1.006 28.111 ( 0.170 -0.888 -0.916) 1.287 33.731 ( -0.250 -1.947 1.330) 2.371 33.999 ( 0.636 -0.889 -3.118) 3.304 34.468 ( -0.059 4.991 1.906) 5.343 34.623 ( -0.282 7.580 -0.775) 7.624 35.404 ( -0.852 3.903 3.855) 5.552 35.848 ( 0.673 -0.237 -2.838) 2.926 37.265 ( 0.595 -1.003 0.173) 1.179 37.309 ( -0.518 -0.487 -0.402) 0.817 43.591 ( -5.808 24.709 3.316) 25.598 44.047 ( 16.949 15.616 -2.481) 23.179 44.704 ( -12.610 11.418 1.841) 17.110 45.033 ( 6.325 1.216 -0.981) 6.515 45.379 ( -2.778 7.299 -0.040) 7.809 45.855 ( 2.098 15.537 -12.319) 19.939 46.490 ( -7.827 16.813 18.470) 26.174 47.770 ( 2.101 7.570 -5.807) 9.769 50.057 ( 1.920 15.347 1.701) 15.560 50.282 ( -2.778 4.384 -0.884) 5.265 51.745 ( -10.740 28.299 5.671) 30.795 53.647 ( 16.963 -2.683 -26.215) 31.340 60.564 ( -0.005 -20.730 2.730) 20.909 60.929 ( -1.244 -8.952 -2.111) 9.281 67.642 ( -5.936 -2.351 13.862) 15.262 69.632 ( 7.487 17.677 -15.528) 24.691 ======================= Grid point 165 (73/204) ======================= q-point: (-0.18 0.27 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.868 ( 2.461 16.081 9.192) 18.685 2.242 ( 1.526 17.642 4.047) 18.164 2.720 ( -3.738 9.517 -4.800) 11.295 2.976 ( 1.447 5.492 -9.450) 11.025 3.180 ( -3.593 0.655 2.646) 4.510 3.304 ( -3.123 8.881 0.970) 9.463 3.662 ( 6.036 1.212 4.518) 7.636 3.867 ( -17.298 4.587 1.482) 17.957 4.082 ( 2.009 -4.302 -1.515) 4.984 4.351 ( 2.365 -5.275 1.558) 5.987 4.422 ( 3.476 -1.331 3.591) 5.172 4.524 ( 11.225 8.515 -4.597) 14.820 5.160 ( 13.151 3.747 0.384) 13.679 5.249 ( 0.108 -8.645 -3.299) 9.254 5.755 ( -4.685 6.136 1.192) 7.811 6.036 ( -0.810 8.000 -1.969) 8.279 6.319 ( -0.203 -0.380 -1.285) 1.356 6.398 ( 3.799 -6.382 -0.860) 7.477 6.757 ( -3.512 2.485 1.401) 4.525 7.110 ( 2.685 2.383 -1.597) 3.929 7.221 ( -0.971 2.279 2.696) 3.661 7.449 ( -0.180 4.983 0.095) 4.988 7.612 ( -0.105 3.166 0.454) 3.200 7.838 ( -6.440 1.605 -0.353) 6.647 7.986 ( 3.706 4.129 -0.942) 5.627 8.282 ( 2.929 0.896 1.509) 3.414 8.434 ( 6.572 2.312 2.483) 7.396 8.872 ( -1.148 1.155 -3.168) 3.562 11.549 ( -13.451 -13.815 0.370) 19.285 12.133 ( 18.219 -13.576 -3.876) 23.049 12.962 ( -8.295 2.115 5.554) 10.204 13.321 ( -20.107 -7.506 -5.038) 22.046 14.401 ( -29.040 23.095 -0.617) 37.109 15.178 ( -3.957 24.329 5.826) 25.328 15.541 ( 12.729 28.282 -6.169) 31.622 16.428 ( 27.139 11.379 -1.888) 29.489 26.860 ( 0.041 0.016 0.525) 0.526 26.905 ( 0.039 -0.633 0.429) 0.766 26.963 ( 0.148 0.278 -0.217) 0.383 27.049 ( 0.606 -0.404 -1.008) 1.244 28.010 ( -0.345 -0.995 0.795) 1.320 28.130 ( 0.260 -1.411 -0.981) 1.738 33.757 ( -1.068 -1.839 1.168) 2.427 34.019 ( 0.792 -1.448 -2.874) 3.314 34.382 ( -0.991 5.631 1.265) 5.856 34.512 ( 1.665 7.235 -0.375) 7.434 35.353 ( -0.487 2.809 4.424) 5.263 35.849 ( 0.358 -0.107 -3.508) 3.527 37.281 ( -0.297 -0.381 0.296) 0.567 37.305 ( 0.864 0.931 -0.236) 1.292 43.022 ( -20.238 25.906 1.973) 32.933 43.998 ( 14.396 18.265 6.669) 24.194 44.254 ( -24.666 19.044 -5.802) 31.698 45.126 ( 10.139 1.083 -0.591) 10.214 45.233 ( -1.956 7.593 -1.523) 7.988 45.604 ( 1.580 15.496 -8.639) 17.811 46.205 ( -5.029 12.194 12.255) 18.005 47.653 ( 2.575 9.110 -5.727) 11.064 49.893 ( -2.113 7.741 2.993) 8.564 50.232 ( 1.971 2.026 -2.864) 4.024 50.988 ( -36.317 23.645 -1.182) 43.352 54.120 ( 59.170 -2.576 -27.255) 65.196 60.597 ( -20.424 -16.325 1.783) 26.207 61.550 ( 58.055 -12.841 -4.951) 59.664 67.561 ( -14.501 1.694 11.548) 18.615 69.351 ( -0.689 19.357 -11.251) 22.400 ======================= Grid point 166 (74/204) ======================= q-point: (-0.09 0.27 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.665 ( 6.014 18.488 7.914) 20.991 1.926 ( -1.742 24.467 7.020) 25.514 2.547 ( -1.920 5.585 -9.596) 11.268 2.827 ( -2.135 8.813 -11.948) 14.999 3.129 ( 7.866 10.442 7.959) 15.306 3.211 ( 3.166 2.574 -0.424) 4.102 3.640 ( -0.939 1.695 1.822) 2.660 3.781 ( -0.692 -3.954 7.215) 8.256 4.136 ( 1.501 0.177 -3.479) 3.793 4.407 ( -0.156 -1.521 3.243) 3.585 4.561 ( 9.145 -4.617 1.989) 10.436 4.603 ( 6.344 -3.739 -3.465) 8.138 5.291 ( 18.196 2.519 2.042) 18.482 5.362 ( -1.969 -5.830 -5.387) 8.178 5.576 ( -5.951 5.814 -0.353) 8.327 5.928 ( 0.907 5.894 -1.555) 6.162 6.284 ( 0.423 4.321 -1.434) 4.572 6.563 ( 4.060 -8.580 -0.750) 9.522 6.709 ( -1.989 -0.559 0.910) 2.258 7.110 ( 0.689 1.311 -2.747) 3.121 7.145 ( -3.321 2.919 4.605) 6.384 7.343 ( -3.965 5.723 2.853) 7.525 7.610 ( 6.262 2.629 -2.871) 7.373 7.802 ( -1.766 -2.240 -1.267) 3.121 7.972 ( 5.461 3.352 1.130) 6.507 8.308 ( 1.434 -0.148 2.623) 2.993 8.496 ( 9.138 2.187 1.342) 9.492 8.812 ( -3.665 2.417 -3.750) 5.774 11.600 ( -14.047 -12.930 -0.962) 19.116 12.378 ( -16.870 13.118 0.902) 21.389 12.665 ( 8.783 -2.146 -2.053) 9.272 13.201 ( -18.035 -12.261 -0.448) 21.812 14.078 ( -6.290 1.532 0.051) 6.474 14.460 ( -34.587 28.690 3.425) 45.068 15.516 ( 41.083 24.530 -5.958) 48.219 16.594 ( 30.239 8.445 -3.906) 31.638 26.863 ( 0.430 0.010 0.396) 0.585 26.908 ( -0.854 -0.158 0.647) 1.082 26.965 ( 0.667 0.188 -0.374) 0.788 27.053 ( 0.572 0.340 -1.105) 1.290 28.023 ( -0.662 -1.217 0.825) 1.612 28.153 ( 0.042 -1.653 -1.046) 1.957 33.765 ( -2.213 -1.225 0.924) 2.693 34.036 ( -0.351 -0.628 -2.193) 2.309 34.305 ( 1.357 3.727 -0.049) 3.966 34.449 ( 4.672 5.322 0.351) 7.090 35.337 ( 0.881 0.832 5.028) 5.172 35.842 ( 0.120 0.192 -4.440) 4.446 37.263 ( -0.147 2.042 0.513) 2.110 37.306 ( 1.061 0.800 -0.113) 1.333 42.499 ( -10.678 18.140 2.468) 21.194 43.352 ( -46.129 25.353 3.276) 52.739 44.039 ( 26.992 19.665 -5.725) 33.883 45.109 ( 0.760 6.933 -2.328) 7.352 45.174 ( 6.034 4.347 -1.654) 7.619 45.480 ( 6.657 3.750 -2.995) 8.207 46.077 ( 5.523 8.983 3.202) 11.021 47.524 ( 3.185 10.386 -4.353) 11.703 49.733 ( -7.095 7.424 1.944) 10.452 50.238 ( 5.015 1.435 -4.263) 6.737 50.451 ( -12.003 8.801 -1.157) 14.929 54.680 ( 40.577 0.799 -26.574) 48.510 60.824 ( 16.047 -17.802 2.010) 24.051 62.423 ( 67.168 -12.520 -19.483) 71.048 67.334 ( -21.974 3.561 9.490) 24.199 68.996 ( -5.206 18.615 -8.375) 21.065 ======================= Grid point 171 (75/204) ======================= q-point: ( 0.36 0.36 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.207 ( 7.828 0.000 4.018) 8.799 2.367 ( 18.132 0.000 3.802) 18.527 2.594 ( 3.233 0.000 -8.190) 8.805 2.899 ( 6.942 0.000 -6.984) 9.847 3.261 ( -0.171 -0.000 1.683) 1.692 3.444 ( -9.602 -0.000 12.031) 15.393 3.456 ( -0.247 -0.000 5.601) 5.606 4.112 ( -1.099 -0.000 2.811) 3.019 4.210 ( 7.684 0.000 -4.927) 9.128 4.496 ( -9.939 -0.000 5.005) 11.128 4.810 ( -1.427 -0.000 -0.928) 1.702 4.863 ( -2.914 -0.000 -6.064) 6.728 5.547 ( 0.132 0.000 0.554) 0.569 5.607 ( -4.846 -0.000 -2.188) 5.317 5.975 ( -6.260 -0.000 0.865) 6.320 6.011 ( 5.471 0.000 -4.813) 7.287 6.316 ( 2.409 0.000 -1.078) 2.639 6.559 ( -2.205 -0.000 -1.451) 2.640 6.695 ( 9.846 0.000 5.753) 11.404 7.110 ( 2.578 0.000 2.296) 3.452 7.219 ( 6.397 0.000 -1.213) 6.511 7.281 ( 8.078 0.000 -4.978) 9.489 7.608 ( 11.059 0.000 -4.328) 11.876 8.020 ( -4.732 -0.000 4.630) 6.620 8.244 ( 20.674 0.000 0.849) 20.691 8.550 ( 1.520 0.000 6.432) 6.609 8.806 ( 6.147 0.000 -2.340) 6.577 8.954 ( 7.663 0.000 -4.327) 8.800 11.120 ( -24.632 -0.000 1.691) 24.690 11.443 ( -28.293 -0.000 -1.844) 28.353 12.706 ( -5.202 -0.000 -1.480) 5.408 12.741 ( -2.146 -0.000 2.309) 3.152 15.505 ( 21.407 0.000 5.940) 22.216 16.268 ( 22.770 0.000 -1.817) 22.842 16.620 ( 25.626 0.000 4.223) 25.971 17.196 ( 5.516 0.000 -11.999) 13.206 26.850 ( -0.411 -0.000 0.799) 0.898 26.862 ( 0.183 0.000 -0.323) 0.371 26.915 ( 0.230 0.000 0.157) 0.279 27.004 ( -0.189 -0.000 -1.110) 1.126 28.002 ( -0.867 -0.000 0.838) 1.206 28.128 ( -1.043 -0.000 -1.150) 1.553 33.669 ( -1.685 -0.000 1.806) 2.470 33.997 ( 0.382 0.000 -3.242) 3.264 34.596 ( 2.750 0.000 0.091) 2.752 34.888 ( 4.151 0.000 1.315) 4.354 35.621 ( 0.526 0.000 2.639) 2.691 35.800 ( 2.008 0.000 -2.803) 3.448 37.221 ( -1.180 -0.000 1.313) 1.765 37.229 ( -0.091 -0.000 -0.990) 0.995 44.262 ( 12.486 0.000 2.427) 12.720 44.537 ( 15.936 0.000 0.644) 15.949 44.674 ( 3.855 0.000 -9.324) 10.089 45.351 ( 13.505 0.000 1.294) 13.567 45.560 ( 7.271 0.000 -0.593) 7.295 45.958 ( 15.773 0.000 9.100) 18.210 46.853 ( 16.086 0.000 -3.634) 16.492 47.786 ( 15.041 0.000 -1.795) 15.148 50.582 ( 12.339 0.000 5.532) 13.522 51.126 ( 30.229 0.000 -9.779) 31.771 51.996 ( 44.906 0.000 -6.858) 45.426 53.298 ( 1.017 0.000 7.734) 7.800 60.903 ( -54.459 -0.000 18.694) 57.578 62.179 ( -60.814 -0.000 -25.962) 66.124 66.749 ( 4.261 0.000 23.259) 23.646 69.894 ( 30.262 0.000 -42.077) 51.830 ======================= Grid point 172 (76/204) ======================= q-point: ( 0.45 0.36 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.329 ( 9.024 -2.788 4.487) 10.456 2.523 ( 7.104 3.254 -0.656) 7.841 2.620 ( 4.808 -3.066 -2.094) 6.074 2.988 ( 4.030 -5.420 -7.487) 10.083 3.227 ( -7.039 -0.836 4.588) 8.444 3.398 ( 0.012 2.197 8.637) 8.912 3.441 ( -3.142 1.325 5.075) 6.114 4.096 ( 0.336 2.141 2.608) 3.390 4.296 ( 8.839 0.095 -5.481) 10.401 4.390 ( -9.373 1.068 4.289) 10.363 4.736 ( -3.224 5.844 0.333) 6.683 4.834 ( 0.483 -1.218 -6.836) 6.960 5.450 ( -1.309 6.837 -0.792) 7.006 5.585 ( -6.907 -1.755 -0.667) 7.158 5.899 ( -4.987 0.602 1.020) 5.126 6.081 ( 4.556 -1.605 -4.556) 6.640 6.309 ( 1.995 2.926 0.116) 3.543 6.524 ( -1.045 1.410 -1.759) 2.485 6.841 ( 6.816 -3.805 5.203) 9.381 7.113 ( -2.496 -0.295 3.693) 4.467 7.298 ( 6.065 0.205 -1.605) 6.277 7.347 ( 7.047 0.306 -6.265) 9.434 7.760 ( 14.488 -1.366 -5.800) 15.665 7.972 ( -5.577 -0.124 4.638) 7.255 8.418 ( 18.937 7.664 2.307) 20.559 8.555 ( -2.441 1.256 7.250) 7.753 8.889 ( 5.555 -1.646 -2.647) 6.370 8.988 ( 2.921 3.042 -4.104) 5.885 10.833 ( -15.394 2.852 1.406) 15.719 11.249 ( -25.120 -11.768 -1.685) 27.791 12.619 ( 1.728 3.030 -0.060) 3.489 12.797 ( -4.250 -6.611 0.695) 7.890 15.651 ( 16.790 8.516 4.805) 19.430 16.416 ( 19.878 7.732 -1.617) 21.390 16.876 ( 11.522 -0.987 2.309) 11.792 17.173 ( 2.327 6.944 -7.910) 10.780 26.849 ( -0.388 -0.207 0.690) 0.818 26.864 ( 0.174 -0.043 -0.189) 0.260 26.925 ( 0.348 -0.889 0.056) 0.956 27.000 ( -0.281 -0.062 -0.958) 1.001 27.994 ( -0.603 0.127 0.804) 1.013 28.114 ( -0.655 0.175 -1.032) 1.235 33.660 ( -1.259 -0.473 1.797) 2.245 33.992 ( 0.433 0.172 -3.346) 3.378 34.617 ( 2.260 1.034 1.208) 2.763 34.915 ( 2.218 1.536 0.382) 2.725 35.616 ( -0.053 1.667 2.460) 2.972 35.819 ( 1.745 -0.301 -2.333) 2.929 37.209 ( -0.390 -0.053 0.197) 0.440 37.237 ( -0.785 -1.156 -0.231) 1.417 44.310 ( 9.910 7.274 1.438) 12.377 44.533 ( 4.986 10.418 -1.400) 11.634 44.804 ( 9.630 -4.275 -3.234) 11.022 45.394 ( 5.506 5.052 -1.316) 7.587 45.625 ( 7.967 3.908 2.401) 9.193 46.204 ( 5.007 -8.204 3.111) 10.102 46.976 ( 13.546 4.041 1.627) 14.229 47.917 ( 9.685 0.787 -2.751) 10.099 50.667 ( 9.249 6.374 4.847) 12.234 51.407 ( 22.470 3.715 -11.231) 25.393 52.255 ( 44.805 24.832 -1.720) 51.256 53.486 ( 2.976 -13.912 5.561) 15.275 60.341 ( -47.920 1.156 13.842) 49.893 61.483 ( -51.573 0.382 -17.922) 54.600 66.926 ( 2.138 -10.354 23.608) 25.867 70.073 ( 24.589 4.529 -35.346) 43.295 ======================= Grid point 173 (77/204) ======================= q-point: ( 0.55 0.36 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.448 ( 2.705 7.237 0.019) 7.726 2.538 ( 7.490 -8.111 3.029) 11.448 2.724 ( 1.800 -2.026 2.015) 3.377 3.083 ( -2.841 -5.376 -1.809) 6.344 3.206 ( -1.744 -4.023 0.299) 4.395 3.372 ( -5.263 2.762 3.054) 6.682 3.411 ( 3.541 0.197 5.130) 6.237 4.074 ( 2.654 3.669 2.537) 5.191 4.262 ( -8.021 3.777 2.886) 9.324 4.353 ( 5.454 2.855 -4.316) 7.518 4.616 ( 0.555 6.484 0.072) 6.508 4.861 ( 0.908 -2.999 -6.986) 7.656 5.344 ( 3.472 7.864 -0.640) 8.620 5.484 ( -9.615 2.863 0.050) 10.033 5.857 ( -3.371 -0.778 1.565) 3.797 6.130 ( 2.626 -0.932 -3.845) 4.749 6.286 ( 0.625 2.220 1.294) 2.645 6.489 ( 0.850 2.459 -2.531) 3.630 6.957 ( 1.725 -2.094 4.706) 5.432 7.098 ( -3.494 -2.146 2.842) 4.989 7.298 ( 3.427 4.515 -2.753) 6.302 7.435 ( 7.739 -1.607 -5.196) 9.459 7.854 ( -1.194 1.317 1.255) 2.176 7.975 ( 7.353 -0.914 -3.123) 8.040 8.443 ( 2.433 6.941 6.379) 9.736 8.506 ( 5.397 7.353 4.383) 10.119 8.826 ( -9.250 7.819 -2.219) 12.314 8.969 ( 4.979 2.560 -3.530) 6.619 10.809 ( 2.888 -8.448 1.023) 8.986 11.191 ( -20.121 -14.122 -1.759) 24.645 12.668 ( 7.296 -2.281 0.130) 7.646 12.840 ( -6.457 -6.965 0.357) 9.504 15.683 ( 13.669 10.557 3.713) 17.666 16.507 ( 16.789 6.672 -2.507) 18.239 16.836 ( -4.860 13.080 -2.515) 14.178 17.011 ( -0.064 12.805 -0.585) 12.819 26.850 ( -0.411 -0.309 0.588) 0.781 26.866 ( 0.071 -0.172 -0.000) 0.186 26.950 ( 0.629 -1.572 -0.167) 1.702 26.993 ( -0.470 0.145 -0.745) 0.893 27.989 ( -0.315 0.092 0.772) 0.839 28.104 ( -0.200 0.198 -0.935) 0.976 33.664 ( -0.754 -0.942 1.733) 2.112 33.987 ( 0.514 0.088 -3.411) 3.450 34.620 ( 1.669 2.098 2.100) 3.406 34.892 ( 0.321 3.368 -0.483) 3.418 35.583 ( -0.535 2.976 2.509) 3.929 35.835 ( 1.379 -0.178 -2.017) 2.450 37.217 ( 0.593 -0.790 -0.286) 1.028 37.244 ( -1.383 -1.520 -0.048) 2.055 44.316 ( 13.060 9.065 1.412) 15.960 44.395 ( -2.101 8.855 -0.729) 9.130 44.945 ( 10.997 0.343 -1.643) 11.125 45.335 ( -0.210 6.580 -2.404) 7.009 45.634 ( 4.294 4.947 3.347) 7.356 46.260 ( -5.503 -0.548 -2.619) 6.119 47.042 ( 9.058 6.285 7.379) 13.267 47.964 ( 4.375 2.236 -3.737) 6.172 50.629 ( 5.671 10.156 3.248) 12.077 51.307 ( 1.514 23.812 -7.176) 24.916 52.444 ( 51.069 19.573 0.872) 54.698 53.616 ( -17.041 -8.152 -0.261) 18.892 59.968 ( -22.506 -4.203 8.714) 24.498 60.964 ( -33.263 -0.134 -10.107) 34.765 67.185 ( -1.730 -14.911 21.047) 25.852 70.144 ( 18.653 8.210 -28.245) 34.830 ======================= Grid point 174 (78/204) ======================= q-point: (-0.36 0.36 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.347 ( 1.060 7.498 2.458) 7.962 2.698 ( -1.689 3.971 2.262) 4.872 2.806 ( 8.663 -10.527 4.487) 14.352 3.083 ( -5.387 -1.320 2.418) 6.051 3.246 ( -8.823 2.841 0.060) 9.269 3.279 ( -0.445 -4.631 -2.835) 5.448 3.517 ( 5.619 -5.542 1.502) 8.034 4.046 ( 1.440 4.129 2.162) 4.878 4.115 ( -3.202 7.061 1.585) 7.914 4.313 ( 0.533 4.518 -1.399) 4.759 4.564 ( 2.714 3.722 -1.166) 4.751 4.904 ( 0.863 -3.159 -7.260) 7.964 5.230 ( -5.172 11.376 -0.143) 12.497 5.343 ( 4.051 5.174 0.329) 6.580 5.848 ( -1.781 -0.953 2.065) 2.888 6.162 ( 1.786 -1.401 -2.787) 3.595 6.262 ( -1.766 0.349 1.554) 2.378 6.444 ( 1.404 4.847 -2.430) 5.600 6.935 ( -4.302 2.161 2.597) 5.470 7.139 ( -0.460 -3.658 1.933) 4.163 7.269 ( 5.722 4.521 -0.590) 7.316 7.519 ( 5.007 -1.105 -4.979) 7.147 7.781 ( -5.913 1.782 1.911) 6.465 8.060 ( 8.402 1.497 -4.901) 9.842 8.292 ( -11.871 8.299 5.133) 15.367 8.431 ( -2.545 7.560 4.928) 9.376 8.619 ( 4.668 9.294 -0.960) 10.444 8.958 ( 2.102 2.988 -2.638) 4.506 11.039 ( -2.521 -13.461 1.064) 13.736 11.275 ( 2.115 -15.536 -2.418) 15.864 12.796 ( 0.986 -4.270 1.028) 4.501 12.903 ( -1.159 -9.858 -0.564) 9.942 15.630 ( 0.971 10.929 3.601) 11.547 16.361 ( -14.092 21.604 -9.227) 27.394 16.629 ( 20.091 12.735 2.129) 23.882 16.746 ( -6.327 17.316 1.732) 18.517 26.852 ( -0.360 -0.332 0.483) 0.687 26.872 ( 0.145 -0.438 0.178) 0.494 26.980 ( -1.116 -0.975 -0.531) 1.575 26.986 ( 1.440 -0.497 -0.383) 1.571 27.988 ( -0.153 -0.057 0.756) 0.773 28.100 ( 0.218 0.047 -0.890) 0.918 33.680 ( -0.304 -1.366 1.626) 2.145 33.985 ( 0.485 -0.126 -3.394) 3.431 34.598 ( 0.808 3.316 2.623) 4.305 34.820 ( -0.952 5.052 -1.134) 5.264 35.528 ( -0.956 3.811 2.756) 4.799 35.846 ( 1.131 -0.001 -1.925) 2.233 37.238 ( 0.808 -0.639 -0.135) 1.039 37.257 ( -1.063 -2.346 -0.354) 2.600 44.167 ( -7.083 13.861 0.743) 15.584 44.357 ( 10.942 5.626 1.121) 12.355 44.990 ( -2.349 5.631 -1.093) 6.199 45.193 ( 2.983 7.706 -1.707) 8.438 45.577 ( -0.170 6.522 2.846) 7.118 46.154 ( -3.606 4.207 -6.942) 8.882 46.982 ( -0.219 12.213 11.427) 16.726 47.934 ( 0.300 3.506 -4.537) 5.742 50.511 ( -0.374 9.951 1.776) 10.115 50.832 ( 0.577 32.367 -2.740) 32.488 52.537 ( -2.135 22.182 4.565) 22.747 53.494 ( 1.828 -5.933 -9.983) 11.756 60.014 ( -5.008 -14.377 5.547) 16.204 60.766 ( 6.412 -0.733 -5.067) 8.205 67.403 ( -7.024 -13.037 17.102) 22.623 70.098 ( 11.083 12.229 -21.790) 27.335 ======================= Grid point 175 (79/204) ======================= q-point: (-0.27 0.36 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.259 ( 3.275 9.171 6.478) 11.696 2.598 ( -1.251 6.123 2.901) 6.890 3.003 ( -3.374 0.901 -1.714) 3.890 3.038 ( 1.130 5.356 -4.875) 7.330 3.088 ( -7.621 -5.899 4.621) 10.688 3.325 ( -5.428 -4.504 1.814) 7.283 3.667 ( 6.835 -3.615 -0.018) 7.732 3.985 ( -4.967 2.325 2.839) 6.176 4.034 ( 5.812 4.326 -0.958) 7.308 4.245 ( -2.459 2.348 -0.195) 3.406 4.514 ( -1.736 4.229 1.746) 4.894 4.857 ( -3.815 8.247 -8.382) 12.362 5.052 ( 0.717 -0.077 -1.324) 1.508 5.378 ( 15.455 6.701 1.495) 16.912 5.841 ( -1.836 0.338 1.559) 2.433 6.203 ( 1.698 -0.318 -1.986) 2.632 6.237 ( -3.988 -1.704 -0.599) 4.378 6.371 ( 2.082 5.068 0.101) 5.480 6.860 ( -2.320 3.014 0.499) 3.836 7.169 ( 0.280 -0.350 0.155) 0.474 7.278 ( 2.884 2.434 2.681) 4.629 7.545 ( 0.475 0.989 -2.895) 3.096 7.698 ( -2.787 2.136 -0.526) 3.551 7.997 ( -13.245 8.334 0.704) 15.665 8.088 ( 4.348 2.917 -3.065) 6.067 8.327 ( -4.018 2.223 6.469) 7.933 8.602 ( 13.339 8.463 -0.048) 15.798 8.919 ( -0.599 2.295 -2.232) 3.257 11.132 ( -12.673 -13.279 -0.074) 18.356 11.677 ( 21.294 -15.746 -1.942) 26.555 12.819 ( -9.818 -6.610 1.832) 11.977 13.075 ( 1.595 -8.509 -1.227) 8.744 15.206 ( -34.454 23.023 0.702) 41.444 15.877 ( -10.645 21.488 -1.188) 24.010 16.355 ( 5.615 24.430 -2.865) 25.230 16.727 ( 19.669 8.376 1.520) 21.432 26.855 ( -0.186 -0.301 0.377) 0.517 26.884 ( 0.313 -0.665 0.373) 0.824 26.971 ( -0.544 0.116 -0.379) 0.674 27.019 ( 1.192 -1.342 -0.588) 1.889 27.991 ( -0.181 -0.272 0.745) 0.813 28.104 ( 0.504 -0.280 -0.881) 1.053 33.704 ( -0.200 -1.580 1.448) 2.153 33.987 ( 0.445 -0.548 -3.243) 3.319 34.546 ( -0.463 4.687 2.586) 5.373 34.720 ( -0.869 5.951 -1.282) 6.149 35.462 ( -1.284 3.975 3.169) 5.244 35.851 ( 0.940 0.182 -2.147) 2.350 37.254 ( -0.163 -1.079 0.255) 1.121 37.288 ( 0.501 -1.821 -0.715) 2.020 43.747 ( -22.680 20.340 0.169) 30.465 44.383 ( 7.269 7.248 5.558) 11.673 44.683 ( -18.309 11.043 -3.377) 21.647 45.236 ( 14.634 4.165 0.006) 15.215 45.453 ( -2.845 7.523 0.953) 8.099 46.037 ( 2.289 8.532 -11.525) 14.521 46.703 ( -10.821 18.621 14.595) 26.016 47.855 ( -1.375 4.275 -4.448) 6.320 50.272 ( -10.104 13.517 0.229) 16.878 50.489 ( 12.060 19.979 0.181) 23.337 51.761 ( -51.278 25.259 -0.239) 57.162 53.896 ( 37.789 -10.834 -10.456) 40.678 60.152 ( -5.836 -12.123 2.851) 13.753 61.198 ( 53.347 -8.598 -2.621) 54.099 67.484 ( -13.523 -7.578 13.068) 20.275 69.907 ( 1.684 16.328 -16.299) 23.132 ======================= Grid point 176 (80/204) ======================= q-point: (-0.18 0.36 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.150 ( 4.072 12.755 8.006) 15.600 2.499 ( 2.644 10.680 4.449) 11.868 2.778 ( -12.021 9.234 -4.295) 15.755 2.934 ( -6.448 -0.136 -9.371) 11.376 3.173 ( 0.399 -2.250 2.239) 3.199 3.322 ( -2.619 -1.381 5.434) 6.188 3.737 ( -4.152 3.021 2.336) 5.641 3.839 ( -0.946 6.667 0.968) 6.803 4.086 ( 7.322 -1.195 -1.542) 7.577 4.270 ( 1.572 -7.417 1.438) 7.717 4.439 ( -0.873 2.778 2.748) 4.004 4.714 ( 2.844 5.894 -6.690) 9.358 5.127 ( 1.831 -5.823 -2.963) 6.785 5.472 ( 18.518 7.075 2.424) 19.971 5.781 ( -3.910 4.253 -0.079) 5.777 6.107 ( -4.314 5.060 -2.615) 7.145 6.293 ( 2.069 -2.898 -1.110) 3.730 6.378 ( 3.497 -1.754 0.812) 3.996 6.785 ( -1.611 4.026 0.160) 4.340 7.166 ( -0.342 1.446 -1.917) 2.426 7.236 ( -2.391 3.046 4.094) 5.635 7.482 ( -5.317 3.196 3.123) 6.946 7.679 ( 4.736 1.139 -2.358) 5.411 7.815 ( -2.458 3.663 -3.185) 5.441 8.066 ( 1.083 2.800 0.462) 3.037 8.298 ( -1.254 -0.159 4.194) 4.380 8.634 ( 13.100 6.883 -0.127) 14.799 8.865 ( -2.780 1.636 -2.388) 4.013 11.198 ( -10.694 -12.634 -0.501) 16.560 12.160 ( 23.979 -13.741 -2.307) 27.733 12.806 ( -13.126 -8.082 3.076) 15.719 13.061 ( -17.236 4.183 -2.518) 17.915 14.407 ( -30.649 22.000 -0.566) 37.732 15.275 ( -34.395 23.835 3.023) 41.956 16.211 ( 28.408 20.911 -4.614) 35.575 16.829 ( 18.588 6.580 0.485) 19.725 26.859 ( 0.098 -0.269 0.273) 0.395 26.898 ( 0.121 -0.517 0.618) 0.815 26.966 ( 0.071 -0.041 -0.321) 0.332 27.047 ( 1.066 -0.769 -0.803) 1.541 27.996 ( -0.345 -0.531 0.731) 0.967 28.116 ( 0.548 -0.695 -0.884) 1.251 33.725 ( -0.769 -1.308 1.147) 1.902 33.999 ( 0.626 -1.239 -2.932) 3.244 34.459 ( -1.397 5.557 1.845) 6.020 34.625 ( 0.630 5.674 -0.714) 5.753 35.399 ( -1.235 3.133 3.787) 5.068 35.851 ( 0.718 0.397 -2.729) 2.850 37.269 ( -0.212 -1.019 0.222) 1.064 37.315 ( 1.020 -0.712 -0.512) 1.345 43.105 ( -28.216 21.599 -0.135) 35.535 44.080 ( -34.752 18.412 7.621) 40.060 44.467 ( 9.361 8.561 -4.253) 13.379 45.305 ( -1.979 7.562 0.063) 7.817 45.338 ( 13.027 3.662 -0.187) 13.533 45.814 ( -4.294 15.694 -9.455) 18.819 46.398 ( 0.529 12.313 9.751) 15.715 47.761 ( -0.967 5.047 -3.235) 6.072 49.985 ( -8.374 10.226 1.084) 13.261 50.385 ( 8.737 10.277 -0.194) 13.491 50.921 ( -29.542 19.733 -3.599) 35.708 54.440 ( 23.815 -14.542 -9.669) 29.532 60.388 ( 19.324 -10.284 2.711) 22.057 62.034 ( 64.725 -12.064 -6.722) 66.182 67.386 ( -20.856 -1.385 9.694) 23.041 69.571 ( -7.058 18.493 -11.773) 23.031 ======================= Grid point 177 (81/204) ======================= q-point: (-0.09 0.36 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.012 ( 6.510 14.602 6.557) 17.280 2.275 ( -1.315 20.750 6.256) 21.712 2.542 ( -7.649 3.100 -8.909) 12.144 2.841 ( -3.376 2.298 -9.101) 9.975 3.189 ( 0.199 1.084 4.620) 4.750 3.375 ( 5.428 -1.210 6.062) 8.227 3.584 ( -4.382 0.021 0.434) 4.404 3.835 ( 3.131 2.825 3.235) 5.315 4.183 ( 6.535 -0.133 -2.743) 7.089 4.396 ( 1.286 -0.874 2.409) 2.867 4.453 ( -0.426 -7.120 -0.535) 7.152 4.695 ( 5.234 0.889 -1.520) 5.523 5.229 ( 0.508 -5.938 -3.881) 7.112 5.506 ( -3.528 5.500 2.385) 6.956 5.700 ( 14.781 6.415 -2.462) 16.300 6.003 ( -0.495 4.439 -1.411) 4.684 6.322 ( 0.732 0.543 -1.737) 1.962 6.490 ( 3.546 -6.065 0.372) 7.036 6.720 ( 0.239 2.699 0.243) 2.721 7.075 ( -8.798 1.159 0.743) 8.905 7.230 ( 7.434 3.586 0.469) 8.267 7.363 ( -7.020 4.172 4.973) 9.561 7.733 ( 4.082 -1.112 -1.015) 4.351 7.769 ( 3.948 3.553 -5.287) 7.494 8.059 ( 3.454 1.050 2.413) 4.343 8.310 ( -0.270 -1.036 2.951) 3.139 8.680 ( 11.593 5.230 -0.205) 12.720 8.792 ( -4.650 1.900 -2.841) 5.771 11.274 ( -9.032 -11.663 -0.786) 14.773 12.392 ( -17.768 13.997 0.404) 22.623 12.681 ( -6.195 -3.256 -3.679) 7.907 12.866 ( 3.793 -13.591 2.208) 14.282 14.032 ( -8.904 3.436 0.233) 9.547 14.486 ( -35.696 25.462 2.120) 43.897 16.242 ( 30.302 18.251 -3.897) 35.588 16.945 ( 16.609 3.977 -1.232) 17.123 26.866 ( 0.371 -0.244 0.122) 0.460 26.902 ( -0.425 0.031 0.854) 0.954 26.971 ( 0.418 -0.093 -0.332) 0.541 27.061 ( 0.792 -0.012 -0.971) 1.253 28.002 ( -0.581 -0.780 0.717) 1.208 28.132 ( 0.274 -1.016 -0.896) 1.382 33.730 ( -1.473 -0.799 0.806) 1.860 34.019 ( 0.335 -1.006 -2.476) 2.694 34.373 ( -0.097 4.143 0.861) 4.233 34.566 ( 2.781 4.135 0.027) 4.984 35.366 ( -0.310 1.069 4.520) 4.655 35.843 ( 0.550 0.586 -3.554) 3.644 37.276 ( -0.120 0.084 0.117) 0.187 37.328 ( 1.006 0.334 -0.190) 1.077 42.592 ( -13.827 11.721 0.218) 18.128 43.256 ( -42.186 26.376 2.211) 49.802 44.457 ( 10.998 7.687 -0.417) 13.424 45.186 ( -0.468 5.343 -2.191) 5.794 45.406 ( 11.833 6.746 0.599) 13.634 45.572 ( -1.181 6.692 -2.405) 7.209 46.348 ( 13.870 9.577 0.788) 16.874 47.663 ( -0.031 6.261 -1.789) 6.512 49.765 ( -7.399 6.756 0.907) 10.060 50.349 ( 2.624 3.261 -0.859) 4.273 50.524 ( 3.288 13.178 -3.217) 13.957 54.746 ( -3.228 -11.686 -8.126) 14.595 60.915 ( 38.148 -12.887 5.189) 40.599 62.922 ( 64.226 -11.985 -18.852) 68.000 67.124 ( -26.211 2.370 7.591) 27.391 69.167 ( -9.852 17.070 -8.733) 21.557 ======================= Grid point 183 (82/204) ======================= q-point: ( 0.45 0.45 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.397 ( 5.019 0.000 2.949) 5.821 2.587 ( 2.619 0.000 -2.204) 3.423 2.674 ( 6.445 0.000 3.614) 7.389 2.954 ( 1.177 0.000 -8.296) 8.379 3.162 ( -4.586 -0.000 5.723) 7.334 3.407 ( -6.075 -0.000 3.147) 6.841 3.440 ( 0.122 0.000 8.352) 8.353 4.138 ( 2.589 0.000 3.761) 4.566 4.307 ( -8.117 -0.000 4.116) 9.101 4.400 ( 11.097 0.000 -6.336) 12.779 4.726 ( -5.738 -0.000 0.375) 5.750 4.808 ( 0.141 0.000 -7.041) 7.043 5.479 ( -3.599 -0.000 0.248) 3.608 5.513 ( -1.421 -0.000 -2.640) 2.998 5.848 ( -4.472 -0.000 1.692) 4.782 6.127 ( 5.971 0.000 -5.696) 8.252 6.344 ( 0.187 0.000 0.619) 0.646 6.514 ( -1.182 -0.000 -2.791) 3.031 6.885 ( 3.651 0.000 6.320) 7.299 7.075 ( -4.680 -0.000 3.956) 6.128 7.358 ( 4.332 0.000 -1.834) 4.704 7.417 ( 7.386 0.000 -6.769) 10.018 7.908 ( -7.212 -0.000 5.167) 8.872 7.920 ( 16.726 0.000 -6.331) 17.885 8.520 ( -7.475 -0.000 8.904) 11.626 8.709 ( 15.240 0.000 1.827) 15.349 8.927 ( 4.720 0.000 -2.409) 5.300 9.023 ( 0.233 0.000 -3.912) 3.919 10.694 ( -12.124 -0.000 1.922) 12.276 10.925 ( -13.291 -0.000 -2.426) 13.510 12.649 ( -0.149 -0.000 -0.184) 0.237 12.713 ( -1.365 -0.000 0.702) 1.535 15.843 ( 6.298 0.000 5.110) 8.110 16.594 ( 6.968 0.000 -4.079) 8.074 17.007 ( 7.381 0.000 2.466) 7.782 17.263 ( 4.824 0.000 -5.305) 7.170 26.845 ( -0.358 -0.000 0.529) 0.639 26.866 ( 0.267 0.000 -0.180) 0.322 26.920 ( 0.081 0.000 0.194) 0.211 26.997 ( 0.075 0.000 -0.920) 0.923 27.991 ( -0.411 -0.000 0.797) 0.897 28.108 ( -0.222 -0.000 -0.974) 0.999 33.649 ( -0.835 -0.000 1.881) 2.058 33.989 ( 0.391 0.000 -3.531) 3.552 34.652 ( 1.713 0.000 2.277) 2.849 34.943 ( 0.543 0.000 -0.467) 0.716 35.631 ( -0.508 -0.000 2.051) 2.113 35.831 ( 1.666 0.000 -1.809) 2.459 37.197 ( -1.170 -0.000 0.433) 1.248 37.227 ( 0.240 0.000 -0.702) 0.742 44.402 ( 1.494 0.000 1.228) 1.934 44.692 ( 2.122 0.000 -4.728) 5.182 44.811 ( 6.993 0.000 3.187) 7.685 45.454 ( 0.947 0.000 -4.911) 5.002 45.771 ( 5.667 0.000 4.457) 7.209 46.201 ( 2.467 0.000 0.562) 2.530 47.129 ( 8.399 0.000 4.716) 9.632 47.997 ( 4.599 0.000 -3.610) 5.847 50.804 ( 3.906 0.000 5.375) 6.645 51.667 ( 19.201 0.000 -12.398) 22.856 52.878 ( 29.547 0.000 -1.399) 29.581 53.412 ( -0.116 -0.000 5.928) 5.929 59.901 ( -33.919 -0.000 11.517) 35.821 61.013 ( -25.325 -0.000 -14.647) 29.255 66.895 ( -2.680 -0.000 24.490) 24.636 70.272 ( 19.109 0.000 -31.621) 36.946 ======================= Grid point 184 (83/204) ======================= q-point: (-0.45 -0.55 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.431 ( -4.069 -2.384 -0.048) 4.716 2.642 ( 10.246 2.026 5.209) 11.671 2.723 ( -0.111 -1.204 2.239) 2.545 2.973 ( -0.571 -3.932 -7.389) 8.389 3.164 ( 0.078 -1.418 6.436) 6.591 3.319 ( -7.915 1.391 0.143) 8.038 3.454 ( -0.539 -0.458 5.980) 6.021 4.155 ( 0.003 2.337 3.902) 4.549 4.242 ( -1.169 1.612 3.686) 4.190 4.482 ( 8.609 3.787 -4.899) 10.604 4.639 ( -5.654 1.443 -0.336) 5.845 4.813 ( 0.853 -2.069 -7.188) 7.529 5.439 ( -2.270 1.653 -0.400) 2.836 5.479 ( 2.321 3.885 -1.395) 4.735 5.820 ( -1.643 -0.588 1.163) 2.097 6.164 ( 4.167 0.991 -5.119) 6.675 6.320 ( -1.404 2.366 1.715) 3.242 6.498 ( -0.612 -0.331 -3.330) 3.402 6.936 ( -1.334 -1.923 5.473) 5.953 7.040 ( -3.215 -1.242 2.645) 4.345 7.377 ( 1.235 0.964 -1.426) 2.118 7.482 ( 7.034 0.148 -5.987) 9.239 7.825 ( -7.224 1.062 3.493) 8.094 8.083 ( 12.905 0.005 -5.382) 13.982 8.424 ( -11.104 1.647 9.575) 14.755 8.721 ( -5.128 7.522 0.602) 9.124 8.897 ( 3.818 6.951 -1.609) 8.093 9.036 ( 3.443 0.925 -2.386) 4.290 10.683 ( -1.843 -7.794 1.256) 8.107 10.906 ( 1.560 -7.122 -2.056) 7.575 12.686 ( 1.976 -3.783 0.345) 4.282 12.709 ( -2.185 -1.495 0.094) 2.649 15.854 ( -1.053 3.676 4.840) 6.168 16.603 ( -2.003 1.774 -5.814) 6.400 16.994 ( -0.795 6.493 1.593) 6.733 17.230 ( 4.542 10.137 -2.217) 11.326 26.843 ( -0.370 -0.177 0.401) 0.574 26.867 ( 0.156 0.094 -0.015) 0.183 26.930 ( 0.010 -1.167 0.074) 1.170 26.995 ( 0.326 0.229 -0.797) 0.892 27.989 ( -0.167 0.062 0.782) 0.802 28.105 ( 0.266 0.152 -0.920) 0.969 33.650 ( -0.355 -0.504 1.875) 1.974 33.985 ( 0.479 0.055 -3.601) 3.633 34.666 ( 1.098 1.087 3.108) 3.471 34.924 ( -1.212 1.699 -1.256) 2.435 35.616 ( -0.869 1.608 1.887) 2.627 35.845 ( 1.349 -0.033 -1.388) 1.936 37.195 ( -0.845 -1.222 -0.041) 1.486 37.230 ( 0.351 -0.084 -0.464) 0.588 44.394 ( -2.194 1.645 0.100) 2.744 44.600 ( 3.943 10.515 0.228) 11.232 44.954 ( 2.677 -6.636 1.185) 7.253 45.401 ( -2.836 4.443 -5.501) 7.619 45.780 ( 2.046 4.873 5.135) 7.369 46.188 ( -5.568 -0.545 -2.799) 6.256 47.195 ( 3.837 2.731 7.759) 9.076 48.001 ( -0.629 1.038 -4.521) 4.681 50.781 ( -1.908 5.684 4.306) 7.382 51.674 ( 7.835 16.618 -9.555) 20.708 53.029 ( 7.264 8.817 3.189) 11.861 53.353 ( -13.460 -2.487 -0.898) 13.718 59.717 ( -8.063 -4.868 7.550) 12.071 60.858 ( 9.871 4.244 -9.218) 14.157 66.979 ( -7.486 -10.455 22.201) 25.656 70.355 ( 13.751 4.311 -26.894) 30.511 ======================= Grid point 185 (84/204) ======================= q-point: (-0.36 -0.55 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.400 ( -3.543 -0.166 2.229) 4.189 2.650 ( -7.080 -0.572 1.996) 7.378 2.851 ( 11.288 -4.106 6.837) 13.821 2.996 ( -2.410 -1.659 -4.579) 5.434 3.196 ( -5.407 1.927 -0.384) 5.753 3.213 ( -2.467 -1.923 2.579) 4.054 3.494 ( 0.827 -4.061 3.102) 5.176 4.082 ( -3.831 3.692 3.190) 6.204 4.236 ( 4.460 4.900 1.639) 6.826 4.419 ( -0.136 7.274 -1.582) 7.445 4.600 ( 1.225 1.611 -1.002) 2.258 4.852 ( 1.453 -3.168 -6.854) 7.689 5.300 ( -5.849 9.161 -1.897) 11.033 5.508 ( 9.766 2.016 0.807) 10.004 5.833 ( 1.147 -0.689 0.510) 1.432 6.176 ( 2.606 0.669 -3.696) 4.571 6.259 ( -3.254 2.309 1.967) 4.449 6.484 ( -0.757 0.828 -2.567) 2.802 6.915 ( -3.960 0.543 2.045) 4.490 7.076 ( -0.529 -4.281 2.416) 4.944 7.359 ( -0.837 1.427 0.295) 1.680 7.533 ( 2.859 -0.351 -3.756) 4.733 7.743 ( -4.204 0.900 -0.487) 4.327 8.163 ( 4.331 1.791 -3.198) 5.674 8.257 ( -12.792 5.704 5.289) 14.971 8.461 ( -11.476 7.709 3.175) 14.185 8.870 ( 8.881 6.938 -0.744) 11.295 9.014 ( 0.020 3.503 -1.521) 3.819 10.781 ( -3.748 -8.294 0.104) 9.102 11.206 ( 20.507 -14.099 -1.209) 24.915 12.673 ( -7.574 -2.419 0.282) 7.956 12.832 ( 6.308 -6.846 0.128) 9.310 15.694 ( -14.872 9.639 4.385) 18.257 16.397 ( -16.783 10.827 -6.017) 20.859 16.873 ( -0.796 6.985 -0.554) 7.052 17.080 ( 8.445 15.742 0.525) 17.872 26.844 ( -0.308 -0.329 0.306) 0.545 26.870 ( 0.187 -0.188 0.180) 0.320 26.949 ( -0.503 -1.427 -0.174) 1.523 26.997 ( 1.042 0.036 -0.600) 1.203 27.989 ( -0.004 0.086 0.767) 0.772 28.106 ( 0.685 0.229 -0.895) 1.150 33.664 ( 0.074 -0.942 1.778) 2.013 33.981 ( 0.481 0.059 -3.537) 3.570 34.655 ( 0.229 2.388 3.535) 4.272 34.861 ( -2.473 3.152 -1.824) 4.402 35.573 ( -1.253 2.915 2.003) 3.753 35.856 ( 1.120 0.062 -1.191) 1.636 37.210 ( -1.049 -1.889 -0.494) 2.216 37.240 ( 1.050 -0.602 -0.172) 1.222 44.230 ( -11.787 10.666 -0.992) 15.927 44.542 ( 6.294 5.500 3.830) 9.195 44.980 ( -9.811 4.636 -0.604) 10.868 45.272 ( -1.851 1.306 -4.142) 4.721 45.700 ( -1.803 7.095 5.484) 9.147 46.128 ( -3.598 -1.180 -6.222) 7.284 47.137 ( -4.161 8.560 9.715) 13.601 47.937 ( -4.770 1.507 -5.041) 7.102 50.617 ( -7.687 9.521 2.626) 12.515 51.360 ( 5.994 28.550 -5.428) 29.673 52.478 ( -52.672 21.273 1.951) 56.839 53.514 ( 12.529 -13.494 -3.279) 18.703 59.862 ( 12.109 -6.865 4.163) 14.529 61.104 ( 46.794 2.385 -4.567) 47.077 67.116 ( -12.190 -14.381 17.620) 25.804 70.311 ( 6.678 9.458 -21.997) 24.858 ======================= Grid point 186 (85/204) ======================= q-point: (-0.27 -0.55 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.385 ( -0.108 1.122 5.056) 5.180 2.584 ( -7.208 -2.091 2.035) 7.776 2.893 ( -12.102 1.044 -1.526) 12.242 3.013 ( 0.577 1.088 -1.219) 1.733 3.133 ( 4.693 1.435 -0.970) 5.003 3.218 ( -4.802 -2.660 5.455) 7.739 3.628 ( 3.167 -8.798 3.289) 9.912 3.999 ( -1.915 3.829 2.348) 4.883 4.178 ( 2.659 5.936 -2.151) 6.851 4.304 ( -0.654 7.340 -0.710) 7.403 4.569 ( 1.336 4.745 2.179) 5.390 4.876 ( -0.707 0.888 -6.761) 6.856 5.095 ( -1.342 6.806 -2.965) 7.544 5.615 ( 11.981 1.604 2.835) 12.416 5.851 ( 2.574 1.296 -0.954) 3.036 6.162 ( -6.463 -0.150 -0.502) 6.484 6.228 ( 3.923 0.004 -1.724) 4.285 6.439 ( -1.154 2.742 0.160) 2.979 6.871 ( -2.231 1.138 0.070) 2.505 7.139 ( -0.603 -3.291 0.624) 3.404 7.311 ( -4.573 1.237 2.028) 5.154 7.519 ( -5.240 -0.491 -0.469) 5.284 7.722 ( 3.236 1.313 -3.649) 5.051 7.979 ( -11.088 6.410 1.424) 12.887 8.157 ( -1.009 3.262 -0.750) 3.496 8.328 ( -2.560 2.422 4.291) 5.553 8.864 ( 8.180 6.220 -0.803) 10.308 8.938 ( -2.878 3.516 -1.128) 4.682 10.872 ( -1.139 -7.449 -0.274) 7.540 11.703 ( 25.870 -15.573 -1.180) 30.219 12.615 ( -10.206 -3.167 0.607) 10.704 12.999 ( 3.231 -5.969 -0.079) 6.787 15.173 ( -34.265 22.889 1.615) 41.238 15.908 ( -28.751 17.620 -1.193) 33.742 16.749 ( 6.510 11.109 -3.959) 13.471 17.016 ( 11.147 8.063 1.642) 13.856 26.848 ( -0.132 -0.425 0.212) 0.493 26.879 ( 0.340 -0.564 0.363) 0.752 26.957 ( -0.645 -0.704 -0.310) 1.004 27.017 ( 1.473 -0.818 -0.519) 1.763 27.990 ( 0.020 0.076 0.745) 0.749 28.109 ( 0.926 0.178 -0.877) 1.288 33.687 ( 0.247 -1.128 1.560) 1.941 33.978 ( 0.366 -0.130 -3.316) 3.338 34.610 ( -1.157 3.975 3.253) 5.265 34.773 ( -2.478 3.798 -1.752) 4.861 35.510 ( -1.709 3.682 2.359) 4.695 35.862 ( 1.023 0.274 -1.322) 1.694 37.225 ( -0.857 -1.739 -0.456) 1.992 37.272 ( 1.359 -1.540 -0.229) 2.067 43.775 ( -26.649 20.701 -0.976) 33.759 44.486 ( -11.958 8.935 8.773) 17.315 44.676 ( -6.068 8.122 -4.722) 11.184 45.324 ( 3.121 -3.987 -3.289) 6.037 45.570 ( -2.508 7.671 5.544) 9.791 46.101 ( -0.881 1.256 -10.233) 10.348 46.865 ( -13.173 15.863 10.695) 23.228 47.844 ( -5.865 0.883 -4.084) 7.201 50.348 ( -10.597 12.072 0.507) 16.071 50.973 ( 2.458 27.597 -1.640) 27.755 51.541 ( -45.309 19.661 -0.588) 49.394 53.883 ( 5.137 -20.680 -3.369) 21.574 60.183 ( 29.061 -4.079 2.939) 29.493 61.766 ( 66.621 -3.989 -3.539) 66.834 67.192 ( -16.881 -11.257 12.331) 23.743 70.097 ( -3.204 15.139 -17.295) 23.207 ======================= Grid point 187 (86/204) ======================= q-point: (-0.18 -0.55 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.347 ( -0.583 5.464 5.235) 7.589 2.567 ( -8.759 -2.191 3.030) 9.524 2.705 ( -8.756 4.213 -2.225) 9.969 2.908 ( -3.880 4.890 -4.449) 7.665 3.137 ( -0.435 -0.398 1.590) 1.696 3.270 ( -0.656 -3.952 3.561) 5.360 3.706 ( -8.469 1.908 3.423) 9.332 3.972 ( 7.744 3.003 2.838) 8.778 4.176 ( 6.168 -1.011 -2.510) 6.735 4.206 ( 0.350 1.554 -0.024) 1.593 4.506 ( 1.207 5.357 2.179) 5.908 4.787 ( 0.028 4.689 -6.532) 8.041 5.092 ( 3.589 -2.070 -2.154) 4.670 5.673 ( -0.205 3.990 3.912) 5.591 5.858 ( 8.142 3.790 -2.253) 9.259 6.077 ( -5.774 -0.224 -2.236) 6.196 6.295 ( 4.810 -1.342 -2.527) 5.596 6.406 ( 0.884 0.760 2.468) 2.730 6.822 ( -1.552 2.461 -0.196) 2.916 7.102 ( -10.195 0.497 0.123) 10.208 7.294 ( 3.868 -0.451 0.835) 3.983 7.451 ( -6.647 0.722 2.409) 7.107 7.702 ( -2.279 1.001 0.193) 2.497 7.893 ( 6.578 2.637 -4.742) 8.527 8.091 ( -3.150 1.308 2.609) 4.294 8.301 ( 0.185 1.172 2.267) 2.559 8.844 ( -5.224 1.938 -1.241) 5.709 8.860 ( 7.094 5.489 -0.978) 9.023 10.979 ( 0.894 -6.512 -0.437) 6.587 12.224 ( 25.439 -13.821 -1.729) 29.002 12.553 ( -10.868 -4.779 1.068) 11.920 12.988 ( -11.579 6.004 -0.310) 13.047 14.392 ( -31.648 21.939 -0.062) 38.508 15.223 ( -37.710 22.088 1.454) 43.726 16.694 ( 13.914 10.295 -3.537) 17.666 17.046 ( 8.256 3.334 0.260) 8.908 26.855 ( 0.108 -0.468 0.098) 0.490 26.893 ( 0.225 -0.563 0.572) 0.833 26.961 ( -0.041 -0.500 -0.267) 0.568 27.046 ( 1.230 -0.888 -0.666) 1.657 27.991 ( -0.066 -0.001 0.707) 0.710 28.116 ( 0.906 -0.004 -0.845) 1.239 33.707 ( -0.131 -0.783 1.176) 1.419 33.982 ( 0.484 -0.846 -2.941) 3.098 34.525 ( -2.328 5.048 2.233) 5.990 34.691 ( -1.352 3.612 -0.883) 3.956 35.439 ( -2.028 3.435 2.938) 4.954 35.863 ( 0.909 0.633 -1.825) 2.135 37.245 ( -0.232 -1.792 -0.304) 1.833 37.309 ( 1.136 -1.401 -0.285) 1.826 43.082 ( -32.468 20.904 -1.018) 38.629 43.997 ( -33.549 19.477 4.804) 39.089 44.620 ( 4.151 4.108 -0.039) 5.840 45.353 ( -1.568 2.929 -4.744) 5.792 45.487 ( 1.668 1.993 6.329) 6.842 45.917 ( -10.569 10.881 -9.038) 17.657 46.592 ( 0.690 7.878 6.321) 10.124 47.766 ( -4.846 0.643 -2.167) 5.347 50.031 ( -12.318 11.450 -0.231) 16.819 50.574 ( -12.628 12.362 0.277) 17.673 51.028 ( -0.487 16.897 -2.195) 17.046 54.199 ( -6.987 -21.904 -2.901) 23.174 60.658 ( 41.399 -4.630 3.977) 41.847 62.615 ( 69.198 -7.032 -7.211) 69.927 67.119 ( -21.704 -4.103 7.647) 23.374 69.707 ( -13.113 18.098 -12.830) 25.770 ======================= Grid point 188 (87/204) ======================= q-point: (-0.09 0.45 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.242 ( -1.099 7.638 4.887) 9.134 2.390 ( -15.680 0.720 -7.923) 17.583 2.576 ( 2.076 12.281 5.751) 13.719 2.835 ( 0.456 1.357 -1.363) 1.976 3.182 ( -0.961 -2.833 2.291) 3.768 3.348 ( 3.609 -6.421 3.232) 8.044 3.558 ( -5.774 1.567 0.067) 5.983 3.951 ( 1.824 8.131 4.237) 9.349 4.232 ( 4.648 -0.852 -2.705) 5.445 4.336 ( 2.364 -7.214 -0.732) 7.627 4.461 ( 2.697 3.486 1.459) 4.643 4.741 ( 1.842 0.801 -2.681) 3.350 5.176 ( 4.158 -3.500 -2.054) 5.810 5.503 ( -11.339 6.710 -0.271) 13.178 5.902 ( 7.069 2.215 -0.429) 7.420 6.058 ( 2.906 1.183 -1.176) 3.351 6.331 ( 1.702 0.203 -2.132) 2.736 6.460 ( 3.003 -3.097 0.817) 4.391 6.773 ( 0.863 2.616 -0.242) 2.765 6.977 ( -9.696 -0.051 0.691) 9.720 7.345 ( -5.322 1.654 4.003) 6.862 7.377 ( 6.957 2.528 0.062) 7.402 7.688 ( -1.931 -2.509 -0.602) 3.223 7.899 ( 2.860 3.992 -2.783) 5.645 8.106 ( 5.367 -1.085 1.413) 5.655 8.300 ( 0.087 -0.185 2.014) 2.024 8.751 ( -5.915 1.455 -1.847) 6.366 8.860 ( 5.675 3.622 -0.877) 6.789 11.079 ( 0.288 -5.521 -0.522) 5.554 12.412 ( -17.894 14.576 0.235) 23.081 12.455 ( -14.188 -1.830 -1.577) 14.392 12.876 ( 22.792 -12.489 0.562) 25.996 13.985 ( -10.432 4.508 0.380) 11.371 14.452 ( -36.029 22.173 1.320) 42.326 16.707 ( 15.140 9.014 -2.389) 17.781 17.089 ( 4.543 0.536 -1.387) 4.780 26.865 ( 0.308 -0.460 -0.040) 0.555 26.900 ( -0.259 -0.090 0.796) 0.842 26.970 ( 0.372 -0.389 -0.232) 0.586 27.065 ( 0.798 -0.374 -0.839) 1.217 27.992 ( -0.224 -0.158 0.666) 0.720 28.125 ( 0.587 -0.226 -0.812) 1.027 33.712 ( -0.684 -0.272 0.745) 1.048 34.001 ( 0.707 -1.327 -2.572) 2.979 34.431 ( -1.642 4.250 1.499) 4.797 34.633 ( 0.021 2.537 -0.239) 2.548 35.385 ( -1.577 1.609 3.723) 4.351 35.855 ( 0.769 0.938 -2.602) 2.871 37.268 ( 0.082 -1.105 -0.208) 1.127 37.335 ( 0.724 -0.643 -0.271) 1.005 42.560 ( -16.880 7.266 -0.916) 18.400 43.225 ( -36.081 25.902 2.136) 44.467 44.601 ( 2.945 3.458 1.372) 4.745 45.249 ( -1.303 4.724 -3.333) 5.926 45.503 ( -1.178 -0.165 3.768) 3.952 45.684 ( -0.634 6.235 -2.961) 6.932 46.602 ( 10.280 3.556 -0.245) 10.880 47.701 ( -3.281 1.445 -0.778) 3.669 49.776 ( -7.917 5.811 0.185) 9.822 50.368 ( -4.775 3.138 -0.534) 5.738 50.866 ( 11.872 13.880 -1.912) 18.365 54.363 ( -15.478 -16.511 -2.064) 22.725 61.211 ( 34.709 -7.296 7.301) 36.211 63.431 ( 59.481 -5.958 -16.036) 61.892 66.882 ( -23.701 1.734 5.157) 24.317 69.253 ( -14.663 14.862 -9.292) 22.853 ======================= Grid point 195 (88/204) ======================= q-point: (-0.45 -0.45 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.365 ( -4.998 -0.000 2.453) 5.567 2.643 ( -9.618 -0.000 0.352) 9.624 2.810 ( 11.266 0.000 6.261) 12.889 2.936 ( 2.613 0.000 -8.140) 8.549 3.187 ( 1.503 0.000 9.807) 9.922 3.241 ( -7.443 -0.000 -4.009) 8.454 3.429 ( -3.944 -0.000 5.621) 6.867 4.152 ( -3.472 -0.000 3.381) 4.846 4.312 ( 6.930 0.000 5.306) 8.728 4.531 ( -8.757 -0.000 -1.207) 8.840 4.638 ( 9.124 0.000 -2.992) 9.602 4.792 ( 2.011 0.000 -7.852) 8.105 5.448 ( 1.085 0.000 -1.173) 1.598 5.536 ( 3.211 0.000 -1.185) 3.423 5.814 ( 1.538 0.000 0.118) 1.542 6.207 ( 3.636 0.000 -5.041) 6.216 6.325 ( -2.913 -0.000 2.794) 4.036 6.466 ( -1.889 -0.000 -4.091) 4.506 6.905 ( -4.151 -0.000 6.230) 7.486 7.004 ( -1.699 -0.000 0.692) 1.834 7.359 ( -3.599 -0.000 -1.775) 4.013 7.547 ( 3.929 0.000 -3.553) 5.297 7.758 ( -5.778 -0.000 0.510) 5.800 8.185 ( 3.415 0.000 -1.783) 3.853 8.330 ( -8.873 -0.000 7.260) 11.465 8.657 ( -15.406 -0.000 0.316) 15.409 8.946 ( -2.862 -0.000 -1.279) 3.135 9.089 ( 3.137 0.000 -1.358) 3.419 10.676 ( 10.783 0.000 1.143) 10.843 10.937 ( 14.470 0.000 -1.846) 14.587 12.678 ( 2.398 0.000 1.117) 2.645 12.681 ( -1.292 -0.000 -0.665) 1.453 15.837 ( -8.841 -0.000 5.079) 10.196 16.549 ( -8.322 -0.000 -5.616) 10.040 16.979 ( -10.336 -0.000 0.961) 10.381 17.352 ( 3.666 0.000 -1.967) 4.160 26.839 ( -0.365 -0.000 0.242) 0.438 26.870 ( 0.078 0.000 -0.003) 0.078 26.920 ( -0.083 -0.000 0.228) 0.242 27.000 ( 0.562 0.000 -0.810) 0.985 27.991 ( 0.073 0.000 0.786) 0.789 28.110 ( 0.763 0.000 -0.916) 1.192 33.650 ( 0.093 0.000 1.924) 1.926 33.983 ( 0.640 0.000 -3.656) 3.711 34.691 ( 0.481 0.000 3.892) 3.921 34.909 ( -2.982 -0.000 -1.963) 3.570 35.621 ( -1.162 -0.000 1.489) 1.888 35.856 ( 1.070 0.000 -0.841) 1.361 37.176 ( -0.671 -0.000 -0.345) 0.755 37.234 ( 0.544 0.000 -0.338) 0.641 44.376 ( -4.005 -0.000 -0.023) 4.005 44.749 ( 4.563 0.000 -2.459) 5.183 44.882 ( -2.409 -0.000 6.059) 6.520 45.378 ( -5.849 -0.000 -7.286) 9.343 45.821 ( -2.968 -0.000 5.906) 6.610 46.074 ( -12.658 -0.000 -3.540) 13.144 47.258 ( -0.268 -0.000 8.902) 8.906 47.959 ( -6.079 -0.000 -5.541) 8.226 50.779 ( -7.871 -0.000 3.861) 8.767 51.841 ( -0.044 -0.000 -7.290) 7.291 53.058 ( -29.848 -0.000 -7.049) 30.669 53.068 ( -15.067 -0.000 7.539) 16.848 59.751 ( 17.960 0.000 4.750) 18.578 61.191 ( 44.672 0.000 -7.056) 45.226 66.838 ( -11.601 -0.000 21.389) 24.333 70.459 ( 9.480 0.000 -24.809) 26.558 ======================= Grid point 196 (89/204) ======================= q-point: (-0.36 -0.45 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.325 ( -6.098 -1.855 4.484) 7.793 2.516 ( -13.991 -1.645 -0.731) 14.107 2.926 ( 3.699 0.372 8.156) 8.963 2.978 ( 4.757 -1.991 -7.117) 8.789 3.145 ( -3.281 0.921 -7.509) 8.246 3.216 ( -1.067 0.259 10.011) 10.071 3.429 ( -1.908 -3.311 4.744) 6.092 4.107 ( -2.176 2.559 2.951) 4.471 4.353 ( 0.402 4.775 1.222) 4.946 4.434 ( -2.977 0.278 1.605) 3.393 4.716 ( 9.221 2.652 -0.357) 9.602 4.818 ( 3.105 -1.012 -7.580) 8.253 5.390 ( -1.065 8.167 -2.558) 8.624 5.594 ( 5.384 -2.402 -0.166) 5.898 5.859 ( 5.601 -0.476 -0.791) 5.677 6.212 ( 0.349 2.598 -3.742) 4.569 6.266 ( -2.605 2.062 2.922) 4.425 6.450 ( -2.426 -1.752 -3.461) 4.575 6.866 ( -5.869 -0.818 4.379) 7.368 7.022 ( 0.929 -2.846 -0.027) 2.994 7.302 ( -7.283 -1.028 -1.405) 7.488 7.512 ( -8.406 0.276 -0.076) 8.411 7.741 ( 4.190 0.233 -4.718) 6.314 8.096 ( -16.109 0.695 7.690) 17.864 8.292 ( 0.504 4.007 -2.774) 4.899 8.438 ( -11.296 4.181 2.795) 12.365 8.913 ( -4.651 -1.780 -1.173) 5.116 9.066 ( -1.841 2.899 -1.125) 3.614 10.815 ( 16.188 3.465 0.813) 16.574 11.256 ( 24.556 -12.020 -1.440) 27.378 12.620 ( -2.519 3.097 -0.037) 3.992 12.791 ( 4.671 -6.632 0.538) 8.130 15.650 ( -18.878 7.721 5.093) 21.022 16.333 ( -18.976 8.887 -4.829) 21.503 16.834 ( -13.548 -1.396 0.164) 13.620 17.321 ( 3.224 7.130 -2.203) 8.129 26.837 ( -0.281 -0.229 0.138) 0.388 26.870 ( 0.094 -0.022 0.145) 0.174 26.927 ( -0.240 -0.867 0.142) 0.911 27.006 ( 0.846 -0.084 -0.754) 1.136 27.994 ( 0.273 0.120 0.789) 0.843 28.117 ( 1.165 0.208 -0.936) 1.509 33.661 ( 0.488 -0.474 1.862) 1.982 33.982 ( 0.759 0.172 -3.559) 3.644 34.692 ( -0.369 1.346 4.248) 4.472 34.851 ( -4.411 1.290 -2.440) 5.204 35.597 ( -1.507 1.602 1.417) 2.616 35.865 ( 0.836 -0.029 -0.511) 0.980 37.177 ( -0.615 -1.021 -0.720) 1.392 37.243 ( 0.805 -0.383 -0.096) 0.897 44.249 ( -10.768 8.397 -0.841) 13.680 44.695 ( 1.599 7.349 4.270) 8.649 44.919 ( -6.364 -1.032 1.133) 6.546 45.218 ( -9.728 2.985 -6.592) 12.124 45.742 ( -7.414 3.824 5.601) 10.048 45.968 ( -11.726 -7.544 -4.497) 14.650 47.205 ( -7.093 5.619 9.429) 13.068 47.848 ( -10.676 -0.188 -6.191) 12.342 50.633 ( -11.480 5.352 2.820) 12.976 51.673 ( -9.418 9.971 -2.471) 13.937 52.274 ( -45.436 31.474 -2.577) 55.333 53.193 ( -14.286 -25.251 -1.552) 29.054 60.087 ( 34.906 -2.062 2.620) 35.065 61.790 ( 67.774 3.149 -5.104) 68.039 66.818 ( -13.981 -9.337 17.848) 24.519 70.437 ( 3.762 6.085 -22.366) 23.482 ======================= Grid point 197 (90/204) ======================= q-point: (-0.27 -0.45 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.301 ( -9.667 -4.126 4.002) 11.246 2.407 ( -13.165 -5.585 0.550) 14.311 2.863 ( -5.176 5.916 3.721) 8.697 3.015 ( -2.699 0.082 -5.683) 6.292 3.148 ( 1.855 -2.430 -3.566) 4.697 3.210 ( 0.518 1.919 6.600) 6.893 3.523 ( 0.960 -7.831 7.042) 10.575 4.053 ( 0.145 3.055 1.980) 3.644 4.251 ( -2.390 3.655 -2.199) 4.889 4.396 ( 0.624 5.819 1.206) 5.976 4.740 ( 7.717 8.933 0.876) 11.837 4.852 ( 1.514 -2.554 -3.755) 4.787 5.208 ( -0.818 10.195 -4.342) 11.112 5.703 ( 5.023 -2.470 1.205) 5.725 5.933 ( 7.836 0.897 -1.017) 7.953 6.091 ( -9.342 3.230 -0.909) 9.927 6.276 ( 4.522 0.078 -0.768) 4.587 6.434 ( -2.623 -0.438 -0.913) 2.812 6.831 ( -4.995 -1.577 2.213) 5.687 7.080 ( -1.303 -2.125 -0.333) 2.515 7.227 ( -7.799 -2.643 -0.865) 8.280 7.409 ( -10.075 -2.237 -1.082) 10.377 7.765 ( -0.469 1.946 -1.142) 2.305 7.935 ( -6.467 0.304 1.771) 6.712 8.162 ( -6.902 4.180 2.455) 8.434 8.364 ( 0.100 1.690 0.427) 1.746 8.877 ( -6.269 -1.223 -1.171) 6.494 8.980 ( -3.750 2.847 -0.991) 4.811 10.942 ( 17.302 4.570 0.404) 17.900 11.766 ( 27.636 -15.128 -1.184) 31.528 12.538 ( -3.216 3.134 0.328) 4.503 12.950 ( 3.986 -5.792 0.395) 7.042 15.145 ( -33.084 21.701 3.241) 39.699 15.826 ( -32.028 17.328 -1.868) 36.463 16.757 ( -9.689 -5.191 -0.631) 11.010 17.237 ( 4.388 7.684 -3.151) 9.393 26.840 ( -0.092 -0.446 0.062) 0.460 26.876 ( 0.254 -0.406 0.298) 0.564 26.938 ( -0.306 -0.940 -0.007) 0.989 27.020 ( 1.101 -0.592 -0.676) 1.421 27.997 ( 0.369 0.276 0.777) 0.903 28.125 ( 1.356 0.398 -0.946) 1.701 33.682 ( 0.706 -0.740 1.650) 1.941 33.977 ( 0.643 0.356 -3.297) 3.378 34.655 ( -2.108 3.172 3.455) 5.142 34.771 ( -4.402 1.594 -1.863) 5.039 35.545 ( -2.020 2.951 1.672) 3.948 35.874 ( 0.827 0.026 -0.540) 0.988 37.188 ( -0.645 -1.614 -0.912) 1.963 37.265 ( 1.092 -1.141 0.076) 1.581 43.798 ( -27.945 22.753 -1.295) 36.060 44.481 ( -20.858 13.299 6.413) 25.555 44.755 ( 1.113 5.757 -1.452) 6.041 45.224 ( -1.543 -8.573 -3.393) 9.349 45.612 ( -7.187 3.776 4.832) 9.448 45.975 ( -9.928 -7.944 -6.777) 14.409 46.941 ( -16.506 13.075 8.091) 22.558 47.729 ( -10.876 -2.500 -4.601) 12.071 50.394 ( -11.620 9.339 1.543) 14.987 51.239 ( -41.772 31.737 -2.681) 52.529 51.404 ( -11.786 8.085 0.250) 14.294 53.467 ( -8.131 -26.656 -3.866) 28.136 60.561 ( 40.928 -2.509 2.091) 41.058 62.552 ( 76.445 2.715 -4.647) 76.634 66.859 ( -14.891 -11.228 12.236) 22.306 70.225 ( -6.043 14.155 -19.484) 24.830 ======================= Grid point 198 (91/204) ======================= q-point: (-0.18 -0.45 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.235 ( -15.148 -6.050 -0.522) 16.320 2.373 ( -15.665 -4.979 4.218) 16.970 2.746 ( 2.120 3.880 5.730) 7.238 2.901 ( -7.524 3.355 -4.203) 9.248 3.151 ( -3.287 -0.029 -4.191) 5.326 3.248 ( 5.970 -0.256 3.578) 6.965 3.631 ( -5.499 -2.346 7.188) 9.349 4.075 ( 7.348 -2.294 1.416) 7.827 4.204 ( 1.820 2.151 -2.001) 3.456 4.284 ( -1.393 6.647 0.654) 6.823 4.637 ( 0.494 8.280 -0.519) 8.311 4.860 ( 3.359 5.269 -2.912) 6.894 5.129 ( 4.414 1.419 -1.853) 4.993 5.701 ( -6.249 5.425 0.552) 8.294 5.938 ( -5.845 -1.987 0.838) 6.230 6.032 ( 6.514 0.624 -2.655) 7.062 6.340 ( 6.288 -0.151 -3.927) 7.415 6.414 ( -1.359 -0.562 3.060) 3.395 6.807 ( -3.703 -1.106 1.279) 4.071 6.993 ( -10.497 1.154 -0.055) 10.560 7.272 ( 0.776 -5.401 -1.211) 5.589 7.368 ( -4.826 -3.474 -0.401) 5.960 7.672 ( -6.880 1.283 2.664) 7.488 7.963 ( 3.765 -0.274 -3.319) 5.027 8.066 ( -2.963 0.024 2.824) 4.093 8.344 ( 1.001 1.978 0.900) 2.392 8.793 ( -7.841 0.884 -0.780) 7.929 8.914 ( -3.753 0.035 -1.496) 4.040 11.059 ( 15.573 4.635 0.092) 16.248 12.293 ( 24.252 -13.146 -1.794) 27.644 12.472 ( 0.873 1.636 1.152) 2.183 12.967 ( -7.899 5.501 0.329) 9.632 14.374 ( -32.789 22.926 0.842) 40.017 15.121 ( -39.331 20.932 0.484) 44.557 16.755 ( -6.950 -6.307 0.136) 9.386 17.174 ( 3.242 5.216 -4.645) 7.700 26.848 ( 0.117 -0.570 -0.029) 0.583 26.888 ( 0.192 -0.587 0.430) 0.752 26.950 ( 0.118 -0.862 -0.052) 0.871 27.043 ( 0.988 -0.917 -0.701) 1.519 27.997 ( 0.363 0.407 0.733) 0.914 28.131 ( 1.282 0.490 -0.906) 1.645 33.703 ( 0.499 -0.447 1.239) 1.409 33.973 ( 0.562 -0.074 -2.868) 2.923 34.567 ( -3.842 4.148 1.646) 5.888 34.702 ( -3.304 1.632 -0.194) 3.690 35.472 ( -2.672 3.548 2.167) 4.942 35.879 ( 0.878 0.422 -0.990) 1.389 37.210 ( -0.252 -2.218 -0.810) 2.375 37.298 ( 0.937 -1.467 0.073) 1.742 43.033 ( -35.794 23.546 -1.360) 42.865 43.953 ( -30.118 20.189 3.770) 36.454 44.715 ( 1.585 3.819 2.097) 4.637 45.322 ( -0.378 -4.832 -5.920) 7.651 45.488 ( -7.732 2.210 6.730) 10.486 45.857 ( -15.582 2.785 -6.883) 17.260 46.647 ( -8.233 2.988 4.180) 9.705 47.661 ( -8.891 -3.757 -2.123) 9.883 50.068 ( -14.923 13.481 0.231) 20.112 50.557 ( -18.201 10.937 -1.222) 21.269 51.180 ( -9.996 5.414 0.596) 11.384 53.780 ( -1.933 -22.033 -4.520) 22.575 61.054 ( 35.240 -3.765 3.192) 35.584 63.353 ( 72.710 1.735 -6.927) 73.060 66.846 ( -15.353 -5.293 6.269) 17.407 69.781 ( -18.222 19.269 -15.512) 30.724 ======================= Grid point 199 (92/204) ======================= q-point: (-0.09 -0.45 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.140 ( -18.505 -4.870 -4.824) 19.734 2.217 ( -12.950 -1.694 5.088) 14.017 2.752 ( -2.579 6.967 0.060) 7.430 2.864 ( 8.018 -3.971 6.846) 11.266 3.105 ( -4.934 -2.705 -3.870) 6.829 3.344 ( 6.802 -2.102 2.671) 7.604 3.521 ( -6.724 4.106 2.346) 8.220 4.109 ( -0.722 9.141 4.900) 10.396 4.251 ( 2.368 -0.959 -2.382) 3.493 4.269 ( 4.017 -7.089 -0.501) 8.163 4.538 ( -1.101 3.716 -1.211) 4.061 4.792 ( 2.763 5.658 -1.513) 6.476 5.195 ( 5.821 -1.571 -0.249) 6.034 5.475 ( -11.196 6.750 -2.308) 13.276 5.947 ( 0.325 -1.006 0.356) 1.116 6.078 ( 0.512 -1.175 -0.148) 1.290 6.363 ( 2.443 1.413 -3.301) 4.343 6.455 ( 1.817 -1.796 1.055) 2.764 6.797 ( -0.049 -0.605 0.735) 0.953 6.876 ( -7.611 0.119 -0.259) 7.616 7.301 ( -5.100 -0.760 3.663) 6.325 7.422 ( 2.703 -4.230 -1.983) 5.397 7.625 ( -2.605 -1.770 0.323) 3.166 7.923 ( -3.526 2.002 0.061) 4.055 8.137 ( 4.364 -3.614 -0.868) 5.732 8.330 ( 1.262 2.039 1.797) 2.997 8.701 ( -4.971 0.588 -0.897) 5.086 8.878 ( -4.352 -1.662 -1.512) 4.898 11.138 ( 10.803 4.716 -0.074) 11.788 12.389 ( -4.276 7.852 -1.458) 9.059 12.439 ( -15.825 13.753 0.738) 20.979 12.937 ( 23.872 -14.310 0.314) 27.834 13.941 ( -10.644 5.320 0.564) 11.913 14.367 ( -35.921 19.249 0.730) 40.761 16.781 ( -6.563 -6.426 1.253) 9.270 17.118 ( -0.656 2.678 -5.941) 6.549 26.860 ( 0.266 -0.609 -0.134) 0.678 26.896 ( -0.293 -0.275 0.590) 0.714 26.967 ( 0.544 -0.687 -0.045) 0.878 27.063 ( 0.591 -0.699 -0.810) 1.223 27.996 ( 0.260 0.441 0.673) 0.846 28.134 ( 0.935 0.488 -0.833) 1.344 33.709 ( 0.038 0.182 0.737) 0.760 33.985 ( 0.938 -1.127 -2.448) 2.853 34.468 ( -3.331 3.523 1.226) 5.001 34.644 ( -2.790 1.225 0.190) 3.053 35.398 ( -2.770 2.366 2.894) 4.653 35.874 ( 0.799 0.989 -1.766) 2.176 37.243 ( 0.146 -2.168 -0.569) 2.246 37.326 ( 0.408 -1.139 -0.075) 1.212 42.453 ( -19.714 6.627 -1.342) 20.841 43.238 ( -31.379 24.309 1.875) 39.738 44.671 ( -0.369 3.201 2.994) 4.398 45.279 ( -2.858 3.270 -4.464) 6.228 45.454 ( -4.911 -2.896 3.476) 6.677 45.673 ( -7.119 -0.431 -1.672) 7.325 46.645 ( -1.303 -4.880 -0.383) 5.066 47.628 ( -6.363 -3.650 -0.837) 7.383 49.769 ( -9.123 5.839 0.085) 10.832 50.357 ( -4.445 2.506 -0.816) 5.168 51.016 ( -9.732 1.755 0.582) 9.906 54.057 ( 4.724 -12.960 -4.576) 14.534 61.422 ( 14.750 -4.370 5.356) 16.290 64.013 ( 51.890 5.045 -12.906) 53.708 66.705 ( -13.220 1.901 3.144) 13.721 69.252 ( -19.899 13.560 -10.686) 26.345 ======================= Grid point 207 (93/204) ======================= q-point: (-0.36 -0.36 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.242 ( -8.600 -0.000 5.502) 10.210 2.312 ( -18.620 -0.000 -0.637) 18.631 2.962 ( -2.537 -0.000 6.077) 6.586 2.973 ( -0.151 -0.000 -6.966) 6.968 3.123 ( 0.938 0.000 -7.589) 7.646 3.226 ( 0.908 0.000 7.787) 7.840 3.413 ( 0.488 0.000 7.673) 7.688 4.110 ( -2.079 -0.000 2.646) 3.366 4.308 ( -8.057 -0.000 -0.936) 8.111 4.509 ( 7.129 0.000 5.472) 8.987 4.764 ( 2.554 0.000 -4.399) 5.086 4.911 ( 10.521 0.000 -2.721) 10.867 5.486 ( 1.846 0.000 -1.849) 2.613 5.565 ( -0.739 -0.000 -2.948) 3.039 5.940 ( 9.051 0.000 -0.885) 9.094 6.216 ( -5.613 -0.000 0.298) 5.621 6.280 ( 2.005 0.000 1.647) 2.595 6.374 ( -4.838 -0.000 -5.624) 7.419 6.795 ( -6.959 -0.000 5.834) 9.081 7.020 ( 3.247 0.000 -2.371) 4.021 7.188 ( -10.414 -0.000 -1.638) 10.542 7.368 ( -15.269 -0.000 -1.264) 15.321 7.801 ( 7.112 0.000 -5.581) 9.040 7.922 ( -18.093 -0.000 9.044) 20.228 8.325 ( -12.592 -0.000 5.308) 13.665 8.333 ( -0.026 -0.000 -4.038) 4.038 8.817 ( -6.612 -0.000 -1.304) 6.740 9.032 ( -6.776 -0.000 -1.251) 6.890 11.138 ( 26.868 0.000 2.542) 26.988 11.417 ( 26.232 0.000 -2.915) 26.393 12.667 ( 0.896 0.000 -0.902) 1.271 12.776 ( 6.360 0.000 1.621) 6.563 15.498 ( -23.627 -0.000 6.143) 24.412 16.191 ( -21.134 -0.000 -5.004) 21.718 16.573 ( -25.734 -0.000 1.392) 25.772 17.373 ( -0.930 -0.000 -4.828) 4.917 26.833 ( -0.167 -0.000 0.016) 0.168 26.871 ( 0.041 0.000 0.143) 0.149 26.919 ( -0.129 -0.000 0.324) 0.349 27.012 ( 0.746 0.000 -0.848) 1.130 28.002 ( 0.527 0.000 0.818) 0.973 28.132 ( 1.550 0.000 -1.019) 1.855 33.669 ( 0.825 0.000 1.846) 2.022 33.986 ( 1.133 0.000 -3.448) 3.629 34.706 ( -1.031 -0.000 4.673) 4.785 34.793 ( -6.285 -0.000 -2.949) 6.942 35.594 ( -1.748 -0.000 1.164) 2.100 35.871 ( 0.492 0.000 -0.038) 0.493 37.161 ( -0.527 -0.000 -0.950) 1.086 37.248 ( 0.742 0.000 0.047) 0.744 44.202 ( -12.756 -0.000 -0.474) 12.765 44.757 ( -12.718 -0.000 9.664) 15.973 44.866 ( 6.307 0.000 -2.195) 6.678 45.090 ( -17.067 -0.000 -9.119) 19.350 45.658 ( -19.938 -0.000 -3.377) 20.222 45.711 ( -8.942 -0.000 6.343) 10.964 47.179 ( -11.109 -0.000 9.744) 14.777 47.669 ( -16.870 -0.000 -7.910) 18.632 50.537 ( -13.268 -0.000 2.467) 13.495 51.453 ( -33.171 -0.000 4.366) 33.457 52.449 ( -39.435 -0.000 15.014) 42.196 52.479 ( -7.123 -0.000 -27.868) 28.763 60.513 ( 40.672 0.000 0.974) 40.684 62.640 ( 79.434 0.000 -5.977) 79.658 66.636 ( -12.264 -0.000 16.684) 20.707 70.462 ( 0.696 0.000 -23.185) 23.196 ======================= Grid point 208 (94/204) ======================= q-point: (-0.27 -0.36 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.100 ( -19.426 -1.864 1.133) 19.548 2.171 ( -14.035 -4.463 3.973) 15.254 2.909 ( -2.399 2.874 1.617) 4.077 2.929 ( -7.725 -1.096 -3.486) 8.546 3.108 ( -2.992 0.130 -4.191) 5.151 3.287 ( 7.529 0.708 3.074) 8.163 3.464 ( -0.120 -4.055 9.917) 10.715 4.083 ( -1.401 0.939 2.088) 2.684 4.235 ( -3.372 0.443 -0.698) 3.472 4.531 ( 3.998 6.661 2.839) 8.271 4.807 ( 0.210 -2.101 -4.836) 5.277 4.970 ( 9.377 5.682 2.083) 11.160 5.352 ( -0.637 10.549 -4.397) 11.446 5.655 ( 0.240 -7.908 -2.101) 8.186 5.993 ( -6.214 4.744 1.900) 8.046 6.090 ( 0.974 2.919 -2.064) 3.705 6.319 ( 2.677 -0.801 2.797) 3.954 6.355 ( -2.883 -4.133 -6.018) 7.848 6.747 ( -5.451 -1.220 4.799) 7.364 7.047 ( -7.964 2.187 0.078) 8.260 7.089 ( -0.481 -4.721 -4.553) 6.576 7.230 ( -11.358 -4.296 -1.916) 12.294 7.731 ( -12.573 2.132 5.868) 14.038 7.891 ( 4.049 -2.938 -3.667) 6.203 8.163 ( -7.092 5.154 4.412) 9.815 8.343 ( -2.906 -2.653 -1.061) 4.076 8.760 ( -6.915 -1.958 -1.517) 7.345 8.930 ( -8.795 0.936 -1.146) 8.918 11.331 ( 25.614 11.378 1.452) 28.065 11.849 ( 27.092 -13.767 -1.991) 30.454 12.625 ( 3.835 6.151 0.203) 7.251 12.926 ( 7.891 -5.015 0.983) 9.401 15.086 ( -32.851 15.829 5.736) 36.914 15.724 ( -33.081 18.009 -2.905) 37.778 16.411 ( -24.348 -14.288 1.393) 28.265 17.310 ( -2.772 2.613 -7.931) 8.798 26.834 ( 0.053 -0.288 -0.062) 0.299 26.874 ( 0.164 -0.227 0.212) 0.351 26.924 ( -0.079 -0.647 0.306) 0.720 27.021 ( 0.741 -0.408 -0.868) 1.212 28.009 ( 0.686 0.238 0.831) 1.104 28.146 ( 1.718 0.344 -1.089) 2.062 33.687 ( 1.036 -0.375 1.677) 2.006 33.988 ( 1.253 0.568 -3.194) 3.478 34.672 ( -4.490 2.568 1.503) 5.386 34.720 ( -4.943 -0.487 0.026) 4.967 35.562 ( -2.120 1.767 1.318) 3.058 35.878 ( 0.412 -0.249 0.043) 0.483 37.158 ( -0.730 -0.899 -1.095) 1.594 37.262 ( 0.827 -0.691 0.224) 1.101 43.827 ( -28.949 21.583 -0.603) 36.114 44.469 ( -20.983 13.845 5.897) 25.821 44.818 ( -7.273 2.260 -1.257) 7.719 45.032 ( -1.695 -10.069 -3.226) 10.708 45.547 ( -9.097 -4.683 -2.525) 10.539 45.645 ( -15.687 -7.905 3.233) 17.861 46.940 ( -20.121 11.471 7.186) 24.250 47.495 ( -16.970 -6.079 -6.588) 19.192 50.369 ( -11.794 4.083 2.134) 12.662 51.055 ( -34.149 6.258 4.075) 34.956 51.527 ( -27.673 34.070 -2.528) 43.965 52.881 ( -6.571 -37.985 -13.622) 40.885 60.962 ( 34.953 -1.918 -0.108) 35.006 63.497 ( 81.440 4.981 -6.814) 81.876 66.616 ( -7.770 -6.629 12.830) 16.399 70.300 ( -6.855 11.102 -23.923) 27.250 ======================= Grid point 209 (95/204) ======================= q-point: (-0.18 -0.36 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.937 ( -20.367 -5.849 1.055) 21.216 2.087 ( -19.557 -6.910 4.146) 21.152 2.810 ( -8.783 2.196 -1.336) 9.151 2.868 ( 1.816 2.024 3.453) 4.395 3.040 ( -7.706 -1.887 -7.745) 11.087 3.367 ( 8.531 1.900 2.246) 9.024 3.556 ( -2.888 -4.870 9.927) 11.428 4.083 ( 0.251 -1.970 0.800) 2.141 4.221 ( 1.272 -0.388 -0.436) 1.400 4.424 ( -0.059 10.879 2.077) 11.076 4.713 ( -5.143 6.453 -5.023) 9.660 5.015 ( 7.823 4.356 3.922) 9.775 5.221 ( 3.190 5.728 -3.546) 7.454 5.707 ( -13.874 8.597 -1.107) 16.359 5.773 ( -4.601 -8.771 -0.464) 9.915 6.106 ( 0.061 1.157 -1.657) 2.021 6.360 ( -2.994 -3.489 2.531) 5.248 6.404 ( 7.363 -0.560 -4.729) 8.769 6.733 ( -3.304 -2.221 3.882) 5.561 6.908 ( -8.219 1.627 -0.767) 8.413 7.168 ( -1.663 -6.493 -2.720) 7.233 7.252 ( -0.137 -6.168 -1.595) 6.372 7.605 ( -7.987 0.249 3.589) 8.760 7.964 ( 0.470 -1.733 -1.753) 2.509 8.055 ( -1.730 1.509 2.011) 3.052 8.352 ( -1.354 -1.784 1.088) 2.490 8.694 ( -7.996 -0.858 -1.865) 8.256 8.825 ( -8.517 -0.756 -1.168) 8.630 11.410 ( 20.395 12.235 0.605) 23.791 12.354 ( 23.564 -13.492 -1.922) 27.221 12.607 ( 10.739 5.119 1.558) 11.998 12.995 ( -1.992 6.638 0.761) 6.972 14.363 ( -33.710 23.435 2.589) 41.137 14.993 ( -40.358 20.950 -0.516) 45.475 16.405 ( -22.320 -17.248 2.459) 28.315 17.208 ( -4.940 2.206 -10.736) 12.022 26.842 ( 0.250 -0.487 -0.138) 0.565 26.882 ( 0.140 -0.470 0.261) 0.555 26.938 ( 0.306 -1.013 0.250) 1.087 27.036 ( 0.628 -0.842 -0.871) 1.364 28.013 ( 0.748 0.527 0.800) 1.215 28.154 ( 1.612 0.690 -1.073) 2.056 33.709 ( 0.990 -0.302 1.300) 1.662 33.981 ( 1.016 0.898 -2.771) 3.085 34.563 ( -6.659 2.467 -0.886) 7.156 34.677 ( -3.917 0.662 2.304) 4.592 35.498 ( -2.943 3.334 1.744) 4.777 35.888 ( 0.633 -0.191 -0.385) 0.765 37.170 ( -0.635 -2.026 -0.993) 2.344 37.287 ( 0.690 -1.223 0.313) 1.439 43.007 ( -38.277 27.923 -1.144) 47.393 43.957 ( -26.852 20.940 2.897) 34.174 44.738 ( -8.123 -1.060 3.419) 8.876 45.169 ( -1.208 -9.891 -2.748) 10.337 45.447 ( -9.970 3.810 2.446) 10.950 45.630 ( -13.036 -8.528 -4.021) 16.089 46.544 ( -20.166 5.024 2.503) 20.932 47.435 ( -13.430 -8.938 -3.342) 16.475 50.107 ( -15.694 13.386 1.647) 20.693 50.531 ( -16.939 12.221 -1.387) 20.933 51.012 ( -23.295 1.990 1.549) 23.431 53.395 ( 5.426 -33.468 -14.768) 36.982 61.315 ( 20.070 -2.639 -0.215) 20.243 64.245 ( 72.765 9.478 -8.277) 73.845 66.677 ( -3.160 -4.413 6.628) 8.567 69.826 ( -21.674 21.894 -21.979) 37.844 ======================= Grid point 210 (96/204) ======================= q-point: (-0.09 -0.36 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.820 ( -19.823 -7.695 -0.157) 21.265 1.965 ( -20.388 -7.439 5.944) 22.502 2.716 ( -5.367 -1.235 -5.106) 7.510 2.928 ( 0.816 -4.228 0.971) 4.414 2.976 ( -1.911 -2.053 -1.798) 3.331 3.408 ( 1.019 2.190 4.860) 5.427 3.561 ( 0.531 2.595 4.894) 5.565 4.131 ( -8.782 -4.646 0.079) 9.936 4.240 ( -0.997 6.482 3.126) 7.266 4.273 ( 4.330 -0.670 0.004) 4.381 4.574 ( -1.195 5.083 -3.884) 6.508 4.956 ( 1.511 9.588 1.398) 9.806 5.242 ( 5.242 -0.774 0.368) 5.311 5.452 ( -8.048 5.312 -3.213) 10.164 5.871 ( -2.819 -8.081 0.006) 8.559 6.028 ( -9.494 1.109 -1.208) 9.634 6.380 ( -0.849 -1.410 1.089) 1.973 6.465 ( 4.006 0.820 -3.574) 5.431 6.762 ( -0.571 -2.691 2.951) 4.035 6.826 ( -1.895 0.725 -1.564) 2.561 7.229 ( -2.504 -3.871 1.528) 4.857 7.343 ( -0.381 -4.902 -0.783) 4.979 7.574 ( -1.222 -2.728 -0.776) 3.088 7.919 ( -3.034 2.040 1.389) 3.911 8.094 ( -0.536 -3.450 -1.385) 3.756 8.361 ( -0.990 0.496 2.397) 2.640 8.645 ( -1.959 -3.146 -1.129) 3.874 8.752 ( -8.746 -2.457 -1.582) 9.221 11.417 ( 13.858 11.791 0.427) 18.201 12.469 ( -24.660 20.706 0.660) 32.207 12.603 ( 14.429 10.959 -0.897) 18.141 12.965 ( 22.573 -16.331 0.417) 27.865 13.920 ( -9.343 6.548 0.858) 11.441 14.246 ( -34.640 16.792 0.209) 38.496 16.427 ( -22.831 -17.311 3.246) 28.835 17.077 ( -9.624 0.847 -11.773) 15.230 26.853 ( 0.335 -0.583 -0.215) 0.706 26.889 ( -0.290 -0.313 0.346) 0.550 26.961 ( 0.735 -0.986 0.202) 1.246 27.054 ( 0.334 -0.903 -0.920) 1.331 28.013 ( 0.679 0.790 0.725) 1.269 28.155 ( 1.256 0.946 -0.967) 1.846 33.720 ( 0.705 0.378 0.780) 1.117 33.980 ( 1.146 -0.184 -2.249) 2.531 34.460 ( -5.624 1.500 -0.406) 5.835 34.620 ( -4.647 1.110 1.847) 5.122 35.410 ( -3.762 3.238 2.320) 5.480 35.892 ( 0.724 0.562 -1.228) 1.533 37.202 ( -0.165 -2.919 -0.659) 2.997 37.311 ( 0.166 -1.169 0.185) 1.195 42.332 ( -22.556 9.508 -1.568) 24.528 43.270 ( -28.903 23.525 1.283) 37.289 44.670 ( -8.371 -1.112 5.034) 9.832 45.259 ( -2.972 -0.714 -5.015) 5.873 45.309 ( -8.781 -5.887 4.867) 11.638 45.570 ( -6.294 -0.448 -3.029) 7.000 46.428 ( -13.738 -11.034 -0.515) 17.628 47.440 ( -9.395 -9.264 -2.334) 13.399 49.755 ( -11.388 7.476 0.252) 13.625 50.345 ( -3.453 2.087 -0.973) 4.150 50.794 ( -20.530 -3.569 2.344) 20.970 53.919 ( 14.629 -23.623 -16.044) 32.085 61.448 ( -2.344 -0.518 0.401) 2.434 64.684 ( 39.732 19.508 -13.374) 46.240 66.678 ( 1.298 2.342 2.942) 3.978 69.178 ( -26.198 14.623 -14.477) 33.312 ======================= Grid point 219 (97/204) ======================= q-point: (-0.27 -0.27 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.841 ( -23.037 -0.000 1.908) 23.116 1.969 ( -18.564 -0.000 4.104) 19.012 2.792 ( -11.030 -0.000 -4.710) 11.993 2.904 ( -2.117 -0.000 -5.739) 6.117 3.096 ( -1.371 -0.000 3.637) 3.887 3.385 ( 1.094 0.000 7.050) 7.134 3.422 ( 0.729 0.000 4.466) 4.525 4.072 ( -1.920 -0.000 2.896) 3.474 4.219 ( 0.334 0.000 1.248) 1.292 4.646 ( 2.552 0.000 3.840) 4.611 4.777 ( 0.190 0.000 -5.215) 5.219 5.106 ( 5.255 0.000 1.509) 5.467 5.471 ( -3.699 -0.000 0.957) 3.820 5.488 ( -2.933 -0.000 -8.281) 8.785 5.977 ( -13.973 -0.000 -0.313) 13.976 6.001 ( -13.226 -0.000 1.608) 13.324 6.315 ( 9.066 0.000 -6.842) 11.358 6.358 ( 3.042 0.000 1.888) 3.581 6.713 ( -1.677 -0.000 4.498) 4.800 6.954 ( -6.352 -0.000 -2.281) 6.749 7.044 ( -9.994 -0.000 -2.359) 10.268 7.110 ( 5.286 0.000 -2.656) 5.916 7.618 ( -11.355 -0.000 6.821) 13.247 7.901 ( 2.650 0.000 -4.430) 5.162 8.163 ( -4.890 -0.000 7.717) 9.136 8.252 ( -4.336 -0.000 -4.021) 5.914 8.679 ( -5.140 -0.000 -1.294) 5.301 8.823 ( -10.264 -0.000 -1.502) 10.374 11.755 ( 23.861 0.000 3.787) 24.159 11.981 ( 24.042 0.000 -4.504) 24.460 12.732 ( 4.979 0.000 0.844) 5.050 13.033 ( 17.363 0.000 1.088) 17.397 14.854 ( -35.656 -0.000 7.454) 36.427 15.569 ( -31.867 -0.000 -4.349) 32.163 15.877 ( -36.626 -0.000 4.199) 36.866 17.238 ( -7.879 -0.000 -14.216) 16.253 26.834 ( 0.316 0.000 -0.151) 0.350 26.874 ( 0.196 0.000 0.139) 0.241 26.919 ( 0.011 0.000 0.493) 0.494 27.022 ( 0.522 0.000 -1.010) 1.137 28.022 ( 0.885 0.000 0.881) 1.249 28.166 ( 1.890 0.000 -1.242) 2.261 33.701 ( 1.243 0.000 1.588) 2.017 34.004 ( 1.879 0.000 -3.027) 3.563 34.606 ( -8.985 -0.000 -3.170) 9.528 34.684 ( -2.973 -0.000 4.544) 5.430 35.557 ( -1.986 -0.000 1.427) 2.445 35.878 ( 0.025 0.000 0.229) 0.230 37.138 ( -1.208 -0.000 -1.078) 1.619 37.266 ( 0.745 0.000 0.337) 0.818 43.691 ( -34.262 -0.000 1.651) 34.301 44.435 ( -17.049 -0.000 10.959) 20.267 44.486 ( -31.687 -0.000 -8.421) 32.787 45.006 ( 5.511 0.000 -2.765) 6.166 45.324 ( -8.000 -0.000 -0.233) 8.003 45.514 ( -9.322 -0.000 1.774) 9.489 46.840 ( -23.363 -0.000 10.211) 25.497 47.169 ( -22.166 -0.000 -12.480) 25.438 50.282 ( -9.823 -0.000 2.472) 10.129 50.783 ( -23.206 -0.000 3.666) 23.494 51.597 ( -41.878 -0.000 18.168) 45.649 52.280 ( -0.759 -0.000 -44.735) 44.741 61.272 ( 23.088 0.000 -2.567) 23.231 64.438 ( 80.779 0.000 -10.531) 81.462 66.562 ( 1.609 0.000 12.678) 12.779 70.252 ( -8.932 -0.000 -31.169) 32.424 ======================= Grid point 220 (98/204) ======================= q-point: (-0.18 -0.27 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.617 ( -23.379 -4.282 3.619) 24.041 1.769 ( -23.760 -3.684 4.352) 24.434 2.673 ( -11.553 -2.645 -5.842) 13.214 2.853 ( -5.308 -1.005 -11.351) 12.571 3.025 ( -2.262 7.233 8.918) 11.704 3.380 ( -11.467 -8.757 10.035) 17.575 3.507 ( 8.027 0.454 -0.927) 8.093 4.063 ( -0.693 0.498 3.477) 3.580 4.251 ( 4.232 -0.084 3.286) 5.358 4.583 ( -2.129 9.765 2.556) 10.316 4.725 ( -3.566 3.607 -6.095) 7.929 5.123 ( 1.086 1.090 4.466) 4.723 5.334 ( -0.380 6.275 -3.923) 7.410 5.509 ( -15.064 -5.516 -0.684) 16.057 5.718 ( -6.508 3.540 -4.048) 8.442 5.952 ( -15.228 -7.163 -0.599) 16.839 6.354 ( 2.866 2.183 1.291) 3.827 6.458 ( 8.624 -2.427 -4.877) 10.200 6.718 ( 0.981 0.062 3.702) 3.831 6.876 ( -1.973 2.636 -0.798) 3.388 7.032 ( -1.816 -6.798 -2.377) 7.427 7.200 ( 4.969 -3.962 -2.321) 6.766 7.529 ( -6.913 -0.232 4.818) 8.430 7.918 ( -1.969 -2.276 -1.604) 3.411 8.085 ( -1.683 4.143 2.131) 4.954 8.267 ( -2.699 -5.696 0.726) 6.345 8.613 ( -5.588 0.844 -1.785) 5.927 8.711 ( -9.065 -0.681 -1.466) 9.208 11.838 ( 17.706 14.595 1.301) 22.983 12.385 ( 20.978 -14.778 -2.387) 25.771 12.775 ( 5.603 2.215 3.043) 6.750 13.198 ( 16.006 9.838 0.323) 18.790 14.316 ( -33.789 16.805 5.316) 38.110 14.877 ( -39.945 23.981 -1.702) 46.622 15.766 ( -33.920 -24.969 3.908) 42.300 17.083 ( -12.709 -0.323 -20.902) 24.465 26.840 ( 0.521 -0.232 -0.233) 0.616 26.879 ( 0.170 -0.226 0.068) 0.291 26.928 ( 0.334 -0.845 0.533) 1.053 27.029 ( 0.351 -0.533 -1.081) 1.255 28.032 ( 0.977 0.345 0.884) 1.362 28.180 ( 1.792 0.524 -1.295) 2.273 33.721 ( 1.360 -0.170 1.317) 1.901 34.009 ( 1.903 1.330 -2.756) 3.604 34.489 ( -9.319 0.471 -2.605) 9.688 34.651 ( -4.150 0.595 3.943) 5.755 35.518 ( -2.416 2.652 1.838) 4.031 35.884 ( 0.149 -0.741 -0.164) 0.773 37.130 ( -1.453 -1.348 -0.816) 2.143 37.280 ( 0.601 -0.667 0.424) 0.993 43.011 ( -39.016 27.681 0.683) 47.843 43.982 ( -26.260 17.377 -0.135) 31.489 44.397 ( -25.244 -14.826 5.369) 29.763 45.088 ( 3.002 -3.751 1.243) 4.963 45.328 ( -10.745 -5.324 3.903) 12.611 45.421 ( -1.835 -2.745 -10.285) 10.802 46.410 ( -27.919 12.435 2.735) 30.686 47.056 ( -19.150 -15.261 -8.290) 25.852 50.126 ( -12.531 8.840 3.274) 15.681 50.528 ( -13.846 8.266 0.667) 16.139 50.870 ( -27.484 18.661 1.725) 33.265 52.685 ( -4.608 -51.735 -37.208) 63.892 61.447 ( 8.595 0.184 -4.130) 9.538 65.193 ( 70.922 11.110 -14.759) 73.288 66.679 ( 8.854 -2.195 8.897) 12.742 69.851 ( -22.548 21.221 -36.574) 47.920 ======================= Grid point 221 (99/204) ======================= q-point: (-0.09 -0.27 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.470 ( -21.730 -8.082 4.450) 23.607 1.594 ( -24.488 -9.051 6.676) 26.947 2.596 ( -8.113 -4.399 -7.070) 11.626 2.748 ( -10.620 -2.172 -13.524) 17.332 2.980 ( -3.286 -3.533 9.615) 10.757 3.395 ( -8.540 -3.226 7.819) 12.019 3.571 ( 2.959 -1.555 -0.814) 3.440 4.028 ( -4.468 3.697 3.729) 6.895 4.324 ( 6.496 0.123 4.861) 8.114 4.340 ( -6.636 10.082 0.957) 12.108 4.643 ( 1.506 3.984 -3.937) 5.800 5.045 ( -9.060 5.816 2.629) 11.082 5.277 ( 1.700 -1.057 -0.165) 2.009 5.430 ( -3.447 -1.500 -4.037) 5.516 5.654 ( -12.607 -3.589 -3.627) 13.601 5.899 ( -7.305 -4.403 -0.780) 8.565 6.351 ( -1.185 0.045 3.646) 3.834 6.535 ( 5.662 1.673 -6.767) 8.980 6.751 ( 2.108 -0.702 2.638) 3.449 6.851 ( 3.582 1.674 -0.455) 3.980 7.130 ( -0.426 -6.480 -0.477) 6.512 7.299 ( 2.345 -2.370 0.256) 3.344 7.507 ( -1.748 -3.258 -0.059) 3.698 7.905 ( -3.876 -0.308 2.369) 4.553 8.047 ( -1.014 0.008 -1.928) 2.178 8.327 ( -2.834 -3.175 3.475) 5.495 8.555 ( -2.914 -3.019 -2.430) 4.849 8.644 ( -4.667 -1.959 -1.001) 5.160 11.773 ( 11.970 15.171 0.754) 19.339 12.513 ( -25.546 21.166 2.764) 33.291 12.915 ( 18.505 -13.218 -1.912) 22.821 13.034 ( 17.411 13.604 0.357) 22.098 13.944 ( -6.707 8.160 1.236) 10.634 14.116 ( -30.565 14.332 -0.407) 33.761 15.787 ( -33.913 -25.098 4.471) 42.427 16.859 ( -20.895 -1.801 -23.427) 31.443 26.850 ( 0.494 -0.342 -0.290) 0.667 26.883 ( -0.134 -0.196 0.051) 0.242 26.954 ( 0.817 -1.248 0.451) 1.559 27.040 ( 0.154 -0.876 -1.123) 1.433 28.036 ( 0.916 0.776 0.813) 1.450 28.184 ( 1.454 1.029 -1.186) 2.140 33.739 ( 1.411 0.288 0.880) 1.688 33.998 ( 1.454 1.380 -2.216) 2.988 34.385 ( -7.962 -0.672 -1.707) 8.170 34.589 ( -5.541 1.540 3.178) 6.570 35.427 ( -4.297 4.374 2.186) 6.510 35.898 ( 0.637 -0.403 -1.125) 1.354 37.148 ( -0.962 -3.070 -0.308) 3.232 37.298 ( 0.162 -0.860 0.337) 0.938 42.249 ( -25.810 16.072 -1.821) 30.460 43.314 ( -28.409 23.654 -0.041) 36.968 44.372 ( -23.772 -15.760 7.198) 29.416 45.146 ( -6.096 -3.383 5.144) 8.664 45.222 ( -4.303 0.859 -0.081) 4.389 45.507 ( 2.264 -3.836 -12.097) 12.891 46.075 ( -20.838 -6.755 -0.435) 21.909 47.105 ( -13.674 -17.143 -7.123) 23.056 49.751 ( -14.713 11.125 0.537) 18.453 50.344 ( -2.505 2.718 -1.142) 3.868 50.565 ( -14.667 -0.245 1.821) 14.782 53.388 ( -0.119 -51.858 -39.817) 65.381 61.414 ( -6.753 4.749 -4.331) 9.322 65.434 ( 26.585 35.393 -24.095) 50.398 66.805 ( 12.476 2.128 5.362) 13.745 69.051 ( -34.247 19.109 -24.655) 46.324 ======================= Grid point 231 (100/204) ======================= q-point: (-0.18 -0.18 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.318 ( -25.003 -0.000 6.570) 25.852 1.468 ( -26.992 -0.000 5.395) 27.526 2.472 ( -17.048 -0.000 -5.376) 17.876 2.755 ( -5.854 -0.000 -14.382) 15.528 3.004 ( -31.233 -0.000 9.719) 32.710 3.197 ( 6.971 0.000 6.961) 9.851 3.594 ( 5.894 0.000 -1.689) 6.131 4.095 ( 2.247 0.000 4.971) 5.455 4.328 ( 7.341 0.000 7.166) 10.259 4.660 ( -1.809 -0.000 4.202) 4.575 4.687 ( -6.256 -0.000 -8.958) 10.926 5.081 ( -10.514 -0.000 2.813) 10.884 5.296 ( -13.602 -0.000 -3.628) 14.078 5.323 ( -8.904 -0.000 1.880) 9.100 5.662 ( -2.467 -0.000 -6.610) 7.056 5.751 ( -7.314 -0.000 -1.399) 7.447 6.413 ( 1.058 0.000 2.778) 2.973 6.519 ( 8.661 0.000 -6.879) 11.061 6.746 ( 2.278 0.000 1.969) 3.010 6.925 ( 2.709 0.000 -0.952) 2.872 6.959 ( 3.151 0.000 -0.185) 3.157 7.223 ( 5.646 0.000 -2.417) 6.142 7.475 ( -4.363 -0.000 6.000) 7.419 7.855 ( -4.804 -0.000 -1.359) 4.993 8.147 ( -1.083 -0.000 5.878) 5.976 8.152 ( -2.230 -0.000 -3.256) 3.947 8.568 ( -4.335 -0.000 -0.678) 4.388 8.601 ( -7.853 -0.000 -2.623) 8.279 12.203 ( 15.986 0.000 4.052) 16.492 12.408 ( 15.763 0.000 -5.082) 16.562 12.826 ( -2.620 -0.000 6.297) 6.820 13.551 ( 26.300 0.000 -1.110) 26.323 14.098 ( -28.813 -0.000 5.715) 29.374 14.761 ( -37.095 -0.000 -4.045) 37.315 15.016 ( -41.433 -0.000 6.936) 42.010 16.823 ( -21.168 -0.000 -38.127) 43.609 26.845 ( 0.728 0.000 -0.324) 0.797 26.879 ( 0.171 0.000 -0.194) 0.259 26.926 ( 0.318 0.000 0.715) 0.782 27.024 ( 0.164 0.000 -1.223) 1.234 28.048 ( 1.047 0.000 0.950) 1.414 28.202 ( 1.733 0.000 -1.452) 2.261 33.740 ( 1.757 0.000 1.237) 2.149 34.043 ( 2.783 0.000 -2.889) 4.012 34.372 ( -10.309 -0.000 -2.410) 10.587 34.615 ( -4.818 -0.000 3.842) 6.163 35.528 ( -1.132 -0.000 2.266) 2.534 35.873 ( -0.478 -0.000 -0.508) 0.698 37.096 ( -2.075 -0.000 -0.334) 2.101 37.282 ( 0.526 0.000 0.472) 0.706 42.861 ( -35.375 -0.000 4.573) 35.670 43.682 ( -33.872 -0.000 -6.329) 34.458 44.136 ( -16.158 -0.000 12.216) 20.257 45.048 ( -1.776 -0.000 0.279) 1.798 45.231 ( -2.363 -0.000 2.297) 3.295 45.322 ( -6.489 -0.000 -22.504) 23.421 46.242 ( -33.184 -0.000 10.095) 34.685 46.579 ( -23.465 -0.000 -22.151) 32.268 50.089 ( -11.207 -0.000 5.179) 12.346 50.464 ( -7.872 -0.000 1.357) 7.988 50.821 ( -30.650 -0.000 11.538) 32.750 51.844 ( -17.566 -0.000 -74.943) 76.975 61.497 ( 1.575 0.000 -6.507) 6.695 66.020 ( 64.560 0.000 -28.186) 70.444 66.828 ( 15.091 0.000 10.439) 18.350 69.673 ( -27.511 -0.000 -61.453) 67.330 ======================= Grid point 232 (101/204) ======================= q-point: (-0.09 -0.18 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.114 ( -23.480 -6.902 9.392) 26.214 1.203 ( -27.837 -5.117 8.562) 29.570 2.282 ( -28.374 -10.398 -1.584) 30.261 2.617 ( -9.456 1.978 -9.669) 13.668 2.749 ( -18.950 -6.162 -0.409) 19.931 3.324 ( 6.064 -2.664 3.673) 7.574 3.608 ( -0.079 2.621 -1.203) 2.885 4.104 ( 1.382 4.253 4.751) 6.525 4.407 ( -10.288 9.313 3.014) 14.201 4.440 ( 7.042 3.525 5.114) 9.390 4.676 ( -0.959 0.437 -4.226) 4.356 4.947 ( -14.970 -1.994 3.679) 15.544 5.192 ( -7.904 -2.910 -4.508) 9.553 5.270 ( -7.083 -4.307 -0.740) 8.323 5.608 ( -0.481 3.750 -4.132) 5.601 5.761 ( -0.990 -6.533 -1.846) 6.861 6.383 ( -1.100 4.407 3.341) 5.638 6.590 ( 4.934 -0.325 -7.079) 8.635 6.786 ( 4.051 -0.400 0.399) 4.090 6.943 ( 5.357 2.229 0.623) 5.835 7.051 ( 3.469 -4.120 -0.526) 5.412 7.307 ( 4.810 -2.238 -0.452) 5.324 7.456 ( -1.879 -0.419 3.962) 4.405 7.827 ( -4.820 -3.560 0.352) 6.002 8.065 ( -0.685 3.383 0.203) 3.458 8.230 ( -2.625 -5.772 3.369) 7.180 8.500 ( -3.275 0.645 -1.986) 3.884 8.562 ( -1.820 -3.802 -1.248) 4.396 12.153 ( 8.889 19.076 1.308) 21.086 12.545 ( -23.606 16.853 6.092) 29.638 12.839 ( 15.956 -18.240 -1.345) 24.271 13.491 ( 6.839 24.138 -2.196) 25.184 14.006 ( -13.686 4.287 -0.907) 14.370 14.026 ( -10.100 14.135 0.550) 17.381 14.955 ( -39.430 -29.809 4.826) 49.665 16.416 ( -37.479 -4.166 -52.296) 64.474 26.852 ( 0.521 -0.005 -0.352) 0.629 26.880 ( 0.034 -0.123 -0.439) 0.457 26.944 ( 0.686 -1.308 0.646) 1.612 27.027 ( 0.064 -0.553 -1.266) 1.383 28.059 ( 0.948 0.460 0.931) 1.406 28.211 ( 1.446 0.684 -1.391) 2.120 33.765 ( 2.306 0.145 1.035) 2.532 34.043 ( 2.004 2.628 -2.702) 4.269 34.266 ( -8.990 -1.545 -1.677) 9.274 34.555 ( -5.908 1.504 3.317) 6.940 35.466 ( -3.598 6.085 2.192) 7.402 35.885 ( 0.387 -1.840 -1.532) 2.425 37.091 ( -1.692 -2.258 0.361) 2.845 37.291 ( 0.230 -0.377 0.397) 0.594 42.253 ( -27.419 24.220 -1.359) 36.610 43.308 ( -28.532 12.918 -2.806) 31.446 43.860 ( -27.321 -6.424 7.118) 28.955 45.039 ( -9.708 -0.703 4.384) 10.676 45.204 ( -1.233 -0.625 0.559) 1.491 45.340 ( 1.256 -20.432 -36.952) 42.243 45.816 ( -23.408 4.517 4.246) 24.215 46.535 ( -22.175 -26.843 -17.918) 39.158 49.772 ( -18.591 15.667 1.552) 24.361 50.365 ( -2.461 3.697 -1.545) 4.702 50.460 ( -9.177 3.248 -0.034) 9.735 52.110 ( -28.395 -73.818 -75.937) 109.644 61.431 ( -3.305 5.802 -6.463) 9.293 66.198 ( 12.396 43.854 -58.570) 74.211 67.017 ( 16.486 0.915 9.115) 18.860 68.854 ( -44.140 21.319 -50.038) 70.047 ======================= Grid point 243 (102/204) ======================= q-point: (-0.09 -0.09 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.814 ( -23.088 -0.000 15.897) 28.031 0.872 ( -28.244 -0.000 12.568) 30.913 1.702 ( -53.450 -0.000 14.447) 55.368 2.489 ( -10.374 -0.000 -5.438) 11.713 2.575 ( -2.293 -0.000 -16.147) 16.309 3.411 ( 10.154 0.000 0.018) 10.154 3.600 ( -5.959 -0.000 -2.857) 6.609 4.165 ( 1.266 0.000 2.483) 2.787 4.307 ( -23.107 -0.000 -3.176) 23.324 4.533 ( -0.999 -0.000 -3.928) 4.053 4.694 ( 3.428 0.000 7.664) 8.395 4.788 ( -1.538 -0.000 8.083) 8.228 5.124 ( -8.075 -0.000 -3.737) 8.898 5.143 ( -1.721 -0.000 0.393) 1.766 5.634 ( -3.599 -0.000 -0.717) 3.669 5.689 ( 3.753 0.000 -5.636) 6.771 6.437 ( -0.653 -0.000 1.722) 1.842 6.613 ( 3.564 0.000 -7.181) 8.017 6.820 ( 3.768 0.000 -0.436) 3.793 6.985 ( 2.044 0.000 -0.635) 2.140 7.120 ( 8.900 0.000 1.394) 9.009 7.339 ( 5.358 0.000 -2.345) 5.849 7.502 ( 5.619 0.000 12.216) 13.446 7.714 ( -6.420 -0.000 -1.446) 6.581 8.114 ( -4.494 -0.000 5.997) 7.494 8.144 ( 3.223 0.000 -0.183) 3.228 8.481 ( -1.369 -0.000 -3.079) 3.370 8.486 ( -2.518 -0.000 0.674) 2.606 12.392 ( -26.559 -0.000 9.135) 28.086 12.601 ( 19.178 0.000 4.735) 19.754 12.773 ( 12.191 0.000 -4.757) 13.086 13.827 ( -25.187 -0.000 -9.948) 27.080 13.842 ( -1.018 -0.000 4.396) 4.512 14.146 ( 5.354 0.000 -6.643) 8.532 14.154 ( -34.650 -0.000 4.351) 34.922 15.480 ( -94.037 -0.000 -109.958) 144.685 26.859 ( 0.668 0.000 -0.450) 0.805 26.871 ( -1.034 -0.000 -1.164) 1.557 26.938 ( 0.368 0.000 0.877) 0.951 27.021 ( 0.165 0.000 -1.092) 1.104 28.074 ( 0.761 0.000 1.040) 1.289 28.228 ( 1.252 0.000 -1.379) 1.862 33.801 ( 3.385 0.000 1.201) 3.592 34.094 ( 2.793 0.000 -3.982) 4.863 34.142 ( -8.923 -0.000 -0.929) 8.971 34.519 ( -5.104 -0.000 2.239) 5.574 35.521 ( -1.529 -0.000 -0.725) 1.692 35.850 ( -0.995 -0.000 -2.251) 2.461 37.053 ( -1.609 -0.000 1.032) 1.911 37.292 ( 0.134 0.000 0.384) 0.407 42.304 ( -15.343 -0.000 4.180) 15.903 43.006 ( -23.475 -0.000 -12.036) 26.381 43.729 ( -26.706 -0.000 11.625) 29.126 44.207 (-100.813 -0.000 -128.529) 163.350 44.980 ( -3.683 -0.000 4.836) 6.079 45.186 ( -3.305 -0.000 1.170) 3.506 45.590 ( -23.245 -0.000 6.715) 24.196 46.061 ( -8.729 -0.000 -9.251) 12.719 49.763 ( -17.185 -0.000 5.643) 18.087 50.365 ( -5.599 -0.000 -6.088) 8.271 50.451 ( -6.884 -0.000 1.559) 7.059 50.545 ( -61.503 -0.000 -82.318) 102.756 61.454 ( 0.593 0.000 -5.610) 5.641 66.294 ( -65.221 -0.000 -151.266) 164.728 67.199 ( 11.180 0.000 8.742) 14.192 68.399 ( -32.682 -0.000 -45.410) 55.948 ======================= Grid point 244 (103/204) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.008 ( -3.208 -0.000 23.319) 23.539 1.114 ( -14.788 -0.000 25.574) 29.542 1.561 ( 2.396 0.000 24.893) 25.008 2.163 ( 0.412 0.000 -3.410) 3.435 2.170 ( 8.154 0.000 -21.206) 22.720 3.193 ( 0.329 0.000 -27.139) 27.141 3.686 ( 4.755 0.000 2.058) 5.182 3.833 ( 0.800 0.000 -3.207) 3.306 4.240 ( -12.294 -0.000 2.183) 12.486 4.336 ( 13.505 0.000 1.067) 13.547 4.765 ( -5.352 -0.000 13.563) 14.581 5.120 ( -6.003 -0.000 6.411) 8.783 5.224 ( 5.503 0.000 -1.446) 5.690 5.419 ( 8.564 0.000 -6.907) 11.002 5.634 ( 8.662 0.000 1.885) 8.865 5.652 ( 4.915 0.000 -2.222) 5.394 6.205 ( -17.582 -0.000 4.187) 18.074 6.502 ( 7.630 0.000 -8.719) 11.586 6.903 ( 2.241 0.000 1.215) 2.549 6.973 ( -0.682 -0.000 -1.730) 1.859 7.270 ( -2.952 -0.000 1.704) 3.409 7.367 ( 1.602 0.000 -2.446) 2.923 7.634 ( -14.349 -0.000 0.434) 14.356 7.644 ( 6.215 0.000 -0.017) 6.215 8.130 ( -7.676 -0.000 5.806) 9.624 8.351 ( 5.494 0.000 -4.015) 6.804 8.434 ( -14.941 -0.000 0.512) 14.949 8.474 ( 5.850 0.000 -1.127) 5.957 11.937 ( 60.748 0.000 1.032) 60.757 11.950 ( -18.954 -0.000 0.539) 18.961 13.016 ( -13.505 -0.000 -2.076) 13.664 13.029 ( 20.393 0.000 -3.284) 20.656 13.472 ( 28.087 0.000 2.372) 28.187 13.499 ( -26.523 -0.000 1.960) 26.595 14.071 ( 4.011 0.000 5.241) 6.600 14.302 ( -1.721 -0.000 -4.715) 5.019 26.854 ( 0.623 0.000 0.052) 0.626 26.862 ( 0.446 0.000 -0.339) 0.560 26.964 ( -0.584 -0.000 1.164) 1.302 27.011 ( 0.380 0.000 -0.940) 1.014 28.120 ( -0.305 -0.000 1.975) 1.999 28.210 ( 0.248 0.000 -1.975) 1.990 33.912 ( -2.059 -0.000 2.662) 3.365 34.055 ( 4.977 0.000 -3.844) 6.289 34.067 ( 5.909 0.000 1.987) 6.234 34.154 ( -13.066 -0.000 -1.767) 13.184 35.375 ( 0.179 0.000 7.118) 7.120 35.692 ( -1.581 -0.000 -7.015) 7.191 37.105 ( 0.983 0.000 3.246) 3.392 37.235 ( -0.786 -0.000 -2.560) 2.678 42.142 ( -12.892 -0.000 1.010) 12.931 42.229 ( 67.897 0.000 -3.012) 67.964 42.957 ( 38.711 0.000 4.749) 39.001 43.143 ( -25.411 -0.000 -3.686) 25.677 45.077 ( 8.248 0.000 0.662) 8.275 45.110 ( 0.811 0.000 -1.118) 1.382 45.516 ( -4.886 -0.000 9.082) 10.313 45.880 ( 2.684 0.000 -7.271) 7.751 49.555 ( -7.520 -0.000 1.153) 7.608 49.604 ( 30.196 0.000 -0.996) 30.212 50.367 ( 1.246 0.000 0.201) 1.263 50.380 ( -1.151 -0.000 -0.372) 1.210 61.647 ( 21.184 0.000 5.182) 21.808 61.879 ( -61.165 -0.000 -5.058) 61.374 67.532 ( -5.760 -0.000 12.050) 13.356 68.087 ( 5.960 0.000 -12.366) 13.727 ======================= Grid point 245 (104/204) ======================= q-point: ( 0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.089 ( 0.955 -7.352 20.476) 21.777 1.189 ( -1.831 -12.627 21.701) 25.174 1.848 ( 18.429 -9.313 6.068) 21.522 2.230 ( 5.283 -3.300 -11.583) 13.152 2.261 ( 11.103 -7.123 -0.353) 13.196 3.175 ( 6.093 -0.799 -20.813) 21.701 3.716 ( 1.736 1.664 1.421) 2.793 3.901 ( 7.548 -2.113 -4.935) 9.262 4.170 ( -1.539 -1.949 0.956) 2.661 4.474 ( 12.424 3.594 1.466) 13.016 4.678 ( -3.236 6.375 15.731) 17.279 4.999 ( -8.660 5.975 0.605) 10.539 5.218 ( 0.288 1.153 -1.295) 1.758 5.489 ( -1.888 -3.395 -3.285) 5.088 5.564 ( 2.857 7.111 1.519) 7.812 5.704 ( -1.015 1.931 -6.934) 7.269 6.126 ( -0.347 -1.650 5.434) 5.690 6.587 ( 9.123 -0.752 -6.783) 11.393 6.906 ( -1.480 1.914 0.685) 2.514 6.990 ( 1.104 -3.612 -1.558) 4.085 7.199 ( -7.369 1.444 1.884) 7.742 7.276 ( -9.102 2.554 0.982) 9.505 7.526 ( -0.375 0.396 1.112) 1.239 7.739 ( 10.653 -0.326 -0.222) 10.660 8.024 ( -7.515 2.733 4.299) 9.079 8.322 ( 1.801 0.765 1.886) 2.718 8.408 ( -1.760 -4.126 0.012) 4.485 8.590 ( -0.055 -5.019 -1.970) 5.392 11.855 ( -1.040 -0.176 0.366) 1.117 12.522 ( -15.648 11.968 -0.507) 19.706 12.995 ( 32.910 18.254 -2.742) 37.733 13.166 ( 46.128 -17.134 -17.416) 52.199 13.507 ( -19.878 -22.752 0.168) 30.213 14.108 ( 0.202 -4.324 -0.633) 4.375 14.139 ( 2.532 -4.166 0.517) 4.902 14.611 ( 59.896 -39.728 -16.887) 73.831 26.859 ( 0.363 -0.018 -0.041) 0.365 26.883 ( 0.771 -1.434 -1.004) 1.912 26.957 ( -1.198 0.004 1.099) 1.626 27.009 ( -0.084 -0.102 -0.887) 0.897 28.112 ( -0.930 0.709 1.887) 2.220 28.196 ( -0.314 0.893 -1.948) 2.166 33.874 ( -3.933 0.602 2.199) 4.546 34.023 ( -5.181 -0.136 -2.882) 5.931 34.144 ( 6.707 -0.555 -1.996) 7.019 34.201 ( 10.374 -2.404 2.577) 10.956 35.420 ( 3.236 -0.198 7.364) 8.046 35.677 ( -0.649 -1.617 -7.559) 7.757 37.149 ( 2.147 -2.071 3.121) 4.317 37.233 ( 0.026 -0.832 -2.459) 2.596 42.024 ( -6.720 -5.107 1.104) 8.512 42.615 ( 18.322 -4.117 -13.004) 22.841 42.990 ( -9.325 -6.373 -0.529) 11.307 44.287 ( 50.400 -33.162 -18.957) 63.240 45.167 ( 7.486 -0.774 -2.524) 7.938 45.232 ( 13.792 3.616 -1.925) 14.388 45.719 ( 10.598 -18.005 -2.540) 21.047 46.024 ( 24.789 -19.402 -10.909) 33.316 49.530 ( -1.365 -1.883 0.493) 2.377 50.151 ( 19.142 -0.422 -9.916) 21.562 50.369 ( -1.077 -0.279 -0.042) 1.113 50.845 ( 78.644 -45.268 -30.392) 95.696 61.423 ( -12.629 5.744 -0.306) 13.877 61.933 ( 29.811 1.585 11.062) 31.837 67.495 ( -13.874 -5.041 11.593) 18.769 68.147 ( -0.129 -7.731 -12.007) 14.281 ======================= Grid point 246 (105/204) ======================= q-point: ( 0.18 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.341 ( 5.940 -13.768 14.110) 20.590 1.477 ( 3.714 -16.425 16.974) 23.910 2.103 ( 12.035 -4.239 -13.641) 18.678 2.295 ( 0.758 -6.784 -17.160) 18.467 2.713 ( 21.527 -18.443 15.019) 32.080 3.243 ( 10.651 0.502 -8.514) 13.645 3.707 ( 2.208 2.392 4.105) 5.240 3.962 ( 0.710 -2.080 -4.967) 5.432 4.226 ( 5.300 4.274 3.203) 7.524 4.504 ( -0.004 2.226 6.926) 7.275 4.655 ( 11.940 4.455 6.137) 14.144 4.830 ( -1.848 6.337 -2.031) 6.906 5.216 ( -2.386 -3.070 -1.978) 4.362 5.418 ( 1.408 7.286 -1.937) 7.669 5.505 ( -3.779 -0.414 -5.477) 6.667 5.734 ( 4.231 -3.664 -0.731) 5.644 6.166 ( 0.721 -1.081 2.428) 2.754 6.674 ( 8.093 1.181 -5.395) 9.798 6.828 ( -3.406 3.938 0.922) 5.287 7.071 ( 1.036 -1.619 -2.468) 3.128 7.103 ( -6.242 -2.892 2.346) 7.269 7.208 ( -5.050 -2.785 2.398) 6.246 7.531 ( 1.294 0.226 -0.698) 1.488 7.875 ( 10.663 -1.041 -1.705) 10.849 7.920 ( -4.928 2.006 3.199) 6.208 8.351 ( 3.307 0.069 1.367) 3.579 8.474 ( -0.589 -5.475 1.486) 5.703 8.633 ( -0.595 -2.287 -1.643) 2.878 11.851 ( 3.302 5.863 2.006) 7.021 12.156 ( -14.112 8.229 -1.575) 16.412 13.012 ( 24.235 16.354 1.647) 29.283 13.505 ( -6.181 1.888 -3.004) 7.127 13.621 ( -21.002 -20.039 -1.051) 29.048 14.085 ( -4.561 -0.323 -0.548) 4.605 14.610 ( 42.921 -25.600 -3.896) 50.128 15.803 ( 50.360 -30.108 -21.358) 62.440 26.864 ( 0.162 -0.236 -0.071) 0.295 26.905 ( -0.058 -0.991 -0.718) 1.225 26.949 ( -0.686 -0.379 0.774) 1.102 27.012 ( 0.060 -0.525 -0.990) 1.122 28.088 ( -1.300 1.194 1.581) 2.369 28.171 ( -0.343 1.253 -1.808) 2.226 33.824 ( -3.270 1.096 1.513) 3.766 33.983 ( -2.758 -0.887 -2.317) 3.709 34.225 ( 6.420 -0.684 -1.726) 6.683 34.359 ( 10.194 -1.948 2.758) 10.739 35.471 ( 2.768 0.324 7.207) 7.727 35.685 ( 0.667 -1.570 -7.165) 7.365 37.214 ( 1.639 -2.068 2.124) 3.387 37.248 ( 0.445 -1.764 -1.531) 2.378 42.097 ( -7.362 -13.265 0.327) 15.174 42.775 ( 3.595 1.086 -6.142) 7.199 43.307 ( 25.692 -25.358 2.829) 36.209 44.772 ( 7.816 -10.188 -5.611) 14.013 45.186 ( 2.910 4.835 0.509) 5.666 45.345 ( 12.345 -2.174 -3.042) 12.899 45.866 ( -1.003 -6.616 -1.637) 6.889 46.824 ( 26.640 -25.524 -14.634) 39.690 49.562 ( -0.015 -2.877 0.390) 2.903 50.192 ( 5.326 2.938 -2.147) 6.450 50.358 ( -1.331 -0.117 -0.025) 1.336 52.719 ( 96.102 -57.178 -63.280) 128.489 61.338 ( 25.351 15.078 -8.355) 30.656 62.316 ( 36.386 0.958 7.008) 37.068 67.405 ( -21.784 -5.517 10.680) 24.881 68.272 ( -2.712 -14.162 -11.414) 18.390 ======================= Grid point 247 (106/204) ======================= q-point: ( 0.27 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.682 ( 8.618 -15.575 10.305) 20.568 1.827 ( 4.802 -17.739 12.925) 22.467 2.198 ( 4.141 -0.834 -15.510) 16.075 2.425 ( 5.590 -10.122 -11.486) 16.299 3.187 ( 11.090 -13.871 5.500) 18.592 3.336 ( 9.724 2.385 2.190) 10.249 3.732 ( 7.869 2.770 2.395) 8.679 4.000 ( 0.494 -4.014 -5.159) 6.555 4.126 ( -3.139 9.604 12.227) 15.862 4.440 ( -3.910 2.424 -1.067) 4.722 4.718 ( -0.194 6.026 -0.250) 6.034 4.782 ( 9.394 3.705 4.297) 10.974 5.215 ( -1.605 0.639 -3.798) 4.173 5.395 ( -2.150 -2.330 -6.737) 7.446 5.536 ( 18.016 -0.363 0.188) 18.021 5.842 ( 2.547 -4.717 -0.194) 5.364 6.196 ( -0.713 -3.001 0.039) 3.084 6.678 ( 2.785 5.157 -3.089) 6.625 6.749 ( -0.872 2.710 0.995) 3.016 7.032 ( -2.913 -0.284 -1.681) 3.375 7.156 ( -2.021 -4.843 2.994) 6.042 7.253 ( -2.637 -6.602 1.380) 7.242 7.560 ( 3.297 -1.947 -2.043) 4.340 7.840 ( -0.629 3.619 1.043) 3.819 8.018 ( 8.057 -2.623 -0.905) 8.522 8.386 ( 0.268 -0.896 2.462) 2.634 8.572 ( 4.790 -4.363 0.010) 6.479 8.650 ( -0.626 -1.339 -1.358) 2.008 11.653 ( -7.644 14.532 1.463) 16.485 12.042 ( -0.306 -1.002 -0.899) 1.381 12.977 ( 0.787 12.789 2.062) 12.978 13.300 ( 5.599 11.934 -1.317) 13.248 13.698 ( -24.107 -21.319 -0.237) 32.182 14.043 ( -3.723 -0.662 0.304) 3.793 15.512 ( 42.563 -25.228 -1.315) 49.496 16.551 ( 29.767 -15.883 -13.071) 36.183 26.868 ( 0.046 -0.187 -0.205) 0.281 26.911 ( -0.509 -0.588 0.410) 0.879 26.956 ( -0.136 -0.677 0.140) 0.705 27.022 ( 0.382 -0.768 -1.129) 1.418 28.057 ( -1.312 1.308 1.243) 2.231 28.144 ( -0.251 1.233 -1.490) 1.950 33.778 ( -2.327 1.142 1.026) 2.788 33.969 ( -1.470 -0.880 -2.228) 2.811 34.299 ( 4.735 -1.108 -0.425) 4.881 34.493 ( 8.182 -1.206 1.779) 8.460 35.503 ( 1.567 0.947 7.022) 7.257 35.702 ( 1.387 -1.160 -6.427) 6.677 37.247 ( -0.254 -1.517 -0.016) 1.538 37.290 ( 1.404 -1.815 0.089) 2.297 42.241 ( -8.055 -16.164 0.211) 18.061 42.741 ( 0.833 3.802 -2.476) 4.613 44.081 ( 30.940 -23.499 7.228) 39.519 44.957 ( 4.913 -7.347 -3.664) 9.568 45.177 ( 5.342 -0.482 0.917) 5.442 45.497 ( 10.362 -0.419 -3.576) 10.970 46.013 ( 4.754 -11.712 0.243) 12.643 47.289 ( 11.205 -13.905 -6.249) 18.919 49.612 ( 0.544 -3.007 0.280) 3.068 50.244 ( 8.893 -0.745 -0.094) 8.924 50.348 ( -0.181 -0.084 0.168) 0.261 54.056 ( 39.171 -31.523 -39.505) 63.943 61.475 ( 47.177 18.248 -7.030) 51.070 62.707 ( 34.941 1.292 -4.864) 35.302 67.226 ( -26.048 -3.574 9.024) 27.797 68.449 ( -3.240 -15.924 -10.718) 19.467 ======================= Grid point 248 (107/204) ======================= q-point: ( 0.36 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.024 ( 7.425 -12.574 6.331) 15.916 2.143 ( 2.036 -7.715 1.516) 8.122 2.215 ( 2.672 -9.101 -3.788) 10.214 2.631 ( 9.410 -7.559 -6.692) 13.801 3.369 ( 2.594 3.673 6.919) 8.252 3.444 ( 3.508 -9.851 1.147) 10.520 3.743 ( 8.426 9.893 -0.881) 13.025 3.934 ( -8.453 4.223 7.513) 12.072 4.122 ( 2.824 -4.561 -0.763) 5.419 4.381 ( -0.564 0.291 -2.216) 2.305 4.583 ( -3.543 8.055 2.601) 9.176 4.798 ( 3.264 3.280 -0.843) 4.704 5.192 ( 3.927 1.994 -4.032) 5.971 5.343 ( -7.394 -0.799 -1.596) 7.606 5.828 ( 19.680 -2.465 -0.563) 19.842 5.930 ( 2.010 -4.576 0.274) 5.006 6.245 ( 0.225 -3.558 -1.856) 4.020 6.602 ( -0.040 5.184 -1.022) 5.284 6.730 ( 2.108 0.694 0.512) 2.278 6.990 ( -5.686 -0.157 -0.506) 5.711 7.254 ( 3.679 -5.944 1.572) 7.165 7.308 ( -4.470 -5.374 2.945) 7.585 7.658 ( 5.694 -3.847 -3.761) 7.834 7.797 ( 1.976 2.810 0.698) 3.506 8.125 ( 4.768 -1.796 -0.046) 5.095 8.391 ( -1.484 0.069 2.954) 3.307 8.645 ( -2.015 -0.985 -2.172) 3.122 8.721 ( 8.781 -3.891 -0.688) 9.629 11.349 ( -8.504 12.105 0.509) 14.802 12.071 ( 2.000 -0.554 -0.340) 2.103 12.673 ( -16.510 9.531 0.870) 19.083 13.310 ( 21.157 10.949 0.401) 23.826 13.719 ( -21.605 -15.268 -0.129) 26.455 14.029 ( -2.532 -1.880 0.218) 3.161 16.256 ( 30.559 -17.683 0.024) 35.307 16.933 ( 13.224 -6.566 -7.361) 16.498 26.870 ( 0.097 -0.071 -0.218) 0.249 26.916 ( -0.415 -0.460 0.957) 1.140 26.963 ( -0.126 -0.479 -0.179) 0.526 27.036 ( 0.525 -0.704 -1.106) 1.412 28.028 ( -1.010 1.002 1.010) 1.744 28.122 ( -0.097 0.887 -1.195) 1.492 33.743 ( -1.441 0.833 0.830) 1.860 33.962 ( -0.621 -0.487 -2.413) 2.538 34.362 ( 2.801 -1.528 0.771) 3.283 34.584 ( 5.335 -0.342 0.639) 5.384 35.511 ( 0.274 1.490 6.885) 7.050 35.722 ( 1.575 -1.248 -5.929) 6.260 37.263 ( -0.558 -1.114 -0.321) 1.287 37.324 ( 0.925 -0.893 -0.109) 1.290 42.397 ( -8.117 -15.531 0.199) 17.525 42.677 ( 2.499 6.189 -1.415) 6.823 44.548 ( 9.889 -6.043 6.355) 13.217 45.064 ( 2.222 -2.949 -3.377) 5.004 45.408 ( 14.943 -10.547 0.947) 18.315 45.559 ( 3.656 1.222 -0.993) 3.981 46.326 ( 13.202 -13.484 -0.157) 18.871 47.529 ( 4.918 -7.863 -2.478) 9.600 49.662 ( 0.708 -2.254 0.255) 2.376 50.320 ( 0.563 0.142 -0.845) 1.025 50.481 ( 16.476 -7.533 1.664) 18.192 54.439 ( -4.574 -6.856 -15.960) 17.963 61.748 ( 42.122 14.373 4.645) 44.749 63.037 ( 29.691 -1.019 -17.336) 34.397 66.999 ( -22.534 -0.965 7.363) 23.726 68.615 ( -3.177 -13.156 -10.545) 17.157 ======================= Grid point 249 (108/204) ======================= q-point: ( 0.45 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.077 ( -2.168 3.014 -7.619) 8.475 2.277 ( 1.402 -5.956 5.314) 8.105 2.477 ( 3.643 -11.721 3.571) 12.783 2.828 ( 9.058 -5.772 -2.183) 10.961 3.325 ( -1.615 4.349 5.473) 7.175 3.539 ( -2.482 0.275 1.190) 2.767 3.641 ( 6.057 11.805 -0.556) 13.281 3.898 ( -4.602 -9.364 9.084) 13.834 4.190 ( 1.082 -2.428 -2.797) 3.859 4.382 ( -0.970 2.933 0.653) 3.158 4.445 ( -3.863 1.492 -2.141) 4.662 4.778 ( 4.187 3.232 -2.669) 5.925 5.223 ( 6.729 1.149 -2.324) 7.211 5.265 ( -7.692 -0.800 -1.779) 7.935 5.936 ( 1.978 -0.387 0.150) 2.021 6.066 ( 5.189 -3.194 0.567) 6.119 6.284 ( 1.586 -0.729 -2.678) 3.197 6.527 ( -1.367 3.088 0.031) 3.377 6.775 ( 4.578 -0.728 -0.115) 4.637 6.913 ( -5.719 1.180 0.239) 5.844 7.326 ( -6.372 -5.188 4.645) 9.439 7.403 ( 6.339 -2.747 -1.037) 6.986 7.709 ( 2.109 2.468 -1.620) 3.628 7.833 ( 1.770 -2.726 -0.203) 3.257 8.180 ( 1.843 -0.841 0.067) 2.027 8.377 ( 0.346 1.364 2.885) 3.210 8.622 ( -2.024 -0.540 -2.505) 3.266 8.850 ( 4.316 -1.906 -1.183) 4.864 11.139 ( -3.390 5.090 -0.003) 6.116 12.085 ( 0.761 0.720 -0.467) 1.147 12.431 ( -6.704 3.486 1.038) 7.627 13.374 ( 11.619 5.813 0.749) 13.014 13.699 ( -11.486 -7.083 -0.147) 13.495 14.034 ( -1.274 -1.122 0.161) 1.705 16.723 ( 16.205 -8.714 0.406) 18.404 17.028 ( -1.397 0.642 -4.975) 5.207 26.871 ( 0.149 0.130 -0.135) 0.240 26.918 ( -0.565 -0.128 1.134) 1.273 26.968 ( 0.161 -0.304 -0.352) 0.492 27.047 ( 0.337 -0.353 -1.054) 1.162 28.011 ( -0.502 0.374 0.899) 1.096 28.111 ( 0.123 0.300 -1.047) 1.096 33.725 ( -0.622 0.334 0.780) 1.052 33.958 ( 0.126 0.013 -2.468) 2.472 34.409 ( 0.809 -1.531 1.235) 2.127 34.625 ( 1.959 0.450 -0.007) 2.010 35.498 ( -0.977 1.672 6.636) 6.913 35.748 ( 1.479 -1.643 -5.536) 5.961 37.267 ( -0.411 -0.302 -0.336) 0.611 37.338 ( 0.418 -0.081 -0.245) 0.492 42.515 ( -1.544 -4.588 1.450) 5.053 42.613 ( -1.767 0.342 -2.322) 2.937 44.659 ( 2.134 -1.507 3.944) 4.730 45.108 ( 1.014 -1.673 -3.688) 4.175 45.547 ( -0.302 1.841 0.731) 2.003 45.671 ( 7.550 -4.090 1.247) 8.677 46.613 ( 8.257 -5.810 -1.066) 10.152 47.636 ( 0.686 -2.568 -0.813) 2.780 49.692 ( 0.386 -0.730 0.319) 0.885 50.316 ( 0.496 0.570 -0.655) 1.000 50.811 ( 13.040 -8.330 0.034) 15.473 54.292 ( -11.588 3.934 -4.253) 12.955 61.896 ( 10.264 10.021 14.863) 20.656 63.334 ( 20.471 -7.570 -25.462) 33.537 66.828 ( -8.108 1.739 6.445) 10.502 68.717 ( -2.955 -7.759 -10.903) 13.705 ======================= Grid point 250 (109/204) ======================= q-point: (-0.45 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.961 ( -4.785 5.274 -2.710) 7.619 2.279 ( -5.398 3.871 5.027) 8.330 2.615 ( 0.512 -2.373 -1.915) 3.092 2.906 ( -3.851 3.202 -6.425) 8.146 3.286 ( 4.213 1.297 8.407) 9.492 3.481 ( -1.780 0.505 2.922) 3.458 3.576 ( 5.931 5.849 2.182) 8.611 4.055 ( -6.847 -11.280 7.513) 15.184 4.234 ( 2.307 -1.468 -0.385) 2.761 4.295 ( -1.641 1.698 -2.875) 3.720 4.392 ( -6.247 -0.933 -3.552) 7.247 4.814 ( 8.331 0.274 -1.339) 8.443 5.193 ( -7.121 -1.613 -3.659) 8.168 5.289 ( 7.143 0.117 -0.935) 7.205 5.946 ( -1.377 -0.519 -0.156) 1.480 6.088 ( -4.578 1.685 0.320) 4.888 6.294 ( 1.892 0.645 -3.737) 4.238 6.485 ( -2.490 -0.336 1.627) 2.994 6.798 ( -1.166 1.405 -1.648) 2.460 6.875 ( 2.680 0.530 2.334) 3.593 7.333 ( -4.402 -1.936 4.266) 6.428 7.443 ( 0.639 2.619 -2.530) 3.696 7.663 ( -0.609 3.980 0.592) 4.069 7.847 ( -2.603 -1.221 -1.034) 3.055 8.186 ( -2.106 1.033 -0.245) 2.358 8.376 ( 0.845 0.514 3.010) 3.168 8.632 ( 2.368 -1.487 -2.777) 3.941 8.837 ( -4.634 2.865 -0.807) 5.507 11.149 ( 5.067 -5.199 -0.299) 7.266 12.072 ( -0.130 1.056 -0.051) 1.065 12.440 ( 8.059 -3.100 0.754) 8.667 13.379 ( -7.661 -3.301 0.628) 8.366 13.693 ( 6.287 3.974 -0.022) 7.437 14.031 ( 0.475 0.973 0.263) 1.114 16.843 ( -11.074 7.154 0.429) 13.191 16.906 ( -2.836 0.469 -4.957) 5.730 26.869 ( 0.153 0.382 -0.042) 0.413 26.913 ( -0.728 0.217 1.071) 1.313 26.974 ( 0.495 -0.109 -0.307) 0.592 27.048 ( 0.010 0.136 -1.112) 1.120 28.010 ( 0.056 -0.366 0.900) 0.973 28.112 ( 0.392 -0.374 -1.065) 1.194 33.723 ( 0.188 -0.218 0.823) 0.871 33.954 ( 0.804 0.420 -2.310) 2.482 34.428 ( -1.143 -0.597 0.686) 1.460 34.618 ( -1.620 0.562 0.160) 1.722 35.472 ( -2.039 1.327 6.272) 6.728 35.777 ( 1.113 -1.864 -5.275) 5.704 37.261 ( 0.023 0.751 -0.163) 0.769 37.336 ( -0.113 0.482 -0.172) 0.524 42.456 ( 8.542 14.456 1.713) 16.879 42.666 ( -9.669 -12.962 -2.434) 16.354 44.707 ( 0.469 -2.121 3.032) 3.730 45.118 ( -0.221 -0.231 -4.765) 4.776 45.497 ( -3.864 2.239 2.518) 5.127 45.701 ( -1.100 4.879 0.432) 5.020 46.653 ( -2.736 4.184 -2.251) 5.482 47.616 ( -3.209 3.273 -0.248) 4.590 49.691 ( -0.402 1.002 0.345) 1.134 50.313 ( 1.134 0.777 -0.511) 1.466 50.888 ( -8.649 2.051 -2.295) 9.180 54.182 ( 4.492 4.753 -1.089) 6.629 61.729 ( -22.483 5.904 15.024) 27.678 63.583 ( 0.560 -16.937 -28.204) 32.903 66.822 ( 12.388 3.938 6.877) 14.706 68.728 ( -2.774 -1.142 -11.545) 11.928 ======================= Grid point 251 (110/204) ======================= q-point: (-0.36 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.798 ( -6.729 7.583 3.673) 10.783 2.087 ( -10.669 10.646 7.153) 16.683 2.564 ( -1.169 5.762 -7.951) 9.889 2.665 ( -11.620 9.748 -10.915) 18.687 3.335 ( 5.603 6.021 7.063) 10.841 3.509 ( -3.943 -4.586 6.137) 8.617 3.609 ( 5.757 -0.426 1.781) 6.042 3.989 ( -18.221 -0.095 -0.229) 18.223 4.269 ( -0.700 -1.413 4.010) 4.309 4.320 ( 3.871 -4.341 -1.329) 5.967 4.427 ( 2.235 -6.055 -0.244) 6.459 4.917 ( 4.130 -2.501 1.355) 5.015 5.156 ( -2.233 -3.488 -7.554) 8.614 5.358 ( 4.682 0.347 -0.390) 4.711 5.837 ( -20.217 4.565 -0.736) 20.739 5.966 ( -0.809 4.241 -0.508) 4.347 6.302 ( 2.475 -0.195 -5.079) 5.654 6.484 ( -2.762 -1.879 3.545) 4.871 6.764 ( -0.639 0.090 -1.126) 1.297 6.901 ( 3.688 2.346 3.005) 5.304 7.298 ( -3.041 2.081 2.929) 4.707 7.364 ( -2.062 3.407 -1.812) 4.375 7.596 ( -0.092 3.972 -0.776) 4.048 7.856 ( 0.524 -2.401 -2.019) 3.181 8.092 ( -8.081 3.046 1.207) 8.720 8.384 ( -0.927 -0.244 2.748) 2.910 8.653 ( -5.124 1.808 -1.933) 5.767 8.723 ( 1.600 3.008 -0.912) 3.527 11.379 ( 10.302 -12.182 -0.365) 15.958 12.045 ( -2.041 1.176 0.399) 2.389 12.693 ( 20.061 -8.170 0.309) 21.662 13.315 ( -20.810 -9.497 0.329) 22.877 13.703 ( 17.542 13.077 0.241) 21.881 14.025 ( 2.337 1.475 0.362) 2.787 16.426 ( -28.350 14.763 -3.818) 32.191 16.755 ( -14.059 8.969 -3.394) 17.018 26.864 ( 0.256 0.526 0.044) 0.586 26.902 ( -0.707 0.415 0.885) 1.207 26.980 ( 0.613 0.129 -0.117) 0.637 27.038 ( -0.225 0.609 -1.300) 1.453 28.026 ( 0.485 -0.975 1.012) 1.487 28.125 ( 0.668 -0.935 -1.233) 1.686 33.739 ( 1.067 -0.672 0.955) 1.582 33.953 ( 1.391 0.536 -2.057) 2.540 34.399 ( -3.061 1.477 -0.452) 3.429 34.580 ( -4.887 -0.500 0.806) 4.978 35.444 ( -2.875 0.547 5.899) 6.585 35.802 ( 0.511 -1.672 -5.317) 5.597 37.243 ( 0.453 2.007 0.275) 2.075 37.322 ( -0.648 0.648 -0.070) 0.919 42.311 ( 8.050 17.067 1.986) 18.974 42.742 ( -7.970 -10.611 -2.587) 13.521 44.727 ( -3.913 0.239 3.683) 5.379 45.094 ( -0.317 0.685 -7.213) 7.252 45.384 ( -8.345 5.749 2.411) 10.416 45.538 ( -7.201 7.407 -0.259) 10.334 46.428 ( -9.999 13.659 -3.387) 17.263 47.457 ( -7.937 9.717 -0.561) 12.559 49.657 ( -1.250 2.200 0.355) 2.555 50.316 ( 2.183 1.065 -0.386) 2.459 50.646 ( -16.228 5.641 -3.378) 17.510 54.064 ( -2.839 19.514 -5.419) 20.451 61.370 ( -34.895 -1.125 9.300) 36.131 63.716 ( -23.703 -26.209 -31.782) 47.527 66.999 ( 26.147 4.706 8.327) 27.842 68.634 ( -2.568 5.890 -12.239) 13.823 ======================= Grid point 252 (111/204) ======================= q-point: (-0.27 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.601 ( -7.631 9.690 10.706) 16.332 1.768 ( -13.586 14.944 10.156) 22.607 2.343 ( -10.209 10.132 -13.659) 19.836 2.432 ( -1.612 7.081 -12.369) 14.343 3.219 ( -8.212 12.121 4.539) 15.328 3.459 ( -10.043 3.321 1.430) 10.674 3.622 ( -2.739 -0.089 3.632) 4.550 3.909 ( -3.892 -8.289 2.412) 9.469 4.289 ( -0.809 -1.066 2.661) 2.979 4.486 ( 4.390 -8.146 -1.502) 9.375 4.529 ( 2.552 -4.339 4.642) 6.847 4.940 ( -6.019 -1.113 2.814) 6.737 5.207 ( -6.173 -2.746 -9.694) 11.817 5.300 ( -4.584 5.036 -1.710) 7.021 5.539 ( -7.580 3.304 0.721) 8.300 5.892 ( -2.361 4.068 -1.677) 4.993 6.333 ( 3.179 -1.015 -5.860) 6.744 6.479 ( -4.563 -1.529 4.521) 6.602 6.785 ( 2.359 -1.724 -0.485) 2.962 6.918 ( 3.409 0.746 2.655) 4.385 7.219 ( -1.845 5.187 1.114) 5.617 7.323 ( 0.470 0.377 -1.139) 1.288 7.535 ( 0.718 4.045 -1.256) 4.295 7.918 ( 2.942 -3.420 -1.641) 4.801 7.947 ( -10.435 2.058 1.685) 10.769 8.363 ( -4.974 -0.014 2.537) 5.584 8.522 ( -6.324 2.391 0.453) 6.776 8.737 ( 7.254 4.349 -2.378) 8.786 11.716 ( 12.320 -14.783 -0.184) 19.244 11.991 ( -4.795 0.879 0.369) 4.889 13.093 ( 24.124 -9.771 -0.562) 26.034 13.220 ( -24.399 -11.657 0.482) 27.045 13.666 ( 18.568 18.601 0.459) 26.286 14.052 ( 4.578 0.013 0.037) 4.578 15.753 ( -40.171 21.093 -7.256) 45.949 16.273 ( -30.087 21.164 -6.651) 37.381 26.860 ( 0.427 0.512 0.155) 0.684 26.890 ( -0.473 0.475 0.547) 0.866 26.983 ( 0.490 0.347 0.205) 0.634 27.020 ( -0.180 0.900 -1.577) 1.825 28.054 ( 0.679 -1.278 1.243) 1.908 28.148 ( 0.907 -1.226 -1.502) 2.140 33.772 ( 2.146 -0.906 1.204) 2.622 33.960 ( 1.834 0.236 -1.934) 2.676 34.315 ( -4.729 3.196 -0.874) 5.774 34.529 ( -7.623 -1.605 0.638) 7.816 35.421 ( -3.564 -0.463 5.532) 6.597 35.811 ( -0.243 -0.992 -5.802) 5.891 37.209 ( 0.347 3.191 1.032) 3.371 37.305 ( -0.895 0.440 -0.218) 1.021 42.128 ( 5.407 17.143 2.602) 18.163 42.798 ( -6.406 -8.018 -3.128) 10.729 44.508 ( -18.467 16.264 1.575) 24.658 45.034 ( -2.974 5.405 -12.282) 13.744 45.204 ( -4.432 1.574 -0.208) 4.708 45.375 ( -7.677 4.026 -0.160) 8.670 46.070 ( -7.054 17.076 -1.984) 18.582 47.114 ( -15.790 18.690 -1.801) 24.533 49.604 ( -1.359 2.773 0.451) 3.120 50.328 ( 3.827 1.804 -0.650) 4.280 50.425 ( -10.304 1.933 -3.919) 11.193 53.285 ( -40.542 50.270 -15.570) 66.432 61.134 ( -21.775 -9.658 3.073) 24.018 63.686 ( -47.930 -31.986 -38.245) 69.160 67.263 ( 27.654 4.223 9.745) 29.624 68.440 ( -1.285 12.251 -12.740) 17.721 ======================= Grid point 253 (112/204) ======================= q-point: (-0.18 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.369 ( -11.860 12.665 14.466) 22.591 1.431 ( -9.299 12.467 17.966) 23.762 2.053 ( -10.067 9.071 -12.232) 18.255 2.287 ( 0.476 6.468 -16.176) 17.428 2.774 ( -26.892 17.530 9.226) 33.401 3.336 ( -2.113 2.652 -8.333) 8.997 3.619 ( -3.602 -1.935 6.549) 7.721 4.006 ( -2.628 -4.866 -1.884) 5.842 4.256 ( -6.081 1.477 -1.047) 6.345 4.533 ( -4.620 -3.829 4.638) 7.584 4.739 ( -13.330 0.928 5.410) 14.416 4.768 ( 0.254 -9.469 -0.995) 9.525 5.079 ( -0.251 -1.618 3.228) 3.620 5.316 ( 4.872 4.212 -3.228) 7.203 5.514 ( 2.606 -0.274 -2.356) 3.524 5.788 ( -3.190 4.051 -2.552) 5.753 6.362 ( -0.272 -1.335 -1.324) 1.900 6.460 ( -3.549 -1.918 -1.236) 4.219 6.845 ( 3.786 -0.608 0.621) 3.884 6.971 ( 1.877 -2.174 1.116) 3.081 7.142 ( 3.111 3.726 0.081) 4.855 7.338 ( 1.695 -0.608 -1.461) 2.319 7.495 ( 0.521 1.262 0.567) 1.479 7.814 ( -10.557 0.356 1.351) 10.649 8.011 ( 4.184 -3.638 -0.593) 5.576 8.290 ( -7.421 0.168 2.045) 7.699 8.459 ( -1.608 1.131 1.606) 2.538 8.728 ( 8.165 7.247 -3.063) 11.338 11.914 ( -6.196 1.077 0.899) 6.353 12.100 ( 12.581 -17.176 -0.720) 21.303 13.131 ( -22.687 -11.612 -0.517) 25.491 13.467 ( 18.968 -3.951 -2.597) 19.548 13.552 ( 11.375 18.441 0.164) 21.668 14.110 ( 3.831 -0.005 -1.749) 4.211 14.861 ( -46.232 27.419 -14.346) 55.633 15.376 ( -44.162 38.778 -7.185) 59.208 26.857 ( 0.277 0.425 0.339) 0.610 26.880 ( 0.055 0.636 -0.086) 0.644 26.979 ( 0.003 0.694 0.573) 0.900 27.005 ( 0.400 0.593 -1.590) 1.744 28.084 ( 0.631 -1.214 1.566) 2.080 28.174 ( 1.065 -1.211 -1.754) 2.382 33.821 ( 3.495 -0.911 1.635) 3.965 33.978 ( 2.019 -0.349 -2.190) 2.999 34.202 ( -5.228 3.680 -0.585) 6.419 34.456 ( -10.738 -2.040 -0.691) 10.952 35.404 ( -4.269 -1.354 5.083) 6.774 35.796 ( -1.103 0.228 -6.773) 6.866 37.161 ( -0.123 3.521 1.933) 4.019 37.287 ( -1.138 0.290 -0.818) 1.431 41.929 ( 1.580 14.637 3.495) 15.131 42.822 ( -7.502 -5.740 -4.136) 10.312 43.873 ( -16.540 35.394 -12.812) 41.115 44.753 ( -12.502 20.860 -16.393) 29.329 45.182 ( -3.259 2.490 -2.551) 4.829 45.233 ( -6.699 1.422 1.910) 7.110 45.788 ( -4.117 11.588 3.391) 12.756 46.490 ( -25.430 29.563 -3.385) 39.142 49.549 ( -0.340 3.236 0.700) 3.328 50.300 ( -2.168 3.652 -6.593) 7.843 50.356 ( 0.782 -0.069 -0.004) 0.785 51.667 ( -63.802 66.732 -17.639) 93.995 61.187 ( -1.270 -11.807 -0.173) 11.877 63.391 ( -72.616 -28.283 -42.786) 88.902 67.493 ( 18.499 4.226 11.075) 21.971 68.204 ( 3.699 14.498 -12.995) 19.818 ======================= Grid point 254 (113/204) ======================= q-point: (-0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.094 ( -12.198 7.150 19.728) 24.272 1.250 ( -6.153 8.505 24.766) 26.899 1.746 ( -16.201 11.277 6.010) 20.634 2.184 ( 4.110 4.270 -19.379) 20.265 2.296 ( -17.013 9.136 3.843) 19.689 3.263 ( -1.005 0.781 -19.913) 19.954 3.635 ( 0.319 -0.889 6.869) 6.934 3.913 ( -9.089 2.719 -6.717) 11.624 4.217 ( 0.775 -2.148 1.607) 2.792 4.430 ( -15.414 2.688 2.922) 15.917 4.692 ( -3.356 -9.631 8.274) 13.133 5.024 ( 6.787 -8.903 4.673) 12.131 5.200 ( 6.371 -3.018 4.935) 8.605 5.255 ( 7.844 5.614 2.552) 9.979 5.538 ( 0.503 -0.748 -3.261) 3.383 5.704 ( 1.053 4.245 -3.268) 5.459 6.343 ( -11.352 -3.405 3.417) 12.334 6.461 ( 3.726 0.086 -9.194) 9.921 6.881 ( 2.785 0.841 1.292) 3.183 6.986 ( -0.096 0.579 -1.205) 1.340 7.212 ( 6.673 -2.716 1.284) 7.319 7.356 ( 2.953 1.332 -2.756) 4.254 7.543 ( 1.344 -6.328 1.446) 6.629 7.713 ( -9.971 -2.334 0.996) 10.289 8.121 ( 1.752 -5.551 3.048) 6.570 8.232 ( -1.639 -0.719 0.600) 1.887 8.439 ( -0.225 0.942 1.050) 1.428 8.672 ( 4.740 9.944 -4.902) 12.057 11.822 ( -5.713 2.542 1.048) 6.340 12.535 ( 15.414 -19.698 -0.736) 25.023 12.872 ( -47.797 36.516 -10.074) 60.987 13.155 ( -31.476 -4.886 -11.715) 33.939 13.478 ( 25.220 27.399 0.418) 37.241 14.014 ( 2.128 4.128 1.415) 4.855 14.214 ( -30.653 26.978 4.705) 41.104 14.337 ( -9.562 11.521 -4.560) 15.651 26.854 ( -0.077 0.274 0.408) 0.498 26.869 ( 0.512 1.103 -0.575) 1.345 26.969 ( -0.210 0.513 0.896) 1.054 27.005 ( 0.813 0.022 -1.056) 1.333 28.109 ( 0.313 -0.760 1.858) 2.032 28.199 ( 1.011 -0.922 -1.885) 2.329 33.883 ( 4.001 -0.728 2.408) 4.726 34.005 ( 2.195 -0.874 -2.686) 3.577 34.096 ( -2.940 3.458 -0.253) 4.546 34.333 ( -15.569 -1.198 -2.779) 15.860 35.385 ( -4.403 -0.943 5.105) 6.808 35.746 ( -1.903 1.648 -7.425) 7.841 37.116 ( -0.136 2.614 2.712) 3.769 37.262 ( -1.830 0.439 -1.933) 2.697 41.767 ( 8.403 11.216 7.386) 15.842 42.701 ( -15.147 13.378 -13.130) 24.099 43.097 ( 16.586 50.856 -13.809) 55.246 43.834 ( -49.999 35.947 1.623) 61.602 45.074 ( -1.641 3.715 1.840) 4.459 45.156 ( -6.721 0.706 0.778) 6.802 45.614 ( -6.150 6.048 7.853) 11.665 45.950 ( -4.435 10.621 -6.080) 13.017 49.507 ( 2.970 4.059 1.445) 5.233 49.955 ( -22.831 28.145 -7.143) 36.938 50.365 ( 1.419 0.861 0.067) 1.661 50.472 ( -13.068 10.897 1.414) 17.073 61.403 ( 12.416 -6.641 0.327) 14.084 62.708 ( -85.592 -12.060 -30.890) 91.791 67.567 ( 3.371 5.171 12.436) 13.883 68.077 ( 10.217 7.895 -13.094) 18.389 ======================= Grid point 256 (114/204) ======================= q-point: ( 0.09 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.092 ( 6.381 0.000 19.654) 20.664 1.254 ( 13.957 0.000 18.772) 23.392 2.042 ( 21.433 0.000 -2.536) 21.583 2.210 ( 2.662 0.000 -22.225) 22.384 2.390 ( 19.515 0.000 15.453) 24.892 3.236 ( 13.203 0.000 -15.078) 20.041 3.776 ( 4.906 0.000 0.592) 4.941 3.926 ( 0.998 0.000 -6.268) 6.347 4.223 ( 16.071 0.000 1.132) 16.110 4.579 ( -4.475 -0.000 11.241) 12.099 4.751 ( 5.081 0.000 8.789) 10.152 4.906 ( -10.274 -0.000 -0.443) 10.283 5.323 ( 5.516 0.000 -3.411) 6.486 5.329 ( -9.232 -0.000 -4.186) 10.137 5.570 ( -5.652 -0.000 -4.482) 7.214 5.726 ( 2.310 0.000 -1.677) 2.854 6.197 ( 7.380 0.000 1.167) 7.472 6.647 ( 5.696 0.000 -4.419) 7.209 6.919 ( -2.245 -0.000 1.193) 2.543 6.929 ( -2.266 -0.000 -2.105) 3.093 7.129 ( -7.192 -0.000 2.247) 7.535 7.181 ( -8.921 -0.000 -0.197) 8.923 7.559 ( 2.388 0.000 3.407) 4.160 7.792 ( 2.486 0.000 0.349) 2.510 7.972 ( -5.299 -0.000 2.745) 5.968 8.256 ( -0.935 -0.000 3.369) 3.496 8.451 ( 4.371 0.000 -3.117) 5.369 8.580 ( 2.535 0.000 0.159) 2.540 12.211 ( 38.029 0.000 4.220) 38.263 12.494 ( -16.365 -0.000 1.731) 16.457 12.886 ( -17.990 -0.000 -2.350) 18.143 13.571 ( 36.093 0.000 -24.554) 43.653 13.743 ( 28.772 0.000 2.177) 28.854 13.988 ( 1.686 0.000 -0.675) 1.816 14.141 ( 6.528 0.000 3.120) 7.236 14.951 ( 74.169 0.000 -31.753) 80.680 26.868 ( 0.368 0.000 -0.790) 0.872 26.871 ( 0.522 0.000 -0.350) 0.628 26.944 ( -1.486 -0.000 1.169) 1.891 27.002 ( -0.455 -0.000 -0.953) 1.056 28.108 ( -1.514 -0.000 1.900) 2.429 28.191 ( -0.764 -0.000 -2.039) 2.178 33.844 ( -3.210 -0.000 2.565) 4.109 33.967 ( -2.549 -0.000 -3.847) 4.615 34.226 ( 8.104 0.000 -3.529) 8.839 34.331 ( 12.807 0.000 4.731) 13.653 35.480 ( 4.160 0.000 6.517) 7.732 35.645 ( 0.616 0.000 -6.508) 6.537 37.175 ( 3.428 0.000 3.528) 4.919 37.224 ( 0.331 0.000 -2.767) 2.787 41.980 ( 12.092 0.000 -6.600) 13.776 42.776 ( 21.499 0.000 -10.894) 24.101 43.154 ( 19.947 0.000 -4.449) 20.437 44.448 ( 26.606 0.000 -11.811) 29.110 45.275 ( 14.129 0.000 -4.336) 14.779 45.492 ( -1.450 -0.000 9.843) 9.949 45.601 ( 14.846 0.000 -13.052) 19.768 46.177 ( 40.572 0.000 -14.334) 43.030 49.603 ( 10.504 0.000 -0.840) 10.538 50.295 ( 3.394 0.000 -4.161) 5.370 50.391 ( 2.532 0.000 -0.522) 2.585 51.355 ( 104.269 0.000 -56.204) 118.453 61.615 ( 38.327 0.000 -22.005) 44.195 62.297 ( 27.076 0.000 23.492) 35.847 67.307 ( -17.535 -0.000 11.690) 21.075 68.022 ( -4.537 -0.000 -12.734) 13.518 ======================= Grid point 257 (115/204) ======================= q-point: ( 0.18 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.312 ( 13.344 -7.168 13.882) 20.546 1.497 ( 16.321 -3.470 15.559) 22.814 2.191 ( 1.208 -1.878 -19.827) 19.952 2.225 ( 16.064 -0.138 -10.934) 19.433 2.769 ( 21.377 -10.366 15.199) 28.204 3.366 ( 12.717 0.101 -5.219) 13.747 3.830 ( 7.976 3.196 4.430) 9.667 3.919 ( 0.462 -1.594 -6.629) 6.834 4.393 ( 6.293 6.424 5.402) 10.491 4.504 ( -3.798 0.708 7.336) 8.291 4.798 ( -0.515 1.109 -1.168) 1.692 4.866 ( 5.587 -1.116 5.368) 7.828 5.195 ( -2.394 0.421 -2.877) 3.766 5.386 ( 0.090 0.958 -5.666) 5.747 5.564 ( 8.781 -0.204 -4.547) 9.891 5.742 ( 2.058 -0.701 -1.063) 2.421 6.221 ( 2.431 3.723 0.455) 4.469 6.703 ( 1.341 -2.545 -3.069) 4.207 6.848 ( -3.092 3.037 -0.529) 4.366 6.950 ( -4.986 -5.676 0.762) 7.593 7.064 ( -3.513 0.709 -1.010) 3.724 7.121 ( -3.957 -2.250 1.070) 4.676 7.567 ( 1.466 2.016 2.032) 3.216 7.840 ( -3.806 -5.651 1.832) 7.055 7.956 ( 3.926 0.732 -0.458) 4.020 8.300 ( 1.344 -3.052 3.394) 4.759 8.493 ( 5.908 -0.141 -2.775) 6.529 8.609 ( 0.812 -1.018 -0.750) 1.503 12.165 ( -14.112 14.956 1.099) 20.592 12.477 ( 39.146 22.368 6.458) 45.546 12.868 ( -18.452 -17.311 -1.704) 25.359 13.460 ( -15.116 11.629 -5.107) 19.744 13.879 ( 25.791 15.074 0.345) 29.875 14.074 ( 12.287 6.720 0.306) 14.008 14.698 ( 44.917 -25.805 -2.490) 51.862 15.862 ( 49.982 -25.514 -30.430) 63.837 26.864 ( 0.137 0.107 -0.547) 0.574 26.886 ( -0.065 -0.964 -0.373) 1.036 26.934 ( -1.123 -0.446 1.052) 1.602 26.999 ( -0.204 -0.515 -1.112) 1.243 28.089 ( -1.704 0.598 1.695) 2.477 28.173 ( -0.846 0.526 -1.993) 2.229 33.812 ( -2.457 0.729 2.293) 3.439 33.942 ( -1.050 -0.306 -3.530) 3.696 34.300 ( 7.160 0.443 -2.867) 7.726 34.480 ( 11.201 0.006 4.337) 12.011 35.532 ( 3.342 0.818 5.977) 6.896 35.659 ( 1.729 -1.533 -5.482) 5.949 37.216 ( 0.688 -0.164 -0.014) 0.708 37.236 ( 2.118 -1.375 0.624) 2.601 42.134 ( 24.739 9.160 -3.007) 26.551 43.163 ( 29.287 7.437 -5.602) 30.732 43.309 ( 32.550 -10.525 -1.089) 34.227 44.697 ( 8.176 -8.838 -5.611) 13.283 45.362 ( 4.816 11.511 2.921) 12.815 45.459 ( 15.760 -1.535 -4.921) 16.582 45.743 ( -1.871 -7.554 -2.382) 8.139 46.747 ( 27.875 -18.221 -11.607) 35.267 49.689 ( 13.973 6.646 0.008) 15.473 50.293 ( 4.007 2.462 -2.699) 5.423 50.390 ( 4.066 3.429 0.052) 5.319 52.661 ( 68.897 -46.540 -60.056) 102.565 62.001 ( 54.745 12.995 -34.967) 66.246 62.664 ( 23.422 -3.429 18.836) 30.251 67.146 ( -18.533 -1.430 11.468) 21.841 68.021 ( -2.043 -9.323 -14.407) 17.281 ======================= Grid point 258 (116/204) ======================= q-point: ( 0.27 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.634 ( 14.542 -9.982 9.788) 20.172 1.790 ( 15.666 -6.968 12.510) 21.224 2.206 ( 2.939 -1.812 -15.811) 16.184 2.406 ( 15.735 -3.852 -8.244) 18.177 3.131 ( 9.415 -9.598 5.259) 14.437 3.467 ( 6.306 1.147 2.454) 6.864 3.902 ( 9.198 -0.233 2.435) 9.518 3.957 ( 6.039 1.126 -4.093) 7.382 4.221 ( -11.626 8.381 13.291) 19.546 4.456 ( -0.403 5.493 -2.885) 6.218 4.757 ( -2.564 1.886 -1.878) 3.696 4.896 ( -1.173 4.029 4.783) 6.363 5.281 ( 6.722 -3.026 -0.619) 7.398 5.351 ( 6.189 4.541 -6.580) 10.110 5.726 ( 17.272 -3.192 -3.367) 17.885 5.812 ( 4.934 -3.732 -0.305) 6.194 6.178 ( -0.882 1.827 0.094) 2.031 6.710 ( -3.369 0.188 -1.869) 3.857 6.772 ( -1.744 1.938 0.840) 2.739 6.978 ( -4.852 -3.056 1.256) 5.870 7.040 ( -2.311 -4.163 -2.378) 5.322 7.163 ( 0.780 -4.418 0.900) 4.576 7.574 ( 3.028 -0.453 -0.406) 3.088 7.861 ( -2.141 -1.067 2.826) 3.702 8.025 ( 3.585 -3.103 -1.696) 5.036 8.372 ( 3.444 -1.359 3.052) 4.799 8.590 ( 7.875 -3.024 -2.200) 8.717 8.625 ( -0.099 -0.999 -1.101) 1.490 11.782 ( -13.487 14.923 0.766) 20.129 12.506 ( 32.513 25.843 3.026) 41.643 12.883 ( -22.019 -10.261 -1.985) 24.373 13.096 ( -20.336 3.353 0.003) 20.610 13.905 ( 15.837 11.180 1.161) 19.420 14.136 ( 27.022 13.579 -0.099) 30.242 15.599 ( 41.581 -24.716 1.029) 48.383 16.570 ( 26.726 -17.912 -18.627) 37.176 26.865 ( 0.011 -0.198 -0.541) 0.576 26.896 ( -0.454 -0.781 0.363) 0.974 26.938 ( -0.686 -0.961 0.548) 1.301 27.008 ( 0.115 -0.971 -1.174) 1.528 28.061 ( -1.557 0.974 1.385) 2.300 28.149 ( -0.809 0.724 -1.695) 2.013 33.779 ( -1.669 1.176 1.644) 2.621 33.933 ( -0.741 -0.738 -2.848) 3.034 34.360 ( 5.960 0.732 -1.390) 6.163 34.596 ( 8.850 0.716 2.834) 9.320 35.558 ( 2.162 1.434 5.518) 6.097 35.691 ( 2.058 -1.154 -4.629) 5.196 37.221 ( -0.463 -0.935 -0.967) 1.423 37.284 ( 1.574 -1.500 1.009) 2.397 42.241 ( 23.179 10.006 -2.143) 25.338 43.165 ( 27.131 21.953 0.311) 34.902 44.104 ( 35.257 -23.812 4.072) 42.739 44.897 ( 7.172 -8.355 -3.454) 11.540 45.290 ( 7.499 5.462 2.110) 9.514 45.622 ( 12.752 2.412 -5.277) 14.010 45.888 ( 5.839 -12.761 -0.453) 14.041 47.200 ( 13.927 -13.420 -4.949) 19.964 49.728 ( 13.238 7.787 0.289) 15.361 50.327 ( 6.042 0.220 -2.183) 6.428 50.408 ( 8.579 2.074 1.489) 8.951 53.729 ( 19.639 -38.778 -35.337) 56.019 62.240 ( 37.320 16.331 -12.404) 42.583 62.964 ( 16.460 -3.922 -6.962) 18.298 66.997 ( -12.628 0.416 8.837) 15.419 68.180 ( 3.397 -13.678 -14.351) 20.114 ======================= Grid point 259 (117/204) ======================= q-point: ( 0.36 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.967 ( 12.193 -10.507 7.593) 17.797 2.113 ( 13.516 -9.815 8.737) 18.851 2.217 ( 5.747 2.646 -11.051) 12.734 2.650 ( 15.509 -6.219 -4.965) 17.431 3.323 ( 2.315 -7.953 -0.893) 8.331 3.473 ( 0.237 3.439 5.493) 6.485 3.914 ( -9.312 4.453 6.826) 12.375 3.995 ( 9.551 9.534 -0.616) 13.509 4.065 ( -1.984 -2.084 2.240) 3.647 4.360 ( -3.511 1.181 -1.872) 4.150 4.657 ( -4.317 6.616 1.945) 8.136 4.828 ( -1.805 0.974 -2.731) 3.415 5.306 ( -0.647 3.096 1.047) 3.332 5.365 ( 13.499 6.505 -4.346) 15.602 5.876 ( 0.733 -4.552 0.443) 4.632 6.003 ( 13.930 -0.056 -1.152) 13.978 6.189 ( 1.711 -4.424 -1.736) 5.051 6.629 ( -4.727 2.827 -0.270) 5.515 6.772 ( 3.154 -0.354 0.819) 3.278 6.948 ( -2.566 0.722 -1.369) 2.997 7.102 ( -5.111 -7.831 2.815) 9.766 7.270 ( 5.530 -5.128 -1.058) 7.616 7.657 ( 5.191 -4.011 -1.689) 6.775 7.846 ( -0.806 1.715 2.346) 3.016 8.097 ( 0.544 -3.417 -1.131) 3.640 8.427 ( 5.112 1.367 2.409) 5.815 8.626 ( -0.199 0.218 -1.015) 1.057 8.743 ( 7.962 -4.849 -1.949) 9.524 11.419 ( -13.660 12.235 0.431) 18.343 12.461 ( 22.006 20.684 0.527) 30.205 12.630 ( -12.030 8.267 -0.778) 14.617 12.996 ( -23.322 -14.919 0.450) 27.689 13.917 ( 11.845 7.452 0.876) 14.021 14.249 ( 34.635 17.451 0.282) 38.784 16.325 ( 29.008 -17.093 1.919) 33.724 16.933 ( 9.980 -7.744 -10.472) 16.409 26.868 ( 0.087 -0.282 -0.454) 0.541 26.904 ( -0.542 -0.741 0.899) 1.285 26.947 ( -0.529 -0.977 0.039) 1.112 27.023 ( 0.140 -1.083 -1.052) 1.516 28.034 ( -1.173 0.961 1.126) 1.888 28.127 ( -0.675 0.625 -1.350) 1.634 33.749 ( -0.913 1.118 1.269) 1.922 33.933 ( -0.628 -1.053 -2.690) 2.956 34.405 ( 4.614 0.914 0.115) 4.705 34.667 ( 6.218 1.786 1.308) 6.600 35.562 ( 0.991 2.109 5.811) 6.261 35.716 ( 1.972 -0.610 -4.774) 5.201 37.231 ( -0.838 -1.475 -0.734) 1.848 37.319 ( 0.697 -1.168 0.279) 1.389 42.352 ( 20.372 6.629 -1.808) 21.499 43.136 ( 27.714 22.343 1.554) 35.633 44.586 ( 9.682 -5.460 5.207) 12.275 45.063 ( 5.837 -2.653 -3.336) 7.228 45.450 ( 15.140 -6.942 1.768) 16.749 45.660 ( 9.227 5.513 -2.337) 10.999 46.254 ( 14.685 -16.696 -0.831) 22.250 47.472 ( 7.900 -7.771 -1.935) 11.249 49.756 ( 11.228 6.462 0.214) 12.957 50.365 ( 4.942 1.978 -1.566) 5.549 50.589 ( 18.230 -4.564 2.095) 18.909 54.132 ( -8.626 -16.998 -14.753) 24.104 62.248 ( 2.796 12.625 9.459) 16.022 63.120 ( 3.422 -6.511 -22.090) 23.282 66.924 ( 3.165 3.514 6.068) 7.694 68.410 ( 7.270 -11.756 -13.316) 19.193 ======================= Grid point 260 (118/204) ======================= q-point: ( 0.45 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.175 ( 2.892 4.975 -6.139) 8.414 2.237 ( 8.982 -5.784 4.576) 11.622 2.427 ( 13.017 -7.139 5.831) 15.950 2.878 ( 12.534 -2.717 -2.735) 13.114 3.397 ( -2.049 5.242 4.499) 7.205 3.459 ( -1.323 -8.502 -4.807) 9.856 3.767 ( -8.278 1.265 12.642) 15.164 3.870 ( 2.982 12.010 -0.816) 12.402 4.114 ( -2.067 -4.905 -1.274) 5.473 4.334 ( -4.438 -2.087 -1.316) 5.078 4.481 ( -6.176 8.418 2.084) 10.647 4.825 ( 2.163 -1.289 -5.916) 6.430 5.222 ( -3.754 4.066 0.619) 5.568 5.417 ( 15.048 7.227 -2.427) 16.869 5.934 ( 0.442 -1.830 0.386) 1.922 6.057 ( -0.945 -0.818 0.087) 1.253 6.281 ( 2.471 -2.345 -2.844) 4.438 6.532 ( -5.146 2.555 0.971) 5.827 6.847 ( 8.041 0.344 -0.594) 8.070 6.899 ( -1.139 1.776 -0.697) 2.222 7.170 ( -4.534 -7.000 4.717) 9.582 7.414 ( 5.539 -4.246 -2.132) 7.298 7.769 ( 1.389 -4.388 -0.695) 4.655 7.799 ( -0.322 3.867 1.717) 4.244 8.137 ( -0.925 -2.479 -0.954) 2.812 8.455 ( 4.597 3.074 2.877) 6.233 8.613 ( 0.843 0.662 -2.149) 2.402 8.864 ( 3.292 -1.534 -1.554) 3.950 11.143 ( -9.665 4.896 -0.074) 10.835 12.358 ( 5.562 9.264 -0.620) 10.823 12.506 ( 13.781 11.262 -0.123) 17.798 12.952 ( -24.597 -14.042 0.341) 28.325 13.949 ( 11.219 5.667 0.568) 12.582 14.364 ( 36.717 20.266 0.794) 41.946 16.767 ( 14.377 -8.163 1.521) 16.602 16.994 ( -4.432 0.960 -6.312) 7.772 26.872 ( 0.160 -0.161 -0.334) 0.404 26.908 ( -0.803 -0.493 1.168) 1.501 26.957 ( -0.134 -0.929 -0.273) 0.977 27.036 ( -0.154 -0.854 -0.956) 1.291 28.014 ( -0.633 0.543 0.977) 1.284 28.110 ( -0.463 0.253 -1.133) 1.250 33.732 ( -0.155 0.705 1.120) 1.332 33.938 ( -0.412 -1.141 -2.737) 2.993 34.434 ( 3.084 1.165 1.130) 3.485 34.685 ( 3.222 3.075 0.198) 4.458 35.543 ( -0.172 2.801 6.233) 6.836 35.735 ( 1.811 -0.764 -5.125) 5.489 37.243 ( -0.855 -1.475 -0.504) 1.778 37.338 ( 0.157 -0.605 -0.128) 0.638 42.481 ( 18.205 4.640 -1.619) 18.857 43.106 ( 29.019 23.722 2.097) 37.540 44.674 ( 1.398 -0.377 3.561) 3.844 45.121 ( 4.022 0.416 -3.185) 5.147 45.589 ( -0.186 1.465 1.595) 2.174 45.749 ( 14.650 1.331 -1.773) 14.817 46.596 ( 8.358 -8.399 -0.271) 11.852 47.616 ( 3.910 -2.891 -0.843) 4.935 49.779 ( 9.136 5.622 0.085) 10.727 50.384 ( 6.818 3.544 -1.001) 7.749 50.860 ( 11.596 -3.486 0.614) 12.124 54.152 ( -7.404 -6.376 -4.384) 10.709 61.948 ( -31.826 8.472 14.404) 35.946 63.140 ( -15.708 -12.032 -21.887) 29.505 67.003 ( 21.686 6.393 5.819) 23.345 68.614 ( 9.046 -6.352 -12.632) 16.786 ======================= Grid point 261 (119/204) ======================= q-point: (-0.45 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.087 ( 2.627 8.940 -1.639) 9.461 2.340 ( 4.058 4.261 3.959) 7.092 2.618 ( 7.237 -1.354 1.455) 7.505 2.936 ( -0.123 5.724 -5.318) 7.814 3.339 ( 2.152 0.071 6.703) 7.041 3.524 ( 1.846 -0.252 -0.365) 1.898 3.693 ( -0.719 4.474 -4.453) 6.353 3.828 ( -5.558 -5.296 12.195) 14.410 4.173 ( -1.837 -6.641 -1.202) 6.995 4.283 ( -6.403 1.537 -2.665) 7.103 4.317 ( -4.069 2.324 1.742) 4.999 4.878 ( 4.051 -2.468 -5.545) 7.297 5.119 ( -5.024 2.409 -0.883) 5.641 5.460 ( 12.219 6.818 -0.289) 13.996 5.916 ( -5.403 2.179 -0.093) 5.827 6.044 ( -3.117 -0.897 -0.916) 3.370 6.303 ( 0.125 -0.519 -3.218) 3.262 6.454 ( -3.988 0.865 2.028) 4.557 6.829 ( 0.666 3.600 -2.442) 4.401 6.953 ( 7.865 0.847 1.754) 8.102 7.233 ( -3.295 -5.106 4.923) 7.821 7.457 ( -3.047 1.169 -1.590) 3.630 7.713 ( -2.904 2.580 1.230) 4.074 7.833 ( 4.287 0.453 -1.788) 4.667 8.129 ( -5.222 -0.421 -0.310) 5.249 8.443 ( 1.573 3.843 4.742) 6.303 8.645 ( 5.000 -1.243 -4.258) 6.684 8.824 ( -6.195 3.751 -0.863) 7.293 11.095 ( 0.676 -5.525 -0.526) 5.591 12.359 ( 17.152 8.656 -0.166) 19.213 12.545 ( 12.920 2.164 -1.253) 13.160 12.883 ( -21.821 -11.380 0.619) 24.618 13.993 ( 10.384 4.610 0.373) 11.367 14.447 ( 36.995 23.446 1.423) 43.822 16.780 ( -18.251 8.426 -5.169) 20.756 16.904 ( -0.485 0.891 1.284) 1.637 26.874 ( 0.200 0.088 -0.218) 0.309 26.906 ( -0.951 -0.173 1.206) 1.546 26.970 ( 0.145 -0.755 -0.279) 0.817 27.040 ( -0.486 -0.462 -1.023) 1.223 28.009 ( -0.076 -0.118 0.946) 0.956 28.104 ( -0.212 -0.335 -1.091) 1.161 33.731 ( 0.680 0.111 1.108) 1.305 33.945 ( -0.107 -1.040 -2.727) 2.921 34.441 ( 1.416 1.713 1.363) 2.607 34.647 ( 0.048 4.139 -0.299) 4.150 35.505 ( -1.065 3.020 6.411) 7.166 35.756 ( 1.434 -1.091 -5.313) 5.610 37.253 ( -0.510 -1.020 -0.219) 1.162 37.341 ( -0.199 0.124 -0.253) 0.345 42.599 ( 16.179 5.139 -1.268) 17.023 43.070 ( 31.289 25.830 2.282) 40.638 44.697 ( 0.418 -0.802 2.426) 2.589 45.130 ( 1.902 1.784 -3.285) 4.195 45.528 ( -2.005 4.710 2.038) 5.510 45.789 ( 2.793 6.816 -2.236) 7.698 46.678 ( -0.652 2.518 0.016) 2.601 47.640 ( -0.032 2.487 -0.925) 2.653 49.784 ( 7.176 5.912 0.182) 9.299 50.407 ( 9.154 5.050 -0.358) 10.461 50.849 ( -8.596 6.260 -2.179) 10.855 54.231 ( 4.398 -4.701 -2.063) 6.760 61.398 ( -51.036 3.401 10.324) 52.181 63.043 ( -33.586 -17.931 -18.423) 42.296 67.216 ( 31.545 7.965 8.087) 33.525 68.734 ( 9.189 0.380 -12.571) 15.576 ======================= Grid point 262 (120/204) ======================= q-point: (-0.36 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.960 ( 2.258 11.496 4.397) 12.514 2.223 ( -0.475 14.268 5.536) 15.312 2.642 ( 2.699 4.747 -3.634) 6.560 2.717 ( -5.583 13.063 -9.195) 16.922 3.424 ( 2.426 -1.319 5.228) 5.912 3.540 ( 5.210 4.771 6.603) 9.670 3.630 ( -4.424 -1.088 -6.301) 7.775 3.791 ( -10.300 0.908 5.076) 11.519 4.214 ( -4.331 -5.297 -1.567) 7.019 4.282 ( 1.862 -1.989 0.570) 2.784 4.328 ( -0.912 -8.189 3.321) 8.884 4.942 ( 1.289 -1.091 -1.797) 2.466 5.055 ( -3.117 -2.539 -5.684) 6.962 5.459 ( 0.457 5.486 1.199) 5.634 5.726 ( -11.009 7.413 -0.946) 13.306 6.009 ( -0.423 2.865 -1.509) 3.266 6.308 ( 0.825 -0.736 -3.076) 3.269 6.426 ( -3.372 -1.424 2.052) 4.196 6.792 ( 2.655 2.622 -1.638) 4.075 6.994 ( 3.395 3.292 2.101) 5.175 7.263 ( -2.807 -1.734 4.135) 5.290 7.355 ( -5.762 1.848 0.376) 6.063 7.675 ( 3.293 3.429 -2.550) 5.395 7.864 ( 3.757 0.565 -1.778) 4.194 8.033 ( -8.196 2.544 1.197) 8.664 8.400 ( -2.526 3.014 4.197) 5.751 8.623 ( -8.040 4.505 -0.382) 9.224 8.746 ( 2.931 -1.708 -3.682) 5.006 11.294 ( 8.882 -11.951 -0.799) 14.911 12.415 ( 26.426 16.362 0.788) 31.091 12.682 ( -16.118 -15.384 -3.771) 22.598 12.892 ( 10.430 -4.800 1.846) 11.629 14.039 ( 8.527 3.424 0.226) 9.192 14.476 ( 35.960 27.028 2.326) 45.045 16.308 ( -30.960 15.279 -5.718) 34.995 16.735 ( -15.287 9.998 0.448) 18.272 26.874 ( 0.359 0.298 -0.058) 0.470 26.899 ( -0.854 0.080 1.088) 1.385 26.980 ( 0.067 -0.470 -0.079) 0.481 27.035 ( -0.576 -0.023 -1.273) 1.397 28.020 ( 0.318 -0.787 1.038) 1.341 28.111 ( 0.038 -0.993 -1.215) 1.570 33.750 ( 1.625 -0.522 1.217) 2.096 33.954 ( 0.238 -0.889 -2.614) 2.771 34.416 ( -0.161 2.971 0.726) 3.062 34.564 ( -3.005 4.243 -0.080) 5.200 35.461 ( -1.580 2.704 6.517) 7.230 35.773 ( 0.812 -1.166 -5.594) 5.771 37.260 ( 0.092 -0.166 0.096) 0.213 37.328 ( -0.553 0.889 -0.162) 1.060 42.656 ( 13.830 10.127 0.158) 17.142 43.036 ( 32.525 25.677 1.589) 41.469 44.710 ( -1.218 0.521 2.273) 2.631 45.096 ( -0.843 2.152 -4.221) 4.813 45.408 ( -5.316 6.716 1.899) 8.774 45.597 ( -7.610 11.890 -3.357) 14.510 46.543 ( -2.368 11.528 1.029) 11.814 47.525 ( -4.721 8.913 -2.397) 10.366 49.761 ( 5.929 6.510 0.766) 8.839 50.419 ( 4.841 5.393 0.958) 7.310 50.604 ( -3.993 9.073 -5.318) 11.249 54.172 ( -16.866 10.197 -7.842) 21.212 60.880 ( -40.998 -5.467 4.781) 41.637 62.855 ( -47.572 -22.351 -16.825) 55.189 67.471 ( 30.677 8.118 11.134) 33.630 68.744 ( 8.108 7.187 -12.951) 16.886 ======================= Grid point 263 (121/204) ======================= q-point: (-0.27 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.812 ( 2.586 13.570 11.167) 17.763 1.947 ( -3.802 19.866 8.080) 21.781 2.418 ( -3.949 14.377 -11.489) 18.823 2.553 ( 3.685 9.234 -9.087) 13.469 3.332 ( -9.968 15.410 0.867) 18.373 3.428 ( -8.658 2.335 -1.590) 9.107 3.596 ( 2.019 0.893 4.330) 4.860 3.801 ( 2.513 -5.751 6.038) 8.709 4.239 ( -4.358 -3.313 -0.986) 5.562 4.386 ( 2.885 -7.225 -0.879) 7.829 4.464 ( -0.697 -8.182 4.303) 9.271 4.851 ( -17.609 4.268 0.506) 18.126 5.063 ( -5.232 -1.803 -5.137) 7.551 5.299 ( -3.446 -0.322 -1.945) 3.970 5.610 ( 6.131 6.396 0.498) 8.874 5.927 ( -2.671 5.283 -1.841) 6.199 6.334 ( 1.985 -1.462 -3.680) 4.430 6.410 ( -4.449 -1.323 2.098) 5.094 6.812 ( 5.422 0.169 -0.986) 5.514 6.961 ( -1.090 1.868 1.865) 2.856 7.249 ( -0.652 1.760 1.551) 2.435 7.300 ( -2.776 0.144 1.725) 3.271 7.651 ( 5.543 5.465 -3.274) 8.444 7.848 ( -8.718 1.703 1.403) 8.993 7.947 ( 3.508 0.803 -0.178) 3.603 8.298 ( -9.383 1.386 1.020) 9.540 8.508 ( -3.150 2.065 3.616) 5.221 8.793 ( 2.171 -0.994 -4.628) 5.208 11.614 ( 12.239 -13.861 -0.988) 18.517 12.458 ( 32.862 22.404 2.290) 39.839 12.637 ( -27.161 -16.303 -3.313) 31.851 13.228 ( 23.468 -8.143 -0.818) 24.854 14.077 ( 5.322 2.041 0.070) 5.701 14.421 ( 29.745 30.187 3.697) 42.540 15.618 ( -36.485 21.450 -8.411) 43.150 16.253 ( -29.128 20.414 -1.259) 35.592 26.873 ( 0.380 0.455 0.402) 0.716 26.892 ( -0.259 0.182 0.529) 0.616 26.984 ( -0.382 -0.221 0.272) 0.518 27.024 ( -0.246 0.372 -1.612) 1.672 28.043 ( 0.435 -1.270 1.260) 1.840 28.129 ( 0.254 -1.520 -1.466) 2.127 33.789 ( 2.563 -1.110 1.479) 3.160 33.966 ( 0.604 -0.847 -2.524) 2.730 34.347 ( -1.063 5.090 -0.313) 5.210 34.458 ( -5.820 2.996 0.434) 6.560 35.421 ( -1.677 2.074 6.722) 7.232 35.780 ( 0.028 -0.842 -6.196) 6.253 37.256 ( 0.601 1.606 0.512) 1.789 37.304 ( -0.885 0.960 -0.109) 1.310 42.581 ( 13.131 20.068 3.755) 24.275 43.010 ( 24.173 20.394 -1.034) 31.644 44.581 ( -8.003 12.481 2.311) 15.005 45.037 ( -3.199 1.058 -8.241) 8.903 45.209 ( -5.242 8.044 -0.668) 9.625 45.362 ( -6.705 5.958 -2.323) 9.265 46.319 ( 2.398 17.612 3.544) 18.124 47.235 ( -10.073 17.502 -6.460) 21.202 49.735 ( 7.106 6.481 1.786) 9.783 50.321 ( -8.005 1.029 -2.354) 8.407 50.558 ( 21.362 12.206 -3.714) 24.882 53.351 ( -58.694 36.816 -21.584) 72.569 60.762 ( -8.010 -14.026 1.594) 16.231 62.575 ( -58.606 -23.574 -16.119) 65.193 67.683 ( 22.139 7.493 13.771) 27.127 68.640 ( 6.856 12.820 -13.713) 19.985 ======================= Grid point 264 (122/204) ======================= q-point: (-0.18 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.586 ( -7.695 19.964 13.133) 25.105 1.663 ( 5.305 17.213 14.487) 23.115 2.146 ( -0.159 14.426 -11.478) 18.436 2.423 ( 5.253 10.407 -13.474) 17.817 2.859 ( -17.494 23.087 6.143) 29.611 3.309 ( -5.753 1.921 -8.866) 10.742 3.637 ( 6.252 1.714 7.101) 9.615 3.939 ( 2.085 -3.839 4.472) 6.252 4.183 ( -8.401 1.144 -4.980) 9.833 4.437 ( -23.364 -3.997 -1.774) 23.770 4.485 ( 0.748 -2.430 3.982) 4.724 4.702 ( 1.862 -8.515 4.571) 9.842 5.073 ( 2.390 -2.724 3.611) 5.116 5.390 ( 5.748 -4.828 -7.058) 10.304 5.575 ( 3.304 6.045 1.455) 7.041 5.791 ( -4.757 5.223 -2.864) 7.623 6.323 ( -5.728 1.241 3.666) 6.913 6.425 ( 3.804 -2.479 -5.833) 7.392 6.882 ( 3.227 -0.821 1.242) 3.554 6.946 ( 0.072 -1.580 -0.579) 1.684 7.222 ( 2.588 2.318 0.405) 3.498 7.279 ( -3.305 -0.964 2.011) 3.987 7.619 ( 6.238 6.016 -2.453) 9.007 7.704 ( -9.864 2.337 1.489) 10.246 8.013 ( 3.021 -2.163 1.915) 4.180 8.200 ( -6.197 -1.148 -1.308) 6.437 8.477 ( -0.449 1.386 4.956) 5.166 8.796 ( -0.486 0.423 -5.397) 5.435 11.975 ( 14.825 -13.904 -0.905) 20.345 12.430 ( 10.254 13.937 2.967) 17.555 12.644 ( 1.441 -4.293 -1.451) 4.755 13.519 ( 5.656 -0.103 -8.187) 9.951 14.054 ( -0.622 8.600 2.089) 8.872 14.220 ( 6.898 17.321 2.173) 18.770 14.925 ( -6.870 29.046 -8.084) 30.922 15.463 ( -35.116 33.059 -5.685) 48.563 26.868 ( -0.108 0.548 0.951) 1.103 26.893 ( 0.950 0.331 -0.465) 1.108 26.979 ( -0.984 -0.010 0.581) 1.143 27.013 ( 0.350 0.483 -1.628) 1.734 28.072 ( 0.257 -1.469 1.561) 2.159 28.154 ( 0.390 -1.756 -1.737) 2.500 33.845 ( 2.622 -1.620 2.016) 3.683 33.983 ( 1.254 -0.947 -2.753) 3.170 34.248 ( -0.197 6.168 -0.536) 6.194 34.341 ( -8.321 2.340 0.105) 8.645 35.394 ( -1.140 1.431 7.092) 7.325 35.768 ( -0.778 -0.064 -7.159) 7.201 37.222 ( 0.280 3.525 1.378) 3.795 37.283 ( -0.606 0.679 -0.686) 1.140 42.366 ( 9.027 25.098 8.569) 28.015 42.915 ( 7.862 14.518 -6.668) 17.806 44.244 ( -0.878 22.675 2.843) 22.870 44.849 ( -9.697 13.240 -16.123) 23.006 45.137 ( -0.777 -0.432 -0.681) 1.120 45.222 ( -4.697 3.677 -2.115) 6.329 46.083 ( 3.977 19.443 6.740) 20.959 46.726 ( -8.101 30.468 -15.735) 35.235 49.734 ( 9.506 7.031 3.458) 12.319 50.240 ( -5.608 -0.678 -5.464) 7.859 50.607 ( 23.822 15.340 -1.414) 28.369 51.841 ( -55.062 55.029 -35.913) 85.730 61.061 ( 17.437 -14.242 1.345) 22.554 62.180 ( -64.220 -19.448 -13.065) 68.361 67.777 ( 7.913 7.491 15.125) 18.641 68.464 ( 7.244 15.121 -14.518) 22.179 ======================= Grid point 265 (123/204) ======================= q-point: (-0.09 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.250 ( -4.382 17.405 16.375) 24.296 1.458 ( -3.447 17.711 18.051) 25.523 1.921 ( 5.628 15.876 -3.298) 17.164 2.302 ( 5.356 8.434 -15.349) 18.314 2.387 ( -5.415 18.655 8.246) 21.103 3.209 ( -1.869 0.701 -17.750) 17.862 3.698 ( 3.830 1.736 5.341) 6.798 3.886 ( -0.883 3.238 -2.753) 4.341 4.179 ( 1.218 -3.806 2.096) 4.512 4.341 ( -4.136 -3.131 -2.016) 5.565 4.558 ( -0.523 -5.613 12.373) 13.597 4.889 ( -0.520 -11.580 0.243) 11.595 5.204 ( 4.372 -5.461 5.033) 8.617 5.415 ( 1.628 4.485 4.005) 6.230 5.562 ( 2.856 0.314 -6.023) 6.674 5.693 ( -1.476 0.054 -5.751) 5.937 6.220 ( -8.444 2.577 5.563) 10.435 6.504 ( 7.774 -1.043 -7.931) 11.155 6.896 ( -2.281 -1.657 2.106) 3.519 6.998 ( 4.319 0.374 -2.468) 4.988 7.232 ( -2.264 -0.876 2.244) 3.306 7.278 ( -1.730 -3.080 0.945) 3.656 7.577 ( -7.769 0.855 0.431) 7.828 7.626 ( 9.999 3.254 -1.348) 10.601 8.045 ( -5.823 -2.958 4.747) 8.074 8.217 ( 4.876 -2.424 -2.529) 6.004 8.469 ( 0.471 1.826 5.135) 5.470 8.730 ( -4.469 3.581 -6.277) 8.496 12.250 ( -10.318 15.946 6.530) 20.084 12.391 ( 14.121 -17.902 1.244) 22.835 12.670 ( -15.822 -1.599 -0.886) 15.928 13.103 ( 11.561 27.771 -23.130) 37.945 14.061 ( 11.247 1.445 3.553) 11.883 14.170 ( 1.135 1.149 -2.212) 2.739 14.336 ( -32.291 34.786 5.501) 47.781 14.733 ( 34.519 42.348 -16.751) 57.145 26.861 ( -0.039 0.458 0.649) 0.795 26.894 ( 1.207 0.997 -1.099) 1.913 26.968 ( -1.130 0.091 0.836) 1.409 27.010 ( 0.499 0.178 -1.128) 1.247 28.098 ( -0.214 -1.301 1.794) 2.227 28.181 ( 0.286 -1.613 -1.886) 2.498 33.888 ( -1.258 -1.474 2.480) 3.147 34.017 ( 3.250 -1.367 -3.218) 4.774 34.176 ( 3.979 5.169 0.136) 6.525 34.201 ( -8.071 3.143 -0.413) 8.671 35.389 ( 0.600 0.921 7.550) 7.630 35.730 ( -1.232 1.120 -8.007) 8.178 37.174 ( 0.551 3.565 2.291) 4.273 37.259 ( -0.557 1.265 -1.624) 2.132 42.128 ( 5.553 16.463 11.652) 20.919 42.736 ( 3.503 13.168 -14.385) 19.814 43.692 ( -43.862 28.473 8.047) 52.909 44.414 ( 28.228 36.756 -28.077) 54.186 45.133 ( 2.188 1.232 -1.324) 2.838 45.152 ( 2.139 2.189 -1.426) 3.376 45.869 ( 4.566 14.737 2.466) 15.624 46.219 ( 17.307 32.975 -17.176) 41.011 49.695 ( -1.958 8.996 5.702) 10.829 50.131 ( -2.098 6.566 -12.999) 14.714 50.480 ( -11.847 9.290 2.031) 15.191 50.866 ( 51.835 47.980 -32.245) 77.645 61.505 ( 25.817 -8.320 4.248) 27.455 61.713 ( -51.364 -10.854 -4.817) 52.719 67.693 ( -6.477 8.208 13.523) 17.094 68.296 ( 6.374 12.508 -13.432) 19.429 ======================= Grid point 268 (124/204) ======================= q-point: ( 0.18 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.481 ( 19.360 0.000 11.203) 22.368 1.716 ( 18.727 0.000 12.571) 22.555 2.159 ( 3.850 0.000 -18.046) 18.452 2.366 ( 13.627 0.000 -9.378) 16.542 2.936 ( 15.694 0.000 11.133) 19.241 3.478 ( 6.641 0.000 1.718) 6.860 3.894 ( 2.925 0.000 -7.701) 8.238 3.995 ( 11.894 0.000 5.847) 13.254 4.353 ( -17.298 -0.000 14.182) 22.368 4.660 ( 12.267 0.000 -7.847) 14.562 4.784 ( 2.704 0.000 -1.639) 3.162 4.915 ( 2.923 0.000 8.232) 8.735 5.115 ( -3.936 -0.000 -3.153) 5.043 5.527 ( 16.517 0.000 -2.214) 16.664 5.646 ( 11.982 0.000 -5.124) 13.032 5.737 ( -0.599 -0.000 -2.550) 2.619 6.270 ( -0.728 -0.000 -0.888) 1.149 6.655 ( -3.925 -0.000 -0.747) 3.996 6.809 ( -6.498 -0.000 0.412) 6.511 6.881 ( -0.203 -0.000 -1.750) 1.761 7.040 ( -1.465 -0.000 2.304) 2.731 7.060 ( -2.105 -0.000 -3.122) 3.765 7.608 ( -0.421 -0.000 5.171) 5.188 7.756 ( -0.303 -0.000 -0.849) 0.902 8.010 ( 4.725 0.000 -0.478) 4.750 8.332 ( 5.627 0.000 3.066) 6.408 8.541 ( 4.999 0.000 -2.935) 5.797 8.621 ( 2.552 0.000 -1.497) 2.958 12.144 ( -16.575 -0.000 2.342) 16.740 12.487 ( -15.831 -0.000 -3.404) 16.193 12.980 ( 7.865 0.000 12.320) 14.617 13.323 ( -21.843 -0.000 -7.129) 22.977 14.225 ( 28.467 0.000 9.309) 29.951 14.705 ( 41.453 0.000 -7.136) 42.063 14.895 ( 48.377 0.000 5.467) 48.685 16.093 ( 41.493 0.000 -33.168) 53.120 26.863 ( -0.327 -0.000 -0.690) 0.764 26.879 ( 0.101 0.000 -0.002) 0.101 26.921 ( -0.870 -0.000 1.205) 1.486 26.990 ( -0.097 -0.000 -1.337) 1.341 28.078 ( -1.779 -0.000 1.739) 2.488 28.161 ( -1.040 -0.000 -2.117) 2.359 33.796 ( -2.468 -0.000 3.024) 3.903 33.928 ( 0.218 0.000 -4.384) 4.390 34.375 ( 6.594 0.000 -2.525) 7.061 34.609 ( 9.560 0.000 3.989) 10.359 35.591 ( 2.999 0.000 5.648) 6.394 35.656 ( 2.332 0.000 -4.468) 5.040 37.216 ( 0.084 0.000 -2.379) 2.381 37.252 ( 1.521 0.000 2.607) 3.018 42.720 ( 47.011 0.000 5.973) 47.389 43.393 ( 36.961 0.000 -12.250) 38.938 43.711 ( 26.607 0.000 2.005) 26.683 44.701 ( 8.507 0.000 -5.039) 9.888 45.548 ( 5.079 0.000 8.330) 9.756 45.588 ( -3.554 -0.000 -5.910) 6.896 45.699 ( 23.681 0.000 -5.004) 24.204 46.883 ( 25.068 0.000 -8.266) 26.396 49.952 ( 18.468 0.000 2.993) 18.709 50.339 ( 3.985 0.000 -2.668) 4.796 50.532 ( 12.147 0.000 -1.433) 12.231 52.768 ( 42.181 0.000 -48.295) 64.122 62.589 ( 45.314 0.000 -62.592) 77.273 62.829 ( 0.609 0.000 38.372) 38.377 67.005 ( -11.002 -0.000 17.310) 20.510 67.935 ( 9.124 0.000 -23.805) 25.494 ======================= Grid point 269 (125/204) ======================= q-point: ( 0.27 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.758 ( 20.305 -3.077 8.333) 22.163 1.947 ( 15.652 -1.480 9.760) 18.505 2.197 ( 8.028 -1.160 -12.367) 14.790 2.512 ( 13.148 -2.673 -7.204) 15.228 3.132 ( 8.002 -4.653 4.955) 10.499 3.518 ( 0.134 0.209 3.884) 3.892 3.931 ( 5.638 0.075 -6.500) 8.605 4.103 ( 0.462 1.914 11.184) 11.356 4.181 ( -9.042 1.434 7.707) 11.967 4.624 ( 4.726 11.512 -7.497) 14.528 4.754 ( -0.643 3.275 -1.927) 3.854 4.911 ( -6.772 2.217 6.078) 9.366 5.239 ( 8.736 -7.901 -3.577) 12.310 5.628 ( 17.062 9.116 -0.962) 19.368 5.734 ( -0.252 -2.956 -3.657) 4.709 5.882 ( 16.551 -6.805 -1.356) 17.946 6.210 ( -2.513 3.717 -1.415) 4.705 6.625 ( -5.175 -2.807 0.720) 5.931 6.757 ( -5.256 -1.277 0.866) 5.477 6.889 ( 1.679 -0.960 -0.118) 1.937 7.011 ( 0.047 1.099 -3.423) 3.596 7.110 ( 2.565 -5.012 -0.657) 5.668 7.600 ( -0.084 0.287 3.459) 3.472 7.807 ( 2.389 -3.059 0.592) 3.926 8.055 ( 4.239 0.529 -0.527) 4.304 8.428 ( 7.389 -1.500 3.341) 8.247 8.600 ( 4.109 -1.196 -3.247) 5.372 8.655 ( 5.158 -0.165 -1.781) 5.459 11.822 ( -18.277 12.680 1.192) 22.277 12.419 ( -21.167 -13.649 -2.228) 25.284 12.901 ( -11.462 8.743 5.071) 15.282 13.071 ( -8.310 3.371 -1.664) 9.121 14.409 ( 34.482 23.156 6.806) 42.090 14.896 ( 42.658 22.039 -1.738) 48.046 15.708 ( 41.652 -21.864 4.904) 47.297 16.547 ( 24.773 -14.411 -22.960) 36.722 26.859 ( -0.207 -0.194 -0.591) 0.655 26.882 ( -0.363 -0.489 0.368) 0.712 26.921 ( -0.392 -0.504 0.926) 1.124 26.992 ( 0.025 -0.710 -1.359) 1.534 28.058 ( -1.608 0.493 1.587) 2.312 28.142 ( -1.060 0.288 -1.943) 2.232 33.774 ( -2.224 0.319 2.833) 3.616 33.921 ( 0.453 0.163 -4.141) 4.169 34.436 ( 5.887 0.697 -1.279) 6.065 34.708 ( 7.635 0.713 2.644) 8.111 35.617 ( 2.116 1.508 4.408) 5.116 35.688 ( 2.311 -1.287 -3.014) 4.010 37.209 ( -0.134 0.113 -1.674) 1.683 37.277 ( 0.319 -1.224 1.369) 1.864 42.960 ( 43.408 28.390 1.579) 51.892 43.777 ( 25.607 13.384 -0.672) 28.902 44.154 ( 33.410 -21.101 1.364) 39.539 44.859 ( 10.344 -7.329 -3.128) 13.057 45.462 ( 2.953 5.694 0.152) 6.416 45.763 ( 6.947 -11.681 5.545) 14.679 45.902 ( 25.306 8.124 -6.546) 27.372 47.197 ( 18.225 -8.285 -4.598) 20.541 50.089 ( 19.208 10.325 4.144) 22.198 50.397 ( 8.199 0.056 -2.891) 8.694 50.624 ( 18.476 7.722 -1.358) 20.071 53.286 ( 15.072 -29.858 -29.026) 44.285 62.626 ( -3.316 11.295 -5.883) 13.160 62.915 ( -5.455 -7.522 -12.961) 15.947 66.986 ( 1.050 0.388 20.071) 20.103 68.101 ( 20.876 -6.220 -29.648) 36.790 ======================= Grid point 270 (126/204) ======================= q-point: ( 0.36 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.043 ( 17.491 -3.638 5.695) 18.751 2.149 ( 9.066 -4.053 2.870) 10.337 2.320 ( 13.504 -1.723 -2.281) 13.803 2.717 ( 13.314 -6.527 -4.526) 15.503 3.263 ( 2.780 -3.705 -0.676) 4.681 3.505 ( -1.497 1.279 3.698) 4.190 3.886 ( -11.401 4.974 9.208) 15.477 4.021 ( -1.178 -0.793 1.119) 1.808 4.215 ( 4.661 0.859 2.611) 5.411 4.419 ( 0.678 15.191 -5.312) 16.107 4.694 ( -3.068 3.574 -1.404) 4.915 4.806 ( -4.707 1.778 0.324) 5.042 5.339 ( 1.385 1.802 -2.169) 3.142 5.671 ( 16.042 8.535 -0.487) 18.178 5.799 ( -0.542 -5.701 -0.422) 5.742 6.117 ( 4.303 1.886 -1.940) 5.083 6.137 ( 1.667 -4.554 -1.310) 5.023 6.595 ( -5.090 0.544 -0.304) 5.128 6.783 ( 3.047 -4.522 3.927) 6.720 6.930 ( 2.094 -0.061 -0.214) 2.106 7.016 ( 2.855 -1.432 -2.862) 4.288 7.241 ( 5.638 -6.132 -2.144) 8.602 7.628 ( -0.704 -3.203 2.374) 4.049 7.872 ( 4.965 0.545 1.014) 5.097 8.090 ( 2.708 -0.242 -0.404) 2.748 8.528 ( 6.975 1.136 4.037) 8.138 8.634 ( 2.667 0.026 -3.478) 4.383 8.758 ( 7.597 -3.639 -2.186) 8.702 11.414 ( -20.023 11.669 0.610) 23.183 12.360 ( -24.823 -13.079 -1.844) 28.118 12.627 ( -11.255 7.301 1.456) 13.494 13.001 ( 2.845 3.976 0.821) 4.958 14.408 ( 34.138 26.824 2.836) 43.508 15.032 ( 42.207 21.981 -0.236) 47.588 16.401 ( 27.900 -15.290 4.264) 32.099 16.880 ( 8.965 -8.613 -13.121) 18.075 26.862 ( 0.002 -0.417 -0.483) 0.638 26.887 ( -0.602 -0.722 0.761) 1.209 26.928 ( -0.205 -0.725 0.331) 0.823 27.004 ( -0.089 -1.103 -1.096) 1.557 28.036 ( -1.246 0.722 1.342) 1.969 28.121 ( -0.953 0.348 -1.597) 1.892 33.752 ( -1.640 0.391 2.427) 2.955 33.915 ( 0.373 -0.080 -3.830) 3.849 34.480 ( 5.055 1.403 0.143) 5.248 34.767 ( 5.527 1.944 1.243) 5.989 35.619 ( 1.167 2.041 4.413) 5.000 35.720 ( 1.981 -0.623 -3.132) 3.758 37.205 ( -0.376 -0.517 -1.092) 1.265 37.301 ( -0.370 -1.576 0.453) 1.681 42.988 ( 39.948 27.412 -1.030) 48.459 43.798 ( 25.956 19.299 2.500) 32.441 44.607 ( 7.944 -6.510 2.708) 10.622 45.084 ( 9.328 -4.430 -2.545) 10.635 45.498 ( 5.610 -2.888 0.221) 6.313 46.004 ( 25.309 12.684 -5.142) 28.772 46.151 ( 16.756 -17.916 5.403) 25.118 47.473 ( 12.388 -5.928 -2.644) 13.986 50.107 ( 18.411 14.925 1.999) 23.785 50.498 ( 14.184 2.988 -2.515) 14.712 50.775 ( 21.446 1.382 0.817) 21.506 53.717 ( -2.536 -22.651 -12.848) 26.164 62.238 ( -36.372 10.068 10.617) 39.205 62.828 ( -24.056 -8.822 -20.130) 32.584 67.121 ( 15.625 0.417 18.401) 24.144 68.395 ( 24.670 -6.255 -28.585) 38.273 ======================= Grid point 271 (127/204) ======================= q-point: ( 0.45 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.220 ( 4.818 0.287 -0.638) 4.869 2.313 ( 12.571 -3.210 2.698) 13.252 2.538 ( 14.864 -4.139 4.538) 16.083 2.968 ( 12.720 -6.292 -2.547) 14.418 3.299 ( -4.148 -3.807 -7.286) 9.208 3.469 ( 0.426 4.627 4.968) 6.802 3.719 ( -10.306 1.139 13.975) 17.401 4.024 ( -2.492 -0.837 0.228) 2.638 4.163 ( 7.607 17.071 -3.675) 19.047 4.260 ( -3.660 -1.054 0.067) 3.810 4.536 ( -7.539 8.036 1.536) 11.126 4.785 ( -0.278 -2.432 -6.437) 6.887 5.255 ( -3.564 5.327 -1.273) 6.534 5.701 ( 9.556 7.462 1.112) 12.175 5.887 ( 1.376 -5.167 0.040) 5.348 6.054 ( -0.513 3.657 -2.170) 4.284 6.232 ( -1.512 -4.402 -1.750) 4.972 6.512 ( -4.995 2.249 1.115) 5.591 6.910 ( 1.485 -1.489 1.514) 2.591 6.952 ( 9.554 0.491 -0.962) 9.615 7.089 ( 3.843 -2.514 0.709) 4.647 7.388 ( 3.377 -5.047 -1.650) 6.293 7.670 ( -3.152 -4.111 1.347) 5.353 7.908 ( 7.315 3.665 0.528) 8.199 8.114 ( 0.304 -0.251 -0.152) 0.423 8.564 ( 4.113 3.385 4.409) 6.915 8.651 ( 4.223 1.425 -3.599) 5.729 8.870 ( 2.883 -1.545 -1.943) 3.805 11.078 ( -14.568 4.593 0.106) 15.276 12.278 ( -24.116 -13.165 -1.614) 27.523 12.479 ( -2.006 2.206 0.961) 3.133 12.995 ( 7.280 4.641 0.354) 8.640 14.393 ( 32.503 24.249 0.877) 40.561 15.163 ( 41.414 22.301 0.676) 47.042 16.805 ( 12.025 -6.726 2.388) 13.984 16.937 ( -4.570 0.915 -7.179) 8.559 26.868 ( 0.107 -0.420 -0.358) 0.562 26.892 ( -0.860 -0.653 1.023) 1.488 26.941 ( 0.140 -0.945 -0.162) 0.969 27.015 ( -0.484 -1.054 -0.853) 1.440 28.017 ( -0.736 0.561 1.152) 1.478 28.104 ( -0.758 0.196 -1.320) 1.535 33.739 ( -0.858 0.201 2.118) 2.294 33.914 ( 0.248 -0.549 -3.660) 3.709 34.505 ( 4.030 2.158 1.238) 4.736 34.775 ( 3.131 3.608 0.119) 4.778 35.600 ( 0.056 2.805 5.191) 5.901 35.739 ( 1.894 -0.199 -4.025) 4.453 37.212 ( -0.350 -1.176 -0.693) 1.409 37.318 ( -0.777 -1.446 -0.027) 1.642 43.031 ( 37.104 23.000 -1.478) 43.680 43.799 ( 27.016 20.206 3.480) 33.915 44.690 ( 0.970 -0.383 2.407) 2.623 45.177 ( 5.021 0.523 -2.753) 5.750 45.589 ( 1.221 -1.857 2.178) 3.112 46.049 ( 17.705 11.485 -7.454) 22.381 46.574 ( 14.409 -8.995 6.273) 18.108 47.639 ( 7.574 -1.922 -2.254) 8.133 50.075 ( 15.158 13.886 0.253) 20.558 50.610 ( 21.690 7.722 -1.750) 23.090 50.968 ( 10.198 2.007 0.873) 10.430 53.931 ( -1.166 -14.222 -4.251) 14.890 61.587 ( -56.054 8.654 9.473) 57.504 62.586 ( -39.762 -12.448 -13.513) 43.802 67.381 ( 23.832 1.251 17.513) 29.602 68.678 ( 23.654 -2.982 -25.703) 35.057 ======================= Grid point 272 (128/204) ======================= q-point: (-0.45 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.208 ( 1.826 4.941 1.324) 5.431 2.478 ( 9.880 0.805 3.415) 10.484 2.735 ( 10.190 -0.143 2.123) 10.409 3.053 ( 3.269 7.930 -4.232) 9.564 3.355 ( -3.037 -12.506 -9.971) 16.280 3.398 ( -0.476 4.092 9.654) 10.496 3.717 ( -2.227 -3.838 11.247) 12.091 3.953 ( 4.488 11.638 2.378) 12.698 4.050 ( -0.276 0.365 -3.769) 3.797 4.232 ( -3.626 0.996 -0.086) 3.761 4.336 ( -5.893 5.778 0.588) 8.274 4.823 ( 0.488 -4.237 -8.383) 9.406 5.127 ( -4.103 4.760 -0.657) 6.318 5.645 ( -3.574 5.566 2.821) 7.191 5.927 ( -0.843 3.315 1.094) 3.591 6.025 ( 5.424 0.566 -4.344) 6.972 6.255 ( -2.676 -2.952 -1.960) 4.440 6.435 ( -3.921 1.623 2.013) 4.697 6.899 ( 2.990 3.278 -2.149) 4.930 7.069 ( 7.840 0.625 1.843) 8.078 7.172 ( 3.680 -2.371 1.823) 4.742 7.402 ( -7.462 -0.063 1.483) 7.608 7.706 ( 2.613 -1.540 -2.519) 3.943 7.929 ( 5.447 3.466 0.961) 6.527 8.091 ( -2.111 1.690 -0.489) 2.748 8.533 ( -0.299 4.976 6.512) 8.201 8.690 ( 6.636 0.202 -5.445) 8.586 8.810 ( -7.890 4.976 -0.888) 9.371 11.004 ( -0.237 -6.203 -0.427) 6.223 12.212 ( -26.394 -15.367 -1.701) 30.589 12.531 ( 10.710 -2.094 0.991) 10.957 13.028 ( 11.070 4.102 -0.256) 11.808 14.397 ( 30.891 22.015 -0.043) 37.933 15.274 ( 40.566 23.908 1.663) 47.117 16.691 ( -19.328 9.546 -5.782) 22.319 16.915 ( -2.199 2.178 2.251) 3.826 26.874 ( 0.169 -0.258 -0.238) 0.390 26.893 ( -0.970 -0.458 1.095) 1.533 26.958 ( 0.356 -0.901 -0.283) 1.009 27.020 ( -0.842 -0.843 -0.837) 1.456 28.009 ( -0.219 0.088 1.084) 1.110 28.093 ( -0.514 -0.179 -1.222) 1.338 33.739 ( -0.015 -0.268 1.963) 1.982 33.920 ( 0.145 -0.950 -3.566) 3.693 34.508 ( 2.816 3.030 1.778) 4.502 34.727 ( 0.715 5.363 -0.593) 5.443 35.561 ( -0.787 3.404 5.792) 6.764 35.752 ( 1.717 -0.221 -4.685) 4.995 37.229 ( -0.033 -1.403 -0.296) 1.435 37.327 ( -0.976 -1.018 -0.286) 1.439 43.101 ( 34.540 20.232 -1.298) 40.051 43.796 ( 26.318 20.730 4.057) 33.747 44.705 ( 1.537 0.097 1.339) 2.040 45.184 ( 1.581 2.699 -2.126) 3.782 45.580 ( -1.472 3.453 2.695) 4.620 45.982 ( 4.794 12.608 -8.058) 15.712 46.759 ( 9.093 2.915 6.862) 11.759 47.689 ( 2.979 2.401 -2.994) 4.858 50.026 ( 11.001 11.712 -0.231) 16.070 50.722 ( 21.175 14.381 2.805) 25.750 50.887 ( -0.163 8.235 -4.784) 9.525 54.124 ( -2.136 -10.084 -2.931) 10.716 60.856 ( -54.156 4.084 5.757) 54.614 62.276 ( -49.331 -16.107 -8.828) 52.639 67.663 ( 23.198 2.728 18.431) 29.754 68.878 ( 20.696 2.083 -23.565) 31.432 ======================= Grid point 273 (129/204) ======================= q-point: (-0.36 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.138 ( 1.871 7.752 6.615) 10.361 2.479 ( 3.912 11.301 4.372) 12.733 2.768 ( 5.391 5.901 -1.735) 8.179 2.883 ( 1.412 13.361 -7.734) 15.503 3.363 ( -7.095 -3.718 0.807) 8.050 3.504 ( 1.353 -5.264 0.320) 5.445 3.737 ( -2.715 2.571 7.347) 8.244 3.861 ( 10.280 11.084 1.651) 15.207 4.056 ( -3.482 -4.445 -3.654) 6.725 4.201 ( -1.937 -5.448 3.114) 6.568 4.282 ( 0.280 -0.436 0.552) 0.758 4.868 ( -1.965 -4.016 -9.365) 10.377 5.027 ( -2.766 2.964 0.292) 4.065 5.437 ( -17.376 6.396 1.856) 18.608 5.851 ( 4.345 7.661 1.688) 8.968 6.054 ( 3.558 2.599 -3.825) 5.835 6.273 ( -0.962 -2.743 -1.161) 3.130 6.382 ( -3.708 0.180 1.007) 3.846 6.884 ( 5.147 3.750 -1.751) 6.605 7.064 ( -3.156 4.107 2.114) 5.594 7.244 ( 2.351 -1.452 1.778) 3.285 7.329 ( -0.889 1.191 1.663) 2.230 7.752 ( 5.897 1.007 -4.098) 7.251 7.909 ( -2.661 2.591 2.395) 4.419 8.039 ( 2.697 3.993 -1.562) 5.065 8.426 ( -8.010 6.403 4.522) 11.208 8.606 ( -8.199 4.946 2.101) 9.803 8.755 ( 4.648 -0.788 -5.294) 7.089 11.218 ( 10.831 -12.078 -0.500) 16.231 12.149 ( -26.122 -15.713 -2.293) 30.570 12.746 ( 16.228 -3.771 2.190) 16.803 13.133 ( 14.505 -0.053 -1.652) 14.599 14.406 ( 30.110 21.367 -0.549) 36.925 15.332 ( 37.266 27.555 3.586) 46.485 16.187 ( -30.693 16.258 -6.038) 35.254 16.716 ( -16.553 10.662 1.331) 19.734 26.879 ( 0.279 -0.081 -0.002) 0.291 26.891 ( -0.776 -0.275 0.953) 1.259 26.972 ( 0.091 -0.538 -0.034) 0.546 27.020 ( -0.719 -0.621 -1.147) 1.489 28.015 ( 0.107 -0.505 1.153) 1.264 28.093 ( -0.244 -0.737 -1.306) 1.519 33.757 ( 0.732 -0.953 1.983) 2.319 33.929 ( 0.105 -1.207 -3.528) 3.730 34.482 ( 1.494 4.059 1.749) 4.665 34.629 ( -1.231 6.720 -0.828) 6.882 35.510 ( -1.175 3.446 6.238) 7.222 35.761 ( 1.275 -0.269 -5.215) 5.375 37.251 ( 0.437 -1.154 0.081) 1.236 37.325 ( -1.002 -0.261 -0.367) 1.099 43.163 ( 31.768 20.687 -0.458) 37.913 43.752 ( 20.227 21.578 3.957) 29.839 44.733 ( 3.762 0.737 0.553) 3.874 45.111 ( -4.826 4.261 -1.295) 6.567 45.472 ( -3.652 7.168 2.075) 8.308 45.727 ( -5.363 16.070 -8.445) 18.929 46.758 ( 7.702 11.169 9.543) 16.587 47.611 ( -1.252 7.916 -5.641) 9.800 49.962 ( 7.210 9.793 0.831) 12.189 50.482 ( -12.395 10.974 0.854) 16.577 50.999 ( 41.703 15.002 -4.527) 44.550 53.963 ( -37.344 6.039 -9.622) 39.034 60.432 ( -20.800 -6.268 2.909) 21.917 61.940 ( -54.518 -18.403 -6.376) 57.892 67.882 ( 16.223 4.042 19.941) 26.023 68.958 ( 16.673 7.913 -22.257) 28.914 ======================= Grid point 274 (130/204) ======================= q-point: (-0.27 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.040 ( 1.202 11.006 12.610) 16.781 2.271 ( 0.847 18.343 4.732) 18.962 2.628 ( 1.974 15.546 -7.626) 17.428 2.735 ( 6.062 9.319 -7.709) 13.529 3.306 ( -8.951 -0.055 -1.956) 9.162 3.443 ( -7.134 9.098 -1.437) 11.651 3.715 ( 1.355 -0.722 10.192) 10.307 3.873 ( 15.318 5.928 1.379) 16.483 4.112 ( -0.228 -4.921 -4.075) 6.394 4.294 ( -5.586 -6.699 2.148) 8.983 4.340 ( 1.495 -5.072 2.628) 5.905 4.715 ( -19.135 6.794 -3.492) 20.604 5.013 ( 1.633 -1.814 -1.396) 2.811 5.223 ( -5.845 -1.156 -1.640) 6.179 5.801 ( 5.044 7.145 2.216) 9.022 5.995 ( -0.138 6.679 -3.018) 7.331 6.310 ( 0.661 -2.734 -1.593) 3.233 6.352 ( -2.945 -1.130 -0.081) 3.156 6.890 ( 2.413 2.118 1.574) 3.576 6.967 ( -1.235 2.617 -1.314) 3.178 7.263 ( -1.063 0.347 2.528) 2.764 7.332 ( 4.555 2.775 -0.519) 5.359 7.768 ( -0.139 3.447 0.761) 3.533 7.820 ( -0.716 3.451 -1.202) 3.724 8.027 ( 4.374 3.682 0.498) 5.739 8.214 ( -10.955 3.453 -0.581) 11.502 8.520 ( -2.247 1.696 5.920) 6.556 8.789 ( 1.987 -0.284 -5.486) 5.841 11.563 ( 14.770 -13.031 0.412) 19.701 12.101 ( -23.016 -15.180 -3.751) 27.825 12.964 ( 16.044 0.884 4.979) 16.822 13.347 ( 11.937 -7.721 -4.673) 14.965 14.415 ( 31.156 22.201 -0.766) 38.264 15.116 ( -8.573 32.894 4.754) 34.324 15.660 ( 2.359 19.219 -5.680) 20.179 16.235 ( -27.369 19.125 -1.040) 33.405 26.880 ( -0.370 0.132 0.917) 0.998 26.893 ( 0.510 -0.229 0.003) 0.559 26.975 ( -0.622 -0.182 0.391) 0.757 27.019 ( -0.023 -0.269 -1.575) 1.598 28.031 ( 0.106 -1.041 1.335) 1.696 28.104 ( 0.037 -1.328 -1.515) 2.015 33.792 ( 0.928 -1.697 2.200) 2.929 33.943 ( 0.337 -1.413 -3.627) 3.907 34.425 ( 0.253 5.100 1.385) 5.290 34.498 ( -2.049 7.352 -0.708) 7.665 35.463 ( -1.083 2.932 6.745) 7.434 35.762 ( 0.647 -0.089 -5.897) 5.933 37.272 ( 0.870 -0.435 0.245) 1.003 37.310 ( -0.951 0.792 -0.184) 1.251 43.149 ( 25.043 25.088 3.122) 35.585 43.560 ( 5.378 23.213 -0.127) 23.829 44.715 ( -0.144 8.614 3.785) 9.410 44.970 ( -6.549 1.009 -4.780) 8.170 45.306 ( -3.389 8.871 0.810) 9.531 45.431 ( -2.148 12.285 -7.274) 14.438 46.639 ( 2.154 16.156 15.072) 22.200 47.397 ( -1.160 14.722 -12.087) 19.084 49.906 ( 5.095 6.615 3.166) 8.930 50.257 ( -7.765 3.323 -2.811) 8.902 51.233 ( 47.533 22.560 0.889) 52.623 53.070 ( -59.576 25.599 -27.526) 70.444 60.607 ( 18.771 -14.287 1.820) 23.659 61.593 ( -54.994 -18.486 -4.492) 58.191 67.983 ( 5.213 5.070 20.653) 21.896 68.907 ( 12.265 13.042 -20.902) 27.522 ======================= Grid point 275 (131/204) ======================= q-point: (-0.18 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.839 ( -3.980 17.818 13.987) 22.999 2.029 ( 3.919 18.358 7.264) 20.128 2.394 ( 3.129 15.596 -9.137) 18.344 2.619 ( 4.179 10.526 -12.209) 16.653 3.086 ( -4.151 19.389 3.466) 20.129 3.248 ( -6.178 2.536 -3.854) 7.710 3.777 ( 3.975 1.029 10.095) 10.898 4.010 ( 9.444 1.760 3.871) 10.357 4.096 ( -13.348 3.398 -5.466) 14.819 4.162 ( -2.584 -3.552 -2.678) 5.144 4.458 ( 1.899 -4.897 3.911) 6.549 4.589 ( -1.668 -6.634 1.409) 6.984 5.072 ( 4.216 -1.965 2.098) 5.103 5.287 ( 0.593 -8.667 -7.049) 11.187 5.720 ( -1.521 8.211 2.786) 8.803 5.861 ( 0.417 7.895 -3.176) 8.521 6.304 ( -2.860 1.575 0.938) 3.397 6.406 ( 4.272 -4.752 -3.603) 7.336 6.847 ( -6.074 -0.228 3.251) 6.893 6.986 ( 6.939 0.539 -3.204) 7.662 7.240 ( -1.044 1.381 2.520) 3.057 7.324 ( 3.288 3.639 -1.435) 5.110 7.648 ( -7.285 3.947 3.358) 8.940 7.796 ( 6.708 5.792 -3.253) 9.441 7.981 ( -7.549 -0.528 4.364) 8.736 8.167 ( 5.685 -0.345 -3.864) 6.882 8.503 ( -0.420 0.738 6.498) 6.554 8.780 ( -0.644 0.747 -5.779) 5.863 11.902 ( 1.984 -13.899 3.421) 14.451 12.116 ( -4.334 -12.791 -6.578) 15.023 13.065 ( 3.812 7.967 9.126) 12.700 13.483 ( -8.122 -3.909 -9.941) 13.419 14.334 ( -8.902 22.519 3.147) 24.418 14.486 ( 19.838 22.045 -4.242) 29.959 15.338 ( -24.052 29.150 6.963) 38.428 15.734 ( 21.480 23.518 -11.871) 33.991 26.874 ( -0.407 0.282 0.991) 1.108 26.906 ( 1.158 -0.115 -0.416) 1.236 26.968 ( -0.991 -0.001 0.636) 1.178 27.019 ( 0.480 0.154 -1.612) 1.689 28.053 ( -0.209 -1.412 1.520) 2.086 28.126 ( 0.252 -1.736 -1.712) 2.451 33.831 ( -0.617 -2.052 2.395) 3.214 33.967 ( 1.329 -1.758 -3.779) 4.375 34.338 ( -2.483 5.524 1.179) 6.170 34.372 ( 1.351 7.315 -0.540) 7.458 35.433 ( -0.337 1.982 7.349) 7.619 35.749 ( 0.048 0.381 -6.784) 6.795 37.274 ( 0.386 2.222 0.479) 2.306 37.287 ( -0.142 0.370 -0.152) 0.424 42.858 ( -5.462 28.518 9.275) 30.481 43.302 ( 17.993 22.337 -10.166) 30.431 44.423 ( -24.458 16.806 10.222) 31.387 44.919 ( 4.849 5.440 -10.716) 12.959 45.170 ( -1.774 4.193 1.302) 4.736 45.270 ( 2.662 7.162 -4.332) 8.783 46.354 ( -11.584 18.078 16.000) 26.777 47.135 ( 12.409 20.890 -18.896) 30.780 49.887 ( 2.432 4.016 5.504) 7.235 50.161 ( -4.400 0.168 -5.565) 7.097 51.066 ( -24.535 27.221 11.564) 38.428 52.297 ( 48.196 34.799 -54.260) 80.485 61.169 ( 36.282 -14.065 1.612) 38.946 61.273 ( -45.002 -15.740 -1.839) 47.711 67.929 ( -7.716 6.434 18.834) 21.346 68.751 ( 8.020 15.688 -18.086) 25.249 ======================= Grid point 276 (132/204) ======================= q-point: (-0.09 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.539 ( -1.168 19.243 13.025) 23.266 1.765 ( -2.207 21.377 12.363) 24.793 2.184 ( 3.272 12.151 -12.650) 17.843 2.454 ( 1.298 10.184 -14.572) 17.826 2.799 ( 12.420 22.933 11.135) 28.358 3.182 ( 1.724 0.429 -7.268) 7.482 3.724 ( -6.481 2.789 4.912) 8.598 3.958 ( 4.263 0.335 -0.138) 4.278 4.129 ( -2.442 -5.060 0.879) 5.687 4.329 ( 19.203 -2.714 0.752) 19.409 4.527 ( -0.891 -2.880 6.902) 7.531 4.718 ( 0.036 -9.141 -1.412) 9.250 5.190 ( 6.756 -3.992 2.643) 8.280 5.375 ( -5.162 -4.894 -6.584) 9.693 5.562 ( -4.092 4.144 -0.182) 5.827 5.774 ( 3.700 6.494 -2.045) 7.749 6.227 ( -3.171 4.076 2.447) 5.714 6.540 ( 8.252 -4.495 -5.311) 10.793 6.814 ( -4.797 -2.861 2.126) 5.976 7.047 ( 3.528 -1.046 -2.597) 4.504 7.201 ( -1.778 3.381 2.613) 4.628 7.288 ( -1.117 2.957 0.546) 3.207 7.545 ( -2.414 1.962 0.234) 3.119 7.793 ( 8.641 3.762 -1.986) 9.631 7.937 ( -6.248 -2.410 3.518) 7.565 8.258 ( 8.183 -1.213 -1.985) 8.507 8.513 ( 0.877 0.898 6.535) 6.655 8.719 ( -3.130 2.802 -5.710) 7.089 11.957 ( -20.085 -10.275 -0.303) 22.563 12.422 ( 6.567 -3.934 4.221) 8.741 12.589 ( -19.880 13.383 -1.586) 24.017 13.445 ( 1.767 -3.505 -4.383) 5.884 14.120 ( -3.499 -0.203 -0.679) 3.570 14.445 ( -27.028 32.457 -3.224) 42.359 14.538 ( 29.301 24.747 2.205) 38.417 15.739 ( 45.270 26.917 -13.597) 54.395 26.868 ( -0.119 0.348 0.565) 0.674 26.915 ( 0.721 0.381 -0.757) 1.113 26.958 ( -0.747 0.135 0.754) 1.070 27.017 ( 0.510 0.365 -1.266) 1.413 28.075 ( -0.723 -1.507 1.577) 2.298 28.152 ( 0.181 -1.759 -1.772) 2.503 33.841 ( -3.278 -1.438 1.871) 4.039 34.002 ( 0.542 -1.594 -3.231) 3.643 34.230 ( -0.170 4.937 0.246) 4.946 34.318 ( 6.029 5.139 0.744) 7.957 35.434 ( 1.196 0.768 7.739) 7.869 35.720 ( -0.087 1.032 -7.528) 7.599 37.237 ( 0.519 2.898 1.350) 3.239 37.275 ( 0.205 1.423 -0.886) 1.689 42.408 ( -8.099 18.538 7.626) 21.620 43.118 ( 9.091 24.917 -16.961) 31.483 43.666 ( -33.779 29.307 14.848) 47.121 44.851 ( 8.624 10.010 -7.609) 15.247 45.133 ( -0.377 -0.552 -0.351) 0.755 45.264 ( 9.701 2.991 -2.391) 10.429 46.026 ( -6.088 11.689 4.648) 13.975 46.959 ( 23.889 24.118 -17.509) 38.195 49.758 ( -11.415 9.528 3.913) 15.375 50.125 ( 1.510 -0.755 -4.953) 5.233 50.473 ( -14.706 9.104 1.551) 17.365 52.510 ( 103.909 46.335 -57.106) 127.299 61.104 ( -20.325 -14.148 0.081) 24.764 61.797 ( 41.647 -7.604 2.694) 42.421 67.710 ( -18.059 7.457 14.296) 24.210 68.533 ( 2.717 15.629 -13.807) 21.030 ======================= Grid point 280 (133/204) ======================= q-point: ( 0.27 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.996 ( 21.627 0.000 7.507) 22.892 2.093 ( 9.804 0.000 4.219) 10.673 2.293 ( 12.626 0.000 -5.466) 13.759 2.599 ( 10.249 0.000 -6.707) 12.249 3.189 ( 6.251 0.000 3.540) 7.183 3.517 ( -1.151 -0.000 2.869) 3.091 3.995 ( 6.477 0.000 -5.746) 8.658 4.002 ( -17.523 -0.000 13.686) 22.234 4.198 ( 1.305 0.000 5.899) 6.042 4.690 ( 0.900 0.000 -10.361) 10.400 4.834 ( -9.993 -0.000 8.145) 12.892 4.861 ( 0.251 0.000 -2.717) 2.729 5.302 ( 16.012 0.000 -3.462) 16.382 5.669 ( -3.977 -0.000 -3.884) 5.559 5.910 ( 7.894 0.000 0.715) 7.926 5.945 ( 13.497 0.000 -0.363) 13.502 6.210 ( -0.828 -0.000 -3.584) 3.678 6.561 ( -1.842 -0.000 1.327) 2.270 6.688 ( -2.642 -0.000 2.083) 3.365 6.941 ( 6.563 0.000 -1.182) 6.669 7.058 ( 4.035 0.000 -4.076) 5.735 7.079 ( 4.130 0.000 -1.079) 4.268 7.588 ( -3.108 -0.000 4.906) 5.807 7.868 ( 11.339 0.000 -0.588) 11.354 8.100 ( 2.409 0.000 1.012) 2.613 8.504 ( 7.722 0.000 2.541) 8.129 8.647 ( 5.344 0.000 -1.678) 5.601 8.709 ( 6.483 0.000 -3.153) 7.209 11.713 ( -23.333 -0.000 2.632) 23.481 12.029 ( -24.809 -0.000 -3.289) 25.026 12.880 ( -13.784 -0.000 -2.990) 14.104 12.903 ( -8.528 -0.000 4.893) 9.831 15.034 ( 32.268 0.000 11.117) 34.129 15.548 ( 35.357 0.000 -6.531) 35.955 15.986 ( 41.120 0.000 10.941) 42.550 16.638 ( 21.491 0.000 -22.481) 31.100 26.854 ( -0.119 -0.000 -0.531) 0.545 26.874 ( -0.480 -0.000 0.504) 0.696 26.918 ( 0.026 0.000 1.021) 1.021 26.983 ( 0.014 0.000 -1.506) 1.506 28.048 ( -1.496 -0.000 1.647) 2.225 28.127 ( -1.074 -0.000 -1.977) 2.250 33.756 ( -2.396 -0.000 3.223) 4.016 33.919 ( 0.639 0.000 -4.571) 4.616 34.503 ( 5.511 0.000 -0.312) 5.520 34.797 ( 6.098 0.000 1.677) 6.324 35.663 ( 1.201 0.000 4.850) 4.996 35.695 ( 2.649 0.000 -3.352) 4.272 37.207 ( 0.088 0.000 -1.902) 1.904 37.266 ( -0.796 -0.000 1.232) 1.466 43.766 ( 37.580 0.000 8.444) 38.517 44.143 ( 29.222 0.000 -13.187) 32.060 44.240 ( 17.131 0.000 6.881) 18.461 44.939 ( 16.808 0.000 -2.135) 16.943 45.493 ( -1.830 -0.000 -3.108) 3.607 45.786 ( 12.177 0.000 8.490) 14.845 46.290 ( 28.778 0.000 -1.405) 28.812 47.341 ( 19.660 0.000 -4.505) 20.170 50.382 ( 16.467 0.000 9.521) 19.021 50.508 ( 13.820 0.000 -4.510) 14.537 51.006 ( 31.977 0.000 -3.822) 32.205 53.141 ( 12.457 0.000 -20.580) 24.056 62.495 ( -44.824 -0.000 34.363) 56.480 62.604 ( -19.211 -0.000 -47.834) 51.548 67.093 ( 6.644 0.000 33.190) 33.848 68.299 ( 35.145 0.000 -43.306) 55.772 ======================= Grid point 281 (134/204) ======================= q-point: ( 0.36 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.208 ( 8.935 -0.864 1.575) 9.114 2.248 ( 18.591 -0.119 5.975) 19.528 2.429 ( 10.364 -2.146 0.121) 10.585 2.727 ( 8.383 -5.259 -6.347) 11.757 3.260 ( 2.640 -0.721 0.688) 2.822 3.518 ( 0.764 0.013 2.403) 2.522 3.826 ( -14.619 2.926 13.653) 20.216 4.037 ( 3.886 1.024 -4.623) 6.126 4.216 ( -1.374 -0.915 5.017) 5.281 4.640 ( 0.626 6.835 -9.144) 11.433 4.696 ( -6.510 3.407 2.127) 7.649 4.799 ( -2.850 4.117 1.047) 5.116 5.407 ( 4.565 4.671 -3.535) 7.426 5.682 ( -1.581 -7.056 -1.926) 7.483 5.898 ( 2.777 4.815 0.693) 5.601 6.070 ( -0.496 -4.700 -0.064) 4.726 6.192 ( 4.202 3.967 -3.055) 6.537 6.548 ( -3.060 -0.159 -1.503) 3.413 6.759 ( 6.511 -4.699 5.767) 9.886 7.022 ( 9.100 1.809 -0.132) 9.279 7.062 ( 6.299 1.492 -4.532) 7.902 7.207 ( 5.993 -5.948 -2.456) 8.794 7.576 ( -2.231 -1.474 3.006) 4.023 8.012 ( 15.090 2.477 0.554) 15.302 8.114 ( 0.665 0.255 1.730) 1.871 8.611 ( 6.582 -1.447 3.829) 7.751 8.687 ( 5.462 1.553 -3.232) 6.534 8.795 ( 7.312 -1.582 -2.862) 8.010 11.335 ( -24.322 10.449 1.457) 26.511 11.847 ( -28.332 -12.932 -1.954) 31.205 12.655 ( -6.153 7.765 0.054) 9.907 12.921 ( -6.033 -6.862 1.099) 9.203 15.217 ( 30.552 20.931 7.477) 37.782 15.762 ( 34.054 15.179 -3.720) 37.469 16.519 ( 26.864 -10.168 7.299) 29.637 16.848 ( 11.705 -5.005 -14.819) 19.536 26.855 ( 0.097 -0.298 -0.444) 0.544 26.874 ( -0.556 -0.422 0.661) 0.961 26.923 ( 0.128 -0.204 0.666) 0.708 26.985 ( -0.099 -0.696 -1.290) 1.469 28.034 ( -1.229 0.357 1.521) 1.988 28.110 ( -0.932 0.141 -1.766) 2.002 33.739 ( -2.083 -0.092 3.155) 3.781 33.913 ( 0.590 0.192 -4.589) 4.631 34.556 ( 4.923 0.936 0.917) 5.094 34.849 ( 4.304 1.185 0.546) 4.498 35.668 ( 0.637 1.568 3.888) 4.240 35.726 ( 2.210 -0.734 -2.581) 3.477 37.200 ( 0.057 0.325 -1.349) 1.389 37.268 ( -1.241 -1.414 0.516) 1.951 43.870 ( 32.802 26.808 0.853) 42.372 44.267 ( 17.977 9.789 1.935) 20.561 44.570 ( 7.511 -9.386 -0.282) 12.024 45.159 ( 13.951 -1.007 -2.134) 14.149 45.504 ( 3.776 -2.010 -0.482) 4.305 46.047 ( 11.630 -11.563 0.870) 16.424 46.540 ( 29.466 7.657 5.236) 30.892 47.561 ( 15.776 -2.314 -4.239) 16.498 50.495 ( 14.164 9.652 6.268) 18.250 50.726 ( 22.025 -2.460 -2.684) 22.324 51.244 ( 37.697 16.998 -3.384) 41.490 53.385 ( 6.244 -17.900 -9.960) 21.415 61.884 ( -55.530 9.521 13.915) 58.033 62.256 ( -42.677 -9.178 -21.137) 48.500 67.301 ( 10.211 -3.917 36.274) 37.887 68.617 ( 37.081 -0.750 -44.823) 58.178 ======================= Grid point 282 (135/204) ======================= q-point: ( 0.45 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.308 ( 8.055 1.709 -0.275) 8.239 2.433 ( 11.534 -1.429 5.381) 12.808 2.609 ( 9.946 -5.231 3.673) 11.822 2.917 ( 5.905 -10.588 -6.700) 13.852 3.251 ( -1.296 2.027 -3.505) 4.251 3.548 ( 1.999 0.093 5.808) 6.143 3.656 ( -11.506 3.995 13.752) 18.370 4.026 ( 1.201 2.708 -3.982) 4.963 4.225 ( -0.694 -0.681 2.186) 2.392 4.479 ( 1.570 11.505 -0.781) 11.638 4.572 ( -4.117 7.480 -1.780) 8.722 4.735 ( -1.436 -0.311 -4.369) 4.610 5.307 ( -1.939 6.845 -3.354) 7.865 5.720 ( -8.301 -2.399 2.086) 8.889 5.885 ( 3.350 -0.003 -1.397) 3.630 6.116 ( -4.503 -4.857 -0.137) 6.624 6.175 ( 7.427 5.001 -2.288) 9.241 6.494 ( -3.545 1.570 -0.655) 3.932 6.918 ( 6.282 -3.116 4.220) 8.184 7.059 ( 6.620 2.153 -1.805) 7.192 7.158 ( 10.085 -0.505 -1.909) 10.277 7.331 ( -0.499 -4.133 0.512) 4.195 7.615 ( 3.961 -3.035 -1.334) 5.165 8.059 ( 1.814 3.730 2.688) 4.942 8.158 ( 10.443 3.447 0.241) 11.000 8.661 ( 1.805 2.857 6.827) 7.617 8.729 ( 7.428 1.365 -5.912) 9.591 8.878 ( 2.578 -0.604 -2.077) 3.365 10.971 ( -16.285 4.446 0.448) 16.887 11.742 ( -28.285 -15.084 -1.199) 32.078 12.545 ( 2.514 3.375 0.298) 4.219 12.966 ( -4.149 -6.114 0.407) 7.400 15.209 ( 32.090 25.868 3.691) 41.383 15.892 ( 33.298 15.893 -1.879) 36.944 16.837 ( 5.243 -1.724 0.498) 5.541 16.927 ( 4.780 0.686 -4.748) 6.772 26.862 ( 0.162 -0.442 -0.291) 0.554 26.876 ( -0.710 -0.547 0.814) 1.211 26.933 ( 0.464 -0.606 0.046) 0.765 26.992 ( -0.519 -0.866 -0.891) 1.347 28.019 ( -0.806 0.414 1.349) 1.625 28.095 ( -0.705 0.156 -1.515) 1.678 33.729 ( -1.507 -0.348 2.978) 3.356 33.907 ( 0.590 0.023 -4.508) 4.547 34.588 ( 4.128 1.974 1.907) 4.957 34.856 ( 2.267 2.841 -0.443) 3.661 35.651 ( -0.203 2.303 4.273) 4.859 35.749 ( 2.005 -0.182 -3.149) 3.738 37.199 ( 0.237 -0.330 -0.832) 0.926 37.279 ( -1.491 -1.804 0.013) 2.340 43.828 ( 31.460 24.532 -1.233) 39.913 44.292 ( 15.406 12.285 3.935) 20.093 44.701 ( 4.398 -1.563 0.580) 4.703 45.239 ( 5.002 1.665 -2.829) 5.983 45.594 ( 4.328 -1.305 2.981) 5.415 46.229 ( 2.991 -0.892 -8.388) 8.950 46.803 ( 26.088 2.902 11.307) 28.580 47.716 ( 10.070 -0.095 -4.602) 11.072 50.463 ( 12.640 14.676 2.726) 19.560 50.999 ( 21.451 0.343 -4.650) 21.952 51.340 ( 35.694 23.832 0.760) 42.926 53.696 ( 3.895 -16.484 -3.572) 17.310 61.097 ( -58.318 10.492 7.454) 59.722 61.848 ( -51.421 -12.010 -10.192) 53.780 67.587 ( 10.055 -6.647 34.302) 36.358 68.915 ( 33.310 0.774 -40.917) 52.767 ======================= Grid point 283 (136/204) ======================= q-point: ( 0.55 0.27 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.323 ( 4.725 5.088 2.001) 7.226 2.600 ( 10.273 -1.579 5.277) 11.656 2.785 ( 5.109 -4.435 2.777) 7.313 3.108 ( -3.086 -10.925 -10.419) 15.409 3.189 ( 4.569 4.247 -3.478) 7.142 3.500 ( -3.391 6.013 15.240) 16.731 3.601 ( -6.230 -5.535 5.852) 10.183 3.977 ( 0.473 3.221 -3.665) 4.902 4.224 ( 0.638 1.853 -0.329) 1.987 4.339 ( -2.167 6.500 1.473) 7.008 4.393 ( 5.176 13.910 0.046) 14.842 4.745 ( 0.131 -3.364 -8.629) 9.262 5.176 ( -0.781 6.615 -2.258) 7.033 5.594 ( -13.637 2.943 1.903) 14.080 5.929 ( 0.326 -1.709 1.502) 2.299 6.120 ( -1.245 -1.289 -2.215) 2.849 6.205 ( 6.189 1.244 -1.760) 6.554 6.425 ( -3.394 2.286 0.228) 4.098 6.992 ( 6.247 2.543 -0.229) 6.749 7.116 ( 3.151 -1.022 1.759) 3.750 7.242 ( 2.008 1.504 -0.719) 2.610 7.330 ( -0.723 -1.415 1.885) 2.465 7.731 ( 8.522 -2.016 -4.227) 9.724 7.998 ( -4.025 2.946 2.618) 5.633 8.200 ( 11.595 7.002 -0.357) 13.550 8.612 ( -2.834 5.125 7.695) 9.670 8.772 ( 6.985 1.945 -5.767) 9.265 8.797 ( -8.695 5.924 -0.900) 10.560 10.907 ( 1.456 -7.088 -0.235) 7.240 11.668 ( -26.538 -15.710 -1.195) 30.862 12.613 ( 9.918 -2.611 0.563) 10.271 13.018 ( -3.634 -6.405 -0.052) 7.364 15.189 ( 33.927 25.587 1.706) 42.528 16.014 ( 32.606 16.036 -0.932) 36.348 16.641 ( -15.795 13.305 -4.833) 21.210 16.940 ( -2.898 4.446 2.154) 5.728 26.870 ( 0.165 -0.438 -0.121) 0.484 26.877 ( -0.810 -0.504 0.872) 1.292 26.951 ( 0.865 -0.804 -0.365) 1.236 26.995 ( -0.985 -0.828 -0.639) 1.437 28.011 ( -0.369 0.169 1.264) 1.328 28.083 ( -0.423 0.014 -1.396) 1.459 33.731 ( -0.846 -0.743 2.818) 3.035 33.906 ( 0.587 -0.329 -4.393) 4.444 34.595 ( 3.143 3.109 2.455) 5.057 34.810 ( 0.315 4.721 -1.146) 4.868 35.613 ( -0.969 3.022 4.874) 5.816 35.763 ( 1.901 0.208 -3.834) 4.285 37.213 ( 0.664 -1.031 -0.394) 1.288 37.289 ( -1.645 -1.782 -0.285) 2.442 43.828 ( 31.245 21.064 -1.377) 37.707 44.252 ( 8.721 12.163 4.376) 15.593 44.767 ( 8.505 1.846 0.380) 8.711 45.225 ( -0.630 2.934 -2.158) 3.696 45.624 ( 0.854 2.632 3.945) 4.819 46.140 ( -3.120 8.447 -9.827) 13.329 47.012 ( 16.400 5.471 12.227) 21.175 47.766 ( 4.958 2.937 -5.843) 8.206 50.364 ( 11.141 15.708 0.634) 19.268 50.957 ( -8.383 15.349 -1.887) 17.590 51.493 ( 56.355 20.201 -0.482) 59.868 53.879 ( -12.524 -9.302 -3.403) 15.968 60.417 ( -37.256 5.046 4.731) 37.892 61.440 ( -53.124 -14.073 -5.381) 55.219 67.856 ( 5.803 -5.956 31.186) 32.276 69.133 ( 27.485 3.767 -35.993) 45.443 ======================= Grid point 284 (137/204) ======================= q-point: (-0.36 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.293 ( 4.128 6.216 6.885) 10.153 2.659 ( 2.669 6.715 4.385) 8.452 2.865 ( 3.408 -0.239 -1.271) 3.645 3.048 ( -1.857 6.650 -9.214) 11.513 3.250 ( 1.010 -2.822 -0.506) 3.040 3.488 ( 0.507 -1.766 12.239) 12.376 3.617 ( -9.662 -6.239 0.850) 11.533 3.933 ( 0.806 1.828 -3.592) 4.110 4.152 ( -3.789 2.446 3.894) 5.958 4.276 ( -0.660 0.630 0.820) 1.226 4.319 ( 16.263 11.737 -1.145) 20.089 4.775 ( -1.134 -2.542 -10.092) 10.468 5.084 ( 1.868 6.364 0.064) 6.633 5.343 ( -16.248 6.501 0.594) 17.510 5.939 ( -0.794 0.871 4.173) 4.336 6.127 ( 1.426 -0.100 -4.283) 4.516 6.252 ( 4.770 0.429 -0.930) 4.879 6.349 ( -4.549 1.817 0.433) 4.918 6.997 ( 1.916 4.097 1.424) 4.742 7.077 ( -2.316 4.114 -1.356) 4.911 7.240 ( 0.936 -1.649 3.138) 3.666 7.392 ( 6.122 0.432 -1.628) 6.349 7.818 ( 4.589 0.335 -2.342) 5.163 7.907 ( -3.258 2.677 0.150) 4.220 8.211 ( 10.736 8.033 -0.094) 13.409 8.433 ( -13.207 9.246 3.238) 16.444 8.605 ( -6.103 4.194 4.807) 8.829 8.803 ( 4.978 1.492 -5.586) 7.630 11.163 ( 13.403 -12.905 0.045) 18.606 11.626 ( -23.005 -15.777 -2.047) 27.971 12.818 ( 11.702 -6.434 1.683) 13.459 13.088 ( -3.724 -8.735 -1.110) 9.560 15.197 ( 35.596 24.705 0.757) 43.336 16.087 ( -19.251 27.944 0.623) 33.939 16.127 ( 21.804 12.758 -4.362) 25.637 16.704 ( -16.821 12.258 1.161) 20.846 26.876 ( -0.540 -0.327 0.670) 0.920 26.881 ( 0.111 -0.532 0.195) 0.577 26.969 ( 0.547 -0.273 -0.208) 0.646 26.996 ( -0.661 -1.074 -0.872) 1.534 28.012 ( -0.142 -0.241 1.294) 1.323 28.079 ( -0.083 -0.326 -1.430) 1.469 33.746 ( -0.346 -1.272 2.723) 3.026 33.910 ( 0.588 -0.692 -4.280) 4.376 34.573 ( 1.919 4.351 2.593) 5.416 34.717 ( -0.941 6.351 -1.511) 6.595 35.563 ( -1.386 3.344 5.450) 6.543 35.768 ( 1.653 0.433 -4.447) 4.764 37.240 ( 1.039 -1.270 0.083) 1.643 37.295 ( -1.518 -1.514 -0.540) 2.211 43.859 ( 29.065 20.057 -0.060) 35.313 44.121 ( -0.081 13.081 2.705) 13.358 44.844 ( 11.308 3.093 0.533) 11.736 45.103 ( -9.274 5.765 -0.772) 10.947 45.550 ( -2.381 6.790 3.252) 7.896 45.889 ( -4.380 13.914 -10.484) 17.964 47.054 ( 6.711 10.531 15.553) 19.946 47.711 ( 1.794 6.659 -8.699) 11.101 50.245 ( 9.741 15.127 0.221) 17.994 50.542 ( -13.893 16.617 0.317) 21.662 51.879 ( 62.248 19.546 0.525) 65.246 53.538 ( -47.903 6.884 -11.379) 49.715 60.260 ( 5.597 -7.352 3.636) 9.929 61.076 ( -48.749 -14.753 -3.375) 51.044 68.024 ( -1.393 -3.184 27.994) 28.209 69.234 ( 20.274 8.056 -31.211) 38.079 ======================= Grid point 285 (138/204) ======================= q-point: (-0.27 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.249 ( 3.246 9.063 11.891) 15.299 2.519 ( 0.093 12.261 3.671) 12.799 2.827 ( -0.155 8.811 -5.928) 10.621 2.875 ( -1.832 7.982 -9.243) 12.349 3.278 ( 0.208 0.660 4.355) 4.410 3.457 ( -5.693 4.841 -0.914) 7.529 3.667 ( 0.672 -7.059 6.423) 9.568 3.945 ( 1.554 -2.606 -2.689) 4.054 4.131 ( -6.235 -1.818 4.781) 8.065 4.288 ( -0.290 -3.408 1.764) 3.849 4.361 ( 17.597 8.235 -1.351) 19.475 4.632 ( -13.253 8.474 -7.920) 17.612 5.040 ( 3.721 0.308 1.318) 3.960 5.170 ( 0.127 2.756 -2.419) 3.669 5.905 ( -1.609 3.312 4.083) 5.498 6.100 ( 0.911 5.500 -4.356) 7.075 6.282 ( 0.134 -0.752 0.223) 0.796 6.307 ( -0.091 -1.522 -0.700) 1.678 6.897 ( -6.402 3.163 3.387) 7.903 7.057 ( 7.071 3.667 -3.956) 8.893 7.275 ( 1.306 0.348 3.244) 3.515 7.423 ( 3.828 1.984 -3.289) 5.423 7.756 ( -7.516 2.444 2.977) 8.446 7.912 ( 7.262 1.907 -4.245) 8.625 8.090 ( -13.374 7.845 4.599) 16.172 8.257 ( 9.362 6.723 -2.479) 11.790 8.533 ( -2.517 1.572 6.672) 7.302 8.807 ( 2.051 1.378 -5.454) 5.988 11.492 ( -1.535 -13.381 3.106) 13.822 11.681 ( 0.780 -15.282 -5.414) 16.231 13.021 ( 3.720 -6.333 4.393) 8.559 13.201 ( -3.866 -11.200 -3.700) 12.413 15.201 ( -0.035 22.216 1.279) 22.253 15.298 ( -0.686 33.610 -2.688) 33.724 16.114 ( -8.302 21.963 3.591) 23.753 16.299 ( 10.112 14.957 -4.466) 18.598 26.875 ( -0.630 -0.215 0.812) 1.050 26.894 ( 0.684 -0.561 0.057) 0.887 26.969 ( -0.455 0.076 0.240) 0.520 27.009 ( 0.519 -0.837 -1.337) 1.660 28.020 ( -0.246 -0.687 1.362) 1.545 28.085 ( 0.280 -0.816 -1.518) 1.746 33.772 ( -0.509 -1.728 2.629) 3.187 33.921 ( 0.847 -1.127 -4.156) 4.389 34.515 ( 0.058 5.646 2.413) 6.140 34.599 ( -0.352 7.120 -1.491) 7.283 35.511 ( -1.411 3.012 6.119) 6.965 35.765 ( 1.234 0.690 -5.155) 5.345 37.271 ( 0.979 -1.033 0.451) 1.493 37.298 ( -0.905 -0.773 -0.680) 1.371 43.688 ( -12.262 22.895 5.939) 26.642 43.962 ( 22.976 18.369 -5.724) 29.968 44.776 ( -16.532 8.449 5.078) 19.248 44.991 ( 10.847 2.861 -3.278) 11.687 45.395 ( -4.234 8.646 1.933) 9.820 45.629 ( 1.819 14.266 -9.516) 17.245 46.888 ( -8.952 15.748 19.742) 26.793 47.586 ( 4.672 10.008 -12.054) 16.348 50.109 ( 3.836 13.232 3.284) 14.163 50.249 ( -4.762 6.645 -2.416) 8.524 51.942 ( -20.876 27.664 14.123) 37.424 52.988 ( 27.148 12.971 -34.214) 45.562 60.646 ( 0.318 -17.860 4.982) 18.544 60.863 ( -1.544 -11.319 -4.295) 12.204 68.043 ( -10.532 0.268 24.375) 26.554 69.191 ( 12.155 12.367 -26.190) 31.410 ======================= Grid point 286 (139/204) ======================= q-point: (-0.18 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.103 ( -0.626 15.597 12.410) 19.941 2.346 ( 3.800 15.459 5.608) 16.878 2.589 ( -5.620 13.480 -7.261) 16.310 2.725 ( -2.450 6.380 -13.006) 14.692 3.247 ( -1.923 2.600 2.051) 3.830 3.331 ( 4.985 9.565 2.147) 10.997 3.808 ( 3.631 -3.520 9.053) 10.369 3.893 ( -18.119 3.916 0.735) 18.552 4.042 ( 0.607 -1.564 -3.102) 3.527 4.391 ( 3.114 -3.916 -0.408) 5.020 4.435 ( 15.528 4.386 1.198) 16.180 4.477 ( -1.630 -3.750 -0.527) 4.122 5.141 ( 3.068 -6.206 -3.539) 7.775 5.185 ( 11.086 3.370 -1.023) 11.632 5.793 ( -6.962 7.230 2.366) 10.312 5.984 ( 0.191 6.957 -2.794) 7.499 6.297 ( -0.612 -0.394 -0.757) 1.050 6.375 ( 4.748 -4.317 -1.184) 6.526 6.799 ( -5.367 1.945 2.460) 6.216 7.066 ( 4.132 2.651 -2.462) 5.492 7.276 ( 0.935 1.873 2.322) 3.126 7.408 ( 2.484 3.307 -3.337) 5.314 7.645 ( -4.928 3.208 2.451) 6.370 7.878 ( -10.284 2.452 3.675) 11.193 7.945 ( 6.363 2.730 -2.532) 7.373 8.288 ( 10.325 3.986 -1.261) 11.139 8.522 ( 0.419 0.372 5.936) 5.963 8.780 ( -0.463 1.692 -5.526) 5.798 11.560 ( -16.498 -13.760 0.561) 21.490 12.061 ( 21.927 -13.094 -2.498) 25.661 13.089 ( -9.696 1.669 6.354) 11.712 13.206 ( -19.101 -6.733 -5.718) 21.044 14.394 ( -28.626 21.747 -0.040) 35.950 15.303 ( 25.901 22.836 4.478) 34.820 15.418 ( -20.707 30.330 -3.932) 36.935 16.355 ( 30.793 15.289 -4.539) 34.678 26.873 ( -0.416 -0.069 0.662) 0.785 26.911 ( 0.742 -0.457 0.067) 0.874 26.963 ( -0.367 0.132 0.392) 0.553 27.022 ( 0.829 -0.208 -1.447) 1.681 28.033 ( -0.574 -1.087 1.352) 1.827 28.103 ( 0.492 -1.280 -1.527) 2.052 33.792 ( -1.798 -1.628 2.154) 3.244 33.947 ( 1.455 -1.745 -3.715) 4.355 34.413 ( -1.577 6.550 1.561) 6.916 34.502 ( 2.344 6.482 -0.593) 6.918 35.474 ( -0.876 1.943 6.889) 7.211 35.750 ( 0.807 1.026 -5.998) 6.138 37.285 ( -0.632 -0.066 -0.046) 0.638 37.301 ( 1.100 0.199 -0.029) 1.118 43.082 ( -24.975 24.014 3.591) 34.833 43.898 ( 16.839 22.905 -11.643) 30.721 44.377 ( -24.535 14.946 13.079) 31.566 45.071 ( 11.851 4.848 -4.668) 13.628 45.228 ( -2.883 7.195 1.250) 7.851 45.452 ( 4.960 10.729 -5.661) 13.105 46.502 ( -15.996 17.839 15.655) 28.621 47.476 ( 9.816 11.591 -10.955) 18.727 49.970 ( -4.478 6.368 3.685) 8.612 50.166 ( 4.120 4.545 -2.821) 6.753 51.014 ( -47.248 23.898 4.079) 53.105 53.427 ( 81.818 15.851 -34.400) 90.160 60.632 ( -19.715 -15.374 1.209) 25.030 61.484 ( 49.982 -12.137 -1.013) 51.445 67.891 ( -20.330 3.657 19.507) 28.411 69.016 ( 4.411 14.988 -20.225) 25.556 ======================= Grid point 287 (140/204) ======================= q-point: (-0.09 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.865 ( 2.136 18.447 10.731) 21.448 2.104 ( -0.763 21.005 9.791) 23.187 2.311 ( -4.627 9.327 -12.476) 16.249 2.568 ( 0.419 8.401 -13.152) 15.612 3.223 ( 7.140 3.393 2.074) 8.173 3.266 ( 9.652 11.752 5.269) 16.094 3.679 ( -6.262 -0.665 1.391) 6.449 3.969 ( 3.488 -5.960 10.015) 12.164 4.054 ( 0.172 0.822 -4.509) 4.586 4.440 ( -2.318 -3.036 -1.079) 3.969 4.586 ( 14.973 -0.211 1.965) 15.103 4.596 ( 2.331 -8.240 2.318) 8.872 5.224 ( -2.293 -5.665 -7.408) 9.604 5.316 ( 19.143 3.071 -0.281) 19.390 5.570 ( -10.113 6.852 0.645) 12.233 5.898 ( 1.825 5.633 -1.060) 6.015 6.263 ( -1.131 3.206 -0.393) 3.422 6.524 ( 6.621 -6.823 -2.536) 9.840 6.741 ( -3.414 -0.604 1.761) 3.889 7.059 ( 0.890 1.228 -2.169) 2.646 7.237 ( -3.365 2.604 3.984) 5.829 7.361 ( 1.501 5.646 -1.410) 6.010 7.574 ( 0.942 3.164 -0.286) 3.313 7.806 ( -4.193 -2.483 1.664) 5.150 7.970 ( 7.308 2.943 -1.020) 7.944 8.347 ( 6.989 1.154 0.355) 7.092 8.554 ( 3.444 0.500 4.702) 5.850 8.718 ( -2.465 2.645 -5.197) 6.331 11.587 ( -14.340 -12.529 -0.194) 19.043 12.423 ( -13.542 8.493 3.350) 16.332 12.612 ( 3.798 1.050 -2.858) 4.868 13.201 ( -14.082 -12.196 0.294) 18.632 14.079 ( -6.047 1.835 0.007) 6.319 14.516 ( -38.164 29.886 1.391) 48.493 15.419 ( 43.738 25.257 -2.548) 50.571 16.462 ( 31.555 14.936 -7.722) 35.755 26.871 ( -0.142 0.076 0.288) 0.330 26.920 ( -0.031 0.066 0.257) 0.267 26.961 ( 0.177 0.212 0.220) 0.353 27.027 ( 0.737 0.336 -1.310) 1.541 28.046 ( -0.953 -1.340 1.269) 2.077 28.126 ( 0.319 -1.478 -1.468) 2.108 33.790 ( -2.915 -1.105 1.381) 3.410 33.979 ( 0.545 -1.302 -2.938) 3.260 34.314 ( 0.705 5.092 0.833) 5.207 34.458 ( 5.218 4.418 0.416) 6.850 35.469 ( 0.323 0.359 7.425) 7.441 35.725 ( 0.756 1.261 -6.692) 6.852 37.270 ( -0.245 1.128 0.101) 1.159 37.303 ( 0.977 1.228 -0.108) 1.572 42.561 ( -12.449 15.181 3.283) 19.905 43.284 ( -40.138 28.621 -9.127) 50.135 44.107 ( 20.661 21.863 12.212) 32.465 45.036 ( 3.741 7.807 -4.421) 9.721 45.160 ( 4.464 4.100 0.313) 6.069 45.417 ( 9.026 3.258 -2.882) 10.019 46.175 ( -2.877 13.507 5.860) 15.002 47.387 ( 10.920 12.692 -8.288) 18.683 49.774 ( -10.600 8.136 1.472) 13.444 50.175 ( 7.736 2.645 -0.728) 8.208 50.447 ( -12.664 7.545 0.576) 14.753 53.940 ( 69.427 21.358 -38.512) 82.216 60.839 ( 16.602 -15.852 -0.728) 22.966 62.185 ( 46.695 -7.399 -2.577) 47.348 67.585 ( -27.441 5.440 13.726) 31.161 68.752 ( -1.444 15.814 -14.116) 21.247 ======================= Grid point 292 (141/204) ======================= q-point: ( 0.36 0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.307 ( 9.279 0.000 3.695) 9.987 2.477 ( 17.313 0.000 6.554) 18.512 2.480 ( 3.475 0.000 -0.973) 3.609 2.744 ( 5.452 0.000 -7.703) 9.437 3.282 ( 0.318 0.000 0.076) 0.327 3.530 ( 0.573 0.000 1.450) 1.559 3.742 ( -10.018 -0.000 15.885) 18.780 4.088 ( 5.315 0.000 -7.029) 8.812 4.206 ( -1.211 -0.000 6.273) 6.389 4.626 ( -11.453 -0.000 7.021) 13.434 4.645 ( 0.258 0.000 -12.212) 12.215 4.815 ( -2.846 -0.000 -1.205) 3.090 5.540 ( -5.118 -0.000 -3.820) 6.387 5.544 ( 3.149 0.000 -0.848) 3.261 5.933 ( 0.713 0.000 -2.536) 2.634 6.000 ( -4.486 -0.000 1.863) 4.857 6.278 ( 4.725 0.000 -2.131) 5.184 6.513 ( -2.507 -0.000 -2.407) 3.475 6.835 ( 9.908 0.000 6.679) 11.949 7.138 ( 10.152 0.000 -2.406) 10.433 7.175 ( 5.031 0.000 -4.714) 6.894 7.189 ( 5.265 0.000 1.231) 5.407 7.569 ( 3.325 0.000 0.289) 3.338 8.105 ( -2.857 -0.000 3.575) 4.576 8.263 ( 22.243 0.000 0.461) 22.248 8.674 ( 5.610 0.000 2.894) 6.313 8.751 ( 4.147 0.000 -0.474) 4.174 8.860 ( 7.342 0.000 -4.409) 8.564 11.173 ( -24.204 -0.000 3.370) 24.437 11.384 ( -28.754 -0.000 -3.722) 28.994 12.680 ( -4.079 -0.000 -1.021) 4.205 12.784 ( -3.765 -0.000 1.719) 4.139 15.669 ( 19.529 0.000 9.490) 21.713 16.173 ( 22.324 0.000 -7.752) 23.631 16.748 ( 22.449 0.000 8.205) 23.901 16.931 ( 13.404 0.000 -12.266) 18.169 26.854 ( 0.314 0.000 -0.416) 0.521 26.866 ( -0.507 -0.000 0.619) 0.800 26.925 ( 0.060 0.000 0.854) 0.856 26.976 ( 0.033 0.000 -1.421) 1.421 28.027 ( -1.088 -0.000 1.543) 1.888 28.098 ( -0.709 -0.000 -1.738) 1.877 33.723 ( -1.908 -0.000 3.375) 3.877 33.909 ( 0.482 0.000 -4.860) 4.884 34.619 ( 4.422 0.000 1.977) 4.844 34.899 ( 2.771 0.000 -0.372) 2.796 35.692 ( -0.396 -0.000 4.030) 4.049 35.741 ( 2.666 0.000 -2.925) 3.958 37.204 ( 0.314 0.000 -1.464) 1.497 37.240 ( -1.662 -0.000 0.585) 1.762 44.351 ( 10.334 0.000 6.620) 12.272 44.476 ( 8.773 0.000 -9.256) 12.753 44.602 ( 15.552 0.000 5.149) 16.382 45.303 ( 8.211 0.000 -5.254) 9.748 45.579 ( 13.157 0.000 1.682) 13.264 46.076 ( 9.382 0.000 0.948) 9.430 46.893 ( 21.883 0.000 8.250) 23.386 47.709 ( 14.105 0.000 -5.539) 15.154 50.762 ( 11.786 0.000 12.297) 17.033 50.926 ( 24.759 0.000 -9.365) 26.471 51.890 ( 46.506 0.000 -3.652) 46.650 53.319 ( 10.490 0.000 -5.314) 11.759 61.356 ( -63.005 -0.000 24.637) 67.650 61.586 ( -46.803 -0.000 -29.634) 55.396 67.439 ( 4.550 0.000 43.264) 43.503 68.928 ( 37.356 0.000 -49.022) 61.633 ======================= Grid point 293 (142/204) ======================= q-point: ( 0.45 0.36 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.438 ( 11.361 -0.324 3.346) 11.848 2.489 ( 0.241 -0.413 1.893) 1.953 2.680 ( 11.153 -2.291 5.536) 12.661 2.813 ( 2.455 -5.448 -8.830) 10.661 3.259 ( -1.656 0.748 -1.239) 2.199 3.525 ( -4.420 -0.483 2.730) 5.218 3.671 ( -5.035 3.478 16.566) 17.660 4.107 ( 6.144 3.869 -6.612) 9.820 4.230 ( 2.293 -0.890 3.732) 4.469 4.492 ( -10.669 2.757 4.937) 12.075 4.625 ( 1.249 -0.153 -11.514) 11.583 4.747 ( -2.996 3.388 -0.637) 4.568 5.404 ( -0.439 7.113 -3.139) 7.787 5.582 ( -7.371 -3.295 0.319) 8.081 5.915 ( -0.111 1.713 -0.048) 1.717 6.007 ( -0.929 -3.789 -1.698) 4.255 6.296 ( 3.837 2.498 -1.011) 4.689 6.476 ( -2.267 0.687 -2.426) 3.391 6.973 ( 7.637 -2.167 6.610) 10.330 7.161 ( 3.799 3.554 -1.711) 5.476 7.245 ( 7.328 -1.063 -3.451) 8.170 7.264 ( -0.973 -2.612 1.257) 3.057 7.669 ( 12.488 -1.341 -2.913) 12.894 8.060 ( -5.321 0.951 3.793) 6.604 8.449 ( 19.963 7.561 0.299) 21.349 8.717 ( -0.970 1.315 7.996) 8.162 8.810 ( 7.430 -0.696 -5.058) 9.015 8.905 ( 2.176 1.540 -3.304) 4.246 10.862 ( -15.426 4.384 1.084) 16.074 11.211 ( -25.467 -13.089 -1.699) 28.684 12.618 ( 1.801 2.531 -0.015) 3.107 12.810 ( -4.590 -6.094 0.507) 7.646 15.784 ( 16.402 11.023 7.579) 21.165 16.322 ( 16.841 4.753 -7.529) 19.050 16.934 ( 8.591 4.391 2.084) 9.871 17.028 ( 9.747 2.110 -3.919) 10.715 26.859 ( 0.337 -0.192 -0.266) 0.470 26.864 ( -0.551 -0.303 0.616) 0.880 26.930 ( 0.228 -0.423 0.498) 0.692 26.976 ( -0.114 -0.321 -1.176) 1.225 28.018 ( -0.786 0.179 1.453) 1.661 28.087 ( -0.396 0.105 -1.599) 1.650 33.714 ( -1.459 -0.307 3.379) 3.693 33.903 ( 0.522 0.029 -4.902) 4.930 34.662 ( 3.678 1.145 2.849) 4.792 34.907 ( 1.003 1.562 -1.225) 2.224 35.683 ( -0.870 1.314 3.749) 4.066 35.764 ( 2.381 -0.103 -2.846) 3.711 37.200 ( 0.418 0.237 -0.873) 0.996 37.236 ( -1.613 -1.411 0.070) 2.145 44.337 ( 10.886 10.858 0.494) 15.383 44.512 ( 1.972 3.932 0.008) 4.399 44.792 ( 13.357 -1.043 2.461) 13.622 45.317 ( 2.543 2.611 -5.349) 6.473 45.703 ( 10.684 3.709 4.173) 12.055 46.191 ( 1.857 -3.413 -4.017) 5.589 47.116 ( 17.011 1.695 11.030) 20.345 47.820 ( 8.590 0.783 -6.482) 10.789 50.808 ( 9.520 10.602 8.174) 16.427 51.182 ( 17.814 0.619 -9.287) 20.099 52.230 ( 48.391 20.873 -0.722) 52.706 53.523 ( 5.217 -11.085 -1.969) 12.408 60.653 ( -51.763 7.735 12.978) 53.923 61.096 ( -44.905 -7.881 -15.498) 48.154 67.615 ( -0.670 -6.572 42.432) 42.943 69.202 ( 32.541 0.966 -46.759) 56.976 ======================= Grid point 294 (143/204) ======================= q-point: ( 0.55 0.36 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.455 ( 2.719 4.030 1.979) 5.249 2.652 ( 10.306 -6.839 6.418) 13.935 2.785 ( 0.681 -0.445 2.184) 2.331 2.914 ( -0.588 -8.508 -8.524) 12.058 3.261 ( 4.417 -0.151 -0.834) 4.497 3.444 ( -11.452 -0.290 2.940) 11.827 3.599 ( -3.109 4.576 14.708) 15.714 4.087 ( 6.522 6.212 -4.658) 10.140 4.273 ( 3.331 1.844 0.191) 3.812 4.338 ( -7.851 3.742 2.931) 9.178 4.599 ( 1.026 4.399 -3.273) 5.578 4.690 ( -0.002 -1.407 -6.808) 6.952 5.312 ( 5.212 7.239 -2.164) 9.179 5.490 ( -10.990 2.074 0.499) 11.195 5.903 ( -1.908 -1.323 2.843) 3.671 6.050 ( 0.763 -2.657 -3.662) 4.589 6.300 ( 3.102 2.003 0.156) 3.696 6.429 ( -1.455 1.869 -2.741) 3.623 7.077 ( 1.640 -0.433 6.215) 6.443 7.151 ( 1.246 0.692 0.775) 1.622 7.231 ( 0.185 2.148 -1.934) 2.896 7.350 ( 5.190 -2.476 -2.959) 6.467 7.821 ( 11.381 0.095 -2.813) 11.724 7.979 ( -5.966 1.683 1.940) 6.495 8.504 ( 15.448 10.374 0.293) 18.610 8.654 ( -5.979 4.299 8.262) 11.068 8.791 ( -9.098 6.780 -0.635) 11.364 8.873 ( 6.920 2.382 -5.721) 9.289 10.824 ( 3.984 -7.805 0.292) 8.768 11.155 ( -21.557 -14.321 -1.394) 25.918 12.672 ( 7.384 -2.608 0.275) 7.836 12.846 ( -6.658 -6.641 0.130) 9.405 15.791 ( 15.814 13.157 6.358) 21.532 16.374 ( 6.668 5.140 -9.403) 12.621 16.821 ( 4.602 17.061 0.943) 17.696 17.011 ( -1.159 7.865 0.437) 7.962 26.864 ( -0.618 -0.422 0.639) 0.985 26.866 ( 0.247 -0.299 -0.033) 0.390 26.947 ( 0.637 -1.040 -0.055) 1.221 26.975 ( -0.423 -0.211 -0.838) 0.962 28.012 ( -0.446 0.138 1.382) 1.458 28.078 ( -0.041 0.143 -1.510) 1.517 33.716 ( -0.943 -0.692 3.284) 3.486 33.899 ( 0.642 -0.124 -4.809) 4.853 34.679 ( 2.755 2.410 3.328) 4.947 34.867 ( -0.682 3.320 -1.862) 3.867 35.652 ( -1.347 2.237 3.967) 4.749 35.781 ( 2.121 0.304 -3.150) 3.810 37.209 ( 0.930 -0.633 -0.429) 1.204 37.241 ( -1.721 -1.671 -0.231) 2.410 44.320 ( 14.369 9.713 -1.047) 17.376 44.416 ( -3.493 7.436 2.528) 8.596 44.937 ( 11.984 1.111 1.189) 12.094 45.262 ( -1.730 4.359 -4.241) 6.323 45.731 ( 5.389 5.860 5.542) 9.700 46.155 ( -5.178 3.346 -6.757) 9.147 47.261 ( 9.755 3.358 12.571) 16.262 47.844 ( 3.358 2.482 -7.736) 8.791 50.722 ( 7.139 14.181 5.456) 16.788 51.137 ( 0.535 16.642 -8.268) 18.590 52.476 ( 54.332 19.638 1.944) 57.805 53.576 ( -21.522 -3.187 -3.281) 22.002 60.174 ( -21.519 0.751 9.640) 23.592 60.736 ( -32.735 -6.745 -10.154) 34.931 67.801 ( -6.584 -9.717 37.861) 39.639 69.398 ( 25.826 2.915 -42.116) 49.490 ======================= Grid point 295 (144/204) ======================= q-point: (-0.36 0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.438 ( 3.672 3.918 6.464) 8.403 2.732 ( -5.191 2.135 -1.160) 5.731 2.876 ( 7.014 -3.367 1.346) 7.896 2.995 ( 0.017 -5.443 -4.534) 7.084 3.251 ( -9.441 1.986 1.961) 9.845 3.421 ( 2.946 -6.713 3.365) 8.067 3.541 ( -2.054 2.513 8.274) 8.888 4.035 ( 4.770 7.306 -5.172) 10.143 4.174 ( -5.109 4.969 4.347) 8.348 4.290 ( 0.604 2.485 -0.531) 2.612 4.542 ( 2.478 3.676 -0.530) 4.464 4.722 ( 1.685 -1.844 -9.300) 9.629 5.240 ( -6.656 9.434 1.247) 11.613 5.328 ( 5.626 5.546 -1.812) 8.105 5.915 ( -2.818 -1.908 4.281) 5.469 6.097 ( 2.216 -2.601 -3.577) 4.947 6.290 ( -2.168 1.085 1.292) 2.747 6.382 ( 2.309 3.414 -3.229) 5.237 7.007 ( -7.894 3.277 4.163) 9.507 7.166 ( 3.050 1.565 -0.903) 3.544 7.263 ( 7.154 0.388 1.371) 7.295 7.419 ( 2.245 -2.042 -4.494) 5.423 7.820 ( -7.249 2.156 2.140) 7.860 7.964 ( 8.032 1.673 -4.456) 9.336 8.391 ( -14.397 10.703 4.668) 18.537 8.533 ( 8.636 9.540 1.267) 12.931 8.619 ( -2.670 4.609 3.741) 6.509 8.878 ( 3.938 3.167 -5.091) 7.174 11.074 ( -4.229 -13.641 2.309) 14.467 11.209 ( 3.810 -14.784 -3.680) 15.704 12.824 ( 1.806 -5.555 1.592) 6.054 12.886 ( -1.975 -8.711 -1.135) 9.004 15.742 ( 2.378 12.952 7.191) 15.004 16.145 ( -8.762 18.295 -11.148) 23.147 16.679 ( 12.364 15.385 2.646) 19.914 16.761 ( -5.333 16.094 -0.449) 16.960 26.865 ( -0.626 -0.395 0.653) 0.987 26.876 ( 0.366 -0.538 0.145) 0.667 26.969 ( -0.973 -0.650 -0.452) 1.255 26.975 ( 1.341 -0.716 -0.598) 1.634 28.010 ( -0.285 -0.034 1.356) 1.386 28.075 ( 0.350 0.027 -1.492) 1.533 33.729 ( -0.565 -1.078 3.116) 3.346 33.899 ( 0.732 -0.373 -4.611) 4.684 34.663 ( 1.465 3.849 3.414) 5.349 34.786 ( -1.587 4.809 -2.194) 5.519 35.605 ( -1.736 2.854 4.451) 5.565 35.788 ( 1.906 0.719 -3.627) 4.160 37.236 ( 1.353 -1.074 0.002) 1.727 37.248 ( -1.610 -1.992 -0.490) 2.608 44.205 ( -10.956 11.668 2.959) 16.276 44.352 ( 15.423 8.009 -2.069) 17.501 44.993 ( -3.829 4.865 1.819) 6.453 45.138 ( 3.337 5.472 -3.473) 7.290 45.667 ( 1.055 8.955 5.806) 10.724 45.987 ( -3.824 7.773 -8.680) 12.263 47.263 ( -1.148 8.150 14.780) 16.917 47.792 ( 0.737 4.019 -9.234) 10.097 50.567 ( -0.679 13.292 3.576) 13.782 50.755 ( 0.865 26.090 -4.578) 26.502 52.681 ( -3.779 19.954 9.461) 22.405 53.227 ( 3.520 4.292 -14.845) 15.849 60.175 ( -8.972 -11.968 9.727) 17.842 60.614 ( 10.335 -4.117 -9.392) 14.559 67.915 ( -13.298 -8.355 31.961) 35.612 69.480 ( 17.340 6.354 -36.538) 40.940 ======================= Grid point 296 (145/204) ======================= q-point: (-0.27 0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.430 ( 2.740 5.914 9.315) 11.369 2.644 ( -0.830 2.845 -0.614) 3.027 2.847 ( -5.082 4.815 -4.772) 8.472 2.959 ( -5.498 7.295 -5.677) 10.755 3.212 ( -4.870 -5.210 4.991) 8.705 3.485 ( -4.617 0.264 10.539) 11.509 3.638 ( 13.066 -5.505 -0.925) 14.208 3.975 ( 3.955 3.992 -4.945) 7.485 4.079 ( -6.359 2.433 5.557) 8.788 4.246 ( -2.002 0.696 0.245) 2.133 4.524 ( -0.259 2.597 -1.054) 2.815 4.660 ( -1.254 7.000 -9.482) 11.853 5.044 ( -3.463 1.984 0.772) 4.065 5.384 ( 18.231 6.912 -0.792) 19.513 5.905 ( -4.099 0.019 4.481) 6.073 6.139 ( 0.631 1.514 -4.041) 4.361 6.229 ( -4.294 -1.434 -0.062) 4.528 6.370 ( 4.572 2.981 -0.249) 5.464 6.887 ( -5.152 3.159 2.122) 6.405 7.167 ( 2.593 2.493 -0.730) 3.670 7.326 ( 4.156 1.309 1.904) 4.755 7.445 ( 1.458 -0.711 -5.868) 6.088 7.702 ( -7.676 1.370 1.144) 7.881 8.008 ( 5.263 2.532 -3.066) 6.597 8.070 ( -13.103 8.579 4.163) 16.205 8.471 ( -0.521 5.171 6.054) 7.979 8.592 ( 9.699 6.128 -0.107) 11.474 8.846 ( 0.917 2.880 -4.779) 5.654 11.139 ( -14.304 -13.382 0.676) 19.599 11.631 ( 23.067 -14.925 -2.135) 27.557 12.852 ( -11.735 -8.356 0.970) 14.438 13.055 ( 3.486 -6.922 -0.408) 7.761 15.217 ( -37.712 26.354 0.254) 46.008 15.881 ( 0.877 15.348 1.795) 15.477 16.284 ( -3.094 25.275 -3.874) 25.757 16.740 ( 20.059 10.535 -0.181) 22.658 26.865 ( -0.490 -0.353 0.594) 0.847 26.892 ( 0.593 -0.735 0.281) 0.985 26.963 ( -0.622 -0.168 -0.204) 0.676 27.003 ( 1.265 -0.957 -0.923) 1.835 28.012 ( -0.372 -0.266 1.291) 1.370 28.079 ( 0.692 -0.275 -1.440) 1.621 33.748 ( -0.692 -1.241 2.762) 3.106 33.906 ( 0.923 -0.838 -4.242) 4.422 34.603 ( -0.884 5.511 2.665) 6.185 34.688 ( -0.403 5.341 -1.634) 5.600 35.550 ( -1.944 2.870 5.160) 6.216 35.784 ( 1.623 1.148 -4.277) 4.717 37.255 ( -0.983 -1.574 -0.235) 1.870 37.277 ( 1.283 -1.497 -0.110) 1.974 43.771 ( -25.880 19.549 2.050) 32.499 44.386 ( 13.082 9.172 -5.536) 16.909 44.699 ( -20.731 9.025 5.111) 23.181 45.196 ( 11.694 2.448 -3.347) 12.407 45.524 ( 0.319 11.382 5.644) 12.708 45.819 ( 1.453 10.250 -9.386) 13.974 47.025 ( -15.390 15.025 15.633) 26.589 47.720 ( 2.460 4.658 -8.379) 9.897 50.269 ( -10.555 13.290 -0.463) 16.978 50.506 ( 13.137 18.735 1.342) 22.921 51.784 ( -62.034 25.196 2.477) 67.001 53.630 ( 52.259 -0.705 -13.173) 53.899 60.231 ( -7.539 -10.139 4.213) 13.319 61.118 ( 52.124 -10.334 -4.452) 53.325 67.891 ( -20.775 -4.168 25.698) 33.308 69.412 ( 7.487 10.440 -30.204) 32.823 ======================= Grid point 297 (146/204) ======================= q-point: (-0.18 0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.335 ( 0.138 10.335 7.740) 12.913 2.600 ( -0.315 10.074 2.883) 10.483 2.621 ( -8.771 8.555 -5.599) 13.471 2.777 ( -2.280 6.558 -6.167) 9.286 3.225 ( -1.572 -3.277 2.219) 4.258 3.457 ( -2.271 1.167 6.352) 6.846 3.816 ( -9.901 5.441 4.894) 12.312 3.860 ( 7.267 2.413 1.575) 7.818 4.044 ( 5.212 -1.217 -3.128) 6.199 4.299 ( 0.926 -8.384 1.414) 8.552 4.417 ( -2.425 2.976 -5.128) 6.405 4.623 ( 5.710 1.383 -1.183) 5.993 5.066 ( 1.731 -3.372 -2.325) 4.447 5.502 ( 22.048 7.306 0.136) 23.228 5.803 ( -9.905 5.783 2.448) 11.728 6.041 ( -2.861 3.498 -3.310) 5.602 6.271 ( 1.030 -2.742 -0.879) 3.058 6.394 ( 4.566 -0.058 0.608) 4.607 6.799 ( -2.992 3.230 1.108) 4.540 7.135 ( -0.667 2.869 -1.101) 3.145 7.311 ( -1.435 2.376 2.886) 4.005 7.455 ( 1.766 0.486 -5.138) 5.455 7.650 ( 1.630 0.728 -0.177) 1.794 7.836 ( -8.685 5.220 4.428) 11.059 8.042 ( 5.041 1.743 -2.197) 5.768 8.416 ( -1.520 2.085 6.124) 6.645 8.621 ( 10.965 5.337 -0.842) 12.224 8.791 ( -1.403 2.500 -4.657) 5.469 11.194 ( -11.306 -12.470 0.185) 16.833 12.120 ( 25.027 -13.554 -1.311) 28.492 12.838 ( -16.332 -9.860 -0.490) 19.083 13.040 ( -14.291 6.174 0.950) 15.596 14.398 ( -29.652 21.581 -0.243) 36.675 15.344 ( -37.766 23.174 3.189) 44.424 16.121 ( 31.027 20.759 -3.510) 37.496 16.810 ( 18.604 8.511 -2.000) 20.556 26.867 ( -0.271 -0.273 0.439) 0.584 26.911 ( 0.531 -0.636 0.448) 0.942 26.961 ( -0.142 -0.157 -0.034) 0.214 27.025 ( 1.182 -0.483 -1.158) 1.724 28.016 ( -0.576 -0.549 1.155) 1.403 28.092 ( 0.785 -0.654 -1.310) 1.662 33.758 ( -1.528 -0.905 1.974) 2.655 33.928 ( 1.316 -1.580 -3.519) 4.076 34.497 ( -1.976 6.206 1.506) 6.685 34.611 ( 1.309 5.129 -0.495) 5.316 35.504 ( -1.748 1.963 6.064) 6.609 35.769 ( 1.298 1.557 -5.090) 5.479 37.268 ( -0.608 -1.217 -0.392) 1.416 37.310 ( 1.286 -0.742 0.082) 1.487 43.113 ( -30.219 20.798 0.939) 36.697 44.083 ( -29.718 20.387 -7.186) 36.748 44.509 ( 6.125 6.458 7.886) 11.892 45.228 ( 1.281 4.062 -4.827) 6.438 45.413 ( 10.660 10.228 5.107) 15.631 45.644 ( 0.836 11.126 -6.543) 12.934 46.632 ( -12.235 15.451 11.862) 23.003 47.662 ( 3.817 5.559 -5.821) 8.908 49.998 ( -9.513 8.190 -0.009) 12.553 50.410 ( 11.870 13.186 2.616) 17.933 50.868 ( -34.799 18.799 -1.065) 39.567 54.164 ( 38.261 -4.075 -14.812) 41.230 60.448 ( 21.258 -8.907 2.554) 23.190 61.897 ( 55.794 -10.505 -5.299) 57.021 67.693 ( -28.417 0.800 19.035) 34.213 69.198 ( -1.371 13.038 -22.764) 26.269 ======================= Grid point 298 (147/204) ======================= q-point: (-0.09 0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.175 ( 2.212 14.652 8.565) 17.115 2.305 ( -11.332 6.813 -10.654) 16.981 2.423 ( 0.286 17.020 5.745) 17.965 2.682 ( 4.229 6.554 -6.927) 10.432 3.300 ( 2.638 -0.780 6.322) 6.895 3.473 ( 4.925 -1.969 2.561) 5.890 3.604 ( -4.947 2.397 1.474) 5.691 3.939 ( -0.017 -0.500 5.730) 5.751 4.115 ( 6.571 0.780 -3.466) 7.470 4.382 ( -0.502 -0.558 -2.985) 3.078 4.465 ( 0.698 -9.285 1.626) 9.452 4.694 ( 5.674 -2.117 0.905) 6.123 5.137 ( 2.090 -3.492 -4.465) 6.041 5.545 ( -14.119 7.479 0.059) 15.977 5.654 ( 22.560 5.856 -0.587) 23.315 5.978 ( 0.591 3.532 -0.759) 3.661 6.287 ( -0.230 0.915 -1.443) 1.724 6.488 ( 4.480 -4.960 -0.536) 6.705 6.733 ( -0.936 2.152 0.872) 2.504 7.067 ( -4.883 1.371 -1.090) 5.187 7.272 ( 1.910 3.478 3.097) 5.033 7.426 ( -2.234 3.031 -0.053) 3.765 7.673 ( 6.352 4.665 -2.940) 8.412 7.740 ( -1.905 -1.615 1.765) 3.058 8.076 ( 5.772 1.003 -0.454) 5.876 8.399 ( -1.338 0.094 4.901) 5.081 8.665 ( 8.555 3.270 -1.197) 9.237 8.720 ( -1.519 2.922 -3.667) 4.928 11.265 ( -9.005 -11.554 0.034) 14.649 12.411 ( -20.097 13.992 1.238) 24.519 12.620 ( 1.317 -7.182 -1.964) 7.561 12.903 ( -0.065 -10.777 1.268) 10.852 14.038 ( -8.416 3.295 0.267) 9.042 14.521 ( -37.816 26.138 1.002) 45.981 16.181 ( 32.081 18.246 -1.514) 36.937 16.882 ( 16.415 7.014 -4.322) 18.366 26.869 ( -0.039 -0.135 0.143) 0.201 26.921 ( -0.055 -0.068 0.767) 0.772 26.964 ( 0.271 -0.083 -0.133) 0.313 27.037 ( 0.931 0.125 -1.197) 1.522 28.022 ( -0.797 -0.835 1.034) 1.550 28.109 ( 0.500 -0.916 -1.197) 1.587 33.752 ( -2.059 -0.571 1.152) 2.427 33.960 ( 0.864 -1.391 -2.820) 3.261 34.397 ( -0.322 4.948 1.263) 5.116 34.566 ( 3.078 3.456 -0.045) 4.628 35.487 ( -0.878 0.194 6.849) 6.908 35.744 ( 1.201 1.690 -5.835) 6.193 37.274 ( -0.203 -0.181 -0.295) 0.401 37.325 ( 0.868 0.290 -0.088) 0.919 42.607 ( -14.354 9.723 1.220) 17.380 43.237 ( -41.526 28.686 -3.998) 50.629 44.521 ( 9.539 6.549 6.420) 13.232 45.128 ( -1.133 5.019 -3.426) 6.182 45.420 ( 13.812 10.949 1.138) 17.662 45.531 ( 2.744 3.326 -1.515) 4.570 46.405 ( 4.879 12.340 4.402) 13.981 47.601 ( 4.035 6.836 -3.843) 8.819 49.781 ( -8.488 6.422 0.397) 10.651 50.358 ( 1.780 5.805 2.231) 6.469 50.476 ( 4.295 10.829 -1.475) 11.743 54.472 ( 13.577 -1.693 -16.116) 21.140 61.003 ( 46.771 -11.537 2.229) 48.225 62.593 ( 47.067 -5.744 -9.934) 48.446 67.344 ( -32.332 3.555 12.490) 34.842 68.904 ( -5.694 13.443 -15.164) 21.050 ======================= Grid point 304 (148/204) ======================= q-point: ( 0.45 0.45 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.465 ( -1.282 -0.000 3.787) 3.998 2.587 ( 12.341 0.000 1.845) 12.478 2.751 ( 3.093 0.000 -1.768) 3.563 2.782 ( 0.701 0.000 -2.557) 2.651 3.251 ( 1.491 0.000 1.303) 1.980 3.457 ( -8.856 -0.000 1.689) 9.015 3.687 ( -4.754 -0.000 16.064) 16.753 4.231 ( 11.696 0.000 -10.694) 15.848 4.264 ( 3.651 0.000 7.982) 8.778 4.406 ( -9.664 -0.000 5.078) 10.917 4.597 ( 0.052 0.000 -10.973) 10.973 4.718 ( -5.151 -0.000 -2.850) 5.887 5.455 ( -0.117 -0.000 -2.572) 2.575 5.482 ( -4.568 -0.000 0.157) 4.571 5.898 ( -4.775 -0.000 3.205) 5.751 6.009 ( 5.584 0.000 -5.611) 7.916 6.342 ( 1.857 0.000 -0.393) 1.898 6.451 ( -1.947 -0.000 -2.915) 3.505 7.037 ( 3.458 0.000 7.751) 8.488 7.172 ( -6.322 -0.000 5.034) 8.081 7.275 ( 7.371 0.000 -6.782) 10.016 7.301 ( 4.619 0.000 -3.515) 5.804 7.824 ( 16.600 0.000 -2.984) 16.867 8.002 ( -7.946 -0.000 3.887) 8.846 8.710 ( -5.558 -0.000 9.184) 10.735 8.737 ( 15.389 0.000 0.380) 15.394 8.860 ( 6.131 0.000 -3.879) 7.255 8.933 ( 0.651 0.000 -4.414) 4.462 10.745 ( -13.258 -0.000 2.974) 13.588 10.860 ( -12.528 -0.000 -3.675) 13.056 12.650 ( 0.953 0.000 0.262) 0.989 12.722 ( -2.553 -0.000 0.185) 2.560 15.989 ( 5.232 0.000 8.864) 10.293 16.450 ( 6.360 0.000 -9.669) 11.573 17.076 ( 4.621 0.000 4.132) 6.199 17.154 ( 9.668 0.000 -4.871) 10.826 26.857 ( -0.563 -0.000 0.549) 0.787 26.862 ( 0.440 0.000 -0.279) 0.521 26.928 ( -0.060 -0.000 0.688) 0.691 26.973 ( 0.266 0.000 -1.299) 1.326 28.015 ( -0.595 -0.000 1.440) 1.559 28.081 ( 0.008 0.000 -1.571) 1.571 33.705 ( -1.089 -0.000 3.529) 3.693 33.897 ( 0.582 0.000 -5.022) 5.056 34.716 ( 2.915 0.000 3.636) 4.660 34.918 ( -0.539 -0.000 -1.955) 2.028 35.688 ( -1.372 -0.000 3.299) 3.573 35.785 ( 2.420 0.000 -2.652) 3.590 37.205 ( -1.602 -0.000 0.362) 1.643 37.209 ( 0.671 0.000 -1.037) 1.235 44.450 ( -0.689 -0.000 3.626) 3.691 44.580 ( 4.929 0.000 -5.823) 7.629 44.912 ( 8.183 0.000 6.189) 10.260 45.331 ( -0.466 -0.000 -6.716) 6.732 45.867 ( 7.531 0.000 4.378) 8.711 46.169 ( -0.712 -0.000 -3.470) 3.542 47.304 ( 10.427 0.000 11.483) 15.511 47.880 ( 3.636 0.000 -7.619) 8.442 50.971 ( 1.149 0.000 10.859) 10.920 51.387 ( 18.514 0.000 -14.073) 23.256 52.876 ( 35.820 0.000 0.945) 35.832 53.466 ( -2.525 -0.000 -0.693) 2.619 60.201 ( -41.524 -0.000 17.120) 44.915 60.652 ( -16.183 -0.000 -19.404) 25.266 67.610 ( -8.363 -0.000 43.814) 44.605 69.437 ( 27.501 0.000 -47.252) 54.672 ======================= Grid point 305 (149/204) ======================= q-point: (-0.45 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.472 ( -1.543 -1.460 4.073) 4.593 2.732 ( 1.365 -0.117 0.641) 1.512 2.759 ( 5.645 -1.395 0.506) 5.836 2.799 ( 0.936 -4.913 -5.197) 7.213 3.319 ( 7.576 -0.777 4.394) 8.793 3.325 ( -12.990 1.537 0.599) 13.094 3.637 ( -6.662 2.216 13.902) 15.575 4.246 ( 1.984 5.516 0.331) 5.871 4.317 ( -0.749 3.150 0.148) 3.242 4.366 ( 7.887 0.983 -0.544) 7.967 4.586 ( -2.093 -1.510 -5.091) 5.708 4.654 ( -1.728 -0.633 -6.151) 6.420 5.429 ( -4.565 1.839 -0.431) 4.941 5.448 ( 4.874 2.569 -1.451) 5.697 5.863 ( -3.084 -0.777 3.134) 4.465 6.054 ( 4.360 -0.099 -5.431) 6.966 6.343 ( 0.213 1.694 0.829) 1.898 6.425 ( -0.915 -0.067 -3.419) 3.540 7.066 ( -4.436 0.405 6.530) 7.904 7.119 ( -3.827 -1.755 4.863) 6.432 7.327 ( 4.160 0.661 -3.686) 5.598 7.348 ( 6.107 -0.670 -6.402) 8.873 7.890 ( -8.904 1.923 2.673) 9.494 7.995 ( 12.203 0.159 -3.231) 12.625 8.622 ( -11.021 2.840 9.152) 14.604 8.749 ( -6.155 5.888 2.398) 8.849 8.848 ( 6.345 6.670 -3.023) 9.689 8.960 ( 5.828 1.114 -4.947) 7.725 10.721 ( -3.096 -7.503 2.428) 8.472 10.849 ( 2.805 -7.163 -3.236) 8.345 12.695 ( 3.277 -3.203 0.512) 4.611 12.709 ( -3.483 -2.023 -0.075) 4.028 15.999 ( -1.374 4.054 8.972) 9.941 16.435 ( -1.339 3.385 -10.053) 10.692 17.040 ( -2.477 6.454 2.723) 7.430 17.171 ( 5.884 8.276 -3.240) 10.659 26.853 ( -0.597 -0.241 0.519) 0.827 26.866 ( 0.345 -0.105 -0.099) 0.374 26.935 ( -0.071 -0.757 0.443) 0.880 26.974 ( 0.445 0.036 -1.198) 1.279 28.012 ( -0.318 0.079 1.402) 1.440 28.079 ( 0.416 0.131 -1.542) 1.602 33.707 ( -0.646 -0.372 3.520) 3.598 33.893 ( 0.766 -0.053 -4.958) 5.017 34.743 ( 1.975 1.309 4.043) 4.686 34.885 ( -2.080 1.646 -2.487) 3.636 35.669 ( -1.680 1.162 3.168) 3.770 35.803 ( 2.157 0.238 -2.667) 3.439 37.196 ( -1.255 -0.964 0.191) 1.594 37.217 ( 0.760 -0.317 -0.690) 1.074 44.417 ( -4.087 2.655 2.343) 5.408 44.569 ( 6.074 6.062 -3.232) 9.170 45.016 ( 4.025 -2.254 4.753) 6.624 45.273 ( -4.089 2.685 -6.623) 8.233 45.896 ( 3.281 4.703 5.771) 8.135 46.112 ( -6.590 1.286 -4.418) 8.038 47.404 ( 4.167 1.811 11.743) 12.591 47.864 ( -1.501 1.014 -8.719) 8.905 50.916 ( -4.438 7.147 8.821) 12.190 51.422 ( 9.840 12.989 -13.840) 21.380 53.118 ( 13.652 7.744 5.159) 16.521 53.314 ( -19.319 1.635 -3.110) 19.636 59.939 ( -14.519 -3.587 13.650) 20.248 60.598 ( 16.324 1.415 -15.370) 22.466 67.636 ( -14.736 -6.912 40.549) 43.694 69.591 ( 20.936 1.407 -45.246) 49.875 ======================= Grid point 306 (150/204) ======================= q-point: (-0.36 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.494 ( -0.462 -1.234 6.604) 6.734 2.639 ( -9.914 -0.760 -3.345) 10.491 2.874 ( 1.210 -4.316 -4.436) 6.306 2.962 ( 11.152 -5.153 0.510) 12.296 3.130 ( -14.448 2.925 0.299) 14.744 3.448 ( 7.728 -1.974 8.442) 11.615 3.558 ( -5.691 1.291 8.402) 10.230 4.158 ( -1.571 4.781 1.211) 5.177 4.230 ( -0.545 7.405 -2.258) 7.760 4.382 ( 3.795 5.727 -0.577) 6.894 4.562 ( 0.453 0.403 -2.975) 3.036 4.703 ( 4.188 -2.951 -5.786) 7.728 5.268 ( -7.877 8.812 -0.848) 11.850 5.515 ( 11.670 1.269 -0.258) 11.741 5.865 ( -1.874 -1.528 2.682) 3.611 6.096 ( 4.092 -1.233 -3.980) 5.840 6.286 ( -4.225 3.095 0.769) 5.294 6.426 ( 1.827 -0.071 -2.580) 3.162 6.975 ( -6.794 2.441 3.738) 8.130 7.148 ( -2.163 -3.172 4.064) 5.591 7.340 ( -1.575 -1.450 -2.434) 3.242 7.420 ( 8.290 0.431 -6.107) 10.306 7.750 ( -10.609 1.551 0.773) 10.750 8.085 ( 8.451 2.323 -3.525) 9.447 8.373 ( -17.502 9.573 5.270) 20.634 8.578 ( -8.941 3.512 7.440) 12.150 8.837 ( 9.134 6.609 -2.271) 11.501 8.953 ( 1.885 3.638 -4.437) 6.039 10.793 ( -4.577 -7.734 1.030) 9.046 11.173 ( 21.662 -14.208 -1.780) 25.966 12.677 ( -7.669 -2.768 0.136) 8.154 12.838 ( 6.523 -6.498 0.349) 9.214 15.817 ( -17.947 12.097 6.990) 22.744 16.257 ( -8.758 8.925 -6.816) 14.242 16.863 ( -5.195 10.740 -0.452) 11.939 17.066 ( 7.511 11.540 -1.612) 13.863 26.853 ( -0.549 -0.402 0.507) 0.849 26.874 ( 0.354 -0.365 0.158) 0.533 26.946 ( -0.495 -0.890 -0.052) 1.019 26.980 ( 1.084 -0.317 -0.935) 1.466 28.012 ( -0.148 0.121 1.358) 1.371 28.080 ( 0.799 0.184 -1.521) 1.728 33.718 ( -0.303 -0.691 3.355) 3.438 33.893 ( 0.896 -0.144 -4.730) 4.816 34.735 ( 0.391 2.947 3.821) 4.841 34.815 ( -2.683 2.843 -2.510) 4.646 35.631 ( -1.996 2.095 3.437) 4.492 35.813 ( 1.926 0.628 -2.945) 3.575 37.202 ( -1.391 -1.599 -0.224) 2.131 37.237 ( 1.387 -0.884 -0.106) 1.648 44.234 ( -12.995 10.505 1.326) 16.763 44.569 ( 8.901 4.425 -1.700) 10.085 44.981 ( -12.883 7.610 0.962) 14.993 45.190 ( 0.504 -1.654 -3.145) 3.589 45.827 ( -1.815 7.239 6.257) 9.739 46.003 ( -3.661 2.133 -5.434) 6.891 47.365 ( -6.135 6.982 11.555) 14.829 47.792 ( -3.873 0.754 -8.778) 9.624 50.698 ( -10.506 12.356 5.080) 16.996 51.200 ( 8.133 22.250 -9.117) 25.384 52.512 ( -56.702 21.426 1.013) 60.624 53.473 ( 17.962 -8.316 -0.307) 19.796 60.009 ( 7.913 -4.814 9.605) 13.344 60.935 ( 49.486 -1.280 -11.153) 50.743 67.659 ( -20.457 -9.374 34.288) 41.012 69.637 ( 12.454 4.284 -41.420) 43.464 ======================= Grid point 307 (151/204) ======================= q-point: (-0.27 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.474 ( -7.509 0.530 -0.023) 7.528 2.612 ( -0.589 -5.385 3.708) 6.564 2.866 ( -6.619 5.988 1.069) 8.989 2.926 ( -5.870 1.373 -6.556) 8.906 3.134 ( 1.669 -4.020 0.268) 4.361 3.447 ( -7.556 1.703 13.462) 15.531 3.681 ( 11.339 -8.246 2.113) 14.179 4.081 ( -5.672 6.202 4.781) 9.669 4.099 ( 3.659 4.761 -5.460) 8.116 4.300 ( 0.491 7.105 0.803) 7.167 4.547 ( 0.746 2.932 -4.825) 5.695 4.730 ( 2.160 4.051 -6.242) 7.748 5.068 ( -2.032 5.251 0.804) 5.687 5.654 ( 16.144 1.530 0.309) 16.219 5.861 ( -3.216 -0.349 2.406) 4.031 6.157 ( -8.273 1.813 -0.086) 8.470 6.171 ( 4.417 -0.399 -3.316) 5.538 6.442 ( 2.345 0.944 -0.024) 2.529 6.885 ( -3.644 2.279 1.469) 4.543 7.166 ( -3.420 -1.501 1.751) 4.125 7.325 ( -4.621 -2.060 -1.418) 5.254 7.457 ( -0.244 0.439 -4.157) 4.187 7.661 ( 0.422 0.147 -1.751) 1.807 8.054 ( -12.402 8.148 5.013) 15.663 8.111 ( 3.162 3.209 -2.751) 5.278 8.468 ( -6.893 1.880 7.916) 10.664 8.833 ( 8.234 6.001 -2.038) 10.390 8.885 ( -1.512 3.862 -3.986) 5.752 10.876 ( -1.237 -7.036 0.624) 7.171 11.674 ( 26.247 -15.299 -1.352) 30.410 12.625 ( -10.233 -3.549 0.236) 10.833 13.002 ( 3.522 -5.620 0.387) 6.644 15.207 ( -36.046 26.365 1.343) 44.679 15.907 ( -25.875 13.786 1.308) 29.347 16.667 ( 8.186 13.272 -3.810) 16.053 17.017 ( 7.657 6.148 -1.171) 9.889 26.856 ( -0.392 -0.454 0.469) 0.761 26.887 ( 0.491 -0.727 0.366) 0.950 26.950 ( -0.459 -0.545 -0.319) 0.780 27.002 ( 1.337 -0.841 -0.838) 1.788 28.011 ( -0.144 0.137 1.243) 1.259 28.085 ( 1.060 0.096 -1.421) 1.776 33.734 ( -0.321 -0.720 2.918) 3.023 33.897 ( 0.976 -0.451 -4.260) 4.393 34.667 ( -2.854 4.674 1.305) 5.630 34.745 ( -0.800 3.301 -0.227) 3.404 35.579 ( -2.339 2.585 4.075) 5.363 35.812 ( 1.719 1.137 -3.488) 4.051 37.214 ( -1.067 -1.911 -0.482) 2.241 37.272 ( 1.554 -1.389 0.264) 2.101 43.771 ( -28.266 20.503 0.525) 34.922 44.544 ( -9.656 10.842 -7.436) 16.311 44.657 ( -5.702 5.479 6.836) 10.453 45.247 ( 1.464 -2.741 -3.489) 4.673 45.702 ( -1.818 6.918 6.111) 9.408 45.924 ( -0.685 5.264 -6.147) 8.121 47.084 ( -18.262 13.401 9.561) 24.586 47.736 ( -2.438 -0.290 -5.675) 6.184 50.361 ( -11.600 14.709 0.719) 18.746 50.939 ( 4.348 20.148 -1.380) 20.658 51.519 ( -48.105 22.694 -1.282) 53.205 53.825 ( 9.490 -16.233 -1.759) 18.885 60.290 ( 29.409 -2.436 6.869) 30.299 61.624 ( 63.533 -5.824 -9.262) 64.468 67.599 ( -25.922 -6.721 26.573) 37.726 69.531 ( 1.977 8.340 -35.550) 36.569 ======================= Grid point 308 (152/204) ======================= q-point: (-0.18 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.372 ( -8.543 -0.029 -4.168) 9.506 2.590 ( -14.263 6.937 1.623) 15.943 2.774 ( 8.879 1.153 7.596) 11.742 2.813 ( -4.313 5.210 -3.880) 7.797 3.155 ( -2.904 -3.157 -0.718) 4.350 3.395 ( -5.463 -1.700 7.523) 9.451 3.804 ( -10.722 6.489 5.754) 13.790 4.014 ( 12.173 -1.518 0.330) 12.272 4.111 ( 6.862 0.995 -3.822) 7.918 4.226 ( -0.433 0.780 2.498) 2.652 4.462 ( 1.011 5.078 -6.065) 7.975 4.678 ( 2.637 2.407 -3.499) 4.999 5.071 ( 4.429 -0.463 0.504) 4.481 5.766 ( -11.695 4.966 3.097) 13.078 5.807 ( 16.349 3.556 -0.815) 16.751 6.024 ( -4.191 0.499 -2.745) 5.035 6.247 ( 2.626 -2.351 -1.784) 3.951 6.452 ( 2.575 1.249 1.690) 3.324 6.823 ( -1.598 2.646 0.332) 3.109 7.100 ( -9.083 0.602 -0.137) 9.104 7.319 ( -0.642 -1.714 0.619) 1.932 7.428 ( -2.669 -1.628 -3.036) 4.358 7.719 ( 6.694 0.115 -0.905) 6.756 7.854 ( -4.672 5.705 2.206) 7.696 8.098 ( 1.281 1.169 -1.031) 2.017 8.403 ( -4.125 0.776 6.705) 7.911 8.789 ( -2.928 3.724 -4.137) 6.290 8.831 ( 6.074 4.249 -1.486) 7.560 10.978 ( 0.794 -6.144 0.337) 6.204 12.193 ( 25.417 -13.673 -1.039) 28.880 12.563 ( -11.073 -4.335 -0.123) 11.892 12.994 ( -10.852 5.868 0.815) 12.364 14.393 ( -31.088 22.391 0.102) 38.313 15.261 ( -38.822 21.350 1.919) 44.347 16.628 ( 16.786 10.637 -2.460) 20.024 17.022 ( 5.253 2.700 -2.242) 6.318 26.860 ( -0.176 -0.435 0.356) 0.589 26.906 ( 0.385 -0.788 0.575) 1.049 26.955 ( 0.058 -0.487 -0.285) 0.567 27.027 ( 1.171 -0.734 -0.991) 1.701 28.010 ( -0.233 0.060 1.071) 1.098 28.094 ( 1.060 -0.087 -1.243) 1.636 33.741 ( -0.899 -0.228 2.003) 2.207 33.912 ( 1.245 -1.239 -3.392) 3.820 34.557 ( -3.294 4.920 0.459) 5.939 34.685 ( -0.337 3.827 0.496) 3.873 35.524 ( -2.522 2.149 5.053) 6.043 35.799 ( 1.459 1.714 -4.274) 4.830 37.235 ( -0.386 -2.046 -0.542) 2.151 37.309 ( 1.216 -1.152 0.299) 1.702 43.069 ( -33.458 20.548 -0.191) 39.264 44.021 ( -32.789 20.389 -2.716) 38.707 44.652 ( 4.956 3.427 2.920) 6.696 45.249 ( -2.059 1.306 -4.783) 5.368 45.629 ( 1.883 4.535 6.879) 8.452 45.759 ( -5.293 8.719 -5.657) 11.664 46.732 ( -9.756 9.682 6.541) 15.222 47.706 ( -1.729 0.143 -3.186) 3.627 50.026 ( -11.922 11.237 -0.229) 16.384 50.609 ( -17.479 10.961 3.193) 20.877 50.961 ( 3.115 17.739 -4.035) 18.456 54.132 ( -2.025 -18.038 -3.089) 18.412 60.780 ( 45.726 -3.772 7.057) 46.421 62.403 ( 61.116 -5.474 -11.768) 62.479 67.394 ( -30.832 -1.111 18.222) 35.831 69.273 ( -7.326 10.731 -26.998) 29.962 ======================= Grid point 309 (153/204) ======================= q-point: (-0.09 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.215 ( -14.029 3.414 -7.669) 16.348 2.358 ( -3.360 6.603 5.226) 9.067 2.640 ( -2.133 10.062 0.435) 10.295 2.839 ( 7.500 6.026 0.717) 9.647 3.257 ( -0.865 -8.597 5.317) 10.145 3.419 ( 2.222 -5.064 2.593) 6.108 3.592 ( -7.812 3.333 3.162) 9.063 4.045 ( 3.162 9.297 4.339) 10.736 4.171 ( 4.897 -0.710 -3.183) 5.883 4.314 ( -0.105 -6.824 -0.833) 6.876 4.442 ( 4.842 1.065 -2.946) 5.767 4.698 ( 2.719 -1.803 -1.541) 3.608 5.139 ( 5.316 -1.135 -1.184) 5.564 5.487 ( -15.987 7.555 -1.124) 17.718 5.900 ( 8.509 2.463 0.288) 8.863 6.035 ( 5.036 0.639 -0.820) 5.143 6.282 ( 0.373 -0.793 -2.151) 2.323 6.481 ( 2.379 -1.099 0.945) 2.786 6.774 ( 0.585 2.576 0.190) 2.649 6.988 ( -9.226 -0.175 0.265) 9.231 7.357 ( 3.712 -0.136 0.391) 3.736 7.420 ( -1.987 0.299 0.172) 2.017 7.705 ( -4.086 0.908 2.565) 4.909 7.828 ( 8.088 3.401 -3.532) 9.458 8.123 ( 3.504 -1.481 0.147) 3.807 8.378 ( -2.446 -0.096 5.106) 5.663 8.690 ( -4.204 2.346 -3.853) 6.166 8.836 ( 5.389 3.125 -1.221) 6.348 11.074 ( 0.264 -5.346 0.085) 5.353 12.389 ( -22.838 12.528 -1.549) 26.095 12.464 ( -5.406 -1.725 1.652) 5.911 12.888 ( 20.168 -11.237 0.491) 23.092 13.993 ( -9.959 4.336 0.371) 10.868 14.474 ( -37.566 22.669 0.623) 43.880 16.670 ( 17.589 9.263 -0.846) 19.897 17.033 ( 2.129 0.615 -3.560) 4.193 26.866 ( 0.030 -0.341 0.139) 0.370 26.918 ( -0.147 -0.360 0.885) 0.967 26.964 ( 0.449 -0.333 -0.319) 0.643 27.044 ( 0.824 -0.258 -1.087) 1.389 28.010 ( -0.360 -0.136 0.936) 1.012 28.104 ( 0.725 -0.250 -1.092) 1.334 33.732 ( -1.228 0.061 1.097) 1.648 33.942 ( 1.177 -1.476 -2.647) 3.251 34.458 ( -1.832 4.061 0.885) 4.542 34.631 ( 0.292 2.684 0.127) 2.703 35.490 ( -2.044 0.442 6.106) 6.454 35.774 ( 1.298 2.010 -5.100) 5.633 37.260 ( 0.075 -1.364 -0.444) 1.437 37.332 ( 0.590 -0.400 0.024) 0.713 42.551 ( -17.014 6.243 0.191) 18.124 43.223 ( -36.120 27.157 -2.295) 45.248 44.655 ( 3.224 2.883 3.442) 5.528 45.166 ( -2.150 3.405 -4.229) 5.840 45.573 ( -3.567 2.987 1.681) 4.947 45.653 ( 5.126 3.468 0.981) 6.266 46.616 ( 4.396 5.257 1.556) 7.027 47.673 ( -1.083 1.361 -1.714) 2.442 49.781 ( -7.811 5.450 0.271) 9.528 50.368 ( -6.702 3.606 0.565) 7.632 50.829 ( 13.000 13.273 -1.411) 18.633 54.296 ( -10.209 -13.204 -3.878) 17.135 61.406 ( 42.026 -8.022 10.266) 43.999 63.040 ( 48.275 -0.323 -18.699) 51.771 67.059 ( -29.809 2.444 10.883) 31.828 68.959 ( -9.554 9.671 -17.171) 21.901 ======================= Grid point 316 (154/204) ======================= q-point: (-0.45 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.451 ( -1.769 -0.000 5.715) 5.982 2.629 ( -11.824 -0.000 -1.854) 11.968 2.763 ( 2.683 0.000 -7.723) 8.176 2.896 ( 12.352 0.000 1.137) 12.404 3.191 ( -13.097 -0.000 -0.106) 13.097 3.422 ( 8.701 0.000 7.249) 11.325 3.583 ( -10.589 -0.000 13.456) 17.123 4.248 ( -4.747 -0.000 5.795) 7.491 4.403 ( -0.063 -0.000 -12.421) 12.421 4.456 ( 7.335 0.000 8.106) 10.932 4.567 ( 6.465 0.000 -4.206) 7.712 4.616 ( 0.996 0.000 -7.300) 7.367 5.425 ( -0.052 -0.000 -0.869) 0.870 5.509 ( 4.394 0.000 -1.228) 4.563 5.835 ( -1.354 -0.000 2.152) 2.542 6.093 ( 4.395 0.000 -5.695) 7.194 6.368 ( 0.226 0.000 1.581) 1.597 6.389 ( -2.637 -0.000 -3.139) 4.100 7.046 ( -5.403 -0.000 3.937) 6.686 7.046 ( -5.059 -0.000 6.510) 8.245 7.300 ( -2.985 -0.000 -4.029) 5.014 7.437 ( 7.917 0.000 -6.157) 10.029 7.778 ( -12.534 -0.000 0.750) 12.556 8.123 ( 9.358 0.000 -2.877) 9.790 8.521 ( -15.053 -0.000 9.385) 17.740 8.691 ( -12.395 -0.000 2.949) 12.741 8.911 ( -1.767 -0.000 -1.958) 2.638 9.024 ( 3.963 0.000 -4.857) 6.269 10.715 ( 11.022 0.000 2.663) 11.339 10.883 ( 14.593 0.000 -3.175) 14.934 12.669 ( -1.861 -0.000 -0.538) 1.937 12.702 ( 3.058 0.000 1.056) 3.235 15.992 ( -8.812 -0.000 9.703) 13.107 16.396 ( -6.924 -0.000 -8.983) 11.342 17.012 ( -11.148 -0.000 2.209) 11.364 17.279 ( 2.647 0.000 -4.734) 5.424 26.846 ( -0.587 -0.000 0.438) 0.732 26.869 ( 0.270 0.000 -0.094) 0.286 26.929 ( -0.126 -0.000 0.629) 0.642 26.977 ( 0.618 0.000 -1.346) 1.481 28.014 ( -0.047 -0.000 1.404) 1.405 28.084 ( 0.836 0.000 -1.583) 1.790 33.707 ( -0.267 -0.000 3.596) 3.606 33.891 ( 1.047 0.000 -4.931) 5.041 34.780 ( 1.060 0.000 4.390) 4.516 34.859 ( -3.659 -0.000 -2.902) 4.670 35.665 ( -1.896 -0.000 2.680) 3.283 35.822 ( 1.912 0.000 -2.442) 3.101 37.175 ( -1.147 -0.000 0.283) 1.182 37.224 ( 1.017 0.000 -0.543) 1.153 44.397 ( -5.213 -0.000 2.187) 5.654 44.666 ( 5.179 0.000 -5.287) 7.401 45.026 ( -0.396 -0.000 7.591) 7.602 45.217 ( -7.340 -0.000 -7.998) 10.856 45.949 ( -1.845 -0.000 6.294) 6.558 46.009 ( -12.343 -0.000 -2.925) 12.685 47.467 ( -0.562 -0.000 10.980) 10.994 47.799 ( -7.281 -0.000 -9.895) 12.285 50.903 ( -10.819 -0.000 8.166) 13.554 51.586 ( 5.662 0.000 -15.947) 16.922 52.958 ( -40.615 -0.000 -3.132) 40.736 53.237 ( -7.492 -0.000 8.391) 11.249 59.932 ( 12.782 0.000 12.615) 17.959 60.948 ( 48.325 0.000 -15.721) 50.818 67.479 ( -20.124 -0.000 39.730) 44.536 69.696 ( 15.047 0.000 -47.011) 49.361 ======================= Grid point 317 (155/204) ======================= q-point: (-0.36 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.448 ( -5.738 -1.388 6.195) 8.558 2.488 ( -12.203 -1.639 -0.730) 12.335 2.814 ( 3.382 -3.857 -8.300) 9.757 2.974 ( -4.882 -0.295 -8.178) 9.529 3.084 ( 1.980 1.284 6.576) 6.987 3.489 ( -9.155 -0.929 8.288) 12.384 3.542 ( 6.652 -0.152 12.218) 13.912 4.195 ( -2.814 2.823 5.164) 6.523 4.294 ( -5.017 4.139 -6.969) 9.532 4.491 ( 2.567 5.042 1.727) 5.915 4.626 ( 7.406 0.320 -8.331) 11.152 4.712 ( 9.687 -2.130 -0.225) 9.921 5.346 ( -2.363 8.952 -1.292) 9.348 5.594 ( 5.734 -4.230 0.021) 7.125 5.853 ( 2.784 -0.525 0.430) 2.866 6.123 ( 3.359 0.210 -4.525) 5.639 6.296 ( -4.131 4.085 -0.358) 5.821 6.410 ( -0.242 -2.664 0.012) 2.675 6.950 ( -5.808 2.438 3.691) 7.301 7.062 ( -3.916 -4.435 3.843) 7.054 7.250 ( -6.512 -1.623 -3.688) 7.658 7.463 ( -3.831 -0.062 -4.319) 5.773 7.666 ( -2.911 0.165 -2.465) 3.818 8.173 ( 1.255 1.301 -1.009) 2.070 8.313 ( -15.969 5.847 5.271) 17.804 8.537 ( -9.825 2.446 6.346) 11.949 8.882 ( -4.276 -1.576 -1.545) 4.812 9.007 ( -0.986 2.427 -4.565) 5.263 10.842 ( 16.409 4.876 1.549) 17.188 11.219 ( 24.711 -13.217 -1.829) 28.084 12.619 ( -2.528 2.582 -0.026) 3.613 12.805 ( 4.953 -6.097 0.658) 7.883 15.799 ( -19.499 10.257 8.792) 23.722 16.213 ( -15.625 6.089 -6.335) 17.926 16.851 ( -13.749 0.745 1.433) 13.843 17.227 ( -0.356 5.321 -6.303) 8.256 26.843 ( -0.499 -0.279 0.403) 0.699 26.873 ( 0.236 -0.205 0.083) 0.324 26.933 ( -0.209 -0.439 0.421) 0.643 26.983 ( 0.842 -0.317 -1.306) 1.586 28.017 ( 0.174 0.158 1.396) 1.416 28.090 ( 1.185 0.151 -1.626) 2.018 33.717 ( 0.036 -0.317 3.492) 3.506 33.893 ( 1.282 0.044 -4.738) 4.908 34.775 ( -2.420 2.258 1.516) 3.640 34.803 ( -2.521 0.505 -0.234) 2.582 35.640 ( -2.117 1.125 2.638) 3.565 35.834 ( 1.633 0.293 -2.519) 3.016 37.170 ( -1.025 -0.768 0.128) 1.287 37.240 ( 1.228 -0.597 -0.150) 1.373 44.254 ( -11.612 9.376 1.417) 14.992 44.696 ( 6.313 1.870 -4.208) 7.814 44.956 ( -14.255 8.704 0.568) 16.711 45.113 ( -4.806 -3.903 -1.396) 6.346 45.820 ( -13.129 1.587 0.087) 13.225 45.947 ( -5.469 -2.263 3.904) 7.091 47.401 ( -9.845 6.547 8.457) 14.536 47.683 ( -9.945 -2.368 -8.888) 13.546 50.724 ( -14.032 6.681 5.918) 16.630 51.486 ( 0.206 10.925 -14.346) 18.033 52.229 ( -52.838 22.537 -1.099) 57.454 53.261 ( -15.490 -18.611 6.914) 25.182 60.235 ( 31.825 -1.317 11.483) 33.859 61.568 ( 68.134 0.781 -15.586) 69.898 67.371 ( -23.324 -5.686 35.014) 42.454 69.696 ( 7.299 2.505 -46.939) 47.569 ======================= Grid point 318 (156/204) ======================= q-point: (-0.27 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.328 ( -14.240 -1.792 -1.498) 14.430 2.472 ( -9.259 -5.941 5.708) 12.394 2.858 ( -3.771 -0.836 -6.996) 7.992 2.885 ( -1.000 -0.649 -3.840) 4.021 3.110 ( -0.801 1.367 1.173) 1.971 3.424 ( -6.221 1.020 11.205) 12.857 3.683 ( 6.960 -5.443 8.011) 11.927 4.130 ( -2.421 4.266 5.733) 7.545 4.173 ( -0.630 3.989 -5.784) 7.054 4.420 ( 1.296 6.812 0.539) 6.956 4.635 ( 4.152 5.045 -8.040) 10.360 4.820 ( 7.708 2.792 -1.797) 8.393 5.161 ( -0.841 8.354 0.651) 8.421 5.739 ( 3.606 -5.690 1.987) 7.024 5.896 ( 7.601 2.282 -2.318) 8.268 6.087 ( -9.702 2.634 0.647) 10.074 6.218 ( 3.187 1.187 -3.961) 5.221 6.449 ( 0.361 -2.040 1.680) 2.667 6.876 ( -3.758 1.075 2.116) 4.445 7.086 ( -4.898 -1.975 1.066) 5.387 7.194 ( -8.358 -4.598 -2.734) 9.923 7.366 ( -10.252 -2.258 -2.233) 10.733 7.701 ( 6.384 -0.708 -3.997) 7.566 8.024 ( -13.740 4.832 5.380) 15.527 8.165 ( -1.542 3.265 -1.601) 3.949 8.446 ( -4.551 1.305 6.504) 8.045 8.845 ( -6.103 -1.145 -1.716) 6.442 8.930 ( -3.021 2.432 -3.707) 5.365 10.956 ( 17.312 5.232 0.865) 18.106 11.740 ( 27.654 -15.326 -1.126) 31.637 12.545 ( -2.820 2.871 0.314) 4.036 12.961 ( 4.225 -5.557 0.562) 7.003 15.225 ( -34.120 26.375 3.714) 43.285 15.800 ( -30.200 13.685 -0.232) 33.157 16.753 ( -6.659 -2.950 0.373) 7.292 17.121 ( -1.467 4.229 -7.305) 8.568 26.845 ( -0.323 -0.485 0.382) 0.697 26.882 ( 0.312 -0.597 0.302) 0.739 26.938 ( -0.121 -0.515 0.006) 0.529 27.000 ( 0.989 -0.844 -1.118) 1.714 28.019 ( 0.264 0.376 1.305) 1.383 28.098 ( 1.384 0.245 -1.562) 2.102 33.732 ( 0.096 -0.367 3.103) 3.126 33.896 ( 1.315 0.050 -4.298) 4.495 34.681 ( -5.357 3.025 -1.493) 6.330 34.775 ( -1.276 1.870 2.542) 3.404 35.596 ( -2.480 2.075 3.077) 4.463 35.837 ( 1.448 0.691 -2.935) 3.345 37.176 ( -0.825 -1.438 -0.137) 1.664 37.269 ( 1.324 -1.239 0.278) 1.835 43.784 ( -28.855 23.300 0.099) 37.088 44.525 ( -22.301 14.373 -3.184) 26.722 44.744 ( 5.460 2.181 0.745) 5.927 45.159 ( -3.159 -6.315 -1.871) 7.305 45.691 ( -9.218 -0.603 1.020) 9.294 45.916 ( -7.196 -0.642 2.344) 7.595 47.068 ( -22.256 12.367 3.015) 25.639 47.630 ( -7.766 -4.736 -3.745) 9.837 50.440 ( -12.674 11.809 2.700) 17.532 51.132 ( -25.725 25.292 -7.389) 36.824 51.384 ( -25.207 9.564 -1.370) 26.995 53.465 ( -11.989 -25.175 3.508) 28.104 60.699 ( 40.024 -2.326 11.021) 41.579 62.327 ( 73.626 0.716 -16.141) 75.378 67.270 ( -24.975 -5.930 27.046) 37.288 69.545 ( -3.262 6.529 -43.359) 43.969 ======================= Grid point 319 (157/204) ======================= q-point: (-0.18 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.203 ( -14.289 -2.943 -1.794) 14.699 2.437 ( -14.524 -4.878 1.149) 15.364 2.797 ( -8.428 2.495 -5.282) 10.255 2.897 ( 6.544 -2.148 7.362) 10.081 3.038 ( -7.691 -0.301 -4.536) 8.934 3.391 ( 0.966 1.488 7.979) 8.174 3.802 ( -4.924 2.096 8.709) 10.221 4.081 ( 5.876 -1.421 -0.944) 6.119 4.154 ( 3.293 0.274 -3.121) 4.545 4.328 ( 1.345 7.320 3.575) 8.257 4.542 ( -0.533 5.549 -7.075) 9.007 4.791 ( 6.742 7.568 -4.073) 10.923 5.140 ( 5.450 1.090 2.681) 6.171 5.716 ( -12.477 6.095 0.696) 13.903 5.945 ( -5.729 -3.320 -0.863) 6.677 5.989 ( 10.429 1.276 -0.598) 10.524 6.252 ( 2.842 -0.574 -3.645) 4.658 6.484 ( 1.101 -0.615 3.030) 3.282 6.835 ( -1.863 0.965 1.300) 2.468 6.987 ( -10.995 0.361 -0.403) 11.009 7.234 ( -1.515 -7.017 -2.729) 7.680 7.341 ( -3.452 -4.531 -1.184) 5.818 7.733 ( -4.215 0.187 1.688) 4.544 7.906 ( 2.296 1.526 -1.341) 3.066 8.095 ( -3.575 0.791 0.306) 3.675 8.412 ( -0.676 1.584 5.050) 5.336 8.762 ( -7.173 1.138 -2.287) 7.614 8.872 ( -3.536 -0.464 -2.267) 4.226 11.065 ( 15.469 5.106 0.454) 16.296 12.261 ( 23.386 -12.698 -1.024) 26.630 12.490 ( 1.966 1.575 0.511) 2.570 12.980 ( -7.395 5.494 0.810) 9.248 14.394 ( -32.982 24.831 0.902) 41.294 15.140 ( -39.699 19.911 1.190) 44.428 16.768 ( -2.364 -4.363 1.250) 5.117 17.037 ( -3.472 1.057 -7.763) 8.569 26.852 ( -0.132 -0.555 0.315) 0.652 26.898 ( 0.178 -0.825 0.499) 0.980 26.948 ( 0.382 -0.638 -0.191) 0.768 27.023 ( 0.843 -0.991 -1.080) 1.691 28.018 ( 0.253 0.538 1.126) 1.273 28.106 ( 1.343 0.282 -1.370) 1.939 33.739 ( -0.290 0.186 2.201) 2.228 33.905 ( 1.394 -0.567 -3.397) 3.716 34.570 ( -5.151 2.996 -1.124) 6.064 34.725 ( -2.022 2.846 1.990) 4.019 35.538 ( -2.998 2.361 4.013) 5.538 35.830 ( 1.263 1.345 -3.693) 4.128 37.197 ( -0.228 -2.206 -0.273) 2.235 37.303 ( 0.976 -1.305 0.415) 1.682 43.010 ( -36.312 23.506 -0.699) 43.262 43.975 ( -30.218 20.487 -1.847) 36.555 44.759 ( 3.794 3.456 1.528) 5.355 45.195 ( -3.260 -3.279 -5.337) 7.062 45.626 ( -6.988 -1.755 4.630) 8.565 45.766 ( -11.956 5.616 -0.310) 13.213 46.705 ( -15.108 3.205 1.093) 15.483 47.616 ( -6.944 -4.787 -1.738) 8.612 50.074 ( -14.924 14.752 0.286) 20.986 50.544 ( -18.645 9.016 0.126) 20.711 51.138 ( -7.945 5.252 -4.212) 10.414 53.743 ( -6.355 -22.902 1.298) 23.802 61.218 ( 35.410 -5.024 12.371) 37.844 63.064 ( 67.117 2.545 -19.636) 69.977 67.095 ( -25.320 -0.862 17.196) 30.619 69.235 ( -13.086 8.558 -33.921) 37.352 ======================= Grid point 320 (158/204) ======================= q-point: (-0.09 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.062 ( -15.099 -0.487 -2.201) 15.266 2.320 ( -11.907 -1.427 4.220) 12.713 2.669 ( -5.148 0.704 -5.701) 7.713 2.948 ( -5.711 -0.429 -5.619) 8.023 3.105 ( 6.808 -9.597 9.448) 15.090 3.437 ( 6.286 -0.136 4.115) 7.514 3.608 ( -7.723 9.147 6.146) 13.457 4.182 ( 0.428 -1.207 -3.191) 3.438 4.238 ( 6.967 0.733 -0.612) 7.032 4.245 ( 0.812 2.484 4.463) 5.172 4.462 ( -3.055 0.737 -4.304) 5.329 4.764 ( 7.336 4.900 -2.214) 9.096 5.197 ( 5.106 0.266 0.680) 5.158 5.424 ( -14.447 7.448 -2.265) 16.411 5.952 ( 0.305 -0.531 0.051) 0.615 6.078 ( 1.970 -1.926 0.043) 2.755 6.273 ( 1.603 -0.544 -3.954) 4.301 6.501 ( 0.409 0.646 2.487) 2.602 6.809 ( -0.199 1.138 0.204) 1.174 6.883 ( -7.044 -0.859 0.893) 7.152 7.325 ( 0.138 -5.107 -1.129) 5.232 7.391 ( -0.015 -3.958 -1.093) 4.106 7.663 ( -5.947 -0.203 2.961) 6.646 7.901 ( -0.666 2.205 -1.886) 2.977 8.120 ( 3.389 -3.850 -0.569) 5.160 8.392 ( -0.208 2.073 3.737) 4.279 8.667 ( -3.924 1.514 -2.341) 4.813 8.847 ( -4.091 -2.273 -1.209) 4.834 11.138 ( 10.878 5.064 0.086) 11.999 12.361 ( -8.848 11.215 -0.962) 14.318 12.463 ( -9.494 9.387 1.363) 13.421 12.946 ( 22.961 -13.530 0.522) 26.656 13.953 ( -10.334 5.312 0.439) 11.628 14.379 ( -37.130 19.639 0.353) 42.006 16.817 ( -2.758 -4.701 2.305) 5.917 16.967 ( -6.061 -1.126 -7.777) 9.924 26.860 ( 0.035 -0.532 0.166) 0.558 26.910 ( -0.311 -0.605 0.768) 1.026 26.964 ( 0.768 -0.524 -0.262) 0.966 27.041 ( 0.498 -0.705 -1.121) 1.415 28.014 ( 0.174 0.537 0.964) 1.117 28.112 ( 1.000 0.325 -1.167) 1.570 33.731 ( -0.517 0.632 1.179) 1.435 33.930 ( 1.504 -1.284 -2.459) 3.155 34.478 ( -3.635 2.202 -0.310) 4.261 34.659 ( -2.477 2.502 1.054) 3.675 35.486 ( -3.018 1.082 5.285) 6.182 35.807 ( 1.066 1.933 -4.606) 5.107 37.233 ( 0.337 -2.251 -0.256) 2.291 37.328 ( 0.241 -0.780 0.181) 0.836 42.436 ( -19.450 5.907 -0.200) 20.328 43.238 ( -31.869 24.931 -1.884) 40.506 44.736 ( 1.330 3.507 2.613) 4.571 45.159 ( -2.801 0.745 -5.892) 6.567 45.549 ( -8.547 1.347 4.642) 9.819 45.654 ( -3.154 -3.548 -0.001) 4.747 46.627 ( -4.876 -4.311 -1.244) 6.626 47.611 ( -5.673 -4.170 -0.690) 7.075 49.773 ( -8.933 5.697 0.264) 10.598 50.348 ( -5.161 2.499 0.044) 5.734 50.987 ( -7.822 2.003 -3.114) 8.654 54.004 ( -0.151 -15.058 -0.061) 15.059 61.636 ( 13.032 -7.235 14.906) 21.080 63.581 ( 45.139 8.577 -26.410) 52.996 66.845 ( -17.525 2.549 9.407) 20.053 68.902 ( -13.014 5.159 -20.308) 24.666 ======================= Grid point 328 (159/204) ======================= q-point: (-0.36 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.298 ( -16.630 -0.000 -0.374) 16.634 2.384 ( -9.228 -0.000 7.807) 12.087 2.795 ( 1.381 0.000 -9.702) 9.800 2.867 ( -7.719 -0.000 -9.916) 12.566 3.160 ( 4.323 0.000 5.825) 7.254 3.406 ( -5.919 -0.000 7.505) 9.558 3.632 ( 3.771 0.000 13.417) 13.937 4.200 ( -2.678 -0.000 6.346) 6.888 4.241 ( -4.780 -0.000 -5.866) 7.567 4.601 ( 3.414 0.000 -10.790) 11.317 4.643 ( 5.305 0.000 6.785) 8.613 4.853 ( 13.897 0.000 -3.188) 14.258 5.458 ( 2.600 0.000 -0.557) 2.659 5.519 ( -4.965 -0.000 -1.113) 5.088 5.922 ( 9.367 0.000 -0.866) 9.407 6.145 ( 1.198 0.000 -4.561) 4.716 6.279 ( -6.864 -0.000 -3.283) 7.609 6.373 ( -0.438 -0.000 4.842) 4.862 6.919 ( -7.899 -0.000 6.093) 9.976 6.978 ( -1.750 -0.000 -1.594) 2.367 7.148 ( -7.994 -0.000 -2.257) 8.307 7.319 ( -15.791 -0.000 -3.103) 16.093 7.692 ( 6.390 0.000 -4.883) 8.042 8.094 ( -17.093 -0.000 7.061) 18.494 8.262 ( -2.873 -0.000 -2.783) 3.999 8.455 ( -9.511 -0.000 6.963) 11.788 8.790 ( -6.595 -0.000 -1.002) 6.670 8.972 ( -5.796 -0.000 -4.505) 7.341 11.208 ( 28.005 0.000 4.025) 28.293 11.342 ( 25.124 0.000 -4.169) 25.468 12.658 ( 1.635 0.000 -0.025) 1.636 12.802 ( 6.118 0.000 0.841) 6.176 15.686 ( -23.066 -0.000 11.703) 25.865 16.059 ( -19.678 -0.000 -7.791) 21.164 16.624 ( -24.029 -0.000 3.571) 24.293 17.199 ( -7.031 -0.000 -11.145) 13.178 26.837 ( -0.367 -0.000 0.338) 0.499 26.873 ( 0.149 0.000 0.070) 0.165 26.929 ( -0.089 -0.000 0.708) 0.713 26.985 ( 0.706 0.000 -1.592) 1.741 28.026 ( 0.461 0.000 1.465) 1.536 28.102 ( 1.496 0.000 -1.779) 2.324 33.725 ( 0.292 0.000 3.475) 3.487 33.900 ( 1.718 0.000 -4.639) 4.947 34.731 ( -6.442 -0.000 -3.064) 7.133 34.801 ( -1.106 -0.000 4.196) 4.339 35.630 ( -2.158 -0.000 2.238) 3.109 35.846 ( 1.191 0.000 -2.422) 2.699 37.155 ( -0.885 -0.000 0.358) 0.955 37.248 ( 1.164 0.000 -0.016) 1.164 44.220 ( -12.693 -0.000 2.522) 12.942 44.745 ( 3.019 0.000 -9.054) 9.544 44.901 ( -16.510 -0.000 -8.785) 18.702 44.965 ( -9.934 -0.000 10.078) 14.151 45.620 ( -18.636 -0.000 -0.814) 18.654 45.860 ( -8.895 -0.000 7.697) 11.763 47.380 ( -11.590 -0.000 9.584) 15.040 47.452 ( -19.031 -0.000 -12.999) 23.047 50.617 ( -15.529 -0.000 5.208) 16.378 51.434 ( -17.581 -0.000 -9.181) 19.833 51.974 ( -32.429 -0.000 -16.444) 36.359 52.783 ( -32.872 -0.000 16.818) 36.925 60.652 ( 37.152 0.000 12.562) 39.218 62.365 ( 77.938 0.000 -19.599) 80.365 67.151 ( -21.904 -0.000 32.730) 39.384 69.648 ( 0.771 0.000 -52.145) 52.151 ======================= Grid point 329 (160/204) ======================= q-point: (-0.27 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.118 ( -17.479 -1.788 1.168) 17.609 2.279 ( -15.525 -2.615 5.704) 16.745 2.765 ( -5.302 -1.846 -9.410) 10.958 2.797 ( -5.102 -3.015 -9.643) 11.319 3.168 ( -0.035 4.214 5.368) 6.825 3.407 ( 0.739 -0.939 6.881) 6.984 3.697 ( 0.483 -2.354 11.601) 11.847 4.170 ( -1.851 2.218 6.448) 7.066 4.193 ( 0.432 1.246 -3.011) 3.287 4.556 ( 3.988 6.478 -3.914) 8.555 4.697 ( 0.444 2.159 -2.542) 3.365 4.979 ( 12.093 2.214 -2.083) 12.469 5.288 ( -2.829 9.925 -0.773) 10.349 5.629 ( -1.312 -9.919 -0.303) 10.010 6.021 ( -1.316 5.848 -4.052) 7.235 6.036 ( -1.559 2.519 2.318) 3.762 6.220 ( -2.021 -2.778 -5.673) 6.632 6.413 ( 0.528 -2.744 4.855) 5.601 6.843 ( -4.927 0.491 4.069) 6.409 6.997 ( -5.525 -6.546 -3.924) 9.422 7.039 ( -7.096 2.950 -0.786) 7.725 7.189 ( -9.400 -4.789 -1.690) 10.684 7.747 ( 3.628 0.771 -3.949) 5.417 7.915 ( -13.129 -0.504 5.210) 14.134 8.185 ( -3.952 4.046 -1.683) 5.900 8.406 ( -4.999 -2.324 6.298) 8.370 8.728 ( -7.166 -1.480 -1.244) 7.422 8.876 ( -7.889 0.456 -3.850) 8.790 11.358 ( 25.340 12.925 0.918) 28.461 11.813 ( 27.072 -15.139 -1.084) 31.036 12.636 ( 4.895 5.854 0.682) 7.662 12.942 ( 7.769 -4.848 0.420) 9.167 15.244 ( -33.018 21.434 8.537) 40.280 15.655 ( -31.525 13.384 -3.258) 34.404 16.464 ( -22.149 -12.745 4.039) 25.872 17.057 ( -11.148 -0.192 -15.290) 18.923 26.837 ( -0.154 -0.314 0.308) 0.466 26.878 ( 0.162 -0.370 0.173) 0.440 26.933 ( 0.049 -0.271 0.526) 0.594 26.994 ( 0.656 -0.648 -1.564) 1.815 28.033 ( 0.622 0.328 1.457) 1.617 28.115 ( 1.662 0.198 -1.825) 2.476 33.738 ( 0.381 -0.137 3.203) 3.228 33.907 ( 1.896 0.341 -4.351) 4.758 34.636 ( -7.292 1.169 -2.592) 7.827 34.784 ( -2.324 0.949 3.538) 4.338 35.601 ( -2.317 1.276 2.340) 3.532 35.850 ( 0.864 0.137 -2.716) 2.854 37.151 ( -0.854 -0.707 0.371) 1.169 37.267 ( 1.120 -0.797 0.290) 1.405 43.831 ( -28.897 23.876 1.134) 37.501 44.482 ( -22.425 12.994 -4.795) 26.358 44.800 ( 1.726 -1.579 -3.360) 4.094 44.967 ( -9.404 -9.950 0.619) 13.705 45.504 ( -11.737 -6.389 -0.953) 13.397 45.779 ( -12.597 -2.282 8.250) 15.230 46.993 ( -26.015 14.002 -4.600) 29.899 47.390 ( -14.602 -10.054 -0.986) 17.756 50.430 ( -12.642 4.646 3.721) 13.973 51.127 ( -35.282 8.425 2.931) 36.392 51.280 ( -18.894 26.602 -19.506) 38.015 52.827 ( -22.678 -35.772 8.139) 43.130 61.091 ( 30.769 -2.669 12.823) 33.441 63.173 ( 77.561 3.084 -23.175) 81.008 67.025 ( -17.395 -2.325 26.400) 31.701 69.448 ( -9.131 4.252 -53.527) 54.467 ======================= Grid point 330 (161/204) ======================= q-point: (-0.18 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.974 ( -16.984 -3.885 2.815) 17.649 2.165 ( -18.079 -6.373 2.764) 19.368 2.679 ( -10.943 -0.995 -8.839) 14.102 2.775 ( -8.137 -5.739 -9.163) 13.532 3.088 ( 0.801 5.524 7.467) 9.323 3.462 ( 5.427 0.374 5.522) 7.751 3.763 ( -5.023 -4.245 8.874) 11.045 4.122 ( -0.843 3.369 3.804) 5.151 4.207 ( 5.882 0.903 -1.107) 6.053 4.481 ( 2.919 8.755 2.489) 9.559 4.572 ( -5.330 5.425 -7.512) 10.689 5.007 ( 9.146 8.355 -4.510) 13.183 5.215 ( 2.843 0.766 2.701) 3.996 5.679 ( -14.051 8.425 -1.125) 16.422 5.777 ( -7.533 -8.922 0.592) 11.692 6.079 ( 0.137 1.162 -0.764) 1.398 6.249 ( 2.284 -2.174 -6.342) 7.083 6.477 ( 1.008 -2.371 4.996) 5.622 6.816 ( -2.246 -0.805 3.904) 4.575 6.886 ( -8.513 1.688 -1.296) 8.775 7.087 ( -0.034 -8.613 -4.421) 9.681 7.224 ( -1.143 -6.072 -1.106) 6.277 7.676 ( -8.019 1.630 2.238) 8.484 7.920 ( 2.741 -3.266 -1.755) 4.611 8.073 ( -4.495 2.919 -0.141) 5.361 8.423 ( -0.945 -1.787 5.261) 5.636 8.653 ( -8.749 -1.281 -1.937) 9.051 8.783 ( -7.687 -0.891 -2.640) 8.176 11.421 ( 20.255 12.649 0.402) 23.884 12.326 ( 23.401 -13.271 -0.674) 26.911 12.636 ( 12.410 5.199 1.015) 13.493 13.010 ( -2.251 6.284 0.587) 6.701 14.423 ( -35.093 28.231 2.685) 45.120 14.990 ( -40.228 18.905 0.419) 44.451 16.474 ( -20.264 -16.308 4.356) 26.373 16.912 ( -13.042 -3.687 -16.119) 21.060 26.843 ( 0.015 -0.491 0.264) 0.558 26.888 ( 0.029 -0.675 0.308) 0.742 26.943 ( 0.562 -0.647 0.200) 0.880 27.011 ( 0.477 -1.079 -1.401) 1.831 28.036 ( 0.668 0.701 1.306) 1.626 28.124 ( 1.613 0.403 -1.661) 2.350 33.748 ( 0.194 0.270 2.467) 2.490 33.912 ( 1.798 0.315 -3.603) 4.039 34.529 ( -7.124 1.193 -1.880) 7.464 34.736 ( -3.488 1.957 2.660) 4.804 35.549 ( -3.014 2.414 3.046) 4.918 35.847 ( 0.732 0.522 -3.447) 3.563 37.163 ( -0.436 -1.825 0.326) 1.904 37.295 ( 0.759 -1.164 0.463) 1.464 42.986 ( -38.713 28.823 -0.814) 48.272 43.960 ( -27.625 20.235 -2.567) 34.339 44.808 ( -4.242 -1.338 2.026) 4.887 45.047 ( -2.227 -8.653 -7.023) 11.365 45.480 ( -9.745 -4.634 0.399) 10.798 45.657 ( -15.828 -0.053 6.456) 17.094 46.515 ( -24.341 3.589 -5.459) 25.202 47.389 ( -13.167 -10.397 -0.513) 16.785 50.140 ( -16.710 16.465 1.307) 23.495 50.494 ( -16.390 10.992 -2.013) 19.837 50.963 ( -19.982 -1.545 -5.700) 20.836 53.238 ( -9.357 -37.307 1.122) 38.479 61.445 ( 14.588 -4.936 13.093) 20.214 63.847 ( 65.509 8.027 -28.357) 71.833 66.923 ( -12.054 1.571 16.556) 20.539 69.077 ( -19.273 6.191 -44.385) 48.784 ======================= Grid point 331 (162/204) ======================= q-point: (-0.09 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.856 ( -16.006 -3.575 3.993) 16.879 2.086 ( -17.129 -8.301 5.039) 19.690 2.561 ( -7.376 -2.443 -9.490) 12.265 2.714 ( -13.684 -6.591 -10.872) 18.679 3.144 ( 7.372 -3.969 8.043) 11.610 3.536 ( 6.645 0.788 5.029) 8.371 3.681 ( -8.614 6.531 7.063) 12.913 4.095 ( -5.073 -2.978 -2.806) 6.518 4.276 ( 5.703 -0.114 -0.344) 5.714 4.355 ( -3.462 6.372 7.223) 10.235 4.477 ( 2.900 4.513 -4.611) 7.073 4.954 ( 6.309 8.344 -2.195) 10.688 5.236 ( -0.737 1.078 -0.579) 1.429 5.392 ( -8.126 5.347 -2.063) 9.943 5.880 ( -3.646 -8.964 0.803) 9.710 5.998 ( -11.161 0.001 -1.366) 11.244 6.286 ( 3.525 0.057 -6.131) 7.072 6.511 ( -0.729 -0.022 4.461) 4.520 6.797 ( -3.358 1.030 -1.097) 3.680 6.836 ( 0.976 -1.572 3.696) 4.133 7.224 ( 1.160 -7.957 -1.905) 8.263 7.308 ( 0.442 -5.190 -1.991) 5.577 7.592 ( -5.602 -0.655 1.816) 5.926 7.921 ( -1.944 3.331 -0.984) 3.981 8.071 ( -0.012 -4.719 -0.550) 4.751 8.424 ( -1.939 2.037 2.988) 4.103 8.624 ( -0.789 -4.242 -0.703) 4.372 8.715 ( -8.425 -2.741 -1.632) 9.009 11.425 ( 14.272 12.051 0.255) 18.681 12.479 ( -26.500 25.242 0.128) 36.598 12.594 ( 16.957 5.842 0.179) 17.936 12.980 ( 22.027 -15.277 0.928) 26.822 13.934 ( -9.744 7.055 0.394) 12.036 14.251 ( -35.481 16.929 0.199) 39.313 16.488 ( -23.437 -15.740 1.645) 28.280 16.806 ( -13.772 -6.613 -11.438) 19.085 26.853 ( 0.130 -0.561 0.167) 0.600 26.898 ( -0.371 -0.650 0.543) 0.925 26.964 ( 0.964 -0.707 -0.007) 1.195 27.028 ( 0.173 -1.053 -1.327) 1.703 28.033 ( 0.613 0.956 1.110) 1.588 28.129 ( 1.288 0.657 -1.400) 2.013 33.744 ( 0.122 0.941 1.396) 1.688 33.928 ( 1.841 -0.633 -2.443) 3.123 34.441 ( -5.689 0.163 -1.185) 5.814 34.660 ( -4.637 2.500 1.695) 5.534 35.482 ( -3.712 1.980 4.430) 6.109 35.832 ( 0.575 1.318 -4.462) 4.688 37.199 ( 0.271 -2.726 0.315) 2.758 37.316 ( -0.043 -0.860 0.264) 0.901 42.310 ( -22.196 8.641 -0.435) 23.823 43.259 ( -29.658 23.523 -2.210) 37.918 44.769 ( -5.474 -0.296 3.654) 6.588 45.102 ( -0.656 -2.543 -9.040) 9.414 45.413 ( -12.944 -4.489 4.425) 14.397 45.541 ( -7.465 -2.344 0.534) 7.843 46.371 ( -15.175 -11.950 -4.434) 19.818 47.411 ( -10.913 -10.209 -0.196) 14.945 49.760 ( -11.500 7.582 0.134) 13.775 50.330 ( -3.513 1.631 -0.310) 3.885 50.778 ( -18.588 -3.851 -3.731) 19.346 53.705 ( -1.391 -30.081 -2.601) 30.225 61.580 ( -10.194 -3.887 12.564) 16.640 64.141 ( 28.915 18.180 -35.644) 49.367 66.817 ( 0.576 3.536 9.195) 9.868 68.726 ( -16.052 -0.127 -24.656) 29.421 ======================= Grid point 340 (163/204) ======================= q-point: (-0.27 -0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.902 ( -19.053 -0.000 4.147) 19.499 2.072 ( -19.935 -0.000 5.147) 20.589 2.632 ( -10.951 -0.000 -10.233) 14.988 2.684 ( -6.192 -0.000 -11.469) 13.034 3.220 ( 0.437 0.000 4.546) 4.567 3.456 ( 6.098 0.000 3.941) 7.260 3.656 ( -9.149 -0.000 11.815) 14.944 4.191 ( -0.716 -0.000 8.970) 8.998 4.229 ( 5.425 0.000 -0.353) 5.436 4.620 ( 1.174 0.000 -9.806) 9.876 4.739 ( 0.936 0.000 4.511) 4.607 5.107 ( 8.277 0.000 -1.976) 8.509 5.321 ( -7.995 -0.000 -6.739) 10.456 5.499 ( -0.413 -0.000 2.226) 2.264 5.974 ( -18.642 -0.000 -0.388) 18.646 6.002 ( -13.419 -0.000 -1.478) 13.501 6.185 ( 11.791 0.000 -4.780) 12.723 6.426 ( 2.426 0.000 4.676) 5.268 6.812 ( -3.255 -0.000 4.836) 5.829 6.873 ( -3.078 -0.000 -5.109) 5.964 7.002 ( -8.725 -0.000 -1.422) 8.840 7.076 ( 2.249 0.000 -0.856) 2.407 7.757 ( -12.535 -0.000 6.030) 13.910 7.802 ( 4.185 0.000 -5.122) 6.615 8.173 ( -4.275 -0.000 -3.396) 5.460 8.326 ( -5.436 -0.000 7.716) 9.439 8.656 ( -4.770 -0.000 -0.640) 4.812 8.767 ( -9.827 -0.000 -3.811) 10.540 11.845 ( 24.098 0.000 4.821) 24.576 11.881 ( 23.421 0.000 -4.961) 23.940 12.766 ( 7.822 0.000 2.259) 8.142 13.035 ( 15.927 0.000 -0.959) 15.956 15.072 ( -36.308 -0.000 13.083) 38.593 15.450 ( -30.951 -0.000 -7.267) 31.793 16.000 ( -33.643 -0.000 8.094) 34.603 16.813 ( -21.534 -0.000 -24.804) 32.848 26.835 ( 0.108 0.000 0.256) 0.278 26.877 ( 0.106 0.000 0.102) 0.147 26.933 ( 0.093 0.000 0.834) 0.839 26.991 ( 0.483 0.000 -1.884) 1.944 28.048 ( 0.829 0.000 1.586) 1.790 28.131 ( 1.825 0.000 -2.038) 2.736 33.750 ( 0.533 0.000 3.099) 3.144 33.925 ( 2.393 0.000 -4.362) 4.975 34.548 ( -8.494 -0.000 -2.326) 8.807 34.766 ( -3.561 -0.000 3.168) 4.767 35.593 ( -1.966 -0.000 1.954) 2.772 35.850 ( 0.182 0.000 -2.909) 2.914 37.136 ( -1.107 -0.000 0.819) 1.377 37.273 ( 0.997 0.000 0.399) 1.073 43.755 ( -31.837 -0.000 4.923) 32.216 44.273 ( -30.305 -0.000 -11.882) 32.551 44.662 ( -17.443 -0.000 10.461) 20.340 44.791 ( 0.147 0.000 -16.022) 16.022 45.355 ( -5.076 -0.000 2.786) 5.791 45.632 ( -14.483 -0.000 8.251) 16.668 46.842 ( -27.701 -0.000 -18.488) 33.304 47.042 ( -22.381 -0.000 9.297) 24.235 50.343 ( -9.760 -0.000 3.400) 10.335 50.845 ( -24.074 -0.000 2.005) 24.158 51.380 ( -18.294 -0.000 -38.618) 42.732 52.047 ( -41.366 -0.000 25.268) 48.472 61.364 ( 16.265 0.000 11.960) 20.189 63.989 ( 72.659 0.000 -30.965) 78.982 66.939 ( -6.229 -0.000 23.530) 24.341 69.198 ( -17.855 -0.000 -62.242) 64.753 ======================= Grid point 341 (164/204) ======================= q-point: (-0.18 -0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( -18.650 -3.375 7.099) 20.238 1.873 ( -21.503 -3.486 4.860) 22.319 2.490 ( -12.974 -2.423 -11.465) 17.483 2.589 ( -9.549 -1.989 -12.177) 15.602 3.189 ( -0.233 5.100 5.215) 7.298 3.525 ( -1.198 -2.618 2.084) 3.554 3.595 ( -8.627 -4.314 9.753) 13.717 4.188 ( 0.012 3.341 8.761) 9.376 4.308 ( 8.795 1.121 1.521) 8.995 4.561 ( -5.251 3.438 -8.287) 10.395 4.657 ( 0.962 9.295 3.007) 9.816 5.171 ( 2.136 -0.642 -0.346) 2.257 5.223 ( 0.459 2.607 -5.783) 6.360 5.527 ( -14.915 -4.134 2.283) 15.644 5.652 ( -10.496 4.462 -1.708) 11.532 5.925 ( -15.827 -6.447 -1.961) 17.201 6.287 ( 8.280 0.845 -5.218) 9.823 6.476 ( 1.925 -1.655 4.654) 5.301 6.792 ( -1.492 0.039 2.556) 2.959 6.866 ( 0.570 1.176 0.483) 1.393 6.971 ( 0.891 -5.330 -3.246) 6.303 7.150 ( 3.433 -4.469 -2.139) 6.028 7.630 ( -6.952 2.693 3.997) 8.459 7.867 ( 0.955 -5.034 -2.658) 5.772 8.081 ( -3.595 3.851 -1.831) 5.577 8.346 ( -2.832 -5.713 5.872) 8.668 8.577 ( -6.018 2.531 -1.619) 6.726 8.668 ( -8.044 -1.709 -2.386) 8.563 11.857 ( 17.655 15.734 0.285) 23.650 12.355 ( 21.099 -15.999 -0.276) 26.481 12.851 ( 10.878 2.759 3.978) 11.906 13.179 ( 12.729 9.219 -2.348) 15.891 14.457 ( -37.270 25.037 7.234) 45.478 14.831 ( -39.124 19.659 -2.288) 43.845 15.878 ( -32.785 -23.201 7.143) 40.794 16.523 ( -29.224 -9.436 -29.638) 42.679 26.840 ( 0.280 -0.234 0.204) 0.418 26.881 ( -0.055 -0.363 0.103) 0.382 26.941 ( 0.483 -0.554 0.696) 1.012 26.997 ( 0.308 -0.722 -1.814) 1.977 28.058 ( 0.906 0.491 1.549) 1.861 28.145 ( 1.803 0.290 -1.996) 2.705 33.762 ( 0.600 0.188 2.634) 2.708 33.936 ( 2.372 0.769 -4.027) 4.736 34.444 ( -8.657 0.072 -1.610) 8.806 34.719 ( -4.707 1.009 2.372) 5.367 35.559 ( -2.413 2.069 2.077) 3.797 35.844 ( -0.119 -0.298 -3.592) 3.606 37.133 ( -1.012 -1.153 1.096) 1.885 37.290 ( 0.669 -0.633 0.483) 1.040 43.021 ( -39.514 32.558 0.189) 51.200 43.910 ( -28.112 9.639 -5.675) 30.256 44.519 ( -22.629 -9.821 3.300) 24.889 44.871 ( -1.405 -13.908 -17.749) 22.593 45.334 ( -5.179 -1.201 2.769) 5.995 45.480 ( -16.508 -0.734 8.665) 18.658 46.316 ( -27.228 11.917 -11.458) 31.854 46.981 ( -22.676 -17.263 2.065) 28.574 50.194 ( -12.488 10.817 2.974) 16.787 50.516 ( -17.842 16.653 -3.135) 24.606 50.740 ( -20.270 7.504 -12.345) 24.891 52.283 ( -31.669 -57.156 2.544) 65.393 61.498 ( 0.324 -1.330 9.710) 9.806 64.580 ( 54.196 8.458 -41.482) 68.772 66.953 ( 2.630 3.299 16.917) 17.435 68.769 ( -26.745 2.313 -56.365) 62.431 ======================= Grid point 342 (165/204) ======================= q-point: (-0.09 -0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.621 ( -16.416 -5.327 10.139) 20.016 1.745 ( -20.073 -9.558 7.108) 23.341 2.377 ( -11.140 -5.184 -13.452) 18.219 2.468 ( -10.972 -2.422 -12.666) 16.932 3.148 ( -3.165 -2.405 6.105) 7.285 3.517 ( -14.379 -8.324 0.810) 16.634 3.623 ( 1.673 1.005 7.584) 7.831 4.092 ( -3.935 8.484 1.409) 9.458 4.324 ( -1.620 2.747 -0.213) 3.197 4.472 ( 7.820 4.286 5.711) 10.590 4.585 ( 2.297 5.160 -0.304) 5.656 5.076 ( -7.496 6.378 0.476) 9.854 5.237 ( 2.024 -0.816 -3.966) 4.527 5.341 ( -9.318 -0.682 -3.588) 10.008 5.616 ( -13.973 -6.161 0.261) 15.273 5.867 ( -6.048 -4.389 -2.044) 7.747 6.324 ( 4.143 1.138 -5.915) 7.311 6.514 ( -0.726 0.016 4.742) 4.798 6.789 ( 0.398 0.309 0.547) 0.744 6.872 ( 4.083 1.549 2.779) 5.176 7.107 ( 2.005 -8.613 -1.822) 9.029 7.257 ( 4.155 -4.185 -3.236) 6.727 7.543 ( -4.254 1.300 2.273) 4.996 7.935 ( -1.110 -1.974 0.517) 2.323 8.002 ( -2.296 0.704 -1.936) 3.085 8.416 ( -3.950 -0.817 4.263) 5.869 8.510 ( -1.472 -5.799 -1.682) 6.215 8.617 ( -3.593 -1.914 -1.262) 4.262 11.788 ( 12.874 14.940 0.578) 19.730 12.566 ( -29.587 27.778 1.860) 40.626 12.874 ( 18.915 -7.791 -1.882) 20.543 13.050 ( 19.919 2.999 1.166) 20.177 13.956 ( -11.161 11.036 -0.194) 15.697 14.114 ( -28.924 12.693 0.311) 31.588 15.864 ( -35.799 -22.126 0.859) 42.094 16.337 ( -31.384 -18.551 -20.615) 41.881 26.848 ( 0.331 -0.379 0.130) 0.520 26.886 ( -0.363 -0.533 0.269) 0.699 26.963 ( 0.947 -0.893 0.408) 1.364 27.009 ( 0.065 -1.060 -1.652) 1.964 28.060 ( 0.852 0.990 1.363) 1.888 28.152 ( 1.531 0.689 -1.720) 2.403 33.767 ( 0.860 0.872 1.729) 2.119 33.942 ( 2.146 0.391 -2.845) 3.585 34.356 ( -7.449 -1.059 -1.041) 7.596 34.639 ( -6.182 2.143 1.373) 6.686 35.486 ( -4.088 3.032 3.365) 6.101 35.836 ( -0.091 0.184 -4.744) 4.748 37.158 ( -0.275 -2.722 1.177) 2.978 37.304 ( -0.160 -0.586 0.207) 0.641 42.215 ( -26.252 15.193 -1.187) 30.355 43.278 ( -29.010 22.333 -3.081) 36.740 44.482 ( -24.326 -17.960 1.067) 30.257 45.004 ( -2.530 -9.437 -18.599) 21.009 45.245 ( -7.686 0.519 4.100) 8.727 45.398 ( -9.164 -4.541 3.195) 10.715 46.011 ( -16.040 -6.440 -4.788) 17.936 47.026 ( -19.704 -18.951 0.198) 27.339 49.753 ( -15.412 11.502 -0.346) 19.234 50.319 ( -2.179 1.155 -1.221) 2.752 50.541 ( -13.338 -1.476 -3.794) 13.945 52.848 ( -30.408 -59.472 -7.852) 67.255 61.433 ( -14.882 2.320 6.573) 16.433 64.567 ( 2.501 25.924 -51.988) 58.147 66.990 ( 13.941 4.143 10.410) 17.886 68.423 ( -17.077 -6.594 -28.605) 33.961 ======================= Grid point 352 (166/204) ======================= q-point: (-0.18 -0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.507 ( -18.732 -0.000 11.687) 22.079 1.611 ( -22.520 -0.000 7.320) 23.679 2.289 ( -13.814 -0.000 -11.943) 18.261 2.437 ( -9.496 -0.000 -14.893) 17.663 3.227 ( -32.128 -0.000 11.011) 33.963 3.267 ( 2.588 0.000 -0.901) 2.740 3.633 ( 4.654 0.000 4.560) 6.516 4.241 ( 0.029 0.000 9.441) 9.441 4.388 ( -2.141 -0.000 -8.313) 8.584 4.545 ( 4.660 0.000 2.224) 5.164 4.748 ( -0.771 -0.000 3.083) 3.178 5.074 ( -6.207 -0.000 -3.110) 6.942 5.245 ( -6.852 -0.000 -2.818) 7.409 5.365 ( -13.274 -0.000 2.753) 13.556 5.543 ( -8.659 -0.000 -3.533) 9.352 5.720 ( -6.267 -0.000 -1.299) 6.400 6.377 ( 6.604 0.000 -6.163) 9.033 6.485 ( 0.824 0.000 4.395) 4.471 6.795 ( -0.073 -0.000 2.465) 2.466 6.895 ( 4.466 0.000 -1.922) 4.862 6.968 ( 4.842 0.000 1.082) 4.961 7.156 ( 5.238 0.000 -3.463) 6.279 7.616 ( -2.616 -0.000 6.674) 7.169 7.800 ( -2.612 -0.000 -3.666) 4.501 8.080 ( -1.567 -0.000 -3.540) 3.871 8.277 ( -2.157 -0.000 6.241) 6.603 8.536 ( -8.374 -0.000 -3.386) 9.032 8.565 ( -3.326 -0.000 0.504) 3.364 12.299 ( 15.970 0.000 5.036) 16.745 12.303 ( 16.373 0.000 -4.918) 17.096 12.982 ( 5.028 0.000 8.485) 9.863 13.471 ( 20.467 0.000 -7.061) 21.650 14.269 ( -35.901 -0.000 10.642) 37.445 14.647 ( -36.017 -0.000 -7.289) 36.747 15.200 ( -41.603 -0.000 11.480) 43.158 15.874 ( -51.644 -0.000 -46.342) 69.388 26.843 ( 0.461 0.000 0.133) 0.479 26.876 ( -0.290 -0.000 -0.082) 0.302 26.943 ( 0.432 0.000 0.940) 1.034 26.991 ( 0.369 0.000 -1.882) 1.918 28.076 ( 0.981 0.000 1.708) 1.969 28.163 ( 1.853 0.000 -2.134) 2.826 33.780 ( 1.098 0.000 2.547) 2.774 33.963 ( 2.688 0.000 -4.485) 5.228 34.339 ( -9.280 -0.000 -0.820) 9.316 34.674 ( -5.588 -0.000 1.562) 5.802 35.560 ( -1.905 -0.000 0.931) 2.121 35.823 ( -1.073 -0.000 -4.112) 4.250 37.113 ( -1.408 -0.000 1.794) 2.281 37.293 ( 0.487 0.000 0.412) 0.637 42.976 ( -34.908 -0.000 6.884) 35.581 43.456 ( -36.002 -0.000 -17.096) 39.855 44.379 ( -14.056 -0.000 10.895) 17.784 44.393 ( -34.358 -0.000 -41.224) 53.665 45.307 ( -16.033 -0.000 8.235) 18.024 45.318 ( -1.839 -0.000 5.746) 6.034 46.162 ( -19.887 -0.000 -17.064) 26.204 46.459 ( -34.044 -0.000 10.875) 35.739 50.193 ( -6.976 -0.000 4.675) 8.398 50.484 ( -11.152 -0.000 -0.321) 11.156 50.620 ( -31.170 -0.000 -38.849) 49.808 51.171 ( -45.271 -0.000 23.493) 51.004 61.475 ( -6.008 -0.000 4.944) 7.781 65.016 ( 25.822 0.000 -62.125) 67.278 67.111 ( 10.913 0.000 16.549) 19.824 68.310 ( -29.592 -0.000 -54.704) 62.195 ======================= Grid point 353 (167/204) ======================= q-point: (-0.09 -0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 364 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.386 ( -15.412 -5.427 16.403) 23.153 1.418 ( -21.258 -4.714 11.137) 24.458 2.131 ( -13.999 -3.559 -12.342) 18.999 2.309 ( -7.228 -1.323 -16.289) 17.870 2.899 ( -32.994 -6.260 11.575) 35.521 3.317 ( -0.034 -3.458 -5.126) 6.183 3.666 ( -0.343 1.181 5.654) 5.786 4.168 ( -6.760 6.791 -4.249) 10.482 4.291 ( -5.827 -1.727 -1.746) 6.323 4.651 ( 3.620 3.894 8.911) 10.377 4.692 ( 6.007 5.454 4.561) 9.308 4.966 ( -16.494 -1.646 -2.244) 16.727 5.141 ( -6.301 0.857 0.158) 6.361 5.256 ( -4.964 -2.366 -1.198) 5.628 5.511 ( 0.884 0.663 -3.997) 4.147 5.731 ( -2.228 -6.289 -0.829) 6.724 6.386 ( 3.248 2.986 -5.506) 7.056 6.509 ( -1.415 -0.533 2.606) 3.013 6.811 ( 2.229 -0.160 1.520) 2.703 6.956 ( 3.929 -0.090 0.609) 3.977 7.042 ( 5.869 -1.976 -0.317) 6.201 7.246 ( 6.068 -3.813 -3.961) 8.188 7.563 ( -1.792 5.363 4.242) 7.069 7.831 ( -2.984 -6.641 0.411) 7.292 8.039 ( 1.428 3.469 -2.391) 4.448 8.323 ( -3.462 -5.149 4.961) 7.944 8.449 ( -2.023 -0.723 -3.023) 3.708 8.554 ( -0.855 -2.743 0.676) 2.952 12.176 ( 11.236 18.518 0.750) 21.673 12.671 ( -29.750 27.522 4.959) 40.831 12.822 ( 12.864 -16.307 -0.627) 20.780 13.398 ( 9.024 13.041 -6.284) 17.058 13.973 ( -33.242 20.018 -2.229) 38.868 14.037 ( 1.754 -0.194 0.760) 1.921 15.045 ( -45.055 -24.010 -0.802) 51.059 15.374 ( -57.860 -34.505 -33.199) 75.103 26.849 ( 0.424 -0.120 0.050) 0.444 26.874 ( -0.525 -0.444 -0.055) 0.690 26.959 ( 0.633 -0.952 0.823) 1.409 26.995 ( 0.436 -0.474 -1.666) 1.786 28.086 ( 0.893 0.647 1.658) 1.991 28.175 ( 1.691 0.464 -1.950) 2.622 33.798 ( 1.948 0.539 2.081) 2.901 33.971 ( 2.324 0.998 -3.858) 4.613 34.245 ( -8.383 -1.304 -0.276) 8.488 34.594 ( -7.371 1.658 0.170) 7.557 35.498 ( -4.410 3.714 1.376) 5.928 35.810 ( -1.017 -1.132 -5.351) 5.563 37.118 ( -0.937 -1.994 2.110) 3.051 37.296 ( -0.366 -0.080 -0.132) 0.397 42.196 ( -32.486 26.695 -4.037) 42.240 43.225 ( -27.601 6.363 -5.177) 28.794 43.729 ( -44.693 -22.084 -23.034) 54.915 44.566 ( -16.851 -28.544 -12.537) 35.439 45.185 ( -8.890 -1.837 6.070) 10.920 45.295 ( -4.212 0.771 4.942) 6.538 45.843 ( -12.543 5.283 -2.119) 13.774 46.378 ( -30.328 -25.959 1.545) 39.951 49.767 ( -21.132 17.385 -2.426) 27.472 50.284 ( -4.831 -2.916 -5.273) 7.723 50.417 ( -6.284 0.375 -1.981) 6.600 51.328 ( -51.560 -62.038 -2.367) 80.702 61.373 ( -7.462 4.629 1.082) 8.847 64.637 ( -37.352 22.947 -74.194) 86.177 67.252 ( 15.655 2.756 12.260) 20.074 68.056 ( -8.818 -10.437 -25.758) 29.158 ======================= Grid point 364 (168/204) ======================= q-point: (-0.09 -0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.188 ( -18.880 -0.000 16.305) 24.946 1.230 ( -11.737 -0.000 23.103) 25.913 1.893 ( -20.597 -0.000 -2.461) 20.744 2.193 ( -2.951 -0.000 -19.532) 19.753 2.473 ( -31.405 -0.000 9.775) 32.891 3.291 ( 1.530 0.000 -12.964) 13.054 3.667 ( -4.164 -0.000 6.499) 7.718 4.048 ( -13.990 -0.000 -13.984) 19.780 4.235 ( -2.734 -0.000 3.737) 4.631 4.619 ( -20.346 -0.000 6.412) 21.333 4.775 ( 1.568 0.000 2.445) 2.904 4.952 ( 12.856 0.000 6.221) 14.282 5.156 ( -0.663 -0.000 3.991) 4.045 5.158 ( 0.881 0.000 0.767) 1.169 5.559 ( 4.980 0.000 -5.965) 7.770 5.636 ( -3.272 -0.000 1.380) 3.551 6.438 ( 3.059 0.000 -8.889) 9.401 6.474 ( -5.032 -0.000 2.418) 5.583 6.837 ( 2.571 0.000 1.710) 3.088 6.969 ( 1.888 0.000 -0.889) 2.086 7.149 ( 9.370 0.000 1.273) 9.456 7.269 ( 6.158 0.000 -3.848) 7.261 7.677 ( -5.871 -0.000 -2.159) 6.255 7.702 ( 5.582 0.000 6.182) 8.330 8.122 ( 8.717 0.000 -2.440) 9.052 8.243 ( -4.749 -0.000 6.289) 7.880 8.410 ( -0.223 -0.000 -3.722) 3.729 8.526 ( -0.011 -0.000 2.703) 2.703 12.590 ( 0.002 0.000 4.560) 4.560 12.705 ( 19.558 0.000 4.835) 20.147 12.723 ( -21.374 -0.000 5.933) 22.182 13.097 ( -80.321 -0.000 -49.185) 94.184 13.910 ( -38.908 -0.000 -7.487) 39.622 13.921 ( 2.838 0.000 3.012) 4.138 14.286 ( -42.163 -0.000 8.546) 43.020 14.352 ( -19.208 -0.000 -11.319) 22.295 26.853 ( 0.442 0.000 -0.093) 0.451 26.860 ( -0.963 -0.000 -0.020) 0.963 26.959 ( 0.443 0.000 1.060) 1.149 26.997 ( 0.913 0.000 -1.238) 1.538 28.105 ( 0.723 0.000 1.837) 1.974 28.194 ( 1.693 0.000 -1.935) 2.571 33.838 ( 3.457 0.000 2.320) 4.163 33.997 ( 2.374 0.000 -4.756) 5.315 34.139 ( -8.058 -0.000 0.622) 8.082 34.512 ( -10.532 -0.000 -2.610) 10.851 35.476 ( -6.661 -0.000 -0.698) 6.698 35.765 ( -1.962 -0.000 -5.728) 6.055 37.095 ( -1.019 -0.000 2.794) 2.974 37.287 ( -1.446 -0.000 -1.228) 1.897 42.173 ( -68.018 -0.000 -34.760) 76.385 42.406 ( -17.715 -0.000 6.053) 18.721 43.160 ( -34.328 -0.000 -6.392) 34.918 43.967 ( -32.750 -0.000 11.498) 34.710 45.086 ( -6.802 -0.000 4.969) 8.423 45.246 ( -8.784 -0.000 4.562) 9.898 45.745 ( -25.338 -0.000 8.382) 26.689 45.895 ( -1.737 -0.000 -8.481) 8.657 49.714 ( -27.953 -0.000 -12.772) 30.732 49.918 ( -22.618 -0.000 9.546) 24.549 50.382 ( -2.284 -0.000 -0.025) 2.284 50.499 ( -14.504 -0.000 3.691) 14.967 61.383 ( 1.723 0.000 -1.385) 2.210 63.955 ( -83.173 -0.000 -72.499) 110.336 67.433 ( 8.460 0.000 13.516) 15.945 67.920 ( 9.043 0.000 -16.714) 19.004 ======================= Grid point 365 (169/204) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.420 ( -3.382 -0.000 -11.066) 11.572 1.420 ( 3.382 0.000 11.066) 11.572 1.728 ( 2.964 0.000 -17.063) 17.319 1.728 ( -2.964 -0.000 17.063) 17.319 2.565 ( 2.168 0.000 -31.748) 31.822 2.565 ( -2.168 -0.000 31.748) 31.822 3.751 ( 0.585 0.000 -3.979) 4.022 3.751 ( -0.585 -0.000 3.979) 4.022 4.311 ( -13.035 -0.000 3.105) 13.400 4.311 ( 13.035 0.000 -3.105) 13.400 5.050 ( 2.233 0.000 -12.506) 12.704 5.050 ( -2.233 -0.000 12.506) 12.704 5.272 ( 6.684 0.000 -7.056) 9.719 5.272 ( -6.684 -0.000 7.056) 9.719 5.649 ( -2.838 -0.000 -0.445) 2.872 5.649 ( 2.838 0.000 0.445) 2.872 6.327 ( 11.409 0.000 -7.612) 13.715 6.327 ( -11.409 -0.000 7.612) 13.715 6.935 ( -1.543 -0.000 -1.781) 2.357 6.935 ( 1.543 0.000 1.781) 2.357 7.315 ( 2.726 0.000 -2.496) 3.696 7.315 ( -2.726 -0.000 2.496) 3.696 7.641 ( -9.255 -0.000 0.253) 9.259 7.641 ( 9.255 0.000 -0.253) 9.259 8.250 ( 7.815 0.000 -5.553) 9.587 8.250 ( -7.815 -0.000 5.553) 9.587 8.451 ( -9.687 -0.000 1.021) 9.741 8.451 ( 9.687 0.000 -1.021) 9.741 11.952 ( -34.492 -0.000 -0.355) 34.494 11.952 ( 34.492 0.000 0.355) 34.494 12.994 ( -20.282 -0.000 0.177) 20.282 12.994 ( 20.282 0.000 -0.177) 20.282 13.507 ( -28.178 -0.000 -0.881) 28.192 13.507 ( 28.178 0.000 0.881) 28.192 14.190 ( -3.033 -0.000 -5.924) 6.656 14.190 ( 3.033 0.000 5.924) 6.656 26.857 ( 0.100 0.000 -0.179) 0.205 26.857 ( -0.100 -0.000 0.179) 0.205 26.989 ( 0.518 0.000 -1.169) 1.279 26.989 ( -0.518 -0.000 1.169) 1.279 28.165 ( 0.318 0.000 -2.279) 2.302 28.165 ( -0.318 -0.000 2.279) 2.302 33.977 ( 3.428 0.000 -3.588) 4.962 33.977 ( -3.428 -0.000 3.588) 4.962 34.112 ( -9.208 -0.000 -2.226) 9.473 34.112 ( 9.208 0.000 2.226) 9.473 35.534 ( -1.439 -0.000 -7.970) 8.099 35.534 ( 1.439 0.000 7.970) 8.099 37.173 ( -1.003 -0.000 -3.276) 3.426 37.173 ( 1.003 0.000 3.276) 3.426 42.175 ( -29.105 -0.000 2.165) 29.185 42.175 ( 29.105 0.000 -2.165) 29.185 43.056 ( -34.882 -0.000 -4.682) 35.195 43.056 ( 34.882 0.000 4.682) 35.195 45.092 ( -2.684 -0.000 -0.772) 2.793 45.092 ( 2.684 0.000 0.772) 2.793 45.708 ( 3.943 0.000 -9.148) 9.962 45.708 ( -3.943 -0.000 9.148) 9.962 49.580 ( -15.197 -0.000 1.244) 15.248 49.580 ( 15.197 0.000 -1.244) 15.248 50.373 ( -1.389 -0.000 -0.334) 1.429 50.373 ( 1.389 0.000 0.334) 1.429 61.764 ( -35.984 -0.000 -5.908) 36.465 61.764 ( 35.984 0.000 5.908) 36.465 67.808 ( 6.768 0.000 -14.104) 15.644 67.808 ( -6.768 -0.000 14.104) 15.644 ======================= Grid point 367 (170/204) ======================= q-point: ( 0.09 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.418 ( -0.059 -5.337 -2.041) 5.714 1.539 ( 7.266 -4.634 11.129) 14.075 1.763 ( 2.487 -4.330 -11.250) 12.308 1.822 ( 4.212 -6.592 0.512) 7.839 2.678 ( 18.147 -7.842 -24.657) 31.604 2.745 ( 9.772 -7.181 27.652) 30.194 3.739 ( 0.887 1.382 -1.681) 2.349 3.822 ( 5.795 -3.850 0.088) 6.958 4.219 ( -2.625 0.775 1.898) 3.330 4.475 ( 18.260 1.407 -1.228) 18.355 4.896 ( -5.581 8.925 -7.535) 12.945 4.965 ( -3.829 8.637 7.855) 12.287 5.234 ( -8.885 -3.005 3.110) 9.882 5.349 ( -0.356 -3.683 -8.712) 9.465 5.532 ( -5.737 4.487 -2.427) 7.677 5.667 ( 4.204 0.777 0.968) 4.383 6.267 ( -4.309 -0.580 8.029) 9.131 6.451 ( 11.841 -0.036 -5.874) 13.218 6.908 ( -2.971 0.391 -0.884) 3.125 6.970 ( 1.925 -2.010 0.024) 2.783 7.227 ( -8.472 2.902 0.231) 8.958 7.300 ( -5.005 -1.243 2.058) 5.553 7.547 ( -0.649 3.471 0.698) 3.600 7.730 ( 10.380 1.372 -0.643) 10.490 8.110 ( -8.653 4.159 3.462) 10.206 8.282 ( 7.698 3.012 -3.703) 9.057 8.448 ( -6.154 -7.537 1.177) 9.801 8.584 ( 2.905 -4.176 2.301) 5.583 11.848 ( -2.164 -4.029 -1.081) 4.700 12.520 ( -13.328 14.800 0.448) 19.922 12.838 ( 55.734 -26.368 -6.780) 62.029 13.047 ( 20.676 14.068 1.678) 25.065 13.499 ( -22.558 -23.863 -0.927) 32.851 14.058 ( -2.295 -4.318 -2.374) 5.436 14.219 ( 1.066 -1.082 4.404) 4.658 14.374 ( 42.930 -34.430 -8.136) 55.629 26.859 ( -0.271 -0.426 0.012) 0.505 26.867 ( 0.574 -0.890 -0.495) 1.169 26.980 ( -1.079 0.106 1.028) 1.494 26.990 ( 0.021 -0.214 -0.846) 0.873 28.148 ( -0.968 1.126 -0.613) 1.606 28.159 ( -0.378 0.558 0.609) 0.908 33.918 ( -5.059 1.588 0.899) 5.378 33.968 ( -2.898 -0.814 -1.164) 3.228 34.109 ( 4.048 -2.080 -1.279) 4.727 34.267 ( 13.342 -0.815 3.437) 13.802 35.517 ( 0.576 -0.611 -7.080) 7.129 35.585 ( 2.706 -0.860 7.831) 8.330 37.176 ( 0.018 -1.720 -2.954) 3.419 37.212 ( 2.255 -1.253 2.847) 3.842 41.951 ( -18.843 -12.703 -8.246) 24.174 42.501 ( 23.019 -8.236 3.212) 24.658 42.990 ( -12.028 -17.565 0.991) 21.312 43.981 ( 54.599 -31.892 -10.907) 64.165 45.119 ( 4.814 -1.653 -2.261) 5.569 45.185 ( 12.035 0.361 -2.020) 12.208 45.740 ( -0.878 -5.285 -0.875) 5.428 45.869 ( 15.866 -16.133 -2.055) 22.721 49.530 ( -4.244 -3.970 -0.583) 5.841 49.964 ( 28.573 -11.248 -6.120) 31.311 50.367 ( -1.386 -0.648 -0.102) 1.533 50.542 ( 24.941 -18.244 -6.118) 31.501 61.416 ( -16.550 6.023 -0.631) 17.623 62.230 ( 47.930 5.679 17.818) 51.449 67.746 ( -15.286 -3.400 8.464) 17.801 67.891 ( 1.084 -9.476 -8.434) 12.732 ======================= Grid point 368 (171/204) ======================= q-point: ( 0.18 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.581 ( 4.935 -11.749 1.839) 12.875 1.755 ( 8.966 -7.713 -0.787) 11.853 1.859 ( 2.082 -8.592 -4.426) 9.887 2.000 ( 5.698 -9.174 1.589) 10.916 3.002 ( 18.395 -9.028 -8.477) 22.176 3.075 ( 15.194 -9.843 12.666) 22.095 3.734 ( 4.193 2.379 -3.039) 5.699 3.928 ( -0.036 -2.804 2.809) 3.969 4.248 ( 8.759 1.076 0.066) 8.825 4.639 ( 8.656 6.417 3.882) 11.453 4.697 ( 1.232 6.994 -4.652) 8.490 4.823 ( 2.686 3.906 2.584) 5.399 5.172 ( -4.788 0.240 -3.644) 6.022 5.277 ( -5.744 2.143 -4.027) 7.335 5.492 ( -0.688 -1.578 0.584) 1.817 5.744 ( 4.701 -3.429 1.503) 6.010 6.249 ( -2.883 0.184 5.605) 6.306 6.551 ( 9.208 0.962 -6.129) 11.103 6.845 ( -3.923 2.515 0.565) 4.694 7.013 ( 0.231 0.248 -2.718) 2.739 7.137 ( -4.253 -4.272 0.753) 6.075 7.273 ( -5.597 -2.219 3.792) 7.115 7.517 ( 1.660 1.501 -0.938) 2.426 7.843 ( 10.587 -0.627 -1.467) 10.707 7.980 ( -5.927 3.022 2.392) 7.070 8.333 ( 8.272 1.264 -2.075) 8.622 8.494 ( -3.345 -5.313 -0.932) 6.347 8.650 ( -2.146 -3.669 3.535) 5.529 11.898 ( 6.671 3.828 2.092) 7.971 12.116 ( -16.033 10.516 -1.917) 19.270 13.078 ( 25.199 15.893 4.097) 30.072 13.439 ( -3.209 0.363 -1.734) 3.666 13.591 ( -22.571 -22.582 -2.109) 31.998 14.084 ( -2.201 -0.963 0.560) 2.467 14.618 ( 42.351 -27.150 5.818) 50.641 15.468 ( 45.175 -36.163 -11.304) 58.960 26.862 ( -0.442 -0.487 -0.121) 0.669 26.888 ( 0.550 -0.983 -0.774) 1.367 26.973 ( -0.814 -0.260 1.423) 1.660 26.993 ( 0.016 -0.532 -0.782) 0.946 28.112 ( -1.316 1.574 -0.312) 2.075 28.144 ( -0.440 0.894 0.280) 1.035 33.844 ( -3.767 1.446 -0.077) 4.036 33.951 ( -2.236 -0.768 -0.139) 2.368 34.201 ( 5.600 -2.572 -0.550) 6.187 34.418 ( 11.085 0.136 2.645) 11.397 35.526 ( 1.778 -0.672 -6.226) 6.510 35.643 ( 2.439 -0.194 7.349) 7.745 37.203 ( -0.146 -2.492 -2.029) 3.217 37.261 ( 1.982 -1.147 1.663) 2.831 42.033 ( -9.347 -17.464 -5.592) 20.582 42.742 ( 10.695 4.614 2.571) 11.928 43.496 ( 19.643 -38.029 16.030) 45.706 44.666 ( 13.127 -14.133 -3.537) 19.611 45.184 ( 4.864 2.574 -0.661) 5.543 45.285 ( 9.678 -0.976 -2.819) 10.127 45.836 ( -0.548 -9.246 -1.487) 9.381 46.565 ( 31.917 -27.956 -9.269) 43.430 49.562 ( -0.875 -3.633 -0.420) 3.760 50.191 ( 6.823 -0.531 2.622) 7.329 50.357 ( -1.487 -0.237 -0.060) 1.507 51.800 ( 79.409 -57.535 -26.248) 101.514 61.217 ( 7.134 11.242 -3.340) 13.727 62.687 ( 45.817 11.806 26.273) 54.119 67.598 ( -24.368 -4.273 4.402) 25.129 68.075 ( -0.725 -15.510 -3.983) 16.029 ======================= Grid point 369 (172/204) ======================= q-point: ( 0.27 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.841 ( 5.398 -9.626 -5.375) 12.276 1.912 ( 6.254 -8.839 -5.165) 11.997 2.102 ( 4.752 -13.857 11.893) 18.869 2.236 ( 10.324 -9.900 -1.294) 14.362 3.265 ( 5.780 -9.255 0.459) 10.921 3.395 ( 14.731 -4.778 4.655) 16.171 3.733 ( 5.960 4.733 -3.875) 8.541 3.932 ( -0.462 -0.283 -0.971) 1.112 4.301 ( 4.466 3.473 3.237) 6.518 4.433 ( -8.171 8.555 1.657) 11.946 4.652 ( -0.005 4.409 -5.321) 6.911 4.926 ( 5.557 3.813 7.238) 9.890 5.109 ( 1.305 3.743 -4.013) 5.641 5.300 ( 5.018 -6.830 -2.027) 8.715 5.544 ( 9.969 -2.192 0.262) 10.210 5.856 ( 2.847 -4.506 1.465) 5.528 6.229 ( -2.780 -0.828 3.401) 4.470 6.587 ( 5.088 3.120 -5.269) 7.961 6.769 ( -1.960 2.476 0.928) 3.292 6.981 ( -2.267 -0.563 -3.028) 3.824 7.225 ( -1.905 -6.959 1.787) 7.433 7.273 ( -1.473 -3.398 1.835) 4.133 7.534 ( 1.864 -1.568 -0.695) 2.533 7.871 ( -1.358 4.059 2.036) 4.740 7.991 ( 8.256 -2.778 -1.813) 8.898 8.401 ( 4.512 -0.198 -0.889) 4.603 8.549 ( 2.502 -3.717 -1.837) 4.843 8.675 ( -2.757 -2.295 3.133) 4.763 11.691 ( -9.021 16.013 1.916) 18.479 12.014 ( 1.031 -2.378 -1.547) 3.018 13.039 ( -6.969 12.505 3.571) 14.755 13.259 ( 12.310 11.381 -2.449) 16.943 13.684 ( -22.909 -21.196 -1.019) 31.227 14.049 ( -3.858 -0.424 0.266) 3.891 15.566 ( 43.548 -24.370 7.041) 50.397 16.320 ( 30.072 -22.325 -8.345) 38.372 26.863 ( -0.355 -0.405 -0.219) 0.582 26.905 ( 0.422 -0.841 -0.792) 1.230 26.973 ( -0.712 -0.294 1.223) 1.445 27.005 ( 0.419 -0.837 -0.345) 0.998 28.073 ( -1.195 1.522 -0.170) 1.942 28.125 ( -0.406 0.973 0.176) 1.068 33.789 ( -2.383 1.198 -0.169) 2.672 33.939 ( -1.597 -0.555 -0.233) 1.707 34.300 ( 4.628 -2.655 0.479) 5.357 34.524 ( 8.139 0.578 1.016) 8.223 35.546 ( 2.142 -0.914 -5.972) 6.410 35.674 ( 1.286 1.026 6.752) 6.949 37.233 ( -0.604 -2.281 -1.114) 2.610 37.298 ( 1.390 -0.881 0.437) 1.703 42.199 ( -9.408 -18.720 -3.624) 21.262 42.739 ( 6.140 7.111 2.053) 9.616 44.337 ( 25.102 -24.638 15.450) 38.417 44.896 ( 4.323 -6.988 -0.835) 8.259 45.197 ( 6.061 -0.735 0.735) 6.150 45.422 ( 9.668 -2.138 -3.470) 10.492 46.030 ( 3.740 -14.539 1.471) 15.084 47.161 ( 16.947 -16.601 -5.288) 24.306 49.612 ( 0.542 -3.111 -0.275) 3.170 50.285 ( 3.992 -2.657 3.438) 5.900 50.358 ( 4.154 0.002 1.258) 4.341 53.374 ( 52.823 -45.699 -22.103) 73.261 61.265 ( 34.915 10.140 -9.550) 37.591 62.992 ( 33.335 14.595 26.861) 45.230 67.361 ( -29.616 -4.020 1.783) 29.940 68.301 ( -0.900 -15.066 -1.117) 15.135 ======================= Grid point 370 (173/204) ======================= q-point: ( 0.36 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.930 ( 2.540 -2.696 -8.813) 9.559 2.173 ( 6.999 -10.703 1.411) 12.866 2.375 ( 2.566 -12.052 9.846) 15.772 2.528 ( 13.498 -10.375 -0.171) 17.025 3.433 ( -0.332 -8.599 -2.458) 8.950 3.500 ( 1.029 3.462 5.024) 6.188 3.695 ( 3.281 6.183 -4.036) 8.080 3.976 ( 7.613 -0.509 -0.307) 7.636 4.228 ( -4.429 4.940 7.202) 9.793 4.335 ( 1.991 0.013 -2.150) 2.931 4.535 ( -2.970 6.959 -7.480) 10.640 4.847 ( -5.334 4.748 6.193) 9.452 5.110 ( 6.816 1.660 -2.756) 7.537 5.341 ( -5.960 -0.884 0.857) 6.086 5.827 ( 19.729 -3.767 0.280) 20.087 5.947 ( 2.315 -4.476 1.183) 5.176 6.234 ( -1.612 -2.080 1.243) 2.910 6.556 ( 1.859 3.911 -3.169) 5.365 6.743 ( 1.127 0.479 0.804) 1.465 6.961 ( -4.156 -1.271 -2.322) 4.928 7.300 ( 1.201 -5.252 2.745) 6.047 7.344 ( -0.684 -4.590 -0.011) 4.641 7.604 ( 3.605 -3.425 -1.443) 5.178 7.817 ( 1.401 2.946 1.467) 3.577 8.115 ( 6.040 -2.542 -0.889) 6.613 8.423 ( -1.004 -0.752 -0.367) 1.307 8.623 ( 0.370 -0.060 0.438) 0.576 8.712 ( 5.104 -3.500 0.027) 6.189 11.364 ( -9.292 12.536 0.880) 15.629 12.058 ( 1.648 -1.124 -0.750) 2.131 12.690 ( -18.178 8.940 0.593) 20.266 13.317 ( 22.375 10.854 0.173) 24.869 13.712 ( -20.767 -14.974 -0.520) 25.608 14.030 ( -2.496 -1.694 -0.123) 3.019 16.309 ( 30.653 -16.112 5.148) 35.010 16.794 ( 13.738 -10.261 -5.442) 17.990 26.866 ( -0.119 -0.329 -0.181) 0.394 26.920 ( 0.421 -0.664 -0.644) 1.016 26.970 ( -0.712 -0.108 0.775) 1.058 27.023 ( 0.507 -0.707 -0.013) 0.870 28.041 ( -0.841 1.106 -0.072) 1.391 28.108 ( -0.286 0.756 0.104) 0.815 33.753 ( -1.316 0.825 -0.121) 1.557 33.931 ( -0.976 -0.389 -0.249) 1.080 34.382 ( 2.888 -2.114 1.013) 3.720 34.590 ( 5.179 0.613 -0.106) 5.216 35.573 ( 2.016 -1.298 -5.660) 6.147 35.675 ( 0.125 1.716 6.052) 6.292 37.253 ( -0.664 -1.471 -0.559) 1.709 37.322 ( 0.847 -0.616 -0.061) 1.049 42.365 ( -10.404 -18.121 -2.763) 21.077 42.689 ( 7.444 9.921 2.147) 12.587 44.704 ( 4.672 -2.037 6.622) 8.357 45.009 ( 2.325 -3.512 -0.593) 4.253 45.419 ( 12.705 -8.253 -0.434) 15.156 45.538 ( 6.340 -3.361 -0.606) 7.201 46.355 ( 10.155 -14.463 2.878) 17.905 47.477 ( 7.908 -8.929 -2.176) 12.124 49.663 ( 0.881 -2.321 -0.149) 2.487 50.311 ( -1.282 -0.732 0.014) 1.476 50.552 ( 16.579 -6.392 4.756) 18.394 54.132 ( 7.327 -17.003 -11.130) 21.602 61.622 ( 47.837 3.551 -13.285) 49.774 63.121 ( 16.983 12.421 21.845) 30.330 67.094 ( -26.487 -3.035 0.312) 26.662 68.488 ( -0.679 -10.205 0.162) 10.229 ======================= Grid point 371 (174/204) ======================= q-point: ( 0.45 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.962 ( 0.948 -0.814 -2.982) 3.233 2.347 ( 2.927 -3.800 -0.079) 4.797 2.553 ( 1.150 -5.350 3.678) 6.593 2.805 ( 8.191 -6.657 1.755) 10.700 3.395 ( -3.038 4.088 -0.485) 5.116 3.525 ( -2.849 -3.947 -1.915) 5.231 3.608 ( 0.964 4.827 -1.475) 5.138 4.099 ( 6.865 -3.507 5.975) 9.753 4.171 ( -1.914 0.243 3.058) 3.616 4.351 ( -4.544 7.673 -7.258) 11.498 4.381 ( 3.596 -0.625 -1.202) 3.843 4.750 ( -3.801 1.488 2.194) 4.635 5.176 ( 8.467 0.660 -1.504) 8.625 5.265 ( -8.111 -0.006 1.100) 8.185 5.941 ( 1.785 -0.157 0.314) 1.819 6.085 ( 5.440 -2.332 0.800) 5.972 6.250 ( -0.376 -0.887 0.008) 0.964 6.516 ( 0.557 1.887 -1.149) 2.278 6.777 ( 2.838 -0.828 0.461) 2.992 6.909 ( -4.382 0.224 -0.833) 4.466 7.381 ( -1.110 -1.940 0.128) 2.239 7.403 ( 2.182 -2.679 1.079) 3.619 7.677 ( 1.508 -1.460 -1.070) 2.356 7.833 ( 3.640 -0.264 0.255) 3.658 8.182 ( 1.350 -0.746 0.157) 1.551 8.416 ( -1.086 -0.311 0.013) 1.130 8.592 ( -1.448 1.217 0.275) 1.912 8.832 ( 4.307 -2.300 -0.371) 4.897 11.142 ( -4.231 5.246 0.291) 6.746 12.076 ( 0.232 -0.116 -0.378) 0.459 12.446 ( -7.183 3.204 0.252) 7.869 13.385 ( 10.361 4.959 0.176) 11.487 13.695 ( -9.561 -5.942 -0.188) 11.259 14.035 ( -0.928 -1.052 -0.094) 1.406 16.764 ( 15.997 -7.644 3.833) 18.139 16.934 ( -1.277 -0.860 -3.903) 4.196 26.869 ( -0.007 -0.136 -0.067) 0.152 26.930 ( 0.249 -0.289 -0.307) 0.489 26.966 ( -0.367 0.013 0.333) 0.496 27.035 ( 0.211 -0.265 0.022) 0.340 28.022 ( -0.306 0.406 -0.018) 0.508 28.098 ( -0.103 0.286 0.035) 0.306 33.734 ( -0.423 0.297 -0.042) 0.518 33.928 ( -0.328 -0.146 -0.103) 0.373 34.429 ( 0.954 -0.833 0.538) 1.376 34.622 ( 1.814 0.280 -0.228) 1.850 35.600 ( 1.151 -1.076 -3.638) 3.964 35.659 ( -0.427 1.274 3.754) 3.987 37.261 ( -0.274 -0.495 -0.184) 0.595 37.335 ( 0.282 -0.226 -0.062) 0.367 42.502 ( -10.068 -15.383 -2.329) 18.532 42.614 ( 8.939 12.447 2.173) 15.478 44.728 ( 0.231 0.700 1.657) 1.813 45.061 ( 0.788 -1.138 -0.057) 1.385 45.539 ( 2.583 -0.329 -1.382) 2.948 45.696 ( 3.957 -4.357 0.882) 5.951 46.614 ( 5.101 -5.315 1.166) 7.458 47.620 ( 2.377 -2.983 -0.589) 3.859 49.696 ( 0.386 -0.901 -0.042) 0.981 50.308 ( -0.416 -0.167 -0.062) 0.452 50.836 ( 10.572 -4.996 2.240) 11.906 54.207 ( -5.546 -1.693 -3.244) 6.645 62.016 ( 24.067 -0.239 -7.583) 25.234 63.122 ( 3.129 5.417 9.952) 11.755 66.905 ( -11.169 -1.189 -0.056) 11.233 68.590 ( -0.261 -3.537 0.201) 3.553 ======================= Grid point 378 (175/204) ======================= q-point: ( 0.09 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.402 ( 4.966 0.000 2.886) 5.744 1.636 ( 9.865 0.000 15.469) 18.346 1.731 ( 4.860 0.000 -22.155) 22.682 1.899 ( 13.387 0.000 1.908) 13.523 2.840 ( 30.069 0.000 -21.214) 36.799 2.883 ( 12.384 0.000 24.908) 27.817 3.801 ( 2.644 0.000 -6.191) 6.732 3.844 ( 7.803 0.000 6.085) 9.895 4.265 ( 9.107 0.000 1.247) 9.192 4.694 ( 18.272 0.000 0.163) 18.272 4.856 ( -10.466 -0.000 -4.409) 11.357 4.943 ( -11.577 -0.000 7.508) 13.798 5.223 ( -6.267 -0.000 -5.552) 8.372 5.231 ( 4.487 0.000 -4.013) 6.019 5.498 ( -5.996 -0.000 -0.885) 6.061 5.684 ( 1.813 0.000 -2.602) 3.171 6.277 ( 1.146 0.000 6.239) 6.343 6.547 ( 7.172 0.000 -4.610) 8.526 6.881 ( -2.115 -0.000 -2.393) 3.193 6.947 ( -1.904 -0.000 1.270) 2.288 7.171 ( -9.768 -0.000 -0.824) 9.803 7.190 ( -6.881 -0.000 3.581) 7.757 7.625 ( 4.247 0.000 2.894) 5.139 7.778 ( 0.358 0.000 -1.830) 1.864 8.049 ( -8.883 -0.000 4.140) 9.800 8.330 ( -1.408 -0.000 3.607) 3.872 8.365 ( 5.351 0.000 -4.985) 7.313 8.570 ( 0.699 0.000 -1.263) 1.444 12.415 ( 58.874 0.000 17.836) 61.516 12.549 ( -16.505 -0.000 3.413) 16.855 12.815 ( -17.499 -0.000 -4.271) 18.013 13.065 ( 43.495 0.000 -22.301) 48.879 13.805 ( 34.287 0.000 3.814) 34.498 13.966 ( 0.201 0.000 -1.530) 1.543 14.220 ( 3.671 0.000 4.518) 5.821 14.514 ( 50.195 0.000 -14.262) 52.181 26.856 ( -0.039 -0.000 -0.348) 0.351 26.864 ( 0.661 0.000 -0.332) 0.740 26.970 ( -1.362 -0.000 1.306) 1.887 26.981 ( -0.527 -0.000 -1.072) 1.194 28.147 ( -0.762 -0.000 -2.189) 2.318 28.151 ( -1.731 -0.000 2.178) 2.782 33.895 ( -3.357 -0.000 -3.174) 4.620 33.909 ( -2.863 -0.000 3.731) 4.703 34.167 ( 7.804 0.000 -2.117) 8.086 34.431 ( 13.194 0.000 4.739) 14.019 35.523 ( 3.180 0.000 -4.755) 5.720 35.627 ( 2.913 0.000 7.305) 7.864 37.160 ( 0.669 0.000 -3.305) 3.372 37.243 ( 3.006 0.000 2.868) 4.155 41.891 ( 26.270 0.000 0.206) 26.271 42.563 ( 20.145 0.000 -9.225) 22.157 43.109 ( 24.005 0.000 -0.028) 24.005 44.205 ( 34.875 0.000 -11.632) 36.764 45.184 ( 10.408 0.000 -4.570) 11.367 45.377 ( 15.550 0.000 -8.403) 17.675 45.701 ( -0.434 -0.000 10.116) 10.125 45.935 ( 29.649 0.000 -10.087) 31.318 49.602 ( 13.951 0.000 1.286) 14.010 50.142 ( 18.553 0.000 -10.751) 21.442 50.384 ( 2.381 0.000 -0.180) 2.388 50.665 ( 43.933 0.000 -15.813) 46.693 61.401 ( 5.370 0.000 -3.719) 6.532 62.899 ( 48.586 0.000 36.643) 60.855 67.590 ( -16.054 -0.000 15.280) 22.164 67.732 ( -6.379 -0.000 -14.903) 16.210 ======================= Grid point 379 (176/204) ======================= q-point: ( 0.18 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.543 ( 10.945 -5.301 3.521) 12.660 1.763 ( 7.387 -3.428 -16.185) 18.118 1.839 ( 12.066 -3.451 11.903) 17.297 2.074 ( 15.936 -1.019 1.479) 16.037 3.081 ( 9.632 -3.076 9.412) 13.814 3.184 ( 26.169 -5.274 -7.290) 27.673 3.792 ( -0.135 -0.259 -6.046) 6.053 3.971 ( 10.375 1.557 9.187) 13.945 4.373 ( 9.649 2.129 -3.952) 10.642 4.714 ( -13.248 6.108 4.956) 15.407 4.752 ( -4.698 2.146 -0.695) 5.211 4.936 ( 15.427 -3.148 -0.192) 15.746 5.150 ( -1.592 0.406 -0.428) 1.698 5.265 ( 4.009 4.255 -4.013) 7.091 5.489 ( 4.999 -2.403 -1.931) 5.873 5.727 ( 1.739 -3.496 -0.371) 3.922 6.270 ( -0.904 2.748 4.327) 5.205 6.606 ( 3.447 -1.476 -5.473) 6.634 6.837 ( -2.693 1.546 -0.886) 3.229 6.963 ( -3.106 -5.297 0.156) 6.142 7.042 ( -6.758 1.898 -0.531) 7.039 7.168 ( -5.164 -3.553 3.247) 7.059 7.599 ( 2.096 5.418 0.511) 5.831 7.849 ( 0.043 -7.577 -0.898) 7.630 7.982 ( -1.083 2.418 2.690) 3.775 8.374 ( 0.154 -3.917 3.434) 5.211 8.422 ( 6.351 -0.905 -3.869) 7.492 8.583 ( 0.027 -1.365 -1.672) 2.159 12.180 ( -13.491 16.234 0.325) 21.110 12.650 ( 46.103 37.418 7.989) 59.912 12.825 ( -19.784 -20.044 -1.909) 28.228 13.348 ( -12.387 0.351 -3.300) 12.823 13.917 ( 32.774 20.690 2.822) 38.861 14.063 ( 6.087 2.292 -1.327) 6.638 14.751 ( 51.537 -25.982 10.126) 58.598 15.389 ( 45.733 -34.383 -15.736) 59.341 26.854 ( -0.161 -0.091 -0.406) 0.447 26.878 ( 0.484 -0.760 -0.367) 0.973 26.961 ( -1.051 -0.296 1.509) 1.863 26.978 ( -0.425 -0.693 -0.958) 1.256 28.118 ( -1.400 1.233 -0.301) 1.889 28.140 ( -1.293 -0.106 0.279) 1.327 33.841 ( -1.563 1.922 -1.125) 2.721 33.905 ( -2.444 -1.385 1.529) 3.198 34.256 ( 7.756 -0.530 -1.362) 7.892 34.561 ( 9.862 1.077 3.140) 10.406 35.547 ( 3.458 0.715 -3.568) 5.020 35.681 ( 2.398 -0.591 6.694) 7.136 37.170 ( 0.443 -1.230 -2.703) 3.003 37.278 ( 1.734 -0.335 1.694) 2.447 42.119 ( 31.676 16.408 2.100) 35.735 43.124 ( 30.180 -5.330 2.594) 30.756 43.367 ( 38.207 -13.798 8.125) 41.427 44.577 ( 11.838 -13.169 -5.613) 18.576 45.309 ( 12.688 1.956 -5.692) 14.043 45.394 ( 5.247 4.320 -3.798) 7.786 45.762 ( 3.049 -3.103 4.042) 5.938 46.514 ( 33.793 -21.654 -10.065) 41.379 49.709 ( 17.246 9.539 2.145) 19.825 50.248 ( 4.701 -0.831 -1.221) 4.927 50.395 ( 4.448 2.311 0.503) 5.038 51.681 ( 65.527 -50.117 -33.273) 88.953 61.503 ( 22.478 4.354 -12.939) 26.299 63.397 ( 31.916 9.084 47.137) 57.646 67.377 ( -16.360 5.873 6.093) 18.419 67.787 ( -4.471 -16.403 -3.489) 17.355 ======================= Grid point 380 (177/204) ======================= q-point: ( 0.27 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.804 ( 13.111 -9.042 3.421) 16.290 1.878 ( 8.720 -4.183 -13.591) 16.681 2.085 ( 12.799 -5.599 13.900) 19.707 2.300 ( 17.521 -3.781 0.854) 17.945 3.209 ( 2.714 -3.500 0.778) 4.496 3.493 ( 13.206 -4.338 1.323) 13.963 3.796 ( 1.676 -2.307 -7.899) 8.398 4.036 ( 10.495 7.608 5.877) 14.233 4.371 ( 0.591 2.863 -3.916) 4.887 4.453 ( -13.932 7.475 6.738) 17.186 4.669 ( -3.232 3.000 -5.767) 7.259 5.023 ( -2.792 5.721 5.988) 8.739 5.211 ( 5.825 -0.736 -3.467) 6.818 5.299 ( 13.007 0.577 0.699) 13.039 5.655 ( 15.998 -5.443 -3.075) 17.176 5.827 ( 4.789 -4.175 1.546) 6.539 6.217 ( -2.902 1.792 3.716) 5.044 6.629 ( 0.337 -0.060 -5.461) 5.472 6.786 ( -1.256 1.453 0.483) 1.980 6.944 ( -2.914 0.964 -3.598) 4.730 7.055 ( -4.876 -9.450 2.869) 11.014 7.198 ( -1.693 -4.445 2.289) 5.278 7.570 ( 3.619 1.843 -0.390) 4.080 7.916 ( -1.427 -0.026 2.222) 2.641 7.993 ( 3.517 -3.023 -1.052) 4.756 8.432 ( 3.517 0.340 2.388) 4.264 8.533 ( 4.959 -6.151 -3.258) 8.546 8.606 ( 1.064 -1.252 -0.348) 1.679 11.793 ( -13.669 14.777 0.179) 20.130 12.566 ( 34.921 32.169 2.024) 47.523 12.854 ( -23.019 -10.357 -0.381) 25.244 13.079 ( -20.660 -0.282 -1.435) 20.712 13.936 ( 16.099 12.578 1.555) 20.489 14.127 ( 26.967 12.594 -0.738) 29.772 15.712 ( 43.144 -22.308 10.278) 49.645 16.262 ( 29.022 -25.568 -9.730) 39.883 26.854 ( -0.142 -0.331 -0.436) 0.565 26.893 ( 0.220 -0.895 -0.398) 1.004 26.959 ( -1.075 -0.467 1.105) 1.611 26.990 ( 0.107 -1.258 -0.288) 1.295 28.082 ( -1.264 1.401 -0.122) 1.891 28.126 ( -1.140 0.246 0.148) 1.175 33.797 ( -0.640 1.946 -0.503) 2.109 33.900 ( -2.182 -1.240 0.426) 2.546 34.345 ( 6.762 -0.482 -0.053) 6.780 34.640 ( 7.561 1.856 1.204) 7.878 35.564 ( 3.221 0.678 -4.017) 5.193 35.718 ( 1.258 0.591 6.085) 6.242 37.190 ( -0.226 -1.881 -1.731) 2.567 37.302 ( 0.850 -0.666 0.485) 1.184 42.208 ( 25.097 12.140 -0.677) 27.887 43.207 ( 28.268 21.429 3.297) 35.626 44.301 ( 32.715 -26.987 14.166) 44.713 44.835 ( 6.613 -8.962 -1.318) 11.215 45.302 ( 7.569 4.405 -1.157) 8.834 45.503 ( 12.149 -0.788 -5.911) 13.533 45.919 ( 9.007 -9.655 3.370) 13.627 47.091 ( 18.662 -16.349 -5.061) 25.321 49.740 ( 14.590 9.460 0.792) 17.407 50.304 ( 3.656 -0.279 -0.045) 3.667 50.457 ( 10.799 -0.173 3.411) 11.326 53.058 ( 37.503 -51.266 -25.195) 68.333 61.715 ( 30.784 2.166 -21.780) 37.772 63.541 ( 6.315 13.261 44.111) 46.492 67.124 ( -12.092 5.946 0.255) 13.478 68.051 ( 1.802 -17.822 5.100) 18.625 ======================= Grid point 381 (178/204) ======================= q-point: ( 0.36 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.988 ( 10.527 -0.338 -8.584) 13.587 2.112 ( 10.477 -10.314 3.719) 15.165 2.341 ( 11.848 -5.442 11.335) 17.276 2.581 ( 17.742 -6.273 0.411) 18.823 3.273 ( -2.913 -5.985 -4.289) 7.918 3.559 ( -2.885 2.000 2.288) 4.191 3.842 ( 7.518 5.370 -7.498) 11.899 4.034 ( 4.209 2.242 2.794) 5.527 4.230 ( -10.588 4.159 6.466) 13.085 4.350 ( 0.075 0.273 2.406) 2.422 4.566 ( -2.180 3.879 -8.951) 9.996 4.868 ( -7.854 6.617 5.070) 11.453 5.257 ( 6.431 2.662 -2.927) 7.550 5.360 ( 7.952 5.837 1.429) 9.967 5.888 ( 1.449 -6.455 0.315) 6.624 5.985 ( 14.752 -1.625 -0.321) 14.845 6.192 ( -1.494 -1.724 2.472) 3.364 6.595 ( -1.535 1.768 -3.128) 3.907 6.782 ( 3.391 0.681 0.391) 3.481 6.904 ( -2.362 -0.243 -2.733) 3.621 7.167 ( -3.375 -9.779 3.138) 10.811 7.273 ( 1.410 -5.138 1.259) 5.475 7.626 ( 6.590 -1.464 -1.402) 6.895 7.890 ( 0.855 2.879 1.847) 3.525 8.075 ( -0.277 -4.582 -0.790) 4.657 8.457 ( 4.406 2.433 0.092) 5.034 8.617 ( -0.751 -1.378 0.073) 1.572 8.706 ( 8.062 -5.071 -1.038) 9.580 11.426 ( -14.173 12.281 0.184) 18.754 12.473 ( 24.198 24.609 0.550) 34.517 12.609 ( -14.771 5.148 -1.081) 15.679 12.996 ( -22.413 -14.599 -0.474) 26.752 13.933 ( 10.985 7.505 0.493) 13.313 14.253 ( 35.542 17.337 0.038) 39.545 16.418 ( 28.506 -14.726 6.630) 32.762 16.754 ( 11.793 -11.825 -5.621) 17.621 26.859 ( 0.028 -0.448 -0.401) 0.602 26.909 ( 0.120 -0.963 -0.351) 1.032 26.957 ( -1.029 -0.507 0.710) 1.349 27.011 ( 0.106 -1.193 0.085) 1.201 28.049 ( -0.904 1.202 -0.042) 1.504 28.109 ( -0.960 0.345 0.099) 1.025 33.765 ( -0.025 1.643 -0.187) 1.654 33.898 ( -1.797 -1.387 -0.115) 2.273 34.417 ( 5.224 0.078 0.976) 5.315 34.680 ( 5.380 2.632 -0.138) 5.991 35.581 ( 2.945 0.265 -4.620) 5.485 35.720 ( 0.175 1.858 5.673) 5.972 37.212 ( -0.692 -2.086 -0.904) 2.376 37.321 ( 0.396 -0.770 -0.117) 0.873 42.318 ( 21.176 7.261 -1.210) 22.419 43.195 ( 28.931 22.872 3.572) 37.053 44.735 ( 4.188 -3.009 7.465) 9.073 45.004 ( 6.156 -3.579 -1.134) 7.211 45.465 ( 14.720 -6.945 -0.571) 16.286 45.592 ( 8.661 2.788 -3.758) 9.845 46.282 ( 15.833 -14.819 3.369) 21.946 47.430 ( 9.836 -9.235 -1.813) 13.614 49.760 ( 11.431 7.043 0.117) 13.427 50.336 ( 4.357 1.427 -0.926) 4.677 50.673 ( 17.647 -4.495 5.445) 19.008 53.823 ( 3.779 -26.155 -12.608) 29.280 61.964 ( 17.691 -2.767 -23.601) 29.625 63.380 ( -17.063 10.231 33.874) 39.285 66.969 ( 3.116 5.879 -3.255) 7.407 68.346 ( 5.081 -12.380 8.760) 15.995 ======================= Grid point 382 (179/204) ======================= q-point: ( 0.45 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.067 ( 10.041 3.346 -2.927) 10.981 2.343 ( 7.254 -4.644 2.949) 9.105 2.550 ( 9.522 -2.679 5.722) 11.427 2.848 ( 12.462 -3.410 1.661) 13.026 3.311 ( -6.938 -8.567 -9.130) 14.314 3.465 ( -3.281 3.385 1.351) 4.904 3.746 ( 5.666 11.607 -6.134) 14.299 4.076 ( -4.183 -3.299 10.449) 11.729 4.133 ( -4.064 -1.407 3.117) 5.311 4.329 ( -4.636 1.518 0.421) 4.896 4.468 ( -0.774 5.117 -4.288) 6.721 4.727 ( -3.824 1.592 -0.839) 4.227 5.219 ( -4.299 2.478 -0.980) 5.058 5.394 ( 16.660 7.869 0.384) 18.429 5.946 ( 0.220 -0.893 0.604) 1.100 6.069 ( -2.817 -1.787 0.872) 3.448 6.237 ( 1.533 -1.666 -0.710) 2.373 6.537 ( -2.305 2.092 -0.738) 3.200 6.819 ( 2.821 1.622 -1.105) 3.437 6.898 ( 3.586 -0.532 -0.212) 3.631 7.269 ( -3.535 -7.277 4.181) 9.107 7.382 ( 2.889 -4.138 -0.619) 5.084 7.725 ( 7.258 -0.637 -2.730) 7.781 7.854 ( -2.651 1.885 2.626) 4.181 8.120 ( -1.857 -3.254 -0.548) 3.786 8.462 ( 3.877 2.222 -2.365) 5.056 8.613 ( 1.139 1.988 2.242) 3.205 8.839 ( 3.549 -2.285 -0.554) 4.257 11.141 ( -10.302 5.159 -0.163) 11.523 12.351 ( 7.747 10.728 0.034) 13.232 12.491 ( 10.181 9.314 -1.198) 13.851 12.954 ( -23.297 -13.364 -0.144) 26.858 13.956 ( 10.593 5.472 0.119) 11.923 14.378 ( 37.586 20.183 0.435) 42.664 16.830 ( 12.921 -6.178 4.828) 15.114 16.884 ( -2.763 -1.406 -4.167) 5.194 26.865 ( 0.117 -0.352 -0.312) 0.485 26.922 ( -0.159 -0.774 -0.100) 0.796 26.956 ( -0.598 -0.535 0.321) 0.864 27.026 ( -0.263 -0.788 0.143) 0.843 28.027 ( -0.367 0.663 0.002) 0.758 28.096 ( -0.758 0.134 0.043) 0.771 33.747 ( 0.597 1.081 -0.034) 1.236 33.902 ( -1.390 -1.510 -0.213) 2.063 34.460 ( 3.444 1.142 1.213) 3.826 34.679 ( 2.761 3.333 -0.725) 4.388 35.600 ( 2.416 -0.121 -4.790) 5.366 35.696 ( -0.619 2.479 5.225) 5.817 37.234 ( -0.675 -1.884 -0.275) 2.020 37.333 ( 0.023 -0.530 -0.285) 0.602 42.447 ( 18.744 4.986 -1.267) 19.437 43.174 ( 30.550 24.549 3.806) 39.375 44.745 ( -1.307 1.507 2.175) 2.952 45.085 ( 4.301 0.145 0.515) 4.334 45.604 ( 3.338 3.155 -0.378) 4.609 45.690 ( 9.101 -3.037 -3.339) 10.159 46.603 ( 8.706 -5.992 0.867) 10.605 47.605 ( 4.349 -3.773 -0.137) 5.759 49.778 ( 8.943 5.579 -0.183) 10.542 50.360 ( 6.419 2.906 -1.068) 7.127 50.909 ( 8.872 -0.652 3.705) 9.637 54.053 ( -1.417 -11.573 -4.367) 12.450 61.971 ( -20.582 -2.993 -13.526) 24.810 63.073 ( -28.218 1.831 17.245) 33.121 67.019 ( 23.453 6.038 -5.124) 24.754 68.564 ( 5.640 -5.229 8.876) 11.744 ======================= Grid point 383 (180/204) ======================= q-point: (-0.45 0.09 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.099 ( 9.079 6.395 3.142) 11.541 2.410 ( 3.833 4.611 1.160) 6.107 2.635 ( 4.625 3.599 0.245) 5.866 2.854 ( -4.104 8.776 -1.835) 9.860 3.393 ( 3.642 -6.192 -4.744) 8.609 3.446 ( -3.749 -5.922 -2.071) 7.309 3.648 ( 5.894 7.694 -1.510) 9.809 4.036 ( -9.357 1.386 6.890) 11.702 4.149 ( -3.340 -0.961 -1.978) 3.999 4.284 ( 0.226 -4.462 2.734) 5.238 4.372 ( -5.405 1.453 3.140) 6.418 4.730 ( 0.853 -3.252 -5.853) 6.750 5.124 ( -5.251 1.928 0.580) 5.624 5.465 ( 16.026 7.545 0.799) 17.731 5.910 ( -7.096 2.483 -0.521) 7.536 6.030 ( -5.547 -0.500 -0.353) 5.581 6.261 ( 0.703 -0.660 -0.495) 1.084 6.485 ( -3.008 0.441 0.723) 3.125 6.787 ( 0.100 2.695 -1.325) 3.005 6.983 ( 8.108 0.205 0.841) 8.154 7.335 ( -2.596 -4.446 3.957) 6.494 7.416 ( -1.145 1.123 -1.485) 2.185 7.752 ( -2.031 5.322 1.401) 5.866 7.785 ( 0.135 -0.139 -2.024) 2.033 8.123 ( -4.352 -1.259 -0.106) 4.532 8.479 ( 4.981 1.614 -3.277) 6.177 8.609 ( 2.010 1.136 2.764) 3.601 8.818 ( -5.617 3.204 0.331) 6.476 11.082 ( 0.222 -5.342 -0.614) 5.382 12.365 ( 19.701 9.629 0.739) 21.941 12.506 ( 7.430 0.189 -2.248) 7.764 12.892 ( -19.581 -10.646 0.144) 22.288 13.997 ( 9.920 4.378 0.000) 10.843 14.472 ( 38.107 23.317 0.783) 44.682 16.687 ( -18.255 8.567 -2.835) 20.363 16.958 ( -1.017 1.183 3.375) 3.718 26.870 ( 0.148 -0.116 -0.196) 0.272 26.926 ( -0.648 -0.307 0.433) 0.838 26.962 ( 0.106 -0.578 -0.285) 0.653 27.029 ( -0.699 -0.286 0.116) 0.764 28.022 ( 0.241 -0.089 0.033) 0.259 28.090 ( -0.569 -0.332 -0.023) 0.659 33.746 ( 1.368 0.379 0.038) 1.420 33.912 ( -1.037 -1.504 -0.075) 1.828 34.462 ( 1.712 2.704 0.505) 3.240 34.638 ( -0.238 3.612 -0.472) 3.650 35.612 ( 1.211 0.263 -2.701) 2.972 35.662 ( -0.679 1.888 2.785) 3.433 37.253 ( -0.299 -1.295 0.185) 1.342 37.335 ( -0.318 -0.044 -0.240) 0.401 42.568 ( 16.727 5.253 -1.371) 17.586 43.147 ( 33.448 27.002 4.476) 43.220 44.713 ( -1.495 0.488 -1.331) 2.060 45.103 ( 2.456 2.654 1.117) 3.785 45.564 ( -0.366 4.437 1.447) 4.681 45.720 ( -1.586 4.218 -4.069) 6.071 46.656 ( 0.761 4.919 -1.916) 5.334 47.642 ( -0.834 1.818 1.027) 2.248 49.785 ( 7.412 5.509 -0.063) 9.235 50.388 ( 9.333 4.494 -1.218) 10.430 50.818 ( -11.860 9.605 -0.495) 15.270 54.230 ( 4.666 -7.335 1.912) 8.901 61.536 ( -54.650 -1.546 0.298) 54.672 62.814 ( -30.871 -7.746 -0.208) 31.828 67.254 ( 36.097 6.676 -5.430) 37.109 68.668 ( 4.458 1.574 7.453) 8.826 ======================= Grid point 384 (181/204) ======================= q-point: (-0.36 0.09 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.094 ( 8.206 8.653 8.686) 14.754 2.302 ( 0.973 12.635 -1.009) 12.713 2.547 ( 2.165 11.290 -5.261) 12.642 2.588 ( -8.612 13.373 -0.822) 15.927 3.454 ( -1.823 0.557 -7.316) 7.560 3.486 ( -5.347 -3.611 -0.244) 6.457 3.624 ( 4.950 4.270 0.535) 6.559 3.923 ( -4.464 1.121 6.825) 8.232 4.137 ( -4.353 -5.113 -4.873) 8.297 4.323 ( -0.396 -0.765 2.622) 2.760 4.438 ( -0.354 -9.690 5.010) 10.914 4.779 ( -0.971 -4.581 -8.324) 9.551 5.062 ( -3.254 0.150 2.748) 4.262 5.501 ( 5.794 7.214 2.800) 9.667 5.689 ( -13.891 6.554 -2.517) 15.565 5.980 ( -1.196 2.731 -0.961) 3.132 6.273 ( 1.142 0.562 -0.337) 1.316 6.466 ( -4.469 -2.935 1.611) 5.584 6.756 ( 2.085 1.970 -1.459) 3.218 7.038 ( 3.478 2.382 1.809) 4.587 7.333 ( -1.728 2.707 -2.372) 3.993 7.362 ( -3.569 -0.116 4.917) 6.077 7.646 ( -1.686 3.766 -0.101) 4.127 7.805 ( 5.122 0.960 -3.706) 6.394 8.056 ( -7.668 1.102 1.150) 7.832 8.461 ( -2.257 3.897 0.280) 4.512 8.633 ( 1.100 0.567 1.427) 1.889 8.685 ( -5.313 1.740 -1.187) 5.715 11.275 ( 8.933 -11.691 -0.832) 14.737 12.427 ( 26.877 16.431 0.007) 31.501 12.617 ( -12.559 -13.100 -1.912) 18.248 12.914 ( 4.786 -7.757 0.274) 9.119 14.041 ( 8.218 3.280 -0.042) 8.849 14.518 ( 38.057 26.929 1.331) 46.640 16.199 ( -32.234 17.022 -3.529) 36.622 16.790 ( -15.989 9.732 4.118) 19.165 26.872 ( 0.321 0.093 -0.100) 0.348 26.921 ( -0.777 0.084 0.776) 1.101 26.972 ( 0.396 -0.383 -0.715) 0.902 27.021 ( -0.971 0.142 0.138) 0.991 28.035 ( 0.762 -0.852 0.084) 1.146 28.093 ( -0.440 -0.893 -0.097) 1.000 33.766 ( 2.341 -0.327 0.053) 2.364 33.924 ( -0.795 -1.444 0.149) 1.655 34.418 ( 0.227 4.473 -0.565) 4.514 34.564 ( -3.213 3.404 0.094) 4.682 35.597 ( -0.765 2.014 4.424) 4.921 35.646 ( 0.177 -0.184 -4.538) 4.545 37.266 ( 0.174 -0.343 0.393) 0.550 37.325 ( -0.628 0.603 -0.083) 0.874 42.638 ( 14.439 8.581 -1.539) 16.867 43.122 ( 35.919 28.569 5.969) 46.282 44.671 ( -3.618 2.003 -6.175) 7.432 45.065 ( 0.141 4.728 1.671) 5.016 45.438 ( -8.477 9.454 0.388) 12.703 45.529 ( -8.782 7.058 -2.145) 11.469 46.504 ( 1.375 13.779 -4.300) 14.500 47.528 ( -7.310 7.963 2.478) 11.089 49.777 ( 7.492 6.314 0.638) 9.818 50.427 ( 13.149 6.478 -1.506) 14.735 50.479 ( -15.622 9.327 -4.188) 18.670 54.188 ( -23.385 8.889 8.990) 26.584 60.981 ( -48.430 -6.842 3.981) 49.073 62.577 ( -38.692 -12.549 -7.981) 41.452 67.555 ( 37.679 7.634 -4.894) 38.755 68.650 ( 1.795 7.447 5.893) 9.665 ======================= Grid point 385 (182/204) ======================= q-point: (-0.27 0.09 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.043 ( 1.270 11.244 5.718) 12.678 2.067 ( 4.107 17.930 1.869) 18.489 2.278 ( -4.416 15.225 -0.578) 15.863 2.367 ( 1.246 13.251 -3.627) 13.795 3.295 ( -11.578 7.041 -3.955) 14.116 3.354 ( -8.132 8.445 -3.769) 12.315 3.675 ( 6.180 -0.648 2.047) 6.542 3.940 ( 0.882 -2.211 6.579) 6.997 4.153 ( -6.367 -5.255 -7.027) 10.842 4.401 ( 3.908 -5.283 1.858) 6.829 4.551 ( -5.309 -5.706 3.527) 8.555 4.746 ( -12.772 -1.982 -8.818) 15.646 5.077 ( 0.787 -3.367 5.749) 6.709 5.295 ( -12.169 3.617 1.076) 12.740 5.600 ( 8.823 6.334 -1.470) 10.961 5.895 ( -2.934 5.345 -0.860) 6.158 6.275 ( 2.535 1.032 -1.694) 3.219 6.466 ( -6.821 -3.938 2.975) 8.419 6.778 ( 4.828 -0.384 -1.845) 5.183 7.013 ( -1.214 1.643 2.491) 3.221 7.286 ( -1.891 2.421 0.463) 3.107 7.318 ( -0.725 2.059 1.118) 2.453 7.593 ( 3.367 4.605 -1.995) 6.044 7.851 ( 2.187 -0.047 -1.733) 2.791 7.945 ( -4.948 1.621 0.830) 5.272 8.328 ( -10.708 1.866 1.643) 10.993 8.603 ( 0.562 2.623 4.987) 5.663 8.678 ( 0.320 -1.125 -5.942) 6.057 11.594 ( 13.431 -12.989 -0.787) 18.701 12.488 ( 32.681 18.629 -1.038) 37.632 12.574 ( -23.920 -11.455 -0.822) 26.534 13.211 ( 16.461 -10.095 -0.688) 19.322 14.078 ( 5.563 2.039 0.051) 5.925 14.499 ( 35.414 30.739 2.956) 46.987 15.449 ( -40.746 24.434 -5.779) 47.861 16.314 ( -31.132 19.798 5.925) 37.366 26.875 ( 0.663 0.241 -0.104) 0.713 26.910 ( -0.776 0.391 0.967) 1.300 26.978 ( 0.488 -0.060 -1.139) 1.241 27.007 ( -0.959 0.302 0.412) 1.086 28.064 ( 1.088 -1.436 0.175) 1.810 28.106 ( -0.419 -1.351 -0.180) 1.426 33.809 ( 3.515 -0.942 -0.024) 3.639 33.938 ( -0.799 -1.457 0.391) 1.707 34.333 ( -0.673 5.674 -0.917) 5.786 34.463 ( -5.718 3.308 -0.020) 6.606 35.569 ( -0.867 1.976 6.538) 6.884 35.636 ( -0.534 -0.251 -6.755) 6.781 37.267 ( 0.472 0.942 0.403) 1.128 37.302 ( -0.894 1.278 -0.016) 1.560 42.613 ( 14.005 14.886 -1.026) 20.464 43.083 ( 27.300 27.072 8.068) 39.284 44.434 ( -8.587 18.361 -15.843) 25.727 44.956 ( -5.240 6.768 1.904) 8.768 45.181 ( -4.756 5.861 -1.511) 7.698 45.367 ( -8.692 3.748 1.864) 9.647 46.296 ( 9.005 18.539 -4.911) 21.187 47.229 ( -17.212 15.434 5.379) 23.736 49.773 ( 10.334 7.317 1.485) 12.749 50.231 ( -9.487 3.156 -5.368) 11.348 50.477 ( 18.037 9.261 -2.727) 20.458 53.322 ( -75.491 35.441 17.354) 85.182 60.804 ( -11.701 -13.875 2.226) 18.286 62.284 ( -45.574 -13.825 -10.779) 48.829 67.814 ( 32.042 8.692 -4.574) 33.514 68.511 ( -2.187 11.791 4.990) 12.989 ======================= Grid point 386 (183/204) ======================= q-point: (-0.18 0.09 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.781 ( 1.557 17.056 -4.920) 17.819 1.858 ( -5.450 15.262 5.607) 17.148 2.076 ( 6.073 14.048 3.758) 15.759 2.166 ( 0.597 13.799 -1.082) 13.854 3.013 ( -11.209 12.005 7.895) 18.223 3.070 ( -9.637 12.176 -13.045) 20.281 3.747 ( 7.509 2.013 2.894) 8.295 3.967 ( -2.860 4.221 -1.456) 5.302 4.134 ( -3.115 -5.049 0.357) 5.943 4.372 ( -19.902 -4.176 -3.239) 20.592 4.605 ( 4.159 -7.922 4.243) 9.902 4.706 ( -3.030 -6.332 -3.267) 7.743 5.198 ( 3.525 -5.906 8.334) 10.806 5.260 ( 0.560 -4.809 -4.605) 6.682 5.590 ( 6.956 6.328 -0.882) 9.445 5.748 ( -6.369 6.385 -0.409) 9.028 6.297 ( 5.192 0.845 -4.325) 6.810 6.433 ( -8.769 -1.743 4.838) 10.166 6.859 ( 6.194 -2.075 -2.193) 6.891 6.985 ( -4.474 -0.765 3.136) 5.517 7.227 ( 2.276 2.931 -0.189) 3.716 7.299 ( -1.717 -0.100 -0.124) 1.725 7.568 ( 5.917 4.587 -2.011) 7.752 7.747 ( -10.063 3.229 2.330) 10.822 8.005 ( 8.044 -2.728 -2.568) 8.874 8.209 ( -10.430 -1.402 2.097) 10.731 8.592 ( 2.036 2.522 5.632) 6.498 8.664 ( -1.328 0.514 -6.819) 6.966 11.959 ( 18.752 -11.545 -0.516) 22.027 12.477 ( -22.172 -10.374 0.518) 24.484 12.592 ( 39.097 19.744 -2.646) 43.879 13.405 ( -9.518 0.957 -1.564) 9.693 14.098 ( 3.142 2.292 1.595) 4.203 14.306 ( 1.112 24.883 6.223) 25.674 14.706 ( 4.041 30.239 -10.598) 32.297 15.513 ( -43.541 31.738 7.881) 54.454 26.878 ( 0.881 0.519 -0.301) 1.066 26.895 ( -0.850 0.692 0.930) 1.437 26.981 ( 0.750 0.101 -1.373) 1.568 26.995 ( -0.807 0.119 0.880) 1.200 28.102 ( 1.149 -1.708 0.290) 2.079 28.123 ( -0.526 -1.567 -0.274) 1.676 33.873 ( 4.647 -1.444 -0.323) 4.877 33.951 ( -1.536 -1.619 0.732) 2.349 34.237 ( 0.367 5.874 -0.460) 5.903 34.334 ( -7.428 3.775 -0.671) 8.359 35.552 ( -0.025 1.538 7.325) 7.485 35.607 ( -1.455 0.479 -7.546) 7.700 37.248 ( 0.422 2.213 0.946) 2.444 37.267 ( -0.948 1.892 -0.762) 2.249 42.509 ( 15.441 19.440 1.198) 24.855 42.855 ( -4.996 22.204 4.871) 23.275 44.041 ( 25.508 32.302 -19.735) 45.646 44.707 ( -19.290 13.148 4.127) 23.706 45.132 ( 0.228 0.132 -0.124) 0.291 45.223 ( -7.821 2.836 1.402) 8.437 46.123 ( 14.325 20.034 -3.446) 24.869 46.656 ( -30.602 26.362 8.982) 41.378 49.798 ( 16.089 9.084 1.459) 18.534 50.107 ( -8.207 0.875 -4.677) 9.486 50.529 ( 22.529 12.996 -4.029) 26.319 51.724 ( -86.011 47.013 18.964) 99.839 61.090 ( 19.623 -14.033 1.250) 24.156 61.938 ( -46.748 -12.431 -9.947) 49.385 67.971 ( 22.681 9.826 -5.011) 25.221 68.275 ( -6.972 13.345 5.081) 15.891 ======================= Grid point 387 (184/204) ======================= q-point: (-0.09 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 187 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.582 ( 1.945 12.065 -13.284) 18.051 1.582 ( -1.945 12.065 13.284) 18.051 1.936 ( 3.369 12.668 -16.364) 20.967 1.936 ( -3.369 12.668 16.364) 20.967 2.778 ( 1.490 11.807 -22.645) 25.581 2.778 ( -1.490 11.807 22.645) 25.581 3.799 ( -4.690 3.381 -4.208) 7.151 3.799 ( 4.690 3.381 4.208) 7.151 4.267 ( -7.456 -3.698 -3.929) 9.204 4.267 ( 7.456 -3.698 3.929) 9.204 4.797 ( -1.521 -10.108 -9.014) 13.629 4.797 ( 1.521 -10.108 9.014) 13.629 5.336 ( 2.795 -3.892 -7.925) 9.261 5.336 ( -2.795 -3.892 7.925) 9.261 5.583 ( -3.180 2.963 -4.963) 6.598 5.583 ( 3.180 2.963 4.963) 6.598 6.349 ( 8.270 0.869 -6.800) 10.742 6.349 ( -8.270 0.869 6.800) 10.742 6.944 ( 0.329 -0.603 -1.958) 2.075 6.944 ( -0.329 -0.603 1.958) 2.075 7.272 ( -4.535 -1.695 -0.845) 4.915 7.272 ( 4.535 -1.695 0.845) 4.915 7.597 ( -9.562 1.543 1.236) 9.764 7.597 ( 9.562 1.543 -1.236) 9.764 8.142 ( -0.405 -3.126 -3.262) 4.536 8.142 ( 0.405 -3.126 3.262) 4.536 8.594 ( -2.910 3.312 -6.581) 7.921 8.594 ( 2.910 3.312 6.581) 7.921 12.375 ( -28.878 -5.273 1.203) 29.380 12.375 ( 28.878 -5.273 -1.203) 29.380 12.744 ( -30.662 19.158 -2.540) 36.245 12.744 ( 30.662 19.158 2.540) 36.245 14.123 ( -4.296 1.861 -2.442) 5.281 14.123 ( 4.296 1.861 2.442) 5.281 14.483 ( -30.057 36.887 2.324) 47.639 14.483 ( 30.057 36.887 -2.324) 47.639 26.875 ( 0.440 0.876 -0.749) 1.233 26.875 ( -0.440 0.876 0.749) 1.233 26.988 ( 0.782 -0.029 -1.059) 1.316 26.988 ( -0.782 -0.029 1.059) 1.316 28.139 ( 0.172 -1.491 -2.070) 2.557 28.139 ( -0.172 -1.491 2.070) 2.557 33.948 ( 0.391 -1.585 -2.959) 3.380 33.948 ( -0.391 -1.585 2.959) 3.380 34.187 ( -6.255 4.381 -0.755) 7.674 34.187 ( 6.255 4.381 0.755) 7.674 35.557 ( -1.113 1.139 -8.513) 8.660 35.557 ( 1.113 1.139 8.513) 8.660 37.220 ( -0.678 2.426 -2.128) 3.297 37.220 ( 0.678 2.426 2.128) 3.297 42.413 ( -8.837 15.679 -14.797) 23.299 42.413 ( 8.837 15.679 14.797) 23.299 43.937 ( -20.111 37.347 -2.448) 42.489 43.937 ( 20.111 37.347 2.448) 42.489 45.131 ( -1.543 1.640 -0.416) 2.290 45.131 ( 1.543 1.640 0.416) 2.290 45.981 ( -5.648 19.653 -6.386) 21.423 45.981 ( 5.648 19.653 6.386) 21.423 49.861 ( -11.610 11.565 -8.561) 18.489 49.861 ( 11.610 11.565 8.561) 18.489 50.555 ( -17.555 17.143 1.717) 24.597 50.555 ( 17.555 17.143 -1.717) 24.597 61.607 ( -37.075 -9.668 -5.223) 38.669 61.607 ( 37.075 -9.668 5.223) 38.669 67.994 ( 4.833 10.571 -14.774) 18.798 67.994 ( -4.833 10.571 14.774) 18.798 ======================= Grid point 391 (185/204) ======================= q-point: ( 0.18 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.674 ( 16.643 0.000 4.109) 17.143 1.793 ( 10.333 0.000 -15.303) 18.465 2.012 ( 15.504 0.000 13.757) 20.727 2.243 ( 14.938 0.000 0.879) 14.964 3.159 ( 4.753 0.000 9.048) 10.220 3.421 ( 21.681 0.000 -6.914) 22.757 3.748 ( -1.817 -0.000 -6.316) 6.572 4.161 ( 13.198 0.000 10.299) 16.741 4.463 ( 4.335 0.000 -11.053) 11.873 4.570 ( -18.686 -0.000 4.601) 19.244 4.772 ( 3.048 0.000 0.044) 3.049 5.007 ( 6.992 0.000 1.809) 7.222 5.146 ( -3.709 -0.000 5.902) 6.970 5.446 ( 16.205 0.000 -4.710) 16.876 5.549 ( 14.589 0.000 -3.500) 15.002 5.708 ( 2.093 0.000 -0.300) 2.115 6.285 ( -3.402 -0.000 2.586) 4.273 6.587 ( -0.526 -0.000 -4.982) 5.009 6.842 ( 0.351 0.000 -2.061) 2.090 6.846 ( -6.885 -0.000 2.630) 7.371 7.003 ( -4.173 -0.000 -2.319) 4.774 7.091 ( -3.202 -0.000 2.776) 4.238 7.712 ( 0.817 0.000 4.802) 4.871 7.722 ( 0.313 0.000 -3.212) 3.227 8.021 ( 2.998 0.000 1.837) 3.517 8.369 ( 3.759 0.000 -1.184) 3.941 8.489 ( 7.221 0.000 -0.320) 7.228 8.588 ( 2.243 0.000 -1.538) 2.720 12.210 ( -16.622 -0.000 3.984) 17.093 12.402 ( -15.955 -0.000 -4.768) 16.653 13.161 ( -14.331 -0.000 -8.524) 16.675 13.256 ( -5.721 -0.000 13.198) 14.385 14.451 ( 34.144 0.000 11.481) 36.023 14.508 ( 41.449 0.000 -11.521) 43.021 15.149 ( 56.646 0.000 22.056) 60.789 15.526 ( 43.211 0.000 -21.174) 48.120 26.850 ( -0.277 -0.000 -0.527) 0.596 26.877 ( 0.391 0.000 -0.118) 0.409 26.952 ( -0.762 -0.000 1.765) 1.922 26.964 ( -0.373 -0.000 -1.159) 1.218 28.116 ( -0.987 -0.000 -2.132) 2.350 28.118 ( -1.916 -0.000 2.141) 2.873 33.844 ( -0.328 -0.000 -3.671) 3.686 33.871 ( -2.482 -0.000 4.165) 4.848 34.340 ( 7.987 0.000 -0.909) 8.039 34.672 ( 7.461 0.000 1.770) 7.668 35.586 ( 3.073 0.000 -2.170) 3.762 35.715 ( 1.956 0.000 6.036) 6.345 37.162 ( 0.724 0.000 -2.711) 2.806 37.289 ( 0.268 0.000 0.942) 0.979 43.002 ( 49.964 0.000 21.488) 54.388 43.154 ( 35.622 0.000 -10.398) 37.108 43.849 ( 34.277 0.000 13.015) 36.665 44.572 ( 11.553 0.000 -7.750) 13.912 45.452 ( -0.141 -0.000 -6.898) 6.899 45.482 ( 17.582 0.000 -8.247) 19.421 45.854 ( 12.423 0.000 13.367) 18.249 46.683 ( 31.510 0.000 -10.674) 33.269 50.103 ( 24.995 0.000 13.271) 28.299 50.277 ( 4.350 0.000 -3.444) 5.548 50.509 ( 10.379 0.000 -0.874) 10.416 51.822 ( 55.225 0.000 -39.964) 68.169 61.748 ( 22.315 0.000 -23.640) 32.508 63.776 ( -1.081 -0.000 54.038) 54.048 67.478 ( 3.045 0.000 29.515) 29.672 67.491 ( -4.068 -0.000 -19.975) 20.385 ======================= Grid point 392 (186/204) ======================= q-point: ( 0.27 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.893 ( 15.641 -2.183 -1.672) 15.881 1.923 ( 14.622 -2.726 -5.214) 15.762 2.230 ( 15.441 -1.742 12.568) 19.986 2.430 ( 13.607 -3.540 1.362) 14.126 3.218 ( 2.381 -0.221 2.214) 3.259 3.553 ( 1.709 -0.467 -0.227) 1.786 3.780 ( 8.296 -2.013 -8.123) 11.784 4.264 ( 3.566 2.576 5.484) 7.030 4.363 ( -9.153 4.527 3.575) 10.819 4.436 ( -1.867 3.305 -6.089) 7.175 4.709 ( -0.024 8.058 -2.160) 8.343 5.058 ( -7.584 4.362 7.362) 11.434 5.192 ( 7.717 -7.403 -0.771) 10.721 5.587 ( 19.182 3.890 -2.859) 19.780 5.660 ( 3.854 -0.576 -2.558) 4.661 5.885 ( 16.379 -6.293 1.475) 17.608 6.211 ( -5.972 2.257 1.835) 6.643 6.581 ( -2.236 -2.065 -4.593) 5.510 6.791 ( -1.528 -0.448 1.931) 2.503 6.894 ( 0.026 -5.356 0.151) 5.359 6.940 ( -1.225 2.601 -2.291) 3.676 7.117 ( -0.552 -4.690 1.043) 4.836 7.658 ( 3.293 3.706 1.450) 5.165 7.828 ( 0.023 -6.067 1.182) 6.181 8.050 ( 4.620 1.978 0.586) 5.060 8.454 ( 5.199 -4.843 -2.904) 7.676 8.548 ( 5.948 2.847 0.212) 6.598 8.636 ( 5.384 -1.542 0.263) 5.607 11.848 ( -17.970 14.545 1.050) 23.142 12.374 ( -21.163 -15.156 -1.865) 26.097 12.925 ( -17.279 5.661 -2.572) 18.364 13.105 ( -5.482 6.348 4.235) 9.395 14.525 ( 37.270 31.900 2.424) 49.118 14.832 ( 40.867 15.754 -3.156) 43.912 15.922 ( 41.596 -14.615 13.639) 46.150 16.171 ( 29.631 -24.197 -9.387) 39.390 26.847 ( -0.151 -0.221 -0.514) 0.580 26.883 ( 0.059 -0.525 -0.117) 0.542 26.947 ( -0.733 0.067 0.966) 1.215 26.971 ( -0.020 -1.218 -0.230) 1.239 28.087 ( -1.273 1.112 -0.135) 1.696 28.110 ( -1.412 -0.367 0.197) 1.472 33.820 ( -0.222 1.533 -1.397) 2.086 33.862 ( -2.075 -0.900 1.511) 2.721 34.425 ( 7.431 0.225 0.235) 7.438 34.741 ( 5.944 1.050 0.321) 6.045 35.606 ( 2.868 0.858 -2.551) 3.933 35.747 ( 0.909 -0.003 5.417) 5.492 37.168 ( 0.424 -0.614 -2.055) 2.187 37.294 ( -0.440 -0.698 0.211) 0.851 43.006 ( 42.000 34.739 1.899) 54.538 43.802 ( 27.537 6.109 3.648) 28.442 44.324 ( 29.115 -18.638 14.673) 37.555 44.776 ( 10.980 -9.135 -4.268) 14.907 45.413 ( 2.054 1.850 -3.900) 4.780 45.668 ( 17.691 -1.053 -9.195) 19.966 46.039 ( 22.131 4.261 13.384) 26.212 47.081 ( 21.363 -11.445 -6.105) 24.992 50.203 ( 20.320 17.506 4.352) 27.172 50.377 ( 11.415 1.840 3.722) 12.146 50.615 ( 15.853 2.186 0.836) 16.025 52.653 ( 34.023 -40.852 -28.394) 60.272 61.886 ( 10.417 -1.650 -29.139) 30.989 63.645 ( -32.599 5.336 45.654) 56.351 67.280 ( 9.192 13.769 -6.642) 17.838 67.867 ( 10.778 -17.231 21.925) 29.896 ======================= Grid point 393 (187/204) ======================= q-point: ( 0.36 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.061 ( 11.011 -2.604 -5.383) 12.530 2.163 ( 16.650 -3.822 3.269) 17.393 2.464 ( 13.890 -3.261 11.125) 18.093 2.664 ( 12.498 -7.484 0.652) 14.582 3.215 ( -0.459 2.001 -4.355) 4.814 3.538 ( -2.414 0.097 -1.020) 2.622 3.887 ( 4.207 -2.742 -3.726) 6.253 4.153 ( -10.980 2.314 5.045) 12.303 4.253 ( 5.062 12.525 -6.421) 14.957 4.361 ( -2.611 1.548 7.633) 8.215 4.593 ( 0.053 5.168 -5.453) 7.513 4.893 ( -8.585 6.845 5.705) 12.374 5.281 ( -0.107 0.514 -3.228) 3.270 5.668 ( 16.326 8.944 0.122) 18.615 5.790 ( 3.217 -8.216 -0.520) 8.839 6.082 ( 2.054 1.492 -1.091) 2.763 6.150 ( 0.214 -3.547 2.813) 4.532 6.564 ( -3.281 -0.861 -3.042) 4.556 6.845 ( 6.827 -1.795 1.944) 7.322 6.895 ( 0.994 2.356 -2.704) 3.722 7.012 ( 1.600 -8.003 2.276) 8.473 7.213 ( 2.936 -5.868 -0.307) 6.568 7.676 ( 2.991 -0.475 1.809) 3.528 7.896 ( 1.509 -1.100 0.975) 2.106 8.075 ( 4.460 1.250 -0.642) 4.676 8.535 ( 1.791 0.969 -4.734) 5.154 8.612 ( 8.338 -1.973 2.220) 8.851 8.738 ( 6.914 -2.290 0.891) 7.338 11.423 ( -20.064 12.356 0.221) 23.565 12.329 ( -24.005 -13.055 -0.972) 27.343 12.645 ( -12.717 6.276 0.210) 14.182 13.014 ( 2.665 4.962 0.273) 5.639 14.448 ( 35.279 30.312 0.570) 46.516 15.012 ( 41.234 19.388 -1.452) 45.588 16.531 ( 25.806 -12.237 4.726) 28.949 16.684 ( 12.237 -12.533 -1.592) 17.588 26.851 ( 0.089 -0.467 -0.489) 0.682 26.893 ( -0.139 -0.883 -0.108) 0.901 26.941 ( -0.698 -0.236 0.566) 0.929 26.991 ( -0.128 -1.381 0.161) 1.396 28.056 ( -0.931 1.113 -0.044) 1.452 28.099 ( -1.278 -0.078 0.132) 1.287 33.792 ( 0.029 1.598 -0.210) 1.612 33.858 ( -1.680 -1.147 0.024) 2.034 34.495 ( 6.299 1.004 1.286) 6.507 34.773 ( 4.310 2.266 -0.766) 4.929 35.617 ( 2.926 0.979 -3.300) 4.518 35.756 ( -0.172 1.063 4.982) 5.097 37.180 ( 0.006 -1.171 -1.200) 1.677 37.303 ( -0.688 -1.227 -0.228) 1.425 42.977 ( 39.587 28.838 -0.026) 48.977 43.877 ( 26.939 19.053 4.653) 33.322 44.725 ( 2.416 -5.895 7.883) 10.135 45.019 ( 9.983 -5.349 -3.143) 11.753 45.491 ( 7.346 -5.071 -0.657) 8.950 45.828 ( 17.704 4.663 -9.208) 20.493 46.343 ( 25.827 -4.476 10.127) 28.101 47.415 ( 12.517 -8.211 -2.554) 15.186 50.145 ( 18.655 18.455 1.085) 26.263 50.467 ( 14.447 4.877 0.010) 15.248 50.838 ( 19.712 -2.412 5.104) 20.505 53.416 ( 9.809 -30.830 -14.037) 35.267 61.858 ( -13.737 -3.771 -26.289) 29.901 63.181 ( -50.047 4.070 33.200) 60.195 67.267 ( 25.089 10.018 -11.073) 29.196 68.281 ( 11.068 -12.482 24.193) 29.387 ======================= Grid point 394 (188/204) ======================= q-point: ( 0.45 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.190 ( 9.082 -0.216 -0.828) 9.123 2.401 ( 13.312 -3.456 4.218) 14.386 2.673 ( 11.274 -1.935 7.006) 13.414 2.930 ( 10.863 -9.178 -0.124) 14.221 3.125 ( -6.078 2.516 -9.033) 11.174 3.506 ( 2.453 3.483 -2.076) 4.739 3.920 ( -4.036 -2.407 1.304) 4.877 4.038 ( -3.215 4.403 2.232) 5.891 4.101 ( 1.201 7.874 -0.234) 7.969 4.327 ( -1.575 2.364 5.318) 6.029 4.496 ( -4.210 5.046 -4.557) 7.997 4.721 ( -5.148 4.384 1.432) 6.912 5.207 ( -4.651 3.146 -3.161) 6.443 5.720 ( 14.796 7.698 0.426) 16.685 5.908 ( -1.140 -5.557 1.892) 5.980 6.009 ( -3.919 2.819 -1.903) 5.189 6.211 ( -1.163 -2.530 0.184) 2.790 6.523 ( -3.575 0.596 -0.496) 3.658 6.869 ( 1.488 2.294 -2.316) 3.583 6.976 ( 11.098 -0.714 0.907) 11.158 7.154 ( 1.461 -6.390 4.504) 7.953 7.347 ( 4.550 -5.080 -1.639) 7.014 7.715 ( -3.813 -3.185 2.449) 5.539 7.910 ( 6.244 4.206 -0.587) 7.551 8.102 ( 1.870 0.385 -0.644) 2.015 8.524 ( 3.638 1.918 -5.343) 6.742 8.692 ( 4.705 2.402 4.394) 6.871 8.845 ( 3.331 -1.773 -0.069) 3.774 11.075 ( -14.960 5.090 -0.361) 15.806 12.255 ( -23.530 -12.792 -0.443) 26.786 12.492 ( -2.329 1.926 0.278) 3.035 12.994 ( 7.077 5.078 -0.422) 8.720 14.404 ( 32.843 25.550 0.046) 41.611 15.163 ( 40.807 20.645 -0.757) 45.738 16.815 ( -3.417 -1.225 -3.428) 4.993 16.893 ( 11.080 -4.551 5.317) 13.105 26.860 ( 0.223 -0.489 -0.435) 0.692 26.905 ( -0.478 -0.941 0.037) 1.056 26.942 ( -0.304 -0.556 0.285) 0.695 27.007 ( -0.554 -1.091 0.219) 1.243 28.034 ( -0.401 0.781 -0.002) 0.878 28.086 ( -1.122 -0.028 0.073) 1.124 33.773 ( 0.570 1.218 0.106) 1.349 33.861 ( -1.456 -1.521 -0.353) 2.135 34.538 ( 4.850 2.166 1.758) 5.595 34.762 ( 2.329 3.681 -1.355) 4.562 35.626 ( 2.763 0.905 -3.960) 4.913 35.736 ( -0.936 2.111 4.800) 5.326 37.199 ( -0.063 -1.690 -0.441) 1.748 37.313 ( -0.911 -1.284 -0.429) 1.632 43.008 ( 36.930 23.321 -0.559) 43.681 43.895 ( 28.410 20.318 5.096) 35.298 44.749 ( -2.481 0.908 2.496) 3.634 45.140 ( 5.371 -0.874 -0.167) 5.444 45.630 ( 3.667 -2.640 1.854) 4.884 45.878 ( 13.099 8.338 -8.361) 17.636 46.681 ( 18.985 -1.717 3.470) 19.376 47.604 ( 6.023 -3.709 -0.705) 7.108 50.078 ( 15.061 15.033 -0.005) 21.280 50.566 ( 20.191 7.071 -1.914) 21.479 51.035 ( 8.501 3.608 4.944) 10.475 53.821 ( 4.490 -18.759 -5.495) 20.056 61.517 ( -44.663 -0.380 -13.953) 46.793 62.645 ( -51.549 -3.130 17.140) 54.414 67.466 ( 36.810 6.834 -13.501) 39.799 68.588 ( 7.814 -6.531 21.257) 23.571 ======================= Grid point 395 (189/204) ======================= q-point: ( 0.55 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.266 ( 7.103 2.485 4.447) 8.741 2.566 ( 11.097 1.905 4.159) 12.003 2.775 ( 6.854 3.987 1.037) 7.997 2.942 ( -4.915 8.630 -7.077) 12.195 3.177 ( 0.849 -11.686 -5.037) 12.753 3.497 ( 7.174 3.082 -0.826) 7.852 3.912 ( 5.875 4.935 -0.162) 7.675 3.944 ( -3.896 2.210 3.556) 5.719 4.039 ( -8.481 -1.725 2.544) 9.021 4.267 ( -1.255 4.047 1.405) 4.465 4.349 ( -4.805 3.071 1.933) 6.021 4.672 ( -1.339 -1.632 -4.097) 4.609 5.101 ( -4.497 2.440 -1.739) 5.404 5.715 ( -2.521 5.513 3.759) 7.133 5.903 ( 2.327 5.809 -5.461) 8.306 5.973 ( 0.963 -1.596 1.659) 2.495 6.230 ( -1.636 -2.753 -0.243) 3.211 6.465 ( -3.963 1.445 0.567) 4.256 6.845 ( 2.765 3.067 -2.091) 4.629 7.096 ( 9.233 1.151 0.508) 9.318 7.260 ( 0.818 -4.470 5.395) 7.054 7.409 ( -1.407 0.189 -0.589) 1.537 7.687 ( -5.463 -0.996 0.863) 5.619 7.921 ( 9.027 5.308 -2.377) 10.739 8.080 ( -3.504 1.262 0.127) 3.727 8.545 ( 6.036 1.123 -6.467) 8.917 8.682 ( 0.995 4.158 5.763) 7.176 8.807 ( -6.552 4.166 0.633) 7.790 10.991 ( -0.457 -5.983 -0.789) 6.052 12.187 ( -25.900 -14.391 -0.526) 29.634 12.552 ( 10.933 -3.033 0.900) 11.382 13.014 ( 10.652 4.900 -0.986) 11.767 14.395 ( 30.730 22.446 -0.109) 38.055 15.288 ( 40.388 22.282 -0.423) 46.129 16.613 ( -18.732 9.947 -1.401) 21.255 16.968 ( -3.132 2.396 2.721) 4.791 26.868 ( 0.291 -0.334 -0.360) 0.571 26.910 ( -0.876 -0.704 0.370) 1.184 26.953 ( 0.253 -0.757 -0.146) 0.812 27.013 ( -0.988 -0.671 0.219) 1.214 28.025 ( 0.198 0.189 0.027) 0.275 28.076 ( -0.971 -0.259 0.007) 1.005 33.770 ( 1.312 0.527 0.135) 1.421 33.869 ( -1.424 -1.811 -0.277) 2.320 34.544 ( 3.370 3.625 1.467) 5.162 34.706 ( 0.195 5.001 -1.292) 5.169 35.631 ( 2.258 0.860 -4.221) 4.864 35.697 ( -1.287 2.568 4.537) 5.370 37.227 ( 0.222 -1.794 0.151) 1.814 37.318 ( -1.107 -1.016 -0.496) 1.583 43.076 ( 34.420 20.252 -0.897) 39.946 43.914 ( 28.332 20.863 6.514) 35.783 44.706 ( -1.291 1.390 -1.528) 2.436 45.177 ( 2.362 1.914 1.733) 3.499 45.642 ( -0.333 4.181 3.457) 5.435 45.810 ( 1.499 9.903 -8.127) 12.899 46.822 ( 14.838 7.423 -1.143) 16.631 47.660 ( -0.102 0.960 0.628) 1.151 50.023 ( 11.261 11.379 -0.002) 16.009 50.697 ( 27.155 9.923 -4.659) 29.284 50.876 ( -8.871 15.501 3.496) 18.198 54.093 ( -2.561 -12.134 0.258) 12.404 60.896 ( -53.633 1.095 -2.608) 53.708 62.217 ( -49.600 -10.713 4.033) 50.904 67.774 ( 39.264 5.975 -12.931) 41.768 68.752 ( 3.337 -0.769 16.622) 16.971 ======================= Grid point 396 (190/204) ======================= q-point: (-0.36 0.18 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.299 ( 6.319 5.023 8.270) 11.557 2.578 ( 7.622 12.054 3.215) 14.619 2.705 ( -2.779 12.026 -6.190) 13.808 2.724 ( 1.262 8.800 -3.647) 9.609 3.280 ( -2.964 -5.410 -3.916) 7.307 3.541 ( 3.372 3.267 -1.049) 4.810 3.858 ( 1.312 6.148 0.519) 6.308 3.918 ( 6.839 4.997 5.133) 9.904 3.965 ( -8.579 -5.064 -3.351) 10.511 4.282 ( -1.984 -5.620 4.087) 7.227 4.321 ( 0.636 -2.194 2.575) 3.442 4.678 ( -3.255 -2.531 -6.979) 8.106 5.038 ( -2.005 0.540 0.673) 2.183 5.479 ( -20.658 6.814 1.962) 21.841 5.861 ( 11.049 9.493 -1.749) 14.672 5.998 ( 0.528 0.464 -0.205) 0.732 6.261 ( -0.341 -2.473 0.021) 2.496 6.397 ( -4.857 0.586 0.329) 4.904 6.833 ( 4.831 3.137 -2.315) 6.208 7.111 ( -1.000 4.064 1.639) 4.495 7.328 ( -0.542 -1.772 5.680) 5.974 7.346 ( -1.721 2.085 0.010) 2.704 7.677 ( 3.469 0.596 -2.749) 4.466 7.930 ( 8.009 5.180 -2.654) 9.900 8.001 ( -5.777 1.727 0.456) 6.047 8.488 ( -8.952 7.695 0.515) 11.816 8.644 ( 1.219 -0.224 -4.044) 4.229 8.686 ( -1.829 3.227 4.867) 6.119 11.204 ( 11.392 -12.180 -0.712) 16.692 12.114 ( -26.068 -14.516 -0.835) 29.849 12.799 ( 17.438 -6.173 2.653) 18.687 13.085 ( 13.325 2.501 -2.706) 13.825 14.398 ( 29.403 21.309 -0.236) 36.313 15.379 ( 40.136 25.114 0.340) 47.347 16.097 ( -32.887 18.529 -1.764) 37.788 16.760 ( -17.820 10.313 2.578) 20.750 26.875 ( 0.494 -0.182 -0.313) 0.612 26.909 ( -1.009 -0.435 0.621) 1.262 26.968 ( 0.532 -0.608 -0.482) 0.940 27.008 ( -1.200 -0.284 0.248) 1.258 28.033 ( 0.699 -0.509 0.067) 0.868 28.073 ( -0.875 -0.703 -0.064) 1.124 33.788 ( 2.186 -0.345 0.074) 2.214 33.881 ( -1.645 -1.969 -0.061) 2.566 34.509 ( 2.171 5.285 0.526) 5.738 34.611 ( -1.735 5.833 -0.609) 6.116 35.628 ( 1.121 1.306 -1.995) 2.635 35.656 ( -0.880 2.051 2.030) 3.016 37.257 ( 0.621 -1.298 0.478) 1.516 37.316 ( -1.179 -0.504 -0.459) 1.362 43.140 ( 32.022 20.296 -1.451) 37.940 43.896 ( 20.857 21.684 9.186) 31.458 44.674 ( 2.129 2.524 -6.330) 7.140 45.135 ( -3.187 4.435 3.478) 6.474 45.513 ( -5.659 10.517 -0.387) 11.949 45.573 ( -6.351 11.408 -3.551) 13.531 46.821 ( 17.926 14.699 -4.349) 23.586 47.563 ( -7.685 6.879 2.122) 10.530 49.984 ( 8.676 8.244 1.118) 12.020 50.470 ( -15.113 13.217 -2.220) 20.199 50.896 ( 42.907 16.613 -3.971) 46.182 53.927 ( -45.223 5.954 6.118) 46.021 60.472 ( -22.183 -6.640 0.523) 23.161 61.852 ( -50.744 -14.201 -1.305) 52.709 68.067 ( 34.617 6.966 -10.617) 36.872 68.763 ( -2.293 4.443 12.142) 13.131 ======================= Grid point 397 (191/204) ======================= q-point: (-0.27 0.18 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.264 ( 4.836 11.323 3.401) 12.773 2.384 ( -3.777 16.289 4.808) 17.399 2.490 ( 5.788 13.884 -1.649) 15.132 2.580 ( 1.260 11.898 -4.466) 12.771 3.268 ( -2.004 2.807 -1.074) 3.612 3.394 ( -8.073 8.574 -3.167) 12.195 3.890 ( 11.839 0.041 1.470) 11.930 3.928 ( 4.887 3.557 7.679) 9.772 3.990 ( -1.032 -4.183 -7.724) 8.844 4.334 ( -6.072 -2.766 2.492) 7.123 4.421 ( -0.550 -6.394 3.980) 7.552 4.570 ( -12.656 0.669 -8.530) 15.277 5.051 ( 1.458 -2.271 4.072) 4.885 5.193 ( -11.838 1.795 -1.172) 12.030 5.832 ( 8.732 8.684 -0.261) 12.317 5.947 ( -2.269 5.333 -0.340) 5.806 6.291 ( 1.191 -1.214 -0.249) 1.719 6.356 ( -4.775 -2.170 0.526) 5.271 6.855 ( 7.119 1.898 -2.878) 7.910 7.008 ( -6.467 2.588 3.136) 7.639 7.310 ( 0.747 2.209 -0.497) 2.384 7.335 ( -1.268 1.373 2.981) 3.519 7.709 ( 7.335 3.003 -3.647) 8.725 7.871 ( -7.134 3.663 3.400) 8.710 7.979 ( 9.253 2.174 -4.254) 10.413 8.243 ( -13.899 4.773 2.566) 14.918 8.651 ( -0.024 1.619 4.340) 4.633 8.661 ( 1.091 0.051 -4.570) 4.699 11.567 ( 17.456 -13.293 -0.071) 21.941 12.046 ( -24.561 -14.031 -1.170) 28.310 13.077 ( 19.341 -0.086 5.724) 20.171 13.231 ( 9.209 -5.584 -6.206) 12.430 14.400 ( 29.542 21.400 -0.552) 36.483 15.236 ( -23.690 31.846 6.418) 40.207 15.508 ( 20.642 21.229 -8.056) 30.686 16.266 ( -31.642 18.768 3.524) 36.958 26.884 ( 0.852 -0.072 -0.381) 0.936 26.904 ( -1.043 -0.144 0.743) 1.289 26.980 ( 0.686 -0.257 -0.751) 1.049 26.998 ( -1.119 -0.038 0.449) 1.206 28.056 ( 0.984 -1.150 0.137) 1.520 28.078 ( -0.873 -1.202 -0.141) 1.492 33.830 ( 3.043 -1.251 -0.054) 3.291 33.891 ( -2.237 -2.046 0.153) 3.036 34.437 ( 1.775 6.654 -0.458) 6.902 34.491 ( -3.071 6.177 0.220) 6.902 35.607 ( -0.309 1.971 4.842) 5.237 35.626 ( 0.098 1.076 -4.895) 5.013 37.279 ( 0.868 -0.223 0.408) 0.985 37.305 ( -1.095 0.262 -0.277) 1.159 43.152 ( 29.429 22.861 -2.482) 37.348 43.664 ( -6.419 25.286 9.587) 27.794 44.644 ( 12.657 8.802 -10.771) 18.807 44.963 ( -12.953 6.283 4.495) 15.082 45.279 ( 1.205 10.091 -3.450) 10.733 45.372 ( -6.281 7.845 1.911) 10.230 46.777 ( 23.685 19.579 -6.511) 31.412 47.269 ( -18.399 14.327 4.782) 23.805 49.978 ( 8.059 5.199 3.031) 10.058 50.178 ( -9.487 5.732 -3.935) 11.762 51.148 ( 59.342 23.655 -7.649) 64.340 52.905 ( -87.529 27.846 11.865) 92.615 60.637 ( 19.045 -14.285 0.760) 23.819 61.509 ( -49.199 -15.129 -3.105) 51.566 68.269 ( 26.284 8.741 -8.144) 28.872 68.623 ( -9.149 8.653 8.635) 15.269 ======================= Grid point 398 (192/204) ======================= q-point: (-0.18 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 187 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.078 ( 4.068 17.754 -7.216) 19.592 2.078 ( -4.068 17.754 7.216) 19.592 2.363 ( -1.424 13.305 -9.865) 16.624 2.363 ( 1.424 13.305 9.865) 16.624 3.163 ( -2.498 10.884 -3.994) 11.860 3.163 ( 2.498 10.884 3.994) 11.860 3.964 ( -8.198 4.958 -7.459) 12.142 3.964 ( 8.198 4.958 7.459) 12.142 4.091 ( -16.325 -3.336 -3.197) 16.966 4.091 ( 16.325 -3.336 3.197) 16.966 4.554 ( -3.427 -6.730 -4.256) 8.669 4.554 ( 3.427 -6.730 4.256) 8.669 5.150 ( -2.648 -5.110 -5.543) 7.990 5.150 ( 2.648 -5.110 5.543) 7.990 5.789 ( -2.769 7.985 -3.033) 8.979 5.789 ( 2.769 7.985 3.033) 8.979 6.340 ( 1.914 -1.537 -2.137) 3.254 6.340 ( -1.914 -1.537 2.137) 3.254 6.916 ( 4.513 0.167 -2.797) 5.312 6.916 ( -4.513 0.167 2.797) 5.312 7.288 ( 1.158 2.124 -1.934) 3.098 7.288 ( -1.158 2.124 1.934) 3.098 7.723 ( 5.525 5.067 -3.162) 8.137 7.723 ( -5.525 5.067 3.162) 8.137 8.077 ( -1.684 -0.471 -2.968) 3.445 8.077 ( 1.684 -0.471 2.968) 3.445 8.645 ( -0.272 0.871 -7.002) 7.061 8.645 ( 0.272 0.871 7.002) 7.061 11.992 ( -18.464 -13.362 -3.519) 23.062 11.992 ( 18.464 -13.362 3.519) 23.062 13.269 ( -12.616 3.182 -9.443) 16.076 13.269 ( 12.616 3.182 9.443) 16.076 14.404 ( -28.715 22.046 0.612) 36.207 14.404 ( 28.715 22.046 -0.612) 36.207 15.509 ( -28.334 27.534 -1.239) 39.528 15.509 ( 28.334 27.534 1.239) 39.528 26.893 ( 0.694 0.202 -0.764) 1.051 26.893 ( -0.694 0.202 0.764) 1.051 26.988 ( 0.712 0.014 -1.298) 1.480 26.988 ( -0.712 0.014 1.298) 1.480 28.089 ( 0.065 -1.576 -1.805) 2.397 28.089 ( -0.065 -1.576 1.805) 2.397 33.892 ( -0.161 -1.960 -3.180) 3.740 33.892 ( 0.161 -1.960 3.180) 3.740 34.358 ( -2.179 6.500 -0.090) 6.856 34.358 ( 2.179 6.500 0.090) 6.856 35.594 ( 0.202 1.323 -7.971) 8.083 35.594 ( -0.202 1.323 7.971) 8.083 37.282 ( -0.638 1.187 -0.276) 1.375 37.282 ( 0.638 1.187 0.276) 1.375 43.075 ( -5.949 25.683 -8.268) 27.629 43.075 ( 5.949 25.683 8.268) 27.629 44.666 ( 2.257 12.219 -10.232) 16.096 44.666 ( -2.257 12.219 10.232) 16.096 45.206 ( -2.029 4.873 -1.471) 5.479 45.206 ( 2.029 4.873 1.471) 5.479 46.724 ( 1.375 23.171 -17.259) 28.925 46.724 ( -1.375 23.171 17.259) 28.925 50.023 ( -6.224 2.358 -6.985) 9.649 50.023 ( 6.224 2.358 6.985) 9.649 51.453 ( -32.873 33.891 -15.857) 49.806 51.453 ( 32.873 33.891 15.857) 49.806 61.221 ( -40.135 -14.742 -2.818) 42.850 61.221 ( 40.135 -14.742 2.818) 42.850 68.343 ( 4.865 10.895 -19.953) 23.249 68.343 ( -4.865 10.895 19.953) 23.249 ======================= Grid point 404 (193/204) ======================= q-point: ( 0.27 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.017 ( 13.532 0.000 -6.812) 15.150 2.122 ( 20.606 0.000 2.316) 20.736 2.403 ( 12.320 0.000 10.972) 16.497 2.524 ( 8.886 0.000 1.765) 9.059 3.250 ( 2.233 0.000 1.438) 2.656 3.525 ( -3.199 -0.000 -1.972) 3.758 3.859 ( 8.679 0.000 -7.842) 11.697 4.190 ( -11.963 -0.000 4.209) 12.682 4.387 ( -1.712 -0.000 11.989) 12.110 4.432 ( 0.033 0.000 -13.393) 13.393 4.813 ( 0.222 0.000 -2.605) 2.614 5.002 ( -10.650 -0.000 7.595) 13.081 5.257 ( 14.634 0.000 -0.286) 14.636 5.572 ( -2.060 -0.000 -4.677) 5.111 5.943 ( 14.239 0.000 2.241) 14.414 5.962 ( 12.981 0.000 1.811) 13.106 6.152 ( -6.626 -0.000 -1.370) 6.766 6.527 ( -2.333 -0.000 -4.222) 4.824 6.764 ( 1.043 0.000 5.055) 5.161 6.900 ( 5.382 0.000 -3.260) 6.292 6.997 ( 6.043 0.000 -1.300) 6.181 7.067 ( 0.567 0.000 -0.038) 0.568 7.694 ( -4.247 -0.000 5.272) 6.770 7.846 ( 12.325 0.000 -2.362) 12.549 8.122 ( 4.082 0.000 1.522) 4.357 8.467 ( 6.180 0.000 -5.463) 8.248 8.661 ( 5.000 0.000 -1.307) 5.168 8.679 ( 8.238 0.000 4.101) 9.202 11.785 ( -23.251 -0.000 4.214) 23.630 11.945 ( -24.415 -0.000 -4.679) 24.860 12.819 ( -10.938 -0.000 -2.815) 11.294 12.991 ( -12.810 -0.000 3.347) 13.240 15.266 ( 30.717 0.000 10.542) 32.476 15.350 ( 36.274 0.000 -12.516) 38.372 16.236 ( 29.005 0.000 -15.504) 32.889 16.317 ( 35.500 0.000 21.205) 41.351 26.843 ( -0.037 -0.000 -0.500) 0.502 26.878 ( -0.141 -0.000 -0.016) 0.142 26.950 ( -0.326 -0.000 1.916) 1.944 26.954 ( -0.059 -0.000 -1.244) 1.245 28.085 ( -0.884 -0.000 -1.998) 2.185 28.088 ( -1.683 -0.000 2.098) 2.689 33.826 ( 0.189 0.000 -4.239) 4.243 33.834 ( -2.480 -0.000 4.237) 4.910 34.512 ( 7.271 0.000 1.129) 7.358 34.807 ( 4.591 0.000 -0.727) 4.648 35.637 ( 2.539 0.000 -2.383) 3.482 35.766 ( 0.307 0.000 4.867) 4.877 37.166 ( 0.645 0.000 -1.934) 2.038 37.278 ( -1.154 -0.000 0.044) 1.155 43.904 ( 30.264 0.000 -9.580) 31.744 44.005 ( 32.773 0.000 13.536) 35.458 44.457 ( 12.276 0.000 14.228) 18.792 44.845 ( 17.758 0.000 -6.960) 19.073 45.423 ( 1.413 0.000 -3.561) 3.832 45.796 ( 13.203 0.000 -6.178) 14.576 46.463 ( 30.789 0.000 16.372) 34.871 47.217 ( 21.048 0.000 -7.427) 22.320 50.420 ( 11.161 0.000 -4.021) 11.863 50.687 ( 17.558 0.000 19.718) 26.403 50.954 ( 31.297 0.000 0.028) 31.297 52.612 ( 31.994 0.000 -28.373) 42.763 61.790 ( -11.730 -0.000 -30.017) 32.228 63.255 ( -57.790 -0.000 38.109) 69.224 67.520 ( 19.051 0.000 -32.798) 37.930 67.976 ( 16.954 0.000 52.502) 55.172 ======================= Grid point 405 (194/204) ======================= q-point: ( 0.36 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.163 ( 13.210 -0.617 -3.216) 13.609 2.348 ( 18.548 0.275 1.161) 18.586 2.564 ( 7.676 -3.343 9.881) 12.951 2.652 ( 5.616 -5.608 1.423) 8.064 3.249 ( -0.116 2.510 -2.143) 3.302 3.515 ( 1.292 -1.817 -2.873) 3.637 3.896 ( 1.669 1.199 -7.147) 7.436 4.080 ( -7.973 1.111 7.836) 11.234 4.364 ( -3.083 2.890 2.004) 4.677 4.391 ( 1.266 1.490 -4.732) 5.120 4.712 ( -1.406 8.795 -1.288) 8.999 4.888 ( -9.537 2.305 5.813) 11.404 5.326 ( 3.788 6.125 -3.680) 8.088 5.643 ( 0.938 -9.794 -1.560) 9.962 5.940 ( 0.160 5.109 3.319) 6.095 6.077 ( -0.085 -0.936 -0.488) 1.059 6.146 ( 5.460 0.567 0.230) 5.494 6.502 ( -2.758 -1.277 -3.334) 4.512 6.858 ( 6.082 -2.948 3.336) 7.537 6.980 ( 7.535 -2.175 -2.916) 8.367 7.024 ( 7.987 3.120 0.413) 8.585 7.173 ( 6.906 -5.522 -0.410) 8.852 7.655 ( -4.903 -0.669 4.423) 6.637 8.001 ( 16.038 1.589 -2.327) 16.284 8.145 ( 2.229 1.837 1.669) 3.336 8.545 ( 5.708 -1.540 -6.475) 8.769 8.713 ( 7.850 0.598 0.939) 7.929 8.789 ( 6.132 -1.175 3.479) 7.147 11.360 ( -24.614 12.411 0.722) 27.576 11.813 ( -27.791 -14.674 -1.051) 31.445 12.649 ( -5.948 6.532 -0.554) 8.852 12.940 ( -6.934 -5.644 0.595) 8.961 15.337 ( 31.399 27.418 1.982) 41.732 15.654 ( 32.259 8.665 -4.586) 33.716 16.593 ( 18.804 -9.681 -8.864) 22.932 16.743 ( 20.469 -5.135 13.666) 25.141 26.845 ( 0.205 -0.329 -0.476) 0.614 26.880 ( -0.273 -0.493 0.030) 0.565 26.940 ( -0.183 0.476 0.345) 0.616 26.969 ( -0.243 -1.281 0.244) 1.326 28.061 ( -0.895 0.859 -0.207) 1.258 28.081 ( -1.273 -0.373 0.319) 1.365 33.807 ( -0.692 0.849 0.208) 1.115 33.827 ( -1.209 -0.690 -0.383) 1.444 34.587 ( 6.437 0.905 2.023) 6.808 34.839 ( 3.072 1.236 -1.626) 3.689 35.654 ( 2.645 0.641 -2.725) 3.851 35.773 ( -0.579 0.422 4.420) 4.477 37.170 ( 0.542 -0.233 -1.380) 1.501 37.272 ( -1.369 -1.017 -0.120) 1.710 43.865 ( 30.614 27.914 -1.504) 41.457 44.349 ( 19.764 7.386 6.266) 22.010 44.655 ( 2.674 -7.432 7.467) 10.869 45.068 ( 12.842 -3.147 -6.070) 14.549 45.499 ( 8.468 -4.126 -0.128) 9.420 45.953 ( 11.044 -3.572 -7.840) 14.007 46.770 ( 30.334 7.025 13.952) 34.120 47.456 ( 14.595 -4.723 -5.368) 16.253 50.513 ( 14.399 6.840 -3.707) 16.366 50.875 ( 18.026 6.961 16.478) 25.395 51.184 ( 37.576 14.367 -2.622) 40.314 53.102 ( 19.275 -24.304 -15.727) 34.778 61.490 ( -31.928 -1.010 -25.462) 40.850 62.612 ( -67.209 0.190 29.260) 73.303 67.661 ( 30.244 5.184 -31.074) 43.671 68.334 ( 10.791 -7.570 46.602) 48.430 ======================= Grid point 406 (195/204) ======================= q-point: ( 0.45 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.301 ( 11.109 0.502 0.444) 11.129 2.538 ( 14.044 -1.162 2.058) 14.242 2.719 ( 4.099 -5.456 5.670) 8.873 2.818 ( 2.596 -8.927 -0.314) 9.302 3.172 ( -0.496 4.791 -3.918) 6.209 3.583 ( 5.387 -1.947 -2.987) 6.460 3.822 ( -5.465 2.883 -3.216) 6.966 4.012 ( -5.240 1.502 7.685) 9.422 4.271 ( 0.708 6.094 -3.443) 7.035 4.391 ( 3.652 1.489 -0.669) 4.000 4.542 ( -5.413 8.195 0.271) 9.825 4.752 ( -5.174 5.367 3.772) 8.355 5.222 ( -1.362 6.179 -4.303) 7.651 5.759 ( -7.556 -6.130 0.816) 9.764 5.865 ( 0.695 1.928 -0.028) 2.050 6.113 ( 3.923 -0.771 -1.309) 4.207 6.150 ( 0.898 2.971 1.615) 3.499 6.479 ( -3.384 -0.640 -1.002) 3.587 6.924 ( 4.796 1.729 -2.461) 5.661 7.092 ( 8.756 -0.674 2.989) 9.277 7.135 ( 6.919 -3.790 0.185) 7.891 7.338 ( 6.952 -3.922 0.527) 7.999 7.629 ( -3.725 -1.639 2.470) 4.760 8.103 ( 10.853 6.269 0.140) 12.534 8.136 ( 3.243 2.022 -0.977) 3.944 8.591 ( 6.547 1.475 -7.102) 9.771 8.792 ( 4.659 1.760 4.763) 6.891 8.861 ( 2.370 -0.475 1.244) 2.719 10.971 ( -16.783 5.192 -0.439) 17.574 11.728 ( -28.011 -15.333 -0.065) 31.933 12.548 ( 2.488 2.998 -0.001) 3.896 12.969 ( -4.315 -5.723 -0.165) 7.169 15.261 ( 33.644 29.155 0.675) 44.523 15.831 ( 30.701 12.284 -3.077) 33.210 16.782 ( 1.869 0.451 -2.707) 3.320 16.974 ( 8.749 -0.949 6.136) 10.728 26.854 ( 0.349 -0.495 -0.433) 0.745 26.886 ( -0.505 -0.731 0.085) 0.892 26.937 ( 0.128 -0.111 0.208) 0.268 26.983 ( -0.653 -1.143 0.245) 1.339 28.041 ( -0.391 0.719 -0.073) 0.822 28.072 ( -1.152 -0.150 0.160) 1.173 33.791 ( -0.179 0.674 0.664) 0.963 33.826 ( -1.020 -0.964 -0.890) 1.662 34.635 ( 5.223 2.192 2.472) 6.180 34.829 ( 1.350 2.732 -2.156) 3.733 35.664 ( 2.669 1.045 -3.219) 4.310 35.760 ( -1.319 1.287 4.197) 4.584 37.182 ( 0.612 -0.856 -0.652) 1.238 37.275 ( -1.521 -1.508 -0.314) 2.165 43.800 ( 30.455 24.399 -1.254) 39.044 44.406 ( 16.589 12.194 6.628) 21.629 44.735 ( 0.767 -0.684 1.867) 2.131 45.173 ( 4.453 -1.183 -2.808) 5.396 45.658 ( 7.612 -1.927 2.946) 8.386 46.046 ( 5.077 2.178 -8.592) 10.215 47.017 ( 26.414 6.386 7.816) 28.277 47.625 ( 6.990 -2.512 -3.180) 8.080 50.486 ( 13.543 15.703 -0.993) 20.761 50.992 ( 18.727 7.965 4.326) 20.806 51.359 ( 34.100 17.702 1.049) 38.435 53.581 ( 9.387 -19.945 -6.665) 23.029 60.982 ( -46.124 2.991 -14.411) 48.415 61.959 ( -63.596 -5.457 16.801) 66.004 67.904 ( 35.300 2.770 -27.916) 45.090 68.625 ( 3.705 -6.457 36.937) 37.680 ======================= Grid point 407 (196/204) ======================= q-point: ( 0.55 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.394 ( 8.429 2.107 4.742) 9.898 2.701 ( 8.321 -1.486 1.476) 8.580 2.823 ( 0.319 -2.864 0.986) 3.046 2.922 ( 0.210 -1.763 -5.212) 5.506 3.138 ( 4.849 -0.330 -1.090) 4.981 3.649 ( 3.097 -0.121 -2.498) 3.981 3.717 ( -7.091 -0.283 0.219) 7.100 3.933 ( -6.986 1.922 5.640) 9.182 4.199 ( 4.835 6.045 -3.743) 8.598 4.344 ( -4.114 6.641 -2.962) 8.354 4.421 ( 5.743 5.125 5.151) 9.262 4.649 ( -2.581 2.550 0.663) 3.689 5.116 ( 0.383 5.130 -3.175) 6.046 5.633 ( -15.947 2.445 1.789) 16.232 5.927 ( 4.068 -3.160 -2.525) 5.737 6.105 ( -1.279 2.669 1.731) 3.429 6.172 ( 5.590 -0.164 -1.184) 5.716 6.435 ( -4.415 0.702 0.564) 4.506 6.935 ( 5.955 3.362 -3.271) 7.581 7.191 ( 4.380 0.154 0.784) 4.452 7.247 ( 3.708 -2.750 3.836) 6.003 7.386 ( -3.808 -0.038 2.972) 4.830 7.663 ( 5.900 -1.051 -1.959) 6.305 8.053 ( -4.829 2.944 2.657) 6.249 8.154 ( 12.882 8.095 -3.910) 15.708 8.629 ( 7.558 2.004 -7.388) 10.757 8.763 ( -4.023 5.928 5.973) 9.328 8.806 ( -5.048 4.221 1.846) 6.834 10.894 ( 1.420 -6.843 -0.916) 7.049 11.657 ( -26.618 -15.384 0.190) 30.745 12.623 ( 10.089 -3.242 0.339) 10.603 13.012 ( -3.718 -5.861 -0.449) 6.955 15.216 ( 35.883 27.857 0.613) 45.431 15.961 ( 27.393 12.514 -3.463) 30.315 16.608 ( -11.349 14.304 1.302) 18.306 16.982 ( -4.599 4.741 1.989) 6.898 26.865 ( 0.414 -0.462 -0.372) 0.724 26.890 ( -0.769 -0.700 0.228) 1.065 26.947 ( 0.579 -0.587 -0.023) 0.825 26.990 ( -1.066 -0.848 0.235) 1.382 28.032 ( 0.196 0.336 -0.018) 0.389 28.062 ( -1.035 -0.138 0.063) 1.047 33.788 ( 0.606 0.206 0.501) 0.813 33.830 ( -1.084 -1.291 -0.659) 1.810 34.647 ( 3.936 3.666 2.316) 5.856 34.775 ( -0.368 4.338 -2.146) 4.854 35.667 ( 2.470 1.343 -3.751) 4.688 35.726 ( -1.726 2.019 4.193) 4.963 37.208 ( 0.946 -1.504 -0.001) 1.776 37.280 ( -1.675 -1.562 -0.465) 2.337 43.794 ( 30.370 20.748 -1.624) 36.817 44.382 ( 7.508 11.364 7.679) 15.635 44.754 ( 7.792 3.302 -2.320) 8.775 45.203 ( -0.715 0.177 0.409) 0.843 45.715 ( 2.697 3.419 4.297) 6.118 45.949 ( -2.470 9.587 -7.890) 12.659 47.182 ( 21.794 8.906 2.161) 23.643 47.672 ( -0.119 0.874 -1.262) 1.540 50.371 ( 11.970 16.902 -0.067) 20.711 50.928 ( -7.157 13.320 -0.545) 15.131 51.496 ( 53.408 23.300 0.760) 58.274 53.822 ( -13.226 -10.518 -1.559) 16.970 60.422 ( -33.444 2.714 -4.372) 33.837 61.446 ( -56.818 -11.522 5.991) 58.283 68.202 ( 33.393 1.727 -23.672) 40.968 68.780 ( -2.924 -3.079 27.790) 28.113 ======================= Grid point 408 (197/204) ======================= q-point: (-0.36 0.27 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.459 ( 7.834 3.218 8.023) 11.666 2.679 ( -7.478 3.055 -6.015) 10.071 2.845 ( 4.630 5.122 3.364) 7.680 2.881 ( 3.009 7.695 -5.488) 9.919 3.257 ( 8.981 -3.226 0.328) 9.548 3.588 ( -13.754 0.540 -1.457) 13.841 3.718 ( 3.022 -2.941 0.280) 4.226 3.844 ( -6.337 -0.279 1.858) 6.609 4.187 ( 6.864 2.705 -3.029) 7.975 4.248 ( -1.110 1.263 -0.281) 1.705 4.412 ( 8.765 7.899 7.903) 14.202 4.606 ( -3.706 0.145 -4.610) 5.917 5.071 ( 4.833 3.797 -1.297) 6.281 5.360 ( -19.129 6.883 1.160) 20.363 6.003 ( 3.509 -1.464 -2.830) 4.740 6.054 ( -0.073 3.575 2.172) 4.184 6.235 ( 4.508 -0.804 -0.609) 4.620 6.361 ( -5.571 1.646 0.579) 5.838 6.946 ( 7.511 3.762 -3.525) 9.110 7.127 ( -8.141 4.363 3.176) 9.767 7.327 ( 1.914 -1.550 5.214) 5.766 7.361 ( 0.200 0.264 -1.560) 1.595 7.750 ( 9.252 0.633 -3.245) 9.825 7.944 ( -8.103 2.108 2.705) 8.799 8.163 ( 13.750 8.761 -4.020) 16.792 8.494 ( -14.960 10.221 2.421) 18.279 8.673 ( 4.785 1.373 -6.590) 8.259 8.729 ( -2.462 3.265 6.344) 7.547 11.156 ( 14.933 -13.202 -0.750) 19.946 11.604 ( -24.200 -14.947 0.196) 28.445 12.850 ( 12.783 -8.125 1.071) 15.185 13.063 ( -4.653 -7.159 -1.068) 8.605 15.213 ( 38.305 27.195 0.633) 46.981 15.959 ( -12.721 12.362 -5.821) 18.669 16.198 ( 13.965 26.113 4.404) 29.938 16.726 ( -18.915 12.010 0.982) 22.428 26.876 ( 0.594 -0.403 -0.362) 0.804 26.891 ( -0.884 -0.576 0.392) 1.126 26.965 ( 0.878 -0.655 -0.260) 1.127 26.988 ( -1.218 -0.585 0.267) 1.377 28.035 ( 0.680 -0.189 0.025) 0.707 28.054 ( -0.951 -0.360 -0.014) 1.017 33.802 ( 1.440 -0.550 0.271) 1.565 33.836 ( -1.437 -1.451 -0.320) 2.067 34.621 ( 2.830 5.202 1.620) 6.140 34.681 ( -1.707 5.673 -1.587) 6.134 35.660 ( 2.010 1.625 -3.988) 4.752 35.683 ( -1.731 2.215 4.100) 4.972 37.246 ( 1.281 -1.611 0.452) 2.107 37.283 ( -1.653 -1.401 -0.567) 2.240 43.823 ( 29.497 19.285 -2.693) 35.344 44.236 ( -6.479 12.369 7.529) 15.863 44.809 ( 14.447 4.925 -4.160) 15.820 45.125 ( -10.159 3.671 2.840) 11.169 45.634 ( -0.449 9.466 2.396) 9.775 45.698 ( -4.829 13.111 -5.024) 14.848 47.256 ( 20.015 11.654 -1.460) 23.207 47.575 ( -8.580 6.055 0.796) 10.532 50.256 ( 10.378 14.143 0.702) 17.557 50.534 ( -14.188 16.934 -1.078) 22.118 51.849 ( 70.111 22.034 -3.097) 73.557 53.443 ( -59.706 8.493 3.043) 60.384 60.293 ( 8.102 -7.194 -0.927) 10.874 61.050 ( -50.597 -14.053 1.333) 52.529 68.459 ( 26.764 3.103 -18.358) 32.603 68.778 ( -9.947 1.306 19.687) 22.096 ======================= Grid point 409 (198/204) ======================= q-point: (-0.27 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 187 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.492 ( -5.153 7.425 -9.184) 12.885 2.492 ( 5.153 7.425 9.184) 12.885 2.741 ( 1.098 11.360 -2.321) 11.647 2.741 ( -1.098 11.360 2.321) 11.647 3.383 ( -9.173 4.084 -4.601) 11.045 3.383 ( 9.173 4.084 4.601) 11.045 3.835 ( 0.494 -6.014 -7.665) 9.755 3.835 ( -0.494 -6.014 7.665) 9.755 4.238 ( 7.176 -0.124 -4.958) 8.723 4.238 ( -7.176 -0.124 4.958) 8.723 4.449 ( -12.176 4.686 -8.272) 15.448 4.449 ( 12.176 4.686 8.272) 15.448 5.102 ( -6.412 2.580 -3.059) 7.559 5.102 ( 6.412 2.580 3.059) 7.559 6.001 ( 1.244 4.519 -4.956) 6.822 6.001 ( -1.244 4.519 4.956) 6.822 6.292 ( -3.275 -0.723 -0.342) 3.371 6.292 ( 3.275 -0.723 0.342) 3.371 6.974 ( 4.698 3.348 -3.187) 6.590 6.974 ( -4.698 3.348 3.187) 6.590 7.349 ( 0.639 1.097 -3.770) 3.978 7.349 ( -0.639 1.097 3.770) 3.978 7.827 ( 2.874 1.693 -2.680) 4.279 7.827 ( -2.874 1.693 2.680) 4.279 8.185 ( -6.950 7.695 -0.220) 10.371 8.185 ( 6.950 7.695 0.220) 10.371 8.678 ( 2.625 1.557 -6.935) 7.577 8.678 ( -2.625 1.557 6.935) 7.577 11.573 ( -17.224 -14.145 -2.495) 22.427 11.573 ( 17.224 -14.145 2.495) 22.427 13.115 ( -6.337 -8.776 -4.248) 11.629 13.115 ( 6.337 -8.776 4.248) 11.629 15.241 ( -40.536 27.637 -0.489) 49.063 15.241 ( 40.536 27.637 0.489) 49.063 16.202 ( -28.854 18.983 -0.621) 34.544 16.202 ( 28.854 18.983 0.621) 34.544 26.889 ( 0.562 -0.368 -0.487) 0.829 26.889 ( -0.562 -0.368 0.487) 0.829 26.983 ( 0.273 -0.392 -1.027) 1.132 26.983 ( -0.273 -0.392 1.027) 1.132 28.052 ( 0.109 -0.744 -1.624) 1.790 28.052 ( -0.109 -0.744 1.624) 1.790 33.838 ( 0.295 -1.431 -3.644) 3.926 33.838 ( -0.295 -1.431 3.644) 3.926 34.562 ( -0.988 6.424 -1.987) 6.796 34.562 ( 0.988 6.424 1.987) 6.796 35.643 ( 1.505 1.868 -6.421) 6.854 35.643 ( -1.505 1.868 6.421) 6.854 37.283 ( -1.258 -0.981 -0.667) 1.729 37.283 ( 1.258 -0.981 0.667) 1.729 43.826 ( -14.382 20.715 -0.887) 25.234 43.826 ( 14.382 20.715 0.887) 25.234 44.895 ( -2.536 5.516 -2.175) 6.449 44.895 ( 2.536 5.516 2.175) 6.449 45.471 ( 2.982 11.405 -5.589) 13.046 45.471 ( -2.982 11.405 5.589) 13.046 47.278 ( 0.063 13.275 -16.192) 20.938 47.278 ( -0.063 13.275 16.192) 20.938 50.184 ( -8.203 9.996 -3.291) 13.343 50.184 ( 8.203 9.996 3.291) 13.343 52.351 ( -51.176 23.792 -13.925) 58.128 52.351 ( 51.176 23.792 13.925) 58.128 60.758 ( -36.664 -14.511 -2.282) 39.497 60.758 ( 36.664 -14.511 2.282) 39.497 68.607 ( 10.291 5.714 -28.655) 30.978 68.607 ( -10.291 5.714 28.655) 30.978 ======================= Grid point 417 (199/204) ======================= q-point: ( 0.36 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.308 ( 13.735 0.000 -1.327) 13.799 2.541 ( 12.999 0.000 -5.913) 14.280 2.593 ( 0.321 0.000 9.275) 9.280 2.677 ( 6.912 0.000 6.726) 9.644 3.254 ( -2.483 -0.000 -2.975) 3.875 3.513 ( 3.302 0.000 -3.014) 4.471 3.904 ( 0.678 0.000 -11.373) 11.393 4.050 ( -3.454 -0.000 12.798) 13.256 4.373 ( -2.425 -0.000 10.069) 10.356 4.385 ( 1.528 0.000 -11.641) 11.741 4.761 ( -3.447 -0.000 -4.272) 5.489 4.762 ( -13.118 -0.000 5.716) 14.309 5.473 ( -4.005 -0.000 -2.167) 4.554 5.521 ( 5.970 0.000 -1.029) 6.058 5.909 ( -5.816 -0.000 0.034) 5.816 6.057 ( -2.879 -0.000 3.654) 4.652 6.248 ( 6.691 0.000 -0.290) 6.698 6.457 ( -2.069 -0.000 -3.266) 3.867 6.940 ( 9.276 0.000 3.019) 9.755 7.041 ( 8.806 0.000 -5.627) 10.450 7.117 ( 3.636 0.000 -0.299) 3.649 7.250 ( 12.460 0.000 3.478) 12.936 7.607 ( -3.093 -0.000 3.183) 4.438 8.162 ( 0.449 0.000 1.303) 1.378 8.247 ( 20.369 0.000 -1.706) 20.441 8.596 ( 8.016 0.000 -6.373) 10.241 8.793 ( 6.685 0.000 -1.688) 6.895 8.855 ( 4.290 0.000 6.480) 7.771 11.254 ( -24.391 -0.000 4.263) 24.760 11.297 ( -28.677 -0.000 -4.483) 29.025 12.663 ( -2.815 -0.000 -0.552) 2.869 12.807 ( -5.222 -0.000 0.442) 5.241 15.874 ( 18.774 0.000 9.863) 21.207 15.951 ( 22.078 0.000 -12.992) 25.617 16.730 ( 20.385 0.000 -7.137) 21.598 16.955 ( 15.725 0.000 11.621) 19.553 26.845 ( 0.406 0.000 -0.452) 0.607 26.873 ( -0.313 -0.000 0.124) 0.337 26.949 ( 0.089 0.000 -1.179) 1.182 26.951 ( -0.387 -0.000 1.618) 1.664 28.060 ( -0.510 -0.000 -1.813) 1.884 28.063 ( -1.311 -0.000 1.925) 2.329 33.804 ( -1.943 -0.000 4.436) 4.843 33.809 ( 0.191 0.000 -4.638) 4.642 34.670 ( 5.796 0.000 2.781) 6.429 34.870 ( 1.689 0.000 -2.429) 2.958 35.682 ( 2.592 0.000 -2.720) 3.757 35.777 ( -1.097 -0.000 4.008) 4.156 37.173 ( 0.724 0.000 -1.332) 1.516 37.247 ( -1.581 -0.000 0.107) 1.584 44.312 ( 11.617 0.000 -6.391) 13.259 44.533 ( 4.810 0.000 10.458) 11.511 44.734 ( 15.179 0.000 7.425) 16.897 45.158 ( 7.890 0.000 -8.441) 11.554 45.606 ( 16.450 0.000 0.834) 16.471 46.009 ( 7.848 0.000 -6.195) 9.998 47.153 ( 21.909 0.000 15.074) 26.594 47.565 ( 12.828 0.000 -8.200) 15.225 50.750 ( 19.476 0.000 -7.613) 20.911 51.091 ( 9.356 0.000 19.071) 21.243 51.846 ( 47.250 0.000 -0.120) 47.250 53.110 ( 22.588 0.000 -13.995) 26.572 61.026 ( -38.433 -0.000 -23.398) 44.995 61.885 ( -71.512 -0.000 25.655) 75.974 67.953 ( 32.254 0.000 -44.210) 54.726 68.487 ( 3.432 0.000 56.554) 56.658 ======================= Grid point 418 (200/204) ======================= q-point: ( 0.45 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.448 ( 11.856 1.113 0.771) 11.934 2.610 ( 2.953 -2.414 -1.879) 4.252 2.652 ( -0.160 -5.244 1.828) 5.556 2.815 ( 8.474 -1.708 7.152) 11.220 3.198 ( -1.430 1.670 -4.364) 4.886 3.546 ( -2.353 -1.831 -0.654) 3.052 3.868 ( 4.568 3.156 -13.954) 15.018 4.031 ( -3.048 3.279 15.293) 15.935 4.338 ( 0.621 3.465 -0.613) 3.573 4.418 ( 3.465 -1.934 -1.599) 4.278 4.568 ( -10.106 5.853 1.804) 11.817 4.724 ( -6.675 -0.996 -1.342) 6.882 5.349 ( 1.493 8.194 -1.648) 8.490 5.591 ( -7.103 -4.402 0.369) 8.364 5.881 ( 1.688 -0.184 -2.186) 2.768 6.036 ( -4.823 -1.789 3.528) 6.238 6.284 ( 4.979 2.860 0.085) 5.743 6.433 ( -2.461 -0.496 -1.735) 3.052 7.025 ( 8.500 2.149 -2.995) 9.265 7.150 ( 6.352 -2.818 -0.015) 6.949 7.164 ( 4.438 -0.957 -0.349) 4.553 7.356 ( -0.477 -1.214 5.550) 5.701 7.640 ( 9.111 -0.329 -0.003) 9.117 8.128 ( -4.932 1.429 2.783) 5.841 8.416 ( 19.616 7.393 -3.649) 21.278 8.679 ( 8.971 0.449 -6.933) 11.347 8.859 ( 3.326 0.097 1.446) 3.628 8.888 ( -0.308 1.270 5.464) 5.618 10.867 ( -15.927 5.686 -0.626) 16.923 11.194 ( -25.273 -14.104 0.278) 28.943 12.618 ( 2.182 2.343 0.023) 3.201 12.814 ( -4.921 -5.873 -0.156) 7.664 15.915 ( 19.232 15.778 2.013) 24.957 16.157 ( 13.293 0.257 -4.867) 14.158 16.895 ( 12.241 3.889 -2.929) 13.173 17.089 ( 6.173 2.457 6.421) 9.240 26.852 ( 0.512 -0.291 -0.410) 0.717 26.872 ( -0.436 -0.351 0.175) 0.586 26.941 ( 0.241 0.281 0.017) 0.370 26.961 ( -0.528 -0.899 0.289) 1.081 28.046 ( -0.310 0.494 -0.316) 0.663 28.058 ( -0.922 -0.207 0.396) 1.025 33.794 ( -0.939 0.146 2.568) 2.738 33.804 ( -0.222 -0.406 -2.748) 2.787 34.726 ( 4.708 1.361 3.176) 5.840 34.864 ( 0.179 1.439 -2.925) 3.265 35.699 ( 2.554 0.629 -2.965) 3.964 35.767 ( -1.641 0.605 3.745) 4.133 37.181 ( 0.914 -0.276 -0.859) 1.284 37.237 ( -1.625 -0.973 0.077) 1.896 44.303 ( 12.163 11.307 -2.963) 16.869 44.578 ( -2.706 0.180 5.823) 6.423 44.882 ( 14.810 4.173 5.395) 16.305 45.192 ( 2.213 -0.117 -6.310) 6.688 45.779 ( 12.822 1.728 3.072) 13.298 46.072 ( 2.611 -0.536 -6.730) 7.239 47.369 ( 16.971 3.289 11.644) 20.843 47.665 ( 6.245 -0.603 -7.493) 9.773 50.858 ( 16.792 11.012 -5.589) 20.844 51.184 ( 3.113 3.307 11.763) 12.610 52.222 ( 51.816 19.605 -0.099) 55.400 53.420 ( 10.605 -12.671 -7.313) 18.069 60.539 ( -33.849 2.983 -16.708) 37.866 61.199 ( -63.094 -4.080 18.304) 65.821 68.208 ( 31.372 -0.432 -42.615) 52.919 68.642 ( -4.669 -3.964 49.838) 50.213 ======================= Grid point 419 (201/204) ======================= q-point: ( 0.55 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 363 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.533 ( 7.344 1.918 5.038) 9.110 2.666 ( -1.614 -3.011 -8.933) 9.564 2.780 ( 4.551 -7.276 5.207) 10.038 2.907 ( -0.966 -3.218 3.741) 5.029 3.199 ( 8.494 1.032 -4.211) 9.536 3.478 ( -12.788 -1.073 0.753) 12.855 3.857 ( 8.883 5.133 -12.857) 16.448 3.950 ( -5.091 5.365 14.055) 15.882 4.292 ( 2.299 3.929 -2.143) 5.031 4.380 ( -6.336 5.719 0.615) 8.558 4.506 ( 5.704 -1.555 -0.394) 5.926 4.648 ( -6.088 0.959 0.390) 6.176 5.273 ( 7.554 7.634 -1.272) 10.815 5.503 ( -12.240 1.587 0.704) 12.363 5.928 ( 4.026 -1.939 -2.253) 5.005 6.021 ( -5.338 -2.750 2.396) 6.465 6.297 ( 5.521 2.751 -0.360) 6.179 6.397 ( -3.864 0.531 -0.044) 3.900 7.066 ( 8.865 3.609 -4.786) 10.701 7.209 ( -1.377 0.250 0.867) 1.646 7.252 ( 3.054 -2.949 3.944) 5.795 7.329 ( -5.117 -1.405 1.938) 5.650 7.774 ( 13.172 0.868 -1.656) 13.304 8.024 ( -8.808 2.623 2.479) 9.519 8.468 ( 16.933 10.355 -3.595) 20.171 8.736 ( 8.077 2.527 -7.356) 11.213 8.784 ( -10.516 7.087 3.053) 13.043 8.838 ( -2.970 3.227 5.918) 7.366 10.817 ( 4.964 -7.413 -0.953) 8.972 11.145 ( -22.465 -14.394 0.584) 26.688 12.677 ( 7.573 -2.848 0.152) 8.093 12.844 ( -6.695 -6.410 -0.229) 9.271 15.901 ( 22.140 16.409 1.847) 27.620 16.201 ( 0.238 4.101 -4.291) 5.940 16.848 ( 7.751 14.821 1.184) 16.767 17.030 ( -4.777 7.984 1.491) 9.423 26.862 ( 0.524 -0.429 -0.325) 0.751 26.874 ( -0.590 -0.489 0.209) 0.794 26.947 ( 0.724 -0.347 -0.031) 0.804 26.966 ( -0.922 -0.741 0.182) 1.197 28.039 ( 0.246 0.303 -0.125) 0.409 28.050 ( -0.800 -0.015 0.160) 0.816 33.793 ( -0.049 -0.146 1.455) 1.464 33.804 ( -0.415 -0.655 -1.555) 1.738 34.747 ( 3.525 2.875 3.045) 5.473 34.816 ( -1.317 3.007 -2.933) 4.402 35.706 ( 2.425 1.198 -3.361) 4.314 35.740 ( -2.035 1.307 3.681) 4.404 37.202 ( 1.328 -1.023 -0.211) 1.689 37.237 ( -1.722 -1.366 -0.121) 2.201 44.278 ( 14.484 10.574 -2.571) 18.116 44.494 ( -6.808 5.014 4.562) 9.607 44.979 ( 13.986 5.021 1.883) 14.979 45.182 ( -3.070 0.417 -2.662) 4.085 45.847 ( 7.191 5.119 5.105) 10.196 46.009 ( -4.080 5.782 -6.638) 9.703 47.497 ( 12.937 4.534 6.468) 15.158 47.676 ( -1.194 1.319 -5.123) 5.423 50.790 ( 13.838 17.723 -1.541) 22.538 51.050 ( -8.489 13.388 2.665) 16.075 52.511 ( 57.586 20.399 1.100) 61.102 53.504 ( -22.490 -3.078 -3.037) 22.902 60.213 ( -6.985 1.111 -7.578) 10.366 60.703 ( -48.088 -7.946 8.568) 49.488 68.463 ( 26.580 -1.972 -36.117) 44.887 68.720 ( -11.749 -4.080 38.939) 40.877 ======================= Grid point 420 (202/204) ======================= q-point: ( 0.64 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 187 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.603 ( -6.696 1.358 -8.796) 11.138 2.603 ( 6.696 1.358 8.796) 11.138 2.926 ( -1.588 -1.596 -3.180) 3.897 2.926 ( 1.588 -1.596 3.180) 3.897 3.343 ( -7.835 -3.260 -3.759) 9.282 3.343 ( 7.835 -3.260 3.759) 9.282 3.830 ( 4.599 5.364 -13.763) 15.471 3.830 ( -4.599 5.364 13.763) 15.471 4.261 ( 0.768 3.377 -2.989) 4.575 4.261 ( -0.768 3.377 2.989) 4.575 4.572 ( -1.545 1.327 -3.993) 4.483 4.572 ( 1.545 1.327 3.993) 4.483 5.280 ( -12.124 7.086 -0.188) 14.044 5.280 ( 12.124 7.086 0.188) 14.044 6.011 ( 1.340 -2.639 -4.450) 5.345 6.011 ( -1.340 -2.639 4.450) 5.345 6.324 ( -2.822 1.965 -1.291) 3.673 6.324 ( 2.822 1.965 1.291) 3.673 7.098 ( 5.925 4.131 -3.753) 8.140 7.098 ( -5.925 4.131 3.753) 8.140 7.330 ( -1.541 -2.252 -4.179) 4.991 7.330 ( 1.541 -2.252 4.179) 4.991 7.879 ( -3.873 2.113 -1.505) 4.661 7.879 ( 3.873 2.113 1.505) 4.661 8.483 ( -11.367 10.721 0.722) 15.642 8.483 ( 11.367 10.721 -0.722) 15.642 8.752 ( 5.253 3.199 -6.938) 9.272 8.752 ( -5.253 3.199 6.938) 9.272 11.134 ( -16.047 -14.070 -1.025) 21.366 11.134 ( 16.047 -14.070 1.025) 21.366 12.858 ( -8.608 -7.164 -0.945) 11.239 12.858 ( 8.608 -7.164 0.945) 11.239 15.922 ( -17.414 15.613 -8.338) 24.830 15.922 ( 17.414 15.613 8.338) 24.830 16.731 ( -15.664 15.784 -1.520) 22.289 16.731 ( 15.664 15.784 1.520) 22.289 26.875 ( 0.499 -0.508 -0.262) 0.759 26.875 ( -0.499 -0.508 0.262) 0.759 26.966 ( -1.072 -0.656 0.171) 1.268 26.966 ( 1.072 -0.656 -0.171) 1.268 28.042 ( 0.252 -0.003 -1.624) 1.644 28.042 ( -0.252 -0.003 1.624) 1.644 33.806 ( 0.660 -0.713 -4.240) 4.350 33.806 ( -0.660 -0.713 4.240) 4.350 34.731 ( -2.019 4.395 -3.010) 5.696 34.731 ( 2.019 4.395 3.010) 5.696 35.701 ( 2.054 1.731 -4.646) 5.366 35.701 ( -2.054 1.731 4.646) 5.366 37.239 ( -1.670 -1.553 -0.312) 2.302 37.239 ( 1.670 -1.553 0.312) 2.302 44.282 ( -9.528 9.908 1.908) 13.878 44.282 ( 9.528 9.908 -1.908) 13.878 45.058 ( -8.480 4.482 -2.213) 9.843 45.058 ( 8.480 4.482 2.213) 9.843 45.812 ( -3.139 9.521 -7.966) 12.805 45.812 ( 3.139 9.521 7.966) 12.805 47.558 ( -1.550 5.443 -12.822) 14.016 47.558 ( 1.550 5.443 12.822) 14.016 50.655 ( -8.952 18.930 -3.403) 21.215 50.655 ( 8.952 18.930 3.403) 21.215 52.923 ( -51.538 14.148 -7.016) 53.903 52.923 ( 51.538 14.148 7.016) 53.903 60.396 ( -16.257 -8.296 -6.896) 19.511 60.396 ( 16.257 -8.296 6.896) 19.511 68.672 ( 16.587 -1.291 -39.698) 43.043 68.672 ( -16.587 -1.291 39.698) 43.043 ======================= Grid point 430 (203/204) ======================= q-point: ( 0.45 0.45 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.558 ( 2.188 0.000 4.827) 5.300 2.592 ( 0.207 0.000 -7.757) 7.759 2.645 ( 9.009 0.000 3.723) 9.748 2.858 ( -3.451 -0.000 3.822) 5.149 3.228 ( 7.922 0.000 -2.566) 8.328 3.474 ( -8.981 -0.000 -0.153) 8.982 3.938 ( 10.288 0.000 -17.419) 20.230 4.062 ( -5.548 -0.000 18.873) 19.672 4.391 ( 3.428 0.000 -8.332) 9.009 4.436 ( 4.742 0.000 8.037) 9.332 4.506 ( -10.320 -0.000 4.573) 11.287 4.617 ( -6.762 -0.000 -6.814) 9.600 5.421 ( 0.553 0.000 -0.608) 0.822 5.490 ( -4.986 -0.000 0.641) 5.027 5.904 ( 4.034 0.000 -4.381) 5.955 5.982 ( -4.698 -0.000 4.890) 6.781 6.345 ( 2.680 0.000 1.042) 2.875 6.401 ( -1.944 -0.000 -1.902) 2.720 7.138 ( 8.853 0.000 -4.546) 9.952 7.179 ( 4.655 0.000 -5.376) 7.111 7.194 ( 1.357 0.000 5.369) 5.538 7.312 ( -7.219 -0.000 5.594) 9.132 7.790 ( 15.457 0.000 -0.734) 15.475 8.068 ( -8.941 -0.000 2.696) 9.338 8.686 ( 16.825 0.000 -5.902) 17.830 8.769 ( 8.998 0.000 -4.224) 9.941 8.882 ( -0.193 -0.000 0.107) 0.221 8.893 ( -4.710 -0.000 7.671) 9.002 10.782 ( -11.711 -0.000 -3.673) 12.273 10.813 ( -14.176 -0.000 3.474) 14.596 12.658 ( 1.701 0.000 0.466) 1.764 12.719 ( -3.143 -0.000 -0.533) 3.188 16.192 ( 5.436 0.000 10.347) 11.688 16.220 ( 7.592 0.000 -11.870) 14.090 17.069 ( 11.346 0.000 -3.373) 11.837 17.173 ( 0.890 0.000 5.161) 5.237 26.855 ( 0.586 0.000 -0.390) 0.704 26.865 ( -0.474 -0.000 0.276) 0.549 26.947 ( 0.239 0.000 -1.121) 1.146 26.949 ( -0.387 -0.000 1.270) 1.327 28.047 ( 0.091 0.000 -1.706) 1.709 28.048 ( -0.756 -0.000 1.753) 1.909 33.791 ( -1.182 -0.000 4.666) 4.814 33.794 ( 0.518 0.000 -4.768) 4.796 34.792 ( 3.646 0.000 3.569) 5.102 34.862 ( -1.112 -0.000 -3.430) 3.606 35.725 ( 2.421 0.000 -3.045) 3.891 35.760 ( -1.956 -0.000 3.450) 3.966 37.188 ( 1.063 0.000 -0.889) 1.386 37.213 ( -1.466 -0.000 0.474) 1.541 44.468 ( 5.847 0.000 -4.660) 7.476 44.549 ( -3.435 -0.000 5.641) 6.604 45.056 ( 8.273 0.000 7.570) 11.214 45.184 ( -0.643 -0.000 -7.509) 7.537 45.946 ( 10.021 0.000 3.338) 10.562 46.073 ( 0.093 0.000 -5.549) 5.550 47.562 ( 9.059 0.000 12.669) 15.575 47.692 ( 2.167 0.000 -10.383) 10.607 51.113 ( 14.765 0.000 -12.024) 19.042 51.248 ( -2.850 -0.000 15.681) 15.937 52.908 ( 40.483 0.000 1.985) 40.531 53.392 ( 0.942 0.000 -6.088) 6.160 60.255 ( -11.791 -0.000 -18.183) 21.672 60.581 ( -46.865 -0.000 19.006) 50.572 68.417 ( 26.824 0.000 -49.551) 56.346 68.633 ( -13.269 -0.000 53.263) 54.891 ======================= Grid point 431 (204/204) ======================= q-point: ( 0.55 0.45 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 187 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.593 ( -0.787 -1.848 -7.468) 7.734 2.593 ( 0.787 -1.848 7.468) 7.734 2.789 ( -10.007 -2.596 -0.464) 10.348 2.789 ( 10.007 -2.596 0.464) 10.348 3.341 ( -12.774 0.946 0.711) 12.829 3.341 ( 12.774 0.946 -0.711) 12.829 3.988 ( 9.156 3.537 -17.736) 20.271 3.988 ( -9.156 3.537 17.736) 20.271 4.387 ( 3.934 3.937 -2.960) 6.304 4.387 ( -3.934 3.937 2.960) 6.304 4.550 ( -6.858 -2.377 -3.680) 8.137 4.550 ( 6.858 -2.377 3.680) 8.137 5.427 ( -6.019 2.044 0.392) 6.369 5.427 ( 6.019 2.044 -0.392) 6.369 5.947 ( 3.510 -0.814 -4.711) 5.931 5.947 ( -3.510 -0.814 4.711) 5.931 6.369 ( -1.921 0.793 -1.752) 2.718 6.369 ( 1.921 0.793 1.752) 2.718 7.188 ( 5.128 1.402 -3.706) 6.481 7.188 ( -5.128 1.402 3.706) 6.481 7.250 ( -3.089 -1.960 -2.435) 4.395 7.250 ( 3.089 -1.960 2.435) 4.395 7.940 ( -10.889 1.304 0.823) 10.997 7.940 ( 10.889 1.304 -0.823) 10.997 8.769 ( -0.326 6.427 -2.001) 6.739 8.769 ( 0.326 6.427 2.001) 6.739 8.840 ( 6.295 1.653 -6.004) 8.855 8.840 ( -6.295 1.653 6.004) 8.855 10.780 ( -5.011 -7.270 -1.914) 9.035 10.780 ( 5.011 -7.270 1.914) 9.035 12.705 ( -4.684 -2.600 -0.329) 5.367 12.705 ( 4.684 -2.600 0.329) 5.367 16.210 ( -0.637 4.157 -10.952) 11.732 16.210 ( 0.637 4.157 10.952) 11.732 17.103 ( 1.344 6.949 -2.652) 7.558 17.103 ( -1.344 6.949 2.652) 7.558 26.862 ( 0.515 -0.254 -0.308) 0.651 26.862 ( -0.515 -0.254 0.308) 0.651 26.950 ( 0.204 -0.291 -0.992) 1.054 26.950 ( -0.204 -0.291 0.992) 1.054 28.045 ( 0.403 0.104 -1.696) 1.747 28.045 ( -0.403 0.104 1.696) 1.747 33.792 ( 0.804 -0.205 -4.678) 4.751 33.792 ( -0.804 -0.205 4.678) 4.751 34.823 ( -2.386 1.519 -3.544) 4.534 34.823 ( 2.386 1.519 3.544) 4.534 35.739 ( 2.190 0.655 -3.412) 4.107 35.739 ( -2.190 0.655 3.412) 4.107 37.204 ( -0.045 -0.634 -0.298) 0.702 37.204 ( 0.045 -0.634 0.298) 0.702 44.487 ( 3.759 3.646 -3.721) 6.425 44.487 ( -3.759 3.646 3.721) 6.425 45.136 ( -4.728 0.787 -6.487) 8.065 45.136 ( 4.728 0.787 6.487) 8.065 46.011 ( -5.283 3.310 -5.301) 8.183 46.011 ( 5.283 3.310 5.301) 8.183 47.651 ( -3.090 1.212 -11.596) 12.062 47.651 ( 3.090 1.212 11.596) 12.062 51.141 ( 5.955 9.612 -12.443) 16.813 51.141 ( -5.955 9.612 12.443) 16.813 53.227 ( -28.245 5.365 -4.160) 29.050 53.227 ( 28.245 5.365 4.160) 29.050 60.258 ( 13.903 -1.445 -15.976) 21.228 60.258 ( -13.904 -1.445 15.976) 21.228 68.587 ( 20.186 -2.623 -49.722) 53.728 68.587 ( -20.186 -2.623 49.722) 53.728 =================== 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 3/47916 10.0 331.094 171.357 248.433 -0.000 -108.865 0.000 3/47916 20.0 60.397 41.254 29.038 -0.000 -7.141 0.000 3/47916 30.0 27.009 18.739 12.169 -0.000 -1.880 0.000 3/47916 40.0 16.007 10.994 7.323 -0.000 -0.888 0.000 3/47916 50.0 10.988 7.461 5.108 -0.000 -0.563 0.000 3/47916 60.0 8.264 5.552 3.874 -0.000 -0.415 0.000 3/47916 70.0 6.611 4.395 3.104 -0.000 -0.332 0.000 3/47916 80.0 5.522 3.634 2.585 -0.000 -0.280 0.000 3/47916 90.0 4.760 3.101 2.215 -0.000 -0.244 0.000 3/47916 100.0 4.201 2.711 1.938 -0.000 -0.217 0.000 3/47916 110.0 3.776 2.415 1.724 -0.000 -0.196 0.000 3/47916 120.0 3.442 2.182 1.553 -0.000 -0.180 0.000 3/47916 130.0 3.173 1.995 1.415 -0.000 -0.166 0.000 3/47916 140.0 2.951 1.841 1.299 -0.000 -0.154 0.000 3/47916 150.0 2.764 1.713 1.202 -0.000 -0.144 0.000 3/47916 160.0 2.605 1.603 1.119 -0.000 -0.135 0.000 3/47916 170.0 2.466 1.509 1.048 -0.000 -0.127 0.000 3/47916 180.0 2.344 1.426 0.985 -0.000 -0.120 0.000 3/47916 190.0 2.236 1.353 0.930 -0.000 -0.114 0.000 3/47916 200.0 2.138 1.288 0.880 -0.000 -0.108 0.000 3/47916 210.0 2.050 1.229 0.836 -0.000 -0.103 0.000 3/47916 220.0 1.969 1.176 0.797 -0.000 -0.098 0.000 3/47916 230.0 1.894 1.127 0.761 -0.000 -0.094 0.000 3/47916 240.0 1.826 1.083 0.728 -0.000 -0.090 0.000 3/47916 250.0 1.762 1.042 0.698 -0.000 -0.086 0.000 3/47916 260.0 1.703 1.004 0.671 -0.000 -0.083 0.000 3/47916 270.0 1.648 0.969 0.646 -0.000 -0.080 0.000 3/47916 280.0 1.596 0.936 0.622 -0.000 -0.077 0.000 3/47916 290.0 1.547 0.906 0.600 -0.000 -0.075 0.000 3/47916 300.0 1.501 0.877 0.580 -0.000 -0.072 0.000 3/47916 310.0 1.458 0.850 0.561 -0.000 -0.070 0.000 3/47916 320.0 1.417 0.825 0.544 -0.000 -0.068 0.000 3/47916 330.0 1.378 0.801 0.527 -0.000 -0.066 0.000 3/47916 340.0 1.341 0.779 0.511 -0.000 -0.064 0.000 3/47916 350.0 1.306 0.757 0.497 -0.000 -0.062 0.000 3/47916 360.0 1.273 0.737 0.483 -0.000 -0.060 0.000 3/47916 370.0 1.241 0.718 0.470 -0.000 -0.059 0.000 3/47916 380.0 1.211 0.700 0.457 -0.000 -0.057 0.000 3/47916 390.0 1.182 0.682 0.446 -0.000 -0.056 0.000 3/47916 400.0 1.154 0.666 0.434 -0.000 -0.054 0.000 3/47916 410.0 1.128 0.650 0.424 -0.000 -0.053 0.000 3/47916 420.0 1.103 0.635 0.414 -0.000 -0.052 0.000 3/47916 430.0 1.079 0.621 0.404 -0.000 -0.051 0.000 3/47916 440.0 1.055 0.607 0.395 -0.000 -0.050 0.000 3/47916 450.0 1.033 0.594 0.386 -0.000 -0.048 0.000 3/47916 460.0 1.012 0.581 0.378 -0.000 -0.047 0.000 3/47916 470.0 0.991 0.569 0.370 -0.000 -0.046 0.000 3/47916 480.0 0.972 0.557 0.362 -0.000 -0.046 0.000 3/47916 490.0 0.953 0.546 0.355 -0.000 -0.045 0.000 3/47916 500.0 0.934 0.535 0.347 -0.000 -0.044 0.000 3/47916 510.0 0.917 0.525 0.341 -0.000 -0.043 0.000 3/47916 520.0 0.900 0.515 0.334 -0.000 -0.042 0.000 3/47916 530.0 0.883 0.505 0.328 -0.000 -0.041 0.000 3/47916 540.0 0.867 0.496 0.322 -0.000 -0.041 0.000 3/47916 550.0 0.852 0.487 0.316 -0.000 -0.040 0.000 3/47916 560.0 0.837 0.478 0.310 -0.000 -0.039 0.000 3/47916 570.0 0.823 0.470 0.305 -0.000 -0.039 0.000 3/47916 580.0 0.809 0.462 0.300 -0.000 -0.038 0.000 3/47916 590.0 0.796 0.454 0.295 -0.000 -0.037 0.000 3/47916 600.0 0.783 0.446 0.290 -0.000 -0.037 0.000 3/47916 610.0 0.770 0.439 0.285 -0.000 -0.036 0.000 3/47916 620.0 0.758 0.432 0.280 -0.000 -0.036 0.000 3/47916 630.0 0.746 0.425 0.276 -0.000 -0.035 0.000 3/47916 640.0 0.735 0.419 0.272 -0.000 -0.035 0.000 3/47916 650.0 0.724 0.412 0.268 -0.000 -0.034 0.000 3/47916 660.0 0.713 0.406 0.264 -0.000 -0.034 0.000 3/47916 670.0 0.703 0.400 0.260 -0.000 -0.033 0.000 3/47916 680.0 0.693 0.394 0.256 -0.000 -0.033 0.000 3/47916 690.0 0.683 0.388 0.252 -0.000 -0.032 0.000 3/47916 700.0 0.673 0.383 0.249 -0.000 -0.032 0.000 3/47916 710.0 0.664 0.377 0.245 -0.000 -0.032 0.000 3/47916 720.0 0.655 0.372 0.242 -0.000 -0.031 0.000 3/47916 730.0 0.646 0.367 0.238 -0.000 -0.031 0.000 3/47916 740.0 0.637 0.362 0.235 -0.000 -0.030 0.000 3/47916 750.0 0.629 0.357 0.232 -0.000 -0.030 0.000 3/47916 760.0 0.621 0.352 0.229 -0.000 -0.030 0.000 3/47916 770.0 0.613 0.348 0.226 -0.000 -0.029 0.000 3/47916 780.0 0.605 0.343 0.223 -0.000 -0.029 0.000 3/47916 790.0 0.597 0.339 0.220 -0.000 -0.029 0.000 3/47916 800.0 0.590 0.335 0.218 -0.000 -0.028 0.000 3/47916 810.0 0.583 0.330 0.215 -0.000 -0.028 0.000 3/47916 820.0 0.576 0.326 0.212 -0.000 -0.028 0.000 3/47916 830.0 0.569 0.322 0.210 -0.000 -0.027 0.000 3/47916 840.0 0.562 0.319 0.207 -0.000 -0.027 0.000 3/47916 850.0 0.556 0.315 0.205 -0.000 -0.027 0.000 3/47916 860.0 0.549 0.311 0.203 -0.000 -0.026 0.000 3/47916 870.0 0.543 0.308 0.200 -0.000 -0.026 0.000 3/47916 880.0 0.537 0.304 0.198 -0.000 -0.026 0.000 3/47916 890.0 0.531 0.301 0.196 -0.000 -0.026 0.000 3/47916 900.0 0.525 0.297 0.194 -0.000 -0.025 0.000 3/47916 910.0 0.519 0.294 0.192 -0.000 -0.025 0.000 3/47916 920.0 0.514 0.291 0.190 -0.000 -0.025 0.000 3/47916 930.0 0.508 0.288 0.188 -0.000 -0.025 0.000 3/47916 940.0 0.503 0.285 0.186 -0.000 -0.024 0.000 3/47916 950.0 0.498 0.282 0.184 -0.000 -0.024 0.000 3/47916 960.0 0.493 0.279 0.182 -0.000 -0.024 0.000 3/47916 970.0 0.488 0.276 0.180 -0.000 -0.024 0.000 3/47916 980.0 0.483 0.273 0.178 -0.000 -0.023 0.000 3/47916 990.0 0.478 0.270 0.176 -0.000 -0.023 0.000 3/47916 1000.0 0.473 0.267 0.175 -0.000 -0.023 0.000 3/47916 Thermal conductivity related properties were written into "kappa-m11116.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 20:39:56]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|