----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 13:32:49]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.495415020203528 0.000000000000000 0.000000000000000 b 0.000000000000000 6.759527850000000 0.000000000000000 c -1.075998268196466 0.000000000000000 6.937305702234957 Atomic positions (fractional): *1 Tm 0.13595366028972 0.14268628533843 0.82434548707290 168.934 2 Tm 0.86404633971028 0.85731371466157 0.17565451292710 168.934 3 Tm 0.13595366028972 0.35731371466157 0.32434548707290 168.934 4 Tm 0.86404633971028 0.64268628533843 0.67565451292710 168.934 *5 Se 0.64363217194371 0.11739002316795 0.70713437896013 78.960 6 Se 0.64363217194371 0.38260997683205 0.20713437896014 78.960 7 Se 0.35636782805629 0.88260997683205 0.29286562103987 78.960 8 Se 0.35636782805629 0.61739002316795 0.79286562103987 78.960 *9 O 0.82695656730576 0.53487695684409 0.35266377557945 15.999 10 O 0.17304343269424 0.46512304315591 0.64733622442055 15.999 *11 O 0.17508431899126 0.80724209463369 0.78357274227738 15.999 12 O 0.17508431899126 0.69275790536631 0.28357274227738 15.999 *13 O 0.48196641135948 0.18983166992110 0.86374493545008 15.999 14 O 0.82695656730576 0.96512304315591 0.85266377557945 15.999 15 O 0.82491568100874 0.30724209463369 0.71642725772262 15.999 16 O 0.48196641135948 0.31016833007890 0.36374493545008 15.999 17 O 0.17304343269424 0.03487695684409 0.14733622442055 15.999 18 O 0.51803358864052 0.81016833007890 0.13625506454992 15.999 19 O 0.51803358864052 0.68983166992110 0.63625506454992 15.999 20 O 0.82491568100874 0.19275790536631 0.21642725772262 15.999 *21 F 0.16898282310095 0.38758737000228 0.02498324242224 18.998 22 F 0.83101717689905 0.61241262999772 0.97501675757776 18.998 23 F 0.83101717689905 0.88758737000228 0.47501675757776 18.998 24 F 0.16898282310095 0.11241262999772 0.52498324242224 18.998 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.495415020203528 0.000000000000000 0.000000000000000 b 0.000000000000000 6.759527850000000 0.000000000000000 c -1.075998268196466 0.000000000000000 6.937305702234957 Atomic positions (fractional): *1 Tm 0.13595366028972 0.14268628533843 0.82434548707290 168.934 > 1 2 Tm 0.86404633971028 0.85731371466157 0.17565451292710 168.934 > 2 3 Tm 0.13595366028972 0.35731371466157 0.32434548707290 168.934 > 3 4 Tm 0.86404633971028 0.64268628533843 0.67565451292710 168.934 > 4 *5 Se 0.64363217194371 0.11739002316795 0.70713437896013 78.960 > 5 6 Se 0.64363217194371 0.38260997683205 0.20713437896014 78.960 > 6 7 Se 0.35636782805629 0.88260997683205 0.29286562103987 78.960 > 7 8 Se 0.35636782805629 0.61739002316795 0.79286562103987 78.960 > 8 *9 O 0.82695656730576 0.53487695684409 0.35266377557945 15.999 > 9 10 O 0.17304343269424 0.46512304315591 0.64733622442055 15.999 > 10 *11 O 0.17508431899126 0.80724209463369 0.78357274227738 15.999 > 11 12 O 0.17508431899126 0.69275790536631 0.28357274227738 15.999 > 12 *13 O 0.48196641135948 0.18983166992110 0.86374493545008 15.999 > 13 14 O 0.82695656730576 0.96512304315591 0.85266377557945 15.999 > 14 15 O 0.82491568100874 0.30724209463369 0.71642725772262 15.999 > 15 16 O 0.48196641135948 0.31016833007890 0.36374493545008 15.999 > 16 17 O 0.17304343269424 0.03487695684409 0.14733622442055 15.999 > 17 18 O 0.51803358864052 0.81016833007890 0.13625506454992 15.999 > 18 19 O 0.51803358864052 0.68983166992110 0.63625506454992 15.999 > 19 20 O 0.82491568100874 0.19275790536631 0.21642725772262 15.999 > 20 *21 F 0.16898282310095 0.38758737000228 0.02498324242224 18.998 > 21 22 F 0.83101717689905 0.61241262999772 0.97501675757776 18.998 > 22 23 F 0.83101717689905 0.88758737000228 0.47501675757776 18.998 > 23 24 F 0.16898282310095 0.11241262999772 0.52498324242224 18.998 > 24 -------------------------------- super cell -------------------------------- Lattice vectors: a 12.990830040407056 0.000000000000000 0.000000000000000 b 0.000000000000000 13.519055699999999 0.000000000000000 c -1.075998268196466 0.000000000000000 6.937305702234957 Atomic positions (fractional): *1 Tm 0.06797683014486 0.07134314266922 0.82434548707290 168.934 > 1 2 Tm 0.56797683014486 0.07134314266922 0.82434548707290 168.934 > 1 3 Tm 0.06797683014486 0.57134314266922 0.82434548707290 168.934 > 1 4 Tm 0.56797683014486 0.57134314266922 0.82434548707290 168.934 > 1 5 Tm 0.43202316985514 0.42865685733078 0.17565451292710 168.934 > 2 6 Tm 0.93202316985514 0.42865685733078 0.17565451292710 168.934 > 2 7 Tm 0.43202316985514 0.92865685733078 0.17565451292710 168.934 > 2 8 Tm 0.93202316985514 0.92865685733078 0.17565451292710 168.934 > 2 9 Tm 0.06797683014486 0.17865685733078 0.32434548707290 168.934 > 3 10 Tm 0.56797683014486 0.17865685733078 0.32434548707290 168.934 > 3 11 Tm 0.06797683014486 0.67865685733078 0.32434548707290 168.934 > 3 12 Tm 0.56797683014486 0.67865685733078 0.32434548707290 168.934 > 3 13 Tm 0.43202316985514 0.32134314266922 0.67565451292710 168.934 > 4 14 Tm 0.93202316985514 0.32134314266922 0.67565451292710 168.934 > 4 15 Tm 0.43202316985514 0.82134314266922 0.67565451292710 168.934 > 4 16 Tm 0.93202316985514 0.82134314266922 0.67565451292710 168.934 > 4 *17 Se 0.32181608597186 0.05869501158398 0.70713437896013 78.960 > 5 18 Se 0.82181608597186 0.05869501158398 0.70713437896013 78.960 > 5 19 Se 0.32181608597186 0.55869501158398 0.70713437896013 78.960 > 5 20 Se 0.82181608597186 0.55869501158398 0.70713437896013 78.960 > 5 21 Se 0.32181608597186 0.19130498841602 0.20713437896014 78.960 > 6 22 Se 0.82181608597186 0.19130498841602 0.20713437896014 78.960 > 6 23 Se 0.32181608597186 0.69130498841602 0.20713437896014 78.960 > 6 24 Se 0.82181608597186 0.69130498841602 0.20713437896014 78.960 > 6 25 Se 0.17818391402815 0.44130498841602 0.29286562103987 78.960 > 7 26 Se 0.67818391402815 0.44130498841602 0.29286562103987 78.960 > 7 27 Se 0.17818391402815 0.94130498841602 0.29286562103987 78.960 > 7 28 Se 0.67818391402815 0.94130498841602 0.29286562103987 78.960 > 7 29 Se 0.17818391402815 0.30869501158398 0.79286562103987 78.960 > 8 30 Se 0.67818391402815 0.30869501158398 0.79286562103987 78.960 > 8 31 Se 0.17818391402815 0.80869501158398 0.79286562103987 78.960 > 8 32 Se 0.67818391402815 0.80869501158398 0.79286562103987 78.960 > 8 *33 O 0.41347828365288 0.26743847842204 0.35266377557945 15.999 > 9 34 O 0.91347828365288 0.26743847842204 0.35266377557945 15.999 > 9 35 O 0.41347828365288 0.76743847842204 0.35266377557945 15.999 > 9 36 O 0.91347828365288 0.76743847842204 0.35266377557945 15.999 > 9 37 O 0.08652171634712 0.23256152157796 0.64733622442055 15.999 > 10 38 O 0.58652171634712 0.23256152157796 0.64733622442055 15.999 > 10 39 O 0.08652171634712 0.73256152157796 0.64733622442055 15.999 > 10 40 O 0.58652171634712 0.73256152157796 0.64733622442055 15.999 > 10 *41 O 0.08754215949563 0.40362104731684 0.78357274227738 15.999 > 11 42 O 0.58754215949563 0.40362104731684 0.78357274227738 15.999 > 11 43 O 0.08754215949563 0.90362104731684 0.78357274227738 15.999 > 11 44 O 0.58754215949563 0.90362104731684 0.78357274227738 15.999 > 11 45 O 0.08754215949563 0.34637895268316 0.28357274227738 15.999 > 12 46 O 0.58754215949563 0.34637895268316 0.28357274227738 15.999 > 12 47 O 0.08754215949563 0.84637895268316 0.28357274227738 15.999 > 12 48 O 0.58754215949563 0.84637895268316 0.28357274227738 15.999 > 12 *49 O 0.24098320567974 0.09491583496055 0.86374493545008 15.999 > 13 50 O 0.74098320567974 0.09491583496055 0.86374493545008 15.999 > 13 51 O 0.24098320567974 0.59491583496055 0.86374493545008 15.999 > 13 52 O 0.74098320567974 0.59491583496055 0.86374493545008 15.999 > 13 53 O 0.41347828365288 0.48256152157796 0.85266377557945 15.999 > 14 54 O 0.91347828365288 0.48256152157796 0.85266377557945 15.999 > 14 55 O 0.41347828365288 0.98256152157796 0.85266377557945 15.999 > 14 56 O 0.91347828365288 0.98256152157796 0.85266377557945 15.999 > 14 57 O 0.41245784050437 0.15362104731684 0.71642725772262 15.999 > 15 58 O 0.91245784050437 0.15362104731684 0.71642725772262 15.999 > 15 59 O 0.41245784050437 0.65362104731684 0.71642725772262 15.999 > 15 60 O 0.91245784050437 0.65362104731684 0.71642725772262 15.999 > 15 61 O 0.24098320567974 0.15508416503945 0.36374493545008 15.999 > 16 62 O 0.74098320567974 0.15508416503945 0.36374493545008 15.999 > 16 63 O 0.24098320567974 0.65508416503945 0.36374493545008 15.999 > 16 64 O 0.74098320567974 0.65508416503945 0.36374493545008 15.999 > 16 65 O 0.08652171634712 0.01743847842204 0.14733622442055 15.999 > 17 66 O 0.58652171634712 0.01743847842204 0.14733622442055 15.999 > 17 67 O 0.08652171634712 0.51743847842204 0.14733622442055 15.999 > 17 68 O 0.58652171634712 0.51743847842204 0.14733622442055 15.999 > 17 69 O 0.25901679432026 0.40508416503945 0.13625506454992 15.999 > 18 70 O 0.75901679432026 0.40508416503945 0.13625506454992 15.999 > 18 71 O 0.25901679432026 0.90508416503945 0.13625506454992 15.999 > 18 72 O 0.75901679432026 0.90508416503945 0.13625506454992 15.999 > 18 73 O 0.25901679432026 0.34491583496055 0.63625506454992 15.999 > 19 74 O 0.75901679432026 0.34491583496055 0.63625506454992 15.999 > 19 75 O 0.25901679432026 0.84491583496055 0.63625506454992 15.999 > 19 76 O 0.75901679432026 0.84491583496055 0.63625506454992 15.999 > 19 77 O 0.41245784050437 0.09637895268316 0.21642725772262 15.999 > 20 78 O 0.91245784050437 0.09637895268316 0.21642725772262 15.999 > 20 79 O 0.41245784050437 0.59637895268316 0.21642725772262 15.999 > 20 80 O 0.91245784050437 0.59637895268316 0.21642725772262 15.999 > 20 *81 F 0.08449141155048 0.19379368500114 0.02498324242224 18.998 > 21 82 F 0.58449141155048 0.19379368500114 0.02498324242224 18.998 > 21 83 F 0.08449141155048 0.69379368500114 0.02498324242224 18.998 > 21 84 F 0.58449141155048 0.69379368500114 0.02498324242224 18.998 > 21 85 F 0.41550858844952 0.30620631499886 0.97501675757776 18.998 > 22 86 F 0.91550858844952 0.30620631499886 0.97501675757776 18.998 > 22 87 F 0.41550858844952 0.80620631499886 0.97501675757776 18.998 > 22 88 F 0.91550858844952 0.80620631499886 0.97501675757776 18.998 > 22 89 F 0.41550858844952 0.44379368500114 0.47501675757776 18.998 > 23 90 F 0.91550858844952 0.44379368500114 0.47501675757776 18.998 > 23 91 F 0.41550858844952 0.94379368500114 0.47501675757776 18.998 > 23 92 F 0.91550858844952 0.94379368500114 0.47501675757776 18.998 > 23 93 F 0.08449141155048 0.05620631499886 0.52498324242224 18.998 > 24 94 F 0.58449141155048 0.05620631499886 0.52498324242224 18.998 > 24 95 F 0.08449141155048 0.55620631499886 0.52498324242224 18.998 > 24 96 F 0.58449141155048 0.55620631499886 0.52498324242224 18.998 > 24 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.0854198 0.0000000 -0.0951328 0.0000000 3.7954345 0.0000000 -0.0951262 0.0000000 3.5401719 -------------------------- Born effective charges -------------------------- 1 Tm 4.4394991 0.0278366 0.0796825 0.0966911 3.9092432 -0.2595232 -0.2372936 0.2249289 3.7830245 2 Tm 4.4394991 0.0278366 0.0796825 0.0966911 3.9092432 -0.2595232 -0.2372936 0.2249289 3.7830245 3 Tm 4.4394991 -0.0278366 0.0796825 -0.0966911 3.9092432 0.2595232 -0.2372936 -0.2249289 3.7830245 4 Tm 4.4394991 -0.0278366 0.0796825 -0.0966911 3.9092432 0.2595232 -0.2372936 -0.2249289 3.7830245 5 Se 3.6209860 -0.0903114 -0.3983277 -0.4176019 3.0594293 -0.2519117 -0.2105012 -0.3379882 2.6386920 6 Se 3.6209860 0.0903114 -0.3983277 0.4176019 3.0594293 0.2519117 -0.2105012 0.3379882 2.6386920 7 Se 3.6209860 -0.0903114 -0.3983277 -0.4176019 3.0594293 -0.2519117 -0.2105012 -0.3379882 2.6386920 8 Se 3.6209860 0.0903114 -0.3983277 0.4176019 3.0594293 0.2519117 -0.2105012 0.3379882 2.6386920 9 O -2.0415915 -0.1468390 -0.4827719 -0.7264458 -1.9851346 -0.7466029 -0.3699422 -0.3280374 -1.9552152 10 O -2.0415915 -0.1468390 -0.4827719 -0.7264458 -1.9851346 -0.7466029 -0.3699422 -0.3280374 -1.9552152 11 O -2.1556015 0.6067492 -0.3131647 0.6725673 -2.3941421 -0.0599269 0.0935227 -0.4548821 -0.9187410 12 O -2.1556015 -0.6067492 -0.3131647 -0.6725673 -2.3941421 0.0599269 0.0935227 0.4548821 -0.9187410 13 O -2.8416693 0.4006919 0.9098801 0.2491810 -1.1977705 -0.4229768 0.3975576 -0.3754054 -1.5718395 14 O -2.0415915 0.1468390 -0.4827719 0.7264458 -1.9851346 0.7466029 -0.3699422 0.3280374 -1.9552152 15 O -2.1556015 -0.6067492 -0.3131647 -0.6725673 -2.3941421 0.0599269 0.0935227 0.4548821 -0.9187410 16 O -2.8416693 -0.4006919 0.9098801 -0.2491810 -1.1977705 0.4229768 0.3975576 0.3754054 -1.5718395 17 O -2.0415915 0.1468390 -0.4827719 0.7264458 -1.9851346 0.7466029 -0.3699422 0.3280374 -1.9552152 18 O -2.8416693 0.4006919 0.9098801 0.2491810 -1.1977705 -0.4229768 0.3975576 -0.3754054 -1.5718395 19 O -2.8416693 -0.4006919 0.9098801 -0.2491810 -1.1977705 0.4229768 0.3975576 0.3754054 -1.5718395 20 O -2.1556015 0.6067492 -0.3131647 0.6725673 -2.3941421 -0.0599269 0.0935227 -0.4548821 -0.9187410 21 F -1.0216228 -0.0735435 0.2047018 -0.1087727 -1.3916254 -0.2183645 0.3266568 -0.0602214 -1.9759208 22 F -1.0216228 -0.0735435 0.2047018 -0.1087727 -1.3916254 -0.2183645 0.3266568 -0.0602214 -1.9759208 23 F -1.0216228 0.0735435 0.2047018 0.1087727 -1.3916254 0.2183645 0.3266568 0.0602214 -1.9759208 24 F -1.0216228 0.0735435 0.2047018 0.1087727 -1.3916254 0.2183645 0.3266568 0.0602214 -1.9759208 ---------------------------------------------------------------------------- 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: 288/288 Permutation basis: 10656/10656 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2700 Number of blocks in projector: 2700 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: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 238 eigenvectors found. (2) Block: 500 / 576 (2) 239 eigenvectors found. (2) Block: 576 / 576 (2) 70 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 564 eigenvectors found. (1) Complementary block size: 12 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 238 eigenvectors found. (2) Block: 500 / 576 (2) 239 eigenvectors found. (2) Block: 576 / 576 (2) 70 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 564 eigenvectors found. (1) Complementary block size: 12 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 239 eigenvectors found. (2) Block: 500 / 576 (2) 241 eigenvectors found. (2) Block: 576 / 576 (2) 71 eigenvectors found. (2) Complementary block size: 25 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 565 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 324 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 324 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 324 Use standard eigh solver. Tree of FC basis block matrices: - (2700, 2647), data: False |-- (324, 318), data: True |-- (324, 318), data: True |-- (324, 318), data: True |-- (576, 565), data: False |-- (576, 565), data: False |-- (576, 14), data: (576, 25) @ (25, 14) |-- (76, 71), data: True |-- (250, 241), data: True |-- (250, 239), data: True |-- (576, 564), data: False |-- (576, 564), data: False |-- (576, 17), data: (576, 29) @ (29, 17) |-- (76, 70), data: True |-- (250, 239), data: True |-- (250, 238), data: True |-- (576, 564), data: False |-- (576, 564), data: False |-- (576, 17), data: (576, 29) @ (29, 17) |-- (76, 70), data: True |-- (250, 239), data: True |-- (250, 238), data: True ----- Solver_atoms: 1 -- 96 / 96 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 720 - Time: 0.831 Solver_block: 200 / 720 - Time: 0.650 Solver_block: 300 / 720 - Time: 0.649 Solver_block: 400 / 720 - Time: 0.644 Solver_block: 500 / 720 - Time: 0.657 Solver_block: 600 / 720 - Time: 0.660 Solver_block: 700 / 720 - Time: 0.655 Solver_block: 720 / 720 - Time: 0.229 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 5.078 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 288/288 Permutation basis: 10656/10656 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2700 Number of blocks in projector: 2700 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: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 238 eigenvectors found. (2) Block: 500 / 576 (2) 239 eigenvectors found. (2) Block: 576 / 576 (2) 70 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 564 eigenvectors found. (1) Complementary block size: 12 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 238 eigenvectors found. (2) Block: 500 / 576 (2) 239 eigenvectors found. (2) Block: 576 / 576 (2) 70 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 564 eigenvectors found. (1) Complementary block size: 12 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 239 eigenvectors found. (2) Block: 500 / 576 (2) 241 eigenvectors found. (2) Block: 576 / 576 (2) 71 eigenvectors found. (2) Complementary block size: 25 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 565 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 324 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 324 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 324 Use standard eigh solver. Tree of FC basis block matrices: - (2700, 2647), data: False |-- (324, 318), data: True |-- (324, 318), data: True |-- (324, 318), data: True |-- (576, 565), data: False |-- (576, 565), data: False |-- (576, 14), data: (576, 25) @ (25, 14) |-- (76, 71), data: True |-- (250, 241), data: True |-- (250, 239), data: True |-- (576, 564), data: False |-- (576, 564), data: False |-- (576, 17), data: (576, 29) @ (29, 17) |-- (76, 70), data: True |-- (250, 239), data: True |-- (250, 238), data: True |-- (576, 564), data: False |-- (576, 564), data: False |-- (576, 17), data: (576, 29) @ (29, 17) |-- (76, 70), data: True |-- (250, 239), data: True |-- (250, 238), 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 13:33:20]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 13:33:21]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.495415020203528 0.000000000000000 0.000000000000000 b 0.000000000000000 6.759527850000000 0.000000000000000 c -1.075998268196466 0.000000000000000 6.937305702234957 Atomic positions (fractional): 1 Tm 0.13595366028972 0.14268628533843 0.82434548707290 168.934 2 Tm 0.86404633971028 0.85731371466157 0.17565451292710 168.934 3 Tm 0.13595366028972 0.35731371466157 0.32434548707290 168.934 4 Tm 0.86404633971028 0.64268628533843 0.67565451292710 168.934 5 Se 0.64363217194371 0.11739002316795 0.70713437896013 78.960 6 Se 0.64363217194371 0.38260997683205 0.20713437896014 78.960 7 Se 0.35636782805629 0.88260997683205 0.29286562103987 78.960 8 Se 0.35636782805629 0.61739002316795 0.79286562103987 78.960 9 O 0.82695656730576 0.53487695684409 0.35266377557945 15.999 10 O 0.17304343269424 0.46512304315591 0.64733622442055 15.999 11 O 0.17508431899126 0.80724209463369 0.78357274227738 15.999 12 O 0.17508431899126 0.69275790536631 0.28357274227738 15.999 13 O 0.48196641135948 0.18983166992110 0.86374493545008 15.999 14 O 0.82695656730576 0.96512304315591 0.85266377557945 15.999 15 O 0.82491568100874 0.30724209463369 0.71642725772262 15.999 16 O 0.48196641135948 0.31016833007890 0.36374493545008 15.999 17 O 0.17304343269424 0.03487695684409 0.14733622442055 15.999 18 O 0.51803358864052 0.81016833007890 0.13625506454992 15.999 19 O 0.51803358864052 0.68983166992110 0.63625506454992 15.999 20 O 0.82491568100874 0.19275790536631 0.21642725772262 15.999 21 F 0.16898282310095 0.38758737000228 0.02498324242224 18.998 22 F 0.83101717689905 0.61241262999772 0.97501675757776 18.998 23 F 0.83101717689905 0.88758737000228 0.47501675757776 18.998 24 F 0.16898282310095 0.11241262999772 0.52498324242224 18.998 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.990830040407056 0.000000000000000 0.000000000000000 b 0.000000000000000 13.519055699999999 0.000000000000000 c -1.075998268196466 0.000000000000000 6.937305702234957 Atomic positions (fractional): 1 Tm 0.06797683014486 0.07134314266922 0.82434548707290 168.934 > 1 2 Tm 0.56797683014486 0.07134314266922 0.82434548707290 168.934 > 1 3 Tm 0.06797683014486 0.57134314266922 0.82434548707290 168.934 > 1 4 Tm 0.56797683014486 0.57134314266922 0.82434548707290 168.934 > 1 5 Tm 0.43202316985514 0.42865685733078 0.17565451292710 168.934 > 5 6 Tm 0.93202316985514 0.42865685733078 0.17565451292710 168.934 > 5 7 Tm 0.43202316985514 0.92865685733078 0.17565451292710 168.934 > 5 8 Tm 0.93202316985514 0.92865685733078 0.17565451292710 168.934 > 5 9 Tm 0.06797683014486 0.17865685733078 0.32434548707290 168.934 > 9 10 Tm 0.56797683014486 0.17865685733078 0.32434548707290 168.934 > 9 11 Tm 0.06797683014486 0.67865685733078 0.32434548707290 168.934 > 9 12 Tm 0.56797683014486 0.67865685733078 0.32434548707290 168.934 > 9 13 Tm 0.43202316985514 0.32134314266922 0.67565451292710 168.934 > 13 14 Tm 0.93202316985514 0.32134314266922 0.67565451292710 168.934 > 13 15 Tm 0.43202316985514 0.82134314266922 0.67565451292710 168.934 > 13 16 Tm 0.93202316985514 0.82134314266922 0.67565451292710 168.934 > 13 17 Se 0.32181608597186 0.05869501158398 0.70713437896013 78.960 > 17 18 Se 0.82181608597186 0.05869501158398 0.70713437896013 78.960 > 17 19 Se 0.32181608597186 0.55869501158398 0.70713437896013 78.960 > 17 20 Se 0.82181608597186 0.55869501158398 0.70713437896013 78.960 > 17 21 Se 0.32181608597186 0.19130498841602 0.20713437896014 78.960 > 21 22 Se 0.82181608597186 0.19130498841602 0.20713437896014 78.960 > 21 23 Se 0.32181608597186 0.69130498841602 0.20713437896014 78.960 > 21 24 Se 0.82181608597186 0.69130498841602 0.20713437896014 78.960 > 21 25 Se 0.17818391402815 0.44130498841602 0.29286562103987 78.960 > 25 26 Se 0.67818391402815 0.44130498841602 0.29286562103987 78.960 > 25 27 Se 0.17818391402815 0.94130498841602 0.29286562103987 78.960 > 25 28 Se 0.67818391402815 0.94130498841602 0.29286562103987 78.960 > 25 29 Se 0.17818391402815 0.30869501158398 0.79286562103987 78.960 > 29 30 Se 0.67818391402815 0.30869501158398 0.79286562103987 78.960 > 29 31 Se 0.17818391402815 0.80869501158398 0.79286562103987 78.960 > 29 32 Se 0.67818391402815 0.80869501158398 0.79286562103987 78.960 > 29 33 O 0.41347828365288 0.26743847842204 0.35266377557945 15.999 > 33 34 O 0.91347828365288 0.26743847842204 0.35266377557945 15.999 > 33 35 O 0.41347828365288 0.76743847842204 0.35266377557945 15.999 > 33 36 O 0.91347828365288 0.76743847842204 0.35266377557945 15.999 > 33 37 O 0.08652171634712 0.23256152157796 0.64733622442055 15.999 > 37 38 O 0.58652171634712 0.23256152157796 0.64733622442055 15.999 > 37 39 O 0.08652171634712 0.73256152157796 0.64733622442055 15.999 > 37 40 O 0.58652171634712 0.73256152157796 0.64733622442055 15.999 > 37 41 O 0.08754215949563 0.40362104731684 0.78357274227738 15.999 > 41 42 O 0.58754215949563 0.40362104731684 0.78357274227738 15.999 > 41 43 O 0.08754215949563 0.90362104731684 0.78357274227738 15.999 > 41 44 O 0.58754215949563 0.90362104731684 0.78357274227738 15.999 > 41 45 O 0.08754215949563 0.34637895268316 0.28357274227738 15.999 > 45 46 O 0.58754215949563 0.34637895268316 0.28357274227738 15.999 > 45 47 O 0.08754215949563 0.84637895268316 0.28357274227738 15.999 > 45 48 O 0.58754215949563 0.84637895268316 0.28357274227738 15.999 > 45 49 O 0.24098320567974 0.09491583496055 0.86374493545008 15.999 > 49 50 O 0.74098320567974 0.09491583496055 0.86374493545008 15.999 > 49 51 O 0.24098320567974 0.59491583496055 0.86374493545008 15.999 > 49 52 O 0.74098320567974 0.59491583496055 0.86374493545008 15.999 > 49 53 O 0.41347828365288 0.48256152157796 0.85266377557945 15.999 > 53 54 O 0.91347828365288 0.48256152157796 0.85266377557945 15.999 > 53 55 O 0.41347828365288 0.98256152157796 0.85266377557945 15.999 > 53 56 O 0.91347828365288 0.98256152157796 0.85266377557945 15.999 > 53 57 O 0.41245784050437 0.15362104731684 0.71642725772262 15.999 > 57 58 O 0.91245784050437 0.15362104731684 0.71642725772262 15.999 > 57 59 O 0.41245784050437 0.65362104731684 0.71642725772262 15.999 > 57 60 O 0.91245784050437 0.65362104731684 0.71642725772262 15.999 > 57 61 O 0.24098320567974 0.15508416503945 0.36374493545008 15.999 > 61 62 O 0.74098320567974 0.15508416503945 0.36374493545008 15.999 > 61 63 O 0.24098320567974 0.65508416503945 0.36374493545008 15.999 > 61 64 O 0.74098320567974 0.65508416503945 0.36374493545008 15.999 > 61 65 O 0.08652171634712 0.01743847842204 0.14733622442055 15.999 > 65 66 O 0.58652171634712 0.01743847842204 0.14733622442055 15.999 > 65 67 O 0.08652171634712 0.51743847842204 0.14733622442055 15.999 > 65 68 O 0.58652171634712 0.51743847842204 0.14733622442055 15.999 > 65 69 O 0.25901679432026 0.40508416503945 0.13625506454992 15.999 > 69 70 O 0.75901679432026 0.40508416503945 0.13625506454992 15.999 > 69 71 O 0.25901679432026 0.90508416503945 0.13625506454992 15.999 > 69 72 O 0.75901679432026 0.90508416503945 0.13625506454992 15.999 > 69 73 O 0.25901679432026 0.34491583496055 0.63625506454992 15.999 > 73 74 O 0.75901679432026 0.34491583496055 0.63625506454992 15.999 > 73 75 O 0.25901679432026 0.84491583496055 0.63625506454992 15.999 > 73 76 O 0.75901679432026 0.84491583496055 0.63625506454992 15.999 > 73 77 O 0.41245784050437 0.09637895268316 0.21642725772262 15.999 > 77 78 O 0.91245784050437 0.09637895268316 0.21642725772262 15.999 > 77 79 O 0.41245784050437 0.59637895268316 0.21642725772262 15.999 > 77 80 O 0.91245784050437 0.59637895268316 0.21642725772262 15.999 > 77 81 F 0.08449141155048 0.19379368500114 0.02498324242224 18.998 > 81 82 F 0.58449141155048 0.19379368500114 0.02498324242224 18.998 > 81 83 F 0.08449141155048 0.69379368500114 0.02498324242224 18.998 > 81 84 F 0.58449141155048 0.69379368500114 0.02498324242224 18.998 > 81 85 F 0.41550858844952 0.30620631499886 0.97501675757776 18.998 > 85 86 F 0.91550858844952 0.30620631499886 0.97501675757776 18.998 > 85 87 F 0.41550858844952 0.80620631499886 0.97501675757776 18.998 > 85 88 F 0.91550858844952 0.80620631499886 0.97501675757776 18.998 > 85 89 F 0.41550858844952 0.44379368500114 0.47501675757776 18.998 > 89 90 F 0.91550858844952 0.44379368500114 0.47501675757776 18.998 > 89 91 F 0.41550858844952 0.94379368500114 0.47501675757776 18.998 > 89 92 F 0.91550858844952 0.94379368500114 0.47501675757776 18.998 > 89 93 F 0.08449141155048 0.05620631499886 0.52498324242224 18.998 > 93 94 F 0.58449141155048 0.05620631499886 0.52498324242224 18.998 > 93 95 F 0.08449141155048 0.55620631499886 0.52498324242224 18.998 > 93 96 F 0.58449141155048 0.55620631499886 0.52498324242224 18.998 > 93 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.0854198 0.0000000 -0.0951328 0.0000000 3.7954345 0.0000000 -0.0951262 0.0000000 3.5401719 -------------------------- Born effective charges -------------------------- 1 Tm 4.4394991 0.0278366 0.0796825 0.0966911 3.9092432 -0.2595232 -0.2372936 0.2249289 3.7830245 2 Tm 4.4394991 0.0278366 0.0796825 0.0966911 3.9092432 -0.2595232 -0.2372936 0.2249289 3.7830245 3 Tm 4.4394991 -0.0278366 0.0796825 -0.0966911 3.9092432 0.2595232 -0.2372936 -0.2249289 3.7830245 4 Tm 4.4394991 -0.0278366 0.0796825 -0.0966911 3.9092432 0.2595232 -0.2372936 -0.2249289 3.7830245 5 Se 3.6209860 -0.0903114 -0.3983277 -0.4176019 3.0594293 -0.2519117 -0.2105012 -0.3379882 2.6386920 6 Se 3.6209860 0.0903114 -0.3983277 0.4176019 3.0594293 0.2519117 -0.2105012 0.3379882 2.6386920 7 Se 3.6209860 -0.0903114 -0.3983277 -0.4176019 3.0594293 -0.2519117 -0.2105012 -0.3379882 2.6386920 8 Se 3.6209860 0.0903114 -0.3983277 0.4176019 3.0594293 0.2519117 -0.2105012 0.3379882 2.6386920 9 O -2.0415915 -0.1468390 -0.4827719 -0.7264458 -1.9851346 -0.7466029 -0.3699422 -0.3280374 -1.9552152 10 O -2.0415915 -0.1468390 -0.4827719 -0.7264458 -1.9851346 -0.7466029 -0.3699422 -0.3280374 -1.9552152 11 O -2.1556015 0.6067492 -0.3131647 0.6725673 -2.3941421 -0.0599269 0.0935227 -0.4548821 -0.9187410 12 O -2.1556015 -0.6067492 -0.3131647 -0.6725673 -2.3941421 0.0599269 0.0935227 0.4548821 -0.9187410 13 O -2.8416693 0.4006919 0.9098801 0.2491810 -1.1977705 -0.4229768 0.3975576 -0.3754054 -1.5718395 14 O -2.0415915 0.1468390 -0.4827719 0.7264458 -1.9851346 0.7466029 -0.3699422 0.3280374 -1.9552152 15 O -2.1556015 -0.6067492 -0.3131647 -0.6725673 -2.3941421 0.0599269 0.0935227 0.4548821 -0.9187410 16 O -2.8416693 -0.4006919 0.9098801 -0.2491810 -1.1977705 0.4229768 0.3975576 0.3754054 -1.5718395 17 O -2.0415915 0.1468390 -0.4827719 0.7264458 -1.9851346 0.7466029 -0.3699422 0.3280374 -1.9552152 18 O -2.8416693 0.4006919 0.9098801 0.2491810 -1.1977705 -0.4229768 0.3975576 -0.3754054 -1.5718395 19 O -2.8416693 -0.4006919 0.9098801 -0.2491810 -1.1977705 0.4229768 0.3975576 0.3754054 -1.5718395 20 O -2.1556015 0.6067492 -0.3131647 0.6725673 -2.3941421 -0.0599269 0.0935227 -0.4548821 -0.9187410 21 F -1.0216228 -0.0735435 0.2047018 -0.1087727 -1.3916254 -0.2183645 0.3266568 -0.0602214 -1.9759208 22 F -1.0216228 -0.0735435 0.2047018 -0.1087727 -1.3916254 -0.2183645 0.3266568 -0.0602214 -1.9759208 23 F -1.0216228 0.0735435 0.2047018 0.1087727 -1.3916254 0.2183645 0.3266568 0.0602214 -1.9759208 24 F -1.0216228 0.0735435 0.2047018 0.1087727 -1.3916254 0.2183645 0.3266568 0.0602214 -1.9759208 ---------------------------------------------------------------------------- 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] [-0.0015 0.0000 0.0099] [ 0.0015 0.0000 -0.0099] 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] [-0.0015 0.0000 0.0099] [ 0.0015 0.0000 -0.0099] Computing fc3[ 33, 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] [-0.0015 0.0000 0.0099] [ 0.0015 0.0000 -0.0099] 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] [-0.0015 0.0000 0.0099] [ 0.0015 0.0000 -0.0099] 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] [-0.0015 0.0000 0.0099] [ 0.0015 0.0000 -0.0099] Computing fc3[ 81, 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] [-0.0015 0.0000 0.0099] [ 0.0015 0.0000 -0.0099] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000002 (zzz) 0.00000002 (zzz) 0.00000002 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000002 (zx) 0.00000002 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 13:33:42]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 13:33:42]------------------------- 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): [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.495415020203528 0.000000000000000 0.000000000000000 b 0.000000000000000 6.759527850000000 0.000000000000000 c -1.075998268196466 0.000000000000000 6.937305702234957 Atomic positions (fractional): 1 Tm 0.13595366028972 0.14268628533843 0.82434548707290 168.934 2 Tm 0.86404633971028 0.85731371466157 0.17565451292710 168.934 3 Tm 0.13595366028972 0.35731371466157 0.32434548707290 168.934 4 Tm 0.86404633971028 0.64268628533843 0.67565451292710 168.934 5 Se 0.64363217194371 0.11739002316795 0.70713437896013 78.960 6 Se 0.64363217194371 0.38260997683205 0.20713437896014 78.960 7 Se 0.35636782805629 0.88260997683205 0.29286562103987 78.960 8 Se 0.35636782805629 0.61739002316795 0.79286562103987 78.960 9 O 0.82695656730576 0.53487695684409 0.35266377557945 15.999 10 O 0.17304343269424 0.46512304315591 0.64733622442055 15.999 11 O 0.17508431899126 0.80724209463369 0.78357274227738 15.999 12 O 0.17508431899126 0.69275790536631 0.28357274227738 15.999 13 O 0.48196641135948 0.18983166992110 0.86374493545008 15.999 14 O 0.82695656730576 0.96512304315591 0.85266377557945 15.999 15 O 0.82491568100874 0.30724209463369 0.71642725772262 15.999 16 O 0.48196641135948 0.31016833007890 0.36374493545008 15.999 17 O 0.17304343269424 0.03487695684409 0.14733622442055 15.999 18 O 0.51803358864052 0.81016833007890 0.13625506454992 15.999 19 O 0.51803358864052 0.68983166992110 0.63625506454992 15.999 20 O 0.82491568100874 0.19275790536631 0.21642725772262 15.999 21 F 0.16898282310095 0.38758737000228 0.02498324242224 18.998 22 F 0.83101717689905 0.61241262999772 0.97501675757776 18.998 23 F 0.83101717689905 0.88758737000228 0.47501675757776 18.998 24 F 0.16898282310095 0.11241262999772 0.52498324242224 18.998 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.990830040407056 0.000000000000000 0.000000000000000 b 0.000000000000000 13.519055699999999 0.000000000000000 c -1.075998268196466 0.000000000000000 6.937305702234957 Atomic positions (fractional): 1 Tm 0.06797683014486 0.07134314266922 0.82434548707290 168.934 > 1 2 Tm 0.56797683014486 0.07134314266922 0.82434548707290 168.934 > 1 3 Tm 0.06797683014486 0.57134314266922 0.82434548707290 168.934 > 1 4 Tm 0.56797683014486 0.57134314266922 0.82434548707290 168.934 > 1 5 Tm 0.43202316985514 0.42865685733078 0.17565451292710 168.934 > 5 6 Tm 0.93202316985514 0.42865685733078 0.17565451292710 168.934 > 5 7 Tm 0.43202316985514 0.92865685733078 0.17565451292710 168.934 > 5 8 Tm 0.93202316985514 0.92865685733078 0.17565451292710 168.934 > 5 9 Tm 0.06797683014486 0.17865685733078 0.32434548707290 168.934 > 9 10 Tm 0.56797683014486 0.17865685733078 0.32434548707290 168.934 > 9 11 Tm 0.06797683014486 0.67865685733078 0.32434548707290 168.934 > 9 12 Tm 0.56797683014486 0.67865685733078 0.32434548707290 168.934 > 9 13 Tm 0.43202316985514 0.32134314266922 0.67565451292710 168.934 > 13 14 Tm 0.93202316985514 0.32134314266922 0.67565451292710 168.934 > 13 15 Tm 0.43202316985514 0.82134314266922 0.67565451292710 168.934 > 13 16 Tm 0.93202316985514 0.82134314266922 0.67565451292710 168.934 > 13 17 Se 0.32181608597186 0.05869501158398 0.70713437896013 78.960 > 17 18 Se 0.82181608597186 0.05869501158398 0.70713437896013 78.960 > 17 19 Se 0.32181608597186 0.55869501158398 0.70713437896013 78.960 > 17 20 Se 0.82181608597186 0.55869501158398 0.70713437896013 78.960 > 17 21 Se 0.32181608597186 0.19130498841602 0.20713437896014 78.960 > 21 22 Se 0.82181608597186 0.19130498841602 0.20713437896014 78.960 > 21 23 Se 0.32181608597186 0.69130498841602 0.20713437896014 78.960 > 21 24 Se 0.82181608597186 0.69130498841602 0.20713437896014 78.960 > 21 25 Se 0.17818391402815 0.44130498841602 0.29286562103987 78.960 > 25 26 Se 0.67818391402815 0.44130498841602 0.29286562103987 78.960 > 25 27 Se 0.17818391402815 0.94130498841602 0.29286562103987 78.960 > 25 28 Se 0.67818391402815 0.94130498841602 0.29286562103987 78.960 > 25 29 Se 0.17818391402815 0.30869501158398 0.79286562103987 78.960 > 29 30 Se 0.67818391402815 0.30869501158398 0.79286562103987 78.960 > 29 31 Se 0.17818391402815 0.80869501158398 0.79286562103987 78.960 > 29 32 Se 0.67818391402815 0.80869501158398 0.79286562103987 78.960 > 29 33 O 0.41347828365288 0.26743847842204 0.35266377557945 15.999 > 33 34 O 0.91347828365288 0.26743847842204 0.35266377557945 15.999 > 33 35 O 0.41347828365288 0.76743847842204 0.35266377557945 15.999 > 33 36 O 0.91347828365288 0.76743847842204 0.35266377557945 15.999 > 33 37 O 0.08652171634712 0.23256152157796 0.64733622442055 15.999 > 37 38 O 0.58652171634712 0.23256152157796 0.64733622442055 15.999 > 37 39 O 0.08652171634712 0.73256152157796 0.64733622442055 15.999 > 37 40 O 0.58652171634712 0.73256152157796 0.64733622442055 15.999 > 37 41 O 0.08754215949563 0.40362104731684 0.78357274227738 15.999 > 41 42 O 0.58754215949563 0.40362104731684 0.78357274227738 15.999 > 41 43 O 0.08754215949563 0.90362104731684 0.78357274227738 15.999 > 41 44 O 0.58754215949563 0.90362104731684 0.78357274227738 15.999 > 41 45 O 0.08754215949563 0.34637895268316 0.28357274227738 15.999 > 45 46 O 0.58754215949563 0.34637895268316 0.28357274227738 15.999 > 45 47 O 0.08754215949563 0.84637895268316 0.28357274227738 15.999 > 45 48 O 0.58754215949563 0.84637895268316 0.28357274227738 15.999 > 45 49 O 0.24098320567974 0.09491583496055 0.86374493545008 15.999 > 49 50 O 0.74098320567974 0.09491583496055 0.86374493545008 15.999 > 49 51 O 0.24098320567974 0.59491583496055 0.86374493545008 15.999 > 49 52 O 0.74098320567974 0.59491583496055 0.86374493545008 15.999 > 49 53 O 0.41347828365288 0.48256152157796 0.85266377557945 15.999 > 53 54 O 0.91347828365288 0.48256152157796 0.85266377557945 15.999 > 53 55 O 0.41347828365288 0.98256152157796 0.85266377557945 15.999 > 53 56 O 0.91347828365288 0.98256152157796 0.85266377557945 15.999 > 53 57 O 0.41245784050437 0.15362104731684 0.71642725772262 15.999 > 57 58 O 0.91245784050437 0.15362104731684 0.71642725772262 15.999 > 57 59 O 0.41245784050437 0.65362104731684 0.71642725772262 15.999 > 57 60 O 0.91245784050437 0.65362104731684 0.71642725772262 15.999 > 57 61 O 0.24098320567974 0.15508416503945 0.36374493545008 15.999 > 61 62 O 0.74098320567974 0.15508416503945 0.36374493545008 15.999 > 61 63 O 0.24098320567974 0.65508416503945 0.36374493545008 15.999 > 61 64 O 0.74098320567974 0.65508416503945 0.36374493545008 15.999 > 61 65 O 0.08652171634712 0.01743847842204 0.14733622442055 15.999 > 65 66 O 0.58652171634712 0.01743847842204 0.14733622442055 15.999 > 65 67 O 0.08652171634712 0.51743847842204 0.14733622442055 15.999 > 65 68 O 0.58652171634712 0.51743847842204 0.14733622442055 15.999 > 65 69 O 0.25901679432026 0.40508416503945 0.13625506454992 15.999 > 69 70 O 0.75901679432026 0.40508416503945 0.13625506454992 15.999 > 69 71 O 0.25901679432026 0.90508416503945 0.13625506454992 15.999 > 69 72 O 0.75901679432026 0.90508416503945 0.13625506454992 15.999 > 69 73 O 0.25901679432026 0.34491583496055 0.63625506454992 15.999 > 73 74 O 0.75901679432026 0.34491583496055 0.63625506454992 15.999 > 73 75 O 0.25901679432026 0.84491583496055 0.63625506454992 15.999 > 73 76 O 0.75901679432026 0.84491583496055 0.63625506454992 15.999 > 73 77 O 0.41245784050437 0.09637895268316 0.21642725772262 15.999 > 77 78 O 0.91245784050437 0.09637895268316 0.21642725772262 15.999 > 77 79 O 0.41245784050437 0.59637895268316 0.21642725772262 15.999 > 77 80 O 0.91245784050437 0.59637895268316 0.21642725772262 15.999 > 77 81 F 0.08449141155048 0.19379368500114 0.02498324242224 18.998 > 81 82 F 0.58449141155048 0.19379368500114 0.02498324242224 18.998 > 81 83 F 0.08449141155048 0.69379368500114 0.02498324242224 18.998 > 81 84 F 0.58449141155048 0.69379368500114 0.02498324242224 18.998 > 81 85 F 0.41550858844952 0.30620631499886 0.97501675757776 18.998 > 85 86 F 0.91550858844952 0.30620631499886 0.97501675757776 18.998 > 85 87 F 0.41550858844952 0.80620631499886 0.97501675757776 18.998 > 85 88 F 0.91550858844952 0.80620631499886 0.97501675757776 18.998 > 85 89 F 0.41550858844952 0.44379368500114 0.47501675757776 18.998 > 89 90 F 0.91550858844952 0.44379368500114 0.47501675757776 18.998 > 89 91 F 0.41550858844952 0.94379368500114 0.47501675757776 18.998 > 89 92 F 0.91550858844952 0.94379368500114 0.47501675757776 18.998 > 89 93 F 0.08449141155048 0.05620631499886 0.52498324242224 18.998 > 93 94 F 0.58449141155048 0.05620631499886 0.52498324242224 18.998 > 93 95 F 0.08449141155048 0.55620631499886 0.52498324242224 18.998 > 93 96 F 0.58449141155048 0.55620631499886 0.52498324242224 18.998 > 93 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.0854198 0.0000000 -0.0951328 0.0000000 3.7954345 0.0000000 -0.0951262 0.0000000 3.5401719 -------------------------- Born effective charges -------------------------- 1 Tm 4.4394991 0.0278366 0.0796825 0.0966911 3.9092432 -0.2595232 -0.2372936 0.2249289 3.7830245 2 Tm 4.4394991 0.0278366 0.0796825 0.0966911 3.9092432 -0.2595232 -0.2372936 0.2249289 3.7830245 3 Tm 4.4394991 -0.0278366 0.0796825 -0.0966911 3.9092432 0.2595232 -0.2372936 -0.2249289 3.7830245 4 Tm 4.4394991 -0.0278366 0.0796825 -0.0966911 3.9092432 0.2595232 -0.2372936 -0.2249289 3.7830245 5 Se 3.6209860 -0.0903114 -0.3983277 -0.4176019 3.0594293 -0.2519117 -0.2105012 -0.3379882 2.6386920 6 Se 3.6209860 0.0903114 -0.3983277 0.4176019 3.0594293 0.2519117 -0.2105012 0.3379882 2.6386920 7 Se 3.6209860 -0.0903114 -0.3983277 -0.4176019 3.0594293 -0.2519117 -0.2105012 -0.3379882 2.6386920 8 Se 3.6209860 0.0903114 -0.3983277 0.4176019 3.0594293 0.2519117 -0.2105012 0.3379882 2.6386920 9 O -2.0415915 -0.1468390 -0.4827719 -0.7264458 -1.9851346 -0.7466029 -0.3699422 -0.3280374 -1.9552152 10 O -2.0415915 -0.1468390 -0.4827719 -0.7264458 -1.9851346 -0.7466029 -0.3699422 -0.3280374 -1.9552152 11 O -2.1556015 0.6067492 -0.3131647 0.6725673 -2.3941421 -0.0599269 0.0935227 -0.4548821 -0.9187410 12 O -2.1556015 -0.6067492 -0.3131647 -0.6725673 -2.3941421 0.0599269 0.0935227 0.4548821 -0.9187410 13 O -2.8416693 0.4006919 0.9098801 0.2491810 -1.1977705 -0.4229768 0.3975576 -0.3754054 -1.5718395 14 O -2.0415915 0.1468390 -0.4827719 0.7264458 -1.9851346 0.7466029 -0.3699422 0.3280374 -1.9552152 15 O -2.1556015 -0.6067492 -0.3131647 -0.6725673 -2.3941421 0.0599269 0.0935227 0.4548821 -0.9187410 16 O -2.8416693 -0.4006919 0.9098801 -0.2491810 -1.1977705 0.4229768 0.3975576 0.3754054 -1.5718395 17 O -2.0415915 0.1468390 -0.4827719 0.7264458 -1.9851346 0.7466029 -0.3699422 0.3280374 -1.9552152 18 O -2.8416693 0.4006919 0.9098801 0.2491810 -1.1977705 -0.4229768 0.3975576 -0.3754054 -1.5718395 19 O -2.8416693 -0.4006919 0.9098801 -0.2491810 -1.1977705 0.4229768 0.3975576 0.3754054 -1.5718395 20 O -2.1556015 0.6067492 -0.3131647 0.6725673 -2.3941421 -0.0599269 0.0935227 -0.4548821 -0.9187410 21 F -1.0216228 -0.0735435 0.2047018 -0.1087727 -1.3916254 -0.2183645 0.3266568 -0.0602214 -1.9759208 22 F -1.0216228 -0.0735435 0.2047018 -0.1087727 -1.3916254 -0.2183645 0.3266568 -0.0602214 -1.9759208 23 F -1.0216228 0.0735435 0.2047018 0.1087727 -1.3916254 0.2183645 0.3266568 0.0602214 -1.9759208 24 F -1.0216228 0.0735435 0.2047018 0.1087727 -1.3916254 0.2183645 0.3266568 0.0602214 -1.9759208 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000002 (zzz) 0.00000002 (zzz) 0.00000002 (zzz) Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 8 7 7 ] 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: 0.62, Number of G-points: 293, Lambda: 0.13 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/116) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116 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 1.903 ( 0.000 0.000 0.000) 0.000 2.204 ( 0.000 0.000 0.000) 0.000 2.778 ( 0.000 0.000 0.000) 0.000 2.927 ( 0.000 0.000 0.000) 0.000 3.107 ( 0.000 0.000 0.000) 0.000 3.221 ( 0.000 0.000 0.000) 0.000 3.237 ( 0.000 0.000 0.000) 0.000 3.454 ( 0.000 0.000 0.000) 0.000 3.564 ( 0.000 0.000 0.000) 0.000 3.668 ( 0.000 0.000 0.000) 0.000 3.702 ( 0.000 0.000 0.000) 0.000 3.740 ( 0.000 0.000 0.000) 0.000 3.915 ( 0.000 0.000 0.000) 0.000 4.077 ( 0.000 0.000 0.000) 0.000 4.290 ( 0.000 0.000 0.000) 0.000 4.476 ( 0.000 0.000 0.000) 0.000 4.607 ( 0.000 0.000 0.000) 0.000 4.884 ( 0.000 0.000 0.000) 0.000 5.313 ( 0.000 0.000 0.000) 0.000 5.314 ( 0.000 0.000 0.000) 0.000 5.416 ( 0.000 0.000 0.000) 0.000 5.780 ( 0.000 0.000 0.000) 0.000 6.017 ( 0.000 0.000 0.000) 0.000 6.186 ( 0.000 0.000 0.000) 0.000 6.264 ( 0.000 0.000 0.000) 0.000 6.413 ( 0.000 0.000 0.000) 0.000 6.447 ( 0.000 0.000 0.000) 0.000 6.599 ( 0.000 0.000 0.000) 0.000 6.865 ( 0.000 0.000 0.000) 0.000 7.223 ( 0.000 0.000 0.000) 0.000 7.339 ( 0.000 0.000 0.000) 0.000 7.630 ( 0.000 0.000 0.000) 0.000 7.901 ( 0.000 0.000 0.000) 0.000 8.197 ( 0.000 0.000 0.000) 0.000 8.338 ( 0.000 0.000 0.000) 0.000 8.551 ( 0.000 0.000 0.000) 0.000 8.725 ( 0.000 0.000 0.000) 0.000 9.296 ( 0.000 0.000 0.000) 0.000 9.443 ( 0.000 0.000 0.000) 0.000 9.886 ( 0.000 0.000 0.000) 0.000 10.047 ( 0.000 0.000 0.000) 0.000 10.423 ( 0.000 0.000 0.000) 0.000 10.643 ( 0.000 0.000 0.000) 0.000 11.027 ( 0.000 0.000 0.000) 0.000 11.269 ( 0.000 0.000 0.000) 0.000 11.724 ( 0.000 0.000 0.000) 0.000 11.917 ( 0.000 0.000 0.000) 0.000 12.562 ( 0.000 0.000 0.000) 0.000 12.736 ( 0.000 0.000 0.000) 0.000 12.898 ( 0.000 0.000 0.000) 0.000 12.987 ( 0.000 0.000 0.000) 0.000 13.781 ( 0.000 0.000 0.000) 0.000 13.837 ( 0.000 0.000 0.000) 0.000 14.042 ( 0.000 0.000 0.000) 0.000 14.101 ( 0.000 0.000 0.000) 0.000 14.220 ( 0.000 0.000 0.000) 0.000 14.354 ( 0.000 0.000 0.000) 0.000 18.758 ( 0.000 0.000 0.000) 0.000 18.977 ( 0.000 0.000 0.000) 0.000 19.840 ( 0.000 0.000 0.000) 0.000 19.950 ( 0.000 0.000 0.000) 0.000 21.589 ( 0.000 0.000 0.000) 0.000 21.762 ( 0.000 0.000 0.000) 0.000 21.855 ( 0.000 0.000 0.000) 0.000 21.993 ( 0.000 0.000 0.000) 0.000 23.535 ( 0.000 0.000 0.000) 0.000 23.758 ( 0.000 0.000 0.000) 0.000 23.900 ( 0.000 0.000 0.000) 0.000 24.371 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/116) ======================= q-point: ( 0.12 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.442 ( 20.682 0.000 13.419) 24.654 0.484 ( 23.786 0.000 2.772) 23.947 1.098 ( 54.266 0.000 -2.136) 54.308 2.049 ( 12.281 0.000 4.125) 12.956 2.196 ( -0.658 0.000 0.138) 0.672 2.874 ( 8.919 0.000 -2.606) 9.292 2.988 ( 4.908 0.000 -0.997) 5.008 2.993 ( -9.444 0.000 -2.009) 9.656 3.215 ( -0.535 0.000 0.129) 0.550 3.255 ( 3.671 0.000 -2.335) 4.351 3.476 ( -2.071 0.000 -1.165) 2.376 3.485 ( 1.184 0.000 -2.847) 3.084 3.684 ( -3.121 0.000 -2.402) 3.938 3.733 ( -0.468 0.000 2.995) 3.031 3.810 ( 5.589 0.000 4.017) 6.883 4.008 ( 4.534 0.000 2.020) 4.963 4.256 ( -3.338 0.000 1.361) 3.604 4.293 ( -11.706 0.000 8.709) 14.590 4.341 ( 8.126 0.000 0.100) 8.126 4.814 ( 11.997 0.000 -5.389) 13.152 4.815 ( -6.123 0.000 -2.195) 6.504 5.155 ( -6.558 0.000 -2.527) 7.028 5.458 ( -1.063 0.000 7.195) 7.273 5.476 ( 6.343 0.000 7.362) 9.718 5.788 ( 1.275 0.000 -5.154) 5.310 6.036 ( 0.915 0.000 -0.056) 0.916 6.207 ( 1.618 0.000 -1.714) 2.357 6.230 ( -1.314 0.000 0.731) 1.503 6.408 ( 0.417 0.000 -0.955) 1.042 6.665 ( 4.563 0.000 1.242) 4.729 6.925 ( 4.336 0.000 3.368) 5.490 7.155 ( -5.983 0.000 12.499) 13.858 7.163 ( -4.611 0.000 -0.327) 4.622 7.704 ( 6.506 0.000 0.360) 6.516 7.875 ( -2.758 0.000 1.977) 3.393 8.030 ( 3.642 0.000 -26.523) 26.772 8.162 ( -3.076 0.000 -0.899) 3.205 8.351 ( 1.269 0.000 0.125) 1.275 8.523 ( -1.877 0.000 1.233) 2.246 8.850 ( -0.230 0.000 3.549) 3.556 9.432 ( -0.359 0.000 -4.222) 4.237 9.603 ( 6.697 0.000 -35.423) 36.051 9.917 ( 2.788 0.000 -0.163) 2.793 10.062 ( 2.191 0.000 -1.279) 2.536 10.425 ( 0.106 0.000 0.436) 0.448 10.646 ( 0.195 0.000 1.040) 1.059 11.043 ( -1.969 0.000 -11.756) 11.920 11.232 ( -3.977 0.000 0.634) 4.028 11.826 ( -5.645 0.000 23.987) 24.642 11.947 ( 1.267 0.000 6.911) 7.026 12.581 ( 2.154 0.000 -0.991) 2.371 12.735 ( -0.276 0.000 1.268) 1.297 12.993 ( 0.838 0.000 0.018) 0.839 13.221 ( 0.683 0.000 14.214) 14.230 13.513 ( -15.361 0.000 -3.668) 15.793 13.878 ( -12.982 0.000 2.510) 13.222 14.065 ( -3.457 0.000 -0.701) 3.527 14.113 ( 6.469 0.000 2.406) 6.902 14.633 ( 16.535 0.000 -2.511) 16.725 15.410 ( -5.470 0.000 26.014) 26.583 18.723 ( -3.438 0.000 1.215) 3.647 18.994 ( 1.978 0.000 -1.704) 2.611 19.900 ( 6.101 0.000 -3.000) 6.799 19.945 ( -4.860 0.000 11.384) 12.378 21.515 ( -5.464 0.000 -0.914) 5.540 21.965 ( 8.603 0.000 3.948) 9.465 21.984 ( -1.099 0.000 1.346) 1.738 23.353 ( 1.150 0.000 20.067) 20.100 23.762 ( 0.470 0.000 -0.196) 0.509 23.881 ( -1.170 0.000 -4.735) 4.877 24.392 ( 1.930 0.000 1.183) 2.264 24.656 ( 14.659 0.000 -88.473) 89.679 ======================= Grid point 2 (3/116) ======================= q-point: ( 0.25 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.870 ( 19.655 0.000 12.163) 23.114 0.903 ( 17.833 0.000 3.683) 18.209 1.893 ( 16.055 0.000 -3.039) 16.340 2.276 ( 7.087 0.000 7.607) 10.397 2.304 ( 23.517 0.000 -0.158) 23.517 2.836 ( -4.558 0.000 -3.318) 5.638 3.023 ( -0.813 0.000 -2.844) 2.958 3.031 ( 7.520 0.000 -5.213) 9.150 3.286 ( 6.860 0.000 1.513) 7.024 3.320 ( 2.989 0.000 -7.047) 7.655 3.484 ( -0.670 0.000 -0.654) 0.936 3.520 ( 6.755 0.000 -0.676) 6.789 3.573 ( -6.103 0.000 -1.694) 6.334 3.728 ( -1.068 0.000 1.941) 2.215 3.930 ( 3.386 0.000 0.838) 3.488 4.054 ( 2.516 0.000 1.632) 2.999 4.158 ( 0.075 0.000 3.191) 3.191 4.228 ( -1.761 0.000 2.589) 3.130 4.497 ( -1.523 0.000 -1.737) 2.310 4.760 ( 7.972 0.000 1.642) 8.139 4.995 ( 8.588 0.000 -4.684) 9.782 5.056 ( -3.211 0.000 -0.620) 3.270 5.456 ( -1.934 0.000 8.911) 9.119 5.590 ( 3.205 0.000 7.037) 7.733 5.793 ( 1.351 0.000 -6.315) 6.458 6.026 ( -1.045 0.000 -1.497) 1.825 6.184 ( -3.530 0.000 -3.132) 4.719 6.270 ( 4.220 0.000 3.335) 5.379 6.470 ( 6.404 0.000 -2.039) 6.720 6.701 ( -2.198 0.000 1.213) 2.511 6.961 ( -3.213 0.000 1.709) 3.639 7.036 ( -9.329 0.000 6.374) 11.298 7.132 ( 2.838 0.000 0.653) 2.912 7.818 ( -3.903 0.000 4.350) 5.845 7.846 ( 7.308 0.000 0.718) 7.343 7.966 ( -3.414 0.000 -17.649) 17.976 8.090 ( -3.682 0.000 -0.920) 3.795 8.384 ( 2.004 0.000 0.131) 2.008 8.543 ( 3.934 0.000 2.059) 4.440 8.852 ( -0.686 0.000 3.590) 3.655 9.410 ( -0.478 0.000 -4.111) 4.139 9.626 ( 2.811 0.000 -11.252) 11.598 9.965 ( 1.768 0.000 -0.001) 1.768 10.152 ( 8.070 0.000 -2.596) 8.477 10.426 ( -0.237 0.000 1.253) 1.275 10.657 ( 0.522 0.000 1.631) 1.712 10.943 ( -5.416 0.000 -5.073) 7.421 11.118 ( -8.042 0.000 0.867) 8.088 11.793 ( -2.527 0.000 7.350) 7.772 11.993 ( 1.773 0.000 3.246) 3.698 12.639 ( 4.114 0.000 -1.366) 4.334 12.735 ( -0.209 0.000 2.233) 2.243 13.023 ( 2.238 0.000 -0.106) 2.241 13.219 ( -13.524 0.000 -2.842) 13.819 13.286 ( 2.402 0.000 6.845) 7.254 13.620 ( -11.854 0.000 0.406) 11.861 13.975 ( -5.265 0.000 -1.047) 5.368 14.256 ( 5.682 0.000 2.359) 6.152 14.902 ( 11.685 0.000 -2.051) 11.864 15.373 ( -3.801 0.000 9.896) 10.601 18.653 ( -3.802 0.000 1.409) 4.055 19.038 ( 3.057 0.000 -2.717) 4.090 19.869 ( -5.603 0.000 7.541) 9.395 20.027 ( 7.457 0.000 -3.934) 8.431 21.415 ( -4.331 0.000 -0.331) 4.343 21.965 ( -1.142 0.000 1.720) 2.065 22.159 ( 9.406 0.000 4.661) 10.498 23.456 ( 4.896 0.000 7.278) 8.771 23.771 ( 0.432 0.000 -0.343) 0.552 23.833 ( -1.976 0.000 -6.655) 6.942 24.444 ( 2.715 0.000 1.680) 3.192 24.677 ( 6.444 0.000 -34.396) 34.994 ======================= Grid point 3 (4/116) ======================= q-point: ( 0.38 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.156 ( 6.996 0.000 3.528) 7.836 1.263 ( 17.481 0.000 10.130) 20.204 1.850 ( -9.169 0.000 -4.597) 10.257 2.398 ( 6.454 0.000 4.086) 7.639 2.751 ( -6.190 0.000 1.136) 6.294 2.886 ( 24.806 0.000 -3.444) 25.044 2.992 ( -0.164 0.000 0.544) 0.568 3.129 ( 4.569 0.000 -8.526) 9.673 3.322 ( 0.637 0.000 -5.168) 5.207 3.409 ( 4.319 0.000 0.932) 4.418 3.449 ( -5.140 0.000 0.009) 5.140 3.465 ( -1.105 0.000 0.872) 1.408 3.704 ( -1.548 0.000 1.382) 2.075 3.712 ( 10.047 0.000 -0.304) 10.052 3.948 ( 0.211 0.000 1.405) 1.420 4.128 ( 3.016 0.000 0.351) 3.036 4.209 ( 1.523 0.000 -1.726) 2.302 4.265 ( 4.421 0.000 2.657) 5.158 4.362 ( -6.565 0.000 0.241) 6.570 4.965 ( 3.975 0.000 0.796) 4.054 5.067 ( 7.622 0.000 0.293) 7.628 5.130 ( 6.935 0.000 -3.960) 7.986 5.417 ( -4.765 0.000 6.179) 7.803 5.634 ( -0.648 0.000 4.890) 4.932 5.831 ( 4.555 0.000 -2.394) 5.146 6.020 ( 1.152 0.000 -1.179) 1.648 6.089 ( -4.571 0.000 -2.598) 5.257 6.380 ( 5.548 0.000 3.499) 6.559 6.592 ( 6.030 0.000 -4.350) 7.435 6.612 ( -5.831 0.000 -0.088) 5.832 6.848 ( -10.841 0.000 5.230) 12.037 6.856 ( -6.702 0.000 0.273) 6.708 7.204 ( 3.024 0.000 0.385) 3.048 7.760 ( -3.581 0.000 6.722) 7.617 7.839 ( -3.572 0.000 -12.590) 13.086 7.960 ( 3.364 0.000 0.272) 3.375 8.036 ( -1.041 0.000 -0.148) 1.051 8.421 ( 1.561 0.000 0.065) 1.562 8.655 ( 5.894 0.000 1.060) 5.989 8.844 ( -1.014 0.000 1.958) 2.205 9.393 ( -0.256 0.000 -2.254) 2.268 9.638 ( 0.722 0.000 -3.624) 3.695 9.988 ( 0.804 0.000 0.036) 0.805 10.327 ( 9.070 0.000 -4.464) 10.109 10.437 ( 1.988 0.000 3.565) 4.082 10.679 ( 1.340 0.000 1.782) 2.230 10.822 ( -5.373 0.000 -2.906) 6.108 10.935 ( -10.796 0.000 0.594) 10.812 11.774 ( -1.003 0.000 2.519) 2.712 12.029 ( 1.200 0.000 1.085) 1.618 12.713 ( 2.672 0.000 -1.109) 2.893 12.749 ( 1.962 0.000 2.640) 3.289 12.994 ( -8.875 0.000 -2.312) 9.171 13.071 ( 2.394 0.000 -0.150) 2.399 13.342 ( 1.644 0.000 3.282) 3.671 13.447 ( -6.052 0.000 -0.207) 6.055 13.876 ( -4.166 0.000 -0.797) 4.242 14.337 ( 2.281 0.000 1.333) 2.642 15.064 ( 5.671 0.000 -1.133) 5.783 15.332 ( -2.354 0.000 3.757) 4.433 18.597 ( -2.195 0.000 0.855) 2.355 19.086 ( 2.445 0.000 -2.239) 3.315 19.790 ( -3.970 0.000 4.539) 6.030 20.139 ( 4.726 0.000 -2.630) 5.409 21.351 ( -2.214 0.000 -0.025) 2.215 21.953 ( -0.596 0.000 1.124) 1.272 22.328 ( 6.282 0.000 3.124) 7.016 23.569 ( 4.721 0.000 3.842) 6.086 23.770 ( -2.469 0.000 -5.652) 6.168 23.775 ( 0.087 0.000 -0.309) 0.321 24.495 ( 1.911 0.000 1.195) 2.254 24.695 ( 2.747 0.000 -13.526) 13.802 ======================= Grid point 4 (5/116) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.220 ( 0.000 0.000 0.000) 0.000 1.568 ( -0.000 0.000 -0.000) 0.000 1.632 ( 0.000 0.000 0.000) 0.000 2.557 ( -0.000 0.000 0.000) 0.000 2.604 ( 0.000 0.000 -0.000) 0.000 2.962 ( 0.000 0.000 0.000) 0.000 3.155 ( 0.000 0.000 0.000) 0.000 3.165 ( 0.000 0.000 0.000) 0.000 3.337 ( 0.000 0.000 0.000) 0.000 3.387 ( 0.000 0.000 -0.000) 0.000 3.448 ( 0.000 0.000 -0.000) 0.000 3.452 ( -0.000 0.000 0.000) 0.000 3.690 ( 0.000 0.000 0.000) 0.000 3.821 ( 0.000 0.000 0.000) 0.000 3.956 ( 0.000 0.000 0.000) 0.000 4.145 ( 0.000 0.000 -0.000) 0.000 4.228 ( 0.000 0.000 0.000) 0.000 4.308 ( 0.000 0.000 0.000) 0.000 4.313 ( 0.000 0.000 0.000) 0.000 4.983 ( 0.000 0.000 0.000) 0.000 5.180 ( 0.000 0.000 0.000) 0.000 5.212 ( 0.000 0.000 0.000) 0.000 5.351 ( 0.000 0.000 0.000) 0.000 5.622 ( 0.000 0.000 -0.000) 0.000 5.909 ( -0.000 0.000 -0.000) 0.000 6.021 ( 0.000 0.000 0.000) 0.000 6.040 ( 0.000 0.000 -0.000) 0.000 6.466 ( -0.000 0.000 -0.000) 0.000 6.532 ( 0.000 0.000 -0.000) 0.000 6.646 ( 0.000 0.000 0.000) 0.000 6.731 ( 0.000 0.000 -0.000) 0.000 6.771 ( 0.000 0.000 0.000) 0.000 7.234 ( 0.000 0.000 -0.000) 0.000 7.731 ( 0.000 0.000 0.000) 0.000 7.786 ( 0.000 0.000 0.000) 0.000 7.976 ( 0.000 0.000 0.000) 0.000 8.043 ( 0.000 0.000 0.000) 0.000 8.437 ( 0.000 0.000 0.000) 0.000 8.726 ( 0.000 0.000 0.000) 0.000 8.832 ( 0.000 0.000 0.000) 0.000 9.387 ( 0.000 0.000 0.000) 0.000 9.638 ( 0.000 0.000 0.000) 0.000 9.996 ( 0.000 0.000 0.000) 0.000 10.385 ( 0.000 0.000 -0.000) 0.000 10.537 ( 0.000 0.000 0.000) 0.000 10.716 ( 0.000 0.000 0.000) 0.000 10.742 ( -0.000 0.000 -0.000) 0.000 10.779 ( 0.000 0.000 0.000) 0.000 11.768 ( 0.000 0.000 0.000) 0.000 12.043 ( 0.000 0.000 0.000) 0.000 12.727 ( 0.000 0.000 0.000) 0.000 12.809 ( -0.000 0.000 -0.000) 0.000 12.881 ( 0.000 0.000 0.000) 0.000 13.097 ( 0.000 0.000 0.000) 0.000 13.363 ( 0.000 0.000 0.000) 0.000 13.388 ( 0.000 0.000 -0.000) 0.000 13.831 ( 0.000 0.000 0.000) 0.000 14.359 ( 0.000 0.000 0.000) 0.000 15.116 ( 0.000 0.000 0.000) 0.000 15.313 ( 0.000 0.000 0.000) 0.000 18.576 ( 0.000 0.000 0.000) 0.000 19.108 ( 0.000 0.000 0.000) 0.000 19.757 ( 0.000 0.000 0.000) 0.000 20.182 ( 0.000 0.000 0.000) 0.000 21.330 ( 0.000 0.000 0.000) 0.000 21.949 ( 0.000 0.000 -0.000) 0.000 22.397 ( 0.000 0.000 0.000) 0.000 23.636 ( 0.000 0.000 0.000) 0.000 23.723 ( 0.000 0.000 -0.000) 0.000 23.775 ( 0.000 0.000 -0.000) 0.000 24.516 ( 0.000 0.000 -0.000) 0.000 24.701 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 9 (6/116) ======================= q-point: ( 0.00 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.520 ( 0.000 24.595 0.000) 24.595 0.582 ( 0.000 27.306 0.000) 27.306 0.890 ( 0.000 40.766 0.000) 40.766 1.952 ( 0.000 4.615 0.000) 4.615 2.230 ( 0.000 1.710 0.000) 1.710 2.714 ( 0.000 -6.814 0.000) 6.814 2.908 ( 0.000 -2.217 0.000) 2.217 3.142 ( 0.000 3.258 0.000) 3.258 3.197 ( 0.000 -3.610 0.000) 3.610 3.244 ( 0.000 0.411 0.000) 0.411 3.369 ( 0.000 -8.301 0.000) 8.301 3.571 ( 0.000 -2.910 0.000) 2.910 3.686 ( 0.000 -3.158 0.000) 3.158 3.800 ( 0.000 4.661 0.000) 4.661 3.942 ( 0.000 1.896 0.000) 1.896 3.982 ( 0.000 2.288 0.000) 2.288 4.208 ( 0.000 10.806 0.000) 10.806 4.496 ( 0.000 1.253 0.000) 1.253 4.613 ( 0.000 0.476 0.000) 0.476 4.823 ( 0.000 -4.367 0.000) 4.367 4.864 ( 0.000 -2.081 0.000) 2.081 5.277 ( 0.000 -2.366 0.000) 2.366 5.283 ( 0.000 -1.549 0.000) 1.549 5.457 ( 0.000 3.340 0.000) 3.340 5.812 ( 0.000 1.804 0.000) 1.804 5.987 ( 0.000 -3.798 0.000) 3.798 6.147 ( 0.000 -3.073 0.000) 3.073 6.269 ( 0.000 4.692 0.000) 4.692 6.394 ( 0.000 -3.186 0.000) 3.186 6.514 ( 0.000 5.782 0.000) 5.782 6.663 ( 0.000 3.959 0.000) 3.959 6.851 ( 0.000 -1.355 0.000) 1.355 7.123 ( 0.000 -6.049 0.000) 6.049 7.425 ( 0.000 4.792 0.000) 4.792 7.535 ( 0.000 -12.316 0.000) 12.316 7.857 ( 0.000 -4.830 0.000) 4.830 8.341 ( 0.000 0.708 0.000) 0.708 8.504 ( 0.000 -1.897 0.000) 1.897 8.703 ( 0.000 -2.115 0.000) 2.115 8.829 ( 0.000 6.895 0.000) 6.895 9.310 ( 0.000 1.656 0.000) 1.656 9.461 ( 0.000 3.217 0.000) 3.217 10.016 ( 0.000 1.286 0.000) 1.286 10.490 ( 0.000 5.775 0.000) 5.775 10.665 ( 0.000 2.128 0.000) 2.128 10.832 ( 0.000 1.969 0.000) 1.969 10.971 ( 0.000 -5.035 0.000) 5.035 11.241 ( 0.000 -2.883 0.000) 2.883 11.747 ( 0.000 2.177 0.000) 2.177 11.955 ( 0.000 3.497 0.000) 3.497 12.505 ( 0.000 -5.378 0.000) 5.378 12.710 ( 0.000 -2.706 0.000) 2.706 12.899 ( 0.000 0.369 0.000) 0.369 12.998 ( 0.000 0.993 0.000) 0.993 13.783 ( 0.000 0.282 0.000) 0.282 13.846 ( 0.000 -0.693 0.000) 0.693 14.046 ( 0.000 0.175 0.000) 0.175 14.100 ( 0.000 -0.203 0.000) 0.203 14.375 ( 0.000 1.979 0.000) 1.979 14.940 ( 0.000 -4.999 0.000) 4.999 19.044 ( 0.000 5.958 0.000) 5.958 19.721 ( 0.000 -6.487 0.000) 6.487 20.102 ( 0.000 9.400 0.000) 9.400 20.540 ( 0.000 -0.117 0.000) 0.117 21.749 ( 0.000 -1.061 0.000) 1.061 21.866 ( 0.000 0.817 0.000) 0.817 21.869 ( 0.000 0.232 0.000) 0.232 21.972 ( 0.000 -2.040 0.000) 2.040 23.553 ( 0.000 1.664 0.000) 1.664 23.883 ( 0.000 -1.664 0.000) 1.664 24.368 ( 0.000 -0.241 0.000) 0.241 24.387 ( 0.000 -0.608 0.000) 0.608 ======================= Grid point 10 (7/116) ======================= q-point: ( 0.12 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.695 ( 12.964 19.485 8.354) 24.850 0.872 ( 15.430 24.770 1.620) 29.227 1.311 ( 41.182 20.115 -2.131) 45.881 2.065 ( 5.454 1.853 -0.137) 5.762 2.279 ( 7.361 5.286 3.328) 9.654 2.793 ( 7.292 -7.611 -1.719) 10.679 2.945 ( 2.592 -1.992 -2.342) 4.022 3.054 ( -6.114 4.355 -0.383) 7.516 3.153 ( -2.218 -5.096 -0.377) 5.571 3.224 ( -1.052 -2.309 -3.453) 4.285 3.425 ( 3.949 -5.068 3.686) 7.407 3.509 ( -4.456 -0.545 -2.459) 5.118 3.680 ( -0.645 1.476 -3.823) 4.148 3.717 ( -2.815 -0.768 1.134) 3.130 3.909 ( 6.790 6.115 0.408) 9.147 4.109 ( -2.054 7.474 2.141) 8.041 4.299 ( -6.229 2.598 1.926) 7.018 4.332 ( 10.360 2.638 3.516) 11.254 4.498 ( -13.312 9.696 1.414) 16.530 4.781 ( 0.219 -1.550 -4.393) 4.663 4.849 ( 4.260 1.067 -1.767) 4.734 5.104 ( -7.862 -3.581 -2.831) 9.091 5.425 ( 3.935 -2.582 6.696) 8.184 5.499 ( 2.453 1.934 7.551) 8.172 5.797 ( 0.644 1.141 -6.674) 6.802 6.001 ( 1.079 -4.864 -1.519) 5.209 6.147 ( 0.935 -2.326 1.990) 3.201 6.228 ( -0.874 1.069 -1.277) 1.881 6.476 ( -0.988 3.776 0.649) 3.957 6.721 ( 7.243 3.249 3.917) 8.852 6.862 ( 5.260 -14.927 1.536) 15.901 6.900 ( 3.791 -2.326 3.162) 5.457 7.168 ( 4.649 -5.820 -2.459) 7.844 7.502 ( 10.024 -2.718 -4.934) 11.498 7.614 ( 7.571 -14.070 -0.655) 15.991 7.832 ( -2.889 -4.514 3.360) 6.326 8.335 ( -1.273 1.922 1.519) 2.761 8.426 ( -4.545 3.329 -5.589) 7.936 8.697 ( -0.706 4.613 -1.757) 4.987 8.865 ( 1.431 2.157 3.055) 4.004 9.372 ( 6.412 -3.946 -8.541) 11.386 9.453 ( -0.546 2.866 0.006) 2.918 10.050 ( 3.832 1.377 -0.841) 4.158 10.393 ( -13.978 14.171 -4.858) 20.489 10.511 ( -1.546 7.788 -5.663) 9.752 10.698 ( -0.040 4.773 0.127) 4.774 10.992 ( -1.665 -4.540 -9.550) 10.704 11.245 ( -1.950 -0.190 -2.586) 3.245 11.813 ( -1.029 -0.299 18.545) 18.576 11.979 ( 1.370 3.079 4.811) 5.874 12.520 ( 2.198 -5.842 0.424) 6.256 12.699 ( -0.928 -3.316 -0.257) 3.453 12.984 ( 1.319 -0.970 2.824) 3.264 13.074 ( 5.883 -5.588 7.251) 10.882 13.539 ( -14.145 2.188 -3.794) 14.807 13.881 ( -7.936 -0.889 2.480) 8.362 14.045 ( -2.617 -1.156 -0.774) 2.964 14.206 ( 5.869 4.541 -0.228) 7.424 14.430 ( 13.957 -9.412 2.082) 16.962 15.154 ( 11.326 -11.324 5.682) 16.994 19.033 ( -1.705 6.045 -2.173) 6.646 19.415 ( -36.227 27.799 -3.241) 45.779 19.810 ( -8.161 0.307 11.451) 14.065 20.101 ( -0.025 8.429 1.289) 8.527 21.519 ( -6.720 0.443 0.396) 6.746 21.920 ( 3.927 -3.141 4.203) 6.554 22.011 ( 5.186 1.564 -0.603) 5.451 22.960 ( 35.788 -28.055 -4.228) 45.670 23.610 ( 5.478 -1.823 -6.873) 8.976 23.907 ( 1.599 -1.786 2.222) 3.269 24.322 ( 0.312 -2.288 -8.331) 8.645 24.520 ( 10.993 -3.823 -18.757) 22.075 ======================= Grid point 11 (8/116) ======================= q-point: ( 0.25 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.016 ( 16.346 12.704 10.409) 23.172 1.153 ( 12.572 20.013 2.856) 23.806 1.979 ( 11.600 8.027 -3.109) 14.445 2.176 ( 16.651 -2.206 -0.586) 16.807 2.482 ( 11.527 8.518 6.465) 15.723 2.879 ( 0.278 -0.403 -2.021) 2.079 2.928 ( 2.690 -2.485 -4.355) 5.690 3.059 ( 2.720 1.533 -3.967) 5.048 3.128 ( 0.203 -11.317 -2.416) 11.574 3.249 ( 4.847 -4.117 0.000) 6.360 3.497 ( 3.827 -1.342 -0.110) 4.057 3.513 ( 3.057 -0.507 3.119) 4.397 3.632 ( -2.050 3.749 -6.016) 7.379 3.715 ( 0.959 -1.869 -0.827) 2.258 4.008 ( -4.617 4.519 5.320) 8.369 4.067 ( 4.985 3.654 -0.771) 6.229 4.230 ( 2.850 5.410 0.764) 6.163 4.342 ( -4.377 9.104 0.879) 10.139 4.560 ( -1.794 5.002 -1.368) 5.488 4.735 ( 9.538 -1.872 2.785) 10.111 4.980 ( 3.831 -3.008 -1.208) 5.019 4.990 ( -0.483 -3.785 -3.081) 4.904 5.450 ( -2.020 -0.494 8.550) 8.799 5.598 ( 3.580 0.485 6.350) 7.306 5.790 ( 1.473 -0.168 -6.523) 6.689 6.012 ( 0.594 -2.330 -2.727) 3.636 6.177 ( -2.010 -0.662 -1.920) 2.858 6.213 ( 2.455 -2.038 1.958) 3.744 6.495 ( 2.485 0.774 0.825) 2.731 6.759 ( -4.211 1.348 -3.270) 5.500 6.868 ( -0.896 -5.224 6.745) 8.578 6.956 ( -0.242 -3.022 2.607) 3.999 7.188 ( 0.337 1.031 -2.176) 2.431 7.657 ( 4.735 -8.675 -1.065) 9.940 7.768 ( 3.689 -9.201 0.945) 9.958 7.789 ( 1.600 -6.794 -0.276) 6.985 8.264 ( -4.891 9.423 -3.020) 11.038 8.375 ( -0.032 0.283 -0.469) 0.549 8.685 ( 0.520 5.676 -1.263) 5.838 8.881 ( -0.425 2.312 3.370) 4.109 9.425 ( 0.868 1.374 -6.766) 6.958 9.485 ( 4.139 -4.632 -0.726) 6.254 10.163 ( 7.870 0.411 -0.978) 7.941 10.206 ( -4.497 13.967 -2.512) 14.887 10.499 ( 0.284 6.584 -2.257) 6.966 10.706 ( 0.368 4.403 1.435) 4.646 10.892 ( -5.949 -4.418 -3.965) 8.404 11.157 ( -6.160 2.692 -2.003) 7.015 11.817 ( -1.820 2.131 7.755) 8.246 12.022 ( 1.622 2.757 3.313) 4.605 12.588 ( 4.318 -6.205 1.011) 7.626 12.681 ( -0.544 -3.728 -0.587) 3.813 13.006 ( -0.038 -0.352 1.786) 1.821 13.158 ( 0.493 -7.256 4.149) 8.374 13.289 ( -8.900 4.507 -2.067) 10.188 13.680 ( -10.138 2.640 0.787) 10.506 13.963 ( -4.977 -0.944 -1.204) 5.207 14.328 ( 5.499 6.083 1.534) 8.343 14.704 ( 11.511 -15.100 0.862) 19.006 15.298 ( 3.115 -6.265 3.745) 7.936 18.854 ( -12.489 14.184 0.483) 18.905 19.117 ( -0.645 8.066 -2.345) 8.425 19.749 ( -4.140 -7.317 5.156) 9.862 20.121 ( 2.001 4.505 -0.982) 5.027 21.411 ( -4.523 0.238 0.677) 4.579 21.990 ( 3.016 1.251 0.654) 3.329 22.147 ( 7.242 -0.121 3.703) 8.135 23.340 ( 11.349 -11.059 0.798) 15.866 23.670 ( 2.292 -2.503 -5.130) 6.151 23.938 ( 0.760 2.267 3.110) 3.923 24.317 ( 1.460 -7.202 -9.256) 11.818 24.651 ( 7.481 -2.130 -13.987) 16.004 ======================= Grid point 12 (9/116) ======================= q-point: ( 0.38 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.313 ( 6.033 12.080 5.310) 14.509 1.376 ( 14.153 11.405 7.078) 19.506 1.931 ( -7.905 7.571 -4.428) 11.807 2.383 ( 7.563 -0.671 -0.053) 7.593 2.717 ( -0.926 -1.028 3.018) 3.320 2.920 ( -1.000 -5.533 -1.611) 5.849 3.021 ( 15.151 7.038 -1.382) 16.763 3.047 ( 0.572 -6.291 -5.190) 8.175 3.207 ( 6.164 -4.326 -3.332) 8.234 3.336 ( 2.603 -3.590 2.975) 5.340 3.516 ( -2.334 3.501 2.633) 4.964 3.586 ( 0.257 1.551 -3.938) 4.240 3.629 ( 5.078 -0.541 -0.880) 5.182 3.739 ( 2.471 -0.673 -1.638) 3.040 3.964 ( -0.110 1.047 4.101) 4.234 4.150 ( 3.441 1.898 -0.031) 3.930 4.273 ( -1.648 7.216 -2.371) 7.772 4.362 ( 4.862 7.426 2.513) 9.225 4.429 ( -5.309 5.597 -0.804) 7.756 4.907 ( 0.884 -5.219 0.570) 5.324 5.053 ( 10.884 -0.602 1.306) 10.979 5.088 ( 5.275 -3.757 -2.618) 6.985 5.415 ( -3.518 0.274 5.029) 6.143 5.652 ( 0.611 1.041 3.810) 3.997 5.839 ( 4.561 0.416 -1.018) 4.692 6.008 ( -0.191 -1.290 -2.628) 2.934 6.103 ( -3.014 1.425 -2.872) 4.401 6.298 ( 4.626 -5.615 3.126) 7.918 6.504 ( -3.488 -5.205 -0.856) 6.324 6.674 ( -1.756 0.576 -2.495) 3.105 6.827 ( -4.337 -0.715 1.362) 4.602 6.897 ( -5.010 3.360 3.948) 7.209 7.213 ( 2.161 0.563 -1.848) 2.899 7.655 ( -2.702 -7.874 1.028) 8.388 7.795 ( 1.044 -1.267 3.064) 3.476 7.861 ( 2.625 -8.018 -4.278) 9.460 8.191 ( -1.508 10.468 -1.755) 10.720 8.382 ( 0.310 -2.376 0.881) 2.553 8.713 ( 2.244 2.149 -0.810) 3.211 8.880 ( -0.449 2.625 2.054) 3.363 9.419 ( 0.184 3.036 -2.604) 4.003 9.549 ( 2.403 -4.346 -1.029) 5.072 10.146 ( -1.409 10.469 -0.469) 10.574 10.352 ( 10.784 -0.614 -0.576) 10.817 10.502 ( 0.576 8.119 -1.844) 8.346 10.715 ( -0.698 2.767 2.004) 3.487 10.760 ( -5.817 -3.771 -1.719) 7.142 11.012 ( -7.616 5.565 -1.011) 9.486 11.804 ( -0.992 2.794 2.866) 4.123 12.057 ( 1.150 2.639 1.246) 3.136 12.648 ( 0.240 -8.677 1.608) 8.828 12.709 ( 4.516 -1.301 -0.547) 4.731 12.944 ( -6.044 -1.006 -1.087) 6.223 13.150 ( 0.867 -0.306 2.165) 2.353 13.222 ( -1.046 -1.609 -0.594) 2.009 13.539 ( -4.623 3.558 0.764) 5.884 13.868 ( -3.980 -0.560 -0.904) 4.119 14.408 ( 2.464 6.442 1.041) 6.976 14.863 ( 5.035 -15.608 0.441) 16.406 15.334 ( 0.547 -1.859 1.348) 2.361 18.692 ( -5.066 8.333 0.693) 9.776 19.129 ( 1.502 4.076 -2.356) 4.941 19.679 ( -3.833 -8.306 3.540) 9.808 20.158 ( 1.765 -0.837 -1.368) 2.385 21.350 ( -2.022 1.219 0.582) 2.432 22.042 ( 2.097 7.433 -0.394) 7.734 22.278 ( 4.760 -4.212 3.276) 7.150 23.509 ( 6.813 -5.281 0.360) 8.628 23.670 ( -1.027 -2.231 -2.702) 3.652 23.957 ( 0.459 8.251 2.006) 8.504 24.316 ( 0.727 -12.234 -5.726) 13.528 24.727 ( 3.615 0.526 -5.833) 6.883 ======================= Grid point 13 (10/116) ======================= q-point: (-0.50 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.359 ( 0.000 12.099 -0.000) 12.099 1.625 ( -0.000 5.347 0.000) 5.347 1.753 ( 0.000 11.186 0.000) 11.186 2.549 ( -0.000 -0.156 0.000) 0.156 2.596 ( 0.000 -0.485 -0.000) 0.485 2.905 ( 0.000 -4.748 0.000) 4.748 3.030 ( -0.000 -7.785 0.000) 7.785 3.191 ( 0.000 -2.527 0.000) 2.527 3.325 ( -0.000 4.635 0.000) 4.635 3.332 ( 0.000 -5.075 -0.000) 5.075 3.489 ( 0.000 4.123 -0.000) 4.123 3.580 ( -0.000 3.526 -0.000) 3.526 3.667 ( 0.000 0.474 0.000) 0.474 3.778 ( 0.000 -3.537 0.000) 3.537 3.990 ( 0.000 1.787 0.000) 1.787 4.185 ( -0.000 -1.946 0.000) 1.946 4.235 ( 0.000 8.403 -0.000) 8.403 4.390 ( -0.000 5.623 0.000) 5.623 4.412 ( 0.000 8.508 -0.000) 8.508 4.914 ( 0.000 -5.558 0.000) 5.558 5.137 ( 0.000 -5.976 -0.000) 5.976 5.185 ( 0.000 0.347 0.000) 0.347 5.379 ( 0.000 2.338 0.000) 2.338 5.655 ( 0.000 2.210 -0.000) 2.210 5.925 ( -0.000 1.435 -0.000) 1.435 5.967 ( 0.000 -3.850 0.000) 3.850 6.081 ( 0.000 2.643 0.000) 2.643 6.384 ( 0.000 -8.930 -0.000) 8.930 6.417 ( 0.000 -4.554 0.000) 4.554 6.652 ( 0.000 -1.397 0.000) 1.397 6.769 ( 0.000 1.413 0.000) 1.413 6.854 ( 0.000 6.831 -0.000) 6.831 7.234 ( 0.000 0.072 -0.000) 0.072 7.624 ( 0.000 -7.322 0.000) 7.322 7.807 ( 0.000 1.626 0.000) 1.626 7.877 ( 0.000 -7.405 -0.000) 7.405 8.179 ( 0.000 9.677 0.000) 9.677 8.387 ( 0.000 -3.703 0.000) 3.703 8.739 ( 0.000 -0.136 0.000) 0.136 8.878 ( 0.000 2.954 0.000) 2.954 9.417 ( 0.000 3.456 0.000) 3.456 9.570 ( 0.000 -3.515 -0.000) 3.515 10.133 ( 0.000 9.701 0.000) 9.701 10.494 ( 0.000 0.350 0.000) 0.350 10.527 ( 0.000 7.433 -0.000) 7.433 10.630 ( -0.000 -5.212 0.000) 5.212 10.740 ( 0.000 2.369 0.000) 2.369 10.918 ( 0.000 7.821 0.000) 7.821 11.799 ( 0.000 2.853 0.000) 2.853 12.070 ( 0.000 2.628 0.000) 2.628 12.649 ( 0.000 -8.178 0.000) 8.178 12.784 ( -0.000 -2.557 -0.000) 2.557 12.851 ( 0.000 0.415 0.000) 0.415 13.186 ( 0.000 5.950 0.000) 5.950 13.195 ( 0.000 -8.206 0.000) 8.206 13.498 ( 0.000 3.225 0.000) 3.225 13.825 ( 0.000 -0.376 0.000) 0.376 14.433 ( 0.000 6.668 0.000) 6.668 14.911 ( 0.000 -15.625 0.000) 15.625 15.340 ( 0.000 -0.552 0.000) 0.552 18.646 ( 0.000 6.379 0.000) 6.379 19.143 ( 0.000 3.283 0.000) 3.283 19.644 ( 0.000 -8.703 0.000) 8.703 20.173 ( 0.000 -3.092 0.000) 3.092 21.333 ( 0.000 1.829 -0.000) 1.829 22.062 ( 0.000 9.861 -0.000) 9.861 22.332 ( 0.000 -5.949 0.000) 5.949 23.607 ( 0.000 -3.268 0.000) 3.268 23.623 ( 0.000 -2.907 -0.000) 2.907 23.965 ( 0.000 11.198 -0.000) 11.198 24.313 ( 0.000 -14.648 0.000) 14.648 24.754 ( 0.000 1.469 0.000) 1.469 ======================= Grid point 18 (11/116) ======================= q-point: ( 0.00 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.035 ( 0.000 23.903 0.000) 23.903 1.148 ( 0.000 26.092 0.000) 26.092 1.675 ( 0.000 31.051 0.000) 31.051 2.093 ( 0.000 8.599 0.000) 8.599 2.230 ( 0.000 -2.123 0.000) 2.123 2.505 ( 0.000 -12.602 0.000) 12.602 2.804 ( 0.000 -8.032 0.000) 8.032 3.137 ( 0.000 -11.563 0.000) 11.563 3.137 ( 0.000 -0.001 0.000) 0.001 3.236 ( 0.000 3.483 0.000) 3.483 3.280 ( 0.000 3.231 0.000) 3.231 3.545 ( 0.000 0.016 0.000) 0.016 3.668 ( 0.000 1.862 0.000) 1.862 3.882 ( 0.000 1.464 0.000) 1.464 3.978 ( 0.000 2.156 0.000) 2.156 4.020 ( 0.000 1.218 0.000) 1.218 4.430 ( 0.000 3.470 0.000) 3.470 4.519 ( 0.000 5.412 0.000) 5.412 4.610 ( 0.000 -1.361 0.000) 1.361 4.676 ( 0.000 -8.348 0.000) 8.348 4.798 ( 0.000 -3.132 0.000) 3.132 5.225 ( 0.000 -3.196 0.000) 3.196 5.310 ( 0.000 4.886 0.000) 4.886 5.546 ( 0.000 5.050 0.000) 5.050 5.771 ( 0.000 -7.331 0.000) 7.331 5.891 ( 0.000 -2.369 0.000) 2.369 6.176 ( 0.000 4.275 0.000) 4.275 6.343 ( 0.000 -1.583 0.000) 1.583 6.402 ( 0.000 7.372 0.000) 7.372 6.606 ( 0.000 2.755 0.000) 2.755 6.718 ( 0.000 0.908 0.000) 0.908 6.804 ( 0.000 -3.228 0.000) 3.228 7.017 ( 0.000 -3.437 0.000) 3.437 7.272 ( 0.000 -11.214 0.000) 11.214 7.499 ( 0.000 2.007 0.000) 2.007 7.715 ( 0.000 -7.554 0.000) 7.554 8.391 ( 0.000 4.398 0.000) 4.398 8.485 ( 0.000 0.027 0.000) 0.027 8.643 ( 0.000 -3.165 0.000) 3.165 8.863 ( 0.000 -3.493 0.000) 3.493 9.378 ( 0.000 4.765 0.000) 4.765 9.592 ( 0.000 6.372 0.000) 6.372 10.068 ( 0.000 5.202 0.000) 5.202 10.629 ( 0.000 5.973 0.000) 5.973 10.731 ( 0.000 3.989 0.000) 3.989 10.831 ( 0.000 -7.462 0.000) 7.462 10.878 ( 0.000 1.904 0.000) 1.904 11.142 ( 0.000 -6.276 0.000) 6.276 11.820 ( 0.000 4.816 0.000) 4.816 12.060 ( 0.000 6.124 0.000) 6.124 12.355 ( 0.000 -8.089 0.000) 8.089 12.613 ( 0.000 -6.446 0.000) 6.446 12.925 ( 0.000 2.130 0.000) 2.130 13.019 ( 0.000 0.688 0.000) 0.688 13.797 ( 0.000 0.942 0.000) 0.942 13.830 ( 0.000 -0.683 0.000) 0.683 14.042 ( 0.000 -0.447 0.000) 0.447 14.088 ( 0.000 -0.969 0.000) 0.969 14.439 ( 0.000 4.004 0.000) 4.004 14.807 ( 0.000 -6.955 0.000) 6.955 19.201 ( 0.000 8.122 0.000) 8.122 19.599 ( 0.000 -5.229 0.000) 5.229 20.296 ( 0.000 8.501 0.000) 8.501 20.536 ( 0.000 -0.404 0.000) 0.404 21.731 ( 0.000 -0.340 0.000) 0.340 21.872 ( 0.000 -0.405 0.000) 0.405 21.883 ( 0.000 0.740 0.000) 0.740 21.913 ( 0.000 -2.978 0.000) 2.978 23.604 ( 0.000 3.058 0.000) 3.058 23.833 ( 0.000 -2.977 0.000) 2.977 24.361 ( 0.000 -0.326 0.000) 0.326 24.372 ( 0.000 -0.765 0.000) 0.765 ======================= Grid point 19 (12/116) ======================= q-point: ( 0.12 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.144 ( 7.806 21.749 5.338) 23.716 1.349 ( 16.207 20.998 -0.097) 26.526 1.844 ( 18.255 24.391 -1.444) 30.500 2.132 ( 1.792 4.555 -2.864) 5.671 2.368 ( 13.207 3.493 5.416) 14.696 2.561 ( 5.684 -13.616 -1.571) 14.838 2.871 ( 5.891 -6.060 -0.857) 8.495 3.027 ( -5.126 -5.110 -4.268) 8.403 3.161 ( -3.862 1.216 -0.251) 4.057 3.184 ( -1.095 0.739 0.026) 1.321 3.359 ( 5.554 1.232 5.770) 8.103 3.485 ( -4.274 -0.857 -2.427) 4.989 3.660 ( -1.928 -1.485 -1.959) 3.124 3.764 ( -2.761 2.705 -3.432) 5.169 4.042 ( 8.338 6.260 -0.390) 10.434 4.190 ( -0.506 -0.785 2.445) 2.617 4.344 ( -4.165 0.514 1.099) 4.338 4.419 ( 2.838 4.220 2.100) 5.502 4.603 ( -3.040 0.869 2.139) 3.817 4.737 ( -1.004 -0.583 -4.150) 4.309 4.835 ( 5.180 -3.083 2.040) 6.364 5.066 ( -9.461 -0.195 -2.290) 9.736 5.404 ( 3.991 1.889 3.326) 5.528 5.543 ( 0.073 1.856 7.297) 7.530 5.819 ( 2.716 -0.577 -8.714) 9.146 5.850 ( 0.053 -6.413 -4.048) 7.584 6.183 ( 1.250 4.415 3.637) 5.855 6.247 ( -3.555 0.710 -0.123) 3.627 6.537 ( -4.438 1.218 2.289) 5.140 6.620 ( 7.833 -4.123 3.219) 9.419 6.827 ( 1.503 -3.360 1.562) 3.999 6.832 ( 7.816 1.240 -1.581) 8.070 7.066 ( 5.742 -2.757 -2.093) 6.705 7.332 ( 5.479 -11.921 1.180) 13.173 7.529 ( 3.764 1.974 -0.633) 4.297 7.710 ( -1.165 -6.156 3.754) 7.304 8.401 ( 0.575 4.840 1.187) 5.016 8.474 ( -0.856 1.837 -3.263) 3.841 8.677 ( 2.954 -3.613 -3.235) 5.679 8.860 ( -0.145 -3.940 1.106) 4.095 9.396 ( 2.278 4.447 -2.084) 5.414 9.580 ( -1.150 6.770 0.118) 6.868 10.090 ( 2.362 3.759 0.186) 4.443 10.574 ( -7.665 4.901 4.033) 9.952 10.677 ( -1.563 7.528 -4.673) 8.997 10.784 ( -0.210 0.726 -1.634) 1.801 10.886 ( -1.304 -3.127 -6.480) 7.312 11.184 ( 2.374 -5.515 -1.567) 6.205 11.845 ( 0.646 3.522 9.145) 9.821 12.075 ( 1.104 5.639 2.001) 6.085 12.358 ( 0.475 -8.561 1.986) 8.801 12.598 ( -1.036 -6.310 -0.737) 6.437 12.971 ( 3.099 0.705 1.797) 3.650 13.043 ( 1.515 0.305 2.948) 3.329 13.598 ( -11.698 3.243 -3.557) 12.650 13.839 ( -5.931 -2.937 1.687) 6.830 14.021 ( -2.451 -0.772 -1.021) 2.765 14.167 ( 8.087 -4.839 -1.738) 9.583 14.447 ( 2.976 6.667 2.200) 7.625 14.950 ( 10.807 -8.882 0.162) 13.989 19.181 ( -1.798 7.631 -2.201) 8.143 19.558 ( -4.587 -3.434 -3.854) 6.906 20.028 ( -35.045 12.310 10.360) 38.562 20.254 ( -4.666 5.285 -0.537) 7.071 21.540 ( -7.428 1.862 2.726) 8.129 21.835 ( 2.116 -4.875 4.707) 7.100 22.058 ( 10.650 3.201 -4.173) 11.878 22.522 ( 36.504 -14.033 -8.968) 40.123 23.628 ( 2.450 2.332 -1.766) 3.816 23.842 ( 0.800 -3.633 1.464) 3.997 24.322 ( -1.243 1.306 -2.146) 2.803 24.461 ( 6.835 -2.501 -3.655) 8.145 ======================= Grid point 20 (13/116) ======================= q-point: ( 0.25 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.347 ( 10.817 17.349 7.985) 21.949 1.598 ( 8.767 19.490 1.594) 21.430 2.138 ( 3.236 2.373 -2.255) 4.603 2.265 ( 16.152 13.692 -4.138) 21.576 2.616 ( 7.926 4.301 6.752) 11.265 2.684 ( 6.674 -12.795 -3.559) 14.863 2.935 ( -1.496 -6.297 -0.316) 6.480 2.960 ( 4.118 -0.250 -4.820) 6.345 3.140 ( -1.168 -0.677 0.241) 1.371 3.203 ( 7.073 6.373 0.826) 9.557 3.428 ( 0.656 -4.495 0.866) 4.624 3.497 ( 5.249 -0.511 2.606) 5.882 3.624 ( 0.123 -3.447 -0.618) 3.504 3.744 ( 0.617 4.152 -7.661) 8.736 4.056 ( -7.567 0.035 3.823) 8.478 4.192 ( 2.116 6.286 -2.042) 6.939 4.324 ( 6.623 2.095 1.002) 7.018 4.515 ( -1.456 4.068 0.079) 4.321 4.656 ( -4.525 3.892 -2.381) 6.426 4.712 ( 13.584 1.063 5.902) 14.849 4.892 ( -0.730 -2.698 -1.044) 2.984 4.949 ( 0.213 -1.031 0.474) 1.155 5.446 ( -0.733 0.520 5.490) 5.563 5.599 ( 2.646 -0.721 4.516) 5.284 5.787 ( 1.018 -0.074 -5.842) 5.931 5.923 ( 4.575 -4.577 -4.553) 7.912 6.181 ( -2.206 -0.392 -3.987) 4.573 6.230 ( 0.479 4.418 4.417) 6.266 6.444 ( -4.795 -5.786 0.057) 7.515 6.685 ( -0.842 -3.118 1.961) 3.779 6.843 ( -0.528 -2.069 1.466) 2.590 6.947 ( 3.665 2.075 2.270) 4.784 7.162 ( 4.023 -2.306 -3.881) 6.046 7.446 ( 4.097 -11.690 2.731) 12.685 7.639 ( 6.580 -0.333 -2.315) 6.984 7.708 ( 0.751 -3.234 6.201) 7.034 8.401 ( -1.437 2.830 -1.112) 3.363 8.435 ( -1.724 6.705 -1.522) 7.089 8.699 ( 0.434 -2.935 -3.493) 4.583 8.874 ( 0.836 -4.000 1.823) 4.475 9.449 ( 3.898 3.719 -3.814) 6.601 9.560 ( -0.803 6.898 1.125) 7.035 10.163 ( 5.057 0.467 0.382) 5.093 10.435 ( -6.066 6.904 1.712) 9.349 10.666 ( 1.179 6.918 -6.140) 9.325 10.775 ( -2.253 -1.977 -0.703) 3.079 10.821 ( -1.951 3.283 0.046) 3.820 11.185 ( -1.294 -0.891 -4.281) 4.561 11.877 ( -0.078 3.646 7.235) 8.102 12.109 ( 1.525 5.185 2.537) 5.971 12.392 ( 1.964 -10.434 2.566) 10.922 12.590 ( 1.036 -5.587 -0.918) 5.756 13.017 ( 0.282 0.915 2.830) 2.988 13.058 ( -0.996 -1.710 1.074) 2.251 13.393 ( -7.509 5.095 -1.932) 9.278 13.687 ( -8.166 -1.894 0.744) 8.415 13.950 ( -4.231 0.152 -1.478) 4.484 14.339 ( 9.173 -11.265 -1.954) 14.658 14.540 ( 4.404 6.755 2.815) 8.541 15.133 ( 7.373 -8.919 0.196) 11.574 19.093 ( -8.070 8.618 -1.835) 11.948 19.357 ( -10.626 10.530 -3.903) 15.461 19.629 ( -10.401 -1.892 7.036) 12.699 20.145 ( -6.089 -2.774 0.176) 6.694 21.456 ( -2.405 4.477 2.195) 5.536 21.941 ( 6.878 -5.935 2.622) 9.456 22.228 ( 7.306 7.879 -1.607) 10.865 23.050 ( 21.065 -15.011 -6.072) 26.569 23.664 ( 1.250 1.199 -1.959) 2.615 23.880 ( 2.735 -5.331 2.669) 6.560 24.291 ( -1.242 3.440 -4.676) 5.937 24.590 ( 7.003 -3.643 -3.320) 8.563 ======================= Grid point 21 (14/116) ======================= q-point: ( 0.38 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.575 ( 8.906 12.942 7.475) 17.398 1.704 ( 3.086 15.705 2.045) 16.135 2.158 ( -2.937 13.310 -2.571) 13.870 2.402 ( 7.172 3.028 -5.602) 9.591 2.718 ( -2.109 0.078 3.774) 4.325 2.772 ( 3.307 -7.147 -2.141) 8.160 2.900 ( -0.788 -5.204 -1.716) 5.536 3.041 ( 2.240 -5.192 -0.318) 5.664 3.170 ( 3.398 -3.073 0.576) 4.617 3.382 ( 9.855 9.526 0.432) 13.713 3.458 ( 1.417 -8.324 2.140) 8.711 3.610 ( 1.350 3.625 4.180) 5.695 3.634 ( 3.888 -2.125 -1.361) 4.635 3.744 ( 1.859 1.539 -9.550) 9.850 3.983 ( -0.971 0.442 4.860) 4.976 4.174 ( -1.581 -0.847 -1.846) 2.574 4.458 ( 1.060 7.474 -1.714) 7.741 4.515 ( 3.246 7.825 3.198) 9.055 4.595 ( -0.077 8.932 -1.979) 9.149 4.803 ( -0.252 -2.931 0.025) 2.942 4.987 ( 2.223 -4.402 1.128) 5.059 5.055 ( 11.810 -0.178 2.094) 11.995 5.435 ( -0.921 1.594 2.721) 3.285 5.651 ( 2.065 -1.534 1.714) 3.091 5.833 ( 3.253 -0.771 1.029) 3.498 5.967 ( 1.124 -2.472 -4.472) 5.231 6.135 ( -0.764 0.461 -3.383) 3.499 6.232 ( -0.641 1.164 3.639) 3.874 6.353 ( -4.427 -8.360 -3.126) 9.963 6.625 ( -5.361 -5.260 1.439) 7.647 6.839 ( 0.455 2.692 0.575) 2.790 6.977 ( -1.039 3.224 3.081) 4.579 7.211 ( 2.594 -0.999 -3.648) 4.587 7.472 ( -1.453 -9.505 2.439) 9.920 7.720 ( 3.090 -2.377 1.007) 4.026 7.791 ( 4.015 -1.074 1.620) 4.461 8.349 ( -1.908 1.220 -2.934) 3.706 8.404 ( -1.919 7.812 0.915) 8.097 8.694 ( 0.087 -3.222 -1.745) 3.665 8.890 ( 0.320 -2.601 1.255) 2.906 9.509 ( 3.221 4.373 -4.489) 7.046 9.557 ( -0.250 5.476 2.869) 6.187 10.266 ( 4.194 -1.387 1.053) 4.541 10.369 ( -0.564 3.869 0.136) 3.913 10.637 ( -3.869 -1.344 -4.421) 6.027 10.728 ( 0.075 5.738 1.670) 5.977 10.829 ( 1.293 7.625 -0.470) 7.748 11.124 ( -3.388 4.112 -2.286) 5.798 11.886 ( -0.467 4.762 3.179) 5.745 12.141 ( 1.103 5.149 1.442) 5.459 12.427 ( 0.833 -10.888 1.593) 11.035 12.639 ( 3.646 -5.588 0.056) 6.673 12.957 ( -5.014 1.677 -0.764) 5.342 13.059 ( 0.171 -3.239 1.472) 3.562 13.311 ( -1.289 5.233 -0.598) 5.422 13.565 ( -4.588 -0.869 0.890) 4.753 13.867 ( -3.370 1.059 -1.206) 3.733 14.480 ( 5.670 -15.138 -1.369) 16.223 14.606 ( 1.525 7.542 2.018) 7.955 15.232 ( 3.070 -7.396 0.062) 8.008 18.907 ( -7.994 10.986 0.098) 13.587 19.256 ( -0.864 7.637 -3.437) 8.419 19.502 ( -5.568 -7.651 3.950) 10.253 20.045 ( -3.790 -9.610 -0.411) 10.338 21.443 ( -0.052 7.493 1.323) 7.609 22.084 ( 6.576 -7.443 0.779) 9.962 22.318 ( 2.295 11.912 0.045) 12.131 23.339 ( 11.209 -11.912 -3.467) 16.720 23.653 ( -1.872 0.783 -0.419) 2.071 23.957 ( 3.849 -8.248 2.838) 9.535 24.243 ( -2.094 7.010 -4.594) 8.639 24.693 ( 4.115 -3.667 -1.663) 5.757 ======================= Grid point 22 (15/116) ======================= q-point: (-0.50 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.659 ( -0.000 14.400 -0.000) 14.400 1.776 ( 0.000 8.141 0.000) 8.141 2.077 ( 0.000 18.439 0.000) 18.439 2.577 ( 0.000 3.074 -0.000) 3.074 2.593 ( -0.000 0.315 0.000) 0.315 2.797 ( -0.000 -4.795 -0.000) 4.795 2.891 ( 0.000 -5.435 0.000) 5.435 3.055 ( 0.000 -8.447 -0.000) 8.447 3.209 ( 0.000 -5.725 0.000) 5.725 3.460 ( 0.000 -4.831 0.000) 4.831 3.520 ( -0.000 5.418 0.000) 5.418 3.592 ( 0.000 4.214 -0.000) 4.214 3.712 ( -0.000 -1.218 -0.000) 1.218 3.739 ( 0.000 1.659 0.000) 1.659 4.007 ( 0.000 -0.062 0.000) 0.062 4.138 ( -0.000 -3.241 0.000) 3.241 4.454 ( 0.000 10.930 -0.000) 10.930 4.539 ( 0.000 8.470 0.000) 8.470 4.618 ( 0.000 9.567 -0.000) 9.567 4.807 ( 0.000 -3.428 0.000) 3.428 5.014 ( 0.000 -4.492 -0.000) 4.492 5.181 ( -0.000 -1.321 0.000) 1.321 5.436 ( 0.000 2.964 0.000) 2.964 5.678 ( 0.000 -0.648 -0.000) 0.648 5.879 ( 0.000 -3.602 -0.000) 3.602 5.954 ( 0.000 0.590 0.000) 0.590 6.136 ( 0.000 1.269 0.000) 1.269 6.239 ( 0.000 -2.983 -0.000) 2.983 6.285 ( 0.000 -7.228 -0.000) 7.228 6.555 ( 0.000 -6.714 0.000) 6.714 6.850 ( 0.000 5.205 -0.000) 5.205 6.963 ( 0.000 3.462 -0.000) 3.462 7.234 ( 0.000 -0.386 0.000) 0.386 7.454 ( -0.000 -8.816 0.000) 8.816 7.756 ( 0.000 -2.721 0.000) 2.721 7.832 ( 0.000 0.189 -0.000) 0.189 8.329 ( -0.000 -0.824 0.000) 0.824 8.380 ( 0.000 8.340 -0.000) 8.340 8.693 ( 0.000 -3.575 0.000) 3.575 8.895 ( 0.000 -2.061 0.000) 2.061 9.535 ( 0.000 6.845 -0.000) 6.845 9.561 ( 0.000 2.801 0.000) 2.801 10.295 ( 0.000 3.463 0.000) 3.463 10.398 ( 0.000 -5.743 0.000) 5.743 10.567 ( 0.000 0.724 -0.000) 0.724 10.742 ( 0.000 4.563 0.000) 4.563 10.846 ( 0.000 10.576 0.000) 10.576 11.078 ( 0.000 6.584 -0.000) 6.584 11.885 ( 0.000 5.185 0.000) 5.185 12.155 ( 0.000 5.150 0.000) 5.150 12.436 ( 0.000 -10.406 0.000) 10.406 12.687 ( -0.000 -6.661 -0.000) 6.661 12.894 ( 0.000 2.899 0.000) 2.899 13.061 ( -0.000 -4.163 0.000) 4.163 13.306 ( 0.000 5.180 0.000) 5.180 13.520 ( 0.000 -0.765 -0.000) 0.765 13.831 ( 0.000 1.482 0.000) 1.482 14.536 ( 0.000 -18.617 0.000) 18.617 14.620 ( 0.000 10.411 0.000) 10.411 15.260 ( 0.000 -6.678 0.000) 6.678 18.829 ( 0.000 10.348 0.000) 10.348 19.248 ( 0.000 6.824 -0.000) 6.824 19.449 ( -0.000 -9.172 0.000) 9.172 20.007 ( 0.000 -12.024 0.000) 12.024 21.447 ( 0.000 8.657 -0.000) 8.657 22.158 ( -0.000 -10.072 0.000) 10.072 22.333 ( 0.000 15.338 -0.000) 15.338 23.455 ( 0.000 -12.166 0.000) 12.166 23.618 ( 0.000 2.152 0.000) 2.152 24.009 ( 0.000 -12.150 -0.000) 12.150 24.207 ( 0.000 11.270 0.000) 11.270 24.731 ( 0.000 -3.532 0.000) 3.532 ======================= Grid point 27 (16/116) ======================= q-point: ( 0.00 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.516 ( 0.000 21.100 0.000) 21.100 1.677 ( 0.000 23.677 0.000) 23.677 1.886 ( 0.000 -11.586 0.000) 11.586 2.127 ( 0.000 -17.401 0.000) 17.401 2.300 ( 0.000 10.364 0.000) 10.364 2.407 ( 0.000 9.055 0.000) 9.055 2.633 ( 0.000 -2.491 0.000) 2.491 2.862 ( 0.000 -14.165 0.000) 14.165 3.208 ( 0.000 4.819 0.000) 4.819 3.273 ( 0.000 -0.802 0.000) 0.802 3.395 ( 0.000 7.912 0.000) 7.912 3.540 ( 0.000 -2.756 0.000) 2.756 3.740 ( 0.000 3.797 0.000) 3.797 3.823 ( 0.000 -4.955 0.000) 4.955 4.034 ( 0.000 1.406 0.000) 1.406 4.036 ( 0.000 0.393 0.000) 0.393 4.404 ( 0.000 0.516 0.000) 0.516 4.493 ( 0.000 -6.903 0.000) 6.903 4.585 ( 0.000 -1.436 0.000) 1.436 4.597 ( 0.000 -1.762 0.000) 1.762 4.879 ( 0.000 10.994 0.000) 10.994 5.105 ( 0.000 -8.682 0.000) 8.682 5.457 ( 0.000 7.453 0.000) 7.453 5.604 ( 0.000 -7.128 0.000) 7.128 5.674 ( 0.000 7.114 0.000) 7.114 5.820 ( 0.000 -5.509 0.000) 5.509 6.268 ( 0.000 3.526 0.000) 3.526 6.316 ( 0.000 -1.393 0.000) 1.393 6.565 ( 0.000 7.682 0.000) 7.682 6.646 ( 0.000 1.898 0.000) 1.898 6.699 ( 0.000 -2.477 0.000) 2.477 6.710 ( 0.000 -5.685 0.000) 5.685 6.997 ( 0.000 1.796 0.000) 1.796 7.086 ( 0.000 -6.429 0.000) 6.429 7.523 ( 0.000 1.094 0.000) 1.094 7.579 ( 0.000 -4.659 0.000) 4.659 8.501 ( 0.000 1.346 0.000) 1.346 8.506 ( 0.000 3.841 0.000) 3.841 8.600 ( 0.000 1.421 0.000) 1.421 8.733 ( 0.000 -7.717 0.000) 7.717 9.500 ( 0.000 6.354 0.000) 6.354 9.617 ( 0.000 -3.632 0.000) 3.632 10.282 ( 0.000 13.657 0.000) 13.657 10.564 ( 0.000 -11.601 0.000) 11.601 10.804 ( 0.000 3.888 0.000) 3.888 10.823 ( 0.000 3.700 0.000) 3.700 10.901 ( 0.000 0.911 0.000) 0.911 10.996 ( 0.000 -6.886 0.000) 6.886 11.950 ( 0.000 7.340 0.000) 7.340 12.110 ( 0.000 -5.997 0.000) 5.997 12.278 ( 0.000 5.582 0.000) 5.582 12.449 ( 0.000 -8.631 0.000) 8.631 12.978 ( 0.000 2.538 0.000) 2.538 13.018 ( 0.000 -0.982 0.000) 0.982 13.814 ( 0.000 0.508 0.000) 0.508 13.820 ( 0.000 -0.257 0.000) 0.257 14.040 ( 0.000 0.441 0.000) 0.441 14.061 ( 0.000 -1.396 0.000) 1.396 14.538 ( 0.000 5.340 0.000) 5.340 14.663 ( 0.000 -6.450 0.000) 6.450 19.363 ( 0.000 6.916 0.000) 6.916 19.490 ( 0.000 -5.299 0.000) 5.299 20.443 ( 0.000 5.182 0.000) 5.182 20.515 ( 0.000 -1.844 0.000) 1.844 21.746 ( 0.000 2.014 0.000) 2.014 21.813 ( 0.000 -3.885 0.000) 3.885 21.893 ( 0.000 0.154 0.000) 0.154 21.894 ( 0.000 0.215 0.000) 0.215 23.678 ( 0.000 3.850 0.000) 3.850 23.760 ( 0.000 -3.787 0.000) 3.787 24.356 ( 0.000 -0.112 0.000) 0.112 24.359 ( 0.000 -0.382 0.000) 0.382 ======================= Grid point 28 (17/116) ======================= q-point: ( 0.12 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.582 ( 4.955 18.992 3.269) 19.898 1.768 ( 7.512 15.790 0.182) 17.486 1.959 ( 7.866 -6.645 -0.374) 10.304 2.211 ( 8.282 -17.033 -1.525) 19.001 2.395 ( 8.838 12.722 -1.415) 15.555 2.520 ( 10.328 6.470 2.261) 12.395 2.729 ( 8.222 -2.494 0.698) 8.621 2.888 ( 2.235 -9.240 -0.286) 9.511 3.168 ( -2.918 2.994 -1.688) 4.508 3.222 ( -3.264 -0.582 0.973) 3.456 3.440 ( 2.663 4.156 1.491) 5.156 3.495 ( -3.816 0.545 -2.579) 4.638 3.653 ( -6.143 2.229 -3.305) 7.323 3.758 ( -0.465 -4.343 -2.510) 5.038 4.125 ( 4.917 1.517 0.170) 5.148 4.171 ( 6.890 -0.632 1.995) 7.201 4.330 ( -4.380 1.201 -0.563) 4.576 4.413 ( -1.212 -3.816 0.589) 4.047 4.610 ( 1.933 2.277 4.556) 5.448 4.715 ( 5.771 -6.703 4.628) 9.983 4.861 ( -1.348 9.258 -1.381) 9.457 5.026 ( -5.844 -4.989 -0.780) 7.723 5.490 ( 0.838 4.668 1.793) 5.070 5.557 ( -2.177 -1.205 5.497) 6.034 5.751 ( 5.820 -0.015 -6.908) 9.033 5.803 ( 0.912 -2.774 -9.815) 10.240 6.262 ( -3.985 1.713 1.288) 4.525 6.274 ( -0.374 1.519 3.662) 3.982 6.527 ( -6.595 1.464 1.388) 6.897 6.599 ( -0.143 -2.450 3.214) 4.044 6.765 ( 5.054 0.454 1.523) 5.298 6.822 ( 7.272 -2.777 -0.589) 7.807 7.057 ( 5.247 1.648 -0.710) 5.546 7.137 ( 4.811 -6.298 0.502) 7.941 7.558 ( 3.416 1.182 1.223) 3.816 7.603 ( 1.894 -3.520 2.583) 4.759 8.514 ( 1.218 3.139 -5.310) 6.287 8.539 ( 2.610 5.538 1.840) 6.393 8.601 ( 0.691 -1.850 -2.460) 3.155 8.727 ( -0.527 -7.813 1.310) 7.939 9.516 ( 1.809 6.203 -0.892) 6.523 9.624 ( 0.774 -2.793 -0.475) 2.937 10.264 ( -1.550 11.998 0.179) 12.099 10.518 ( -4.424 -10.062 0.842) 11.024 10.789 ( -2.119 3.542 -1.418) 4.364 10.827 ( -0.106 2.858 1.802) 3.380 10.894 ( 1.099 3.551 -3.571) 5.155 11.037 ( 3.746 -7.744 -1.200) 8.686 11.958 ( 0.277 6.945 3.759) 7.901 12.116 ( 0.511 -6.308 0.985) 6.405 12.275 ( -0.333 5.458 2.121) 5.865 12.439 ( -0.609 -8.301 0.262) 8.327 13.007 ( 2.168 2.075 0.662) 3.073 13.040 ( 1.488 -0.858 1.701) 2.417 13.674 ( -9.330 3.958 -2.401) 10.416 13.762 ( -7.225 -4.173 -0.353) 8.351 14.028 ( -1.133 1.531 -0.877) 2.097 14.081 ( 1.746 -3.291 -1.132) 3.894 14.602 ( 5.933 7.638 1.048) 9.728 14.769 ( 8.715 -8.245 0.193) 11.999 19.336 ( -2.465 6.748 -2.006) 7.459 19.462 ( -2.617 -5.229 -1.960) 6.167 20.223 ( -24.703 6.420 4.610) 25.937 20.302 ( -13.890 -0.881 1.220) 13.971 21.607 ( -4.806 4.469 4.302) 7.847 21.720 ( -0.949 -5.802 4.881) 7.641 22.152 ( 17.814 5.700 -6.420) 19.775 22.298 ( 26.548 -8.272 -7.668) 28.845 23.690 ( 1.116 3.361 -0.163) 3.545 23.764 ( 0.350 -3.617 0.755) 3.712 24.359 ( 1.191 2.082 -0.547) 2.460 24.408 ( 4.131 -2.483 -0.962) 4.915 ======================= Grid point 29 (18/116) ======================= q-point: ( 0.25 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.701 ( 5.892 14.872 5.630) 16.958 1.876 ( 3.051 2.730 2.405) 4.748 2.175 ( 13.445 4.968 -2.807) 14.606 2.399 ( 11.133 -13.317 -3.653) 17.738 2.572 ( 6.501 11.795 -1.735) 13.579 2.694 ( 4.486 1.776 2.470) 5.420 2.844 ( 1.640 -0.931 0.841) 2.065 2.918 ( 1.362 -3.695 -1.654) 4.271 3.128 ( -0.472 2.170 1.421) 2.637 3.236 ( 2.539 -6.279 4.066) 7.899 3.437 ( 2.562 4.651 -4.111) 6.715 3.492 ( 3.709 -0.987 -1.171) 4.013 3.611 ( 2.028 4.819 -0.351) 5.240 3.760 ( 0.729 -4.832 -4.140) 6.405 4.069 ( -5.664 3.648 1.202) 6.844 4.192 ( -5.404 -6.026 -1.752) 8.282 4.402 ( 11.587 6.104 0.311) 13.100 4.507 ( 5.960 -3.184 0.784) 6.802 4.707 ( 6.172 2.915 2.903) 7.417 4.791 ( 0.532 -2.679 3.356) 4.326 4.852 ( 2.267 4.854 1.364) 5.528 4.945 ( -1.550 -1.660 2.017) 3.038 5.484 ( -0.818 3.058 1.842) 3.662 5.557 ( 0.193 -3.177 1.935) 3.725 5.801 ( 2.662 1.720 -5.021) 5.937 5.850 ( 4.601 -2.618 -5.938) 7.955 6.188 ( -2.931 1.752 -3.439) 4.846 6.264 ( -2.001 -4.484 -1.507) 5.136 6.411 ( -5.657 6.607 4.380) 9.739 6.577 ( -3.877 -7.502 4.981) 9.804 6.858 ( 3.799 3.449 1.101) 5.248 6.941 ( 4.683 -3.151 0.857) 5.709 7.149 ( 3.892 1.860 -0.820) 4.391 7.242 ( 4.634 -7.042 1.005) 8.489 7.648 ( 4.394 0.461 0.996) 4.529 7.662 ( 3.682 -1.156 4.543) 5.961 8.485 ( -2.525 4.950 -4.895) 7.405 8.566 ( -1.848 2.887 -0.906) 3.546 8.620 ( 2.720 -0.985 -2.153) 3.606 8.745 ( 1.913 -7.231 2.130) 7.777 9.561 ( 3.019 5.675 -1.518) 6.605 9.641 ( 1.070 -0.611 -0.502) 1.330 10.241 ( -0.523 7.463 0.541) 7.501 10.424 ( -5.006 -7.519 0.744) 9.064 10.731 ( -2.825 4.034 -2.079) 5.346 10.800 ( -2.608 -0.905 1.633) 3.208 10.947 ( 4.653 8.288 -2.195) 9.755 11.108 ( 3.783 -6.112 -3.035) 7.802 11.981 ( 0.625 6.308 4.736) 7.913 12.136 ( 1.007 -7.026 2.104) 7.403 12.289 ( 1.204 5.346 2.220) 5.913 12.445 ( 1.331 -7.760 0.361) 7.881 13.037 ( 0.269 1.030 0.804) 1.334 13.051 ( -1.449 -0.137 0.858) 1.690 13.503 ( -6.837 5.317 -0.955) 8.714 13.613 ( -6.945 -4.721 0.094) 8.398 13.989 ( -2.289 3.830 -1.835) 4.825 14.117 ( 2.392 -8.391 -2.097) 8.974 14.729 ( 5.993 9.609 1.147) 11.382 14.934 ( 7.472 -9.698 0.215) 12.244 19.254 ( -5.505 6.902 -2.186) 9.095 19.383 ( -4.438 -4.860 -2.949) 7.212 19.776 ( -20.131 11.933 4.231) 23.781 20.011 ( -14.876 -9.366 1.506) 17.643 21.595 ( 1.363 8.160 3.113) 8.840 21.779 ( 4.582 -8.727 3.310) 10.398 22.447 ( 13.681 12.305 -4.668) 18.984 22.734 ( 19.822 -14.576 -6.239) 25.383 23.708 ( 0.504 2.848 -0.201) 2.899 23.780 ( 1.071 -3.972 1.045) 4.244 24.389 ( 1.959 5.222 -1.211) 5.707 24.498 ( 5.076 -4.897 -0.834) 7.103 ======================= Grid point 30 (19/116) ======================= q-point: ( 0.38 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.829 ( 5.097 9.689 5.210) 12.124 1.917 ( 0.725 2.818 2.075) 3.574 2.415 ( 11.206 8.765 -2.069) 14.376 2.553 ( -2.998 11.485 -5.027) 12.890 2.585 ( 8.603 -8.051 -3.923) 12.419 2.739 ( -0.249 -3.123 -0.556) 3.182 2.833 ( -3.008 0.481 2.925) 4.224 2.918 ( -2.378 -5.719 2.509) 6.683 3.128 ( -0.043 1.105 1.872) 2.174 3.251 ( -0.373 -9.611 1.175) 9.690 3.578 ( 8.485 5.365 0.706) 10.063 3.605 ( 5.336 -0.170 -1.187) 5.469 3.662 ( 3.102 3.189 1.588) 4.724 3.757 ( 0.499 -2.162 -5.678) 6.096 4.001 ( -1.344 2.738 1.292) 3.313 4.099 ( -3.325 -5.267 -2.476) 6.702 4.584 ( 5.945 4.632 0.378) 7.547 4.627 ( 6.045 1.422 2.493) 6.692 4.756 ( 0.516 4.856 -2.834) 5.645 4.792 ( -0.541 0.358 -0.139) 0.663 4.944 ( 3.741 1.706 3.270) 5.253 5.024 ( 7.172 -3.381 3.926) 8.847 5.489 ( 1.089 3.790 1.003) 4.069 5.585 ( 2.318 -4.465 0.769) 5.089 5.838 ( 1.485 1.804 -0.366) 2.366 5.902 ( 2.110 -3.548 -2.706) 4.935 6.137 ( -0.944 0.841 -4.085) 4.276 6.197 ( -2.889 -5.301 -4.431) 7.489 6.329 ( -4.356 6.539 3.119) 8.454 6.482 ( -6.502 -7.521 2.819) 10.334 6.923 ( 2.689 4.588 1.348) 5.486 7.001 ( 1.067 -1.713 1.978) 2.826 7.199 ( 2.043 1.400 -1.513) 2.902 7.291 ( 0.186 -6.863 1.098) 6.953 7.719 ( 2.968 1.492 1.697) 3.730 7.759 ( 3.989 -1.949 2.713) 5.203 8.410 ( -3.246 4.569 -3.282) 6.495 8.500 ( -3.189 -1.582 -2.641) 4.432 8.662 ( 1.456 3.435 0.443) 3.757 8.787 ( 1.422 -6.338 1.126) 6.593 9.614 ( 2.702 4.716 -1.450) 5.625 9.656 ( 0.380 1.717 0.186) 1.768 10.252 ( 1.298 1.850 0.740) 2.378 10.343 ( -3.439 -5.204 0.074) 6.238 10.678 ( -2.057 4.740 -0.819) 5.232 10.760 ( -1.500 -2.029 0.332) 2.545 11.031 ( 4.030 8.890 -1.284) 9.844 11.152 ( 1.422 -2.086 -1.889) 3.154 12.004 ( 0.479 6.519 2.735) 7.086 12.161 ( 0.812 -7.318 1.775) 7.574 12.327 ( 1.790 5.658 1.288) 6.072 12.488 ( 2.553 -8.063 0.571) 8.476 12.995 ( -3.411 1.636 -0.729) 3.852 13.022 ( -1.548 -1.018 0.038) 1.853 13.419 ( -2.135 4.965 0.494) 5.427 13.514 ( -3.563 -3.730 0.942) 5.243 13.942 ( -1.755 6.531 -1.615) 6.953 14.153 ( 1.717 -13.350 -1.489) 13.542 14.821 ( 3.098 10.747 0.664) 11.204 15.043 ( 3.714 -10.050 0.125) 10.715 19.124 ( -6.372 9.257 -0.650) 11.257 19.297 ( -3.202 -6.718 -2.550) 7.867 19.513 ( -8.605 11.238 2.656) 14.401 19.789 ( -7.821 -13.550 0.345) 15.649 21.643 ( 2.141 10.775 1.701) 11.117 21.877 ( 4.056 -10.988 1.696) 11.835 22.635 ( 6.857 17.004 -2.321) 18.481 23.011 ( 10.366 -17.813 -3.484) 20.902 23.705 ( -0.593 3.885 0.130) 3.932 23.807 ( 1.129 -5.683 0.554) 5.820 24.419 ( 1.331 8.413 -0.929) 8.568 24.581 ( 3.336 -6.668 -0.447) 7.469 ======================= Grid point 31 (20/116) ======================= q-point: (-0.50 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.898 ( -0.000 6.821 -0.000) 6.821 1.921 ( 0.000 4.129 0.000) 4.129 2.469 ( 0.000 16.619 0.000) 16.619 2.611 ( 0.000 1.095 -0.000) 1.095 2.654 ( -0.000 1.619 0.000) 1.619 2.745 ( -0.000 2.475 0.000) 2.475 2.761 ( 0.000 -8.264 -0.000) 8.264 2.876 ( 0.000 -7.794 -0.000) 7.794 3.135 ( 0.000 0.149 -0.000) 0.149 3.252 ( -0.000 -9.988 0.000) 9.988 3.633 ( 0.000 1.621 0.000) 1.621 3.673 ( -0.000 2.480 -0.000) 2.480 3.721 ( -0.000 0.117 -0.000) 0.117 3.748 ( 0.000 1.669 0.000) 1.669 4.004 ( 0.000 0.563 0.000) 0.563 4.056 ( 0.000 -3.882 -0.000) 3.882 4.645 ( -0.000 6.201 -0.000) 6.201 4.689 ( 0.000 3.067 0.000) 3.067 4.766 ( -0.000 3.640 -0.000) 3.640 4.781 ( 0.000 0.590 -0.000) 0.590 4.992 ( 0.000 3.223 0.000) 3.223 5.108 ( -0.000 -5.576 0.000) 5.576 5.512 ( 0.000 4.595 0.000) 4.595 5.620 ( 0.000 -4.640 -0.000) 4.640 5.850 ( 0.000 1.231 -0.000) 1.231 5.917 ( -0.000 -3.935 0.000) 3.935 6.123 ( 0.000 0.076 0.000) 0.076 6.163 ( -0.000 -3.606 -0.000) 3.606 6.283 ( 0.000 4.677 0.000) 4.677 6.405 ( 0.000 -6.821 0.000) 6.821 6.958 ( 0.000 4.386 -0.000) 4.386 7.005 ( 0.000 0.282 0.000) 0.282 7.221 ( 0.000 0.081 0.000) 0.081 7.284 ( -0.000 -6.143 0.000) 6.143 7.755 ( 0.000 1.844 0.000) 1.844 7.806 ( 0.000 -2.355 -0.000) 2.355 8.369 ( 0.000 4.207 0.000) 4.207 8.460 ( 0.000 -2.323 0.000) 2.323 8.677 ( 0.000 4.167 0.000) 4.167 8.802 ( 0.000 -6.033 0.000) 6.033 9.645 ( 0.000 3.600 -0.000) 3.600 9.655 ( -0.000 3.231 0.000) 3.231 10.285 ( 0.000 -1.872 0.000) 1.872 10.293 ( -0.000 -3.204 0.000) 3.204 10.655 ( 0.000 5.526 0.000) 5.526 10.747 ( 0.000 -2.565 0.000) 2.565 11.073 ( 0.000 8.285 0.000) 8.285 11.159 ( 0.000 0.309 -0.000) 0.309 12.013 ( 0.000 6.872 0.000) 6.872 12.172 ( 0.000 -7.186 0.000) 7.186 12.349 ( 0.000 5.979 0.000) 5.979 12.520 ( 0.000 -8.647 0.000) 8.647 12.955 ( 0.000 2.596 0.000) 2.596 13.002 ( -0.000 -2.068 -0.000) 2.068 13.404 ( 0.000 4.152 0.000) 4.152 13.479 ( 0.000 -2.861 -0.000) 2.861 13.921 ( 0.000 7.789 0.000) 7.789 14.168 ( 0.000 -15.265 0.000) 15.265 14.851 ( 0.000 11.154 0.000) 11.154 15.079 ( 0.000 -10.050 0.000) 10.050 19.055 ( 0.000 10.429 0.000) 10.429 19.259 ( 0.000 -9.030 -0.000) 9.030 19.438 ( -0.000 11.265 0.000) 11.265 19.716 ( 0.000 -14.367 -0.000) 14.367 21.668 ( 0.000 11.698 0.000) 11.698 21.922 ( 0.000 -11.944 0.000) 11.944 22.697 ( 0.000 18.765 -0.000) 18.765 23.107 ( 0.000 -19.235 0.000) 19.235 23.697 ( 0.000 4.944 0.000) 4.944 23.819 ( 0.000 -6.722 -0.000) 6.722 24.431 ( 0.000 9.812 -0.000) 9.812 24.614 ( 0.000 -7.283 -0.000) 7.283 ======================= Grid point 63 (21/116) ======================= q-point: ( 0.00 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.418 ( -7.192 0.000 19.890) 21.151 0.536 ( -1.684 0.000 25.696) 25.751 0.985 ( -1.660 0.000 46.745) 46.774 1.855 ( 4.681 0.000 -4.508) 6.499 2.327 ( -1.745 0.000 8.991) 9.159 2.781 ( -2.840 0.000 0.425) 2.871 2.884 ( -0.314 0.000 -3.061) 3.077 3.133 ( -2.272 0.000 2.447) 3.339 3.196 ( 2.200 0.000 -3.047) 3.758 3.203 ( -1.300 0.000 -1.473) 1.965 3.441 ( -4.841 0.000 -0.770) 4.902 3.588 ( -1.193 0.000 2.353) 2.638 3.710 ( -6.683 0.000 3.137) 7.382 3.730 ( 2.357 0.000 -1.526) 2.808 3.890 ( 6.033 0.000 -2.400) 6.493 4.058 ( -10.206 0.000 -1.285) 10.287 4.162 ( 26.840 0.000 1.912) 26.908 4.282 ( -0.461 0.000 -0.716) 0.852 4.415 ( 13.285 0.000 -3.716) 13.795 4.695 ( -12.411 0.000 5.840) 13.716 4.818 ( -1.897 0.000 -5.752) 6.057 5.202 ( -4.713 0.000 -5.009) 6.878 5.362 ( 7.748 0.000 -4.803) 9.116 5.429 ( 9.499 0.000 4.544) 10.530 5.859 ( -3.444 0.000 5.668) 6.632 6.025 ( 1.017 0.000 0.726) 1.249 6.131 ( -0.254 0.000 -4.208) 4.216 6.210 ( 0.376 0.000 -4.902) 4.917 6.409 ( -0.900 0.000 -0.395) 0.983 6.486 ( -4.078 0.000 3.188) 5.176 6.577 ( 1.821 0.000 -2.105) 2.783 6.845 ( 4.997 0.000 -1.897) 5.345 7.232 ( -0.600 0.000 1.090) 1.244 7.532 ( -18.350 0.000 -1.738) 18.432 7.676 ( -0.280 0.000 4.325) 4.334 7.923 ( -0.028 0.000 1.936) 1.937 8.196 ( -1.099 0.000 -0.016) 1.099 8.317 ( 0.575 0.000 -1.759) 1.850 8.540 ( 0.343 0.000 -1.257) 1.303 8.674 ( 0.124 0.000 -4.873) 4.874 9.427 ( -1.249 0.000 -0.458) 1.331 9.485 ( -13.425 0.000 2.419) 13.641 9.842 ( 0.273 0.000 -4.214) 4.223 10.015 ( -0.615 0.000 -2.902) 2.966 10.443 ( 0.062 0.000 1.712) 1.713 10.626 ( 1.288 0.000 -1.538) 2.006 11.070 ( -5.532 0.000 0.837) 5.595 11.263 ( 0.832 0.000 -0.607) 1.030 11.986 ( -0.967 0.000 6.123) 6.199 12.548 ( -0.619 0.000 -1.444) 1.571 12.757 ( 0.758 0.000 1.884) 2.030 12.773 ( -13.109 0.000 -0.694) 13.127 13.050 ( -0.712 0.000 5.340) 5.387 13.702 ( -11.218 0.000 -5.431) 12.463 13.894 ( 12.381 0.000 3.294) 12.811 14.016 ( -30.012 0.000 0.020) 30.012 14.096 ( 1.176 0.000 -0.511) 1.282 14.216 ( 10.370 0.000 -0.620) 10.388 14.357 ( -12.763 0.000 0.523) 12.773 14.546 ( 95.478 0.000 -0.486) 95.480 18.781 ( 1.289 0.000 2.109) 2.472 18.977 ( -2.104 0.000 -0.063) 2.105 19.873 ( -4.302 0.000 3.136) 5.324 20.563 ( 46.214 0.000 -3.695) 46.362 21.599 ( -2.962 0.000 0.936) 3.106 21.818 ( -31.637 0.000 -3.545) 31.835 21.849 ( 6.621 0.000 -0.565) 6.645 21.998 ( -22.762 0.000 -0.141) 22.763 23.763 ( -0.341 0.000 0.484) 0.592 23.876 ( 0.115 0.000 -2.002) 2.005 24.242 ( -47.863 0.000 2.241) 47.916 24.368 ( 1.499 0.000 -0.257) 1.521 ======================= Grid point 64 (22/116) ======================= q-point: ( 0.12 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.753 ( 14.210 0.000 19.392) 24.041 1.006 ( 28.997 0.000 17.693) 33.969 1.278 ( 25.495 0.000 29.226) 38.783 2.094 ( 18.654 0.000 -0.018) 18.654 2.314 ( -1.832 0.000 9.200) 9.381 2.827 ( 6.369 0.000 -1.736) 6.601 2.909 ( 2.577 0.000 -4.836) 5.480 2.981 ( -12.304 0.000 0.524) 12.315 3.193 ( 0.003 0.000 -3.027) 3.027 3.245 ( 1.394 0.000 2.329) 2.715 3.366 ( 1.362 0.000 -6.728) 6.864 3.471 ( -3.363 0.000 0.686) 3.433 3.669 ( -4.280 0.000 0.430) 4.301 3.767 ( 1.725 0.000 0.026) 1.725 3.880 ( -3.211 0.000 0.407) 3.237 4.034 ( 4.660 0.000 0.140) 4.662 4.325 ( 8.477 0.000 -1.431) 8.597 4.326 ( -4.805 0.000 5.072) 6.987 4.427 ( -8.638 0.000 3.718) 9.405 4.728 ( 11.430 0.000 -2.603) 11.722 4.743 ( -3.459 0.000 -4.327) 5.539 5.100 ( -4.291 0.000 -3.106) 5.297 5.490 ( 6.892 0.000 -4.100) 8.019 5.597 ( 6.502 0.000 3.460) 7.365 5.791 ( -5.955 0.000 5.678) 8.228 6.047 ( -1.179 0.000 1.169) 1.660 6.154 ( 0.791 0.000 -3.630) 3.715 6.214 ( 3.755 0.000 -1.889) 4.203 6.375 ( -0.770 0.000 -2.210) 2.340 6.650 ( 4.629 0.000 -2.610) 5.314 6.960 ( 5.271 0.000 -0.024) 5.271 7.053 ( 30.992 0.000 -33.886) 45.921 7.175 ( -4.224 0.000 1.643) 4.532 7.316 ( -2.159 0.000 0.085) 2.160 7.754 ( 6.142 0.000 4.469) 7.595 7.942 ( -0.026 0.000 2.687) 2.687 8.145 ( -3.566 0.000 -0.548) 3.608 8.339 ( 1.945 0.000 -1.053) 2.212 8.526 ( -0.365 0.000 -1.493) 1.538 8.765 ( 8.963 0.000 -7.224) 11.512 9.322 ( -3.421 0.000 5.739) 6.681 9.478 ( 2.948 0.000 0.259) 2.959 9.872 ( 4.042 0.000 -4.250) 5.865 10.005 ( 0.872 0.000 -3.717) 3.818 10.452 ( 0.240 0.000 1.805) 1.821 10.645 ( 1.087 0.000 -1.386) 1.761 10.975 ( -4.923 0.000 0.308) 4.932 11.238 ( -3.418 0.000 -0.095) 3.419 11.962 ( -3.034 0.000 5.982) 6.707 12.479 ( -17.054 0.000 17.001) 24.080 12.554 ( 1.857 0.000 -1.558) 2.424 12.773 ( 0.303 0.000 2.157) 2.178 13.055 ( -0.575 0.000 5.931) 5.959 13.432 ( -14.141 0.000 -4.212) 14.755 13.495 ( -13.203 0.000 10.064) 16.602 13.919 ( -15.811 0.000 1.489) 15.881 14.058 ( -4.095 0.000 -0.189) 4.100 14.157 ( 6.781 0.000 1.838) 7.025 14.575 ( 16.842 0.000 -3.093) 17.123 15.480 ( 9.534 0.000 -12.542) 15.754 18.774 ( -2.798 0.000 3.641) 4.592 18.956 ( 0.332 0.000 -1.933) 1.961 19.865 ( 2.993 0.000 -0.515) 3.037 20.356 ( -24.361 0.000 19.629) 31.285 21.502 ( -5.489 0.000 -0.243) 5.494 21.920 ( 1.922 0.000 -8.163) 8.387 22.051 ( 11.617 0.000 4.460) 12.444 22.676 ( 67.602 0.000 -57.019) 88.438 23.708 ( -11.179 0.000 12.459) 16.739 23.761 ( 0.051 0.000 0.026) 0.057 23.969 ( 5.203 0.000 0.669) 5.246 24.413 ( 2.889 0.000 0.954) 3.042 ======================= Grid point 65 (23/116) ======================= q-point: ( 0.25 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.097 ( 14.299 0.000 13.833) 19.895 1.396 ( 11.198 0.000 31.931) 33.838 1.921 ( 17.367 0.000 5.387) 18.183 2.386 ( 14.062 0.000 6.110) 15.332 2.436 ( 10.035 0.000 7.714) 12.657 2.755 ( -3.351 0.000 -4.767) 5.827 2.921 ( 1.262 0.000 -4.761) 4.926 2.968 ( 3.978 0.000 -0.794) 4.056 3.156 ( -0.760 0.000 -7.948) 7.984 3.299 ( 4.164 0.000 -1.047) 4.294 3.431 ( 4.632 0.000 -2.415) 5.224 3.522 ( 7.557 0.000 0.863) 7.606 3.558 ( -5.631 0.000 0.040) 5.631 3.764 ( -1.905 0.000 1.493) 2.420 3.922 ( 5.866 0.000 -2.769) 6.487 4.081 ( 2.675 0.000 0.491) 2.720 4.200 ( -6.268 0.000 3.565) 7.211 4.345 ( -2.069 0.000 5.862) 6.217 4.460 ( -0.758 0.000 -1.699) 1.860 4.763 ( 9.990 0.000 -1.610) 10.119 4.913 ( 8.582 0.000 -3.091) 9.121 5.026 ( -2.448 0.000 -2.373) 3.409 5.626 ( 7.015 0.000 1.687) 7.215 5.679 ( -6.036 0.000 1.461) 6.210 5.702 ( 3.099 0.000 3.160) 4.426 6.001 ( -2.058 0.000 -0.816) 2.214 6.121 ( -3.334 0.000 -2.955) 4.455 6.325 ( 6.086 0.000 2.231) 6.482 6.394 ( 3.738 0.000 -5.655) 6.779 6.673 ( -1.981 0.000 -3.708) 4.204 6.970 ( -4.434 0.000 -0.876) 4.519 7.054 ( -8.155 0.000 -6.140) 10.208 7.157 ( 2.213 0.000 1.775) 2.837 7.493 ( 10.714 0.000 -18.852) 21.684 7.899 ( 6.519 0.000 4.287) 7.802 7.921 ( -3.025 0.000 3.570) 4.679 8.073 ( -3.248 0.000 -0.357) 3.267 8.380 ( 2.272 0.000 -0.357) 2.300 8.556 ( 4.109 0.000 -1.132) 4.262 8.884 ( 4.088 0.000 -3.534) 5.403 9.311 ( 0.359 0.000 1.554) 1.595 9.551 ( 4.097 0.000 0.321) 4.109 9.943 ( 3.121 0.000 -2.196) 3.816 10.055 ( 6.745 0.000 -6.210) 9.169 10.464 ( 0.560 0.000 2.001) 2.077 10.658 ( 0.791 0.000 -2.039) 2.187 10.875 ( -5.257 0.000 -0.875) 5.330 11.129 ( -7.851 0.000 0.131) 7.852 11.914 ( -3.629 0.000 6.312) 7.281 12.276 ( -9.521 0.000 16.899) 19.397 12.612 ( 4.413 0.000 -1.213) 4.577 12.781 ( -0.103 0.000 1.872) 1.874 13.073 ( 0.883 0.000 4.922) 5.000 13.158 ( -12.643 0.000 -3.012) 12.997 13.409 ( -1.452 0.000 4.874) 5.086 13.630 ( -12.611 0.000 0.419) 12.617 13.960 ( -5.507 0.000 -0.508) 5.530 14.282 ( 4.631 0.000 0.120) 4.632 14.854 ( 12.507 0.000 -2.553) 12.765 15.452 ( -4.818 0.000 -2.077) 5.246 18.711 ( -4.416 0.000 4.187) 6.085 18.975 ( 2.371 0.000 -3.279) 4.046 19.964 ( 7.072 0.000 -2.343) 7.450 20.091 ( -11.557 0.000 12.790) 17.238 21.407 ( -4.147 0.000 -0.244) 4.154 21.910 ( -0.031 0.000 -7.080) 7.080 22.281 ( 9.727 0.000 7.266) 12.141 23.353 ( 22.780 0.000 -36.060) 42.653 23.645 ( -0.637 0.000 8.671) 8.695 23.763 ( 0.118 0.000 -0.569) 0.581 24.158 ( 14.498 0.000 -9.222) 17.183 24.473 ( 2.634 0.000 1.243) 2.913 ======================= Grid point 66 (24/116) ======================= q-point: ( 0.38 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.315 ( 3.279 0.000 11.065) 11.540 1.683 ( 9.359 0.000 26.991) 28.567 1.907 ( -11.703 0.000 9.019) 14.776 2.470 ( 0.330 0.000 2.996) 3.014 2.749 ( 12.062 0.000 -10.533) 16.014 2.808 ( -6.850 0.000 3.579) 7.729 2.964 ( 8.469 0.000 -6.867) 10.903 3.026 ( 11.712 0.000 3.492) 12.221 3.219 ( 6.868 0.000 -4.233) 8.068 3.368 ( 3.384 0.000 -3.946) 5.199 3.470 ( -3.222 0.000 2.036) 3.811 3.493 ( 1.294 0.000 2.341) 2.675 3.719 ( 10.063 0.000 0.894) 10.103 3.721 ( -2.659 0.000 0.391) 2.687 3.997 ( 0.935 0.000 2.306) 2.488 4.142 ( 2.295 0.000 0.715) 2.404 4.173 ( 2.984 0.000 -1.240) 3.232 4.350 ( -0.034 0.000 4.857) 4.857 4.371 ( -4.851 0.000 0.336) 4.862 4.951 ( 3.390 0.000 -1.942) 3.907 5.030 ( 7.014 0.000 -4.162) 8.156 5.051 ( 6.944 0.000 -3.570) 7.808 5.544 ( -7.840 0.000 5.255) 9.438 5.702 ( -4.205 0.000 1.668) 4.524 5.793 ( 8.775 0.000 -0.273) 8.780 6.006 ( 2.799 0.000 -0.411) 2.829 6.041 ( -3.279 0.000 -1.934) 3.807 6.431 ( 3.868 0.000 1.495) 4.147 6.443 ( 3.128 0.000 -10.308) 10.772 6.577 ( -5.569 0.000 -3.153) 6.400 6.839 ( -7.253 0.000 -1.778) 7.468 6.877 ( -7.702 0.000 -1.880) 7.928 7.214 ( 2.344 0.000 0.779) 2.470 7.567 ( 2.986 0.000 -11.713) 12.087 7.878 ( -1.590 0.000 4.417) 4.695 7.978 ( 0.149 0.000 0.596) 0.615 8.055 ( 1.488 0.000 3.127) 3.463 8.415 ( 1.407 0.000 -0.473) 1.484 8.655 ( 5.446 0.000 -1.364) 5.615 8.906 ( -0.934 0.000 1.026) 1.387 9.331 ( 1.422 0.000 -0.314) 1.456 9.622 ( 2.924 0.000 1.497) 3.285 9.975 ( 1.113 0.000 -1.254) 1.677 10.204 ( 9.333 0.000 -7.362) 11.887 10.496 ( 2.421 0.000 2.112) 3.212 10.665 ( 0.775 0.000 -3.843) 3.920 10.781 ( -3.728 0.000 0.251) 3.737 10.946 ( -10.635 0.000 0.415) 10.643 11.867 ( -3.155 0.000 6.536) 7.258 12.191 ( -4.414 0.000 12.136) 12.914 12.691 ( 2.995 0.000 -1.322) 3.274 12.793 ( 1.613 0.000 1.528) 2.222 12.947 ( -8.023 0.000 -2.094) 8.292 13.112 ( 1.434 0.000 3.807) 4.068 13.404 ( -1.106 0.000 2.785) 2.996 13.455 ( -5.807 0.000 0.906) 5.877 13.865 ( -3.697 0.000 -0.343) 3.713 14.333 ( 1.184 0.000 -1.634) 2.018 15.034 ( 6.834 0.000 -1.735) 7.051 15.351 ( -4.589 0.000 -1.704) 4.895 18.644 ( -3.447 0.000 3.715) 5.068 19.022 ( 3.461 0.000 -3.722) 5.082 19.932 ( -8.597 0.000 8.699) 12.230 20.096 ( 6.621 0.000 -1.744) 6.847 21.344 ( -2.260 0.000 -0.425) 2.300 21.885 ( -0.187 0.000 -7.389) 7.391 22.439 ( 3.734 0.000 7.716) 8.571 23.549 ( 8.342 0.000 -15.476) 17.581 23.679 ( 1.153 0.000 5.960) 6.070 23.763 ( 0.225 0.000 -0.927) 0.954 24.411 ( 14.238 0.000 -11.183) 18.105 24.511 ( 0.884 0.000 0.444) 0.990 ======================= Grid point 67 (25/116) ======================= q-point: (-0.50 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.306 ( -5.512 0.000 8.000) 9.715 1.648 ( -17.034 0.000 11.393) 20.493 1.913 ( 6.746 0.000 19.710) 20.832 2.509 ( -5.123 0.000 -4.129) 6.580 2.640 ( 0.089 0.000 3.393) 3.394 2.852 ( 5.377 0.000 -8.510) 10.066 3.175 ( 10.864 0.000 1.632) 10.985 3.202 ( 1.554 0.000 1.672) 2.283 3.335 ( 5.628 0.000 0.252) 5.634 3.404 ( 1.528 0.000 -3.500) 3.818 3.430 ( -2.320 0.000 3.513) 4.210 3.461 ( -5.555 0.000 1.964) 5.892 3.674 ( -1.747 0.000 -1.377) 2.225 3.838 ( 0.448 0.000 1.573) 1.636 3.991 ( -1.980 0.000 2.736) 3.377 4.163 ( 0.213 0.000 1.404) 1.420 4.235 ( 1.530 0.000 -0.004) 1.530 4.312 ( -1.458 0.000 0.260) 1.481 4.341 ( -2.191 0.000 2.870) 3.611 4.960 ( -0.080 0.000 -2.362) 2.363 5.118 ( 0.478 0.000 -5.823) 5.843 5.153 ( 4.497 0.000 -4.575) 6.416 5.419 ( -6.281 0.000 5.259) 8.193 5.597 ( -4.911 0.000 -1.871) 5.256 5.898 ( -0.709 0.000 -1.323) 1.501 6.029 ( 4.462 0.000 1.210) 4.623 6.052 ( 0.665 0.000 0.621) 0.910 6.422 ( -5.430 0.000 -3.944) 6.711 6.497 ( 7.934 0.000 -10.716) 13.333 6.520 ( 1.644 0.000 -1.479) 2.211 6.755 ( 0.699 0.000 -1.353) 1.523 6.761 ( -5.165 0.000 0.746) 5.219 7.236 ( -0.359 0.000 0.471) 0.592 7.576 ( 1.953 0.000 -7.784) 8.025 7.910 ( 3.454 0.000 5.217) 6.257 7.977 ( 0.580 0.000 -0.115) 0.591 8.075 ( -1.416 0.000 3.373) 3.658 8.428 ( 0.069 0.000 -0.692) 0.695 8.712 ( -0.056 0.000 -1.457) 1.458 8.871 ( -2.599 0.000 1.440) 2.971 9.361 ( 1.732 0.000 -0.652) 1.851 9.677 ( 2.383 0.000 3.469) 4.209 9.982 ( 0.055 0.000 -1.400) 1.401 10.324 ( 4.880 0.000 -5.511) 7.362 10.530 ( -3.228 0.000 -0.645) 3.292 10.652 ( -0.871 0.000 -4.315) 4.402 10.767 ( 2.410 0.000 1.231) 2.706 10.799 ( -0.590 0.000 1.522) 1.633 11.832 ( -2.508 0.000 6.356) 6.833 12.161 ( -2.394 0.000 9.990) 10.273 12.702 ( -0.392 0.000 -2.749) 2.776 12.801 ( -3.143 0.000 -0.423) 3.171 12.902 ( 4.548 0.000 1.788) 4.887 13.133 ( -0.652 0.000 2.665) 2.744 13.368 ( -3.281 0.000 0.965) 3.420 13.406 ( 0.153 0.000 1.696) 1.703 13.836 ( 0.995 0.000 0.582) 1.153 14.326 ( -0.980 0.000 -3.162) 3.310 15.109 ( 1.381 0.000 -0.618) 1.513 15.272 ( -2.812 0.000 -3.610) 4.576 18.606 ( -1.425 0.000 2.819) 3.159 19.077 ( 2.959 0.000 -2.769) 4.053 19.813 ( -5.712 0.000 5.063) 7.633 20.191 ( 3.033 0.000 0.695) 3.112 21.319 ( -0.066 0.000 -0.854) 0.857 21.863 ( 0.287 0.000 -7.727) 7.732 22.453 ( -4.491 0.000 5.462) 7.071 23.603 ( -0.111 0.000 -3.328) 3.330 23.730 ( 3.506 0.000 0.376) 3.526 23.768 ( 0.598 0.000 -0.591) 0.841 24.506 ( -1.319 0.000 -0.981) 1.644 24.636 ( 11.955 0.000 -5.790) 13.283 ======================= Grid point 68 (26/116) ======================= q-point: (-0.38 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.186 ( -9.339 0.000 6.295) 11.262 1.339 ( -18.727 0.000 15.642) 24.400 2.060 ( 3.171 0.000 13.099) 13.477 2.302 ( -9.679 0.000 -4.976) 10.884 2.775 ( 7.432 0.000 3.398) 8.172 2.936 ( 0.424 0.000 -1.636) 1.690 2.985 ( -20.763 0.000 4.328) 21.210 3.306 ( -3.753 0.000 8.434) 9.232 3.369 ( -3.883 0.000 -2.032) 4.383 3.404 ( 0.472 0.000 -5.024) 5.046 3.411 ( 4.055 0.000 2.910) 4.991 3.460 ( 6.054 0.000 0.796) 6.106 3.661 ( 1.222 0.000 -2.672) 2.938 3.734 ( -10.275 0.000 1.842) 10.439 3.950 ( -2.147 0.000 1.065) 2.397 4.129 ( -5.090 0.000 0.388) 5.105 4.198 ( -5.379 0.000 -1.875) 5.696 4.291 ( -3.446 0.000 3.895) 5.201 4.369 ( 8.309 0.000 0.895) 8.357 4.901 ( -7.659 0.000 -5.911) 9.675 5.036 ( -3.263 0.000 -2.338) 4.014 5.163 ( -2.335 0.000 -3.196) 3.958 5.343 ( -2.938 0.000 1.293) 3.210 5.524 ( -2.448 0.000 -4.973) 5.543 5.869 ( 0.398 0.000 1.097) 1.166 6.046 ( -0.438 0.000 0.963) 1.058 6.150 ( 5.885 0.000 3.478) 6.835 6.287 ( -6.026 0.000 -5.402) 8.093 6.574 ( 4.141 0.000 -3.824) 5.637 6.643 ( -7.329 0.000 -0.293) 7.335 6.680 ( 11.849 0.000 -8.241) 14.433 6.831 ( 5.688 0.000 -2.142) 6.078 7.200 ( -3.381 0.000 0.388) 3.403 7.617 ( 4.522 0.000 -6.499) 7.917 7.983 ( -3.017 0.000 2.288) 3.787 8.033 ( 7.184 0.000 5.853) 9.266 8.042 ( 0.293 0.000 0.695) 0.754 8.413 ( -1.486 0.000 -0.627) 1.612 8.637 ( -6.636 0.000 -0.774) 6.681 8.826 ( -2.048 0.000 -1.316) 2.435 9.391 ( 1.559 0.000 -0.837) 1.769 9.745 ( 3.400 0.000 5.155) 6.175 9.970 ( -0.737 0.000 -1.779) 1.926 10.328 ( -7.436 0.000 -5.283) 9.122 10.405 ( -1.206 0.000 1.461) 1.895 10.623 ( -0.763 0.000 -3.052) 3.146 10.867 ( 7.188 0.000 1.521) 7.348 10.924 ( 9.498 0.000 -0.405) 9.506 11.807 ( -2.115 0.000 6.609) 6.939 12.154 ( -1.666 0.000 11.407) 11.528 12.679 ( -0.934 0.000 -4.064) 4.170 12.745 ( -2.478 0.000 1.669) 2.988 13.040 ( 9.128 0.000 2.197) 9.389 13.102 ( -2.874 0.000 1.469) 3.228 13.284 ( -5.279 0.000 -1.131) 5.399 13.466 ( 5.386 0.000 1.621) 5.625 13.900 ( 4.791 0.000 1.669) 5.074 14.279 ( -2.862 0.000 -4.200) 5.083 15.082 ( -4.330 0.000 0.723) 4.390 15.211 ( -2.356 0.000 -7.144) 7.523 18.608 ( 0.903 0.000 1.875) 2.081 19.107 ( 0.306 0.000 -0.301) 0.429 19.755 ( -0.888 0.000 1.006) 1.341 20.207 ( -2.172 0.000 3.907) 4.470 21.339 ( 2.547 0.000 -1.169) 2.802 21.852 ( 1.099 0.000 -7.780) 7.857 22.312 ( -10.529 0.000 1.627) 10.653 23.532 ( -6.512 0.000 0.172) 6.514 23.779 ( 0.376 0.000 0.122) 0.395 23.801 ( 3.694 0.000 -2.394) 4.402 24.461 ( -2.680 0.000 -2.190) 3.461 24.845 ( 10.801 0.000 -0.254) 10.804 ======================= Grid point 69 (27/116) ======================= q-point: (-0.25 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.968 ( -15.720 0.000 9.391) 18.311 1.046 ( -17.171 0.000 24.144) 29.628 2.030 ( -19.343 0.000 9.004) 21.336 2.129 ( -7.730 0.000 -6.484) 10.089 2.410 ( -23.194 0.000 9.011) 24.883 2.912 ( 5.854 0.000 4.301) 7.265 3.023 ( 1.560 0.000 -1.103) 1.910 3.155 ( -11.585 0.000 6.046) 13.068 3.256 ( -5.980 0.000 -1.572) 6.183 3.420 ( -6.297 0.000 2.699) 6.852 3.426 ( 3.472 0.000 -5.393) 6.414 3.547 ( -3.639 0.000 1.822) 4.069 3.626 ( 5.942 0.000 2.754) 6.549 3.688 ( 1.407 0.000 -1.684) 2.194 3.932 ( -2.567 0.000 0.824) 2.696 4.033 ( -2.777 0.000 0.164) 2.782 4.036 ( -4.742 0.000 -6.247) 7.843 4.264 ( -0.990 0.000 3.570) 3.705 4.514 ( -3.727 0.000 -0.747) 3.801 4.703 ( -0.209 0.000 -3.679) 3.685 5.050 ( 4.434 0.000 -1.583) 4.708 5.078 ( -6.115 0.000 1.686) 6.343 5.303 ( -0.527 0.000 -4.131) 4.164 5.448 ( -3.945 0.000 -5.691) 6.924 5.906 ( 1.263 0.000 4.378) 4.557 6.054 ( 0.380 0.000 0.929) 1.004 6.182 ( -2.587 0.000 -5.187) 5.796 6.250 ( 2.383 0.000 3.254) 4.033 6.487 ( -7.316 0.000 -0.355) 7.324 6.626 ( 1.956 0.000 -5.762) 6.084 6.846 ( 6.864 0.000 -9.702) 11.885 6.893 ( 0.255 0.000 -4.953) 4.960 7.141 ( -1.207 0.000 1.828) 2.191 7.698 ( 5.303 0.000 -5.932) 7.957 7.872 ( -7.657 0.000 3.241) 8.315 8.101 ( 4.147 0.000 0.007) 4.147 8.171 ( 2.993 0.000 3.181) 4.368 8.373 ( -2.128 0.000 -0.735) 2.251 8.507 ( -4.267 0.000 -0.844) 4.350 8.786 ( -1.363 0.000 -3.736) 3.977 9.412 ( 0.954 0.000 -1.220) 1.549 9.830 ( 3.286 0.000 3.396) 4.726 9.941 ( -1.886 0.000 -2.416) 3.065 10.147 ( -7.495 0.000 -2.862) 8.023 10.423 ( 0.948 0.000 0.737) 1.201 10.608 ( 0.054 0.000 -2.611) 2.611 11.036 ( 9.052 0.000 2.512) 9.394 11.095 ( 7.949 0.000 -1.368) 8.066 11.805 ( 0.388 0.000 10.302) 10.309 12.180 ( 0.903 0.000 19.089) 19.110 12.635 ( -2.491 0.000 -2.682) 3.660 12.723 ( -0.326 0.000 1.861) 1.890 13.044 ( -3.114 0.000 -0.714) 3.195 13.167 ( -6.055 0.000 -1.945) 6.360 13.273 ( 14.258 0.000 2.276) 14.439 13.618 ( 9.857 0.000 0.177) 9.859 14.007 ( 5.138 0.000 2.110) 5.554 14.186 ( -5.609 0.000 -4.427) 7.145 14.942 ( -10.739 0.000 1.987) 10.921 15.109 ( -6.226 0.000 -13.407) 14.782 18.651 ( 3.012 0.000 1.178) 3.235 19.084 ( -2.669 0.000 1.707) 3.168 19.791 ( 4.564 0.000 -0.700) 4.617 20.131 ( -7.045 0.000 6.198) 9.383 21.412 ( 5.379 0.000 -0.730) 5.428 21.860 ( 2.069 0.000 -7.585) 7.862 22.091 ( -11.550 0.000 -1.792) 11.688 23.350 ( -12.412 0.000 -3.499) 12.896 23.780 ( -0.348 0.000 0.590) 0.685 23.850 ( 2.197 0.000 -2.825) 3.579 24.401 ( -2.430 0.000 -2.477) 3.470 25.043 ( 9.228 0.000 -1.200) 9.305 ======================= Grid point 70 (28/116) ======================= q-point: (-0.12 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.677 ( -16.803 0.000 17.824) 24.495 0.837 ( -14.855 0.000 30.043) 33.515 1.294 ( -46.272 0.000 19.010) 50.025 1.936 ( -8.953 0.000 -6.467) 11.044 2.308 ( -0.253 0.000 8.455) 8.459 2.922 ( -10.092 0.000 1.900) 10.269 2.959 ( -5.884 0.000 -1.655) 6.112 3.067 ( 5.429 0.000 4.982) 7.369 3.199 ( -0.033 0.000 -3.094) 3.095 3.277 ( -6.307 0.000 -0.106) 6.308 3.482 ( 1.683 0.000 -0.130) 1.688 3.519 ( 1.257 0.000 3.052) 3.301 3.681 ( -0.318 0.000 -1.846) 1.873 3.755 ( 4.801 0.000 2.778) 5.547 3.823 ( -1.076 0.000 3.128) 3.308 3.968 ( -8.092 0.000 -0.743) 8.126 4.136 ( 10.799 0.000 -5.270) 12.016 4.247 ( -1.323 0.000 -0.041) 1.324 4.317 ( -5.776 0.000 -2.274) 6.208 4.813 ( 4.489 0.000 -2.460) 5.119 4.925 ( -10.990 0.000 4.684) 11.947 5.193 ( 9.759 0.000 -0.867) 9.797 5.303 ( 1.915 0.000 -5.839) 6.145 5.343 ( -4.757 0.000 -3.469) 5.887 5.913 ( -2.387 0.000 5.702) 6.181 6.038 ( -1.742 0.000 -0.328) 1.772 6.180 ( 2.980 0.000 -3.958) 4.955 6.219 ( -4.857 0.000 -0.959) 4.951 6.417 ( -0.583 0.000 0.265) 0.640 6.605 ( -2.056 0.000 -4.365) 4.825 6.830 ( -2.305 0.000 -5.509) 5.972 6.830 ( -7.796 0.000 -12.731) 14.929 7.186 ( 3.686 0.000 1.979) 4.184 7.739 ( -6.563 0.000 3.706) 7.537 7.761 ( 1.627 0.000 -7.150) 7.333 8.074 ( -12.142 0.000 -3.745) 12.707 8.175 ( 2.972 0.000 0.190) 2.978 8.333 ( -1.540 0.000 -1.361) 2.055 8.513 ( 2.680 0.000 -0.508) 2.728 8.740 ( -2.535 0.000 -5.698) 6.236 9.422 ( 0.551 0.000 -1.320) 1.430 9.807 ( -8.619 0.000 -8.622) 12.191 9.882 ( -2.787 0.000 -3.511) 4.483 10.047 ( -2.369 0.000 -2.482) 3.431 10.437 ( 0.223 0.000 1.345) 1.363 10.610 ( 0.852 0.000 -2.075) 2.243 11.152 ( 0.180 0.000 -2.378) 2.385 11.213 ( 4.603 0.000 -1.224) 4.763 11.928 ( 5.959 0.000 9.895) 11.551 12.538 ( 41.979 0.000 53.940) 68.350 12.581 ( -2.217 0.000 -1.427) 2.636 12.735 ( 0.796 0.000 1.543) 1.736 12.962 ( -5.065 0.000 -6.812) 8.489 13.069 ( -3.256 0.000 2.993) 4.422 13.583 ( 16.251 0.000 3.069) 16.538 13.812 ( 7.627 0.000 -4.019) 8.621 14.062 ( -2.856 0.000 -2.397) 3.729 14.093 ( 2.840 0.000 2.008) 3.478 14.683 ( -16.521 0.000 2.578) 16.721 14.819 ( -21.566 0.000 -21.285) 30.300 18.723 ( 3.683 0.000 1.108) 3.846 19.028 ( -3.305 0.000 1.541) 3.646 19.947 ( 13.186 0.000 4.884) 14.061 19.992 ( -8.577 0.000 5.989) 10.461 21.536 ( 6.808 0.000 0.995) 6.880 21.884 ( 2.571 0.000 -7.323) 7.762 21.888 ( -7.880 0.000 -3.476) 8.613 22.972 ( -28.384 0.000 -15.206) 32.200 23.771 ( -0.650 0.000 0.689) 0.947 23.870 ( 0.912 0.000 -2.663) 2.815 24.363 ( -0.710 0.000 -1.680) 1.824 25.063 ( -11.947 0.000 -22.661) 25.617 ======================= Grid point 71 (29/116) ======================= q-point: ( 0.00 0.14 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.689 ( -1.822 20.477 11.457) 23.535 0.943 ( -0.931 24.289 19.777) 31.336 1.198 ( -3.195 21.807 33.167) 39.822 1.902 ( 2.814 4.407 -4.539) 6.924 2.366 ( -0.663 2.746 10.858) 11.220 2.713 ( -2.178 -6.227 -0.117) 6.598 2.867 ( -0.946 -1.844 -3.092) 3.723 3.143 ( 1.404 -3.265 -4.715) 5.905 3.157 ( -3.432 -0.571 -0.622) 3.534 3.207 ( 1.114 1.078 1.530) 2.179 3.413 ( -1.814 -2.187 1.522) 3.223 3.591 ( 0.108 -7.102 1.599) 7.281 3.662 ( -3.865 1.175 -1.214) 4.219 3.789 ( 4.356 4.592 -0.030) 6.329 3.857 ( -8.144 1.166 -3.590) 8.976 4.061 ( 9.880 -0.540 2.982) 10.335 4.186 ( -0.484 10.229 -1.783) 10.395 4.440 ( 11.925 1.943 -3.634) 12.617 4.605 ( 3.079 7.483 -10.704) 13.419 4.676 ( -11.133 -1.971 3.723) 11.903 4.839 ( -2.849 0.820 -4.201) 5.142 5.170 ( -5.011 -2.116 -5.732) 7.902 5.356 ( 9.008 -1.821 0.156) 9.192 5.422 ( 7.519 1.155 -0.817) 7.651 5.872 ( -6.048 1.276 5.155) 8.049 5.992 ( -0.241 -4.820 0.408) 4.843 6.104 ( 2.403 -1.869 -2.855) 4.174 6.204 ( 1.950 3.836 -4.746) 6.406 6.433 ( 1.897 -2.117 2.554) 3.821 6.482 ( 2.486 4.661 -2.616) 5.895 6.668 ( -3.532 4.631 -0.689) 5.865 6.832 ( 4.307 -1.212 -1.813) 4.828 7.145 ( -4.301 -7.207 2.017) 8.632 7.420 ( -4.463 -0.849 0.100) 4.544 7.582 ( -0.018 -11.176 3.310) 11.656 7.817 ( 3.388 -4.867 -1.955) 6.244 8.308 ( 1.580 0.952 -2.832) 3.380 8.400 ( -3.757 5.266 -4.253) 7.742 8.646 ( -2.041 -1.829 -5.220) 5.896 8.770 ( 2.133 11.712 -2.685) 12.204 9.387 ( -2.913 -0.515 3.875) 4.876 9.500 ( -3.081 3.745 3.508) 5.985 9.985 ( -0.867 4.914 -3.535) 6.115 10.234 ( -1.867 15.812 -16.774) 23.127 10.497 ( -1.793 5.607 -0.957) 5.964 10.661 ( 1.358 3.168 -2.309) 4.149 11.028 ( -5.831 -3.664 2.168) 7.220 11.241 ( 1.159 -2.284 -0.352) 2.586 12.012 ( -1.200 2.466 5.506) 6.151 12.474 ( -1.281 -10.150 5.555) 11.641 12.606 ( -4.776 -14.399 13.155) 20.080 12.715 ( -0.744 -4.236 1.758) 4.646 13.027 ( 1.744 -3.389 5.961) 7.076 13.187 ( 18.582 -20.343 28.316) 39.509 13.708 ( -10.125 0.532 -4.851) 11.240 13.901 ( 10.925 -0.874 3.249) 11.431 14.046 ( -1.865 0.598 0.046) 1.959 14.109 ( -2.619 -0.167 0.826) 2.751 14.352 ( 3.221 1.754 -2.108) 4.230 14.827 ( 8.256 -0.080 -8.785) 12.055 19.044 ( -2.440 6.525 0.011) 6.967 19.493 ( 1.020 25.570 -21.152) 33.201 19.877 ( 3.329 4.269 -1.265) 5.559 20.548 ( 25.244 -1.111 -2.415) 25.384 21.623 ( 8.854 0.852 -4.428) 9.936 21.814 ( -1.449 -0.743 -4.361) 4.655 21.878 ( -14.935 1.958 -0.242) 15.064 21.982 ( -17.985 -1.094 0.640) 18.030 23.665 ( -4.366 -3.067 5.747) 7.842 23.873 ( 1.923 -1.095 -0.934) 2.402 24.321 ( -13.955 2.440 -2.244) 14.343 24.373 ( -4.744 0.493 -0.490) 4.794 ======================= Grid point 72 (30/116) ======================= q-point: ( 0.12 0.14 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.017 ( 14.261 18.237 12.932) 26.518 1.172 ( 18.335 14.510 20.342) 30.992 1.438 ( 22.329 15.941 20.891) 34.484 2.081 ( 11.661 0.365 0.394) 11.673 2.418 ( 5.021 6.812 9.609) 12.804 2.753 ( 5.884 -7.261 -2.116) 9.582 2.870 ( 0.394 -2.172 -4.097) 4.654 3.048 ( -7.596 3.676 -0.835) 8.480 3.116 ( -2.592 -4.239 -2.132) 5.406 3.214 ( -0.265 -2.083 2.572) 3.321 3.391 ( 2.482 1.068 -5.028) 5.709 3.504 ( -4.704 1.590 0.667) 5.010 3.623 ( -0.742 -2.180 -1.475) 2.735 3.746 ( -3.253 -3.410 1.527) 4.954 3.916 ( 6.636 3.443 -0.177) 7.478 4.107 ( -0.863 7.335 -2.243) 7.719 4.332 ( 4.860 1.248 1.525) 5.244 4.376 ( -2.848 2.068 0.906) 3.634 4.510 ( -7.413 6.044 -0.599) 9.583 4.703 ( 4.903 -1.374 -1.897) 5.433 4.792 ( 2.240 3.357 -3.986) 5.672 5.045 ( -5.528 -4.354 -3.170) 7.718 5.504 ( 6.929 0.548 -2.938) 7.546 5.570 ( 7.377 -1.868 1.940) 7.854 5.776 ( -6.416 -1.236 4.980) 8.215 5.980 ( -1.042 -6.969 -0.564) 7.069 6.170 ( 1.982 1.811 -1.522) 3.086 6.182 ( 0.326 0.331 -0.761) 0.891 6.463 ( 0.613 5.529 -2.387) 6.054 6.668 ( 3.298 -1.369 -6.995) 7.854 6.851 ( 17.708 -7.777 -4.578) 19.875 6.942 ( 5.621 -2.500 0.227) 6.156 7.087 ( 1.407 -4.872 -2.255) 5.550 7.379 ( 2.398 3.676 -3.609) 5.682 7.655 ( 5.373 -10.967 3.223) 12.631 7.850 ( 0.316 -4.143 -0.164) 4.158 8.286 ( -4.087 6.645 -4.063) 8.796 8.348 ( 1.108 1.941 -0.279) 2.252 8.627 ( 1.029 0.690 -5.143) 5.291 8.823 ( 4.447 5.930 -4.708) 8.781 9.346 ( -2.114 2.395 5.535) 6.391 9.490 ( 0.811 3.540 2.592) 4.462 9.996 ( 3.627 6.215 -4.833) 8.668 10.159 ( -1.220 14.303 -8.771) 16.823 10.474 ( -0.533 2.633 -0.399) 2.716 10.682 ( 1.325 2.863 -2.128) 3.806 10.940 ( -4.473 -2.870 1.647) 5.564 11.220 ( -3.073 -1.801 -0.455) 3.590 11.984 ( -3.053 1.989 5.701) 6.766 12.416 ( -9.716 -5.390 17.319) 20.577 12.538 ( 0.684 -2.158 1.581) 2.761 12.698 ( -1.215 -5.964 0.592) 6.115 13.065 ( 0.935 0.044 5.388) 5.469 13.307 ( -5.324 -11.510 11.505) 17.123 13.469 ( -12.039 2.384 -1.512) 12.366 13.915 ( -10.690 -1.245 0.793) 10.791 14.043 ( -4.020 -1.090 0.452) 4.190 14.198 ( 8.779 1.076 -0.326) 8.850 14.457 ( 13.857 -6.418 0.401) 15.277 15.147 ( 15.676 -16.967 -5.804) 23.818 18.992 ( -3.019 6.622 -1.509) 7.432 19.254 ( -15.740 23.485 -7.678) 29.295 19.893 ( -0.388 3.859 -1.039) 4.015 20.344 ( -20.511 -0.731 14.565) 25.167 21.532 ( -7.361 2.608 1.009) 7.874 21.896 ( 4.152 -1.705 -9.039) 10.092 22.025 ( 10.573 -2.356 4.234) 11.631 22.458 ( 51.492 -13.090 -30.601) 61.313 23.620 ( -1.535 -0.194 5.990) 6.187 23.934 ( 4.813 -2.592 -0.799) 5.525 24.069 ( -6.977 13.068 -3.895) 15.318 24.424 ( 4.518 0.642 0.189) 4.568 ======================= Grid point 73 (31/116) ======================= q-point: ( 0.25 0.14 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.304 ( 11.931 16.983 11.723) 23.837 1.495 ( 9.501 8.943 29.922) 32.643 1.986 ( 15.735 6.501 2.726) 17.242 2.233 ( 7.220 -4.897 6.019) 10.599 2.644 ( 12.544 8.602 8.233) 17.296 2.817 ( 0.625 3.667 -3.557) 5.147 2.850 ( 2.693 -6.789 -3.576) 8.132 2.974 ( 0.191 3.182 -3.029) 4.398 3.064 ( -0.302 -6.134 -3.647) 7.143 3.270 ( 5.566 -2.672 1.961) 6.478 3.440 ( 1.806 1.803 -6.686) 7.156 3.514 ( 6.098 -1.103 1.699) 6.425 3.587 ( -2.210 2.125 -0.086) 3.067 3.713 ( -1.042 -4.625 0.210) 4.745 4.040 ( 6.875 5.271 -2.547) 9.030 4.091 ( -1.046 4.186 1.129) 4.460 4.218 ( -3.366 1.928 1.495) 4.158 4.402 ( -1.865 4.816 2.957) 5.951 4.518 ( -2.317 4.383 -2.399) 5.508 4.768 ( 10.684 0.643 -0.248) 10.706 4.906 ( 5.994 -1.012 -3.492) 7.010 4.964 ( -1.236 -4.552 -1.507) 4.952 5.629 ( 5.363 -0.329 2.679) 6.004 5.648 ( -6.118 -2.518 0.864) 6.672 5.708 ( 5.601 0.474 1.716) 5.877 5.965 ( -0.399 -3.958 -1.747) 4.345 6.115 ( -3.058 -0.474 -3.069) 4.358 6.259 ( 3.513 -1.263 1.524) 4.032 6.492 ( 2.390 3.921 -1.161) 4.736 6.632 ( -3.816 -4.049 -8.757) 10.375 6.941 ( -4.366 -2.593 -0.072) 5.079 6.989 ( 1.615 -2.267 0.577) 2.843 7.131 ( 1.538 -2.256 -2.737) 3.866 7.518 ( 9.700 2.086 -10.480) 14.432 7.756 ( 2.429 -11.066 1.977) 11.501 7.849 ( 0.636 -4.343 2.287) 4.950 8.207 ( -2.579 8.672 -0.624) 9.069 8.373 ( 1.109 0.224 -0.501) 1.238 8.645 ( 2.194 3.045 -2.677) 4.609 8.890 ( 3.167 0.716 -3.976) 5.133 9.344 ( 0.293 3.470 3.289) 4.790 9.537 ( 2.807 1.129 3.403) 4.554 10.096 ( 7.245 8.320 -5.833) 12.479 10.133 ( 1.108 9.219 -3.482) 9.917 10.470 ( 0.293 1.353 -0.580) 1.501 10.695 ( 0.786 2.677 -2.871) 4.003 10.853 ( -4.987 -1.534 0.784) 5.277 11.126 ( -6.334 -0.415 -0.833) 6.402 11.936 ( -3.532 1.963 5.549) 6.864 12.288 ( -7.746 1.002 15.920) 17.732 12.606 ( 5.033 -1.206 0.230) 5.181 12.676 ( -1.102 -8.316 0.403) 8.398 13.068 ( -4.296 0.414 3.594) 5.617 13.204 ( -4.349 -1.151 0.337) 4.511 13.309 ( -4.887 -2.143 4.060) 6.705 13.691 ( -9.997 2.617 0.227) 10.336 13.949 ( -5.280 -0.864 -0.265) 5.357 14.334 ( 5.287 4.150 -0.773) 6.766 14.718 ( 11.250 -11.635 0.431) 16.191 15.298 ( 3.208 -11.000 -3.602) 12.011 18.871 ( -9.187 11.026 1.547) 14.435 19.059 ( -2.031 8.393 -3.093) 9.172 19.870 ( -2.989 -5.852 4.402) 7.909 20.153 ( -4.724 2.733 4.840) 7.294 21.426 ( -4.422 2.108 0.994) 4.999 21.925 ( 2.565 1.606 -7.367) 7.964 22.242 ( 9.047 -3.451 6.164) 11.478 23.118 ( 26.095 -15.371 -23.410) 38.279 23.637 ( 1.089 0.878 3.781) 4.031 23.976 ( -2.239 11.924 -1.810) 12.267 24.058 ( 8.217 -6.782 -5.807) 12.134 24.525 ( 5.741 2.761 -1.211) 6.484 ======================= Grid point 74 (32/116) ======================= q-point: ( 0.38 0.14 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.480 ( 1.555 14.245 10.735) 17.904 1.752 ( 8.269 6.103 25.702) 27.681 1.972 ( -10.181 6.503 7.192) 14.059 2.378 ( 6.273 -5.263 0.334) 8.195 2.811 ( -6.279 0.481 3.234) 7.080 2.817 ( 0.341 0.321 -6.826) 6.842 2.950 ( 5.917 -1.945 -2.815) 6.835 3.027 ( 14.492 2.510 0.554) 14.718 3.145 ( 6.628 -4.123 -1.620) 7.972 3.410 ( 5.589 1.106 -5.324) 7.798 3.437 ( 1.560 -0.081 2.864) 3.263 3.544 ( -2.250 3.691 -0.196) 4.327 3.660 ( 3.468 -3.473 2.114) 5.344 3.715 ( 4.080 -2.575 -0.763) 4.885 4.059 ( -1.832 2.286 4.070) 5.014 4.158 ( 5.312 3.953 -0.240) 6.626 4.231 ( 2.105 4.397 -0.910) 4.959 4.400 ( -4.689 5.085 -0.468) 6.933 4.426 ( 0.689 4.546 1.904) 4.976 4.887 ( 0.643 -5.690 -2.326) 6.180 5.007 ( 6.463 -2.212 -5.000) 8.466 5.054 ( 8.537 1.006 -1.396) 8.708 5.524 ( -6.595 -1.238 4.719) 8.203 5.700 ( -0.723 -0.481 1.551) 1.777 5.826 ( 6.783 2.303 -0.612) 7.190 5.959 ( 0.193 -3.855 -1.839) 4.276 6.063 ( -0.350 1.521 -1.035) 1.873 6.327 ( 3.573 -4.358 -1.158) 5.753 6.463 ( -5.457 -7.294 -3.241) 9.669 6.569 ( 0.707 4.659 -6.424) 7.967 6.815 ( -6.957 -1.787 -1.797) 7.405 6.939 ( -4.750 3.961 -0.146) 6.186 7.190 ( 3.797 -1.583 -0.061) 4.114 7.597 ( 1.527 1.735 -7.584) 7.928 7.755 ( -0.739 -8.810 0.271) 8.845 7.896 ( 2.126 -4.414 2.455) 5.480 8.192 ( 0.402 7.998 1.907) 8.232 8.381 ( -0.060 -2.023 -1.136) 2.321 8.696 ( 3.266 1.543 -0.957) 3.737 8.912 ( -0.019 0.086 -1.074) 1.078 9.368 ( 1.306 4.042 1.558) 4.525 9.602 ( 2.289 -0.067 4.390) 4.952 10.111 ( -0.012 10.471 -2.705) 10.814 10.287 ( 11.254 5.507 -5.671) 13.753 10.482 ( 0.960 0.113 -0.076) 0.970 10.692 ( -0.273 1.583 -4.136) 4.437 10.763 ( -4.459 -0.467 2.070) 4.938 10.986 ( -7.124 3.160 -1.124) 7.875 11.886 ( -3.190 1.828 5.358) 6.498 12.216 ( -4.206 2.317 11.673) 12.623 12.645 ( -0.971 -6.979 -1.968) 7.316 12.726 ( 5.672 -2.920 2.051) 6.701 12.929 ( -7.213 -0.138 -0.599) 7.239 13.206 ( 0.440 6.373 3.116) 7.108 13.245 ( -2.209 -8.430 2.793) 9.151 13.555 ( -4.758 3.458 0.804) 5.937 13.859 ( -3.438 -0.391 -0.043) 3.461 14.396 ( 1.735 5.509 -2.167) 6.169 14.875 ( 4.893 -13.487 0.660) 14.363 15.309 ( 0.034 -4.125 -3.585) 5.465 18.730 ( -5.643 7.479 3.016) 9.842 19.063 ( 2.379 3.759 -3.774) 5.834 19.796 ( -6.061 -8.897 7.015) 12.849 20.138 ( 1.444 -0.206 -0.553) 1.560 21.363 ( -2.478 2.739 0.863) 3.793 21.954 ( 2.664 6.100 -7.822) 10.271 22.383 ( 2.985 -5.013 6.996) 9.110 23.421 ( 12.760 -8.932 -11.147) 19.154 23.658 ( -0.356 -0.242 2.821) 2.854 23.940 ( -0.916 10.779 -3.845) 11.481 24.206 ( 7.867 -11.505 -2.524) 14.164 24.626 ( 5.290 4.064 -3.549) 7.556 ======================= Grid point 75 (33/116) ======================= q-point: (-0.50 0.14 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.455 ( -5.368 12.883 8.463) 16.322 1.715 ( -15.564 6.126 10.183) 19.582 1.990 ( 6.622 7.250 18.424) 20.877 2.502 ( 0.768 -0.401 -3.312) 3.424 2.646 ( -3.214 0.776 3.706) 4.966 2.835 ( 3.434 -1.834 -6.023) 7.171 3.055 ( 4.060 -6.655 1.617) 7.962 3.230 ( 3.112 -1.814 2.414) 4.336 3.254 ( 5.516 -5.147 -0.903) 7.599 3.404 ( -2.522 2.642 -1.443) 3.927 3.450 ( -3.133 -1.059 0.049) 3.307 3.550 ( 1.806 5.336 -0.649) 5.671 3.659 ( -0.780 -0.439 -0.506) 1.028 3.798 ( 0.888 -2.731 1.352) 3.174 4.039 ( -3.009 3.004 3.748) 5.668 4.214 ( -0.305 -1.339 2.103) 2.512 4.243 ( 0.163 6.803 0.788) 6.850 4.355 ( 1.207 5.043 -2.700) 5.846 4.438 ( -0.975 7.267 1.894) 7.573 4.892 ( 0.188 -5.501 -2.192) 5.925 5.065 ( 1.448 -4.938 -5.975) 7.886 5.150 ( 0.609 0.376 -3.781) 3.848 5.429 ( -4.703 1.196 4.412) 6.559 5.633 ( -4.290 2.349 -1.748) 5.194 5.888 ( -1.676 -1.451 -2.488) 3.332 6.001 ( 5.207 -1.514 1.773) 5.705 6.093 ( 2.092 2.827 1.031) 3.665 6.340 ( -5.681 -7.311 -3.307) 9.832 6.407 ( 5.641 -4.444 -2.406) 7.573 6.567 ( 1.683 2.269 -6.744) 7.312 6.738 ( 0.982 -0.901 -1.838) 2.270 6.855 ( -3.925 5.693 -0.450) 6.929 7.243 ( 1.394 0.512 0.875) 1.724 7.577 ( -0.166 -0.489 -4.919) 4.946 7.753 ( 0.200 -9.659 -0.598) 9.679 7.935 ( 1.225 -2.881 2.041) 3.737 8.210 ( 0.470 7.583 2.573) 8.021 8.370 ( -0.521 -3.341 -1.489) 3.694 8.740 ( 0.913 0.859 -0.110) 1.259 8.890 ( -1.791 0.840 -0.538) 2.050 9.397 ( 1.242 4.203 0.903) 4.474 9.643 ( 0.411 -1.228 5.438) 5.591 10.108 ( 0.620 9.285 -2.277) 9.580 10.439 ( 2.654 7.582 -5.350) 9.652 10.506 ( 1.580 -1.419 -0.787) 2.265 10.662 ( -0.415 0.225 -0.562) 0.734 10.706 ( -1.050 0.044 -0.407) 1.127 10.909 ( 1.066 6.290 -0.692) 6.417 11.847 ( -2.554 1.477 5.025) 5.827 12.185 ( -2.520 2.250 9.594) 10.172 12.618 ( -0.856 -7.883 -2.926) 8.452 12.783 ( -2.180 -2.126 -0.166) 3.049 12.881 ( 3.766 0.244 2.720) 4.653 13.160 ( -3.239 -2.436 -0.738) 4.119 13.272 ( 0.726 0.286 5.358) 5.414 13.497 ( -1.233 2.868 0.016) 3.122 13.835 ( 1.047 0.056 1.055) 1.487 14.396 ( -0.691 6.272 -3.533) 7.232 14.917 ( -0.557 -14.524 0.641) 14.549 15.295 ( -0.349 -0.891 -4.144) 4.253 18.672 ( -1.258 6.017 2.453) 6.618 19.109 ( 3.068 2.916 -2.955) 5.162 19.705 ( -4.669 -8.207 5.443) 10.899 20.174 ( 1.853 -3.569 -0.041) 4.022 21.333 ( -0.832 2.712 0.214) 2.845 21.975 ( 1.756 9.592 -7.799) 12.486 22.387 ( -4.469 -5.973 5.268) 9.133 23.583 ( 5.974 -2.519 -4.057) 7.648 23.632 ( -2.313 -4.111 1.904) 5.086 23.911 ( -0.814 7.299 -4.591) 8.661 24.330 ( 4.756 -10.297 1.383) 11.426 24.709 ( 4.824 2.349 -4.040) 6.717 ======================= Grid point 76 (34/116) ======================= q-point: (-0.38 0.14 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.357 ( -7.653 13.927 7.354) 17.511 1.432 ( -16.520 9.067 12.782) 22.770 2.133 ( 2.671 6.660 13.078) 14.917 2.347 ( -8.256 4.157 -3.605) 9.922 2.731 ( 1.006 -2.554 4.424) 5.206 2.908 ( 4.378 -2.811 -1.501) 5.415 3.076 ( -12.013 4.325 2.501) 13.011 3.140 ( -2.343 -8.358 3.795) 9.473 3.259 ( -6.797 -5.888 0.977) 9.046 3.324 ( -1.622 -2.451 3.084) 4.260 3.450 ( 1.892 -1.808 -2.926) 3.926 3.565 ( -0.693 -0.685 -3.008) 3.162 3.656 ( 0.376 2.402 -0.490) 2.480 3.767 ( -1.639 3.409 0.075) 3.783 3.954 ( -5.290 0.591 3.496) 6.368 4.168 ( -4.031 2.722 1.390) 5.058 4.256 ( -2.226 5.778 -4.480) 7.643 4.363 ( -0.329 6.127 2.767) 6.731 4.449 ( 4.413 6.525 1.320) 7.987 4.847 ( -5.284 -4.804 -5.952) 9.297 5.009 ( -5.095 -1.998 -2.272) 5.925 5.091 ( -2.994 -5.473 -3.239) 7.029 5.364 ( -3.043 1.762 1.101) 3.684 5.556 ( -3.104 2.311 -4.582) 5.998 5.864 ( 0.572 -0.818 0.900) 1.344 6.048 ( 0.463 0.065 0.903) 1.017 6.177 ( 4.974 2.147 3.974) 6.719 6.215 ( -5.463 -5.390 -4.474) 8.884 6.501 ( 1.775 -3.287 -1.034) 3.877 6.628 ( 7.219 -3.604 -7.766) 11.199 6.770 ( -3.132 6.071 -2.027) 7.126 6.824 ( 5.690 -0.359 -2.906) 6.399 7.246 ( -1.449 3.286 1.243) 3.801 7.590 ( 3.110 -2.417 -5.294) 6.599 7.741 ( -1.878 -12.943 0.453) 13.086 7.943 ( -1.703 -6.385 2.258) 6.983 8.230 ( 1.220 6.818 1.041) 7.004 8.362 ( 0.609 -0.194 -0.518) 0.822 8.726 ( -1.894 3.719 0.199) 4.178 8.849 ( -1.898 1.612 -1.923) 3.147 9.419 ( 0.734 3.554 0.301) 3.641 9.653 ( -1.109 -3.831 6.290) 7.447 10.128 ( 2.264 9.586 -2.225) 10.097 10.331 ( -9.048 -0.562 -2.143) 9.315 10.524 ( 0.663 9.852 -0.425) 9.884 10.656 ( 0.005 3.539 -3.890) 5.259 10.794 ( 8.071 -4.416 2.172) 9.453 11.008 ( 7.946 5.306 -1.446) 9.663 11.817 ( -2.123 1.088 5.237) 5.755 12.172 ( -2.032 1.706 10.619) 10.945 12.595 ( -0.764 -7.859 -3.525) 8.648 12.731 ( -2.620 -1.803 1.340) 3.451 12.981 ( 3.708 -1.967 2.367) 4.819 13.109 ( -0.700 -3.190 -1.839) 3.748 13.272 ( -1.442 2.769 3.931) 5.020 13.528 ( 4.674 2.948 -0.081) 5.527 13.899 ( 4.556 -0.015 2.136) 5.032 14.351 ( -2.681 6.561 -4.451) 8.369 14.860 ( -5.641 -15.170 0.182) 16.186 15.262 ( -1.927 -0.183 -5.088) 5.444 18.699 ( 3.737 8.085 1.355) 9.009 19.149 ( 1.345 3.956 -0.483) 4.206 19.667 ( -0.170 -6.987 2.294) 7.355 20.194 ( -0.400 -2.747 2.066) 3.461 21.336 ( 1.422 1.228 -0.713) 2.010 21.972 ( 0.161 10.137 -6.752) 12.181 22.255 ( -9.518 -5.269 1.391) 10.968 23.511 ( -8.363 -2.633 0.917) 8.816 23.696 ( 3.970 -3.830 -0.745) 5.567 23.882 ( -0.723 3.043 -4.736) 5.676 24.385 ( 0.545 -5.510 1.271) 5.681 24.796 ( 4.884 -3.845 -0.675) 6.253 ======================= Grid point 77 (35/116) ======================= q-point: (-0.25 0.14 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.159 ( -14.762 10.504 20.566) 27.408 1.207 ( -11.884 19.060 7.895) 23.809 2.119 ( -14.207 8.050 9.311) 18.797 2.184 ( -10.869 5.101 -2.604) 12.285 2.448 ( -18.642 2.650 5.320) 19.567 2.927 ( -1.533 -3.534 2.686) 4.696 3.000 ( 2.231 3.883 2.374) 5.068 3.099 ( -7.749 -6.578 0.714) 10.189 3.198 ( 0.901 -6.916 3.748) 7.917 3.260 ( -3.121 -3.595 1.167) 4.901 3.416 ( -4.458 -4.296 -4.294) 7.534 3.510 ( -2.097 -1.444 0.722) 2.646 3.670 ( 1.408 -0.880 -1.217) 2.059 3.785 ( 0.469 6.659 2.687) 7.196 3.924 ( 2.570 1.758 -0.874) 3.234 4.074 ( -7.737 5.239 -1.360) 9.442 4.146 ( -0.768 6.174 -4.535) 7.699 4.385 ( 1.581 9.444 3.259) 10.115 4.555 ( -7.615 2.934 -2.515) 8.539 4.667 ( 2.538 -2.604 -3.377) 4.963 4.974 ( 0.676 -5.210 -1.699) 5.522 5.042 ( -0.913 -4.252 0.476) 4.375 5.321 ( -0.996 1.589 -2.641) 3.239 5.467 ( -4.824 1.424 -5.352) 7.345 5.905 ( 2.229 -0.141 4.130) 4.695 6.062 ( 0.102 -0.007 1.578) 1.581 6.118 ( -3.055 -3.724 -4.302) 6.458 6.256 ( 1.058 0.280 3.081) 3.269 6.465 ( -3.069 -1.314 -1.823) 3.804 6.673 ( -1.038 -1.397 -10.631) 10.772 6.789 ( 5.111 0.814 -0.538) 5.204 6.879 ( -0.361 -1.705 -4.746) 5.056 7.214 ( -1.327 4.227 0.814) 4.505 7.647 ( 2.273 -4.947 -6.213) 8.261 7.680 ( -2.864 -12.498 2.252) 13.018 7.857 ( -8.214 -13.652 2.583) 16.141 8.258 ( 1.728 3.571 -2.450) 4.663 8.403 ( 2.988 4.468 0.920) 5.453 8.699 ( -0.366 7.576 -0.010) 7.585 8.808 ( -1.501 2.288 -3.837) 4.713 9.426 ( -0.030 2.417 -0.306) 2.437 9.635 ( -2.924 -6.300 6.400) 9.445 10.156 ( -7.026 2.753 -2.386) 7.915 10.190 ( 4.216 8.762 -3.023) 10.182 10.533 ( 0.360 8.215 0.073) 8.223 10.650 ( 0.485 4.506 -3.807) 5.918 10.974 ( 9.254 -4.330 3.289) 10.734 11.151 ( 6.324 3.234 -3.189) 7.786 11.813 ( 0.732 0.957 9.240) 9.319 12.176 ( -1.188 -0.147 16.102) 16.146 12.559 ( -2.132 -7.490 -2.237) 8.103 12.702 ( -0.699 -2.385 1.642) 2.979 12.979 ( -2.374 -2.884 -1.928) 4.204 13.105 ( -2.494 -3.449 0.412) 4.277 13.346 ( 10.103 4.994 2.981) 11.657 13.664 ( 8.936 2.199 -0.615) 9.223 14.001 ( 4.813 -0.458 2.494) 5.440 14.266 ( -4.657 7.075 -4.527) 9.604 14.690 ( -12.295 -15.453 -0.324) 19.750 15.173 ( -5.960 -0.449 -7.185) 9.347 18.840 ( 11.366 14.710 -0.755) 18.604 19.154 ( -0.676 6.732 1.296) 6.889 19.711 ( 3.729 -6.082 1.228) 7.239 20.168 ( -2.874 1.629 3.273) 4.650 21.392 ( 4.823 -0.818 -1.220) 5.042 21.936 ( -2.572 5.094 -4.386) 7.197 22.067 ( -8.389 -1.040 -3.390) 9.107 23.288 ( -15.253 -6.266 -3.127) 16.784 23.741 ( 0.439 -2.169 1.904) 2.920 23.859 ( -0.043 -0.524 -4.438) 4.469 24.372 ( -1.464 -2.156 -0.607) 2.676 24.867 ( 0.948 -12.407 1.404) 12.522 ======================= Grid point 78 (36/116) ======================= q-point: (-0.12 0.14 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.967 ( -15.825 15.253 16.638) 27.567 0.995 ( -10.258 19.056 20.126) 29.554 1.491 ( -36.725 18.163 16.560) 44.191 2.017 ( -9.371 6.390 -6.036) 12.848 2.343 ( -0.861 2.466 8.908) 9.284 2.816 ( -7.400 -7.812 0.391) 10.768 2.962 ( -7.921 -1.558 0.296) 8.078 3.092 ( 4.383 0.992 2.221) 5.013 3.152 ( 1.097 -1.149 -0.110) 1.592 3.255 ( -4.880 -1.933 -1.776) 5.541 3.374 ( 3.642 -7.447 1.787) 8.480 3.537 ( 4.474 -2.170 -0.005) 4.973 3.702 ( 1.592 3.573 -0.472) 3.940 3.755 ( -3.808 -1.080 3.344) 5.182 3.894 ( -0.654 6.078 -1.998) 6.431 4.058 ( -0.906 6.494 -1.434) 6.712 4.204 ( 7.018 4.269 -5.382) 9.821 4.285 ( -8.199 2.437 -2.015) 8.788 4.464 ( 6.798 10.263 -1.703) 12.428 4.812 ( 5.994 -0.725 -1.696) 6.272 4.890 ( -8.660 -3.390 1.783) 9.470 5.142 ( 9.161 -3.935 -0.835) 10.005 5.305 ( -1.500 0.491 -3.752) 4.070 5.356 ( -2.492 1.422 -4.118) 5.018 5.938 ( -1.375 2.308 5.414) 6.044 6.038 ( -3.149 -2.082 1.754) 4.162 6.082 ( 0.694 -4.287 -3.719) 5.718 6.225 ( -2.715 -0.047 -1.775) 3.244 6.446 ( 1.400 0.914 -1.988) 2.598 6.574 ( -6.825 -2.072 -6.887) 9.915 6.804 ( -4.349 -0.847 -4.549) 6.350 6.827 ( -2.048 0.242 -3.213) 3.818 7.197 ( -1.620 -1.500 1.371) 2.599 7.544 ( -7.661 -9.997 1.022) 12.636 7.664 ( -8.666 -13.984 1.442) 16.514 7.747 ( 3.763 -5.943 -1.988) 7.309 8.284 ( 1.816 1.861 -2.981) 3.955 8.442 ( 0.550 4.187 -2.104) 4.719 8.704 ( -0.366 3.869 -1.523) 4.174 8.763 ( -1.206 6.957 -4.717) 8.491 9.416 ( -0.928 0.758 0.278) 1.230 9.575 ( -4.996 -4.082 5.427) 8.430 10.040 ( -3.989 2.908 -2.051) 5.346 10.263 ( 3.957 11.291 -11.533) 16.618 10.533 ( -0.621 7.823 -1.713) 8.032 10.650 ( 0.698 4.181 -3.473) 5.480 11.118 ( 1.231 -3.240 0.476) 3.499 11.195 ( 1.520 -1.810 -3.398) 4.139 11.948 ( 7.270 1.759 10.058) 12.535 12.305 ( 11.571 -14.711 38.260) 42.593 12.514 ( -1.315 -6.006 -0.439) 6.164 12.707 ( 0.477 -2.925 0.819) 3.075 12.922 ( -1.982 0.737 -1.310) 2.488 13.049 ( -2.275 -1.449 2.719) 3.830 13.614 ( 14.948 2.464 3.390) 15.524 13.814 ( 4.125 -0.595 -3.975) 5.759 14.076 ( 1.437 -0.471 2.231) 2.695 14.191 ( 0.769 8.012 -2.018) 8.298 14.388 ( -17.197 -11.433 -1.336) 20.694 14.977 ( -11.441 0.703 -9.169) 14.679 19.066 ( 3.027 8.789 0.265) 9.299 19.240 ( 20.079 28.399 -11.252) 36.556 19.794 ( 3.232 -7.224 6.518) 10.253 20.153 ( 3.837 7.548 2.904) 8.952 21.512 ( 7.331 -1.715 -0.461) 7.543 21.832 ( -5.409 -3.058 -3.839) 7.304 21.960 ( -2.030 4.547 -4.959) 7.028 22.833 ( -33.743 -11.582 -9.559) 36.934 23.725 ( -2.782 -2.794 3.407) 5.211 23.855 ( 0.698 -1.503 -2.664) 3.138 24.345 ( -0.594 -1.227 -1.055) 1.723 24.755 ( -14.891 -16.609 -2.805) 22.483 ======================= Grid point 79 (37/116) ======================= q-point: ( 0.00 0.29 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.154 ( -0.317 22.444 6.777) 23.447 1.388 ( -0.177 20.272 22.092) 29.984 1.790 ( -3.390 27.474 11.689) 30.049 2.034 ( -0.145 7.277 -4.341) 8.475 2.366 ( 1.619 -4.318 9.595) 10.645 2.547 ( -2.020 -8.217 5.194) 9.929 2.778 ( -0.047 -7.316 -2.206) 7.641 3.027 ( -1.144 -6.442 -7.782) 10.167 3.152 ( -1.784 1.208 1.047) 2.396 3.262 ( -0.153 2.782 3.116) 4.180 3.374 ( 3.600 -0.478 5.648) 6.714 3.519 ( -1.800 0.664 -1.423) 2.389 3.676 ( -4.409 1.200 0.284) 4.578 3.850 ( -4.606 0.031 -3.444) 5.751 3.921 ( -0.837 4.334 -2.702) 5.175 4.065 ( 7.664 0.330 2.182) 7.976 4.405 ( 0.796 4.278 -2.491) 5.014 4.485 ( 9.332 5.682 -2.849) 11.291 4.600 ( -2.656 -4.860 -5.048) 7.494 4.610 ( -3.533 -3.601 -0.383) 5.059 4.805 ( 0.145 -3.510 -1.397) 3.781 5.138 ( -3.310 -1.803 -7.057) 8.001 5.340 ( 4.713 2.296 2.113) 5.652 5.473 ( 5.792 2.778 -4.970) 8.122 5.824 ( -3.435 -8.346 1.269) 9.114 5.882 ( -8.663 -1.157 1.388) 8.850 6.158 ( 5.624 5.484 -0.087) 7.855 6.329 ( 3.056 7.215 -5.980) 9.857 6.404 ( 0.425 -0.680 4.012) 4.092 6.571 ( 5.108 3.294 -3.560) 7.044 6.722 ( -1.598 0.287 -0.491) 1.696 6.787 ( 1.430 -3.420 -1.583) 4.031 7.023 ( -3.730 -3.581 1.373) 5.350 7.289 ( 0.538 -10.672 1.693) 10.819 7.474 ( 0.040 0.229 -2.296) 2.308 7.686 ( 3.884 -6.866 -2.082) 8.158 8.347 ( 0.485 3.009 -2.866) 4.183 8.488 ( -1.922 4.040 -0.108) 4.475 8.589 ( -2.514 -3.315 -4.287) 5.974 8.850 ( 0.733 -2.740 -1.555) 3.235 9.445 ( -2.264 5.015 5.741) 7.952 9.638 ( -0.849 6.824 4.058) 7.985 10.075 ( 0.076 5.402 0.482) 5.424 10.460 ( 2.394 6.189 -12.906) 14.511 10.655 ( -1.579 7.054 -4.324) 8.423 10.747 ( -0.804 4.511 -5.862) 7.441 10.938 ( -5.845 -4.094 4.987) 8.706 11.157 ( 1.604 -5.624 0.837) 5.908 12.088 ( -3.053 4.168 5.517) 7.559 12.190 ( 4.695 -7.950 19.907) 21.943 12.412 ( 2.293 -7.709 6.182) 10.144 12.600 ( -0.727 -6.611 -0.924) 6.715 12.976 ( 1.036 0.174 4.681) 4.798 13.074 ( 4.380 -1.141 6.126) 7.617 13.729 ( -7.747 1.532 -4.075) 8.886 13.882 ( 6.094 -1.259 2.643) 6.761 14.050 ( -2.602 -0.075 0.752) 2.709 14.102 ( -1.376 -0.589 1.290) 1.976 14.411 ( 2.730 3.698 -2.640) 5.301 14.742 ( 0.870 -5.940 -5.978) 8.472 19.214 ( -2.751 8.854 1.401) 9.377 19.624 ( -3.941 -2.913 2.057) 5.315 20.130 ( 7.962 13.303 -12.553) 19.948 20.521 ( 8.708 -1.558 -2.695) 9.248 21.630 ( 11.386 0.241 -6.106) 12.922 21.777 ( 11.242 -2.785 -6.261) 13.165 21.910 ( -19.289 1.123 1.313) 19.366 21.964 ( -13.017 -0.640 1.853) 13.164 23.658 ( -2.010 1.651 4.301) 5.027 23.836 ( 1.259 -2.321 0.277) 2.655 24.339 ( 0.634 0.146 -1.247) 1.407 24.375 ( -5.631 -0.464 -0.339) 5.660 ======================= Grid point 80 (38/116) ======================= q-point: ( 0.12 0.29 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.385 ( 16.249 16.978 7.075) 24.542 1.527 ( 7.292 17.876 22.786) 29.865 1.903 ( 12.212 23.402 7.699) 27.496 2.129 ( 7.093 3.707 0.947) 8.059 2.495 ( 8.672 -6.344 3.819) 11.403 2.568 ( 4.047 -2.665 6.202) 7.871 2.826 ( 3.938 -2.956 -3.073) 5.805 2.942 ( -3.422 -6.487 -3.539) 8.143 3.161 ( 0.182 -0.689 0.782) 1.058 3.232 ( -3.218 5.858 3.861) 7.719 3.403 ( -1.055 0.997 -3.087) 3.411 3.486 ( 0.403 -1.752 3.919) 4.312 3.613 ( -1.626 -1.395 -2.797) 3.524 3.695 ( -5.160 0.417 -2.370) 5.694 4.010 ( 7.052 5.162 -2.534) 9.099 4.212 ( 1.187 0.403 -0.894) 1.540 4.345 ( -6.490 -0.634 -0.072) 6.521 4.440 ( 2.681 2.087 -0.616) 3.453 4.613 ( 1.947 5.446 -3.756) 6.896 4.663 ( 2.312 -1.700 0.009) 2.870 4.846 ( 4.993 -0.015 -1.229) 5.142 4.989 ( -7.875 0.391 -5.081) 9.380 5.475 ( 6.701 -1.740 2.564) 7.382 5.572 ( 6.598 1.453 -5.809) 8.910 5.733 ( -7.274 -3.070 1.885) 8.118 5.804 ( 1.141 -8.363 0.432) 8.452 6.204 ( -6.493 1.755 -3.445) 7.557 6.258 ( 3.425 5.489 3.387) 7.303 6.554 ( -4.794 -3.968 -2.261) 6.621 6.575 ( 6.995 3.226 -5.440) 9.430 6.823 ( 9.139 0.425 0.722) 9.177 6.869 ( 3.753 -4.253 1.953) 5.999 7.022 ( 4.875 -0.954 -2.099) 5.393 7.345 ( 5.104 -9.195 -0.062) 10.517 7.504 ( 3.886 0.407 -1.329) 4.127 7.745 ( 2.282 -5.618 -0.196) 6.067 8.344 ( -0.169 1.926 -3.985) 4.429 8.460 ( -0.774 6.237 0.547) 6.309 8.571 ( 2.168 -4.036 -5.720) 7.328 8.857 ( 0.729 -3.052 -1.557) 3.503 9.435 ( -0.529 5.797 5.490) 8.001 9.627 ( -1.271 6.694 4.009) 7.906 10.098 ( 2.335 4.813 0.302) 5.358 10.454 ( 1.128 10.596 -12.302) 16.275 10.574 ( -4.543 6.165 -2.975) 8.216 10.730 ( 0.706 1.557 -3.433) 3.835 10.887 ( -2.041 -1.231 3.956) 4.619 11.152 ( -1.904 -4.942 -0.645) 5.335 12.043 ( -3.293 3.448 5.719) 7.446 12.289 ( 0.609 -5.368 14.819) 15.773 12.445 ( -0.427 -6.065 6.883) 9.184 12.572 ( -1.275 -5.661 -1.600) 6.019 13.035 ( 2.913 -1.628 4.081) 5.272 13.157 ( -0.397 -3.263 7.600) 8.280 13.539 ( -9.553 3.970 -1.446) 10.445 13.858 ( -7.428 -4.114 0.124) 8.492 14.021 ( -3.221 -0.654 1.016) 3.440 14.139 ( 7.033 -4.102 -0.905) 8.192 14.464 ( 5.175 4.864 -0.456) 7.116 14.891 ( 12.134 -9.049 -5.648) 16.156 19.152 ( -3.633 8.311 -0.449) 9.082 19.503 ( -9.162 1.832 -1.514) 9.466 20.059 ( -13.447 9.934 -4.991) 17.447 20.335 ( -14.779 -0.282 5.824) 15.888 21.601 ( -8.359 3.815 3.150) 9.713 21.875 ( 6.034 -0.287 -7.879) 9.928 21.959 ( 10.272 -3.281 1.895) 10.948 22.238 ( 34.789 -8.287 -15.493) 38.974 23.653 ( 0.129 2.723 3.705) 4.600 23.867 ( 1.910 -3.391 0.830) 3.979 24.255 ( -3.616 5.462 -3.073) 7.235 24.424 ( 5.556 -0.829 -0.427) 5.634 ======================= Grid point 81 (39/116) ======================= q-point: ( 0.25 0.29 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.676 ( 11.344 15.642 11.699) 22.588 1.746 ( 6.580 13.955 21.232) 26.246 2.188 ( 8.703 4.588 1.581) 9.964 2.225 ( 2.910 11.264 4.663) 12.533 2.615 ( 5.835 -12.132 -2.627) 13.716 2.768 ( 7.937 2.389 8.072) 11.570 2.856 ( 2.246 0.320 -4.148) 4.728 2.948 ( 4.538 -4.504 -0.220) 6.397 3.131 ( -2.783 6.310 -1.504) 7.058 3.243 ( 5.988 2.454 3.639) 7.425 3.434 ( 3.366 -3.390 -1.581) 5.032 3.511 ( 2.294 0.886 0.017) 2.460 3.578 ( -0.018 -5.507 -4.083) 6.856 3.662 ( 0.176 3.574 0.539) 3.619 4.064 ( -1.013 -0.066 -3.038) 3.203 4.205 ( -1.576 2.365 3.527) 4.529 4.298 ( 5.694 4.125 -3.086) 7.679 4.498 ( 2.009 2.724 -1.833) 3.849 4.590 ( -3.148 2.288 -4.060) 5.624 4.806 ( 8.760 3.555 2.710) 9.835 4.842 ( -2.267 -2.799 -3.638) 5.119 4.949 ( 5.003 2.690 -0.357) 5.691 5.576 ( -1.868 -3.463 6.254) 7.389 5.607 ( 1.141 -2.082 -3.601) 4.313 5.718 ( 7.209 0.347 -0.625) 7.244 5.850 ( 2.787 -5.957 -1.957) 6.862 6.097 ( -3.156 -0.946 -4.037) 5.211 6.297 ( -0.095 2.530 1.405) 2.896 6.418 ( -7.219 -5.730 -2.094) 9.452 6.650 ( 2.278 3.509 -4.340) 6.028 6.871 ( -2.907 -3.401 0.644) 4.520 6.980 ( 6.011 -0.283 1.251) 6.146 7.099 ( 2.206 -0.095 -2.230) 3.138 7.472 ( 6.404 -10.960 -1.277) 12.758 7.591 ( 4.217 1.537 -1.373) 4.694 7.785 ( 2.624 -2.682 1.137) 3.921 8.312 ( -1.568 2.263 -3.715) 4.624 8.443 ( -1.289 5.214 -0.866) 5.440 8.626 ( 3.900 -2.818 -2.672) 5.504 8.871 ( 1.194 -3.303 -1.954) 4.019 9.457 ( 1.087 6.751 4.874) 8.397 9.627 ( 0.109 5.744 4.781) 7.474 10.174 ( 5.509 1.945 0.270) 5.848 10.411 ( -3.265 12.927 -4.525) 14.080 10.519 ( 0.698 0.861 -5.606) 5.715 10.743 ( 1.488 3.606 -3.125) 4.998 10.848 ( -3.276 0.863 2.245) 4.064 11.101 ( -2.295 -2.171 -2.691) 4.151 11.995 ( -3.212 3.634 4.316) 6.492 12.306 ( -2.807 0.026 12.712) 13.018 12.457 ( -0.458 -9.188 3.384) 9.802 12.575 ( 2.802 -3.465 -0.130) 4.458 13.081 ( -6.296 0.233 1.862) 6.570 13.093 ( 0.272 -4.337 2.893) 5.221 13.392 ( -5.469 5.891 2.214) 8.338 13.699 ( -7.528 -1.723 0.500) 7.739 13.938 ( -4.778 0.192 0.305) 4.792 14.314 ( 9.421 -10.018 -0.470) 13.760 14.569 ( 4.567 3.300 0.221) 5.639 15.080 ( 8.392 -9.491 -5.166) 13.682 19.067 ( -5.819 8.059 -0.435) 9.950 19.278 ( -10.544 8.896 -3.141) 14.148 19.779 ( -11.685 -1.464 6.209) 13.313 20.153 ( -7.685 -3.120 0.711) 8.325 21.511 ( -2.880 6.087 3.205) 7.458 21.962 ( 6.229 -0.077 -3.330) 7.063 22.173 ( 9.374 -0.783 -0.473) 9.418 22.808 ( 27.313 -13.905 -16.235) 34.683 23.672 ( 0.388 2.397 2.728) 3.652 23.917 ( 3.037 -5.593 0.635) 6.396 24.200 ( -1.248 8.821 -2.847) 9.352 24.543 ( 6.508 -1.225 -1.329) 6.755 ======================= Grid point 82 (40/116) ======================= q-point: ( 0.38 0.29 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.825 ( -1.536 15.842 11.106) 19.408 1.914 ( 4.464 8.418 20.829) 22.905 2.193 ( -5.728 14.353 3.958) 15.953 2.318 ( 9.025 0.057 -0.356) 9.032 2.708 ( 3.837 -8.591 -2.573) 9.755 2.805 ( -4.434 -1.047 1.814) 4.904 2.914 ( 2.206 -0.109 3.727) 4.333 3.060 ( 4.347 -3.511 1.754) 5.857 3.121 ( 2.892 2.184 -4.349) 5.662 3.404 ( 4.235 -1.308 -6.069) 7.515 3.452 ( 3.305 -0.840 3.039) 4.567 3.576 ( 1.768 -0.739 -3.378) 3.884 3.644 ( 5.000 -1.272 1.928) 5.508 3.672 ( 3.565 4.569 1.137) 5.906 4.060 ( 1.498 -1.263 1.451) 2.438 4.179 ( -2.441 -3.132 3.080) 5.026 4.404 ( 3.597 9.269 -3.554) 10.558 4.512 ( -1.377 6.185 -4.035) 7.512 4.566 ( 3.841 6.618 -0.287) 7.657 4.773 ( -0.159 -3.428 -2.780) 4.416 4.955 ( 3.203 -1.485 -3.033) 4.654 5.096 ( 8.070 2.342 0.602) 8.425 5.506 ( -3.347 -0.444 3.770) 5.061 5.671 ( 2.112 -2.398 1.040) 3.360 5.856 ( 6.205 0.054 -2.609) 6.731 5.866 ( 0.139 -4.243 -1.905) 4.653 6.075 ( 2.007 -1.182 -2.354) 3.312 6.274 ( -2.119 -7.155 -3.898) 8.419 6.299 ( -3.623 0.301 1.892) 4.098 6.620 ( -4.397 -1.538 -1.735) 4.971 6.812 ( -1.851 2.803 -2.721) 4.323 7.005 ( -2.671 1.968 -0.329) 3.334 7.164 ( 4.934 -0.738 -0.656) 5.032 7.519 ( -1.391 -10.859 1.726) 11.083 7.643 ( 2.368 1.838 -5.298) 6.087 7.853 ( 2.989 -1.263 1.434) 3.547 8.281 ( -0.244 1.344 -2.623) 2.958 8.412 ( -1.359 4.168 -0.676) 4.436 8.681 ( 2.155 -1.858 0.510) 2.890 8.884 ( 0.471 -3.068 -1.990) 3.687 9.500 ( 1.748 7.667 4.169) 8.901 9.653 ( 0.444 4.191 5.922) 7.269 10.289 ( 3.726 0.507 0.775) 3.840 10.348 ( 0.452 4.898 -2.109) 5.352 10.529 ( 0.954 2.009 -5.168) 5.626 10.765 ( 0.920 7.244 -0.230) 7.306 10.785 ( -2.135 1.928 -2.128) 3.578 11.055 ( -1.480 2.884 -3.370) 4.676 11.947 ( -2.933 3.941 3.132) 5.826 12.279 ( -3.058 2.916 9.611) 10.499 12.443 ( -1.152 -9.677 -0.263) 9.748 12.660 ( 4.266 -4.632 2.019) 6.613 12.945 ( -5.449 1.397 -0.485) 5.646 13.099 ( -1.509 -4.961 2.227) 5.644 13.341 ( -0.876 6.206 3.379) 7.120 13.584 ( -4.983 -0.437 1.020) 5.105 13.863 ( -2.649 1.262 0.737) 3.025 14.462 ( 5.816 -9.646 -0.812) 11.293 14.623 ( 0.917 1.120 0.158) 1.456 15.181 ( 3.903 -7.753 -4.844) 9.940 18.922 ( -7.425 9.802 1.505) 12.388 19.170 ( -0.498 5.706 -4.223) 7.116 19.626 ( -7.229 -6.182 7.134) 11.890 20.036 ( -3.936 -8.908 -0.543) 9.754 21.485 ( -1.334 8.527 2.788) 9.070 22.080 ( 6.560 1.133 -3.520) 7.531 22.291 ( 2.707 1.252 0.400) 3.009 23.187 ( 16.830 -13.703 -11.394) 24.512 23.670 ( -1.533 1.710 2.338) 3.277 23.969 ( 1.640 -7.437 -1.999) 7.874 24.196 ( 1.544 10.120 0.745) 10.264 24.648 ( 4.693 -1.764 -2.382) 5.551 ======================= Grid point 83 (41/116) ======================= q-point: (-0.50 0.29 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.767 ( -6.354 14.228 10.137) 18.589 1.890 ( -9.947 9.718 8.612) 16.357 2.210 ( 4.302 13.030 12.807) 18.770 2.515 ( 8.586 2.218 -2.141) 9.122 2.679 ( -7.039 2.450 3.894) 8.409 2.770 ( 3.606 -4.217 -1.360) 5.713 2.941 ( 0.008 -4.169 3.784) 5.631 3.103 ( -0.096 -7.643 4.098) 8.673 3.160 ( 0.835 -4.398 -3.430) 5.639 3.398 ( -0.204 -4.789 -7.303) 8.735 3.492 ( -0.080 2.633 -0.450) 2.673 3.591 ( -0.556 1.073 -1.955) 2.298 3.676 ( -1.594 2.429 2.993) 4.172 3.792 ( 4.846 1.902 0.376) 5.219 4.067 ( -4.755 -1.058 5.272) 7.178 4.160 ( 2.488 -3.467 1.642) 4.572 4.427 ( 0.593 8.912 -3.049) 9.437 4.489 ( -0.058 6.997 -4.655) 8.404 4.620 ( 0.962 8.823 0.197) 8.878 4.786 ( 0.980 -3.307 -1.916) 3.945 4.963 ( -1.184 -3.197 -4.330) 5.511 5.163 ( -1.501 0.259 -2.023) 2.533 5.463 ( -2.862 1.868 2.611) 4.301 5.662 ( -2.743 -0.100 -1.216) 3.002 5.831 ( -0.965 -3.046 -3.100) 4.452 5.975 ( 4.975 -1.553 0.427) 5.230 6.119 ( 1.554 -2.604 -2.110) 3.694 6.238 ( -1.000 0.203 1.382) 1.718 6.296 ( 3.633 -5.512 -0.420) 6.615 6.546 ( -1.077 -4.299 -0.690) 4.486 6.781 ( 0.068 5.002 -5.353) 7.327 6.944 ( -2.749 2.549 -1.801) 4.159 7.245 ( 3.212 -0.527 0.878) 3.371 7.476 ( -2.770 -9.261 2.344) 9.946 7.642 ( -0.387 0.489 -7.379) 7.405 7.879 ( -1.126 -2.949 0.975) 3.304 8.290 ( 1.874 1.546 -2.530) 3.507 8.402 ( 0.499 5.234 1.181) 5.388 8.717 ( 1.217 -2.446 1.923) 3.341 8.873 ( -0.896 -2.640 -2.245) 3.579 9.540 ( 0.999 8.325 3.787) 9.200 9.664 ( -1.417 2.981 6.721) 7.488 10.278 ( -0.958 4.586 -1.703) 4.985 10.408 ( -0.744 -4.701 0.883) 4.841 10.537 ( 3.930 1.324 -2.656) 4.925 10.738 ( -0.988 1.386 -1.628) 2.356 10.811 ( 2.256 12.192 -2.397) 12.629 11.040 ( 1.711 5.532 -3.109) 6.572 11.902 ( -2.527 3.932 2.326) 5.221 12.250 ( -2.599 3.220 7.654) 8.701 12.417 ( -1.169 -9.371 -1.738) 9.602 12.697 ( -1.303 -5.993 0.723) 6.176 12.917 ( 2.209 2.392 2.117) 3.883 13.064 ( -1.920 -3.883 0.352) 4.346 13.352 ( -0.169 4.470 4.035) 6.024 13.518 ( -1.332 -0.508 -0.101) 1.429 13.853 ( 1.234 2.222 2.321) 3.442 14.530 ( 1.664 -6.796 -1.998) 7.276 14.610 ( -2.263 -0.843 0.420) 2.451 15.210 ( 0.721 -6.798 -4.703) 8.298 18.844 ( -0.694 9.726 1.467) 9.860 19.192 ( 3.573 4.366 -4.046) 6.943 19.534 ( -4.280 -6.747 6.679) 10.414 20.006 ( 0.803 -11.620 -0.183) 11.649 21.463 ( -1.755 9.172 1.661) 9.485 22.166 ( 2.091 -3.274 -1.737) 4.255 22.283 ( -2.545 7.920 -1.760) 8.503 23.391 ( 6.423 -14.674 -6.884) 17.435 23.636 ( -1.734 2.951 2.063) 3.996 23.953 ( -1.958 -4.291 -3.976) 6.169 24.262 ( 3.814 5.546 4.087) 7.874 24.703 ( 1.687 -2.839 -2.634) 4.224 ======================= Grid point 84 (42/116) ======================= q-point: (-0.38 0.29 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.627 ( -11.736 12.306 11.500) 20.528 1.748 ( -5.694 16.876 5.544) 18.654 2.313 ( 0.595 9.408 11.512) 14.879 2.474 ( -5.249 7.820 -0.544) 9.434 2.692 ( -1.165 -1.020 3.392) 3.729 2.826 ( 1.096 -5.139 2.739) 5.925 2.942 ( -0.844 -6.156 1.647) 6.428 3.088 ( -2.150 -6.773 3.849) 8.082 3.136 ( -1.790 -5.042 -1.205) 5.484 3.351 ( -4.327 -4.192 -5.013) 7.838 3.425 ( -6.875 7.895 1.411) 10.563 3.549 ( -1.448 0.157 -1.122) 1.839 3.633 ( -1.709 -1.493 -1.523) 2.733 3.857 ( 3.098 2.087 -1.407) 3.992 3.974 ( -5.418 1.244 6.801) 8.783 4.216 ( 1.584 0.306 1.551) 2.238 4.398 ( -3.687 6.636 -8.026) 11.047 4.473 ( 0.305 3.598 -0.517) 3.648 4.629 ( 0.937 9.387 1.395) 9.536 4.752 ( -4.378 -2.609 -5.600) 7.572 4.915 ( -0.699 -5.580 -3.512) 6.630 5.033 ( -10.145 -0.502 -1.159) 10.223 5.408 ( -2.748 2.422 0.281) 3.674 5.591 ( -3.601 0.478 -3.338) 4.933 5.833 ( 1.639 -1.481 0.533) 2.273 6.025 ( 0.141 -3.255 0.937) 3.390 6.126 ( 0.755 -1.233 -4.669) 4.888 6.241 ( 1.114 3.426 4.853) 6.044 6.399 ( 3.782 -6.494 0.827) 7.561 6.556 ( 1.942 -4.116 -4.997) 6.759 6.798 ( 2.419 1.204 -2.721) 3.834 6.896 ( -0.795 3.583 -4.061) 5.474 7.284 ( -0.150 -0.466 2.625) 2.670 7.443 ( -1.272 -10.697 0.660) 10.793 7.596 ( -1.563 -0.207 -7.572) 7.734 7.809 ( -6.122 -5.420 0.372) 8.185 8.328 ( 2.368 4.431 -3.048) 5.876 8.438 ( 2.557 5.271 2.321) 6.302 8.739 ( 0.529 -1.856 2.253) 2.967 8.842 ( -1.263 -2.771 -3.246) 4.451 9.558 ( -0.294 8.509 3.355) 9.151 9.641 ( -2.832 2.458 7.392) 8.289 10.252 ( -2.663 -0.169 -0.485) 2.712 10.346 ( -2.077 3.667 -1.912) 4.628 10.647 ( 5.570 -0.625 -2.545) 6.156 10.730 ( 1.243 1.016 -1.044) 1.916 10.822 ( -0.019 10.397 0.525) 10.411 11.113 ( 5.797 3.812 -3.335) 7.698 11.864 ( -2.094 3.593 2.379) 4.791 12.224 ( -2.520 2.912 7.894) 8.784 12.386 ( -1.470 -10.192 -2.208) 10.531 12.651 ( -2.896 -5.769 1.022) 6.536 12.975 ( 1.465 0.939 0.755) 1.896 13.049 ( 0.803 -1.425 0.837) 1.838 13.355 ( 0.708 4.147 3.252) 5.317 13.552 ( 4.590 -0.598 -0.168) 4.631 13.914 ( 3.734 1.969 3.370) 5.402 14.514 ( -2.984 -9.759 -1.448) 10.307 14.541 ( -4.479 3.952 -0.861) 6.035 15.179 ( -2.566 -7.114 -4.808) 8.962 18.913 ( 7.662 11.137 0.614) 13.532 19.269 ( 4.919 6.892 -2.098) 8.723 19.512 ( 0.501 -6.655 4.752) 8.192 20.054 ( 3.773 -10.217 0.430) 10.900 21.430 ( -1.640 7.511 0.143) 7.689 22.093 ( -8.930 -9.199 1.871) 12.956 22.246 ( -0.371 14.656 -6.594) 16.075 23.348 ( -8.667 -13.714 -2.887) 16.478 23.663 ( 3.327 1.349 0.542) 3.630 23.889 ( -3.191 -2.171 -2.997) 4.886 24.335 ( 1.939 1.996 3.644) 4.585 24.701 ( -1.177 -5.179 -1.245) 5.455 ======================= Grid point 85 (43/116) ======================= q-point: (-0.25 0.29 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.441 ( -10.766 15.360 15.242) 24.169 1.643 ( -8.433 19.610 5.661) 22.084 2.283 ( -4.496 4.815 9.208) 11.322 2.380 ( -14.933 13.205 6.332) 20.916 2.488 ( -12.257 1.906 -3.443) 12.873 2.759 ( -9.140 -11.573 3.422) 15.139 2.932 ( -0.035 -6.297 -0.634) 6.329 3.084 ( 0.726 -2.745 6.444) 7.042 3.153 ( 3.278 1.822 1.025) 3.888 3.187 ( -8.318 -1.824 -0.147) 8.517 3.356 ( -2.596 2.162 -3.572) 4.917 3.499 ( -2.230 0.277 1.786) 2.871 3.624 ( 1.510 -1.806 -1.106) 2.601 3.884 ( -3.755 2.652 4.782) 6.633 3.978 ( 7.986 1.432 -2.137) 8.390 4.214 ( -9.296 7.281 -2.858) 12.149 4.252 ( 0.945 2.472 -3.681) 4.533 4.510 ( 1.521 -0.693 -0.559) 1.763 4.569 ( -11.192 -1.307 -7.781) 13.693 4.688 ( 4.657 5.683 0.721) 7.383 4.864 ( -4.053 -6.034 -3.454) 8.048 4.949 ( 3.515 -1.772 0.275) 3.946 5.371 ( -0.740 3.158 -1.557) 3.597 5.496 ( -5.156 1.159 -4.218) 6.762 5.891 ( 3.203 -1.168 3.102) 4.609 6.008 ( -1.630 -2.646 2.981) 4.306 6.131 ( 0.233 3.052 -4.464) 5.413 6.256 ( -2.155 -0.080 2.822) 3.552 6.420 ( 0.941 -3.547 -1.683) 4.037 6.573 ( 1.015 -4.935 -7.794) 9.281 6.821 ( -0.179 -1.307 -0.880) 1.585 6.890 ( 0.253 3.473 -2.924) 4.548 7.241 ( -5.295 -2.124 3.119) 6.502 7.400 ( -3.701 -11.588 -0.792) 12.190 7.566 ( 0.521 -3.063 -6.671) 7.359 7.669 ( -7.225 -4.158 0.453) 8.349 8.349 ( 0.866 5.617 -3.389) 6.617 8.495 ( 2.050 4.009 1.668) 4.802 8.745 ( -1.140 -1.072 0.478) 1.636 8.816 ( 0.125 -3.359 -2.903) 4.442 9.540 ( -2.896 6.337 4.229) 8.150 9.619 ( -1.101 4.739 6.482) 8.105 10.165 ( -4.958 0.231 0.534) 4.992 10.362 ( 3.780 6.070 -4.882) 8.658 10.679 ( 0.289 5.459 -2.767) 6.127 10.764 ( 0.857 2.769 -3.460) 4.513 10.891 ( 6.707 -1.087 5.429) 8.697 11.185 ( 1.521 -0.770 -4.577) 4.884 11.856 ( 1.032 3.395 6.355) 7.279 12.195 ( -3.455 2.469 9.721) 10.608 12.354 ( -0.931 -10.455 -1.299) 10.577 12.611 ( -1.363 -6.167 1.171) 6.424 12.975 ( -0.363 1.795 -1.304) 2.248 13.062 ( -1.202 -0.785 1.542) 2.107 13.450 ( 8.523 4.696 3.148) 10.227 13.673 ( 7.522 -1.162 -0.338) 7.619 13.999 ( 3.654 0.695 3.305) 4.976 14.392 ( -9.154 -11.958 2.859) 15.329 14.451 ( -4.123 9.584 -5.388) 11.742 15.074 ( -6.937 -7.849 -5.180) 11.686 19.125 ( 11.693 10.616 0.804) 15.813 19.382 ( 10.259 14.349 -2.163) 17.771 19.577 ( 4.172 -6.185 3.164) 8.104 20.141 ( 5.114 -4.666 -0.150) 6.924 21.420 ( 1.331 3.831 -1.333) 4.269 21.903 ( -9.829 -6.673 -0.705) 11.901 22.190 ( -3.847 10.853 -5.118) 12.601 23.075 ( -18.993 -13.397 -2.911) 23.424 23.716 ( 0.935 -0.038 2.242) 2.430 23.826 ( -2.084 -1.996 -2.049) 3.539 24.352 ( -0.717 0.849 1.215) 1.647 24.648 ( -4.519 -7.984 1.035) 9.232 ======================= Grid point 86 (44/116) ======================= q-point: (-0.12 0.29 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.303 ( -10.264 17.790 15.194) 25.548 1.443 ( -12.385 20.581 10.694) 26.293 1.967 ( -19.250 22.218 10.732) 31.295 2.185 ( -10.595 9.338 -3.754) 14.613 2.352 ( -3.007 -2.300 8.472) 9.280 2.605 ( -5.859 -11.766 2.477) 13.375 2.874 ( -7.812 -6.797 0.326) 10.360 3.026 ( 0.058 -6.148 -5.535) 8.273 3.201 ( 4.787 3.193 4.614) 7.375 3.243 ( -2.818 -1.390 2.643) 4.106 3.272 ( 1.911 2.631 0.482) 3.288 3.516 ( 1.960 1.392 0.639) 2.487 3.703 ( 5.576 -0.568 2.248) 6.039 3.806 ( -3.434 2.708 0.329) 4.386 4.016 ( -5.916 5.370 -3.123) 8.578 4.138 ( -1.480 -0.486 -1.988) 2.526 4.279 ( 2.959 2.274 -4.569) 5.900 4.364 ( 2.110 4.040 -3.644) 5.835 4.565 ( 2.206 -1.154 -1.233) 2.778 4.774 ( -1.920 -6.705 -3.218) 7.681 4.785 ( -0.243 -1.084 -0.333) 1.160 5.068 ( 8.464 -2.480 -2.672) 9.216 5.360 ( -2.934 4.752 -0.671) 5.625 5.401 ( 0.621 2.486 -4.977) 5.598 5.910 ( -3.821 -5.397 1.771) 6.846 5.993 ( -2.208 1.596 5.093) 5.776 6.102 ( -0.275 3.154 -2.560) 4.071 6.222 ( 1.451 -0.108 -2.231) 2.664 6.463 ( 3.173 1.309 -4.578) 5.722 6.539 ( -2.698 -1.545 -2.964) 4.296 6.763 ( -3.413 -2.609 -3.640) 5.631 6.861 ( -4.024 1.190 -0.179) 4.200 7.118 ( -6.991 -3.776 3.049) 8.511 7.320 ( -3.742 -11.592 0.599) 12.196 7.511 ( -3.333 -1.871 -2.601) 4.623 7.628 ( 2.453 -5.031 -3.004) 6.352 8.349 ( 0.274 4.646 -2.964) 5.518 8.513 ( -0.394 3.196 0.129) 3.223 8.679 ( -4.744 -2.944 -2.436) 6.091 8.833 ( 1.483 -2.547 -1.383) 3.256 9.487 ( -3.648 4.750 5.563) 8.175 9.631 ( 0.100 6.720 4.754) 8.232 10.094 ( -2.379 3.451 0.491) 4.220 10.427 ( 4.369 5.180 -8.882) 11.172 10.674 ( 0.014 5.527 -2.663) 6.135 10.763 ( 0.523 4.444 -4.112) 6.077 11.024 ( 2.109 -4.850 4.580) 6.996 11.130 ( -2.966 -4.305 -4.232) 6.726 11.980 ( 8.292 0.766 14.200) 16.462 12.148 ( -4.425 0.801 11.098) 11.975 12.357 ( 1.302 -8.379 1.980) 8.707 12.604 ( 0.136 -6.748 0.059) 6.749 12.969 ( -0.377 2.727 1.784) 3.280 13.029 ( -1.166 -0.234 1.294) 1.758 13.672 ( 12.222 2.788 3.498) 13.015 13.793 ( 3.284 -1.216 -2.674) 4.406 14.061 ( 1.547 -0.641 2.800) 3.263 14.209 ( -9.649 -5.267 2.222) 11.215 14.375 ( -0.699 7.796 -4.512) 9.034 14.887 ( -10.067 -7.321 -5.568) 13.636 19.236 ( 0.370 8.273 3.020) 8.815 19.644 ( 1.559 -3.910 1.745) 4.557 19.776 ( 28.474 17.316 -9.022) 34.525 20.263 ( 9.037 2.372 -0.895) 9.386 21.490 ( 6.437 0.114 -2.206) 6.806 21.746 ( -4.828 -5.084 -3.613) 7.888 22.072 ( -6.831 5.914 -2.503) 9.375 22.577 ( -32.165 -11.215 -2.352) 34.145 23.698 ( -2.974 0.332 3.946) 4.952 23.814 ( 0.922 -2.136 -0.935) 2.507 24.333 ( -0.701 0.336 -0.487) 0.917 24.527 ( -8.143 -6.600 1.212) 10.552 ======================= Grid point 87 (45/116) ======================= q-point: ( 0.00 0.43 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.612 ( -0.300 20.441 5.357) 21.133 1.815 ( -0.206 19.290 14.900) 24.376 1.984 ( -1.809 -11.869 6.420) 13.615 2.159 ( -1.614 -7.212 4.202) 8.501 2.284 ( -1.073 6.890 -0.465) 6.989 2.466 ( 1.060 -2.691 4.183) 5.086 2.644 ( 0.991 2.826 2.585) 3.957 2.852 ( 1.291 -10.268 -0.971) 10.394 3.239 ( -4.266 4.874 2.305) 6.875 3.289 ( -0.934 -0.248 2.637) 2.809 3.428 ( 3.321 6.051 2.956) 7.509 3.549 ( -2.549 -1.301 0.784) 2.968 3.718 ( -5.496 2.656 -1.847) 6.378 3.790 ( -5.299 -4.341 -3.049) 7.497 4.008 ( 2.108 3.277 -1.449) 4.157 4.059 ( 4.460 -1.359 1.072) 4.784 4.381 ( 0.675 -0.010 -2.200) 2.301 4.461 ( -0.076 -6.144 -3.099) 6.882 4.559 ( 4.594 -0.784 -2.238) 5.170 4.587 ( 7.308 -1.886 -0.910) 7.602 4.843 ( -1.583 9.304 -3.723) 10.146 5.043 ( -0.656 -7.568 -5.897) 9.617 5.436 ( 2.798 4.855 -1.868) 5.906 5.504 ( 5.098 -1.009 -5.717) 7.726 5.727 ( -7.750 0.998 2.033) 8.074 5.816 ( -9.478 -4.885 0.601) 10.680 6.286 ( 5.803 5.760 1.952) 8.407 6.375 ( 4.353 -2.444 3.560) 6.132 6.500 ( -2.225 8.401 -5.182) 10.118 6.628 ( 5.747 2.597 -2.088) 6.643 6.672 ( -2.534 -7.290 -3.005) 8.283 6.690 ( 3.190 -2.922 -1.313) 4.521 7.008 ( -2.016 2.233 1.582) 3.399 7.104 ( -0.058 -6.588 1.725) 6.810 7.488 ( 1.782 1.569 -3.205) 3.988 7.556 ( 2.993 -4.934 -2.072) 6.132 8.426 ( -1.400 4.115 -3.376) 5.504 8.511 ( -2.649 -3.886 -3.164) 5.668 8.595 ( -0.357 6.184 0.981) 6.271 8.738 ( 0.358 -6.718 -0.158) 6.729 9.567 ( -1.723 6.076 6.006) 8.715 9.675 ( -1.397 -3.091 5.281) 6.277 10.269 ( 0.313 11.746 -1.113) 11.803 10.475 ( 1.498 -5.649 -6.551) 8.779 10.770 ( 0.854 4.204 -3.320) 5.425 10.815 ( 0.179 0.674 -4.974) 5.023 10.907 ( -4.199 2.419 3.899) 6.220 11.019 ( 0.146 -6.838 1.859) 7.088 12.112 ( 0.401 1.994 12.950) 13.109 12.189 ( -0.951 -1.824 6.603) 6.916 12.301 ( 3.435 2.135 2.874) 4.962 12.442 ( 0.477 -7.979 -0.611) 8.017 13.007 ( 0.344 2.109 2.678) 3.426 13.048 ( 1.927 -1.601 3.035) 3.936 13.774 ( -4.483 2.754 -2.385) 5.777 13.837 ( 0.218 -2.874 0.293) 2.897 14.057 ( -1.373 0.925 1.719) 2.387 14.082 ( -0.660 -1.207 1.920) 2.362 14.502 ( 1.962 4.846 -3.411) 6.243 14.614 ( 1.017 -5.784 -4.555) 7.432 19.393 ( -2.829 7.627 2.880) 8.630 19.531 ( -2.904 -5.483 3.832) 7.292 20.353 ( 5.527 7.844 -8.082) 12.546 20.470 ( 4.545 -3.585 -4.689) 7.450 21.649 ( 11.902 1.836 -6.574) 13.720 21.707 ( 12.673 -3.413 -6.897) 14.826 21.932 ( -16.468 0.993 2.085) 16.629 21.950 ( -13.274 -0.741 2.318) 13.495 23.712 ( -0.521 3.069 2.933) 4.277 23.778 ( 0.454 -3.045 1.610) 3.474 24.344 ( 0.557 0.470 -0.797) 1.080 24.359 ( -1.929 -0.873 -0.377) 2.151 ======================= Grid point 88 (46/116) ======================= q-point: ( 0.12 0.43 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.742 ( 10.052 16.450 5.714) 20.107 1.898 ( 3.164 15.665 16.050) 22.650 2.054 ( 6.443 -8.104 6.897) 12.440 2.219 ( 5.333 -11.239 3.532) 12.932 2.369 ( 9.573 11.716 -1.235) 15.180 2.587 ( 9.493 -5.516 3.954) 11.669 2.749 ( 7.456 3.996 2.570) 8.841 2.874 ( 0.181 -3.337 -0.310) 3.356 3.176 ( -1.690 3.399 2.077) 4.327 3.264 ( -0.343 -2.805 2.393) 3.703 3.444 ( -6.608 1.259 -0.640) 6.757 3.484 ( -2.312 -0.916 0.757) 2.599 3.593 ( -3.105 3.862 -2.004) 5.345 3.700 ( -0.643 -2.627 -2.824) 3.911 4.101 ( 4.508 3.327 -2.649) 6.198 4.185 ( 5.852 -3.106 -0.578) 6.650 4.305 ( -5.383 0.872 -1.386) 5.627 4.395 ( -0.510 -4.775 -2.255) 5.305 4.678 ( 4.068 3.242 1.279) 5.357 4.767 ( 6.906 -1.339 -0.351) 7.044 4.815 ( 1.708 6.450 -2.638) 7.175 4.973 ( -2.392 -4.385 -4.440) 6.683 5.503 ( 2.536 4.537 -0.870) 5.269 5.593 ( 5.176 -0.744 -8.133) 9.669 5.659 ( -0.852 -4.511 3.909) 6.029 5.661 ( -3.199 -2.749 -1.654) 4.530 6.258 ( -8.829 3.307 -2.006) 9.639 6.322 ( -3.927 -1.311 0.678) 4.195 6.530 ( -1.035 3.935 -0.886) 4.164 6.623 ( 4.297 -1.587 -1.312) 4.765 6.786 ( 4.846 -0.958 0.481) 4.963 6.815 ( 7.867 -1.826 0.229) 8.079 7.044 ( 5.074 2.973 -0.359) 5.891 7.154 ( 4.541 -7.498 1.115) 8.837 7.547 ( 5.158 2.991 -2.066) 6.310 7.631 ( 4.607 -4.871 -0.356) 6.714 8.402 ( -0.205 3.427 -4.536) 5.689 8.482 ( 0.541 -4.062 -5.443) 6.813 8.599 ( 0.689 6.828 1.409) 7.006 8.745 ( 0.624 -6.663 0.037) 6.692 9.568 ( 0.056 6.278 5.574) 8.396 9.672 ( -0.436 -2.509 4.787) 5.422 10.259 ( -0.738 10.134 -0.551) 10.176 10.464 ( -0.882 -7.581 -4.900) 9.070 10.746 ( -3.334 8.279 -3.955) 9.762 10.811 ( 2.876 4.519 -4.395) 6.929 10.878 ( -1.035 0.497 3.258) 3.454 11.010 ( -0.650 -8.128 -0.270) 8.158 12.117 ( -2.393 3.598 7.830) 8.943 12.204 ( 0.022 -3.999 7.076) 8.128 12.362 ( 1.085 0.504 6.845) 6.949 12.448 ( 0.467 -5.883 0.862) 5.964 13.042 ( 1.701 2.048 2.672) 3.772 13.098 ( 0.962 -2.827 3.702) 4.756 13.635 ( -7.625 5.097 -1.062) 9.233 13.750 ( -6.915 -5.643 -0.626) 8.948 14.029 ( -2.512 1.384 0.831) 2.986 14.071 ( -0.235 -2.534 0.135) 2.548 14.586 ( 6.962 6.233 -2.423) 9.654 14.725 ( 9.495 -7.020 -4.273) 12.557 19.323 ( -4.634 7.486 0.818) 8.842 19.456 ( -5.395 -4.839 1.373) 7.376 20.232 ( -16.716 6.006 -3.487) 18.101 20.315 ( -14.068 -2.058 -0.222) 14.220 21.697 ( -5.188 5.272 4.186) 8.499 21.815 ( -1.084 -5.343 3.493) 6.475 21.967 ( 18.499 4.054 -9.870) 21.355 22.084 ( 25.020 -6.517 -11.714) 28.385 23.721 ( 0.420 3.491 2.861) 4.533 23.795 ( 0.718 -3.425 1.964) 4.013 24.338 ( 0.501 2.974 -1.330) 3.297 24.392 ( 3.925 -2.118 -0.648) 4.507 ======================= Grid point 89 (47/116) ======================= q-point: ( 0.25 0.43 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.951 ( 7.470 10.478 11.755) 17.429 2.011 ( 3.707 8.415 12.573) 15.577 2.213 ( 6.489 0.395 7.428) 9.871 2.352 ( 8.173 -10.974 -0.268) 13.686 2.551 ( 4.944 13.223 -0.234) 14.119 2.745 ( 2.376 -5.112 2.449) 6.146 2.868 ( 4.260 1.833 2.096) 5.089 2.907 ( 5.776 -0.191 0.880) 5.846 3.181 ( -0.949 2.648 2.736) 3.924 3.301 ( -0.774 -6.827 1.311) 6.995 3.360 ( 2.549 3.384 -2.671) 5.008 3.442 ( 4.571 -4.223 -4.135) 7.471 3.611 ( 2.653 6.003 0.782) 6.610 3.710 ( 1.402 -1.157 0.100) 1.820 4.065 ( -4.000 1.590 -2.291) 4.876 4.155 ( -5.579 -5.721 -1.060) 8.061 4.388 ( 10.966 5.102 -1.471) 12.184 4.483 ( 7.978 -3.291 -2.896) 9.103 4.673 ( -1.121 5.190 -4.686) 7.082 4.777 ( -2.598 -4.023 -4.036) 6.263 4.924 ( 6.376 6.279 3.824) 9.731 5.004 ( 4.379 0.124 2.083) 4.851 5.525 ( -0.138 -0.474 2.215) 2.269 5.557 ( -1.083 -2.461 -1.471) 3.064 5.722 ( 6.915 0.132 -2.931) 7.511 5.747 ( 5.479 -3.052 -2.868) 6.896 6.105 ( -5.432 2.382 -4.285) 7.318 6.204 ( -5.994 -6.570 -3.989) 9.747 6.490 ( -4.015 7.555 2.684) 8.967 6.638 ( -3.201 -5.308 0.582) 6.225 6.865 ( 3.328 3.286 -0.368) 4.691 6.944 ( 5.402 -3.136 -0.163) 6.248 7.135 ( 3.499 3.508 -0.587) 4.990 7.257 ( 4.803 -8.237 0.447) 9.546 7.650 ( 4.901 3.231 -1.012) 5.957 7.721 ( 4.670 -3.369 0.634) 5.794 8.376 ( -1.199 4.037 -4.634) 6.262 8.466 ( -0.866 -3.525 -5.901) 6.928 8.642 ( 2.885 5.026 1.891) 6.096 8.766 ( 1.493 -5.963 0.145) 6.149 9.601 ( 1.617 6.274 5.252) 8.341 9.689 ( 0.657 -1.011 4.763) 4.913 10.253 ( 0.369 6.383 0.582) 6.420 10.414 ( -3.143 -7.522 -1.464) 8.283 10.673 ( -2.429 9.922 -3.721) 10.872 10.825 ( -3.250 -3.957 -0.684) 5.166 10.888 ( 4.222 7.888 -2.424) 9.270 11.027 ( 2.998 -4.981 -3.498) 6.785 12.087 ( -2.401 5.024 4.023) 6.869 12.215 ( -0.734 -7.117 4.313) 8.354 12.391 ( -0.011 2.416 7.425) 7.808 12.480 ( 2.148 -5.103 3.313) 6.452 13.054 ( -1.871 0.297 0.749) 2.037 13.074 ( -3.437 -1.023 1.013) 3.726 13.518 ( -4.544 5.804 2.561) 7.803 13.630 ( -5.291 -4.564 1.673) 7.185 13.973 ( -2.835 3.441 0.264) 4.466 14.096 ( 2.629 -8.404 0.069) 8.806 14.712 ( 6.075 8.073 -2.678) 10.452 14.889 ( 8.074 -8.666 -4.377) 12.627 19.227 ( -5.404 6.909 -0.352) 8.778 19.339 ( -6.456 -2.710 -1.188) 7.101 19.853 ( -18.274 7.664 2.869) 20.023 20.030 ( -14.598 -7.888 0.332) 16.596 21.673 ( 0.315 8.778 4.452) 9.848 21.859 ( 3.481 -8.102 4.102) 9.726 22.281 ( 16.187 9.611 -10.171) 21.397 22.525 ( 22.833 -12.801 -12.958) 29.208 23.736 ( 0.032 3.512 2.574) 4.354 23.817 ( 0.867 -4.148 2.145) 4.749 24.361 ( 2.097 6.584 -1.337) 7.038 24.480 ( 5.023 -4.503 -0.919) 6.808 ======================= Grid point 90 (48/116) ======================= q-point: ( 0.38 0.43 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.065 ( -1.593 5.748 11.059) 12.565 2.070 ( -0.909 5.203 16.232) 17.070 2.371 ( 9.146 4.959 -1.758) 10.551 2.507 ( 7.038 -1.702 -1.376) 7.370 2.547 ( -0.646 8.415 2.911) 8.928 2.753 ( -0.785 -5.034 2.166) 5.536 2.934 ( -1.078 1.872 5.999) 6.376 2.989 ( 0.042 -3.051 4.046) 5.067 3.138 ( -1.725 1.640 -1.081) 2.614 3.257 ( -1.691 -9.007 -1.020) 9.221 3.491 ( 7.034 2.703 -4.946) 9.013 3.540 ( 4.688 -2.051 -7.556) 9.126 3.711 ( 6.020 4.572 4.616) 8.857 3.750 ( 2.456 1.632 2.736) 4.022 4.025 ( 0.844 -1.134 -0.094) 1.416 4.067 ( -3.422 -5.275 0.251) 6.292 4.556 ( 5.597 5.174 -3.250) 8.286 4.613 ( 3.726 0.613 -4.865) 6.159 4.669 ( 3.993 4.461 -4.082) 7.247 4.737 ( 0.630 -1.732 -4.267) 4.648 5.001 ( 1.261 5.723 2.116) 6.231 5.108 ( 3.834 -2.412 2.882) 5.369 5.518 ( 0.289 2.230 1.914) 2.953 5.598 ( 2.836 -4.366 0.808) 5.269 5.809 ( 1.485 -0.401 -3.264) 3.608 5.835 ( 5.289 -1.801 -2.583) 6.155 6.046 ( 0.860 0.041 -4.229) 4.316 6.111 ( -1.503 -5.963 -3.705) 7.179 6.398 ( -5.584 6.293 2.955) 8.917 6.530 ( -7.078 -5.829 1.716) 9.328 6.906 ( 1.289 5.066 -2.796) 5.929 6.999 ( 0.193 -2.926 -2.003) 3.551 7.186 ( 2.528 3.550 0.276) 4.367 7.312 ( 0.617 -8.133 0.888) 8.205 7.709 ( 1.639 4.045 -1.952) 4.781 7.798 ( 2.446 -3.864 -0.200) 4.577 8.342 ( -0.386 4.446 -2.811) 5.275 8.433 ( -0.220 -2.847 -3.347) 4.399 8.691 ( 1.129 3.500 1.995) 4.184 8.792 ( 0.788 -5.163 -0.263) 5.230 9.654 ( 1.916 6.035 5.313) 8.265 9.718 ( 0.490 0.540 5.435) 5.484 10.277 ( 1.568 1.109 1.617) 2.511 10.346 ( -3.412 -4.159 0.233) 5.384 10.635 ( -0.578 6.973 -3.346) 7.756 10.754 ( -2.775 -3.632 -1.340) 4.764 10.973 ( 4.982 8.434 -4.074) 10.609 11.079 ( 2.998 -1.478 -4.369) 5.501 12.052 ( -2.127 5.987 1.758) 6.593 12.203 ( -1.362 -8.174 1.406) 8.405 12.407 ( -0.563 4.859 5.971) 7.719 12.534 ( 1.755 -6.618 3.668) 7.767 12.981 ( -3.209 1.973 -0.541) 3.806 13.027 ( -2.086 -2.426 0.473) 3.234 13.462 ( -2.555 5.035 3.435) 6.609 13.547 ( -4.231 -2.937 2.178) 5.592 13.940 ( -0.578 6.704 1.533) 6.901 14.157 ( 2.938 -13.595 1.928) 14.042 14.790 ( 2.954 9.708 -3.503) 10.735 14.995 ( 4.283 -9.486 -4.576) 11.370 19.115 ( -5.596 7.957 -0.115) 9.728 19.232 ( -3.142 -1.850 -3.058) 4.759 19.602 ( -9.218 5.487 5.167) 11.907 19.806 ( -8.090 -11.681 1.091) 14.251 21.699 ( 0.362 11.156 3.741) 11.772 21.935 ( 2.393 -10.642 3.747) 11.533 22.508 ( 10.077 15.022 -9.072) 20.236 22.854 ( 14.736 -16.931 -10.981) 24.988 23.735 ( -0.831 4.180 2.490) 4.936 23.836 ( 0.401 -5.333 1.904) 5.677 24.402 ( 2.165 8.901 -0.689) 9.186 24.562 ( 3.545 -6.097 -1.285) 7.169 ======================= Grid point 91 (49/116) ======================= q-point: (-0.50 0.43 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.998 ( -6.901 7.382 9.797) 14.075 2.050 ( -5.106 3.177 10.044) 11.706 2.486 ( 3.057 10.667 1.978) 11.271 2.604 ( 5.605 4.030 1.886) 7.156 2.668 ( 8.192 -2.124 -1.843) 8.661 2.742 ( -2.052 0.767 4.687) 5.173 2.868 ( -5.102 -1.693 6.205) 8.210 2.944 ( -5.226 -6.814 5.652) 10.281 3.110 ( -1.307 1.115 -2.021) 2.652 3.232 ( -0.819 -9.064 -2.450) 9.425 3.547 ( 1.314 2.719 -3.981) 4.997 3.589 ( 2.373 -0.751 -5.549) 6.081 3.771 ( -2.177 3.438 3.472) 5.349 3.808 ( 2.297 -0.634 0.809) 2.516 4.029 ( -0.904 -0.045 3.272) 3.395 4.083 ( 3.536 -3.753 2.169) 5.594 4.576 ( -0.777 4.553 -7.067) 8.443 4.601 ( -1.177 2.389 -7.832) 8.272 4.745 ( 2.462 2.324 -1.867) 3.866 4.763 ( 1.249 0.181 -1.513) 1.971 4.991 ( -3.183 5.967 0.202) 6.766 5.124 ( -3.148 -4.621 0.846) 5.655 5.518 ( -1.554 3.783 0.668) 4.144 5.615 ( -1.681 -4.313 -0.290) 4.638 5.813 ( 0.932 2.144 -2.841) 3.679 5.903 ( 2.413 -5.096 -1.486) 5.831 6.079 ( 3.373 0.965 -3.246) 4.780 6.154 ( 5.608 -5.439 -1.495) 7.955 6.329 ( -2.064 4.797 3.718) 6.411 6.436 ( -2.223 -5.368 2.864) 6.478 6.896 ( -0.836 4.982 -5.311) 7.330 6.963 ( -1.940 -0.987 -3.811) 4.389 7.234 ( 1.911 0.412 1.157) 2.271 7.301 ( -1.628 -6.142 1.520) 6.533 7.698 ( -1.666 4.054 -4.273) 6.122 7.795 ( -2.341 -4.715 -2.009) 5.634 8.366 ( 3.325 5.096 -0.613) 6.116 8.455 ( 2.957 -1.695 -0.819) 3.506 8.699 ( -0.617 2.263 2.225) 3.233 8.788 ( -0.961 -4.875 -0.750) 5.025 9.696 ( 0.598 5.269 5.656) 7.753 9.730 ( -1.191 1.911 6.194) 6.590 10.288 ( -2.350 -1.002 0.497) 2.602 10.313 ( 1.100 -3.539 1.603) 4.038 10.628 ( 1.040 5.762 -2.690) 6.443 10.725 ( 0.211 -2.767 -2.375) 3.653 11.036 ( 2.128 7.653 -3.417) 8.647 11.111 ( 2.035 0.447 -4.156) 4.649 12.013 ( -2.251 6.478 0.384) 6.869 12.174 ( -1.788 -8.438 -0.251) 8.629 12.399 ( -2.003 5.904 4.418) 7.641 12.547 ( -1.448 -7.575 2.339) 8.059 12.966 ( 1.357 2.115 1.086) 2.738 13.007 ( 0.085 -1.968 0.541) 2.043 13.433 ( -1.416 3.214 2.559) 4.346 13.489 ( -1.530 -2.047 0.916) 2.715 13.958 ( 1.422 8.252 3.636) 9.128 14.206 ( 1.031 -14.762 3.518) 15.210 14.805 ( -0.085 10.779 -4.333) 11.617 15.028 ( 0.581 -9.947 -4.777) 11.050 19.055 ( 0.241 9.461 0.003) 9.464 19.214 ( 2.341 -4.354 -3.192) 5.885 19.509 ( -2.582 6.239 5.453) 8.679 19.733 ( -0.202 -13.065 1.474) 13.150 21.692 ( -2.202 11.951 2.342) 12.376 21.950 ( -2.143 -12.093 2.713) 12.577 22.612 ( 3.353 18.259 -7.566) 20.047 23.017 ( 4.887 -19.406 -8.258) 21.648 23.725 ( -0.680 5.113 2.474) 5.721 23.839 ( -0.684 -5.518 1.542) 5.770 24.433 ( 0.992 8.704 0.177) 8.762 24.599 ( 0.581 -6.676 -1.397) 6.845 ======================= Grid point 92 (50/116) ======================= q-point: (-0.38 0.43 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.878 ( -7.936 10.259 9.202) 15.903 1.982 ( -4.060 2.760 7.465) 8.935 2.497 ( -6.143 7.927 6.171) 11.775 2.648 ( -3.234 -2.121 3.891) 5.486 2.682 ( -0.997 6.708 1.242) 6.895 2.744 ( -5.284 1.434 3.929) 6.738 2.842 ( -0.076 -4.054 1.136) 4.210 2.911 ( 3.002 -9.367 2.931) 10.264 3.089 ( 0.720 1.736 -1.096) 2.175 3.203 ( -1.184 -7.793 -3.416) 8.591 3.547 ( -0.715 2.213 -0.699) 2.428 3.575 ( -2.995 0.357 -1.655) 3.440 3.693 ( -4.877 7.145 1.924) 8.862 3.830 ( 0.035 -4.557 0.456) 4.580 4.024 ( -0.816 4.481 3.827) 5.949 4.149 ( 2.554 -5.852 2.032) 6.701 4.507 ( -3.897 3.269 -8.965) 10.308 4.529 ( -3.910 1.333 -6.072) 7.344 4.731 ( -3.994 1.027 -4.877) 6.387 4.755 ( -1.118 -0.421 -2.902) 3.138 4.896 ( -4.608 5.130 0.154) 6.897 5.002 ( -8.089 -3.252 0.913) 8.766 5.474 ( -2.231 3.953 -0.455) 4.562 5.561 ( -2.871 -3.402 -1.382) 4.661 5.840 ( 2.279 2.658 -0.137) 3.504 5.930 ( 1.011 -5.011 0.121) 5.114 6.151 ( 4.621 3.168 -3.677) 6.702 6.252 ( 4.398 -5.922 -0.460) 7.391 6.330 ( -0.540 4.281 3.517) 5.566 6.441 ( 0.839 -5.968 0.109) 6.028 6.863 ( -0.773 4.024 -3.910) 5.664 6.926 ( -0.369 -1.074 -4.658) 4.795 7.244 ( -2.151 -1.624 2.632) 3.767 7.275 ( -1.150 -4.611 -0.081) 4.753 7.634 ( -3.186 3.134 -5.293) 6.927 7.712 ( -4.963 -4.090 -2.756) 6.997 8.445 ( 4.238 6.000 -0.870) 7.397 8.521 ( 3.505 0.787 -0.429) 3.617 8.692 ( -0.669 -0.615 3.034) 3.168 8.754 ( -2.277 -4.785 -1.175) 5.428 9.699 ( -2.580 4.139 6.359) 8.014 9.721 ( -1.128 2.818 6.352) 7.040 10.248 ( -1.752 2.111 0.298) 2.760 10.341 ( 1.782 -4.650 -0.194) 4.984 10.666 ( 3.473 3.721 -2.094) 5.504 10.737 ( 1.604 -1.748 -2.290) 3.297 11.025 ( -1.991 7.955 -1.717) 8.378 11.135 ( 1.077 -2.125 -3.354) 4.114 11.972 ( -1.854 6.590 0.272) 6.851 12.140 ( -1.300 -9.023 -0.582) 9.135 12.358 ( -3.376 5.954 4.046) 7.951 12.506 ( -3.029 -7.424 2.010) 8.267 13.005 ( 1.576 1.598 0.200) 2.254 13.032 ( 1.818 -0.831 1.083) 2.273 13.439 ( 2.112 3.783 2.113) 4.821 13.512 ( 3.594 -2.928 0.865) 4.716 14.005 ( 1.893 7.032 4.510) 8.565 14.214 ( -1.391 -12.533 4.223) 13.298 14.762 ( -2.997 10.982 -4.942) 12.410 14.989 ( -3.095 -10.284 -4.947) 11.824 19.135 ( 7.726 9.380 0.273) 12.155 19.303 ( 7.313 -6.042 -1.786) 9.653 19.529 ( 3.486 10.345 3.972) 11.617 19.796 ( 6.171 -13.358 0.893) 14.741 21.630 ( -4.381 10.850 0.538) 11.714 21.869 ( -6.497 -11.373 0.981) 13.134 22.593 ( -3.205 17.860 -5.889) 19.077 22.987 ( -5.839 -18.861 -5.538) 20.506 23.729 ( 0.211 4.171 2.203) 4.721 23.819 ( -1.839 -4.060 1.422) 4.679 24.436 ( -0.842 6.442 0.637) 6.528 24.577 ( -2.421 -6.479 -0.944) 6.981 ======================= Grid point 93 (51/116) ======================= q-point: (-0.25 0.43 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.768 ( -6.364 14.408 11.061) 19.246 1.936 ( -3.688 3.783 7.592) 9.250 2.295 ( -14.707 1.780 8.108) 16.888 2.490 ( -13.111 -12.751 4.619) 18.863 2.604 ( -9.494 8.055 -0.213) 12.452 2.655 ( -4.158 9.181 0.376) 10.085 2.822 ( -2.128 -3.000 -1.179) 3.862 2.947 ( -2.745 -9.126 0.232) 9.533 3.145 ( 4.029 1.011 2.753) 4.984 3.177 ( 0.670 -1.384 -0.381) 1.584 3.500 ( -3.815 5.215 0.576) 6.488 3.527 ( -0.370 2.098 4.566) 5.039 3.639 ( -0.411 5.263 2.000) 5.645 3.827 ( -1.067 -8.294 1.748) 8.543 4.044 ( 3.244 6.091 -0.814) 6.949 4.198 ( 1.868 -6.868 -1.891) 7.364 4.358 ( -7.916 5.900 -4.330) 10.781 4.453 ( -3.455 -3.155 -4.546) 6.523 4.574 ( -7.676 2.560 -7.619) 11.114 4.678 ( -3.986 -6.425 -6.216) 9.788 4.860 ( 0.026 5.268 1.221) 5.408 4.937 ( 1.484 -1.453 0.294) 2.098 5.444 ( -0.446 3.455 -1.990) 4.012 5.501 ( -2.834 -1.294 -2.669) 4.102 5.895 ( 2.189 2.252 3.181) 4.470 5.959 ( 1.740 -2.765 3.959) 5.133 6.199 ( 0.564 2.960 -4.339) 5.283 6.258 ( -4.707 -1.250 -1.186) 5.012 6.356 ( 5.053 0.766 -0.322) 5.121 6.458 ( 2.495 -6.234 -5.396) 8.614 6.834 ( -2.417 2.809 -0.699) 3.771 6.906 ( -1.567 -2.451 -2.078) 3.575 7.180 ( -4.913 -1.134 2.409) 5.588 7.226 ( -4.166 -4.987 -0.207) 6.501 7.555 ( -3.018 1.683 -5.484) 6.482 7.607 ( -4.509 -2.692 -2.990) 6.043 8.493 ( 1.051 7.378 -3.708) 8.324 8.571 ( 1.619 2.321 -0.025) 2.830 8.693 ( -3.607 -3.629 0.508) 5.142 8.703 ( 0.633 -5.126 1.908) 5.506 9.652 ( -3.956 4.853 6.734) 9.195 9.713 ( -1.780 0.616 6.258) 6.535 10.232 ( 0.257 6.934 -0.407) 6.951 10.388 ( 3.415 -4.809 -2.533) 6.419 10.735 ( 3.715 1.346 -2.328) 4.586 10.768 ( 2.126 -0.401 -1.866) 2.857 10.976 ( -2.126 6.549 0.787) 6.930 11.112 ( -2.762 -5.603 -2.510) 6.733 11.963 ( 0.953 6.701 3.142) 7.462 12.133 ( 0.760 -9.140 1.337) 9.269 12.302 ( -3.367 6.348 3.595) 8.035 12.458 ( -2.242 -7.805 1.645) 8.285 13.021 ( 0.261 2.084 -0.486) 2.156 13.051 ( -0.492 -0.710 0.732) 1.132 13.543 ( 7.779 4.143 2.585) 9.185 13.624 ( 7.248 -3.308 1.195) 8.056 14.049 ( 1.098 4.227 3.922) 5.870 14.180 ( -3.294 -8.127 3.844) 9.575 14.663 ( -5.471 10.200 -5.118) 12.656 14.879 ( -6.749 -10.061 -5.019) 13.114 19.307 ( 7.732 7.253 2.571) 10.909 19.446 ( 6.237 -6.113 2.485) 9.080 19.701 ( 15.332 14.501 -2.247) 21.222 19.973 ( 12.418 -10.838 -1.932) 16.595 21.548 ( -3.286 7.866 -1.364) 8.634 21.731 ( -7.008 -8.933 -1.212) 11.418 22.454 ( -9.719 13.795 -3.694) 17.275 22.763 ( -15.873 -15.210 -3.143) 22.208 23.738 ( -0.205 1.921 2.322) 3.021 23.784 ( -1.918 -2.105 1.292) 3.128 24.405 ( -2.327 3.941 0.278) 4.585 24.508 ( -4.297 -5.646 -0.092) 7.096 ======================= Grid point 94 (52/116) ======================= q-point: (-0.12 0.43 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.688 ( -6.479 17.702 10.845) 21.747 1.849 ( -7.123 15.412 8.696) 19.076 2.070 ( -9.208 -8.647 8.760) 15.372 2.263 ( -10.062 -14.039 3.460) 17.616 2.406 ( -9.940 10.360 -0.980) 14.391 2.522 ( -7.320 7.203 3.182) 10.751 2.718 ( -7.812 -3.833 0.370) 8.710 2.860 ( -2.130 -9.287 -2.944) 9.972 3.239 ( 3.498 0.992 4.962) 6.152 3.248 ( 4.132 0.747 3.273) 5.324 3.421 ( -3.715 9.654 0.253) 10.347 3.562 ( 0.818 -0.329 3.520) 3.628 3.719 ( 6.595 2.071 3.170) 7.604 3.793 ( -1.692 -3.957 0.767) 4.371 4.100 ( -2.115 -0.611 -2.309) 3.191 4.104 ( -8.027 1.648 -4.353) 9.279 4.304 ( 1.963 1.418 -3.426) 4.195 4.369 ( 3.925 -3.244 -3.714) 6.303 4.519 ( 1.228 0.032 -3.598) 3.802 4.606 ( -2.376 -7.360 -5.389) 9.427 4.867 ( -0.043 7.159 -0.881) 7.213 5.004 ( 4.763 -4.680 -2.959) 7.304 5.441 ( -1.624 1.836 -3.804) 4.525 5.449 ( 1.667 1.441 -3.111) 3.812 5.878 ( -6.499 2.828 4.434) 8.360 5.970 ( -5.083 -3.861 4.825) 8.001 6.184 ( 2.555 3.719 -3.770) 5.880 6.226 ( 5.014 -0.149 -1.903) 5.365 6.476 ( 7.646 0.641 -3.568) 8.462 6.515 ( 4.232 -1.670 -4.344) 6.290 6.738 ( -6.908 1.615 -0.813) 7.140 6.822 ( -6.979 -4.591 -0.478) 8.367 7.083 ( -5.401 0.563 2.140) 5.837 7.140 ( -3.866 -5.114 1.106) 6.506 7.495 ( -1.323 0.745 -4.385) 4.640 7.543 ( -0.867 -3.277 -3.353) 4.768 8.471 ( -1.679 6.234 -3.629) 7.406 8.579 ( -1.107 -1.053 -3.474) 3.795 8.614 ( -3.618 1.163 2.985) 4.833 8.726 ( 0.818 -6.239 0.835) 6.348 9.599 ( -3.399 5.598 6.455) 9.195 9.693 ( -2.056 -2.014 5.859) 6.528 10.251 ( 1.585 10.839 -0.990) 10.999 10.445 ( 3.323 -4.923 -5.037) 7.787 10.769 ( 0.798 3.108 -3.550) 4.785 10.802 ( 1.762 -0.040 -2.006) 2.670 10.967 ( -0.481 0.349 3.450) 3.501 11.029 ( -3.886 -4.636 -1.240) 6.175 12.031 ( 3.543 4.796 9.376) 11.112 12.171 ( 1.414 -7.634 5.845) 9.718 12.262 ( -0.920 7.084 1.141) 7.234 12.437 ( -0.207 -8.591 0.156) 8.595 13.016 ( -1.076 1.480 1.482) 2.354 13.030 ( -0.825 -0.013 0.689) 1.075 13.725 ( 9.094 2.152 2.353) 9.636 13.764 ( 5.618 -1.572 -0.046) 5.834 14.066 ( -0.238 1.379 2.754) 3.089 14.119 ( -3.628 -3.420 2.468) 5.564 14.542 ( -4.589 7.985 -4.590) 10.291 14.715 ( -7.812 -8.397 -4.893) 12.469 19.402 ( 1.161 7.091 4.224) 8.335 19.534 ( 1.477 -5.586 4.799) 7.511 20.081 ( 22.738 10.917 -8.357) 26.571 20.243 ( 15.542 -4.364 -4.667) 16.804 21.528 ( 2.697 3.516 -3.212) 5.473 21.628 ( -1.734 -5.613 -3.671) 6.927 22.208 ( -14.426 7.023 -0.803) 16.065 22.371 ( -23.444 -8.483 -0.431) 24.936 23.725 ( -1.610 1.886 2.836) 3.767 23.769 ( -0.051 -2.148 1.185) 2.454 24.360 ( -1.938 2.155 -0.393) 2.925 24.423 ( -4.248 -3.781 0.190) 5.691 ======================= Grid point 119 (53/116) ======================= q-point: ( 0.00 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.811 ( -7.655 0.000 18.093) 19.646 1.048 ( -1.489 0.000 23.485) 23.532 1.725 ( 7.696 0.000 -7.697) 10.885 1.900 ( -1.055 0.000 41.365) 41.379 2.350 ( 1.497 0.000 -9.595) 9.711 2.799 ( -4.680 0.000 1.423) 4.892 2.911 ( -1.608 0.000 4.902) 5.159 3.153 ( 2.533 0.000 0.210) 2.541 3.154 ( -4.370 0.000 -2.058) 4.831 3.221 ( -1.797 0.000 4.685) 5.018 3.466 ( -6.916 0.000 4.452) 8.225 3.625 ( -6.227 0.000 -1.655) 6.443 3.662 ( 3.294 0.000 -4.955) 5.950 3.746 ( 1.115 0.000 0.038) 1.116 3.854 ( 2.800 0.000 0.839) 2.923 4.032 ( -9.388 0.000 -1.304) 9.478 4.211 ( 16.966 0.000 2.473) 17.146 4.263 ( -1.461 0.000 -1.030) 1.788 4.356 ( 14.519 0.000 -1.578) 14.604 4.678 ( -1.564 0.000 -7.297) 7.463 4.789 ( -11.653 0.000 2.649) 11.950 5.087 ( -1.662 0.000 -6.670) 6.873 5.300 ( 3.891 0.000 -0.149) 3.894 5.472 ( 7.305 0.000 -0.468) 7.320 5.910 ( -1.265 0.000 -2.323) 2.645 6.022 ( 5.786 0.000 -3.566) 6.796 6.100 ( -3.347 0.000 2.906) 4.432 6.111 ( -0.913 0.000 -1.544) 1.794 6.399 ( -3.549 0.000 -0.472) 3.580 6.519 ( 3.089 0.000 -3.216) 4.459 6.561 ( -5.967 0.000 3.900) 7.129 6.791 ( 7.852 0.000 -3.151) 8.460 7.275 ( -0.808 0.000 3.099) 3.203 7.485 ( -9.674 0.000 -2.721) 10.049 7.797 ( -0.468 0.000 6.939) 6.955 7.967 ( 0.462 0.000 1.929) 1.983 8.201 ( -0.915 0.000 0.569) 1.077 8.285 ( 0.499 0.000 -0.665) 0.831 8.477 ( -1.044 0.000 -5.893) 5.985 8.551 ( 1.713 0.000 -5.807) 6.055 9.429 ( 1.431 0.000 0.889) 1.685 9.561 ( -6.432 0.000 5.015) 8.157 9.726 ( 0.092 0.000 -6.604) 6.604 9.935 ( -0.479 0.000 -4.811) 4.835 10.481 ( 0.151 0.000 1.774) 1.780 10.587 ( 1.164 0.000 -2.055) 2.362 11.103 ( -4.054 0.000 2.294) 4.658 11.243 ( 1.551 0.000 -1.321) 2.037 12.139 ( -1.906 0.000 7.981) 8.205 12.500 ( 0.048 0.000 -3.189) 3.190 12.778 ( -3.630 0.000 1.214) 3.827 12.803 ( 0.455 0.000 2.232) 2.278 13.177 ( 0.719 0.000 6.525) 6.564 13.577 ( -9.842 0.000 -6.535) 11.814 13.956 ( 12.503 0.000 2.678) 12.787 14.020 ( -21.100 0.000 0.435) 21.104 14.082 ( 2.594 0.000 -0.659) 2.677 14.185 ( 14.409 0.000 -2.401) 14.607 14.385 ( -20.381 0.000 2.140) 20.493 14.528 ( 45.591 0.000 -1.292) 45.609 18.838 ( 2.711 0.000 3.195) 4.190 18.971 ( -3.701 0.000 -0.572) 3.745 19.967 ( -9.027 0.000 5.986) 10.832 20.452 ( 26.912 0.000 -6.913) 27.785 21.625 ( -6.252 0.000 1.479) 6.425 21.743 ( -5.194 0.000 -3.313) 6.161 21.840 ( 14.179 0.000 0.021) 14.179 21.974 ( -25.158 0.000 -2.228) 25.257 23.775 ( -0.882 0.000 0.675) 1.111 23.834 ( 1.510 0.000 -1.772) 2.328 24.291 ( -19.567 0.000 2.196) 19.690 24.360 ( 3.320 0.000 -0.454) 3.351 ======================= Grid point 120 (54/116) ======================= q-point: ( 0.12 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.183 ( 7.809 0.000 21.186) 22.580 1.222 ( 34.847 0.000 8.990) 35.988 2.041 ( 24.706 0.000 -4.956) 25.198 2.050 ( 3.419 0.000 37.302) 37.458 2.353 ( 2.068 0.000 -8.475) 8.724 2.810 ( 4.961 0.000 0.177) 4.964 2.952 ( 1.640 0.000 9.877) 10.012 2.991 ( -13.457 0.000 -0.464) 13.465 3.167 ( -3.797 0.000 1.372) 4.037 3.227 ( 4.267 0.000 -4.619) 6.288 3.339 ( -4.024 0.000 6.309) 7.483 3.499 ( -2.645 0.000 1.542) 3.062 3.680 ( -5.949 0.000 0.251) 5.954 3.711 ( 4.072 0.000 -5.341) 6.716 3.870 ( -5.636 0.000 -0.340) 5.646 3.998 ( 4.123 0.000 -3.776) 5.591 4.291 ( 8.841 0.000 -1.707) 9.004 4.419 ( 3.404 0.000 1.981) 3.939 4.478 ( -8.623 0.000 3.311) 9.237 4.641 ( -0.772 0.000 -5.857) 5.908 4.699 ( 8.114 0.000 -0.832) 8.157 5.021 ( -2.702 0.000 -4.508) 5.256 5.402 ( 6.946 0.000 -2.580) 7.410 5.597 ( 6.504 0.000 -3.116) 7.212 5.907 ( -2.202 0.000 2.180) 3.099 6.061 ( -3.223 0.000 -1.178) 3.431 6.074 ( 0.174 0.000 -1.659) 1.668 6.183 ( 10.045 0.000 0.009) 10.045 6.320 ( -3.681 0.000 -2.802) 4.626 6.579 ( 2.863 0.000 -3.572) 4.578 6.648 ( 13.416 0.000 -8.343) 15.799 6.926 ( 5.192 0.000 -3.047) 6.020 7.237 ( -3.317 0.000 4.406) 5.515 7.333 ( -4.942 0.000 0.596) 4.978 7.874 ( 5.547 0.000 6.438) 8.498 7.996 ( 0.594 0.000 2.326) 2.401 8.153 ( -3.577 0.000 1.670) 3.948 8.323 ( 2.984 0.000 -0.001) 2.984 8.449 ( 0.888 0.000 -6.180) 6.244 8.616 ( 6.511 0.000 -7.097) 9.631 9.464 ( -0.118 0.000 4.951) 4.953 9.508 ( 0.429 0.000 5.136) 5.154 9.751 ( 4.610 0.000 -7.102) 8.467 9.922 ( 0.630 0.000 -4.323) 4.369 10.488 ( 0.151 0.000 1.620) 1.627 10.596 ( 0.432 0.000 -2.917) 2.949 11.012 ( -5.970 0.000 2.888) 6.632 11.228 ( -2.945 0.000 -0.897) 3.078 12.112 ( -3.102 0.000 7.959) 8.543 12.514 ( 2.480 0.000 -2.437) 3.477 12.695 ( -6.674 0.000 6.750) 9.492 12.812 ( -0.220 0.000 1.258) 1.277 13.209 ( -0.400 0.000 8.356) 8.365 13.344 ( -12.123 0.000 -4.144) 12.812 13.626 ( -14.811 0.000 3.416) 15.200 13.933 ( -17.613 0.000 -0.448) 17.618 14.050 ( -4.267 0.000 -0.785) 4.338 14.188 ( 4.322 0.000 1.085) 4.456 14.508 ( 17.514 0.000 -3.315) 17.825 15.196 ( 20.514 0.000 -12.543) 24.045 18.865 ( -1.403 0.000 4.985) 5.179 18.916 ( -1.446 0.000 -1.997) 2.465 19.874 ( -1.254 0.000 1.317) 1.818 20.597 ( -12.179 0.000 3.763) 12.747 21.507 ( -5.696 0.000 0.857) 5.760 21.661 ( 6.491 0.000 -12.515) 14.099 22.084 ( 28.729 0.000 -11.608) 30.985 22.156 ( 16.262 0.000 6.000) 17.334 23.761 ( -0.748 0.000 -0.107) 0.755 23.837 ( -1.883 0.000 1.375) 2.332 24.057 ( -4.839 0.000 6.573) 8.162 24.434 ( 3.833 0.000 1.138) 3.998 ======================= Grid point 121 (55/116) ======================= q-point: ( 0.25 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.423 ( 9.532 0.000 16.862) 19.369 1.866 ( 24.449 0.000 7.469) 25.564 2.207 ( 2.156 0.000 21.334) 21.442 2.386 ( 3.582 0.000 -3.861) 5.267 2.528 ( 23.990 0.000 -3.075) 24.186 2.697 ( -14.457 0.000 3.122) 14.791 2.962 ( 10.073 0.000 -1.216) 10.146 3.009 ( 2.539 0.000 14.350) 14.573 3.050 ( -9.107 0.000 -0.727) 9.136 3.240 ( 2.046 0.000 -3.560) 4.106 3.441 ( 7.722 0.000 3.413) 8.443 3.555 ( 6.270 0.000 1.822) 6.529 3.570 ( -3.373 0.000 1.458) 3.674 3.783 ( -1.639 0.000 0.109) 1.642 3.827 ( 7.453 0.000 -5.516) 9.272 4.047 ( 4.341 0.000 -4.469) 6.231 4.290 ( -9.259 0.000 4.190) 10.163 4.423 ( 0.013 0.000 -2.384) 2.384 4.442 ( -0.233 0.000 3.559) 3.567 4.684 ( 9.751 0.000 -6.060) 11.481 4.863 ( 7.518 0.000 -2.100) 7.806 4.964 ( -2.182 0.000 -3.261) 3.924 5.539 ( 7.265 0.000 -3.587) 8.102 5.710 ( 5.433 0.000 -2.204) 5.863 5.846 ( -4.169 0.000 7.900) 8.932 5.988 ( -3.582 0.000 -0.639) 3.639 6.064 ( -1.101 0.000 -2.583) 2.808 6.243 ( -2.353 0.000 -7.640) 7.994 6.361 ( 7.276 0.000 0.812) 7.321 6.575 ( -2.120 0.000 -4.831) 5.276 6.816 ( 4.509 0.000 -11.578) 12.425 6.925 ( -4.181 0.000 -3.335) 5.348 7.217 ( 0.263 0.000 4.373) 4.381 7.323 ( 3.849 0.000 -1.428) 4.105 7.982 ( -2.547 0.000 2.362) 3.473 7.990 ( 2.480 0.000 3.138) 4.000 8.110 ( -0.041 0.000 5.173) 5.173 8.380 ( 2.335 0.000 0.643) 2.422 8.491 ( 5.188 0.000 -5.255) 7.385 8.730 ( 6.934 0.000 -9.308) 11.607 9.456 ( -1.919 0.000 9.456) 9.649 9.587 ( 4.783 0.000 3.504) 5.929 9.855 ( 8.001 0.000 -6.908) 10.570 9.936 ( 2.227 0.000 -4.304) 4.846 10.500 ( 0.700 0.000 1.428) 1.590 10.584 ( -0.462 0.000 -4.192) 4.217 10.902 ( -5.910 0.000 2.755) 6.520 11.124 ( -7.516 0.000 -0.625) 7.542 12.073 ( -3.389 0.000 8.649) 9.289 12.564 ( -9.006 0.000 10.861) 14.109 12.580 ( 4.651 0.000 -2.271) 5.175 12.802 ( -0.666 0.000 0.182) 0.690 13.101 ( -11.613 0.000 -2.385) 11.856 13.202 ( -1.940 0.000 6.692) 6.967 13.488 ( -2.444 0.000 3.140) 3.979 13.628 ( -11.925 0.000 -1.001) 11.967 13.948 ( -5.404 0.000 -0.704) 5.449 14.262 ( 2.522 0.000 -1.973) 3.202 14.800 ( 13.251 0.000 -2.566) 13.497 15.339 ( 1.045 0.000 -7.441) 7.514 18.819 ( -4.631 0.000 6.062) 7.629 18.906 ( 1.208 0.000 -3.416) 3.623 19.923 ( 5.828 0.000 -1.828) 6.108 20.337 ( -14.130 0.000 10.010) 17.317 21.413 ( -4.370 0.000 1.046) 4.493 21.696 ( 1.727 0.000 -12.510) 12.629 22.464 ( 12.124 0.000 10.643) 16.133 22.705 ( 34.395 0.000 -23.577) 41.700 23.745 ( -0.651 0.000 -1.152) 1.323 23.799 ( -1.976 0.000 5.005) 5.381 24.099 ( 6.156 0.000 1.089) 6.252 24.499 ( 2.180 0.000 1.446) 2.616 ======================= Grid point 122 (56/116) ======================= q-point: ( 0.38 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.577 ( 0.191 0.000 13.643) 13.645 2.100 ( -2.959 0.000 8.262) 8.776 2.227 ( -2.444 0.000 15.272) 15.466 2.502 ( -4.333 0.000 -1.165) 4.487 2.526 ( 11.449 0.000 -3.112) 11.864 2.819 ( -7.429 0.000 -1.171) 7.521 2.939 ( 12.442 0.000 4.083) 13.095 3.140 ( 5.064 0.000 7.739) 9.249 3.169 ( 10.749 0.000 -0.323) 10.753 3.288 ( 3.233 0.000 -3.535) 4.790 3.523 ( -1.241 0.000 2.639) 2.917 3.583 ( 4.307 0.000 7.140) 8.339 3.718 ( -3.953 0.000 -0.751) 4.024 3.749 ( 10.153 0.000 2.049) 10.358 4.004 ( 9.130 0.000 -1.788) 9.304 4.132 ( 4.473 0.000 -2.490) 5.119 4.175 ( -3.054 0.000 1.424) 3.369 4.357 ( -3.497 0.000 -2.290) 4.180 4.448 ( -0.740 0.000 4.414) 4.476 4.872 ( 9.357 0.000 -7.456) 11.964 4.917 ( -1.395 0.000 -4.222) 4.447 4.978 ( 5.412 0.000 -3.738) 6.577 5.602 ( -1.159 0.000 0.860) 1.443 5.717 ( -5.632 0.000 0.134) 5.633 5.847 ( 2.144 0.000 3.968) 4.510 5.978 ( 3.785 0.000 -2.815) 4.717 6.023 ( -1.791 0.000 0.913) 2.010 6.201 ( 1.952 0.000 -11.178) 11.347 6.439 ( -0.674 0.000 -0.801) 1.047 6.491 ( -3.206 0.000 -4.702) 5.691 6.796 ( -6.589 0.000 -2.160) 6.934 6.804 ( -1.384 0.000 -4.332) 4.548 7.251 ( 1.342 0.000 3.021) 3.306 7.406 ( 4.179 0.000 -4.155) 5.893 7.944 ( -1.053 0.000 2.176) 2.418 7.981 ( -1.466 0.000 0.301) 1.497 8.171 ( 1.744 0.000 7.531) 7.731 8.411 ( 0.871 0.000 0.320) 0.928 8.592 ( 5.840 0.000 -4.902) 7.624 8.803 ( 3.250 0.000 -9.424) 9.969 9.451 ( -1.731 0.000 9.980) 10.129 9.688 ( 4.038 0.000 4.826) 6.293 9.940 ( 1.217 0.000 -2.034) 2.370 10.030 ( 9.786 0.000 -9.342) 13.529 10.526 ( 1.465 0.000 1.003) 1.775 10.564 ( 0.139 0.000 -4.902) 4.904 10.815 ( -3.654 0.000 2.273) 4.304 10.949 ( -9.671 0.000 -0.186) 9.673 12.038 ( -3.050 0.000 9.537) 10.013 12.443 ( -6.470 0.000 11.246) 12.975 12.636 ( 1.066 0.000 -4.603) 4.725 12.815 ( 1.752 0.000 0.672) 1.877 12.913 ( -5.745 0.000 -1.094) 5.849 13.190 ( -1.094 0.000 2.624) 2.843 13.471 ( -1.668 0.000 4.127) 4.452 13.478 ( -4.187 0.000 1.055) 4.318 13.862 ( -2.780 0.000 0.312) 2.798 14.271 ( -0.369 0.000 -4.309) 4.325 14.996 ( 7.850 0.000 -1.803) 8.055 15.282 ( -3.884 0.000 -4.341) 5.825 18.744 ( -4.592 0.000 5.717) 7.333 18.939 ( 3.334 0.000 -4.292) 5.435 20.058 ( 8.106 0.000 -2.148) 8.386 20.121 ( -11.554 0.000 8.951) 14.615 21.346 ( -2.897 0.000 0.950) 3.049 21.682 ( 0.846 0.000 -11.265) 11.296 22.649 ( 2.598 0.000 12.680) 12.944 23.188 ( 22.353 0.000 -17.890) 28.630 23.735 ( 0.330 0.000 -1.783) 1.813 23.783 ( -1.748 0.000 3.471) 3.887 24.270 ( 11.535 0.000 -2.883) 11.890 24.518 ( -0.651 0.000 0.291) 0.713 ======================= Grid point 123 (57/116) ======================= q-point: (-0.50 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.524 ( -7.975 0.000 12.495) 14.824 1.947 ( -12.692 0.000 14.398) 19.194 2.241 ( -0.416 0.000 5.710) 5.725 2.410 ( -7.858 0.000 -4.961) 9.293 2.738 ( 10.129 0.000 2.531) 10.440 2.742 ( 2.862 0.000 6.319) 6.937 3.201 ( 0.131 0.000 -1.608) 1.613 3.206 ( 12.707 0.000 0.904) 12.739 3.340 ( 3.061 0.000 -1.686) 3.495 3.351 ( 8.148 0.000 1.208) 8.237 3.509 ( -1.900 0.000 3.637) 4.104 3.570 ( -9.276 0.000 8.567) 12.627 3.638 ( -3.515 0.000 -1.981) 4.035 3.884 ( 1.247 0.000 2.772) 3.040 4.049 ( -3.444 0.000 2.791) 4.433 4.182 ( 1.081 0.000 -0.070) 1.084 4.212 ( 3.050 0.000 -2.216) 3.770 4.305 ( -0.907 0.000 -1.613) 1.851 4.425 ( -2.873 0.000 4.904) 5.684 4.869 ( -2.953 0.000 -7.181) 7.765 4.971 ( 3.178 0.000 -6.827) 7.531 5.040 ( 2.295 0.000 -6.204) 6.615 5.540 ( -5.382 0.000 6.109) 8.142 5.570 ( -7.477 0.000 -0.348) 7.485 5.844 ( -1.221 0.000 -3.739) 3.933 6.038 ( 1.771 0.000 -2.610) 3.154 6.087 ( 6.750 0.000 4.456) 8.088 6.296 ( 10.510 0.000 -7.284) 12.787 6.319 ( -7.608 0.000 -5.567) 9.427 6.461 ( -0.210 0.000 -4.287) 4.292 6.727 ( 0.484 0.000 -1.083) 1.186 6.757 ( -3.045 0.000 -0.880) 3.170 7.268 ( -0.749 0.000 2.697) 2.799 7.452 ( 2.572 0.000 -4.206) 4.931 7.971 ( 0.562 0.000 -0.293) 0.633 7.979 ( 4.037 0.000 1.702) 4.381 8.184 ( -2.740 0.000 7.038) 7.553 8.420 ( -0.026 0.000 0.286) 0.287 8.648 ( 0.771 0.000 -4.993) 5.052 8.801 ( -0.403 0.000 -8.022) 8.032 9.445 ( -1.872 0.000 8.764) 8.962 9.765 ( 2.629 0.000 4.694) 5.380 9.938 ( -0.384 0.000 -2.928) 2.953 10.175 ( 6.937 0.000 -8.550) 11.010 10.515 ( -4.433 0.000 -0.650) 4.480 10.568 ( 1.321 0.000 -3.392) 3.640 10.792 ( 1.460 0.000 1.310) 1.961 10.826 ( -0.520 0.000 0.942) 1.076 12.016 ( -2.304 0.000 10.724) 10.969 12.390 ( -2.397 0.000 11.104) 11.360 12.611 ( -1.083 0.000 -6.035) 6.131 12.785 ( -1.866 0.000 -1.541) 2.420 12.951 ( 5.508 0.000 3.061) 6.301 13.157 ( -2.971 0.000 -0.988) 3.132 13.427 ( -4.305 0.000 4.530) 6.249 13.452 ( 0.654 0.000 2.566) 2.648 13.862 ( 2.335 0.000 2.214) 3.218 14.232 ( -1.907 0.000 -5.897) 6.198 15.094 ( 2.830 0.000 -0.657) 2.905 15.186 ( -4.624 0.000 -4.182) 6.235 18.686 ( -2.819 0.000 4.763) 5.535 19.003 ( 4.451 0.000 -4.290) 6.182 19.942 ( -9.358 0.000 6.948) 11.655 20.200 ( 6.501 0.000 -0.139) 6.502 21.309 ( -1.053 0.000 0.349) 1.110 21.669 ( 1.236 0.000 -10.134) 10.209 22.621 ( -8.964 0.000 10.840) 14.066 23.480 ( 12.731 0.000 -9.252) 15.737 23.729 ( -4.732 0.000 -0.405) 4.750 23.752 ( 1.724 0.000 -0.927) 1.958 24.478 ( -2.989 0.000 -1.609) 3.395 24.506 ( 13.605 0.000 -5.526) 14.685 ======================= Grid point 124 (58/116) ======================= q-point: (-0.38 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.394 ( -9.206 0.000 13.146) 16.049 1.752 ( -12.482 0.000 20.797) 24.255 2.213 ( -9.754 0.000 -3.145) 10.248 2.242 ( -0.703 0.000 1.712) 1.851 2.878 ( 7.004 0.000 6.271) 9.401 2.929 ( 8.174 0.000 3.343) 8.832 3.104 ( -14.972 0.000 2.391) 15.162 3.314 ( -10.206 0.000 -1.401) 10.302 3.356 ( -4.626 0.000 2.406) 5.214 3.401 ( 3.068 0.000 -4.097) 5.118 3.456 ( -0.357 0.000 4.210) 4.225 3.499 ( 5.193 0.000 4.086) 6.608 3.613 ( 2.377 0.000 -1.139) 2.636 3.787 ( -10.587 0.000 3.234) 11.070 3.976 ( -3.675 0.000 1.438) 3.947 4.137 ( -5.286 0.000 0.089) 5.286 4.145 ( -8.957 0.000 -3.298) 9.545 4.384 ( 9.674 0.000 -0.376) 9.681 4.389 ( -2.548 0.000 5.418) 5.987 4.723 ( -9.580 0.000 -10.373) 14.120 4.972 ( -0.535 0.000 -3.891) 3.928 5.034 ( 0.085 0.000 -7.091) 7.091 5.444 ( -6.421 0.000 6.911) 9.434 5.463 ( -3.830 0.000 -0.437) 3.855 5.873 ( 4.685 0.000 -0.608) 4.724 6.043 ( 0.564 0.000 -1.661) 1.754 6.162 ( -6.270 0.000 -6.369) 8.937 6.234 ( 6.239 0.000 4.586) 7.743 6.462 ( 1.939 0.000 -6.710) 6.985 6.486 ( 7.922 0.000 -6.894) 10.502 6.681 ( -3.205 0.000 1.467) 3.525 6.770 ( 3.140 0.000 -3.329) 4.576 7.237 ( -3.007 0.000 3.143) 4.350 7.505 ( 4.451 0.000 -4.518) 6.342 8.003 ( 2.585 0.000 -0.528) 2.638 8.092 ( 6.471 0.000 0.294) 6.478 8.115 ( -6.023 0.000 6.450) 8.825 8.407 ( -1.523 0.000 0.548) 1.618 8.590 ( -4.687 0.000 -4.163) 6.268 8.747 ( -2.730 0.000 -6.556) 7.102 9.432 ( -1.650 0.000 5.605) 5.843 9.821 ( 1.897 0.000 2.374) 3.039 9.913 ( -1.151 0.000 -3.802) 3.973 10.190 ( -3.973 0.000 -7.877) 8.822 10.425 ( -1.481 0.000 0.596) 1.596 10.573 ( -0.122 0.000 -1.632) 1.637 10.893 ( 8.094 0.000 1.162) 8.177 10.916 ( 7.508 0.000 -0.552) 7.529 12.018 ( -0.847 0.000 12.477) 12.506 12.425 ( 2.778 0.000 13.422) 13.707 12.575 ( -0.608 0.000 -6.057) 6.087 12.772 ( 0.104 0.000 0.407) 0.420 13.071 ( -4.948 0.000 -3.912) 6.308 13.088 ( 8.335 0.000 2.559) 8.719 13.341 ( -5.911 0.000 5.472) 8.055 13.510 ( 4.410 0.000 2.536) 5.088 13.949 ( 5.271 0.000 3.225) 6.179 14.167 ( -2.916 0.000 -6.541) 7.162 15.071 ( -6.318 0.000 -5.834) 8.600 15.099 ( -2.629 0.000 1.051) 2.831 18.668 ( -0.386 0.000 3.717) 3.737 19.073 ( 3.478 0.000 -2.972) 4.575 19.815 ( -5.029 0.000 4.278) 6.603 20.290 ( 1.856 0.000 3.702) 4.141 21.314 ( 1.833 0.000 -0.782) 1.993 21.671 ( 1.991 0.000 -9.013) 9.231 22.396 ( -16.003 0.000 6.519) 17.280 23.557 ( -9.648 0.000 0.962) 9.696 23.670 ( 6.331 0.000 -9.778) 11.648 23.783 ( 1.270 0.000 0.424) 1.339 24.405 ( -3.481 0.000 -3.129) 4.681 24.731 ( 10.984 0.000 -8.237) 13.729 ======================= Grid point 125 (59/116) ======================= q-point: (-0.25 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.244 ( -10.858 0.000 16.306) 19.590 1.592 ( -12.183 0.000 24.646) 27.493 2.021 ( -10.048 0.000 -3.736) 10.720 2.193 ( -8.284 0.000 4.053) 9.223 2.583 ( -28.712 0.000 7.751) 29.740 3.009 ( 4.038 0.000 4.911) 6.358 3.082 ( 2.528 0.000 6.264) 6.755 3.207 ( -8.398 0.000 -2.106) 8.658 3.250 ( -10.911 0.000 2.181) 11.127 3.308 ( 7.101 0.000 -5.463) 8.959 3.446 ( -8.094 0.000 0.004) 8.094 3.595 ( 0.806 0.000 2.697) 2.815 3.642 ( 0.158 0.000 -1.413) 1.422 3.687 ( 3.279 0.000 2.413) 4.071 3.910 ( -9.846 0.000 -5.795) 11.424 3.961 ( 1.118 0.000 2.223) 2.489 4.072 ( 0.134 0.000 2.975) 2.978 4.345 ( -3.862 0.000 4.067) 5.608 4.441 ( -13.779 0.000 -6.484) 15.228 4.625 ( 11.207 0.000 -3.437) 11.723 4.971 ( 3.098 0.000 -5.887) 6.652 5.021 ( -0.013 0.000 -4.992) 4.992 5.341 ( -5.977 0.000 5.941) 8.427 5.397 ( -3.371 0.000 0.904) 3.490 5.964 ( 3.375 0.000 1.217) 3.588 6.047 ( -3.316 0.000 -4.583) 5.656 6.068 ( 1.854 0.000 -2.805) 3.362 6.311 ( -1.580 0.000 2.191) 2.701 6.460 ( -3.713 0.000 -1.370) 3.958 6.485 ( 2.361 0.000 -7.391) 7.759 6.728 ( 4.020 0.000 -1.261) 4.213 6.773 ( -1.949 0.000 -6.066) 6.371 7.206 ( -0.367 0.000 4.068) 4.085 7.587 ( 4.967 0.000 -5.128) 7.140 7.972 ( -7.352 0.000 5.920) 9.440 8.094 ( 3.797 0.000 -0.174) 3.801 8.165 ( -0.843 0.000 -2.653) 2.784 8.367 ( -2.692 0.000 0.514) 2.740 8.492 ( -2.787 0.000 -1.382) 3.111 8.672 ( -2.675 0.000 -7.281) 7.757 9.418 ( -0.952 0.000 2.517) 2.691 9.827 ( -2.355 0.000 -1.145) 2.619 9.865 ( -2.815 0.000 -4.831) 5.591 10.053 ( -5.678 0.000 -6.011) 8.269 10.442 ( 1.503 0.000 0.976) 1.792 10.565 ( 0.048 0.000 -1.514) 1.515 11.061 ( 7.426 0.000 0.772) 7.466 11.063 ( 7.542 0.000 -1.761) 7.745 12.065 ( 1.607 0.000 12.962) 13.061 12.549 ( -0.534 0.000 -5.355) 5.381 12.631 ( 15.952 0.000 19.810) 25.435 12.776 ( -0.092 0.000 2.440) 2.442 12.956 ( -5.113 0.000 -4.912) 7.090 13.251 ( -4.860 0.000 7.570) 8.995 13.310 ( 14.351 0.000 1.313) 14.411 13.626 ( 6.588 0.000 0.478) 6.605 14.061 ( 4.854 0.000 3.026) 5.720 14.080 ( -4.117 0.000 -5.589) 6.942 14.882 ( -11.930 0.000 -8.148) 14.447 14.990 ( -9.491 0.000 2.900) 9.924 18.695 ( 2.147 0.000 2.857) 3.574 19.098 ( -0.645 0.000 -0.615) 0.891 19.805 ( 3.963 0.000 1.532) 4.249 20.278 ( -5.125 0.000 7.749) 9.290 21.385 ( 6.222 0.000 -1.651) 6.437 21.692 ( 2.822 0.000 -7.971) 8.455 22.091 ( -15.801 0.000 1.963) 15.922 23.262 ( -19.878 0.000 -6.797) 21.008 23.757 ( 4.193 0.000 -4.924) 6.467 23.797 ( -0.084 0.000 1.088) 1.091 24.341 ( -1.883 0.000 -3.430) 3.913 24.837 ( 1.941 0.000 -12.815) 12.961 ======================= Grid point 126 (60/116) ======================= q-point: (-0.12 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.095 ( -9.471 0.000 21.246) 23.262 1.277 ( -30.977 0.000 15.287) 34.544 1.795 ( -9.973 0.000 -6.899) 12.127 1.907 ( -14.889 0.000 34.526) 37.599 2.354 ( -0.681 0.000 -6.020) 6.058 2.956 ( -9.891 0.000 1.641) 10.026 3.011 ( -9.400 0.000 4.203) 10.297 3.122 ( 1.100 0.000 -0.815) 1.369 3.186 ( 2.411 0.000 5.882) 6.357 3.260 ( -7.637 0.000 -1.150) 7.723 3.484 ( 7.590 0.000 -1.510) 7.738 3.596 ( 1.966 0.000 3.912) 4.378 3.655 ( -4.825 0.000 0.643) 4.868 3.701 ( 3.827 0.000 -8.049) 8.913 3.877 ( 9.226 0.000 1.934) 9.426 4.035 ( -12.458 0.000 6.049) 13.849 4.085 ( 10.064 0.000 0.378) 10.071 4.246 ( 1.077 0.000 -4.373) 4.503 4.250 ( -6.712 0.000 0.385) 6.723 4.731 ( 0.183 0.000 -4.901) 4.905 4.966 ( -5.825 0.000 -1.074) 5.924 5.071 ( 6.945 0.000 -9.077) 11.429 5.272 ( -1.819 0.000 3.173) 3.657 5.364 ( 1.154 0.000 3.032) 3.245 5.979 ( -2.477 0.000 -0.045) 2.477 5.992 ( -0.537 0.000 -5.056) 5.085 6.102 ( 1.951 0.000 -2.109) 2.873 6.194 ( -7.106 0.000 0.069) 7.106 6.438 ( -0.926 0.000 1.757) 1.986 6.501 ( 1.051 0.000 -5.409) 5.510 6.714 ( 0.281 0.000 -5.309) 5.317 6.717 ( -5.841 0.000 -0.118) 5.842 7.244 ( 2.277 0.000 3.437) 4.122 7.626 ( -0.874 0.000 -6.152) 6.214 7.850 ( -6.398 0.000 6.712) 9.273 8.039 ( -8.393 0.000 -0.734) 8.425 8.169 ( 3.458 0.000 -0.554) 3.502 8.314 ( -2.646 0.000 0.085) 2.647 8.486 ( 1.145 0.000 -2.584) 2.826 8.596 ( -2.931 0.000 -7.989) 8.510 9.413 ( 0.011 0.000 0.993) 0.993 9.710 ( -8.549 0.000 -0.805) 8.587 9.781 ( -3.451 0.000 -5.979) 6.904 9.969 ( -1.748 0.000 -5.070) 5.362 10.468 ( 0.733 0.000 1.545) 1.710 10.570 ( 0.947 0.000 -1.681) 1.929 11.140 ( 0.402 0.000 0.717) 0.822 11.182 ( 5.148 0.000 -1.796) 5.453 12.127 ( 0.572 0.000 9.821) 9.837 12.521 ( -0.794 0.000 -4.183) 4.258 12.786 ( 0.350 0.000 2.788) 2.810 12.848 ( -3.664 0.000 -3.621) 5.151 13.133 ( 8.431 0.000 5.277) 9.946 13.359 ( 34.783 0.000 24.147) 42.343 13.634 ( 17.987 0.000 1.496) 18.049 13.710 ( 0.179 0.000 -5.673) 5.676 14.022 ( 1.903 0.000 -1.378) 2.349 14.143 ( 2.834 0.000 2.537) 3.804 14.542 ( -20.745 0.000 -7.693) 22.126 14.746 ( -16.798 0.000 3.674) 17.195 18.762 ( 3.731 0.000 2.503) 4.493 19.049 ( -3.906 0.000 0.269) 3.915 20.003 ( 16.942 0.000 0.199) 16.943 20.145 ( -10.527 0.000 8.845) 13.750 21.547 ( 10.534 0.000 -0.184) 10.536 21.729 ( 3.215 0.000 -6.922) 7.633 21.834 ( -10.383 0.000 -1.292) 10.463 22.714 ( -35.142 0.000 -10.962) 36.812 23.790 ( -0.854 0.000 1.101) 1.393 23.805 ( 2.282 0.000 -2.984) 3.756 24.322 ( 0.927 0.000 -2.348) 2.524 24.678 ( -14.847 0.000 -11.945) 19.056 ======================= Grid point 127 (61/116) ======================= q-point: ( 0.00 0.14 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.963 ( -4.082 13.435 14.199) 19.969 1.325 ( -2.763 21.566 18.036) 28.250 1.764 ( 5.285 4.166 -5.335) 8.588 1.993 ( -1.027 8.555 36.600) 37.601 2.456 ( 2.314 8.961 -7.190) 11.720 2.714 ( -3.632 -7.616 1.990) 8.670 2.874 ( -2.765 -3.595 2.681) 5.269 3.063 ( -0.082 -5.885 -0.053) 5.886 3.161 ( -0.721 -0.819 -0.141) 1.100 3.270 ( -0.877 3.907 4.163) 5.776 3.464 ( -7.322 0.105 5.299) 9.039 3.552 ( 2.337 -4.584 -4.377) 6.755 3.700 ( -10.382 1.783 -1.572) 10.651 3.768 ( 9.145 -0.240 0.368) 9.155 3.823 ( -3.031 0.302 1.111) 3.242 4.093 ( -0.226 1.043 -0.236) 1.093 4.156 ( 6.556 5.743 -0.361) 8.723 4.377 ( 13.060 2.111 -2.269) 13.422 4.452 ( 0.353 6.998 -4.934) 8.570 4.689 ( -5.083 -0.949 -4.671) 6.968 4.756 ( -6.367 -1.872 -1.256) 6.755 5.036 ( -1.395 -4.155 -7.723) 8.880 5.320 ( 3.640 2.017 0.120) 4.163 5.448 ( 6.741 -2.032 0.640) 7.070 5.905 ( -1.771 -1.942 -2.665) 3.743 6.026 ( -0.039 -2.470 2.629) 3.608 6.055 ( 2.491 0.880 -3.885) 4.698 6.134 ( -0.929 2.021 0.351) 2.251 6.405 ( -1.487 1.247 -2.952) 3.533 6.484 ( 4.164 -0.841 0.791) 4.321 6.649 ( -5.245 4.433 -0.262) 6.872 6.783 ( 6.898 -0.813 -2.730) 7.463 7.206 ( -4.482 -6.248 3.906) 8.624 7.418 ( -4.418 -2.972 -0.834) 5.389 7.654 ( 0.136 -12.658 3.748) 13.202 7.805 ( 3.336 -7.874 0.216) 8.554 8.259 ( 1.470 1.517 -1.626) 2.666 8.361 ( -2.017 5.713 -0.572) 6.086 8.519 ( -2.533 0.654 -5.870) 6.426 8.706 ( 1.181 10.229 -4.109) 11.086 9.461 ( 0.365 4.025 3.912) 5.624 9.597 ( -3.435 4.258 5.784) 7.962 9.864 ( -1.493 10.802 -7.331) 13.140 10.031 ( -0.096 7.764 -6.556) 10.162 10.491 ( -0.969 1.410 0.313) 1.739 10.606 ( 1.462 1.565 -2.833) 3.551 11.083 ( -3.865 -1.823 3.033) 5.240 11.227 ( 1.412 -1.601 -1.042) 2.376 12.151 ( -1.685 1.174 7.389) 7.669 12.487 ( 0.800 -1.306 -1.581) 2.201 12.686 ( -1.743 -7.176 1.982) 7.646 12.780 ( -1.516 -3.422 2.233) 4.358 13.145 ( 0.982 -2.798 6.060) 6.747 13.538 ( -4.957 -7.228 -3.760) 9.537 13.762 ( 6.377 -16.600 14.611) 23.016 13.961 ( 10.300 -1.601 2.466) 10.711 14.054 ( -5.478 1.308 0.872) 5.699 14.134 ( -0.843 -0.166 1.612) 1.826 14.301 ( 3.397 0.282 -2.132) 4.020 14.644 ( 6.985 0.474 -8.507) 11.017 19.048 ( -3.565 8.748 0.472) 9.458 19.203 ( 4.171 24.382 -7.520) 25.854 19.944 ( -5.747 -1.810 5.815) 8.374 20.446 ( 20.548 -0.768 -6.990) 21.718 21.587 ( -3.753 -2.566 0.036) 4.547 21.721 ( 5.006 -2.245 -4.198) 6.908 21.875 ( 1.773 2.543 0.148) 3.103 21.974 ( -20.657 0.105 -1.441) 20.707 23.745 ( -1.729 -1.268 2.616) 3.382 23.848 ( 2.176 0.319 -1.328) 2.569 24.310 ( -11.840 1.102 0.595) 11.906 24.361 ( 0.333 0.061 -0.658) 0.740 ======================= Grid point 128 (62/116) ======================= q-point: ( 0.12 0.14 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.291 ( 23.259 8.892 11.473) 27.417 1.443 ( 13.040 19.145 13.383) 26.752 2.021 ( 18.657 0.279 0.555) 18.667 2.128 ( 3.655 6.750 30.320) 31.277 2.485 ( 4.192 9.441 -8.012) 13.072 2.736 ( 4.958 -6.741 1.433) 8.490 2.897 ( 1.962 -4.017 7.617) 8.832 3.004 ( -7.025 -0.651 -2.744) 7.570 3.131 ( -4.974 -0.016 4.233) 6.531 3.275 ( 3.392 2.637 -2.735) 5.093 3.334 ( -5.500 -0.004 6.610) 8.599 3.516 ( -3.119 1.463 0.154) 3.448 3.590 ( -0.219 -3.525 -2.075) 4.097 3.771 ( -2.884 -2.245 0.632) 3.709 3.890 ( 1.891 3.089 -1.999) 4.137 4.032 ( 0.120 4.751 -4.997) 6.896 4.329 ( 8.255 3.051 -1.993) 9.023 4.415 ( -3.457 -2.138 3.171) 5.155 4.481 ( -2.604 1.958 -1.583) 3.622 4.682 ( -1.796 2.952 -4.656) 5.798 4.694 ( 9.440 0.047 -2.236) 9.701 4.967 ( -2.764 -4.666 -4.198) 6.858 5.416 ( 6.619 1.154 -2.701) 7.241 5.581 ( 6.759 -1.682 -1.992) 7.245 5.862 ( -2.915 -4.319 1.325) 5.376 5.993 ( -2.719 -4.931 2.296) 6.081 6.077 ( -0.640 0.486 -4.807) 4.874 6.226 ( 7.381 3.959 2.690) 8.798 6.356 ( -0.467 2.016 -6.724) 7.035 6.564 ( -1.854 -1.355 -2.038) 3.070 6.709 ( 14.688 4.869 -6.921) 16.952 6.912 ( 5.523 -1.246 -2.525) 6.199 7.129 ( -3.588 -6.727 4.514) 8.860 7.358 ( -1.641 1.110 0.547) 2.055 7.722 ( 5.079 -12.370 3.120) 13.732 7.859 ( 1.763 -7.033 0.658) 7.280 8.255 ( -1.629 3.740 0.044) 4.080 8.343 ( 0.325 3.531 -0.507) 3.582 8.506 ( 2.961 0.709 -5.146) 5.979 8.725 ( 2.370 8.104 -4.960) 9.793 9.484 ( 0.121 2.720 6.361) 6.919 9.574 ( -0.311 6.169 6.294) 8.818 9.863 ( 3.643 9.630 -7.413) 12.687 10.028 ( 1.526 8.844 -5.486) 10.519 10.475 ( -0.746 -0.515 0.509) 1.040 10.621 ( 0.875 1.670 -3.277) 3.781 11.000 ( -5.586 -1.009 3.511) 6.674 11.210 ( -2.937 -1.731 -0.712) 3.483 12.121 ( -3.376 0.889 7.248) 8.045 12.516 ( 2.876 0.137 -1.604) 3.296 12.647 ( -3.890 -4.920 5.599) 8.408 12.738 ( -3.324 -5.490 2.714) 6.968 13.196 ( 1.548 -1.802 6.991) 7.383 13.337 ( -10.998 -1.696 -3.657) 11.714 13.584 ( -14.152 -2.139 6.816) 15.852 13.909 ( -12.299 -2.167 -1.543) 12.583 14.059 ( -5.981 0.660 0.824) 6.074 14.199 ( 7.323 -0.385 0.492) 7.349 14.451 ( 15.516 -3.847 -0.800) 16.005 14.981 ( 18.478 -14.489 -8.807) 25.078 18.978 ( -3.235 7.185 0.005) 7.879 19.152 ( -6.935 19.527 -2.438) 20.865 19.884 ( -0.825 1.157 0.532) 1.517 20.524 ( -11.167 -5.927 2.553) 12.897 21.561 ( -6.151 4.466 1.403) 7.729 21.649 ( 6.266 -0.846 -11.145) 12.813 22.052 ( 26.187 -2.908 -10.110) 28.221 22.133 ( 14.807 -2.314 5.123) 15.838 23.727 ( -1.019 -0.782 3.665) 3.883 23.885 ( 1.905 1.061 -2.592) 3.387 24.107 ( -6.846 4.851 4.260) 9.410 24.436 ( 4.631 -0.003 0.853) 4.709 ======================= Grid point 129 (63/116) ======================= q-point: ( 0.25 0.14 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.589 ( 9.131 13.807 15.098) 22.404 1.922 ( 22.211 5.343 3.720) 23.145 2.233 ( -0.979 3.434 24.617) 24.875 2.322 ( 7.710 -1.685 0.677) 7.921 2.635 ( 11.530 4.786 -7.644) 14.638 2.799 ( -5.601 2.649 0.751) 6.241 2.881 ( 5.543 -0.236 2.389) 6.041 2.988 ( 6.633 -2.264 8.618) 11.108 3.037 ( -6.748 -0.838 3.064) 7.458 3.259 ( 0.147 1.372 -3.810) 4.052 3.416 ( 6.987 -1.083 5.463) 8.935 3.559 ( 4.934 0.637 1.840) 5.304 3.571 ( 0.541 0.131 -0.334) 0.649 3.722 ( -2.490 -5.253 0.640) 5.848 3.947 ( 7.104 7.515 -5.642) 11.780 4.051 ( 3.253 1.435 -5.032) 6.161 4.293 ( -6.348 0.573 4.007) 7.529 4.438 ( 2.822 0.692 0.587) 2.965 4.465 ( -3.127 2.278 -3.024) 4.911 4.707 ( 7.568 2.376 -4.940) 9.345 4.843 ( 4.958 -2.928 -3.299) 6.636 4.932 ( 0.971 -1.492 -1.284) 2.195 5.540 ( 6.151 0.065 -3.074) 6.877 5.698 ( 5.876 -1.192 -2.337) 6.435 5.813 ( -2.776 -3.289 6.544) 7.832 5.936 ( -3.067 -3.970 -0.842) 5.087 6.058 ( -0.009 -0.882 -2.532) 2.682 6.249 ( -2.544 1.225 -3.556) 4.541 6.419 ( 5.282 2.973 -4.924) 7.809 6.500 ( -3.486 -3.857 -1.818) 5.508 6.873 ( 1.352 1.597 -6.455) 6.785 6.939 ( -0.932 2.595 -4.114) 4.952 7.132 ( 2.744 -4.819 3.084) 6.346 7.382 ( 4.213 3.130 -2.140) 5.668 7.811 ( 1.292 -11.313 2.868) 11.742 7.887 ( 1.807 -6.605 1.442) 6.998 8.230 ( -0.600 4.876 2.092) 5.340 8.348 ( 0.416 0.368 -2.139) 2.209 8.581 ( 5.179 2.780 -2.887) 6.548 8.768 ( 3.708 3.853 -6.281) 8.249 9.499 ( -0.847 3.883 9.349) 10.159 9.626 ( 3.360 4.255 5.688) 7.858 9.956 ( 7.990 8.647 -7.631) 14.030 10.048 ( 1.983 9.470 -4.537) 10.686 10.469 ( 0.116 -1.855 0.262) 1.877 10.618 ( -0.008 2.067 -3.776) 4.305 10.899 ( -5.587 -0.144 2.978) 6.333 11.113 ( -6.678 -1.051 -0.591) 6.786 12.073 ( -3.758 0.091 7.413) 8.311 12.556 ( -6.930 -1.079 8.933) 11.357 12.579 ( 2.535 -0.437 -1.904) 3.201 12.702 ( 0.100 -7.431 1.661) 7.615 13.094 ( -11.018 -0.313 -1.142) 11.081 13.266 ( 1.576 1.507 5.630) 6.038 13.386 ( -8.031 -3.493 2.469) 9.099 13.689 ( -8.270 2.665 -0.381) 8.697 13.948 ( -5.495 0.111 0.089) 5.496 14.300 ( 3.477 2.991 -2.471) 5.210 14.722 ( 11.768 -7.286 -0.060) 13.842 15.180 ( 5.534 -12.255 -6.929) 15.127 18.919 ( -4.431 6.801 2.287) 8.433 19.005 ( -5.111 9.848 -1.345) 11.176 19.903 ( 2.193 -1.830 -0.396) 2.884 20.289 ( -11.991 -4.235 6.560) 14.309 21.460 ( -4.509 4.351 2.504) 6.748 21.714 ( 3.996 1.976 -11.912) 12.719 22.405 ( 11.151 -5.236 9.618) 15.629 22.635 ( 32.445 -6.140 -19.807) 38.506 23.727 ( -0.268 -0.132 3.388) 3.401 23.885 ( -0.893 4.294 -3.689) 5.732 24.090 ( 3.290 0.959 4.070) 5.320 24.522 ( 3.655 1.347 0.495) 3.926 ======================= Grid point 130 (64/116) ======================= q-point: ( 0.38 0.14 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.730 ( -0.480 13.574 12.767) 18.641 2.123 ( -2.862 1.272 4.720) 5.665 2.272 ( 0.926 5.408 15.802) 16.727 2.426 ( 3.473 -2.554 8.785) 9.785 2.618 ( 0.198 4.117 -9.210) 10.090 2.846 ( -6.222 1.547 1.112) 6.507 2.972 ( 6.602 0.017 3.292) 7.377 3.043 ( 9.834 -2.876 1.327) 10.332 3.179 ( 8.566 -1.815 5.591) 10.389 3.275 ( 2.183 -0.318 -4.833) 5.313 3.528 ( -1.912 -0.400 -0.273) 1.972 3.589 ( 6.125 1.519 7.964) 10.161 3.678 ( -1.913 -3.255 -0.273) 3.785 3.733 ( 8.243 -1.456 2.725) 8.802 4.093 ( 1.758 -0.704 -1.801) 2.614 4.116 ( 10.497 7.359 -3.388) 13.260 4.238 ( -1.069 4.231 0.840) 4.444 4.365 ( -4.751 0.505 -2.582) 5.431 4.479 ( 1.096 2.710 2.615) 3.922 4.823 ( 2.696 -5.619 -3.381) 7.090 4.877 ( 3.829 -1.337 -7.358) 8.402 5.002 ( 4.577 1.969 -3.481) 6.078 5.593 ( -0.879 -0.393 2.245) 2.443 5.725 ( -4.145 -0.077 -0.025) 4.145 5.827 ( 2.259 -1.880 1.203) 3.176 5.922 ( 3.146 -3.767 -2.178) 5.369 6.058 ( 0.756 1.719 0.790) 2.037 6.206 ( 1.667 0.253 -9.241) 9.394 6.394 ( -4.561 -6.336 -2.271) 8.131 6.485 ( 0.251 3.779 -2.050) 4.307 6.779 ( -6.182 -1.108 -1.484) 6.454 6.894 ( -2.533 5.438 -3.930) 7.172 7.212 ( 3.879 -2.385 2.137) 5.030 7.452 ( 3.004 3.065 -4.805) 6.442 7.799 ( -1.810 -10.357 2.978) 10.928 7.926 ( 1.296 -4.174 0.760) 4.436 8.246 ( 0.909 2.319 2.603) 3.603 8.345 ( 0.021 -1.235 -1.907) 2.272 8.668 ( 4.430 3.224 -1.780) 5.761 8.812 ( 2.336 1.184 -6.870) 7.353 9.511 ( -1.027 5.500 10.388) 11.799 9.711 ( 2.977 2.535 6.260) 7.381 10.044 ( 1.006 8.780 -3.579) 9.535 10.134 ( 10.295 8.556 -8.919) 16.086 10.484 ( 1.319 -2.347 0.022) 2.692 10.603 ( -0.174 2.092 -3.849) 4.384 10.810 ( -4.553 -0.172 2.452) 5.174 10.968 ( -7.208 1.580 -0.760) 7.418 12.027 ( -3.244 -0.668 7.995) 8.653 12.454 ( -5.930 0.937 10.414) 12.021 12.573 ( -1.371 -6.396 -5.081) 8.283 12.770 ( 4.128 -2.798 1.653) 5.254 12.917 ( -5.409 0.563 -0.541) 5.465 13.247 ( -5.252 1.298 0.676) 5.452 13.339 ( 2.101 -3.200 5.271) 6.514 13.577 ( -4.604 3.154 1.491) 5.777 13.868 ( -2.345 0.681 1.173) 2.709 14.323 ( 0.267 4.534 -4.793) 6.603 14.891 ( 5.574 -9.721 0.880) 11.240 15.206 ( 0.376 -6.335 -5.819) 8.610 18.813 ( -6.012 6.078 4.887) 9.847 18.982 ( 2.036 3.904 -4.055) 5.986 19.928 ( -1.981 -8.126 4.653) 9.571 20.139 ( -3.522 -2.142 1.005) 4.243 21.396 ( -3.090 5.104 2.582) 6.501 21.749 ( 3.419 6.041 -11.103) 13.094 22.573 ( 2.290 -6.709 11.627) 13.617 23.115 ( 22.886 -6.814 -16.520) 29.036 23.725 ( -1.217 -0.549 2.472) 2.809 23.848 ( -1.439 4.520 -4.012) 6.213 24.217 ( 7.944 -2.217 2.617) 8.653 24.573 ( 1.939 3.108 -1.814) 4.087 ======================= Grid point 131 (65/116) ======================= q-point: (-0.50 0.14 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.667 ( -7.667 12.663 11.555) 18.779 1.990 ( -11.581 3.897 13.615) 18.294 2.324 ( 0.168 7.530 7.496) 10.626 2.428 ( -5.063 1.690 -3.788) 6.545 2.714 ( 8.397 -1.301 3.622) 9.237 2.776 ( 1.956 2.192 4.629) 5.482 3.077 ( 2.124 -4.865 0.821) 5.371 3.236 ( 8.031 -5.524 0.817) 9.781 3.312 ( 4.841 -3.367 -0.213) 5.901 3.329 ( 5.167 0.386 -1.263) 5.333 3.452 ( -6.130 -2.476 1.099) 6.702 3.624 ( -4.660 1.746 5.295) 7.266 3.654 ( -1.916 2.978 1.184) 3.734 3.831 ( 0.203 -3.823 2.137) 4.384 4.103 ( -1.157 3.485 1.693) 4.043 4.203 ( -1.747 2.706 -4.259) 5.340 4.270 ( -1.860 1.652 1.108) 2.723 4.306 ( 5.069 2.399 -1.158) 5.726 4.490 ( -0.717 5.571 3.239) 6.484 4.808 ( -2.964 -4.954 -6.391) 8.613 4.932 ( 3.480 -3.593 -5.709) 7.591 5.038 ( 0.145 0.910 -6.582) 6.647 5.541 ( -5.216 0.289 6.106) 8.036 5.605 ( -6.651 2.393 -0.565) 7.091 5.829 ( -0.258 -1.654 -3.134) 3.553 6.004 ( 3.857 -2.528 -2.183) 5.102 6.120 ( 4.925 1.382 1.418) 5.308 6.269 ( -3.684 -2.141 -3.743) 5.672 6.299 ( 6.572 -1.331 -5.216) 8.496 6.463 ( -0.906 1.716 -3.526) 4.025 6.714 ( 0.521 -1.057 -0.284) 1.211 6.828 ( -3.573 4.505 -2.187) 6.151 7.275 ( 1.679 0.337 2.285) 2.856 7.464 ( 0.472 1.187 -4.918) 5.081 7.790 ( -0.095 -12.417 3.180) 12.818 7.948 ( 1.085 -2.860 -0.424) 3.088 8.256 ( -0.809 0.100 1.315) 1.548 8.344 ( 0.444 -0.112 -0.512) 0.687 8.725 ( 1.369 3.623 -1.467) 4.141 8.809 ( -0.324 0.549 -6.463) 6.494 9.515 ( -1.831 6.598 9.861) 12.005 9.761 ( 0.259 0.823 5.774) 5.838 10.045 ( 0.803 8.132 -3.743) 8.988 10.288 ( 6.601 9.208 -9.210) 14.601 10.494 ( -1.318 -1.893 -0.284) 2.324 10.589 ( -0.051 1.500 -3.694) 3.987 10.756 ( -0.106 -0.779 3.036) 3.136 10.891 ( 0.566 3.935 -1.077) 4.119 11.998 ( -2.354 -1.242 9.117) 9.497 12.402 ( -2.584 0.987 10.333) 10.697 12.529 ( -1.085 -7.106 -5.642) 9.138 12.769 ( -1.646 -1.704 -1.439) 2.772 12.951 ( 5.250 0.597 3.857) 6.541 13.144 ( -5.222 -2.381 -1.219) 5.867 13.396 ( 0.819 0.706 5.917) 6.015 13.504 ( -2.419 1.748 0.757) 3.079 13.876 ( 2.329 1.471 3.248) 4.259 14.291 ( -1.565 5.366 -6.434) 8.523 14.940 ( -0.822 -11.713 1.671) 11.861 15.188 ( -0.270 -2.228 -5.758) 6.180 18.742 ( -2.576 5.109 4.209) 7.104 19.033 ( 4.371 2.764 -4.188) 6.655 19.843 ( -6.925 -7.590 7.394) 12.659 20.162 ( 4.025 -4.817 -1.460) 6.445 21.353 ( -2.122 4.894 2.049) 5.714 21.779 ( 2.926 9.338 -10.331) 14.230 22.548 ( -8.313 -6.678 10.337) 14.851 23.427 ( 14.118 -6.465 -11.436) 19.284 23.676 ( -5.146 -1.788 2.073) 5.829 23.816 ( -0.346 3.613 -3.883) 5.315 24.366 ( 4.987 -3.961 2.141) 6.719 24.607 ( 3.965 3.422 -5.348) 7.486 ======================= Grid point 132 (66/116) ======================= q-point: (-0.38 0.14 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.553 ( -7.630 13.844 11.780) 19.713 1.807 ( -11.813 5.080 19.573) 23.419 2.263 ( -8.213 4.813 -3.733) 10.225 2.338 ( -1.078 8.315 3.704) 9.166 2.863 ( 2.981 -1.392 7.199) 7.915 2.920 ( 9.004 -0.973 4.006) 9.903 3.075 ( -2.052 -3.828 -1.910) 4.744 3.221 ( -13.168 -4.201 1.301) 13.883 3.287 ( -7.401 -5.113 4.161) 9.911 3.411 ( 2.343 -4.300 0.913) 4.981 3.451 ( -6.292 -0.656 6.389) 8.991 3.461 ( 5.212 0.245 -6.011) 7.960 3.673 ( 0.916 2.826 2.547) 3.913 3.761 ( -5.462 -0.378 -0.026) 5.476 4.039 ( -5.024 4.530 3.471) 7.603 4.129 ( -5.688 1.348 -6.844) 9.001 4.189 ( -4.795 1.887 -0.312) 5.163 4.415 ( 5.216 3.544 1.263) 6.432 4.488 ( 0.473 7.125 2.458) 7.552 4.669 ( -8.132 -4.670 -9.744) 13.524 4.959 ( -3.198 0.044 -3.827) 4.988 4.983 ( 0.887 -4.989 -5.208) 7.266 5.445 ( -6.112 -0.032 5.838) 8.452 5.497 ( -4.397 2.895 -0.447) 5.283 5.861 ( 4.054 -1.115 -1.193) 4.370 6.038 ( 1.410 -0.763 -1.928) 2.508 6.112 ( -4.663 -3.880 -4.826) 7.751 6.272 ( 4.470 3.095 4.699) 7.186 6.431 ( 3.878 -1.619 -9.112) 10.035 6.472 ( 3.391 -1.629 -2.309) 4.414 6.747 ( -2.063 4.366 -0.522) 4.858 6.767 ( 2.882 -0.163 -2.420) 3.767 7.279 ( -1.932 3.176 2.175) 4.307 7.477 ( 2.868 -2.157 -4.989) 6.146 7.796 ( -1.008 -14.833 3.928) 15.377 7.957 ( -0.637 -6.608 -0.605) 6.666 8.227 ( -1.831 -0.162 -0.632) 1.944 8.364 ( 1.675 3.473 0.130) 3.859 8.707 ( -1.889 5.303 -2.376) 6.111 8.774 ( -1.594 1.667 -4.693) 5.230 9.497 ( -2.558 6.563 7.379) 10.201 9.761 ( -1.658 -1.173 4.115) 4.589 10.058 ( 1.601 8.648 -4.332) 9.804 10.257 ( -6.379 4.325 -5.847) 9.674 10.484 ( 1.680 5.353 -2.454) 6.124 10.582 ( 0.099 1.117 -2.532) 2.769 10.849 ( 7.664 -1.849 2.719) 8.340 10.969 ( 6.757 2.992 -1.987) 7.652 11.997 ( -0.675 -1.619 10.957) 11.096 12.421 ( 1.386 -0.551 11.617) 11.713 12.504 ( 0.136 -6.360 -4.728) 7.926 12.752 ( -0.350 -2.175 0.295) 2.222 13.008 ( -3.555 -3.099 -0.914) 4.803 13.101 ( 4.470 0.091 2.129) 4.952 13.365 ( -3.677 2.173 4.452) 6.169 13.543 ( 4.921 1.992 1.589) 5.542 13.960 ( 4.731 1.181 3.951) 6.276 14.230 ( -2.658 5.687 -7.096) 9.474 14.874 ( -6.418 -12.028 1.221) 13.687 15.150 ( -2.446 -1.133 -5.190) 5.849 18.744 ( 1.841 6.895 2.910) 7.707 19.113 ( 4.504 3.592 -2.961) 6.478 19.753 ( -3.616 -5.068 5.460) 8.281 20.234 ( 2.702 -5.603 1.477) 6.393 21.332 ( -0.172 2.905 0.751) 3.006 21.799 ( 2.141 10.587 -9.207) 14.193 22.338 ( -15.131 -5.474 6.494) 17.352 23.492 ( -9.582 -8.955 -6.867) 14.804 23.638 ( 6.454 0.514 -1.721) 6.699 23.808 ( 0.001 1.662 -1.690) 2.370 24.388 ( -1.786 -0.938 -0.643) 2.117 24.708 ( 6.732 -2.167 -6.500) 9.606 ======================= Grid point 133 (67/116) ======================= q-point: (-0.25 0.14 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.433 ( -9.145 15.755 13.547) 22.702 1.657 ( -11.139 5.990 23.246) 26.464 2.089 ( -9.315 6.353 -4.370) 12.093 2.301 ( -7.138 9.504 4.920) 12.863 2.607 ( -25.067 1.661 8.359) 26.476 3.009 ( -5.415 -5.161 5.109) 9.059 3.037 ( 1.114 -2.152 0.900) 2.585 3.105 ( -3.002 -3.239 1.135) 4.559 3.226 ( 6.466 -3.670 -1.503) 7.585 3.313 ( -9.165 1.328 2.920) 9.710 3.393 ( -4.537 -4.819 1.762) 6.849 3.530 ( -0.101 -3.514 2.328) 4.217 3.632 ( 0.904 -1.499 -1.655) 2.409 3.779 ( 3.699 6.713 -1.076) 7.740 3.944 ( -10.340 2.594 -5.164) 11.845 4.005 ( 1.701 3.399 2.426) 4.509 4.118 ( -0.926 4.132 0.039) 4.235 4.421 ( -8.973 0.634 -6.385) 11.031 4.465 ( -5.136 5.552 0.695) 7.595 4.612 ( 9.987 -0.035 -2.192) 10.225 4.897 ( 0.351 -5.130 -5.131) 7.265 5.002 ( 1.140 -3.124 -3.670) 4.953 5.356 ( -4.547 1.105 4.978) 6.832 5.414 ( -4.535 1.732 0.541) 4.885 5.933 ( 2.382 -2.479 -1.443) 3.728 6.039 ( -0.459 -0.835 -3.997) 4.109 6.069 ( 1.706 0.246 -0.209) 1.737 6.301 ( -4.517 -1.079 0.426) 4.664 6.436 ( -1.903 -1.708 -1.584) 3.008 6.479 ( 2.176 -0.738 -5.674) 6.122 6.760 ( 0.267 1.500 -3.693) 3.995 6.788 ( 0.881 2.400 -1.542) 2.986 7.243 ( -1.426 2.711 2.008) 3.663 7.532 ( 3.497 -4.738 -4.945) 7.690 7.759 ( -4.080 -14.495 4.771) 15.796 7.889 ( -6.601 -13.562 0.666) 15.098 8.206 ( 0.528 2.289 -1.957) 3.058 8.398 ( 1.399 4.783 -1.324) 5.157 8.671 ( -0.838 5.298 -3.108) 6.199 8.721 ( -2.197 5.467 -3.879) 7.054 9.469 ( -2.043 5.720 4.638) 7.642 9.723 ( -3.351 -1.912 2.835) 4.788 10.051 ( -2.383 9.092 -6.315) 11.324 10.123 ( -3.594 5.065 -4.523) 7.683 10.505 ( 0.826 5.324 -1.962) 5.734 10.580 ( 0.507 1.735 -2.500) 3.085 11.021 ( 8.621 -2.348 1.170) 9.011 11.087 ( 4.948 0.788 -2.089) 5.428 12.050 ( 2.599 -1.150 11.832) 12.168 12.484 ( 0.936 -5.505 -3.205) 6.438 12.568 ( 8.471 -6.249 15.967) 19.125 12.744 ( -0.769 -3.234 2.121) 3.943 12.930 ( -2.079 -0.217 -1.750) 2.727 13.173 ( -1.056 -3.662 5.461) 6.660 13.400 ( 9.068 5.237 2.073) 10.674 13.661 ( 6.195 1.922 0.364) 6.496 14.062 ( 4.312 0.351 2.926) 5.223 14.151 ( -3.085 6.134 -5.747) 8.954 14.694 ( -12.799 -11.303 0.664) 17.088 15.043 ( -7.620 -0.759 -4.842) 9.060 18.836 ( 7.263 11.994 0.608) 14.035 19.166 ( 1.002 6.069 -0.432) 6.166 19.765 ( 4.066 -3.435 3.237) 6.230 20.252 ( -2.191 -2.879 4.713) 5.942 21.366 ( 4.135 -0.336 -0.932) 4.252 21.807 ( 1.397 9.335 -7.465) 12.034 22.049 ( -14.915 -4.012 1.792) 15.549 23.182 ( -20.248 -7.828 -8.399) 23.276 23.744 ( 4.551 -0.569 -1.839) 4.942 23.797 ( -0.880 0.088 -0.158) 0.898 24.339 ( -2.072 0.104 -2.332) 3.122 24.761 ( -0.283 -6.173 -8.242) 10.301 ======================= Grid point 134 (68/116) ======================= q-point: (-0.12 0.14 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.252 ( -17.126 11.793 14.640) 25.431 1.445 ( -16.258 14.968 17.702) 28.315 1.862 ( -10.916 6.480 -5.971) 14.028 2.019 ( -15.188 10.190 29.393) 34.618 2.435 ( 0.710 6.818 -3.803) 7.839 2.838 ( -9.158 -8.882 2.525) 13.005 3.013 ( -10.260 -2.127 -0.317) 10.483 3.048 ( 0.404 -5.597 2.102) 5.992 3.215 ( -2.759 -2.051 0.878) 3.548 3.242 ( -0.506 3.306 3.416) 4.781 3.442 ( 6.982 -3.153 1.123) 7.743 3.542 ( 0.747 -2.745 3.711) 4.676 3.683 ( 0.508 2.641 -2.247) 3.505 3.794 ( -0.081 2.758 -5.110) 5.808 3.836 ( 2.869 0.586 2.827) 4.070 4.067 ( -8.219 2.996 0.855) 8.790 4.130 ( 9.590 3.762 -0.374) 10.309 4.219 ( -3.099 0.794 -4.798) 5.767 4.437 ( 0.305 10.063 -0.591) 10.084 4.740 ( 2.619 -0.198 -4.747) 5.425 4.887 ( -3.683 -6.910 -1.966) 8.073 5.026 ( 4.296 -3.506 -8.934) 10.515 5.302 ( -2.464 2.650 3.224) 4.847 5.361 ( 0.474 -0.143 2.796) 2.839 5.941 ( 0.068 -2.791 -3.787) 4.705 6.039 ( -1.027 2.954 -2.090) 3.762 6.071 ( -1.980 -2.126 0.615) 2.970 6.174 ( -4.125 -1.242 -1.310) 4.503 6.409 ( -0.339 -2.456 -1.298) 2.799 6.499 ( -0.771 1.317 -0.870) 1.757 6.698 ( -0.996 -0.971 -5.121) 5.307 6.784 ( -3.367 3.960 -0.721) 5.247 7.240 ( -0.410 -1.030 2.652) 2.874 7.526 ( -4.127 -7.839 -3.308) 9.456 7.694 ( -3.958 -12.555 3.504) 13.623 7.771 ( -2.565 -12.035 2.054) 12.476 8.228 ( 1.971 2.165 -2.089) 3.597 8.397 ( -0.857 4.835 -2.043) 5.318 8.612 ( -4.194 1.342 -5.560) 7.092 8.698 ( 0.663 10.656 -3.043) 11.102 9.453 ( -0.753 4.985 3.447) 6.107 9.657 ( -4.083 0.301 3.434) 5.344 9.950 ( -4.544 9.352 -6.416) 12.218 10.070 ( -1.509 7.893 -7.169) 10.769 10.505 ( -0.326 3.494 -0.679) 3.574 10.588 ( 1.120 1.746 -2.596) 3.322 11.124 ( -0.572 -1.555 0.713) 1.803 11.163 ( 5.560 -1.846 -0.979) 5.940 12.131 ( 1.513 0.507 8.838) 8.981 12.485 ( 0.333 -3.533 -2.460) 4.318 12.708 ( -0.799 -8.586 1.756) 8.801 12.782 ( 1.351 -6.001 2.735) 6.731 13.098 ( 14.388 -2.898 8.695) 17.060 13.173 ( 9.076 -8.585 17.049) 21.137 13.668 ( 15.852 2.495 0.821) 16.068 13.728 ( -0.234 0.898 -3.162) 3.296 14.118 ( 1.416 5.742 -1.310) 6.057 14.145 ( 4.956 0.935 1.079) 5.158 14.386 ( -18.820 -7.744 0.905) 20.372 14.825 ( -12.929 0.566 -5.349) 14.004 19.012 ( 9.808 18.188 -3.302) 20.927 19.151 ( -1.433 10.172 -0.083) 10.273 19.927 ( 9.255 -5.078 5.018) 11.689 20.200 ( -1.089 2.834 2.669) 4.042 21.493 ( 9.100 -3.236 -1.383) 9.756 21.779 ( -6.862 -0.710 -1.160) 6.995 21.842 ( -1.394 4.312 -5.665) 7.255 22.639 ( -33.432 -6.452 -9.338) 35.306 23.773 ( -1.637 -0.987 1.595) 2.489 23.808 ( 2.656 0.101 -1.586) 3.095 24.314 ( 0.458 -0.436 -1.884) 1.987 24.616 ( -12.115 -4.828 -6.922) 14.764 ======================= Grid point 135 (69/116) ======================= q-point: ( 0.00 0.29 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.316 ( -1.962 18.648 8.817) 20.720 1.789 ( -0.434 20.125 11.628) 23.247 1.907 ( 1.198 8.920 -1.677) 9.155 2.227 ( -2.542 11.340 25.645) 28.156 2.499 ( -2.378 -11.278 4.325) 12.311 2.656 ( 3.080 6.042 -2.102) 7.100 2.755 ( -1.647 -6.289 -1.920) 6.778 2.931 ( 0.327 -5.831 5.681) 8.147 3.155 ( -1.558 1.556 -1.227) 2.521 3.363 ( 0.924 4.394 5.430) 7.047 3.477 ( -6.569 1.025 6.155) 9.060 3.499 ( 2.801 0.438 -2.187) 3.581 3.709 ( -7.893 -0.827 3.787) 8.794 3.743 ( -3.217 -0.763 -5.976) 6.830 3.880 ( 1.261 3.512 -1.817) 4.150 4.102 ( 6.752 0.322 1.475) 6.918 4.319 ( 5.982 4.595 -5.818) 9.526 4.428 ( 9.259 2.523 -1.830) 9.770 4.505 ( -6.744 -0.013 -4.515) 8.115 4.597 ( -3.041 -5.550 -0.461) 6.345 4.716 ( 1.655 -3.245 -6.581) 7.522 4.957 ( -0.821 -2.997 -10.443) 10.896 5.378 ( 2.421 2.617 1.167) 3.751 5.410 ( 3.789 -0.748 -0.414) 3.884 5.810 ( -3.892 -5.220 -0.185) 6.514 5.951 ( -4.683 -3.764 3.428) 6.918 6.160 ( 8.560 7.356 -3.403) 11.788 6.205 ( -1.240 4.524 -3.396) 5.791 6.435 ( -4.276 1.014 -2.887) 5.258 6.504 ( 9.123 2.642 -0.151) 9.499 6.694 ( -1.096 -0.446 -1.584) 1.977 6.750 ( 2.140 -2.849 -1.774) 3.980 7.088 ( -5.323 -3.647 4.601) 7.925 7.345 ( -0.879 -8.134 3.367) 8.847 7.412 ( 1.617 -4.893 -3.150) 6.040 7.644 ( 4.387 -7.549 -2.328) 9.036 8.304 ( 0.428 3.066 -1.132) 3.296 8.441 ( -1.387 1.576 -4.548) 5.009 8.547 ( -3.453 2.362 1.183) 4.348 8.794 ( 0.837 -1.227 -3.828) 4.106 9.589 ( -1.923 6.744 7.931) 10.587 9.743 ( -1.390 7.765 5.775) 9.776 10.071 ( -0.219 7.709 -1.409) 7.840 10.221 ( 1.191 9.416 -9.834) 13.667 10.562 ( -1.963 5.158 -4.022) 6.829 10.642 ( 0.819 1.803 -4.640) 5.045 11.033 ( -3.145 -2.667 4.174) 5.868 11.168 ( 1.074 -4.158 0.041) 4.294 12.193 ( -1.553 2.989 5.391) 6.357 12.437 ( 2.543 -3.517 5.265) 6.824 12.520 ( -0.442 -7.116 1.160) 7.223 12.646 ( -0.111 -8.791 5.263) 10.247 13.085 ( 0.533 -1.919 5.585) 5.929 13.276 ( 7.098 -9.930 9.889) 15.710 13.669 ( -4.144 1.189 0.033) 4.311 13.920 ( 2.874 -3.162 0.798) 4.347 14.077 ( -5.129 1.159 2.039) 5.640 14.140 ( -1.653 0.278 2.457) 2.974 14.339 ( 4.411 2.845 -4.025) 6.615 14.584 ( 1.099 -4.479 -8.806) 9.940 19.262 ( -4.808 10.964 3.297) 12.418 19.627 ( -0.587 10.788 -3.975) 11.512 19.943 ( 3.665 4.631 -2.029) 6.244 20.412 ( 11.221 -2.647 -7.604) 13.811 21.542 ( 1.229 -1.418 -2.256) 2.935 21.654 ( 9.158 -3.770 -5.275) 11.221 21.924 ( -7.627 1.913 0.393) 7.873 21.978 ( -13.066 0.130 -0.378) 13.072 23.745 ( -1.285 1.106 3.700) 4.070 23.842 ( 1.449 -0.793 0.217) 1.666 24.322 ( -1.577 0.161 -0.355) 1.625 24.359 ( -3.256 -0.425 -1.067) 3.452 ======================= Grid point 136 (70/116) ======================= q-point: ( 0.12 0.29 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( 17.410 13.336 7.507) 23.180 1.900 ( 8.806 21.631 10.572) 25.636 2.083 ( 15.164 5.390 -0.073) 16.093 2.302 ( 1.508 7.071 24.348) 25.398 2.501 ( 1.455 -9.655 -0.657) 9.786 2.718 ( 4.374 7.513 -1.143) 8.768 2.802 ( 4.683 -5.067 0.320) 6.907 2.942 ( -0.780 -3.202 8.671) 9.276 3.170 ( 0.931 1.160 0.025) 1.488 3.335 ( -5.215 0.636 0.797) 5.313 3.366 ( -2.677 6.011 5.965) 8.882 3.533 ( -2.494 -1.646 -0.246) 2.999 3.551 ( -1.136 0.816 -2.933) 3.250 3.688 ( -3.023 -3.442 1.984) 4.992 3.946 ( 3.921 2.493 -3.264) 5.678 4.150 ( 0.235 3.646 -4.972) 6.170 4.357 ( -3.962 -3.330 0.149) 5.178 4.386 ( 0.549 1.213 -3.463) 3.710 4.523 ( 2.632 1.937 -3.811) 5.020 4.667 ( 7.595 0.110 -0.847) 7.643 4.785 ( 6.470 3.877 -4.896) 8.992 4.864 ( -4.388 -3.674 -6.252) 8.476 5.445 ( 5.165 1.514 -2.627) 5.989 5.526 ( 7.067 -3.204 -0.311) 7.766 5.745 ( -2.841 -5.664 0.687) 6.374 5.884 ( -3.187 -5.611 5.265) 8.329 6.103 ( -4.976 2.306 -5.746) 7.943 6.329 ( -1.401 2.549 1.957) 3.506 6.378 ( 6.790 2.709 -8.421) 11.151 6.550 ( -3.974 0.464 -0.862) 4.093 6.783 ( 10.930 0.910 -4.524) 11.865 6.885 ( 8.261 -1.260 -0.979) 8.414 7.033 ( -1.227 -1.670 3.964) 4.473 7.348 ( 0.951 -3.930 0.677) 4.100 7.484 ( 5.999 -6.746 -0.561) 9.045 7.718 ( 3.627 -6.551 -2.449) 7.879 8.299 ( -0.756 1.970 -0.487) 2.166 8.404 ( -0.748 0.585 -5.256) 5.341 8.537 ( 1.978 3.291 2.349) 4.502 8.803 ( 1.197 -0.926 -3.494) 3.808 9.589 ( -0.664 6.455 8.657) 10.819 9.733 ( -1.119 7.083 6.244) 9.508 10.079 ( 2.039 8.890 -2.947) 9.585 10.246 ( 3.783 10.724 -7.817) 13.799 10.503 ( -2.877 3.624 -2.907) 5.464 10.649 ( 1.117 1.273 -4.202) 4.531 10.975 ( -4.143 -1.279 4.068) 5.945 11.148 ( -2.903 -4.340 -0.059) 5.222 12.153 ( -3.903 2.199 5.261) 6.910 12.489 ( -1.984 -8.690 3.462) 9.562 12.513 ( 3.517 -0.634 0.636) 3.630 12.629 ( -3.483 -4.965 6.249) 8.708 13.132 ( 1.953 -3.213 5.153) 6.379 13.262 ( -7.847 -4.483 0.632) 9.059 13.586 ( -6.995 1.917 5.774) 9.271 13.846 ( -7.449 -3.977 -1.217) 8.532 14.065 ( -5.222 -0.290 3.049) 6.054 14.132 ( 7.980 -3.984 0.525) 8.935 14.438 ( 7.518 2.544 -1.730) 8.123 14.740 ( 13.037 -8.127 -8.319) 17.471 19.166 ( -5.429 9.948 1.781) 11.472 19.485 ( -11.632 8.722 -0.663) 14.554 19.950 ( -2.281 6.007 -4.220) 7.688 20.390 ( -10.285 -6.135 -0.838) 12.005 21.646 ( 7.586 1.054 -9.272) 12.026 21.672 ( -4.962 5.626 2.175) 7.810 21.966 ( 22.498 -5.030 -8.805) 24.677 22.060 ( 10.048 -4.442 4.454) 11.854 23.741 ( -0.448 1.761 3.998) 4.392 23.872 ( 1.803 -1.481 -0.305) 2.354 24.222 ( -3.983 5.108 -0.174) 6.480 24.424 ( 5.242 -1.342 0.240) 5.416 ======================= Grid point 137 (71/116) ======================= q-point: ( 0.25 0.29 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.866 ( 13.497 9.978 8.679) 18.896 2.140 ( 9.774 15.494 4.162) 18.786 2.331 ( 3.653 4.632 14.595) 15.742 2.384 ( 1.076 7.161 13.591) 15.400 2.581 ( 8.783 -9.965 -0.851) 13.310 2.759 ( -1.318 2.239 -4.400) 5.110 2.917 ( 9.278 -2.369 -0.353) 9.583 2.997 ( 1.817 0.089 11.822) 11.961 3.105 ( -4.405 7.803 -0.764) 8.993 3.282 ( -1.533 0.592 -2.502) 2.993 3.400 ( 4.954 -1.378 3.020) 5.963 3.524 ( -0.505 -7.335 -1.664) 7.539 3.576 ( 5.818 2.358 5.013) 8.033 3.667 ( 0.127 3.061 0.265) 3.075 3.982 ( 2.508 -1.155 -4.525) 5.301 4.193 ( 6.175 8.029 -6.723) 12.157 4.299 ( -2.473 -1.788 4.639) 5.553 4.436 ( 5.094 -0.839 -4.606) 6.919 4.490 ( -3.486 -0.203 -5.494) 6.510 4.738 ( -2.929 -2.998 -5.529) 6.938 4.814 ( 5.924 5.564 -1.808) 8.327 4.947 ( 7.943 2.783 -0.221) 8.420 5.539 ( 4.266 -0.165 -1.730) 4.607 5.651 ( 5.653 -3.649 -1.101) 6.818 5.725 ( 0.947 -3.885 2.260) 4.594 5.849 ( -2.106 -4.414 1.934) 5.259 6.022 ( -1.129 -1.946 -2.981) 3.734 6.238 ( -4.386 -4.807 -6.418) 9.140 6.406 ( -3.580 2.504 0.794) 4.440 6.559 ( 3.603 4.809 -3.694) 7.054 6.855 ( -1.986 -1.757 -2.107) 3.386 6.993 ( 2.478 0.220 -1.436) 2.873 7.077 ( 3.990 0.327 1.365) 4.230 7.406 ( 5.030 -2.693 -3.218) 6.550 7.597 ( 4.022 -5.705 1.112) 7.068 7.773 ( 3.348 -4.627 -2.114) 6.090 8.274 ( -1.513 1.464 -0.190) 2.114 8.381 ( -0.110 0.762 -4.305) 4.373 8.619 ( 4.882 2.176 1.710) 5.612 8.816 ( 1.179 -0.440 -2.918) 3.177 9.616 ( 0.638 6.828 9.361) 11.604 9.749 ( 0.753 6.029 7.156) 9.387 10.147 ( 6.220 7.230 -3.692) 10.227 10.288 ( 1.626 12.701 -5.879) 14.090 10.448 ( -1.248 -0.391 -1.669) 2.120 10.657 ( 1.045 2.410 -4.754) 5.432 10.900 ( -4.714 -0.050 2.532) 5.352 11.073 ( -4.202 -2.896 -0.491) 5.127 12.087 ( -4.158 1.526 4.612) 6.394 12.441 ( -2.723 -9.042 -1.209) 9.520 12.562 ( -5.112 -1.237 7.230) 8.941 12.610 ( 5.178 -1.299 3.304) 6.278 13.077 ( -9.563 -1.485 -1.414) 9.780 13.169 ( -0.043 -5.362 3.489) 6.397 13.468 ( -5.431 6.582 4.076) 9.457 13.711 ( -5.763 -0.362 0.745) 5.822 13.959 ( -5.230 1.009 1.606) 5.563 14.313 ( 8.206 -5.246 -0.052) 9.740 14.568 ( 5.523 -2.569 0.329) 6.100 14.939 ( 9.326 -9.533 -7.908) 15.504 19.075 ( -4.534 7.992 0.897) 9.232 19.237 ( -12.159 9.533 -0.725) 15.467 19.860 ( -5.466 -1.493 1.604) 5.889 20.173 ( -10.567 -6.537 0.975) 12.464 21.591 ( -2.741 7.833 4.562) 9.470 21.790 ( 8.442 5.224 -10.631) 14.546 22.261 ( 8.997 -7.882 7.436) 14.084 22.466 ( 28.077 -9.533 -15.375) 33.401 23.744 ( -0.587 1.667 3.393) 3.826 23.904 ( 1.412 -1.505 -1.693) 2.669 24.191 ( 0.635 7.168 1.617) 7.376 24.526 ( 4.932 -1.339 -0.454) 5.130 ======================= Grid point 138 (72/116) ======================= q-point: ( 0.38 0.29 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.075 ( 1.270 15.377 12.564) 19.898 2.172 ( -2.519 5.772 0.289) 6.304 2.413 ( 1.425 1.235 11.047) 11.207 2.447 ( 2.229 9.711 17.740) 20.347 2.646 ( -0.870 -3.360 -4.187) 5.438 2.813 ( 5.098 -1.329 0.422) 5.285 2.982 ( -0.630 3.156 0.909) 3.344 3.064 ( 1.280 0.987 -0.749) 1.782 3.118 ( 5.507 -2.765 5.172) 8.045 3.265 ( 0.211 -1.498 -4.225) 4.488 3.493 ( 1.246 -3.098 -0.128) 3.341 3.542 ( 2.919 -5.895 0.120) 6.580 3.676 ( 3.924 2.748 -0.100) 4.791 3.749 ( 5.881 4.066 7.134) 10.100 4.052 ( 5.477 -1.959 -1.822) 6.096 4.266 ( -2.007 -4.150 3.107) 5.559 4.308 ( 5.411 7.701 -4.758) 10.546 4.385 ( -4.045 2.667 -7.746) 9.137 4.540 ( 5.933 2.727 -2.710) 7.070 4.707 ( 1.086 -3.627 -2.887) 4.761 4.889 ( 2.346 3.488 -2.889) 5.100 5.067 ( 4.388 3.896 -3.234) 6.700 5.584 ( -0.301 -0.724 3.669) 3.752 5.698 ( -0.611 -2.510 0.842) 2.716 5.768 ( 1.029 -3.134 -3.160) 4.568 5.852 ( 4.410 -2.682 -1.331) 5.330 6.042 ( 2.496 -3.528 -0.610) 4.364 6.166 ( 0.072 -5.448 -6.064) 8.152 6.335 ( -3.353 2.885 1.578) 4.696 6.569 ( -1.446 2.597 -2.684) 4.005 6.764 ( -5.171 0.732 -1.397) 5.406 6.971 ( -3.123 1.305 -2.915) 4.467 7.177 ( 5.296 -0.622 1.726) 5.605 7.475 ( 2.797 -3.810 -5.183) 7.014 7.613 ( -2.270 -3.319 2.424) 4.696 7.836 ( 3.110 -4.290 -2.804) 5.995 8.250 ( -0.704 1.052 -0.326) 1.307 8.379 ( 1.000 1.362 -2.534) 3.045 8.703 ( 3.158 1.100 1.389) 3.622 8.829 ( 0.765 -0.430 -2.595) 2.740 9.663 ( 0.877 8.120 10.475) 13.282 9.793 ( 0.914 4.652 7.769) 9.102 10.259 ( -2.031 9.753 -4.391) 10.887 10.290 ( 9.317 4.012 -3.838) 10.846 10.455 ( 1.226 -0.051 -1.296) 1.785 10.655 ( 0.242 3.523 -6.559) 7.449 10.816 ( -3.814 1.086 2.139) 4.505 11.002 ( -2.554 1.264 -1.917) 3.435 12.027 ( -3.379 1.072 4.581) 5.793 12.384 ( -2.489 -9.187 -2.769) 9.913 12.490 ( -4.335 1.357 7.335) 8.628 12.707 ( 2.759 -3.682 1.855) 4.961 12.937 ( -3.071 1.323 -0.254) 3.353 13.145 ( -3.217 -5.888 2.084) 7.026 13.422 ( -0.584 6.060 3.568) 7.057 13.612 ( -5.531 0.297 1.688) 5.791 13.902 ( -1.029 2.870 3.313) 4.503 14.419 ( 3.428 1.152 -3.887) 5.309 14.646 ( 2.100 -9.114 2.722) 9.741 15.048 ( 4.629 -8.238 -7.565) 12.105 18.970 ( -6.888 7.980 2.994) 10.959 19.091 ( -1.676 5.876 -3.374) 6.980 19.768 ( -5.442 -6.278 6.040) 10.272 20.019 ( -4.774 -8.425 -1.143) 9.751 21.562 ( -2.284 10.086 4.815) 11.408 21.917 ( 7.789 9.102 -10.413) 15.873 22.394 ( 1.766 -9.148 8.646) 12.710 22.903 ( 21.320 -12.976 -15.078) 29.159 23.731 ( -1.846 1.577 2.966) 3.834 23.906 ( -0.403 0.198 -3.442) 3.471 24.251 ( 4.295 5.375 3.899) 7.908 24.599 ( 2.970 -0.985 -2.365) 3.922 ======================= Grid point 139 (73/116) ======================= q-point: (-0.50 0.29 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.994 ( -7.442 16.246 9.980) 20.467 2.104 ( -8.903 6.568 11.934) 16.273 2.477 ( 0.376 2.883 0.566) 2.962 2.526 ( 1.340 10.398 9.528) 14.167 2.691 ( 6.513 -1.134 0.978) 6.683 2.819 ( -0.411 1.697 5.246) 5.529 3.007 ( -1.027 -2.033 2.002) 3.033 3.113 ( 3.962 -4.684 -0.411) 6.149 3.197 ( 1.245 -6.529 3.772) 7.642 3.262 ( 0.500 -5.287 -4.616) 7.037 3.451 ( -2.415 1.055 -1.765) 3.172 3.604 ( 2.041 -2.923 3.555) 5.035 3.755 ( -0.772 4.088 1.153) 4.317 3.788 ( -1.452 1.280 2.396) 3.081 4.145 ( 3.144 0.038 -0.336) 3.162 4.211 ( -3.452 -4.301 4.103) 6.874 4.295 ( -2.855 3.707 -9.652) 10.726 4.386 ( 3.695 2.174 -4.629) 6.309 4.621 ( 2.600 5.499 -0.239) 6.087 4.726 ( -0.535 -1.308 -3.938) 4.184 4.882 ( -1.306 1.218 -2.261) 2.881 5.090 ( -0.998 3.231 -5.046) 6.074 5.539 ( -5.132 -0.468 4.424) 6.791 5.646 ( -4.564 0.943 0.185) 4.664 5.775 ( 1.514 -2.916 -2.337) 4.032 5.947 ( 4.812 -2.864 -3.231) 6.465 6.068 ( -0.066 -5.003 -2.052) 5.408 6.231 ( 6.999 -5.326 -4.700) 9.973 6.305 ( 0.104 4.720 3.701) 5.999 6.524 ( -2.082 2.292 -1.882) 3.623 6.702 ( 0.324 1.026 -1.099) 1.538 6.890 ( -3.916 0.951 -3.398) 5.271 7.270 ( 3.601 -0.747 1.600) 4.011 7.483 ( -0.140 -3.343 -5.949) 6.826 7.559 ( -3.575 -4.516 3.757) 6.877 7.851 ( -0.808 -5.863 -3.349) 6.800 8.252 ( 0.993 2.498 -0.772) 2.797 8.403 ( 2.139 2.537 -1.581) 3.675 8.753 ( 1.690 -0.211 1.301) 2.143 8.818 ( -1.238 -0.195 -2.327) 2.643 9.699 ( -0.756 9.732 10.992) 14.701 9.812 ( -1.363 3.729 7.537) 8.518 10.220 ( -0.318 7.096 -4.055) 8.179 10.429 ( -3.993 -1.917 0.688) 4.483 10.458 ( 8.179 2.581 -5.316) 10.090 10.629 ( 0.098 2.282 -6.921) 7.288 10.806 ( 2.003 6.005 1.347) 6.472 10.972 ( 0.778 3.384 -3.223) 4.738 11.986 ( -2.427 0.581 5.450) 5.994 12.334 ( -1.614 -8.991 -3.091) 9.644 12.446 ( -2.471 1.788 7.283) 7.896 12.705 ( -1.719 -4.443 -0.266) 4.772 12.974 ( 4.089 1.227 3.202) 5.336 13.074 ( -3.694 -3.168 0.404) 4.883 13.444 ( 0.136 2.829 4.261) 5.117 13.520 ( -2.591 0.039 0.375) 2.618 13.933 ( 2.374 4.220 5.549) 7.365 14.431 ( -0.159 5.943 -6.917) 9.120 14.664 ( -1.427 -12.123 4.291) 12.939 15.081 ( 1.228 -7.476 -7.390) 10.583 18.888 ( -1.717 8.155 2.702) 8.761 19.108 ( 3.990 3.794 -3.969) 6.787 19.685 ( -4.850 -6.257 7.524) 10.922 19.991 ( 1.898 -10.480 -1.502) 10.755 21.520 ( -3.521 10.372 4.039) 11.675 22.016 ( 5.424 11.568 -10.128) 16.304 22.368 ( -7.133 -8.740 8.144) 13.914 23.175 ( 10.665 -16.252 -13.347) 23.580 23.695 ( -2.332 3.228 3.217) 5.119 23.878 ( -1.212 1.548 -3.200) 3.756 24.349 ( 3.693 2.299 4.224) 6.063 24.629 ( 1.479 -1.336 -4.300) 4.740 ======================= Grid point 140 (74/116) ======================= q-point: (-0.38 0.29 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.901 ( -5.568 16.938 9.937) 20.412 1.955 ( -9.866 8.575 16.321) 20.911 2.410 ( -4.956 8.870 -3.658) 10.799 2.542 ( -1.793 9.190 7.297) 11.871 2.815 ( 0.832 -3.161 6.159) 6.972 2.894 ( 4.694 -1.132 4.474) 6.583 2.955 ( -5.253 -6.928 0.175) 8.696 3.123 ( -1.552 -4.528 0.599) 4.824 3.177 ( -3.211 -5.032 2.520) 6.480 3.270 ( 0.565 -8.328 -0.841) 8.389 3.457 ( 3.267 1.483 -3.899) 5.299 3.537 ( -11.596 6.186 5.802) 14.366 3.657 ( -3.694 -0.148 4.962) 6.188 3.824 ( 3.347 2.785 -1.719) 4.681 4.105 ( -5.735 0.989 4.705) 7.484 4.189 ( -5.005 3.579 -11.641) 13.167 4.211 ( 0.869 -0.146 -2.972) 3.100 4.437 ( 3.017 -3.592 -2.844) 5.486 4.598 ( -8.905 0.620 -7.110) 11.412 4.655 ( 0.940 6.771 0.786) 6.881 4.868 ( -0.596 -3.522 -1.518) 3.881 4.994 ( -6.488 2.648 -2.498) 7.439 5.446 ( -4.988 0.345 3.237) 5.956 5.552 ( -4.784 1.512 0.109) 5.019 5.831 ( 4.369 -1.428 -1.112) 4.729 6.007 ( 2.094 -2.678 -2.746) 4.370 6.033 ( -0.937 -2.378 -3.410) 4.261 6.336 ( 5.180 -4.135 -2.675) 7.147 6.346 ( 0.367 0.324 0.457) 0.670 6.478 ( -2.192 1.638 -1.642) 3.191 6.762 ( 4.284 0.355 -0.268) 4.307 6.825 ( -0.744 2.251 -2.747) 3.629 7.318 ( 0.404 -0.533 1.261) 1.428 7.442 ( -1.456 -2.218 -6.416) 6.943 7.513 ( -2.679 -8.759 4.681) 10.286 7.787 ( -4.850 -7.845 -2.203) 9.482 8.272 ( 1.269 4.670 -2.014) 5.242 8.449 ( 2.841 3.248 -1.755) 4.658 8.772 ( -1.310 1.098 0.077) 1.711 8.778 ( -0.545 -1.234 -1.531) 2.040 9.693 ( -2.839 10.595 9.237) 14.340 9.794 ( -2.650 3.905 7.265) 8.663 10.220 ( 1.072 5.071 -3.433) 6.216 10.309 ( -6.750 1.519 -1.429) 7.065 10.575 ( 4.587 0.926 -4.948) 6.810 10.629 ( 1.785 2.867 -6.174) 7.037 10.864 ( 3.563 4.186 2.360) 5.982 11.026 ( 5.112 2.142 -4.137) 6.917 11.973 ( -0.464 -0.004 7.293) 7.308 12.311 ( 0.250 -9.173 -2.893) 9.621 12.435 ( -1.393 0.399 9.181) 9.294 12.673 ( -1.696 -5.074 0.852) 5.417 12.979 ( -2.436 0.313 -0.405) 2.489 13.094 ( 3.056 -0.935 3.054) 4.421 13.422 ( -0.470 3.124 2.739) 4.182 13.568 ( 5.052 0.175 1.798) 5.366 14.008 ( 3.277 3.598 5.718) 7.509 14.382 ( -2.309 7.386 -8.162) 11.247 14.612 ( -5.435 -11.268 4.760) 13.385 15.050 ( -2.362 -7.808 -7.350) 10.980 18.932 ( 5.877 10.079 1.297) 11.740 19.209 ( 7.123 4.766 -3.332) 9.195 19.643 ( -1.478 -4.329 6.990) 8.354 20.057 ( 4.592 -10.536 -0.284) 11.496 21.455 ( -3.876 8.427 2.530) 9.614 22.059 ( 1.797 10.743 -9.196) 14.255 22.185 ( -13.146 -5.963 5.502) 15.449 23.197 ( -4.886 -17.337 -11.445) 21.341 23.695 ( 1.756 3.972 2.603) 5.064 23.844 ( -1.577 1.412 -1.553) 2.625 24.390 ( -0.597 1.303 1.804) 2.304 24.641 ( 0.979 -4.053 -4.148) 5.881 ======================= Grid point 141 (75/116) ======================= q-point: (-0.25 0.29 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.803 ( -10.263 16.233 11.221) 22.243 1.840 ( -6.414 12.118 17.936) 22.576 2.281 ( -8.003 11.378 -5.108) 14.819 2.531 ( -2.060 9.100 6.076) 11.134 2.615 ( -19.623 -1.155 10.259) 22.174 2.825 ( -11.983 -10.785 3.320) 16.460 2.889 ( -0.672 -6.999 -2.223) 7.374 3.152 ( -6.770 -2.937 0.236) 7.383 3.192 ( 6.831 1.779 0.636) 7.087 3.231 ( 0.441 -4.515 6.243) 7.717 3.380 ( -5.363 4.102 3.318) 7.523 3.509 ( 1.780 2.338 0.240) 2.948 3.621 ( 1.231 1.621 2.828) 3.484 3.893 ( 1.128 2.584 -1.865) 3.381 4.004 ( -4.933 2.684 -2.016) 5.967 4.068 ( -1.213 2.009 -3.368) 4.105 4.208 ( 0.396 3.006 -3.654) 4.748 4.368 ( -9.801 -2.992 -9.817) 14.191 4.512 ( 2.910 -3.123 -0.753) 4.334 4.685 ( 2.072 2.558 -0.822) 3.393 4.789 ( -4.479 -2.084 -3.156) 5.862 4.936 ( 0.459 -1.212 -1.552) 2.022 5.380 ( -2.516 1.284 2.416) 3.717 5.458 ( -5.196 1.873 0.557) 5.551 5.890 ( 1.194 -0.952 -2.291) 2.753 6.023 ( 3.297 -0.711 -2.050) 3.947 6.066 ( 3.094 -0.294 -2.000) 3.696 6.261 ( -8.027 -2.873 -3.294) 9.140 6.407 ( -0.891 -1.921 0.631) 2.210 6.438 ( 2.800 -1.930 -3.192) 4.665 6.793 ( -1.797 1.911 -1.930) 3.257 6.853 ( 2.229 2.696 -0.174) 3.503 7.278 ( -4.092 -0.149 0.676) 4.151 7.405 ( -1.922 -7.788 -1.700) 8.200 7.481 ( -1.276 -8.527 1.221) 8.708 7.662 ( -6.816 -7.634 -0.951) 10.278 8.286 ( 0.925 5.228 -2.437) 5.842 8.484 ( 1.155 3.090 -2.920) 4.406 8.720 ( -3.112 0.629 -1.303) 3.432 8.783 ( 0.612 -0.437 -1.198) 1.415 9.657 ( -3.298 9.872 7.079) 12.588 9.762 ( -2.467 5.575 6.806) 9.137 10.173 ( -5.168 1.354 -0.372) 5.356 10.248 ( 1.405 7.291 -5.938) 9.508 10.602 ( 0.732 3.041 -4.650) 5.605 10.652 ( 1.687 3.816 -6.274) 7.535 10.974 ( 6.710 -1.391 2.379) 7.254 11.089 ( 1.645 -0.843 -3.289) 3.773 12.033 ( 4.361 -0.069 8.958) 9.964 12.326 ( 1.897 -8.472 -1.621) 8.832 12.446 ( -0.604 -3.767 12.171) 12.755 12.645 ( -1.552 -5.914 2.321) 6.540 12.961 ( 1.330 2.491 -0.008) 2.824 13.117 ( -1.550 -1.992 3.525) 4.336 13.507 ( 8.512 4.779 2.116) 9.989 13.682 ( 5.596 0.087 1.281) 5.742 14.081 ( 2.541 1.676 4.253) 5.230 14.302 ( -3.252 6.531 -7.377) 10.375 14.482 ( -9.449 -7.447 4.588) 12.876 14.939 ( -6.998 -8.156 -7.525) 13.119 19.120 ( 12.893 12.993 -1.027) 18.333 19.336 ( 6.245 9.319 -1.738) 11.351 19.685 ( 4.279 -3.306 5.882) 7.990 20.142 ( 3.769 -7.529 0.373) 8.428 21.408 ( -0.814 4.407 0.438) 4.503 21.920 ( -13.588 -7.552 2.390) 15.728 22.045 ( -1.308 12.159 -8.122) 14.681 22.942 ( -17.745 -13.949 -9.677) 24.558 23.752 ( 2.739 1.381 1.656) 3.486 23.808 ( -1.782 0.877 0.145) 1.991 24.354 ( -2.523 1.379 -0.820) 2.990 24.619 ( -2.742 -6.642 -3.126) 7.836 ======================= Grid point 142 (76/116) ======================= q-point: (-0.12 0.29 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.541 ( -19.018 15.296 9.830) 26.311 1.796 ( -3.940 16.421 17.018) 23.975 2.052 ( -12.171 10.588 -6.448) 17.373 2.294 ( -12.964 13.125 20.094) 27.279 2.549 ( -1.817 -2.439 6.256) 6.956 2.639 ( -4.419 -5.413 0.079) 6.988 2.871 ( -2.790 -7.436 -7.264) 10.763 2.940 ( -8.746 -6.833 7.063) 13.156 3.223 ( -3.204 4.173 -0.844) 5.328 3.315 ( 1.653 2.949 5.093) 6.113 3.387 ( 6.097 -1.418 3.558) 7.201 3.538 ( 0.258 3.026 4.398) 5.344 3.738 ( 6.836 2.272 -0.763) 7.244 3.799 ( -4.885 1.247 1.253) 5.195 3.919 ( -3.020 3.514 -5.690) 7.338 4.106 ( -9.017 -0.376 -2.673) 9.412 4.198 ( 9.369 1.138 -1.917) 9.630 4.262 ( 4.649 2.697 -5.799) 7.907 4.551 ( 0.633 -1.340 -0.322) 1.516 4.701 ( -1.620 -9.703 -3.341) 10.389 4.732 ( -1.167 1.509 -4.723) 5.094 4.953 ( 2.630 -2.735 -7.555) 8.454 5.365 ( -0.741 0.586 1.095) 1.446 5.378 ( -1.455 3.855 2.007) 4.584 5.882 ( -1.571 -1.623 -2.577) 3.427 6.028 ( -4.435 -1.709 0.644) 4.796 6.092 ( -0.746 1.805 -3.146) 3.703 6.176 ( 4.190 1.308 -1.505) 4.640 6.380 ( 0.938 -0.063 -2.189) 2.382 6.515 ( 2.856 -1.061 0.397) 3.073 6.687 ( -5.660 0.740 -3.506) 6.699 6.844 ( -3.862 1.158 -0.801) 4.110 7.187 ( -5.793 -3.183 3.491) 7.475 7.363 ( -1.905 -9.083 2.407) 9.588 7.440 ( -3.029 -7.016 -2.657) 8.091 7.589 ( 0.839 -6.776 -1.444) 6.978 8.295 ( 0.801 4.417 -1.952) 4.896 8.476 ( -0.757 2.600 -3.714) 4.597 8.637 ( -5.066 0.844 -0.506) 5.161 8.790 ( 0.698 -0.919 -2.985) 3.200 9.615 ( -2.997 7.894 6.964) 10.946 9.748 ( -1.148 7.696 6.034) 9.847 10.097 ( -2.388 4.527 -0.713) 5.168 10.243 ( 0.184 7.858 -8.603) 11.653 10.595 ( -0.120 3.972 -4.546) 6.038 10.649 ( 0.187 3.879 -5.593) 6.809 11.075 ( -1.984 -2.893 0.737) 3.585 11.103 ( 5.352 -3.634 0.970) 6.541 12.157 ( 4.103 2.096 6.278) 7.787 12.371 ( 2.681 -6.445 3.236) 7.694 12.490 ( 1.603 -8.633 8.687) 12.351 12.632 ( -0.594 -7.913 4.028) 8.900 13.058 ( 8.392 -0.447 6.161) 10.420 13.087 ( -2.027 -1.638 5.007) 5.645 13.712 ( 7.398 1.609 -1.604) 7.739 13.759 ( 4.690 1.840 1.395) 5.227 14.132 ( 1.321 -0.395 3.777) 4.020 14.226 ( -4.423 -0.479 -2.486) 5.096 14.307 ( -6.116 3.029 0.449) 6.840 14.742 ( -10.268 -6.963 -8.020) 14.773 19.300 ( 1.552 10.720 2.926) 11.220 19.495 ( 13.507 16.976 -8.642) 23.352 19.830 ( 7.304 -3.250 6.629) 10.385 20.217 ( 6.246 -1.650 -2.892) 7.078 21.450 ( 5.578 -0.442 -1.496) 5.792 21.699 ( -8.853 -5.358 -0.744) 10.375 21.982 ( -2.745 7.391 -5.485) 9.604 22.477 ( -27.056 -8.237 -6.605) 29.043 23.767 ( -1.771 0.503 2.589) 3.177 23.810 ( 1.804 0.074 0.494) 1.872 24.315 ( -0.670 0.633 -1.257) 1.559 24.509 ( -7.554 -4.994 -2.248) 9.330 ======================= Grid point 143 (77/116) ======================= q-point: ( 0.00 0.43 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.712 ( -1.770 18.097 4.891) 18.830 2.011 ( -0.858 -5.066 -2.298) 5.628 2.173 ( 1.453 15.067 14.937) 21.266 2.279 ( -3.650 1.481 3.170) 5.056 2.379 ( -3.342 -3.323 11.605) 12.525 2.494 ( 3.130 -12.842 -0.692) 13.236 2.800 ( 2.208 3.156 6.288) 7.374 2.848 ( 3.568 -2.114 6.062) 7.346 3.273 ( -5.660 8.861 1.649) 10.643 3.419 ( -3.699 -2.650 8.817) 9.921 3.493 ( 4.062 4.035 2.587) 6.283 3.561 ( -1.869 1.698 -0.492) 2.573 3.690 ( -7.528 -1.232 0.024) 7.628 3.708 ( -9.311 -1.794 -3.744) 10.194 3.967 ( 2.614 4.862 -2.753) 6.169 4.073 ( 4.179 -3.906 -0.267) 5.726 4.320 ( 3.837 -0.486 -3.484) 5.205 4.373 ( 2.282 -4.624 -4.147) 6.617 4.509 ( 5.519 0.002 -2.446) 6.037 4.564 ( 9.697 -2.809 -1.225) 10.170 4.717 ( -3.537 7.139 -8.193) 11.428 4.873 ( -1.410 -5.755 -10.055) 11.671 5.398 ( 2.779 0.769 -1.386) 3.199 5.419 ( 1.869 -0.527 -2.381) 3.073 5.769 ( -7.196 2.116 2.991) 8.075 5.857 ( -7.130 -4.948 2.963) 9.170 6.298 ( 4.429 4.501 -2.741) 6.884 6.322 ( 7.417 4.187 -7.739) 11.508 6.468 ( -6.065 4.030 1.128) 7.369 6.566 ( 11.189 2.009 -1.463) 11.462 6.639 ( -0.649 -6.421 -0.854) 6.509 6.651 ( -1.044 -3.220 -1.668) 3.773 7.069 ( -3.289 1.808 4.090) 5.551 7.160 ( -0.860 -6.833 3.748) 7.841 7.404 ( 2.934 2.245 -4.684) 5.965 7.496 ( 4.120 -6.122 -3.882) 8.338 8.379 ( -1.411 3.593 -1.178) 4.036 8.438 ( -2.526 -1.655 -3.098) 4.326 8.618 ( -1.224 4.260 1.032) 4.551 8.718 ( 0.272 -4.810 -1.635) 5.088 9.724 ( -2.227 5.779 8.677) 10.660 9.812 ( -2.312 -1.610 7.403) 7.921 10.241 ( 0.689 8.162 -1.569) 8.340 10.342 ( 1.434 0.251 -6.116) 6.287 10.670 ( 0.317 3.919 -5.961) 7.140 10.688 ( 0.173 2.059 -6.240) 6.573 10.992 ( -2.155 -0.149 3.749) 4.326 11.058 ( -0.257 -5.511 1.634) 5.754 12.281 ( -2.382 5.150 2.824) 6.338 12.369 ( -0.880 -2.257 9.473) 9.778 12.411 ( 4.280 -3.105 1.534) 5.506 12.461 ( 2.473 -7.335 7.196) 10.568 13.083 ( 0.884 1.499 4.542) 4.864 13.141 ( 3.509 -4.041 5.474) 7.656 13.725 ( -4.234 3.965 -2.009) 6.139 13.826 ( -2.487 -5.168 -1.459) 5.918 14.108 ( -2.660 1.595 3.163) 4.429 14.135 ( -1.767 -0.809 3.163) 3.712 14.409 ( 3.572 3.623 -5.287) 7.338 14.490 ( 2.109 -4.142 -7.028) 8.426 19.482 ( -5.135 9.332 5.756) 12.107 19.641 ( -5.099 -5.264 6.511) 9.803 20.146 ( 8.156 10.561 -10.961) 17.268 20.323 ( 7.583 -6.084 -9.273) 13.435 21.535 ( 5.428 0.832 -4.028) 6.811 21.578 ( 8.354 -3.099 -5.172) 10.302 21.956 ( -10.134 1.208 0.502) 10.218 21.975 ( -10.234 -0.502 0.228) 10.249 23.780 ( -0.393 1.927 3.271) 3.817 23.817 ( 0.456 -1.512 1.933) 2.496 24.327 ( 0.048 0.492 -0.769) 0.915 24.343 ( -1.658 -0.918 -1.050) 2.167 ======================= Grid point 144 (78/116) ======================= q-point: ( 0.12 0.43 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.834 ( 10.552 14.809 4.712) 18.784 2.127 ( 10.082 -10.037 1.007) 14.262 2.257 ( 3.450 8.227 11.843) 14.827 2.331 ( 8.946 9.491 1.247) 13.102 2.413 ( 3.723 -0.904 11.244) 11.879 2.629 ( 8.916 -11.073 0.308) 14.220 2.878 ( 2.623 6.104 3.447) 7.485 2.941 ( 1.960 0.893 13.229) 13.403 3.202 ( -0.213 4.494 -1.073) 4.626 3.322 ( -5.320 -3.021 3.681) 7.140 3.451 ( -10.064 0.148 0.895) 10.104 3.487 ( -7.948 -2.960 0.488) 8.495 3.588 ( 2.496 4.693 1.274) 5.465 3.661 ( 3.183 -1.061 -0.228) 3.363 4.019 ( 1.754 5.123 -4.701) 7.171 4.149 ( 4.023 -4.651 -3.206) 6.935 4.279 ( -2.965 -1.061 -1.594) 3.530 4.333 ( -0.388 -4.308 -2.886) 5.200 4.620 ( -2.992 6.140 -6.923) 9.725 4.725 ( 4.991 0.496 -3.208) 5.953 4.759 ( 9.512 0.309 -2.943) 9.961 4.846 ( 7.027 -2.190 -6.948) 10.122 5.469 ( 4.013 0.379 -2.848) 4.936 5.475 ( 5.214 -1.014 -2.128) 5.722 5.679 ( -2.935 0.511 3.469) 4.573 5.757 ( -3.963 -5.766 5.171) 8.700 6.180 ( -9.096 4.651 -5.193) 11.460 6.279 ( -8.557 -4.267 -4.938) 10.762 6.507 ( 4.926 5.772 -1.236) 7.689 6.567 ( 1.487 0.060 -3.312) 3.631 6.775 ( 7.652 0.155 -1.438) 7.787 6.829 ( 9.621 -3.910 0.745) 10.411 7.064 ( 1.973 4.096 2.707) 5.291 7.191 ( 2.791 -7.746 2.724) 8.672 7.479 ( 6.366 3.440 -4.431) 8.485 7.583 ( 5.846 -6.008 -4.250) 9.399 8.349 ( -1.410 2.398 -0.651) 2.857 8.390 ( -1.279 -1.419 -3.033) 3.584 8.626 ( 1.633 4.809 1.380) 5.263 8.732 ( 1.491 -4.798 -1.110) 5.145 9.723 ( -0.563 5.634 8.812) 10.475 9.801 ( -0.979 -0.978 7.282) 7.413 10.244 ( 0.423 7.446 -0.957) 7.519 10.362 ( 2.152 -1.800 -4.533) 5.331 10.629 ( -2.061 7.611 -6.380) 10.143 10.698 ( 2.134 1.998 -6.352) 6.992 10.953 ( -3.029 0.011 3.535) 4.656 11.028 ( -2.843 -6.280 1.442) 7.043 12.218 ( -4.322 4.036 3.088) 6.671 12.326 ( -3.676 -6.347 2.653) 7.800 12.498 ( 3.315 -0.191 4.499) 5.591 12.532 ( 1.291 -3.603 7.390) 8.322 13.108 ( -0.423 1.269 3.386) 3.641 13.169 ( -2.819 -4.017 2.326) 5.431 13.646 ( -3.353 3.755 2.357) 5.559 13.743 ( -3.829 -5.199 0.205) 6.460 14.061 ( -3.118 0.537 2.443) 3.997 14.083 ( -2.221 -1.328 1.013) 2.779 14.513 ( 7.537 4.090 -4.273) 9.581 14.608 ( 9.774 -5.014 -6.663) 12.848 19.370 ( -7.303 8.815 3.701) 12.031 19.515 ( -9.028 -4.075 4.072) 10.710 20.116 ( -7.901 8.153 -7.097) 13.389 20.265 ( -9.865 -6.076 -4.709) 12.506 21.701 ( 11.237 4.007 -8.401) 14.591 21.769 ( 3.949 1.110 -1.961) 4.547 21.873 ( 12.751 -1.082 -3.528) 13.274 21.953 ( 5.042 -5.422 3.728) 8.289 23.788 ( 0.039 2.432 3.117) 3.954 23.835 ( 0.830 -2.000 1.747) 2.782 24.313 ( 0.406 3.645 -0.951) 3.789 24.380 ( 3.832 -2.703 -0.452) 4.711 ======================= Grid point 145 (79/116) ======================= q-point: ( 0.25 0.43 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.062 ( 10.796 9.826 4.055) 15.151 2.281 ( 5.914 -9.304 4.744) 12.003 2.417 ( 5.621 4.755 10.683) 12.974 2.485 ( 1.782 1.409 10.533) 10.775 2.571 ( 8.223 11.434 5.350) 15.065 2.762 ( 3.074 -4.310 -1.607) 5.532 2.933 ( 6.209 5.022 3.258) 8.625 3.003 ( 1.591 0.018 10.074) 10.199 3.197 ( -4.247 1.650 -2.806) 5.351 3.264 ( -2.696 -3.460 -2.662) 5.131 3.348 ( 2.028 -2.002 -1.355) 3.155 3.373 ( -1.439 -4.226 1.623) 4.750 3.677 ( 5.847 5.282 4.955) 9.308 3.733 ( 3.569 0.887 1.407) 3.937 3.990 ( -1.154 3.420 -3.862) 5.286 4.140 ( -2.936 -9.475 -1.137) 9.985 4.337 ( 7.859 4.332 -3.961) 9.809 4.404 ( 7.181 -2.345 -4.625) 8.857 4.544 ( -1.619 5.211 -7.135) 8.982 4.658 ( -2.702 -4.807 -6.781) 8.740 4.957 ( 6.514 6.084 -0.735) 8.944 5.012 ( 8.727 1.472 -0.984) 8.904 5.534 ( 2.819 -0.197 -0.654) 2.901 5.560 ( 3.419 -3.447 0.305) 4.864 5.685 ( 2.902 0.400 0.574) 2.985 5.745 ( 1.188 -4.776 2.346) 5.452 6.019 ( -5.226 2.227 -3.822) 6.847 6.109 ( -6.339 -5.842 -4.884) 9.908 6.510 ( -2.439 5.648 -0.756) 6.199 6.602 ( 0.269 -1.844 -3.516) 3.980 6.855 ( 1.110 2.748 -0.427) 2.994 6.941 ( 2.556 -4.185 -0.156) 4.906 7.137 ( 3.782 4.683 1.146) 6.128 7.268 ( 4.010 -7.531 0.784) 8.568 7.599 ( 6.084 3.166 -3.808) 7.845 7.680 ( 5.245 -4.204 -4.393) 8.030 8.320 ( -1.286 2.577 -0.686) 2.960 8.368 ( -0.175 -1.674 -3.179) 3.597 8.682 ( 3.181 3.648 1.999) 5.237 8.764 ( 1.861 -3.744 -0.184) 4.186 9.756 ( 1.211 5.602 9.005) 10.674 9.822 ( 0.750 0.021 7.839) 7.875 10.264 ( 1.847 5.405 0.330) 5.722 10.383 ( 0.364 -4.945 -1.103) 5.079 10.565 ( -2.017 11.267 -6.611) 13.218 10.713 ( 0.939 -0.702 -8.044) 8.129 10.902 ( -2.482 1.970 1.981) 3.737 10.991 ( -0.537 -4.695 -0.221) 4.731 12.144 ( -3.963 3.980 1.916) 5.935 12.261 ( -3.311 -7.208 0.132) 7.933 12.545 ( -0.666 0.213 5.826) 5.867 12.575 ( 2.117 -2.116 5.257) 6.049 13.057 ( -5.438 0.366 -0.573) 5.480 13.092 ( -3.393 -2.559 0.735) 4.313 13.598 ( -3.398 5.265 4.380) 7.645 13.681 ( -3.978 -2.557 2.974) 5.587 14.001 ( -2.232 3.453 2.582) 4.855 14.127 ( 4.612 -8.607 3.241) 10.289 14.630 ( 5.457 5.680 -4.881) 9.266 14.767 ( 8.150 -7.157 -7.102) 12.964 19.240 ( -6.762 7.047 1.512) 9.883 19.336 ( -9.780 -0.753 0.806) 9.842 19.886 ( -12.199 4.514 0.248) 13.010 20.022 ( -12.534 -7.397 -1.126) 14.598 21.775 ( 0.824 8.888 5.158) 10.309 21.892 ( 8.144 1.178 -3.715) 9.029 22.125 ( 11.806 -1.669 -1.140) 11.977 22.251 ( 22.139 -10.002 -12.455) 27.300 23.795 ( -0.310 2.934 2.686) 3.990 23.857 ( 0.761 -2.740 1.525) 3.227 24.342 ( 2.537 6.669 -0.422) 7.148 24.462 ( 4.442 -4.544 -0.732) 6.397 ======================= Grid point 146 (80/116) ======================= q-point: ( 0.38 0.43 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.249 ( 5.834 6.784 4.227) 9.896 2.372 ( -5.442 0.556 10.185) 11.560 2.438 ( 2.777 3.267 7.247) 8.421 2.518 ( 0.808 -3.173 4.600) 5.646 2.688 ( 2.178 10.224 10.285) 14.665 2.822 ( 2.956 -1.029 4.099) 5.157 3.039 ( -0.816 1.663 1.776) 2.567 3.063 ( 1.540 -0.678 0.744) 1.840 3.100 ( -1.484 1.905 0.295) 2.433 3.197 ( -3.120 -5.095 -3.489) 6.918 3.418 ( 4.729 -2.291 -2.111) 5.663 3.435 ( 6.106 -3.249 -0.077) 6.917 3.767 ( 0.988 4.999 -0.213) 5.100 3.824 ( 4.149 1.145 4.641) 6.330 4.022 ( 5.022 -0.266 0.614) 5.066 4.095 ( -1.115 -7.998 1.843) 8.283 4.425 ( 2.004 2.820 -10.119) 10.694 4.438 ( -1.143 1.302 -10.397) 10.540 4.604 ( 7.484 3.168 -2.816) 8.601 4.659 ( 4.514 -1.924 -2.650) 5.576 5.025 ( 1.201 7.736 0.343) 7.837 5.124 ( 2.967 -0.187 -1.253) 3.226 5.566 ( 0.021 -0.136 2.301) 2.305 5.617 ( 2.209 -4.394 0.417) 4.936 5.740 ( 1.409 1.047 -2.092) 2.731 5.795 ( 3.845 -3.131 -1.194) 5.100 5.977 ( 1.199 -0.481 -2.284) 2.624 6.039 ( 0.823 -5.416 -3.411) 6.453 6.442 ( -3.665 5.813 1.377) 7.009 6.550 ( -3.874 -3.812 0.169) 5.437 6.835 ( -2.095 5.078 -3.323) 6.420 6.939 ( -2.082 -3.991 -3.362) 5.618 7.208 ( 3.260 3.720 1.704) 5.232 7.326 ( 1.586 -7.186 0.386) 7.369 7.652 ( 0.401 3.941 -3.217) 5.103 7.743 ( 2.085 -4.476 -4.698) 6.815 8.307 ( 0.480 3.559 -0.557) 3.634 8.371 ( 1.656 -2.016 -2.662) 3.727 8.738 ( 1.536 2.270 2.393) 3.638 8.793 ( 0.829 -2.591 0.462) 2.759 9.817 ( 1.897 5.584 9.804) 11.441 9.867 ( 0.849 1.168 8.783) 8.900 10.313 ( 2.419 0.986 1.622) 3.075 10.355 ( -2.737 -1.853 0.668) 3.372 10.535 ( 0.765 7.793 -6.353) 10.084 10.671 ( -2.101 -3.710 -7.337) 8.487 10.902 ( 2.337 6.334 -1.749) 6.974 10.999 ( 1.352 -2.152 -3.013) 3.942 12.082 ( -3.003 4.141 1.262) 5.269 12.203 ( -2.516 -7.332 -1.252) 7.852 12.532 ( -2.134 2.774 5.181) 6.253 12.613 ( -0.019 -4.684 3.170) 5.656 12.977 ( -1.518 2.562 0.203) 2.985 13.044 ( -1.876 -3.831 1.191) 4.429 13.535 ( -3.727 4.203 2.881) 6.313 13.596 ( -5.417 -1.724 2.331) 6.144 14.010 ( 1.569 7.807 5.420) 9.632 14.232 ( 4.244 -12.624 5.235) 14.311 14.688 ( 2.254 7.699 -6.022) 10.031 14.866 ( 4.409 -8.768 -7.587) 12.405 19.123 ( -5.739 5.877 0.869) 8.260 19.182 ( -4.809 1.165 -1.787) 5.261 19.704 ( -7.214 1.382 4.359) 8.541 19.825 ( -7.061 -8.765 0.561) 11.269 21.797 ( -0.746 11.588 5.785) 12.973 22.008 ( 3.702 -5.456 1.673) 6.802 22.324 ( 9.216 7.481 -6.265) 13.422 22.596 ( 16.792 -15.116 -13.160) 26.147 23.792 ( -0.777 3.764 2.659) 4.673 23.869 ( 0.072 -3.130 1.041) 3.299 24.396 ( 2.845 7.304 0.296) 7.844 24.532 ( 2.905 -5.117 -1.564) 6.089 ======================= Grid point 147 (81/116) ======================= q-point: (-0.50 0.43 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.241 ( -7.078 5.356 10.900) 14.057 2.254 ( -7.152 6.099 9.810) 13.587 2.544 ( 5.782 3.620 2.694) 7.334 2.632 ( 7.264 -3.974 0.009) 8.280 2.734 ( 0.060 8.333 8.363) 11.806 2.846 ( -1.303 -0.767 5.049) 5.271 2.981 ( -5.205 0.650 3.587) 6.354 3.057 ( -2.545 -4.766 3.176) 6.267 3.072 ( -1.526 0.074 -0.148) 1.535 3.153 ( -0.386 -5.267 -4.383) 6.863 3.494 ( 2.967 3.140 -0.827) 4.399 3.549 ( 4.554 -1.874 3.237) 5.893 3.785 ( 1.830 0.854 -2.037) 2.868 3.825 ( -4.090 -1.262 2.109) 4.772 4.116 ( 1.300 -1.551 3.631) 4.157 4.127 ( 3.759 -1.720 1.827) 4.519 4.362 ( -2.759 2.225 -12.823) 13.304 4.391 ( -1.112 -0.762 -11.678) 11.756 4.699 ( 2.315 2.428 -2.311) 4.074 4.729 ( 1.301 -0.110 -1.901) 2.307 5.003 ( -3.653 8.085 1.007) 8.929 5.123 ( -2.748 -1.666 -1.121) 3.404 5.542 ( -3.136 1.644 1.589) 3.881 5.616 ( -2.754 -3.994 0.376) 4.866 5.761 ( 2.477 2.802 -1.688) 4.103 5.863 ( 3.493 -5.403 -2.176) 6.792 6.009 ( 2.409 0.988 -3.208) 4.132 6.097 ( 4.873 -6.310 -3.833) 8.846 6.414 ( -0.086 5.071 4.319) 6.661 6.507 ( -1.001 -3.318 3.442) 4.884 6.779 ( -1.280 5.036 -5.183) 7.339 6.868 ( -2.961 -2.872 -4.928) 6.427 7.265 ( 1.893 0.996 1.713) 2.741 7.334 ( -0.735 -5.812 1.233) 5.986 7.612 ( -2.979 4.742 -3.394) 6.549 7.724 ( -2.282 -5.784 -4.330) 7.577 8.340 ( 3.005 4.775 -1.475) 5.831 8.415 ( 3.571 -1.687 -2.949) 4.929 8.756 ( -0.185 1.039 2.862) 3.050 8.793 ( -1.027 -1.912 1.118) 2.441 9.872 ( 0.198 5.237 10.924) 12.116 9.891 ( -1.164 2.689 9.215) 9.670 10.298 ( -2.302 1.302 0.077) 2.646 10.351 ( -0.355 -3.867 1.962) 4.351 10.541 ( 2.070 5.242 -5.782) 8.074 10.633 ( 0.802 -2.471 -6.931) 7.402 10.955 ( 3.150 5.880 -3.632) 7.595 11.015 ( 1.601 0.079 -4.600) 4.871 12.035 ( -2.306 4.097 1.670) 4.989 12.156 ( -1.918 -7.274 -1.379) 7.648 12.502 ( -2.377 3.509 4.954) 6.519 12.596 ( -2.033 -5.232 1.972) 5.949 12.998 ( 2.109 1.047 1.845) 2.992 13.024 ( -0.356 -1.633 1.020) 1.958 13.492 ( -1.782 1.593 2.724) 3.624 13.514 ( -2.182 -0.581 1.397) 2.656 14.070 ( 2.173 8.935 7.068) 11.598 14.305 ( 1.363 -12.634 5.677) 13.918 14.684 ( -0.488 9.248 -6.914) 11.557 14.893 ( 0.794 -9.845 -7.994) 12.707 19.059 ( -0.142 7.193 0.472) 7.209 19.153 ( 2.361 -0.878 -2.599) 3.619 19.626 ( -2.568 1.859 5.531) 6.375 19.764 ( 0.126 -9.903 1.193) 9.976 21.767 ( -4.200 12.524 4.970) 14.113 22.026 ( -2.980 -10.816 4.088) 11.941 22.429 ( 3.986 14.973 -8.762) 17.800 22.797 ( 7.619 -18.527 -12.299) 23.507 23.784 ( -0.715 4.607 2.903) 5.492 23.866 ( -0.713 -2.590 0.756) 2.791 24.441 ( 1.395 5.704 0.733) 5.917 24.560 ( 0.557 -4.894 -2.334) 5.451 ======================= Grid point 148 (82/116) ======================= q-point: (-0.38 0.43 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.135 ( -6.718 7.543 13.499) 16.860 2.176 ( -4.168 6.147 10.348) 12.738 2.602 ( -0.938 7.021 0.367) 7.093 2.683 ( -6.903 6.524 4.081) 10.338 2.730 ( -0.246 -5.477 3.284) 6.390 2.821 ( -6.480 -4.637 -1.699) 8.147 2.889 ( -3.879 1.233 6.458) 7.634 2.998 ( -1.415 -8.659 4.266) 9.756 3.102 ( 3.890 -0.472 1.839) 4.329 3.135 ( 0.418 -3.401 -2.420) 4.195 3.541 ( 2.546 5.648 -0.154) 6.197 3.604 ( -0.855 0.321 5.205) 5.285 3.736 ( -4.432 4.848 3.386) 7.390 3.822 ( 1.908 -2.961 -0.456) 3.552 4.103 ( -3.535 0.673 2.555) 4.413 4.164 ( -0.906 -3.741 -1.555) 4.151 4.265 ( -2.225 3.269 -13.570) 14.134 4.338 ( -0.435 -4.042 -10.752) 11.495 4.642 ( -7.739 2.302 -3.368) 8.749 4.689 ( -3.757 -1.868 -3.124) 5.231 4.928 ( -3.488 6.630 2.387) 7.862 5.023 ( -6.311 -1.173 0.855) 6.476 5.474 ( -3.610 2.658 0.643) 4.529 5.543 ( -4.030 -2.580 -0.077) 4.786 5.830 ( 4.731 2.201 -0.811) 5.281 5.917 ( 2.772 -4.996 -1.210) 5.840 6.046 ( 2.892 3.426 -5.444) 7.052 6.170 ( 3.797 -7.781 -6.052) 10.563 6.415 ( -2.413 3.431 3.808) 5.665 6.478 ( -3.702 -1.969 2.087) 4.684 6.795 ( 3.616 2.537 -1.871) 4.797 6.838 ( 1.749 -0.931 -3.331) 3.876 7.282 ( -0.754 -1.380 1.417) 2.117 7.308 ( -2.574 -4.498 2.302) 5.670 7.532 ( -3.963 4.401 -3.734) 7.001 7.644 ( -4.672 -5.946 -3.498) 8.331 8.391 ( 2.521 5.717 -3.248) 7.042 8.475 ( 3.292 -1.422 -3.932) 5.322 8.752 ( -1.182 -0.272 2.479) 2.760 8.768 ( -1.621 -1.087 1.985) 2.784 9.867 ( -3.399 5.133 9.487) 11.310 9.897 ( -1.614 3.423 10.346) 11.016 10.256 ( -2.323 1.852 0.126) 2.973 10.329 ( -0.926 -2.413 -1.160) 2.833 10.590 ( 4.192 2.652 -5.282) 7.246 10.650 ( 2.670 -1.437 -6.249) 6.946 10.977 ( 0.417 4.932 -2.460) 5.527 11.043 ( 2.199 -1.039 -4.736) 5.324 12.012 ( -0.359 3.765 3.191) 4.948 12.130 ( -0.074 -7.313 -0.396) 7.324 12.469 ( -2.856 2.971 6.052) 7.322 12.558 ( -2.553 -5.212 2.758) 6.426 13.008 ( -0.026 2.162 0.094) 2.165 13.058 ( 1.684 -2.293 1.268) 3.115 13.491 ( 2.264 3.232 2.715) 4.790 13.549 ( 4.077 -1.945 2.491) 5.159 14.123 ( 1.016 7.412 6.753) 10.079 14.316 ( -1.893 -10.279 5.109) 11.634 14.630 ( -2.893 9.701 -7.142) 12.389 14.850 ( -2.743 -10.454 -8.250) 13.596 19.135 ( 8.031 8.400 -0.115) 11.622 19.255 ( 8.863 -1.917 -2.477) 9.400 19.634 ( 1.451 4.827 5.362) 7.359 19.819 ( 4.804 -11.162 1.158) 12.207 21.669 ( -6.919 11.364 3.348) 13.719 21.919 ( -8.961 -11.842 3.792) 15.326 22.426 ( -1.380 17.086 -9.345) 19.523 22.808 ( -2.809 -18.724 -11.003) 21.898 23.785 ( -0.150 4.084 2.945) 5.037 23.847 ( -1.464 -1.446 1.021) 2.297 24.446 ( -1.227 3.888 0.299) 4.088 24.543 ( -1.468 -4.960 -2.202) 5.621 ======================= Grid point 149 (83/116) ======================= q-point: (-0.25 0.43 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.065 ( -6.223 11.229 15.156) 19.862 2.139 ( -3.666 9.750 10.548) 14.825 2.440 ( -14.416 -3.911 2.922) 15.220 2.539 ( -10.011 -2.495 0.394) 10.324 2.598 ( -10.663 1.760 2.195) 11.028 2.712 ( -5.159 1.593 2.641) 6.010 2.817 ( -2.912 0.062 2.064) 3.570 2.943 ( -7.487 -11.547 0.701) 13.780 3.211 ( 7.262 0.983 3.374) 8.068 3.226 ( 6.108 -0.124 3.611) 7.097 3.542 ( -4.452 8.507 2.259) 9.864 3.604 ( 1.701 3.746 2.986) 5.083 3.707 ( 0.902 6.060 5.703) 8.370 3.851 ( -0.285 -6.113 1.547) 6.312 4.033 ( -1.845 0.768 -0.707) 2.120 4.081 ( -3.606 -1.562 -9.350) 10.142 4.234 ( 0.897 0.960 -7.606) 7.718 4.294 ( -3.244 -4.238 -9.373) 10.786 4.476 ( -4.960 1.977 -2.094) 5.735 4.576 ( -5.368 -6.679 -3.475) 9.246 4.882 ( -2.317 5.038 0.898) 5.617 4.939 ( -2.405 -0.255 -0.124) 2.422 5.417 ( -2.375 2.417 -0.075) 3.390 5.468 ( -3.581 -1.400 -0.419) 3.868 5.914 ( 3.455 3.306 -1.029) 4.891 5.990 ( 5.703 -2.815 -1.165) 6.466 6.081 ( 2.250 2.257 -5.600) 6.443 6.168 ( -2.926 -5.390 -6.803) 9.160 6.378 ( -0.342 0.255 1.827) 1.876 6.407 ( -2.430 -1.709 0.233) 2.980 6.838 ( -0.824 2.296 0.842) 2.581 6.876 ( 0.895 -0.709 -0.404) 1.212 7.241 ( -4.220 -2.078 2.266) 5.221 7.250 ( -3.932 -4.058 3.456) 6.623 7.446 ( -3.280 2.600 -4.751) 6.332 7.534 ( -5.083 -5.135 -3.793) 8.160 8.412 ( 0.776 6.056 -3.655) 7.116 8.506 ( 1.102 -1.853 -4.742) 5.209 8.720 ( -2.763 0.391 2.016) 3.443 8.750 ( -1.097 -1.933 1.258) 2.553 9.815 ( -4.534 5.801 8.631) 11.345 9.881 ( -3.042 1.478 9.427) 10.015 10.220 ( -0.753 5.188 -0.892) 5.318 10.327 ( 1.125 -1.570 -3.182) 3.722 10.647 ( 3.043 2.108 -5.845) 6.919 10.687 ( 2.760 -0.513 -5.960) 6.588 10.985 ( 1.359 2.291 0.033) 2.664 11.047 ( -0.593 -2.919 -2.773) 4.070 12.062 ( 4.657 3.148 5.312) 7.734 12.166 ( 3.750 -6.440 1.442) 7.591 12.426 ( -3.647 1.987 7.514) 8.586 12.515 ( -3.017 -5.786 3.829) 7.566 13.019 ( 1.196 2.784 0.155) 3.033 13.074 ( -0.261 -2.312 1.267) 2.649 13.599 ( 7.503 3.813 2.677) 8.831 13.662 ( 6.327 -2.007 2.463) 7.080 14.144 ( -0.705 4.450 5.023) 6.748 14.264 ( -4.656 -6.530 3.748) 8.853 14.535 ( -4.703 8.829 -6.448) 11.902 14.738 ( -6.150 -10.035 -8.204) 14.347 19.344 ( 11.996 8.154 0.648) 14.519 19.457 ( 11.757 -1.180 -1.319) 11.890 19.713 ( 5.890 8.403 3.201) 10.749 19.942 ( 7.750 -11.037 -0.851) 13.513 21.544 ( -5.949 8.128 1.139) 10.137 21.734 ( -10.106 -9.400 1.626) 13.898 22.323 ( -6.489 13.939 -8.159) 17.406 22.630 ( -12.268 -14.956 -8.993) 21.332 23.792 ( -0.083 1.989 2.717) 3.368 23.819 ( -1.737 -0.277 1.730) 2.467 24.401 ( -2.966 3.200 -0.683) 4.416 24.491 ( -3.318 -5.300 -1.400) 6.408 ======================= Grid point 150 (84/116) ======================= q-point: (-0.12 0.43 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.881 ( -14.950 16.356 7.491) 23.391 2.122 ( -1.223 14.383 12.317) 18.976 2.179 ( -13.290 -7.228 1.813) 15.237 2.379 ( -4.058 -6.220 2.611) 7.872 2.418 ( -8.778 2.777 8.178) 12.314 2.585 ( -8.902 -5.014 1.399) 10.312 2.797 ( -0.121 -0.939 -1.573) 1.836 2.801 ( -4.537 -3.117 7.877) 9.610 3.323 ( 1.975 3.056 4.229) 5.579 3.364 ( 5.962 -0.931 5.588) 8.224 3.454 ( -3.655 10.725 2.129) 11.529 3.620 ( -2.099 0.154 2.128) 2.993 3.780 ( -0.274 1.389 -0.257) 1.439 3.813 ( -0.021 0.395 4.850) 4.866 3.981 ( -3.302 2.695 -6.829) 8.050 4.053 ( -1.622 -3.936 -2.660) 5.020 4.201 ( 3.752 0.910 -5.912) 7.061 4.260 ( 5.365 -3.109 -6.068) 8.676 4.468 ( 2.304 -2.712 -1.749) 3.965 4.513 ( -0.697 -6.572 -3.296) 7.385 4.820 ( -4.233 5.382 -3.581) 7.727 4.909 ( -0.264 -2.517 -5.699) 6.236 5.384 ( -0.741 1.367 -0.864) 1.779 5.416 ( -1.256 -0.729 -0.682) 1.605 5.910 ( -5.581 3.858 -0.614) 6.813 5.987 ( -5.967 -2.703 -1.060) 6.636 6.137 ( 5.996 2.928 -3.101) 7.358 6.191 ( 9.386 -0.942 -2.248) 9.698 6.397 ( 3.700 1.540 -2.408) 4.675 6.453 ( 5.736 -3.687 -1.254) 6.933 6.736 ( -9.267 3.528 0.501) 9.929 6.817 ( -7.214 -3.416 0.195) 7.984 7.147 ( -5.574 -0.134 3.987) 6.854 7.194 ( -3.303 -5.037 4.319) 7.412 7.393 ( -0.393 1.092 -5.426) 5.548 7.464 ( -0.103 -5.057 -4.267) 6.617 8.404 ( -0.493 5.313 -2.625) 5.947 8.489 ( -1.323 -1.934 -4.252) 4.855 8.663 ( -3.401 2.206 1.645) 4.375 8.730 ( -0.941 -3.672 -0.693) 3.853 9.757 ( -3.867 5.907 8.444) 11.007 9.844 ( -3.263 -0.897 8.147) 8.822 10.225 ( 1.227 8.055 -1.633) 8.310 10.338 ( 1.058 -0.531 -5.110) 5.245 10.669 ( 1.273 3.197 -5.888) 6.820 10.705 ( 0.837 0.487 -6.488) 6.560 11.019 ( -1.615 -1.682 1.011) 2.542 11.029 ( 2.332 -2.614 1.624) 3.861 12.211 ( 7.808 2.637 5.224) 9.758 12.273 ( 5.934 -3.101 3.768) 7.683 12.381 ( -3.149 -0.546 9.006) 9.556 12.468 ( -2.931 -6.989 3.983) 8.562 13.060 ( 2.723 0.347 2.590) 3.775 13.069 ( -0.431 -0.483 2.963) 3.033 13.749 ( 4.459 1.927 -0.273) 4.865 13.778 ( 5.469 -0.360 1.619) 5.715 14.135 ( -1.057 0.983 3.612) 3.890 14.175 ( -4.847 -2.571 2.596) 6.070 14.429 ( -3.523 6.666 -5.589) 9.385 14.580 ( -6.931 -7.651 -7.722) 12.892 19.503 ( 2.173 8.298 5.379) 10.125 19.638 ( 4.593 -3.576 4.046) 7.088 19.916 ( 15.314 10.985 -6.197) 19.839 20.121 ( 12.268 -7.415 -6.484) 15.733 21.480 ( 0.092 3.239 -1.268) 3.480 21.578 ( -5.303 -5.636 -1.093) 7.816 22.141 ( -9.721 7.650 -4.998) 13.342 22.305 ( -18.197 -7.911 -5.208) 20.514 23.787 ( -1.226 1.174 2.807) 3.280 23.807 ( -0.026 -0.527 2.183) 2.246 24.345 ( -2.087 2.313 -1.008) 3.274 24.412 ( -4.179 -3.976 -1.072) 5.867 ======================= Grid point 175 (85/116) ======================= q-point: ( 0.00 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.155 ( -7.999 0.000 14.991) 16.992 1.377 ( 4.430 0.000 -1.041) 4.551 1.664 ( 2.814 0.000 11.249) 11.595 2.033 ( 1.285 0.000 -18.762) 18.806 2.644 ( 2.283 0.000 29.007) 29.097 2.841 ( -5.535 0.000 2.397) 6.032 2.928 ( 2.565 0.000 -1.878) 3.179 3.067 ( -4.791 0.000 -8.258) 9.547 3.220 ( -1.709 0.000 4.865) 5.156 3.315 ( -0.233 0.000 1.149) 1.173 3.473 ( -0.540 0.000 -6.877) 6.898 3.526 ( 4.686 0.000 -5.650) 7.340 3.644 ( -5.309 0.000 8.306) 9.858 3.754 ( 2.145 0.000 -1.383) 2.552 3.911 ( -0.943 0.000 3.913) 4.025 3.990 ( -6.537 0.000 -3.098) 7.234 4.242 ( 13.218 0.000 0.301) 13.221 4.246 ( -5.792 0.000 -0.487) 5.813 4.387 ( 8.983 0.000 5.156) 10.358 4.528 ( -1.854 0.000 -7.358) 7.588 4.824 ( -7.805 0.000 2.273) 8.129 4.929 ( 2.414 0.000 -7.674) 8.045 5.354 ( 0.043 0.000 4.286) 4.286 5.432 ( 2.835 0.000 -2.957) 4.097 5.851 ( -3.099 0.000 -1.235) 3.336 5.898 ( 5.431 0.000 -5.553) 7.768 6.147 ( 1.742 0.000 2.576) 3.109 6.166 ( -2.388 0.000 1.480) 2.810 6.403 ( -5.744 0.000 1.331) 5.896 6.453 ( 4.716 0.000 -3.093) 5.640 6.642 ( -7.368 0.000 3.887) 8.330 6.720 ( 8.270 0.000 -3.668) 9.047 7.350 ( 0.705 0.000 3.816) 3.881 7.423 ( -4.607 0.000 -3.250) 5.638 7.931 ( -1.057 0.000 5.173) 5.280 7.987 ( 1.165 0.000 -0.413) 1.236 8.225 ( 1.270 0.000 2.353) 2.674 8.320 ( -1.010 0.000 4.306) 4.423 8.324 ( -1.617 0.000 -7.153) 7.334 8.436 ( 1.582 0.000 -5.981) 6.187 9.477 ( 1.104 0.000 3.954) 4.106 9.587 ( -0.440 0.000 -6.436) 6.451 9.684 ( -2.713 0.000 6.597) 7.133 9.819 ( 0.582 0.000 -6.299) 6.326 10.515 ( 0.062 0.000 1.533) 1.534 10.547 ( 0.423 0.000 -1.720) 1.771 11.157 ( -3.008 0.000 2.700) 4.042 11.208 ( 2.210 0.000 -2.140) 3.076 12.294 ( -2.217 0.000 6.847) 7.197 12.416 ( 1.370 0.000 -4.983) 5.168 12.813 ( -0.213 0.000 1.783) 1.796 12.832 ( -0.220 0.000 0.264) 0.343 13.310 ( 3.634 0.000 6.310) 7.282 13.441 ( -7.190 0.000 -6.538) 9.718 14.003 ( 13.591 0.000 1.821) 13.713 14.027 ( -20.102 0.000 -0.278) 20.104 14.081 ( 0.440 0.000 1.041) 1.130 14.126 ( 10.193 0.000 -2.938) 10.608 14.438 ( -23.625 0.000 2.784) 23.788 14.491 ( 29.902 0.000 -2.263) 29.988 18.902 ( 3.946 0.000 2.849) 4.867 18.949 ( -4.375 0.000 -1.656) 4.678 20.114 ( -14.191 0.000 8.086) 16.333 20.289 ( 19.704 0.000 -8.580) 21.491 21.655 ( -7.465 0.000 1.434) 7.602 21.688 ( 3.445 0.000 -1.999) 3.983 21.859 ( 20.834 0.000 1.943) 20.925 21.915 ( -23.880 0.000 -3.140) 24.085 23.789 ( -1.584 0.000 0.699) 1.732 23.806 ( 2.018 0.000 -1.013) 2.258 24.328 ( -10.330 0.000 1.359) 10.419 24.349 ( 5.925 0.000 -0.738) 5.971 ======================= Grid point 176 (86/116) ======================= q-point: ( 0.12 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.401 ( 24.401 0.000 8.024) 25.686 1.572 ( 9.020 0.000 13.429) 16.177 1.925 ( 23.528 0.000 -3.273) 23.755 2.027 ( 3.814 0.000 -18.212) 18.607 2.770 ( 0.498 0.000 29.078) 29.083 2.822 ( 1.827 0.000 -0.869) 2.023 2.938 ( -5.489 0.000 -3.934) 6.753 3.056 ( 9.747 0.000 -1.740) 9.901 3.214 ( 0.373 0.000 3.663) 3.682 3.246 ( -8.116 0.000 5.303) 9.695 3.480 ( 4.083 0.000 -5.365) 6.742 3.536 ( -4.050 0.000 4.412) 5.989 3.594 ( 3.301 0.000 0.075) 3.302 3.676 ( -5.579 0.000 0.127) 5.581 3.886 ( -4.217 0.000 3.141) 5.258 3.913 ( -3.630 0.000 -2.747) 4.552 4.259 ( 9.364 0.000 -1.416) 9.471 4.387 ( 1.969 0.000 -4.512) 4.923 4.476 ( -1.252 0.000 -10.643) 10.716 4.567 ( 1.604 0.000 3.643) 3.980 4.710 ( 0.422 0.000 3.745) 3.769 4.938 ( 0.283 0.000 -2.687) 2.702 5.402 ( 3.943 0.000 1.678) 4.285 5.503 ( 6.025 0.000 -5.350) 8.058 5.854 ( 2.739 0.000 -3.168) 4.188 5.994 ( 3.345 0.000 -3.831) 5.086 6.111 ( -3.766 0.000 1.195) 3.951 6.210 ( 5.560 0.000 1.404) 5.734 6.299 ( -5.398 0.000 2.071) 5.782 6.521 ( 2.172 0.000 -2.138) 3.047 6.582 ( 1.649 0.000 0.246) 1.667 6.847 ( 4.443 0.000 -4.327) 6.202 7.338 ( -3.060 0.000 -0.271) 3.072 7.352 ( -1.829 0.000 6.561) 6.811 7.982 ( 4.032 0.000 3.456) 5.310 8.028 ( 1.660 0.000 0.444) 1.719 8.230 ( -1.097 0.000 5.895) 5.996 8.292 ( 1.266 0.000 -7.969) 8.069 8.357 ( 2.886 0.000 3.465) 4.510 8.473 ( 4.171 0.000 -6.773) 7.954 9.539 ( 3.816 0.000 4.383) 5.812 9.599 ( 3.775 0.000 -7.167) 8.100 9.674 ( -0.744 0.000 8.641) 8.672 9.828 ( 2.114 0.000 -4.600) 5.062 10.517 ( -0.104 0.000 1.198) 1.203 10.540 ( -0.638 0.000 -2.329) 2.415 11.078 ( -5.835 0.000 3.214) 6.662 11.202 ( -2.383 0.000 -1.562) 2.849 12.273 ( -2.206 0.000 7.468) 7.787 12.444 ( 3.115 0.000 -4.595) 5.552 12.798 ( -2.414 0.000 3.291) 4.082 12.818 ( -1.112 0.000 -0.526) 1.230 13.270 ( -9.219 0.000 -2.997) 9.694 13.385 ( 0.401 0.000 8.540) 8.550 13.665 ( -14.488 0.000 0.797) 14.510 13.884 ( -20.165 0.000 -4.812) 20.731 14.028 ( -4.403 0.000 -1.170) 4.556 14.200 ( 0.498 0.000 0.038) 0.500 14.452 ( 18.295 0.000 -1.749) 18.379 14.983 ( 19.468 0.000 -8.399) 21.202 18.871 ( -2.773 0.000 -2.372) 3.649 18.965 ( 0.828 0.000 4.327) 4.405 19.915 ( -6.895 0.000 2.584) 7.363 20.543 ( 5.488 0.000 -7.575) 9.354 21.519 ( -7.899 0.000 -1.959) 8.138 21.540 ( -5.380 0.000 2.428) 5.903 21.928 ( 16.745 0.000 -5.372) 17.586 22.304 ( 22.449 0.000 8.342) 23.949 23.758 ( -1.850 0.000 -0.092) 1.853 23.836 ( 1.200 0.000 -0.799) 1.442 24.180 ( -5.239 0.000 4.997) 7.240 24.464 ( 5.266 0.000 1.946) 5.614 ======================= Grid point 177 (87/116) ======================= q-point: ( 0.25 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.758 ( 5.872 0.000 14.916) 16.030 1.879 ( 19.292 0.000 -5.772) 20.137 2.077 ( 6.615 0.000 -11.432) 13.208 2.358 ( 15.417 0.000 -10.696) 18.764 2.805 ( 2.287 0.000 3.266) 3.988 2.818 ( -2.799 0.000 24.226) 24.387 2.964 ( 4.097 0.000 3.220) 5.211 3.088 ( -6.087 0.000 2.976) 6.776 3.172 ( 2.848 0.000 -2.885) 4.054 3.301 ( 4.004 0.000 9.153) 9.991 3.545 ( 1.324 0.000 -3.601) 3.837 3.584 ( 7.776 0.000 8.257) 11.342 3.644 ( 4.151 0.000 5.056) 6.541 3.709 ( 9.198 0.000 -4.003) 10.032 3.810 ( -4.633 0.000 4.426) 6.407 3.895 ( 4.767 0.000 -8.847) 10.049 4.325 ( -2.146 0.000 -8.266) 8.540 4.343 ( -5.873 0.000 0.483) 5.893 4.504 ( -1.823 0.000 2.854) 3.386 4.538 ( 10.102 0.000 -6.798) 12.176 4.825 ( 5.837 0.000 -0.980) 5.919 4.917 ( -1.877 0.000 -0.793) 2.038 5.503 ( 5.807 0.000 -0.756) 5.856 5.625 ( 7.691 0.000 -5.767) 9.612 5.897 ( 2.033 0.000 -2.503) 3.225 5.972 ( -4.054 0.000 -0.757) 4.124 6.041 ( -3.009 0.000 0.490) 3.049 6.194 ( -6.076 0.000 4.159) 7.363 6.350 ( 7.021 0.000 -1.306) 7.141 6.506 ( -3.106 0.000 -2.042) 3.717 6.669 ( 5.504 0.000 -2.974) 6.256 6.842 ( -2.990 0.000 -4.390) 5.312 7.317 ( 1.030 0.000 -0.320) 1.078 7.335 ( -1.661 0.000 6.705) 6.908 8.019 ( -2.593 0.000 1.282) 2.892 8.035 ( -0.425 0.000 2.167) 2.208 8.269 ( 2.949 0.000 8.915) 9.390 8.345 ( 6.439 0.000 -8.465) 10.636 8.415 ( 1.646 0.000 2.877) 3.314 8.544 ( 4.999 0.000 -8.180) 9.587 9.623 ( 2.162 0.000 6.462) 6.814 9.687 ( 7.603 0.000 -8.646) 11.514 9.719 ( 3.247 0.000 8.974) 9.544 9.867 ( 2.553 0.000 -2.762) 3.761 10.509 ( -1.569 0.000 -2.879) 3.279 10.523 ( 0.571 0.000 0.921) 1.084 10.965 ( -6.456 0.000 3.018) 7.127 11.105 ( -7.150 0.000 -1.122) 7.238 12.254 ( -2.278 0.000 8.581) 8.879 12.495 ( 2.980 0.000 -6.463) 7.117 12.732 ( -5.689 0.000 5.679) 8.038 12.803 ( 0.350 0.000 0.488) 0.600 13.054 ( -11.830 0.000 -2.772) 12.150 13.307 ( -7.526 0.000 2.801) 8.030 13.558 ( -0.281 0.000 3.830) 3.840 13.573 ( -8.693 0.000 -4.669) 9.868 13.938 ( -4.044 0.000 0.115) 4.045 14.204 ( -0.409 0.000 -3.442) 3.466 14.760 ( 13.685 0.000 -0.991) 13.721 15.187 ( 5.302 0.000 -6.819) 8.638 18.835 ( -0.067 0.000 -3.512) 3.513 18.947 ( -4.019 0.000 6.041) 7.256 19.884 ( 3.304 0.000 -1.969) 3.846 20.469 ( -9.209 0.000 2.213) 9.471 21.456 ( -4.310 0.000 3.217) 5.378 21.462 ( 1.003 0.000 -8.624) 8.682 22.356 ( 28.048 0.000 -11.882) 30.461 22.722 ( 16.225 0.000 14.349) 21.660 23.717 ( -2.015 0.000 -1.415) 2.462 23.843 ( -0.412 0.000 -0.118) 0.429 24.166 ( 2.056 0.000 4.537) 4.981 24.540 ( 1.478 0.000 2.828) 3.191 ======================= Grid point 178 (88/116) ======================= q-point: ( 0.38 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.852 ( -1.324 0.000 12.536) 12.606 2.043 ( 5.153 0.000 -15.828) 16.646 2.194 ( 4.075 0.000 -0.359) 4.091 2.399 ( -1.700 0.000 -8.081) 8.258 2.860 ( 0.268 0.000 19.418) 19.420 2.870 ( -4.380 0.000 5.352) 6.916 3.019 ( 9.745 0.000 2.896) 10.166 3.186 ( 0.065 0.000 -3.990) 3.991 3.211 ( 9.875 0.000 3.925) 10.626 3.346 ( -1.071 0.000 8.187) 8.257 3.557 ( 0.806 0.000 0.068) 0.809 3.684 ( -4.024 0.000 -2.380) 4.675 3.790 ( 8.972 0.000 0.513) 8.987 3.809 ( 3.905 0.000 14.121) 14.651 3.945 ( 14.610 0.000 -3.297) 14.977 4.023 ( 9.049 0.000 -6.844) 11.346 4.214 ( -6.547 0.000 2.236) 6.918 4.260 ( -1.284 0.000 -6.962) 7.080 4.524 ( 1.304 0.000 2.784) 3.075 4.682 ( 6.192 0.000 -9.318) 11.188 4.876 ( -1.512 0.000 -0.045) 1.512 4.905 ( 3.048 0.000 -2.675) 4.056 5.594 ( 3.565 0.000 -2.545) 4.380 5.703 ( -1.367 0.000 -2.243) 2.627 5.870 ( -4.103 0.000 0.513) 4.135 5.895 ( -0.066 0.000 -4.144) 4.144 6.059 ( 5.352 0.000 -1.233) 5.492 6.132 ( -1.076 0.000 7.542) 7.618 6.397 ( -7.193 0.000 -2.424) 7.590 6.415 ( -0.498 0.000 -2.890) 2.933 6.731 ( 1.745 0.000 -2.284) 2.874 6.754 ( -3.607 0.000 -1.931) 4.091 7.332 ( -0.457 0.000 4.492) 4.515 7.357 ( 2.607 0.000 -1.628) 3.074 7.974 ( -1.432 0.000 0.854) 1.668 8.006 ( -2.417 0.000 2.228) 3.287 8.343 ( 1.009 0.000 8.357) 8.417 8.444 ( 0.701 0.000 3.502) 3.571 8.455 ( 6.581 0.000 -8.116) 10.449 8.598 ( 2.965 0.000 -9.213) 9.678 9.660 ( -0.324 0.000 9.147) 9.153 9.821 ( 7.835 0.000 -10.523) 13.119 9.822 ( 3.257 0.000 8.171) 8.796 9.899 ( 2.377 0.000 -2.127) 3.190 10.482 ( 0.361 0.000 -2.939) 2.961 10.541 ( 0.540 0.000 0.523) 0.752 10.862 ( -4.697 0.000 2.111) 5.150 10.938 ( -8.795 0.000 -0.819) 8.833 12.240 ( -1.825 0.000 9.774) 9.943 12.495 ( -0.313 0.000 -8.927) 8.932 12.636 ( -5.500 0.000 7.387) 9.210 12.796 ( -4.352 0.000 -3.502) 5.586 12.917 ( 2.312 0.000 1.920) 3.005 13.199 ( -4.278 0.000 -1.536) 4.545 13.487 ( -0.958 0.000 -0.449) 1.058 13.553 ( -2.001 0.000 2.602) 3.282 13.898 ( -0.300 0.000 3.850) 3.861 14.162 ( -2.296 0.000 -6.038) 6.460 14.969 ( 8.463 0.000 -0.520) 8.479 15.195 ( -1.852 0.000 -3.828) 4.252 18.848 ( 2.626 0.000 -4.545) 5.249 18.869 ( -5.370 0.000 6.200) 8.202 20.000 ( 8.678 0.000 -3.583) 9.388 20.276 ( -11.346 0.000 5.564) 12.637 21.393 ( -3.327 0.000 3.767) 5.026 21.464 ( 1.732 0.000 -9.049) 9.214 22.847 ( 25.644 0.000 -14.953) 29.685 22.961 ( 2.253 0.000 17.363) 17.508 23.690 ( 0.583 0.000 -2.569) 2.634 23.813 ( -2.865 0.000 -0.186) 2.871 24.270 ( 7.322 0.000 2.236) 7.655 24.532 ( -2.966 0.000 1.362) 3.264 ======================= Grid point 179 (89/116) ======================= q-point: (-0.50 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.799 ( -6.903 0.000 13.822) 15.449 2.062 ( 1.070 0.000 -9.038) 9.101 2.226 ( -0.217 0.000 3.876) 3.882 2.317 ( -5.222 0.000 -4.151) 6.670 2.882 ( 3.967 0.000 6.338) 7.477 2.911 ( 1.066 0.000 6.545) 6.631 3.154 ( -2.850 0.000 -1.121) 3.063 3.194 ( 7.222 0.000 -2.332) 7.589 3.350 ( 0.058 0.000 1.796) 1.797 3.371 ( 6.471 0.000 0.204) 6.474 3.566 ( 0.221 0.000 1.925) 1.937 3.599 ( -3.285 0.000 -1.614) 3.660 3.797 ( -8.818 0.000 12.159) 15.020 3.934 ( 3.429 0.000 0.592) 3.479 4.104 ( -4.943 0.000 2.215) 5.417 4.148 ( 5.593 0.000 -3.092) 6.391 4.159 ( 4.119 0.000 -1.689) 4.452 4.217 ( -2.282 0.000 -6.099) 6.512 4.539 ( -1.267 0.000 6.300) 6.426 4.690 ( -2.522 0.000 -8.528) 8.893 4.885 ( 2.166 0.000 -1.251) 2.501 4.922 ( 0.178 0.000 -4.437) 4.440 5.590 ( -6.751 0.000 2.168) 7.091 5.629 ( 0.900 0.000 0.442) 1.002 5.807 ( -1.938 0.000 2.841) 3.439 5.934 ( 3.143 0.000 -7.032) 7.703 6.190 ( 6.722 0.000 2.902) 7.322 6.225 ( -8.982 0.000 -2.947) 9.454 6.228 ( 9.151 0.000 2.519) 9.492 6.349 ( -3.010 0.000 -6.341) 7.020 6.719 ( -0.267 0.000 0.309) 0.408 6.735 ( -0.646 0.000 -1.096) 1.272 7.334 ( -0.926 0.000 3.224) 3.354 7.390 ( 1.577 0.000 -2.386) 2.860 7.974 ( -0.905 0.000 0.683) 1.134 7.990 ( 2.948 0.000 -0.419) 2.978 8.349 ( -3.031 0.000 8.478) 9.003 8.461 ( -0.269 0.000 4.250) 4.258 8.514 ( 1.383 0.000 -7.493) 7.619 8.607 ( 1.256 0.000 -9.380) 9.464 9.662 ( -2.952 0.000 11.001) 11.390 9.850 ( -0.318 0.000 -6.345) 6.353 9.864 ( -0.540 0.000 5.050) 5.079 9.994 ( 6.289 0.000 -8.137) 10.284 10.507 ( -4.523 0.000 -0.014) 4.523 10.520 ( 3.433 0.000 -1.368) 3.696 10.818 ( 0.653 0.000 1.106) 1.284 10.833 ( -0.382 0.000 -0.253) 0.458 12.246 ( -0.769 0.000 11.078) 11.105 12.455 ( -0.562 0.000 -8.996) 9.013 12.592 ( -1.011 0.000 8.205) 8.267 12.724 ( -0.441 0.000 -4.609) 4.630 13.025 ( 5.714 0.000 3.929) 6.934 13.105 ( -5.137 0.000 -3.554) 6.247 13.500 ( 1.771 0.000 1.719) 2.468 13.504 ( -3.393 0.000 1.859) 3.869 13.945 ( 3.175 0.000 6.004) 6.792 14.091 ( -2.725 0.000 -7.490) 7.970 15.090 ( 4.203 0.000 0.374) 4.219 15.117 ( -5.004 0.000 -2.380) 5.541 18.794 ( -4.010 0.000 5.472) 6.784 18.905 ( 4.676 0.000 -5.172) 6.973 20.079 ( -10.701 0.000 5.863) 12.202 20.171 ( 9.589 0.000 -2.915) 10.022 21.351 ( -2.250 0.000 3.972) 4.565 21.476 ( 2.265 0.000 -8.063) 8.375 22.893 ( -13.587 0.000 15.169) 20.365 23.218 ( 16.927 0.000 -15.400) 22.884 23.724 ( -6.265 0.000 0.093) 6.266 23.734 ( 3.780 0.000 -0.776) 3.859 24.439 ( 9.266 0.000 -1.051) 9.325 24.446 ( -5.459 0.000 -1.305) 5.612 ======================= Grid point 180 (90/116) ======================= q-point: (-0.38 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.702 ( -7.637 0.000 16.289) 17.990 2.040 ( -2.039 0.000 -0.271) 2.057 2.182 ( -8.045 0.000 0.041) 8.045 2.218 ( -2.091 0.000 4.982) 5.403 2.979 ( 6.306 0.000 -2.691) 6.856 3.009 ( 6.188 0.000 5.139) 8.044 3.058 ( -7.218 0.000 -2.031) 7.499 3.246 ( 0.050 0.000 -10.274) 10.274 3.286 ( -9.572 0.000 -2.440) 9.878 3.460 ( 2.027 0.000 -2.673) 3.354 3.499 ( -10.025 0.000 6.365) 11.875 3.610 ( 3.605 0.000 4.869) 6.058 3.675 ( -0.910 0.000 8.179) 8.229 3.861 ( -11.738 0.000 3.737) 12.319 3.987 ( -8.068 0.000 -1.663) 8.237 4.087 ( -5.447 0.000 -7.616) 9.363 4.122 ( -5.219 0.000 3.921) 6.528 4.295 ( 9.368 0.000 -6.842) 11.600 4.515 ( -3.568 0.000 6.945) 7.808 4.571 ( -6.856 0.000 -3.058) 7.507 4.898 ( -0.850 0.000 -2.259) 2.414 4.917 ( 1.161 0.000 -3.958) 4.125 5.507 ( -3.371 0.000 4.260) 5.432 5.597 ( -5.792 0.000 7.321) 9.335 5.858 ( 6.287 0.000 -0.284) 6.294 5.954 ( 1.176 0.000 -6.287) 6.396 6.071 ( -5.263 0.000 -2.100) 5.666 6.306 ( 0.981 0.000 -8.385) 8.442 6.329 ( 5.472 0.000 4.359) 6.996 6.398 ( 6.095 0.000 -1.785) 6.351 6.715 ( -0.311 0.000 1.824) 1.850 6.719 ( -0.380 0.000 -1.167) 1.228 7.309 ( -2.411 0.000 3.242) 4.041 7.421 ( 2.896 0.000 -3.981) 4.922 7.988 ( 2.310 0.000 -0.670) 2.405 8.063 ( 4.176 0.000 -2.675) 4.960 8.276 ( -6.848 0.000 8.739) 11.103 8.454 ( -1.930 0.000 4.447) 4.848 8.482 ( -1.728 0.000 -5.740) 5.994 8.580 ( -1.576 0.000 -8.707) 8.849 9.603 ( -5.991 0.000 10.152) 11.788 9.813 ( -1.454 0.000 -5.982) 6.156 9.860 ( -0.834 0.000 1.742) 1.931 10.010 ( -2.396 0.000 -9.424) 9.724 10.441 ( -0.820 0.000 1.167) 1.426 10.552 ( -0.011 0.000 -0.623) 0.623 10.897 ( 5.902 0.000 -1.300) 6.043 10.917 ( 8.349 0.000 1.142) 8.427 12.277 ( 0.254 0.000 12.013) 12.016 12.428 ( 0.406 0.000 -8.238) 8.248 12.664 ( 6.269 0.000 9.219) 11.148 12.745 ( 3.228 0.000 -3.216) 4.557 12.983 ( -5.769 0.000 -4.090) 7.072 13.147 ( 6.464 0.000 3.031) 7.139 13.445 ( -3.240 0.000 3.817) 5.007 13.558 ( 3.438 0.000 1.645) 3.811 14.021 ( -2.157 0.000 -7.245) 7.559 14.039 ( 4.365 0.000 5.466) 6.995 14.986 ( -8.171 0.000 -2.367) 8.507 15.132 ( -0.492 0.000 2.264) 2.317 18.754 ( -1.596 0.000 4.496) 4.770 18.988 ( 5.216 0.000 -5.127) 7.314 19.912 ( -7.705 0.000 4.768) 9.061 20.334 ( 7.361 0.000 -0.014) 7.361 21.334 ( -0.453 0.000 3.353) 3.383 21.504 ( 2.946 0.000 -6.921) 7.521 22.578 ( -21.802 0.000 11.062) 24.448 23.336 ( -2.996 0.000 -17.927) 18.176 23.633 ( -0.113 0.000 2.716) 2.718 23.798 ( 2.330 0.000 0.915) 2.504 24.335 ( -4.771 0.000 -3.556) 5.951 24.590 ( 6.469 0.000 -4.707) 8.001 ======================= Grid point 181 (91/116) ======================= q-point: (-0.25 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.601 ( -8.249 0.000 17.477) 19.326 1.940 ( -11.198 0.000 4.192) 11.957 1.983 ( -13.573 0.000 0.199) 13.574 2.177 ( -3.483 0.000 1.353) 3.736 2.766 ( -20.856 0.000 7.174) 22.055 3.068 ( -6.198 0.000 -4.976) 7.948 3.102 ( -0.979 0.000 3.661) 3.790 3.167 ( 12.087 0.000 -4.970) 13.069 3.186 ( 0.805 0.000 -9.866) 9.899 3.368 ( -7.178 0.000 11.329) 13.412 3.414 ( -6.239 0.000 -3.355) 7.084 3.606 ( -10.914 0.000 0.586) 10.929 3.663 ( -1.269 0.000 2.629) 2.919 3.744 ( 4.377 0.000 -0.719) 4.435 3.795 ( -7.836 0.000 -2.285) 8.163 4.036 ( 4.079 0.000 -10.257) 11.038 4.097 ( 0.571 0.000 11.215) 11.229 4.330 ( -7.427 0.000 -0.751) 7.465 4.429 ( -7.212 0.000 4.256) 8.374 4.563 ( 9.212 0.000 -2.805) 9.630 4.855 ( -1.987 0.000 -4.147) 4.599 4.937 ( 1.416 0.000 -2.697) 3.046 5.457 ( -3.372 0.000 3.744) 5.039 5.485 ( -7.347 0.000 7.398) 10.426 5.916 ( -2.484 0.000 -5.106) 5.678 5.968 ( 3.638 0.000 -0.285) 3.649 6.049 ( 2.154 0.000 -0.530) 2.218 6.331 ( 3.865 0.000 -7.519) 8.454 6.331 ( -6.046 0.000 0.441) 6.062 6.468 ( 2.497 0.000 1.707) 3.025 6.673 ( -3.541 0.000 -2.961) 4.616 6.759 ( 2.469 0.000 3.332) 4.147 7.285 ( -0.493 0.000 2.997) 3.038 7.472 ( 3.560 0.000 -6.197) 7.147 8.037 ( 1.371 0.000 -0.218) 1.389 8.094 ( -0.698 0.000 -3.568) 3.636 8.169 ( -5.269 0.000 7.828) 9.436 8.413 ( -3.547 0.000 4.271) 5.552 8.429 ( -2.104 0.000 -5.326) 5.727 8.511 ( -2.338 0.000 -7.087) 7.463 9.520 ( -4.753 0.000 7.027) 8.483 9.750 ( -3.553 0.000 -6.057) 7.023 9.825 ( -3.555 0.000 1.075) 3.714 9.904 ( -3.820 0.000 -8.348) 9.181 10.466 ( 1.898 0.000 1.468) 2.400 10.541 ( -0.313 0.000 -0.910) 0.962 11.021 ( 7.004 0.000 -2.365) 7.392 11.081 ( 6.936 0.000 1.134) 7.028 12.313 ( -0.469 0.000 10.831) 10.841 12.418 ( 0.853 0.000 -7.253) 7.303 12.798 ( 2.338 0.000 -0.788) 2.467 12.830 ( 0.880 0.000 -1.111) 1.417 12.960 ( 11.928 0.000 6.421) 13.547 13.327 ( 12.361 0.000 0.240) 12.363 13.430 ( 1.506 0.000 8.821) 8.948 13.621 ( 2.175 0.000 -1.543) 2.666 13.976 ( -0.207 0.000 -3.819) 3.824 14.130 ( 3.334 0.000 3.615) 4.917 14.773 ( -13.470 0.000 -2.661) 13.730 15.068 ( -7.791 0.000 4.725) 9.111 18.762 ( 1.192 0.000 3.503) 3.700 19.052 ( 2.113 0.000 -3.855) 4.396 19.843 ( 0.520 0.000 2.003) 2.070 20.426 ( 0.275 0.000 5.696) 5.703 21.368 ( 4.052 0.000 0.924) 4.156 21.549 ( 3.701 0.000 -5.791) 6.872 22.175 ( -21.273 0.000 6.197) 22.157 23.032 ( -20.824 0.000 -14.609) 25.437 23.701 ( 4.156 0.000 -0.396) 4.175 23.823 ( 0.065 0.000 1.339) 1.341 24.260 ( -1.391 0.000 -4.361) 4.577 24.633 ( -0.637 0.000 -6.728) 6.759 ======================= Grid point 182 (92/116) ======================= q-point: (-0.12 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.468 ( -10.342 0.000 8.759) 13.552 1.549 ( -29.294 0.000 10.826) 31.231 1.711 ( -11.012 0.000 4.680) 11.965 2.091 ( -2.201 0.000 -14.092) 14.263 2.566 ( -4.129 0.000 23.680) 24.037 2.959 ( -3.771 0.000 -4.420) 5.810 2.997 ( -8.925 0.000 2.422) 9.248 3.175 ( -4.000 0.000 -7.687) 8.665 3.260 ( -4.705 0.000 8.113) 9.379 3.297 ( 0.096 0.000 -0.532) 0.540 3.403 ( 10.058 0.000 -4.178) 10.891 3.496 ( -0.659 0.000 -5.769) 5.807 3.661 ( 2.154 0.000 1.123) 2.429 3.687 ( -2.118 0.000 0.360) 2.148 3.898 ( 11.094 0.000 -0.063) 11.094 4.035 ( -5.617 0.000 -8.207) 9.945 4.187 ( 2.818 0.000 8.296) 8.761 4.254 ( 1.640 0.000 6.797) 6.992 4.276 ( -6.904 0.000 3.746) 7.854 4.635 ( -4.123 0.000 -3.932) 5.698 4.865 ( 6.301 0.000 -9.970) 11.795 4.928 ( -2.493 0.000 -1.416) 2.867 5.383 ( -4.780 0.000 6.252) 7.870 5.414 ( -1.048 0.000 1.230) 1.616 5.869 ( -0.390 0.000 -4.786) 4.802 5.955 ( -4.930 0.000 -0.428) 4.949 6.098 ( 2.582 0.000 1.079) 2.798 6.216 ( -4.219 0.000 0.910) 4.316 6.389 ( 3.608 0.000 -5.369) 6.469 6.479 ( -2.161 0.000 2.076) 2.997 6.623 ( 1.407 0.000 -3.375) 3.656 6.761 ( -4.144 0.000 3.614) 5.498 7.311 ( 1.870 0.000 2.511) 3.131 7.494 ( -0.132 0.000 -6.826) 6.828 7.986 ( -5.352 0.000 5.208) 7.468 8.023 ( -4.364 0.000 -1.033) 4.485 8.176 ( 2.512 0.000 2.323) 3.421 8.355 ( -3.369 0.000 4.091) 5.299 8.377 ( -1.272 0.000 -7.610) 7.716 8.454 ( -1.623 0.000 -5.474) 5.709 9.473 ( -1.936 0.000 4.753) 5.132 9.651 ( -3.934 0.000 -6.237) 7.374 9.743 ( -4.825 0.000 3.334) 5.864 9.840 ( -0.741 0.000 -7.316) 7.353 10.500 ( 1.026 0.000 1.637) 1.932 10.541 ( 0.514 0.000 -1.218) 1.322 11.137 ( 5.545 0.000 -2.536) 6.097 11.167 ( 1.528 0.000 1.692) 2.280 12.315 ( -2.054 0.000 7.971) 8.231 12.414 ( 0.781 0.000 -6.098) 6.148 12.810 ( -0.192 0.000 -0.338) 0.388 12.826 ( 0.691 0.000 0.561) 0.890 13.212 ( 6.620 0.000 2.964) 7.253 13.554 ( 1.658 0.000 -7.684) 7.861 13.669 ( 13.105 0.000 0.299) 13.108 13.717 ( 26.238 0.000 11.869) 28.798 14.010 ( 4.197 0.000 0.289) 4.207 14.186 ( 2.245 0.000 1.462) 2.679 14.450 ( -18.876 0.000 -1.868) 18.968 14.840 ( -17.674 0.000 5.604) 18.541 18.818 ( 3.499 0.000 2.771) 4.463 19.032 ( -3.027 0.000 -2.049) 3.655 19.972 ( 12.951 0.000 -2.613) 13.212 20.347 ( -10.950 0.000 10.345) 15.064 21.526 ( 12.978 0.000 -1.477) 13.062 21.611 ( 4.402 0.000 -4.535) 6.320 21.846 ( -13.588 0.000 2.437) 13.805 22.496 ( -29.802 0.000 -10.168) 31.489 23.764 ( 2.746 0.000 -0.975) 2.914 23.814 ( -1.206 0.000 1.179) 1.686 24.264 ( 3.028 0.000 -3.327) 4.499 24.525 ( -8.335 0.000 -4.338) 9.396 ======================= Grid point 183 (93/116) ======================= q-point: ( 0.00 0.14 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.249 ( -5.511 8.913 13.239) 16.884 1.483 ( 4.442 8.423 -7.552) 12.154 1.815 ( -0.668 13.625 15.870) 20.927 2.177 ( 2.394 11.962 -17.043) 20.960 2.669 ( 2.457 1.671 23.568) 23.754 2.781 ( -5.802 -5.176 4.575) 9.021 2.859 ( 1.943 -5.790 -0.569) 6.134 3.065 ( -4.072 -0.124 -5.600) 6.925 3.190 ( -0.794 -2.151 4.604) 5.143 3.335 ( 3.116 1.455 -4.168) 5.404 3.437 ( -1.467 -1.310 -0.250) 1.983 3.555 ( 0.873 1.164 -7.294) 7.438 3.646 ( -6.486 0.595 8.709) 10.875 3.773 ( 3.349 1.749 -2.893) 4.758 3.915 ( -1.910 -0.279 6.708) 6.981 4.039 ( -5.788 3.528 -4.659) 8.225 4.196 ( 12.090 -0.004 4.179) 12.792 4.306 ( -1.265 2.293 -5.440) 6.038 4.431 ( 5.675 3.031 3.721) 7.432 4.556 ( -2.546 2.177 -7.011) 7.770 4.761 ( -7.115 -5.653 1.875) 9.279 4.862 ( 3.361 -5.828 -7.915) 10.387 5.373 ( -0.419 1.600 3.813) 4.156 5.434 ( 3.084 -0.067 -1.850) 3.597 5.860 ( -2.042 0.427 -0.059) 2.087 5.926 ( 3.316 2.522 -5.922) 7.241 6.096 ( 0.334 -3.416 3.148) 4.657 6.146 ( -0.253 -1.583 -1.083) 1.934 6.398 ( -4.066 0.205 2.363) 4.707 6.461 ( 4.179 0.555 -2.766) 5.042 6.673 ( -6.830 1.953 2.235) 7.447 6.726 ( 7.376 0.251 -2.761) 7.880 7.296 ( -2.803 -4.765 4.477) 7.114 7.377 ( -0.736 -3.409 -3.116) 4.677 7.734 ( -1.351 -13.710 3.791) 14.289 7.795 ( 2.711 -11.459 -1.724) 11.901 8.252 ( 1.761 1.616 1.309) 2.725 8.314 ( -1.373 1.413 -4.100) 4.549 8.491 ( -2.102 7.990 3.505) 8.974 8.599 ( 1.085 9.111 -5.905) 10.911 9.561 ( 0.481 7.972 5.882) 9.919 9.689 ( 0.779 7.932 -4.115) 8.970 9.754 ( -3.588 7.642 4.022) 9.352 9.894 ( 0.898 6.381 -7.037) 9.542 10.510 ( -0.812 -0.235 1.518) 1.737 10.551 ( 1.047 0.250 -2.393) 2.624 11.145 ( -2.641 -1.112 2.870) 4.056 11.196 ( 1.878 -1.132 -2.004) 2.971 12.298 ( -1.918 0.297 6.657) 6.935 12.418 ( 1.500 0.079 -4.853) 5.080 12.746 ( -0.426 -5.517 3.299) 6.442 12.794 ( -0.152 -3.655 -0.935) 3.775 13.274 ( 3.001 -3.003 6.438) 7.712 13.411 ( -5.690 -2.876 -6.800) 9.322 13.956 ( 0.902 -6.888 4.354) 8.199 13.992 ( 4.791 -2.946 0.188) 5.627 14.087 ( -6.432 1.693 2.403) 7.072 14.140 ( 6.787 1.591 -1.961) 7.242 14.328 ( -2.389 -4.955 5.633) 7.873 14.477 ( 4.118 -3.173 -7.836) 9.404 19.068 ( -3.105 11.678 1.514) 12.178 19.110 ( 3.228 15.883 -2.717) 16.434 20.094 ( -11.461 -1.950 8.418) 14.353 20.277 ( 16.167 -1.298 -8.983) 18.541 21.605 ( -7.269 -3.721 1.533) 8.309 21.649 ( 7.397 -3.356 -2.784) 8.586 21.891 ( 10.909 2.291 1.479) 11.245 21.932 ( -17.068 1.317 -2.310) 17.274 23.788 ( -0.999 0.302 1.732) 2.022 23.820 ( 1.455 0.898 -1.427) 2.227 24.328 ( -7.170 -0.054 0.954) 7.234 24.346 ( 3.609 -0.248 -0.788) 3.702 ======================= Grid point 184 (94/116) ======================= q-point: ( 0.12 0.14 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.480 ( 21.531 7.218 7.812) 24.014 1.697 ( 12.636 10.013 4.286) 16.682 1.960 ( 13.444 6.517 3.239) 15.288 2.204 ( 6.616 12.277 -15.764) 21.047 2.752 ( 1.812 -3.573 6.730) 7.832 2.801 ( 1.742 0.449 21.109) 21.186 2.916 ( -1.316 -3.571 -3.593) 5.234 3.015 ( 4.831 -1.875 -0.276) 5.190 3.191 ( -0.101 -0.147 -0.811) 0.830 3.311 ( -6.862 4.106 8.439) 11.626 3.434 ( 3.930 -2.395 -7.982) 9.214 3.545 ( -0.521 -0.060 1.256) 1.361 3.567 ( -1.557 -1.491 7.400) 7.708 3.765 ( -0.798 5.238 -1.494) 5.505 3.879 ( -4.965 -0.170 2.735) 5.671 3.929 ( -4.795 1.994 -3.107) 6.052 4.256 ( 6.404 -0.932 -5.211) 8.308 4.406 ( 1.291 2.433 -5.845) 6.461 4.510 ( 1.349 -0.688 1.208) 1.937 4.546 ( -1.654 1.347 -2.693) 3.436 4.689 ( 4.175 -1.683 1.794) 4.846 4.890 ( 1.476 -4.311 -2.693) 5.293 5.411 ( 3.797 0.731 1.176) 4.042 5.509 ( 5.345 0.237 -4.425) 6.943 5.852 ( 1.187 -1.211 -0.504) 1.769 5.955 ( -0.110 -1.719 -3.778) 4.152 6.091 ( -2.320 -2.707 3.063) 4.701 6.195 ( 4.855 -0.262 -4.140) 6.386 6.327 ( -1.988 2.095 3.026) 4.183 6.551 ( -4.297 0.640 -0.280) 4.353 6.601 ( 8.756 2.997 -3.125) 9.768 6.852 ( 4.568 0.378 -3.041) 5.501 7.233 ( -3.434 -5.745 4.893) 8.291 7.380 ( -0.014 -0.306 1.469) 1.501 7.775 ( 4.404 -14.214 1.854) 14.995 7.854 ( 3.288 -10.940 -1.625) 11.538 8.276 ( 0.012 1.238 1.582) 2.009 8.279 ( -0.438 1.397 -4.118) 4.371 8.502 ( 1.899 7.595 4.133) 8.852 8.619 ( 2.556 8.642 -4.883) 10.250 9.604 ( 2.080 6.017 5.866) 8.657 9.704 ( 3.014 9.666 -7.523) 12.614 9.741 ( -0.018 5.856 8.735) 10.516 9.914 ( 3.000 7.718 -5.311) 9.837 10.493 ( -1.196 -1.305 1.165) 2.119 10.561 ( 0.527 0.986 -2.317) 2.573 11.070 ( -5.696 -0.726 3.083) 6.517 11.189 ( -2.328 -1.280 -1.298) 2.957 12.266 ( -3.150 -0.652 6.327) 7.097 12.450 ( 2.936 0.236 -4.431) 5.320 12.730 ( -1.564 -5.996 2.212) 6.579 12.777 ( -2.075 -3.064 1.184) 3.886 13.258 ( -8.489 -1.118 -3.414) 9.217 13.346 ( 1.772 -4.076 7.046) 8.330 13.664 ( -17.211 0.185 1.283) 17.259 13.845 ( -12.512 -2.139 -4.760) 13.556 14.066 ( -6.158 2.403 -0.043) 6.610 14.211 ( 1.755 0.551 0.262) 1.858 14.433 ( 16.868 -1.443 -0.833) 16.950 14.825 ( 18.212 -12.536 -5.719) 22.838 18.978 ( -4.555 9.388 -0.137) 10.436 19.137 ( -1.907 14.276 0.482) 14.411 19.915 ( -6.458 -0.062 2.295) 6.854 20.472 ( 2.765 -6.192 -6.532) 9.416 21.484 ( -2.141 -0.905 -3.407) 4.124 21.627 ( -7.459 5.492 3.478) 9.895 21.898 ( 16.746 -2.783 -5.561) 17.864 22.269 ( 20.019 -3.143 7.730) 21.689 23.774 ( -0.956 1.229 1.173) 1.949 23.838 ( 0.789 0.440 -1.921) 2.123 24.195 ( -4.725 1.454 3.989) 6.352 24.461 ( 5.562 -0.533 1.617) 5.817 ======================= Grid point 185 (95/116) ======================= q-point: ( 0.25 0.14 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.873 ( 10.446 7.920 7.694) 15.200 1.927 ( 12.967 6.822 1.175) 14.699 2.161 ( 6.927 7.176 -8.473) 13.087 2.408 ( 12.223 4.086 -11.089) 17.002 2.796 ( -0.579 0.713 15.350) 15.378 2.865 ( 2.325 1.622 6.633) 7.213 2.922 ( 5.567 -3.418 5.888) 8.794 3.068 ( -5.656 -1.251 3.615) 6.828 3.176 ( 1.188 0.708 -3.813) 4.056 3.279 ( 2.154 -1.466 10.676) 10.989 3.483 ( 3.402 -1.835 -4.897) 6.239 3.601 ( 3.002 -2.998 4.956) 6.524 3.646 ( 8.454 1.844 5.800) 10.417 3.767 ( -2.493 -0.774 6.359) 6.874 3.840 ( 5.569 6.976 -4.152) 9.845 3.887 ( 2.994 -0.161 -8.901) 9.392 4.320 ( -0.228 -0.856 -3.310) 3.426 4.347 ( -4.614 1.041 -7.766) 9.093 4.465 ( 0.661 -2.134 2.598) 3.426 4.619 ( 6.898 5.685 -2.958) 9.416 4.781 ( 2.279 -4.355 -1.731) 5.211 4.911 ( 1.420 -0.261 -0.482) 1.522 5.511 ( 5.837 0.547 -0.810) 5.919 5.617 ( 7.139 -0.704 -5.331) 8.938 5.871 ( -1.259 -4.146 0.822) 4.410 5.926 ( -0.280 -1.011 -2.309) 2.536 6.037 ( -3.149 -1.685 1.807) 4.002 6.181 ( -3.836 -0.773 -0.207) 3.919 6.385 ( 4.194 2.415 0.284) 4.848 6.483 ( -3.019 -1.402 -0.583) 3.379 6.739 ( 5.397 4.586 -4.997) 8.667 6.861 ( -2.197 2.118 -3.465) 4.618 7.218 ( 0.640 -4.759 4.369) 6.492 7.385 ( 0.392 0.908 1.614) 1.893 7.861 ( 1.862 -12.004 1.864) 12.290 7.900 ( 2.377 -9.967 -0.553) 10.261 8.268 ( 0.429 -1.255 -2.673) 2.984 8.287 ( 1.070 1.384 0.996) 2.013 8.567 ( 3.393 7.133 1.713) 8.082 8.661 ( 2.931 7.248 -3.672) 8.638 9.667 ( 2.191 4.180 6.446) 7.989 9.779 ( 6.034 7.957 -1.310) 10.071 9.794 ( 3.865 6.858 2.312) 8.205 9.961 ( 2.491 8.351 -3.493) 9.389 10.476 ( -0.645 -1.565 0.380) 1.734 10.557 ( -0.142 1.455 -1.933) 2.423 10.960 ( -6.220 -0.414 2.780) 6.825 11.098 ( -6.588 -0.727 -0.886) 6.687 12.225 ( -2.957 -2.340 6.959) 7.915 12.475 ( 0.453 -2.629 -6.635) 7.152 12.716 ( -4.983 -1.531 4.961) 7.196 12.733 ( 1.950 -4.817 1.608) 5.440 13.050 ( -11.234 -0.427 -3.081) 11.657 13.378 ( -1.272 1.966 4.221) 4.827 13.393 ( -8.421 -4.791 -1.928) 9.879 13.680 ( -4.231 3.592 -0.341) 5.561 13.957 ( -4.420 1.720 1.142) 4.878 14.236 ( 0.431 2.630 -3.652) 4.521 14.718 ( 12.559 -3.778 -0.241) 13.117 15.049 ( 7.066 -11.726 -5.081) 14.602 18.910 ( -1.951 6.728 -2.188) 7.339 19.048 ( -7.080 8.597 4.238) 11.916 19.877 ( 1.932 -0.737 -1.923) 2.823 20.376 ( -9.183 -7.921 1.320) 12.199 21.487 ( 2.635 2.510 -8.193) 8.965 21.537 ( -3.626 6.947 4.258) 8.919 22.314 ( 26.940 -3.956 -11.487) 29.553 22.647 ( 14.644 -6.768 13.236) 20.868 23.753 ( -1.335 2.660 -0.679) 3.053 23.834 ( -0.789 -0.210 -1.402) 1.623 24.185 ( 2.179 1.936 4.821) 5.633 24.545 ( 2.234 0.050 1.975) 2.982 ======================= Grid point 186 (96/116) ======================= q-point: ( 0.38 0.14 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.977 ( -1.817 11.141 10.406) 15.352 2.094 ( 6.539 4.037 -9.380) 12.126 2.260 ( 4.209 6.471 -2.286) 8.051 2.427 ( -2.526 2.681 -7.891) 8.708 2.843 ( -0.144 -0.642 15.937) 15.951 2.912 ( -5.091 3.099 5.795) 8.313 3.052 ( 7.039 1.618 3.166) 7.886 3.085 ( 8.099 -8.268 4.019) 12.252 3.196 ( 2.417 0.346 -2.635) 3.592 3.336 ( -0.461 -2.362 6.004) 6.469 3.531 ( 1.818 -1.800 0.876) 2.704 3.637 ( -1.418 -3.191 -1.732) 3.898 3.777 ( 5.160 -2.417 5.748) 8.094 3.839 ( 4.849 2.375 9.623) 11.034 3.965 ( 6.881 -1.429 -9.691) 11.971 4.034 ( 12.768 4.597 -4.341) 14.247 4.218 ( -4.714 0.732 -4.256) 6.393 4.320 ( 0.564 4.666 0.001) 4.700 4.516 ( 2.814 -1.522 0.677) 3.270 4.722 ( 3.300 3.424 -6.652) 8.177 4.788 ( 0.984 -5.562 0.223) 5.653 4.932 ( 0.622 1.249 -2.547) 2.904 5.606 ( 3.878 0.878 -2.020) 4.460 5.702 ( 0.116 -0.098 -2.347) 2.352 5.823 ( -0.433 -4.151 -1.766) 4.532 5.893 ( -3.098 -0.827 0.696) 3.281 6.055 ( 5.172 -0.459 -2.777) 5.889 6.126 ( -1.320 0.042 4.636) 4.820 6.379 ( -4.898 -1.893 0.717) 5.300 6.442 ( -1.389 2.876 -2.567) 4.098 6.753 ( -2.467 0.203 -1.107) 2.712 6.805 ( -0.884 5.104 -3.885) 6.475 7.271 ( 2.999 -2.896 3.250) 5.286 7.399 ( 0.463 1.177 -1.107) 1.681 7.860 ( -1.139 -9.171 2.735) 9.637 7.929 ( 0.203 -7.467 -0.626) 7.496 8.279 ( 0.942 -3.995 -0.274) 4.114 8.315 ( 1.195 -0.772 -0.290) 1.452 8.635 ( 3.563 6.630 -0.864) 7.576 8.699 ( 1.605 6.240 -3.074) 7.139 9.722 ( 1.111 5.520 8.553) 10.240 9.866 ( 1.757 4.424 8.539) 9.776 9.930 ( 9.250 9.087 -10.023) 16.389 9.975 ( 0.637 6.735 -2.805) 7.324 10.476 ( 0.930 -0.400 -0.786) 1.282 10.550 ( -0.213 0.416 -1.171) 1.261 10.860 ( -4.671 -0.053 2.319) 5.215 10.949 ( -7.547 0.949 -1.082) 7.683 12.198 ( -2.061 -3.444 8.220) 9.148 12.433 ( -1.691 -5.680 -8.257) 10.164 12.632 ( -4.838 -0.408 6.643) 8.228 12.766 ( -1.912 -2.379 -2.766) 4.119 12.919 ( 1.685 0.496 1.235) 2.147 13.233 ( -6.450 1.029 -2.004) 6.832 13.421 ( 2.610 -2.217 2.237) 4.090 13.606 ( -4.462 2.492 0.566) 5.142 13.926 ( 0.333 2.590 4.846) 5.505 14.206 ( -1.804 3.839 -6.361) 7.645 14.910 ( 7.237 -5.618 0.739) 9.191 15.097 ( 0.285 -8.463 -4.005) 9.367 18.895 ( 1.143 4.250 -3.396) 5.559 18.926 ( -6.359 5.037 4.852) 9.453 19.951 ( 5.743 -4.276 -2.151) 7.476 20.190 ( -9.974 -7.368 3.342) 12.842 21.475 ( -3.004 7.284 4.695) 9.172 21.535 ( 3.320 6.410 -8.586) 11.218 22.783 ( 23.715 -6.123 -13.322) 27.881 22.866 ( 3.075 -8.553 14.645) 17.237 23.730 ( -0.128 3.188 -2.171) 3.859 23.798 ( -2.744 -0.571 -0.686) 2.886 24.289 ( 6.604 1.738 3.929) 7.879 24.552 ( -1.770 1.241 -0.010) 2.162 ======================= Grid point 187 (97/116) ======================= q-point: (-0.50 0.14 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.917 ( -6.496 10.459 12.393) 17.469 2.134 ( -0.039 6.099 -4.667) 7.680 2.297 ( 0.210 6.646 0.272) 6.655 2.356 ( -3.198 3.721 -3.184) 5.849 2.889 ( 1.338 -0.150 5.397) 5.563 2.892 ( 2.751 -0.774 5.730) 6.404 3.116 ( -1.413 -2.182 3.770) 4.579 3.224 ( 4.489 0.855 -5.293) 6.993 3.271 ( 5.275 -6.084 2.455) 8.418 3.322 ( -0.220 -4.850 -1.914) 5.219 3.535 ( -3.236 -1.815 5.308) 6.476 3.620 ( 1.992 1.398 -2.496) 3.486 3.815 ( -6.609 0.945 10.175) 12.170 3.901 ( -0.015 -2.794 4.406) 5.217 4.049 ( 3.195 -2.922 -6.568) 7.867 4.089 ( -1.493 -0.926 -6.536) 6.768 4.278 ( -5.413 3.866 0.290) 6.658 4.291 ( 7.466 5.812 -0.597) 9.481 4.570 ( 1.083 2.383 4.382) 5.104 4.670 ( -5.084 -2.163 -5.685) 7.928 4.858 ( 4.685 -1.673 -1.000) 5.074 4.907 ( -1.769 0.234 -5.287) 5.580 5.618 ( -5.897 1.948 1.733) 6.447 5.642 ( 0.008 0.994 1.564) 1.853 5.797 ( -2.249 -1.399 2.205) 3.447 5.910 ( 4.400 -2.402 -6.353) 8.092 6.137 ( -1.904 -3.185 0.674) 3.771 6.175 ( 6.970 -1.504 -3.380) 7.891 6.302 ( -0.115 3.315 3.336) 4.704 6.386 ( -1.487 2.863 -4.188) 5.287 6.728 ( 0.231 0.639 1.611) 1.748 6.774 ( -1.569 2.786 -2.675) 4.169 7.331 ( 1.645 -0.477 2.827) 3.305 7.387 ( -0.726 -0.263 -2.868) 2.970 7.861 ( 0.165 -10.009 3.419) 10.578 7.921 ( 0.206 -6.042 -2.215) 6.439 8.282 ( -1.527 -4.553 2.040) 5.218 8.331 ( 1.181 -1.285 -1.699) 2.435 8.688 ( 0.446 7.006 -1.621) 7.205 8.695 ( 0.469 5.270 -3.100) 6.133 9.749 ( -2.097 7.708 11.428) 13.943 9.870 ( -2.906 3.244 3.551) 5.620 9.962 ( 0.720 6.808 -3.122) 7.524 10.075 ( 6.453 7.389 -10.537) 14.397 10.500 ( -1.468 -0.720 0.880) 1.857 10.530 ( 0.782 0.532 -2.123) 2.324 10.815 ( 0.273 0.438 2.630) 2.680 10.862 ( -0.031 1.992 -1.863) 2.728 12.197 ( -0.799 -4.024 9.700) 10.532 12.383 ( -0.582 -6.128 -8.146) 10.210 12.592 ( -1.079 -0.026 7.587) 7.663 12.713 ( -0.419 -1.034 -4.215) 4.360 13.032 ( 6.219 0.502 3.844) 7.328 13.102 ( -6.389 -0.711 -2.790) 7.008 13.489 ( 2.629 0.140 2.895) 3.913 13.517 ( -3.559 0.426 -0.027) 3.584 13.981 ( 2.979 3.297 6.850) 8.165 14.140 ( -2.472 4.419 -7.995) 9.463 14.989 ( -0.673 -8.193 3.235) 8.834 15.074 ( 0.202 -4.802 -4.967) 6.911 18.838 ( -3.765 4.057 4.951) 7.426 18.940 ( 4.475 3.206 -4.818) 7.316 19.991 ( -7.244 -7.054 6.641) 12.097 20.105 ( 6.103 -6.174 -4.190) 9.640 21.429 ( -3.320 7.194 5.446) 9.615 21.577 ( 3.600 8.687 -8.809) 12.885 22.808 ( -12.135 -7.796 14.721) 20.609 23.133 ( 15.128 -8.369 -16.021) 23.571 23.715 ( -4.185 0.362 1.823) 4.579 23.756 ( 1.843 2.005 -2.234) 3.522 24.422 ( 2.733 0.277 3.346) 4.330 24.503 ( 0.478 2.677 -4.580) 5.327 ======================= Grid point 188 (98/116) ======================= q-point: (-0.38 0.14 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.826 ( -6.998 10.913 14.146) 19.188 2.093 ( -3.826 4.592 3.057) 6.714 2.243 ( -5.926 5.034 4.526) 8.997 2.304 ( -1.736 8.524 -3.074) 9.227 2.958 ( 4.681 -2.714 -1.336) 5.573 3.000 ( 4.903 0.273 2.560) 5.538 3.068 ( -2.525 0.177 2.281) 3.407 3.186 ( -7.884 -6.028 -4.501) 10.897 3.279 ( -2.274 0.677 -9.723) 10.008 3.358 ( -0.962 -6.233 2.238) 6.692 3.486 ( -2.473 -4.955 5.085) 7.518 3.630 ( -4.130 3.482 3.709) 6.553 3.715 ( 0.406 2.735 5.861) 6.481 3.834 ( -7.991 -1.980 5.864) 10.108 3.970 ( -7.064 -1.557 -5.241) 8.932 4.104 ( -0.761 -1.237 -7.623) 7.760 4.126 ( -5.538 3.455 2.033) 6.837 4.366 ( 0.688 5.514 -4.416) 7.098 4.512 ( -5.097 -2.138 0.326) 5.537 4.606 ( -1.521 3.821 4.059) 5.778 4.846 ( -2.490 -2.425 -4.984) 6.077 4.922 ( 1.914 -0.596 -1.556) 2.537 5.530 ( -4.159 1.631 3.825) 5.881 5.592 ( -6.043 -0.355 7.160) 9.376 5.827 ( 4.689 -2.155 -1.630) 5.412 5.959 ( 1.779 -0.267 -5.009) 5.322 6.046 ( -3.562 -2.099 -1.315) 4.339 6.257 ( 2.411 -2.268 -7.538) 8.233 6.364 ( 4.108 2.649 3.842) 6.217 6.425 ( 3.291 0.632 -2.205) 4.011 6.738 ( -1.270 1.627 0.008) 2.064 6.754 ( 1.609 2.985 1.099) 3.565 7.315 ( -2.869 0.309 0.158) 2.890 7.399 ( 2.427 -1.784 -1.961) 3.594 7.872 ( -0.179 -11.677 2.684) 11.983 7.929 ( 0.322 -8.783 -1.683) 8.949 8.237 ( -3.174 -2.022 1.913) 4.222 8.347 ( 0.844 -0.302 -1.901) 2.102 8.646 ( -2.093 7.062 -2.183) 7.682 8.698 ( -0.952 6.171 -2.395) 6.687 9.694 ( -6.381 8.138 10.820) 14.967 9.817 ( -3.040 2.640 0.470) 4.054 9.969 ( 0.669 7.292 -3.173) 7.981 10.082 ( -2.384 6.321 -10.363) 12.371 10.462 ( -0.097 1.562 0.197) 1.578 10.549 ( 0.182 -0.252 -0.858) 0.913 10.889 ( 5.669 -0.284 0.467) 5.695 10.936 ( 7.330 1.292 -0.640) 7.470 12.225 ( 0.525 -4.275 10.399) 11.256 12.368 ( 1.301 -5.340 -6.787) 8.733 12.647 ( 4.451 -1.502 8.442) 9.661 12.729 ( 2.592 -1.600 -2.737) 4.096 12.963 ( -5.732 -1.114 -2.626) 6.402 13.171 ( 6.474 1.215 3.711) 7.561 13.429 ( -3.729 -0.528 1.438) 4.031 13.587 ( 4.802 1.900 2.121) 5.583 14.043 ( -0.208 2.633 -1.131) 2.873 14.094 ( 1.673 4.452 -0.619) 4.796 14.905 ( -7.696 -6.991 1.334) 10.482 15.072 ( -1.001 -5.789 -1.799) 6.144 18.815 ( 0.049 5.509 3.792) 6.688 19.032 ( 6.224 3.911 -4.744) 8.749 19.869 ( -5.846 -3.761 5.271) 8.724 20.240 ( 7.284 -8.042 -1.085) 10.905 21.385 ( -2.531 5.050 4.709) 7.354 21.618 ( 3.221 9.594 -7.977) 12.886 22.519 ( -20.635 -5.608 11.021) 24.057 23.213 ( -3.174 -10.952 -17.044) 20.507 23.670 ( 0.605 3.329 2.972) 4.504 23.794 ( 1.712 0.120 -0.101) 1.720 24.359 ( -4.820 1.960 -2.430) 5.743 24.589 ( 5.009 -0.372 -4.020) 6.433 ======================= Grid point 189 (99/116) ======================= q-point: (-0.25 0.14 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.726 ( -8.192 10.857 13.737) 19.331 1.965 ( -12.020 3.874 2.705) 12.916 2.106 ( -11.487 8.370 8.265) 16.441 2.256 ( -1.876 8.064 -4.790) 9.565 2.792 ( -18.892 1.957 6.638) 20.120 2.987 ( -5.668 -6.633 -3.761) 9.501 3.095 ( -3.447 -1.917 3.488) 5.265 3.134 ( 8.873 -0.879 -4.630) 10.047 3.220 ( 1.117 1.402 -7.602) 7.811 3.297 ( -5.721 -4.028 7.748) 10.440 3.415 ( -3.641 -1.607 -1.907) 4.413 3.605 ( -2.633 -1.903 3.459) 4.746 3.665 ( -6.625 2.035 4.045) 8.025 3.775 ( 2.005 2.874 -0.795) 3.593 3.816 ( -5.211 2.188 -2.860) 6.335 4.039 ( 2.759 0.083 -10.999) 11.340 4.126 ( -0.170 2.092 8.390) 8.648 4.287 ( -7.219 -2.329 -0.547) 7.605 4.507 ( 0.995 2.485 0.300) 2.693 4.579 ( 0.594 4.184 0.029) 4.226 4.800 ( -0.788 -4.513 -3.481) 5.754 4.930 ( -0.523 -1.333 -2.510) 2.890 5.464 ( -4.001 0.450 3.650) 5.435 5.488 ( -6.425 0.393 6.678) 9.275 5.899 ( 0.005 -2.646 -0.667) 2.729 5.932 ( 1.539 -0.574 -5.196) 5.449 6.067 ( 3.284 -0.118 -0.515) 3.326 6.242 ( -2.516 -3.876 -4.753) 6.629 6.395 ( -1.684 2.297 -0.566) 2.904 6.469 ( 3.257 -0.858 0.813) 3.464 6.694 ( -4.114 2.343 -0.911) 4.821 6.803 ( 2.083 3.462 2.038) 4.525 7.272 ( -0.895 -1.087 -0.187) 1.420 7.440 ( 2.246 -2.833 -3.786) 5.235 7.853 ( -3.193 -13.849 3.788) 14.708 7.888 ( -4.326 -13.000 -0.648) 13.716 8.199 ( -0.800 1.435 1.675) 2.346 8.350 ( 0.359 1.470 -3.192) 3.533 8.607 ( -1.587 7.041 -1.851) 7.452 8.653 ( -2.396 7.939 -2.853) 8.770 9.605 ( -5.141 7.971 8.057) 12.446 9.754 ( -3.242 2.460 -0.705) 4.130 9.941 ( -3.375 8.495 -3.082) 9.646 9.986 ( -2.999 6.604 -8.445) 11.132 10.482 ( 1.428 1.275 -0.312) 1.940 10.546 ( 0.016 0.423 -0.782) 0.889 11.010 ( 6.741 -0.999 -1.902) 7.075 11.079 ( 6.241 -0.278 0.822) 6.301 12.269 ( 0.785 -3.575 7.969) 8.770 12.390 ( 2.359 -3.004 -3.825) 5.405 12.741 ( 0.178 -6.413 0.919) 6.481 12.780 ( 2.255 -2.429 -0.083) 3.315 12.962 ( 9.638 0.329 4.920) 10.826 13.304 ( 4.260 -4.930 6.292) 9.058 13.422 ( 5.799 3.650 -0.225) 6.856 13.673 ( 3.056 2.952 0.549) 4.284 14.015 ( 0.712 3.400 -4.639) 5.795 14.156 ( 2.310 2.364 3.891) 5.106 14.710 ( -12.965 -5.258 0.652) 14.006 14.992 ( -7.645 -7.150 0.159) 10.469 18.865 ( 4.186 9.064 1.976) 10.178 19.129 ( 4.249 6.693 -3.106) 8.514 19.828 ( 1.241 -1.353 2.788) 3.338 20.345 ( 2.204 -7.033 3.735) 8.262 21.375 ( 1.021 1.554 2.460) 3.083 21.656 ( 3.247 8.718 -6.820) 11.535 22.134 ( -20.610 -3.923 6.339) 21.917 22.938 ( -18.958 -8.466 -14.165) 25.134 23.730 ( 3.510 2.567 0.762) 4.415 23.812 ( 0.029 -0.621 0.960) 1.144 24.276 ( -2.209 1.465 -3.808) 4.640 24.615 ( -1.265 -1.781 -5.193) 5.634 ======================= Grid point 190 (100/116) ======================= q-point: (-0.12 0.14 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( -18.335 6.598 10.681) 22.222 1.641 ( -17.674 7.753 -2.161) 19.420 1.875 ( -11.059 13.313 13.341) 21.852 2.203 ( -0.324 9.936 -13.484) 16.753 2.604 ( -4.097 3.392 19.910) 20.608 2.874 ( -4.440 -6.337 -0.187) 7.740 2.961 ( -10.221 -4.844 1.123) 11.366 3.162 ( -4.125 -1.330 -6.141) 7.517 3.208 ( -3.223 -3.526 6.301) 7.907 3.271 ( 4.630 0.304 -3.001) 5.526 3.427 ( 2.346 -0.360 1.396) 2.754 3.553 ( 0.799 4.441 -7.802) 9.013 3.669 ( 4.090 1.318 2.565) 5.005 3.717 ( -3.101 2.696 0.059) 4.110 3.906 ( 10.897 0.683 1.566) 11.031 4.026 ( -5.376 -1.085 -7.124) 8.991 4.139 ( -2.072 -3.208 2.692) 4.673 4.230 ( 3.870 3.555 8.365) 9.879 4.449 ( -3.962 8.442 1.877) 9.512 4.635 ( -0.390 -1.494 -5.193) 5.417 4.799 ( 3.636 -5.125 -7.643) 9.895 4.878 ( -4.109 -4.109 -2.249) 6.232 5.397 ( -3.659 1.131 4.464) 5.882 5.419 ( -1.639 0.335 2.711) 3.185 5.876 ( -0.051 0.298 -2.216) 2.237 5.945 ( -1.238 -0.698 -3.865) 4.118 6.093 ( -0.799 -0.709 1.651) 1.966 6.170 ( -2.097 -3.070 -0.405) 3.740 6.383 ( 1.065 -0.298 -1.863) 2.166 6.514 ( -1.725 2.824 2.016) 3.875 6.611 ( 0.405 -0.929 -2.964) 3.133 6.798 ( -3.875 2.633 1.908) 5.058 7.283 ( 1.561 -2.280 0.605) 2.829 7.438 ( -1.860 -4.739 -4.356) 6.700 7.784 ( -4.083 -13.356 3.752) 14.462 7.797 ( -3.712 -14.027 0.894) 14.537 8.214 ( 1.527 2.092 1.099) 2.813 8.342 ( -0.272 1.807 -3.564) 4.005 8.550 ( -3.946 7.329 0.422) 8.335 8.612 ( -0.557 9.098 -5.147) 10.468 9.556 ( -2.060 8.178 6.393) 10.583 9.702 ( -1.497 4.460 -1.314) 4.885 9.843 ( -5.358 9.284 -1.177) 10.784 9.921 ( -1.325 6.405 -7.817) 10.193 10.506 ( 0.950 0.487 0.371) 1.130 10.544 ( 0.176 0.378 -1.255) 1.323 11.121 ( 4.922 -1.450 -1.681) 5.399 11.161 ( 1.940 -0.807 1.208) 2.424 12.297 ( -0.104 -1.475 6.139) 6.315 12.414 ( 0.931 -0.372 -3.610) 3.746 12.734 ( 0.259 -6.325 1.028) 6.413 12.797 ( 0.175 -2.871 -0.344) 2.897 13.189 ( 6.084 -1.843 3.451) 7.234 13.441 ( 7.749 -10.421 1.820) 13.113 13.643 ( 15.401 0.465 1.582) 15.489 13.746 ( 8.934 2.307 3.263) 9.787 14.074 ( 5.619 4.149 -1.263) 7.098 14.195 ( 1.592 0.677 1.941) 2.600 14.412 ( -17.830 -2.647 1.282) 18.070 14.765 ( -15.815 -6.951 -0.138) 17.276 18.978 ( 6.819 13.582 -0.402) 15.203 19.150 ( -1.635 10.225 -0.387) 10.362 19.961 ( 12.253 -1.084 -1.337) 12.373 20.310 ( -7.972 -3.502 7.798) 11.689 21.465 ( 8.278 -2.816 -0.846) 8.785 21.715 ( 5.325 6.802 -4.866) 9.915 21.813 ( -13.477 -3.128 2.590) 14.075 22.446 ( -27.159 -4.449 -9.253) 29.035 23.785 ( 2.000 1.793 -0.195) 2.693 23.806 ( -0.688 -0.469 1.193) 1.455 24.266 ( 2.338 0.274 -2.878) 3.718 24.511 ( -7.770 -1.435 -3.485) 8.636 ======================= Grid point 191 (101/116) ======================= q-point: ( 0.00 0.29 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.507 ( -3.009 14.568 9.580) 17.694 1.701 ( 2.933 11.815 -8.957) 15.114 2.147 ( -1.504 15.369 14.796) 21.387 2.426 ( -0.089 7.366 -10.492) 12.820 2.589 ( 0.628 -7.470 2.433) 7.881 2.657 ( 0.117 -9.223 -3.249) 9.779 2.806 ( -0.039 3.534 20.200) 20.507 3.085 ( -1.732 1.144 -6.588) 6.908 3.158 ( -0.687 1.424 11.248) 11.359 3.379 ( 4.064 3.437 -9.097) 10.539 3.455 ( 0.551 2.863 3.988) 4.940 3.566 ( -3.712 -0.102 -6.234) 7.256 3.678 ( -9.508 2.281 8.497) 12.954 3.819 ( 4.951 2.436 -4.311) 7.002 3.876 ( -3.694 -3.378 9.920) 11.111 4.076 ( -0.076 -0.984 -6.973) 7.043 4.242 ( 16.466 2.998 2.157) 16.875 4.365 ( -10.652 3.902 -7.200) 13.436 4.461 ( 2.113 -1.608 3.693) 4.548 4.576 ( 3.430 -1.665 -5.580) 6.758 4.618 ( -3.257 -6.084 1.943) 7.169 4.735 ( 0.721 -4.320 -9.531) 10.490 5.403 ( -1.041 0.654 1.349) 1.825 5.418 ( 2.960 -1.498 0.112) 3.319 5.852 ( -3.513 -0.819 4.504) 5.771 5.973 ( 0.970 -0.728 -4.796) 4.947 6.065 ( 1.529 2.965 0.781) 3.426 6.141 ( 1.052 1.580 -4.489) 4.873 6.422 ( -1.717 2.217 2.428) 3.709 6.485 ( 2.985 1.934 -2.624) 4.420 6.686 ( -1.416 -1.080 0.916) 2.002 6.715 ( 2.049 -1.693 -1.616) 3.110 7.196 ( -4.755 -3.583 5.605) 8.177 7.308 ( 3.036 -2.718 -4.969) 6.426 7.460 ( -1.958 -11.351 5.546) 12.785 7.572 ( 3.587 -9.593 -4.782) 11.303 8.304 ( 1.123 3.268 1.242) 3.672 8.354 ( -1.702 2.209 -3.475) 4.456 8.605 ( -2.132 2.973 4.028) 5.442 8.700 ( 1.200 0.878 -4.917) 5.137 9.759 ( -1.358 8.653 8.103) 11.932 9.850 ( 0.226 7.271 2.519) 7.699 10.005 ( -2.777 12.952 -3.141) 13.614 10.060 ( 2.844 8.972 -5.972) 11.147 10.517 ( -1.450 1.286 0.036) 1.939 10.557 ( 1.212 0.424 -3.395) 3.630 11.107 ( -1.828 -2.487 3.009) 4.310 11.154 ( 1.176 -3.013 -1.471) 3.553 12.306 ( -1.407 0.609 5.479) 5.689 12.412 ( 1.722 -0.913 -4.460) 4.867 12.617 ( -0.545 -5.727 5.541) 7.987 12.690 ( 0.368 -5.780 -1.055) 5.887 13.207 ( 1.533 -2.671 6.168) 6.894 13.322 ( -1.212 -5.106 -3.984) 6.589 13.781 ( 4.932 -6.614 8.120) 11.576 13.901 ( -2.315 -5.898 -3.071) 7.041 14.134 ( -6.318 2.517 3.341) 7.577 14.188 ( 3.260 2.240 0.160) 3.958 14.281 ( 0.223 -0.205 0.938) 0.986 14.400 ( 1.813 -3.190 -8.442) 9.205 19.352 ( -6.005 14.150 5.465) 16.314 19.487 ( 5.859 17.259 -7.500) 19.709 20.033 ( -6.746 -3.696 8.251) 11.280 20.226 ( 10.415 -3.682 -9.836) 14.791 21.529 ( -4.094 -3.083 0.731) 5.177 21.568 ( 6.944 -3.860 -3.056) 8.512 21.935 ( 1.520 1.733 0.858) 2.460 21.958 ( -8.446 0.981 -1.240) 8.592 23.806 ( -0.530 1.287 2.257) 2.652 23.838 ( 0.812 0.686 -0.798) 1.329 24.323 ( -1.395 -0.415 0.404) 1.510 24.337 ( -0.449 -0.626 -0.949) 1.222 ======================= Grid point 192 (102/116) ======================= q-point: ( 0.12 0.29 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.686 ( 15.505 11.671 7.363) 20.756 1.920 ( 19.099 10.708 -6.448) 22.826 2.204 ( 3.956 14.317 11.575) 18.831 2.392 ( 0.748 1.610 -8.270) 8.459 2.664 ( 7.937 -3.581 -0.691) 8.735 2.756 ( 5.524 -8.183 -0.155) 9.874 2.866 ( -0.804 4.877 20.166) 20.763 3.039 ( 0.562 3.133 -3.563) 4.778 3.197 ( 1.116 0.133 0.381) 1.186 3.394 ( -7.263 3.826 1.974) 8.443 3.436 ( 2.358 2.862 -2.126) 4.275 3.495 ( -1.923 -3.448 0.689) 4.008 3.586 ( -0.073 2.614 7.829) 8.254 3.785 ( -4.885 -2.502 7.889) 9.610 3.903 ( -0.029 1.418 -1.050) 1.764 4.020 ( -3.593 5.626 -6.603) 9.389 4.215 ( 2.969 -2.674 -9.785) 10.569 4.434 ( -2.242 -3.513 4.519) 6.147 4.449 ( -1.480 -0.984 -5.042) 5.346 4.639 ( 7.604 2.629 -2.459) 8.413 4.646 ( 2.469 0.627 -4.353) 5.043 4.787 ( 7.012 -4.037 -1.271) 8.190 5.425 ( 3.450 0.412 -0.285) 3.486 5.496 ( 4.888 -1.773 -2.426) 5.738 5.798 ( -2.713 -2.481 4.906) 6.131 5.950 ( -2.085 -0.057 -2.542) 3.288 6.022 ( -2.963 -2.610 1.595) 4.259 6.190 ( 0.312 -0.427 -6.608) 6.629 6.390 ( 2.715 3.905 1.291) 4.928 6.535 ( -5.967 -1.388 -0.452) 6.143 6.681 ( 10.962 3.422 -4.234) 12.239 6.859 ( 6.406 0.183 -1.197) 6.519 7.143 ( -2.208 -2.351 5.811) 6.646 7.355 ( 1.325 -1.436 -0.821) 2.119 7.492 ( 4.974 -11.684 1.807) 12.827 7.635 ( 4.326 -9.476 -5.552) 11.804 8.308 ( -1.361 2.269 -1.426) 3.005 8.324 ( -0.114 2.298 0.562) 2.368 8.613 ( 1.495 3.117 4.541) 5.707 8.725 ( 2.456 1.363 -3.716) 4.658 9.759 ( -0.630 7.668 6.876) 10.319 9.876 ( 1.048 5.859 6.442) 8.771 9.971 ( 1.166 13.629 -5.566) 14.768 10.122 ( 4.632 10.737 -4.683) 12.596 10.480 ( -2.190 0.486 0.819) 2.388 10.571 ( 0.966 0.154 -2.839) 3.003 11.045 ( -5.006 -1.617 2.649) 5.890 11.141 ( -2.320 -3.406 -0.649) 4.172 12.253 ( -4.625 -0.300 4.011) 6.129 12.427 ( -0.181 -3.161 -3.950) 5.062 12.604 ( -0.237 -4.330 2.626) 5.069 12.703 ( -0.053 -3.744 1.355) 3.982 13.220 ( -7.346 -2.827 -2.579) 8.283 13.233 ( -0.962 -4.895 3.097) 5.872 13.671 ( -9.784 0.565 1.079) 9.860 13.819 ( -6.264 -0.861 -0.998) 6.401 14.104 ( -5.119 1.123 1.041) 5.344 14.192 ( 4.688 -2.741 3.838) 6.650 14.411 ( 11.153 -0.127 -0.476) 11.164 14.579 ( 12.972 -8.532 -6.106) 16.683 19.222 ( -7.975 12.577 3.568) 15.313 19.458 ( -7.505 13.568 -2.181) 15.658 19.913 ( -4.615 0.173 0.533) 4.649 20.312 ( -1.482 -8.309 -5.975) 10.342 21.489 ( 2.837 1.479 -4.834) 5.797 21.737 ( 1.090 2.583 2.204) 3.566 21.828 ( 10.627 -1.492 -3.412) 11.260 22.179 ( 14.064 -5.186 6.603) 16.380 23.801 ( -0.591 1.375 1.708) 2.271 23.855 ( 1.052 0.785 -1.349) 1.882 24.240 ( -2.566 2.705 1.718) 4.105 24.434 ( 5.477 -2.080 0.828) 5.916 ======================= Grid point 193 (103/116) ======================= q-point: ( 0.25 0.29 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.996 ( 12.622 6.365 3.635) 14.596 2.215 ( 9.199 15.772 0.317) 18.261 2.338 ( 5.013 8.752 1.120) 10.148 2.484 ( 11.921 1.750 -8.534) 14.765 2.747 ( -2.503 -6.439 3.371) 7.687 2.881 ( 8.382 -4.961 5.378) 11.126 2.884 ( -0.340 7.075 13.566) 15.304 3.092 ( 1.221 2.268 -0.447) 2.614 3.199 ( 1.142 -0.737 -3.075) 3.362 3.247 ( -6.118 1.227 7.022) 9.394 3.450 ( 0.198 -3.860 -6.401) 7.477 3.528 ( 3.186 -2.350 8.108) 9.023 3.665 ( 2.075 1.018 3.542) 4.230 3.759 ( 3.312 1.637 9.535) 10.226 3.896 ( 2.120 1.378 -3.560) 4.366 4.019 ( 5.732 7.973 -9.190) 13.449 4.302 ( 5.425 -2.427 -7.967) 9.939 4.355 ( -3.339 -1.105 -7.291) 8.095 4.396 ( -1.930 -3.785 4.424) 6.134 4.660 ( 0.757 -4.915 -1.322) 5.146 4.768 ( 5.699 7.260 -2.001) 9.444 4.925 ( 5.820 2.078 -1.527) 6.365 5.518 ( 5.664 -0.073 -1.345) 5.822 5.589 ( 5.927 -2.269 -4.289) 7.660 5.779 ( -1.530 -3.210 3.772) 5.184 5.902 ( -2.489 -1.749 1.121) 3.242 5.987 ( -0.466 -2.743 0.452) 2.818 6.128 ( -3.109 -4.577 -2.265) 5.979 6.420 ( -2.647 1.501 0.419) 3.072 6.498 ( 2.841 2.426 -2.698) 4.608 6.799 ( 1.324 1.572 -2.710) 3.402 6.930 ( 1.167 2.922 -3.373) 4.613 7.153 ( 1.900 -1.074 4.885) 5.351 7.372 ( 1.294 -2.050 -0.537) 2.483 7.618 ( 5.781 -9.417 0.803) 11.079 7.697 ( 3.690 -8.404 -5.070) 10.486 8.281 ( -0.918 1.905 -1.127) 2.396 8.322 ( -0.331 1.762 0.998) 2.052 8.674 ( 3.127 3.206 3.238) 5.526 8.761 ( 2.076 1.982 -2.274) 3.662 9.790 ( 1.943 6.997 6.390) 9.673 9.927 ( 1.721 5.908 9.717) 11.502 10.023 ( 6.034 12.267 -7.336) 15.514 10.180 ( 1.953 11.280 -4.642) 12.354 10.451 ( -0.788 -0.947 1.713) 2.110 10.570 ( -0.276 -0.127 -3.054) 3.069 10.948 ( -5.434 -0.721 2.120) 5.877 11.067 ( -4.877 -2.383 -0.272) 5.435 12.177 ( -4.074 -1.652 3.821) 5.825 12.367 ( -3.712 -6.758 -5.036) 9.209 12.637 ( 1.240 -3.176 0.731) 3.487 12.696 ( -0.269 -1.292 3.368) 3.617 13.034 ( -9.206 -0.868 -2.699) 9.632 13.215 ( -1.233 -6.922 0.594) 7.056 13.527 ( -5.946 7.019 1.455) 9.314 13.728 ( -3.569 1.172 0.540) 3.795 14.006 ( -3.564 2.880 3.317) 5.657 14.290 ( 3.419 1.400 -2.522) 4.473 14.606 ( 8.212 -6.432 3.038) 10.865 14.782 ( 9.174 -11.144 -6.267) 15.736 19.091 ( -5.869 9.585 0.494) 11.250 19.251 ( -11.916 9.097 1.919) 15.114 19.855 ( -1.575 -1.040 -1.767) 2.586 20.179 ( -9.247 -9.792 -0.463) 13.475 21.575 ( 7.148 5.890 -8.041) 12.265 21.716 ( -1.733 9.347 6.182) 11.340 22.190 ( 23.785 -7.497 -10.688) 27.132 22.459 ( 10.950 -10.412 10.936) 18.653 23.793 ( -0.715 1.449 1.269) 2.055 23.859 ( -0.193 1.827 -2.469) 3.077 24.249 ( 2.503 4.015 3.560) 5.921 24.525 ( 3.338 -2.192 0.512) 4.026 ======================= Grid point 194 (104/116) ======================= q-point: ( 0.38 0.29 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.171 ( 4.722 5.590 -0.099) 7.318 2.305 ( 1.069 16.174 6.591) 17.498 2.429 ( 4.733 7.508 -2.378) 9.188 2.515 ( -4.193 5.396 -7.099) 9.854 2.817 ( 2.389 -3.852 9.249) 10.300 2.919 ( 4.276 -1.572 10.290) 11.253 2.986 ( -2.109 0.930 -0.498) 2.359 3.062 ( 1.591 -0.590 1.565) 2.308 3.225 ( 0.511 1.736 1.649) 2.448 3.233 ( -0.841 -6.728 1.139) 6.876 3.465 ( 4.331 -4.401 -3.326) 7.014 3.604 ( 1.476 -0.461 6.196) 6.386 3.706 ( 2.866 -1.598 5.191) 6.141 3.896 ( 4.188 2.549 6.557) 8.187 3.965 ( 6.088 1.656 -7.796) 10.030 4.131 ( 4.291 3.463 -9.856) 11.294 4.230 ( -0.119 -0.382 -5.313) 5.328 4.358 ( -3.230 -7.315 2.668) 8.430 4.475 ( 9.292 3.217 -2.119) 10.059 4.674 ( 0.737 -3.177 -0.430) 3.290 4.852 ( 3.254 7.579 -0.598) 8.270 4.985 ( 1.403 4.060 -3.901) 5.803 5.613 ( 4.060 -0.594 -1.819) 4.489 5.677 ( 3.158 -3.152 -3.460) 5.646 5.748 ( -1.500 -1.563 1.725) 2.769 5.850 ( -2.651 -2.532 1.926) 4.141 6.033 ( 4.615 -2.190 -2.695) 5.776 6.087 ( -1.409 -4.890 1.915) 5.437 6.372 ( -1.760 2.483 2.001) 3.642 6.517 ( -0.561 3.417 -2.555) 4.304 6.752 ( -3.745 0.117 0.082) 3.748 6.891 ( -3.164 1.931 -4.426) 5.773 7.231 ( 4.183 -0.696 3.435) 5.457 7.392 ( 0.774 -1.815 -2.626) 3.285 7.673 ( -0.312 -6.961 2.879) 7.540 7.749 ( 2.733 -7.840 -5.327) 9.865 8.270 ( -0.300 1.844 1.377) 2.321 8.321 ( 0.497 0.959 -1.637) 1.961 8.735 ( 2.299 3.127 1.566) 4.185 8.789 ( 1.178 2.157 -1.299) 2.780 9.866 ( 3.369 7.488 7.489) 11.113 9.988 ( 0.598 6.160 11.361) 12.937 10.141 ( 5.485 9.722 -7.170) 13.267 10.163 ( 1.124 9.965 -6.950) 12.201 10.464 ( 1.192 -0.982 1.205) 1.958 10.543 ( -1.374 -1.204 -3.449) 3.903 10.864 ( -3.580 0.564 2.385) 4.338 10.969 ( -4.542 0.597 -1.348) 4.775 12.126 ( -2.469 -2.660 4.788) 6.008 12.286 ( -2.628 -7.243 -6.073) 9.811 12.615 ( -2.800 -1.149 4.227) 5.199 12.710 ( -0.847 -2.967 -2.010) 3.682 12.940 ( 1.347 1.558 0.714) 2.179 13.173 ( -3.921 -5.135 0.323) 6.469 13.466 ( -0.302 4.824 0.708) 4.885 13.638 ( -5.934 0.483 0.228) 5.958 14.010 ( 1.708 5.460 7.156) 9.162 14.306 ( 0.040 5.088 -6.580) 8.318 14.734 ( 3.653 -10.425 5.288) 12.247 14.890 ( 4.410 -9.876 -7.066) 12.920 19.013 ( -1.942 6.434 -1.419) 6.869 19.058 ( -8.127 6.711 2.568) 10.848 19.842 ( 0.477 -5.318 0.173) 5.342 20.005 ( -8.044 -9.337 0.569) 12.338 21.676 ( 0.926 11.155 2.303) 11.428 21.716 ( 3.862 10.286 -4.475) 11.864 22.593 ( 17.732 -11.404 -8.715) 22.813 22.629 ( 4.960 -12.991 8.034) 16.060 23.780 ( -1.167 1.989 1.601) 2.807 23.836 ( -0.950 3.234 -3.171) 4.628 24.340 ( 5.098 3.000 4.349) 7.342 24.557 ( 0.081 -1.132 -1.469) 1.856 ======================= Grid point 195 (105/116) ======================= q-point: (-0.50 0.29 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.183 ( -3.772 12.777 8.566) 15.839 2.284 ( -4.271 7.757 2.409) 9.177 2.451 ( -2.222 6.648 -0.644) 7.039 2.506 ( 4.892 9.893 -4.599) 11.956 2.861 ( 0.175 -0.659 7.047) 7.080 2.908 ( 1.068 0.911 1.834) 2.310 3.056 ( -0.800 -3.786 4.474) 5.915 3.138 ( 6.238 -5.896 1.591) 8.729 3.186 ( -3.011 -4.847 -3.555) 6.722 3.209 ( 0.388 -4.368 -2.048) 4.840 3.515 ( -3.905 0.473 7.541) 8.505 3.659 ( 6.144 1.931 -3.913) 7.536 3.779 ( 1.051 -2.793 8.196) 8.722 3.900 ( -5.424 1.957 6.353) 8.579 4.019 ( -0.192 -0.155 -10.663) 10.666 4.086 ( 0.589 0.303 -9.404) 9.427 4.288 ( -4.442 -4.100 2.592) 6.578 4.322 ( 4.895 -3.635 -1.449) 6.266 4.618 ( 4.845 2.387 0.383) 5.414 4.649 ( -4.181 1.798 -2.804) 5.346 4.886 ( -0.089 5.172 2.438) 5.718 4.973 ( -0.358 5.333 -5.602) 7.743 5.621 ( -4.284 -1.411 3.205) 5.534 5.667 ( -1.628 0.022 -0.132) 1.633 5.754 ( -0.186 -1.710 2.130) 2.738 5.852 ( 4.172 -2.473 -5.538) 7.361 6.058 ( -2.602 -4.611 1.431) 5.485 6.124 ( 5.467 -4.166 -4.701) 8.327 6.388 ( 2.268 5.057 4.051) 6.865 6.466 ( -2.614 4.736 -3.445) 6.413 6.731 ( 1.613 -0.603 3.165) 3.603 6.810 ( -3.233 -0.013 -4.146) 5.257 7.312 ( 2.909 -1.113 2.447) 3.961 7.375 ( -1.497 -1.109 -4.012) 4.423 7.656 ( -2.122 -7.428 5.077) 9.244 7.761 ( 0.414 -7.452 -4.968) 8.966 8.267 ( -0.812 2.092 2.318) 3.226 8.338 ( 2.267 1.119 -4.065) 4.787 8.772 ( 1.009 2.282 0.795) 2.619 8.789 ( -0.857 2.613 -0.848) 2.878 9.944 ( 1.219 8.907 10.028) 13.468 9.980 ( -5.004 7.397 9.867) 13.308 10.116 ( 0.250 7.219 -5.293) 8.955 10.259 ( 4.694 8.373 -12.246) 15.560 10.468 ( -1.859 -2.450 2.151) 3.753 10.524 ( 1.570 -1.467 -3.416) 4.035 10.848 ( 1.320 2.690 2.567) 3.946 10.907 ( -0.403 2.112 -3.079) 3.755 12.111 ( -0.904 -3.367 6.328) 7.225 12.236 ( -0.619 -6.851 -5.685) 8.923 12.588 ( -1.109 -0.328 5.763) 5.877 12.676 ( -0.677 -2.552 -2.729) 3.797 13.036 ( 5.180 -0.200 2.515) 5.762 13.071 ( -5.051 -1.830 -0.845) 5.438 13.509 ( 2.460 1.404 1.906) 3.414 13.527 ( -3.711 0.568 -0.012) 3.754 14.081 ( 2.547 6.123 8.500) 10.781 14.264 ( -1.654 6.939 -8.891) 11.399 14.775 ( -1.274 -11.277 6.400) 13.029 14.922 ( 1.382 -9.097 -7.697) 11.996 18.953 ( -2.854 6.280 3.494) 7.733 19.028 ( 3.693 4.678 -3.807) 7.072 19.830 ( -4.313 -7.240 6.290) 10.516 19.936 ( 3.195 -8.854 -3.906) 10.191 21.634 ( -4.969 11.600 7.018) 14.440 21.807 ( 5.666 12.357 -9.634) 16.662 22.585 ( -9.522 -12.445 12.695) 20.167 22.875 ( 11.197 -15.064 -14.990) 24.020 23.759 ( -1.447 3.491 2.947) 4.792 23.817 ( 0.091 3.330 -2.794) 4.348 24.438 ( 2.146 1.035 4.496) 5.088 24.534 ( -0.169 0.020 -4.752) 4.755 ======================= Grid point 196 (106/116) ======================= q-point: (-0.38 0.29 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.104 ( -6.142 13.527 8.369) 17.051 2.220 ( -4.680 7.452 7.870) 11.806 2.388 ( -4.330 8.595 3.329) 10.184 2.540 ( -0.370 11.959 -6.024) 13.395 2.884 ( 0.760 -4.663 0.418) 4.743 2.966 ( -6.114 -7.281 1.573) 9.637 3.013 ( 4.033 0.151 2.793) 4.908 3.120 ( -1.154 -1.630 -1.884) 2.745 3.211 ( -0.150 -7.178 2.048) 7.466 3.268 ( 3.505 -5.238 -1.864) 6.573 3.393 ( -7.131 1.503 0.996) 7.355 3.718 ( -6.475 3.822 2.740) 8.002 3.757 ( -1.615 1.546 3.613) 4.249 3.830 ( 0.038 2.010 5.948) 6.278 3.956 ( -2.463 0.642 -7.381) 7.808 4.071 ( -0.376 -1.902 -7.585) 7.829 4.179 ( -6.605 0.128 1.486) 6.772 4.386 ( 0.970 -8.641 -1.372) 8.803 4.493 ( -8.080 5.591 -3.225) 10.342 4.670 ( 0.683 0.006 0.403) 0.793 4.851 ( -3.978 4.353 -0.169) 5.899 4.948 ( -1.469 3.737 -0.944) 4.125 5.534 ( -5.115 -1.154 4.923) 7.192 5.595 ( -5.368 -0.078 3.586) 6.456 5.792 ( 3.710 -0.727 -2.191) 4.369 5.924 ( 3.963 -2.666 -4.506) 6.567 5.999 ( -2.762 -2.196 -0.084) 3.529 6.189 ( 2.273 -5.625 -6.837) 9.141 6.402 ( -0.151 1.812 0.140) 1.824 6.468 ( 0.406 3.513 1.359) 3.789 6.764 ( 0.599 0.657 -0.727) 1.149 6.812 ( 3.961 1.786 2.479) 5.003 7.315 ( -3.089 -0.205 -4.316) 5.311 7.355 ( 1.125 -2.298 0.913) 2.717 7.627 ( -2.772 -9.346 5.920) 11.406 7.733 ( -2.536 -8.490 -2.776) 9.286 8.256 ( -0.488 3.168 0.607) 3.262 8.375 ( 2.467 1.725 -4.551) 5.456 8.755 ( -1.789 3.268 -0.299) 3.737 8.777 ( -0.935 1.723 -0.160) 1.967 9.890 ( -6.036 8.345 6.857) 12.373 9.945 ( -3.826 9.819 8.633) 13.623 10.130 ( 2.115 7.356 -3.713) 8.507 10.222 ( -4.043 5.398 -8.849) 11.126 10.477 ( 2.468 -0.651 -1.700) 3.067 10.544 ( 0.982 -0.301 -2.682) 2.872 10.896 ( 3.340 1.135 0.133) 3.530 10.962 ( 5.642 0.977 -1.550) 5.932 12.131 ( 1.013 -3.835 7.281) 8.291 12.232 ( 1.913 -6.536 -3.988) 7.893 12.608 ( 0.639 -1.971 6.558) 6.877 12.675 ( 1.011 -3.305 -0.661) 3.519 12.962 ( -3.365 1.106 -1.132) 3.719 13.153 ( 3.810 -2.910 2.207) 5.278 13.461 ( -0.478 3.425 1.062) 3.618 13.614 ( 5.564 0.468 2.201) 6.002 14.129 ( -0.444 5.416 3.114) 6.263 14.215 ( -0.128 6.714 -5.046) 8.400 14.724 ( -5.855 -9.306 5.863) 12.460 14.895 ( -2.122 -10.314 -7.027) 12.660 18.968 ( 3.623 8.339 2.111) 9.334 19.134 ( 8.171 5.078 -3.861) 10.366 19.777 ( -2.167 -4.229 5.549) 7.306 20.037 ( 6.866 -10.365 -1.685) 12.546 21.542 ( -6.236 9.461 5.977) 12.811 21.861 ( 2.901 12.479 -9.254) 15.804 22.350 ( -17.578 -9.682 10.227) 22.524 22.916 ( -2.524 -16.133 -14.797) 22.036 23.758 ( 0.616 4.487 3.218) 5.556 23.818 ( 0.301 2.014 -1.069) 2.301 24.403 ( -4.317 2.020 -1.052) 4.881 24.561 ( 2.121 -2.308 -2.521) 4.023 ======================= Grid point 197 (107/116) ======================= q-point: (-0.25 0.29 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.003 ( -8.025 13.841 6.178) 17.150 2.100 ( -10.967 8.669 5.477) 15.014 2.281 ( -9.403 8.476 8.278) 15.126 2.492 ( -1.427 11.580 -7.934) 14.110 2.774 ( -9.149 -6.642 3.238) 11.760 2.836 ( -8.404 -5.620 0.306) 10.114 3.004 ( -7.518 -4.832 9.261) 12.870 3.144 ( -1.121 -1.819 -0.525) 2.201 3.207 ( 4.829 -1.867 -5.474) 7.534 3.295 ( -0.861 3.433 1.234) 3.748 3.344 ( 1.786 -0.599 -0.009) 1.884 3.615 ( -1.835 2.599 3.086) 4.432 3.714 ( -2.670 3.407 2.472) 4.985 3.850 ( -0.492 3.379 -1.313) 3.659 3.875 ( -3.906 2.563 -0.705) 4.725 4.028 ( 0.768 -1.133 -12.958) 13.031 4.148 ( 1.520 -0.622 6.036) 6.255 4.256 ( -8.226 -1.279 0.515) 8.341 4.475 ( 2.863 -3.851 -2.957) 5.636 4.666 ( -0.749 -5.326 -1.004) 5.471 4.749 ( -5.501 7.083 -0.459) 8.980 4.909 ( -2.945 0.546 -0.389) 3.020 5.459 ( -4.055 -0.707 4.354) 5.991 5.501 ( -5.276 0.215 3.351) 6.254 5.851 ( 2.363 -0.836 -1.489) 2.915 5.931 ( -0.045 -0.223 -4.740) 4.745 6.031 ( 5.024 -2.488 -2.236) 6.036 6.161 ( -2.968 -4.841 -4.517) 7.256 6.422 ( 0.447 -0.712 0.383) 0.924 6.443 ( -0.815 0.313 2.232) 2.396 6.768 ( -2.360 4.063 0.055) 4.699 6.874 ( 0.912 2.678 1.979) 3.452 7.250 ( -1.653 -0.526 -3.840) 4.214 7.366 ( -0.098 -3.743 -0.274) 3.755 7.576 ( -4.368 -11.160 5.858) 13.339 7.639 ( -6.160 -9.750 -0.998) 11.576 8.258 ( 0.623 4.008 -0.046) 4.057 8.396 ( 1.068 2.108 -4.762) 5.316 8.719 ( -2.340 3.211 0.577) 4.015 8.745 ( -1.738 1.416 -2.151) 3.107 9.807 ( -4.295 8.773 5.952) 11.439 9.885 ( -3.604 10.427 5.013) 12.118 10.112 ( -3.722 4.371 -6.483) 8.660 10.145 ( -0.727 9.517 -2.511) 9.870 10.505 ( 1.213 0.594 -3.626) 3.870 10.559 ( 1.205 0.751 -2.307) 2.709 10.984 ( 5.487 -1.227 -1.140) 5.737 11.061 ( 4.330 -1.598 0.096) 4.617 12.192 ( 3.090 -3.136 5.102) 6.739 12.292 ( 4.855 -5.603 -0.479) 7.429 12.611 ( -1.936 -4.711 3.633) 6.256 12.706 ( 0.977 -4.618 2.519) 5.350 12.980 ( 6.014 1.438 1.989) 6.495 13.189 ( -0.081 -5.055 2.884) 5.820 13.534 ( 7.338 5.865 0.550) 9.410 13.717 ( 3.762 1.114 1.582) 4.230 14.101 ( -0.016 4.545 -4.704) 6.542 14.223 ( -0.066 3.725 2.438) 4.452 14.585 ( -10.239 -5.938 5.025) 12.859 14.787 ( -7.255 -11.184 -6.282) 14.737 19.100 ( 9.607 12.075 -0.652) 15.444 19.298 ( 8.814 8.209 -2.181) 12.240 19.793 ( 2.659 -1.634 4.265) 5.285 20.159 ( 5.036 -9.963 1.178) 11.226 21.450 ( -4.149 5.477 3.920) 7.911 21.867 ( 0.416 9.538 -7.984) 12.446 22.016 ( -18.127 -5.901 6.212) 20.050 22.705 ( -14.416 -12.756 -12.438) 22.918 23.791 ( 1.484 2.634 1.681) 3.459 23.818 ( -0.122 1.484 0.909) 1.745 24.318 ( -3.293 2.378 -2.731) 4.895 24.555 ( -2.314 -3.877 -2.507) 5.165 ======================= Grid point 198 (108/116) ======================= q-point: (-0.12 0.29 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.738 ( -19.764 12.189 8.629) 24.772 1.851 ( -12.712 11.535 -6.470) 18.344 2.160 ( -4.668 11.791 12.825) 18.037 2.451 ( 0.155 11.346 -10.415) 15.402 2.627 ( -6.874 -5.622 4.724) 10.058 2.731 ( -2.365 -7.043 3.824) 8.356 2.843 ( -11.089 -2.201 10.328) 15.312 3.095 ( -1.132 -5.122 3.693) 6.415 3.216 ( -4.749 5.774 -1.010) 7.543 3.315 ( 4.739 3.658 -4.109) 7.261 3.410 ( 2.717 0.130 3.485) 4.421 3.641 ( -0.436 2.915 -7.128) 7.713 3.700 ( 4.362 1.892 0.001) 4.754 3.799 ( -4.785 3.902 3.970) 7.340 3.929 ( 8.750 2.228 5.897) 10.784 3.990 ( -2.906 -2.131 -8.442) 9.179 4.102 ( -1.535 -1.658 -3.894) 4.502 4.292 ( 6.597 0.882 7.492) 10.022 4.528 ( 3.217 -4.887 -3.088) 6.616 4.627 ( -8.055 5.703 -3.294) 10.404 4.650 ( -0.220 -8.696 -1.889) 8.901 4.815 ( -5.616 -1.388 -4.453) 7.300 5.404 ( -2.078 -0.534 1.869) 2.846 5.435 ( -2.575 0.645 3.224) 4.176 5.875 ( 0.190 0.175 2.156) 2.171 5.942 ( 2.965 0.780 -8.044) 8.608 6.057 ( -2.578 -2.540 0.527) 3.657 6.137 ( 2.502 -0.094 -1.703) 3.028 6.385 ( -1.313 0.572 1.400) 2.003 6.529 ( 7.078 -2.405 0.443) 7.489 6.639 ( -9.608 4.432 -0.445) 10.590 6.841 ( -4.991 0.945 0.480) 5.102 7.234 ( 0.085 -1.805 -1.022) 2.076 7.333 ( -3.419 -4.180 -0.985) 5.489 7.507 ( -4.514 -11.728 6.252) 14.036 7.547 ( -0.899 -9.942 -2.746) 10.353 8.277 ( 1.228 3.905 0.328) 4.106 8.388 ( -0.484 2.229 -4.160) 4.744 8.660 ( -3.937 2.859 2.339) 5.398 8.711 ( -0.625 0.977 -4.555) 4.700 9.766 ( -2.040 8.841 6.924) 11.414 9.851 ( -1.227 9.974 2.948) 10.472 10.047 ( -1.034 6.313 -4.917) 8.068 10.091 ( -3.319 10.926 -4.198) 12.167 10.519 ( 1.223 0.851 -2.463) 2.879 10.560 ( -0.256 1.202 -2.438) 2.730 11.079 ( 4.084 -2.420 -0.555) 4.779 11.124 ( 2.018 -2.794 0.929) 3.570 12.267 ( 3.069 -0.955 3.619) 4.840 12.384 ( 3.402 -2.569 -0.462) 4.288 12.592 ( -0.085 -5.768 3.147) 6.571 12.706 ( -1.222 -5.525 1.396) 5.828 13.148 ( 5.180 -1.850 3.731) 6.646 13.233 ( 6.689 -7.595 4.893) 11.241 13.671 ( 4.106 2.129 -0.787) 4.692 13.798 ( 7.509 1.918 1.484) 7.890 14.143 ( 4.314 2.128 -2.926) 5.631 14.209 ( -1.116 0.509 1.938) 2.294 14.369 ( -13.036 -1.133 4.040) 13.695 14.583 ( -11.363 -8.919 -6.279) 15.751 19.306 ( 11.160 15.619 -3.790) 19.567 19.409 ( 1.901 12.969 1.429) 13.186 19.926 ( 10.323 -2.107 1.250) 10.610 20.201 ( -1.893 -6.780 2.883) 7.607 21.437 ( 2.855 0.348 0.565) 2.931 21.714 ( -12.278 -5.686 2.018) 13.681 21.870 ( 1.157 7.422 -4.962) 9.002 22.327 ( -20.410 -6.471 -7.547) 22.702 23.807 ( -0.099 0.698 1.183) 1.377 23.826 ( 0.506 1.728 1.016) 2.068 24.281 ( 0.574 1.245 -1.983) 2.411 24.462 ( -6.211 -3.107 -1.924) 7.206 ======================= Grid point 199 (109/116) ======================= q-point: ( 0.00 0.43 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.819 ( -1.968 13.417 5.424) 14.606 1.929 ( 0.980 6.406 -5.020) 8.197 2.338 ( -3.571 -5.920 3.646) 7.816 2.401 ( 5.429 2.088 1.838) 6.100 2.435 ( -5.467 -3.416 3.643) 7.405 2.549 ( 2.440 -2.952 -1.665) 4.176 2.913 ( 2.245 5.849 9.817) 11.645 3.029 ( 2.959 -4.741 2.538) 6.137 3.334 ( -5.936 11.485 5.367) 13.998 3.481 ( 2.265 4.007 -6.623) 8.065 3.520 ( 2.507 1.618 0.423) 3.013 3.529 ( -3.737 -3.571 -0.491) 5.192 3.728 ( -9.978 2.450 8.112) 13.091 3.794 ( -6.331 -3.768 8.640) 11.355 3.881 ( 4.760 3.826 -5.850) 8.457 3.993 ( 3.542 -5.985 -8.281) 10.814 4.294 ( 4.700 1.825 3.042) 5.889 4.357 ( 0.874 -5.034 1.797) 5.416 4.439 ( 1.119 1.806 -4.467) 4.946 4.497 ( 7.103 -3.107 -6.554) 10.152 4.597 ( 0.158 2.829 -0.180) 2.839 4.674 ( -4.247 -3.060 -7.628) 9.251 5.386 ( 1.285 -0.834 0.069) 1.533 5.393 ( 0.201 -1.210 -0.588) 1.360 5.859 ( -4.484 1.768 5.274) 7.145 5.916 ( -2.314 -3.223 1.406) 4.209 6.166 ( 2.333 3.977 -5.055) 6.842 6.188 ( 2.712 1.647 -5.754) 6.571 6.501 ( 2.245 5.477 2.173) 6.305 6.546 ( -0.781 3.847 -1.834) 4.333 6.628 ( 10.400 -4.698 0.482) 11.422 6.639 ( -9.312 -4.952 -0.346) 10.552 7.167 ( -3.520 0.988 5.137) 6.305 7.239 ( -0.185 -5.261 1.490) 5.471 7.318 ( 1.466 0.170 -1.295) 1.963 7.398 ( 3.502 -6.492 -5.401) 9.142 8.373 ( -0.055 2.605 0.409) 2.638 8.392 ( -1.509 0.869 -1.456) 2.269 8.642 ( -1.094 1.276 1.416) 2.198 8.678 ( 0.553 -2.025 -2.020) 2.914 9.898 ( -1.483 4.603 7.200) 8.674 9.943 ( -1.647 0.852 3.741) 4.175 10.204 ( 0.380 5.744 -1.621) 5.980 10.229 ( 1.597 4.191 -4.287) 6.205 10.568 ( -0.424 2.714 -2.764) 3.897 10.579 ( 0.694 1.471 -3.632) 3.980 11.053 ( -0.966 -1.719 2.097) 2.879 11.076 ( 0.144 -3.570 -0.060) 3.574 12.332 ( -0.981 1.863 2.364) 3.166 12.377 ( 0.469 -2.153 -1.967) 2.954 12.539 ( 0.521 -1.130 5.195) 5.342 12.575 ( 1.322 -4.262 1.973) 4.878 13.181 ( 1.142 0.408 4.421) 4.584 13.224 ( 1.537 -3.587 1.214) 4.088 13.715 ( -0.078 0.210 1.566) 1.582 13.776 ( -3.549 -5.040 -3.304) 6.994 14.184 ( -3.890 1.954 3.988) 5.904 14.209 ( -1.776 -0.293 3.554) 3.984 14.303 ( 3.313 1.915 -4.148) 5.643 14.346 ( 2.966 -2.156 -6.346) 7.329 19.625 ( -6.284 10.883 7.823) 14.802 19.745 ( -0.436 3.380 -0.039) 3.408 19.979 ( 1.559 1.970 -1.181) 2.776 20.114 ( 7.554 -6.978 -10.170) 14.464 21.487 ( 0.033 -0.698 -0.720) 1.003 21.502 ( 4.025 -2.088 -2.182) 5.032 21.962 ( -2.561 0.820 0.268) 2.702 21.970 ( -4.383 0.098 -0.437) 4.406 23.834 ( -0.101 1.077 1.716) 2.028 23.846 ( 0.182 -0.032 0.539) 0.570 24.316 ( 0.097 -0.066 -0.181) 0.215 24.322 ( -0.794 -0.616 -0.775) 1.269 ======================= Grid point 200 (110/116) ======================= q-point: ( 0.12 0.43 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.946 ( 10.734 12.187 5.993) 17.310 2.110 ( 16.811 2.581 -2.678) 17.217 2.318 ( 1.345 -1.063 1.275) 2.137 2.438 ( 4.641 0.599 4.304) 6.358 2.541 ( 8.375 -1.362 0.855) 8.528 2.640 ( 5.974 -4.163 -1.293) 7.395 2.997 ( 3.265 5.365 6.081) 8.742 3.084 ( 2.587 -1.752 -6.244) 6.982 3.245 ( -5.668 7.173 8.284) 12.337 3.403 ( -5.682 -5.636 4.238) 9.056 3.482 ( -7.665 3.131 2.188) 8.564 3.498 ( -3.299 1.679 1.513) 3.999 3.661 ( 2.994 3.701 5.308) 7.130 3.723 ( -1.310 -2.716 6.967) 7.591 3.945 ( 1.003 3.598 -2.111) 4.290 4.050 ( 4.160 -4.263 -5.392) 8.034 4.201 ( -2.598 2.691 -6.571) 7.561 4.302 ( -3.438 -7.003 -1.360) 7.919 4.463 ( -1.499 3.747 -5.980) 7.214 4.580 ( -1.898 -5.900 -8.425) 10.459 4.723 ( 13.753 3.859 -0.569) 14.295 4.769 ( 11.907 0.074 -0.513) 11.918 5.425 ( 3.696 -0.086 -1.506) 3.992 5.445 ( 4.379 -2.204 -1.455) 5.114 5.790 ( -4.050 1.992 6.846) 8.200 5.872 ( -3.126 -5.189 5.486) 8.173 6.069 ( -6.662 4.953 -4.758) 9.569 6.160 ( -5.851 -2.898 -5.151) 8.316 6.467 ( 2.491 2.615 -2.744) 4.535 6.504 ( -2.701 -1.434 -2.638) 4.038 6.751 ( 10.075 3.900 -0.562) 10.818 6.835 ( 9.100 -3.006 -0.108) 9.584 7.148 ( -0.121 3.151 5.054) 5.957 7.267 ( 0.645 -7.499 4.465) 8.752 7.374 ( 6.519 1.647 -5.463) 8.663 7.464 ( 5.434 -6.462 -6.957) 10.941 8.356 ( -1.718 1.749 -0.200) 2.459 8.365 ( -1.039 1.071 1.594) 2.183 8.660 ( 2.212 2.008 1.895) 3.538 8.708 ( 2.676 -2.200 -1.093) 3.633 9.898 ( -0.466 4.911 6.803) 8.404 9.948 ( 0.528 0.484 6.162) 6.203 10.205 ( 1.293 7.694 -3.035) 8.371 10.281 ( 4.115 1.757 -3.349) 5.590 10.529 ( -2.596 4.213 -2.220) 5.424 10.581 ( 0.238 0.272 -3.709) 3.726 11.012 ( -3.690 -0.775 2.009) 4.272 11.052 ( -2.535 -4.258 0.644) 4.997 12.266 ( -5.150 1.774 1.497) 5.649 12.333 ( -4.295 -4.499 -0.873) 6.281 12.572 ( 1.997 0.826 1.244) 2.494 12.623 ( 1.911 -3.580 1.258) 4.249 13.158 ( -4.594 -0.997 0.668) 4.748 13.175 ( -4.962 -2.065 -1.497) 5.579 13.702 ( -0.848 2.570 2.083) 3.415 13.773 ( -0.067 -3.527 2.395) 4.264 14.117 ( -3.118 0.407 2.430) 3.974 14.136 ( -1.540 -1.633 4.693) 5.203 14.428 ( 7.740 1.433 -3.447) 8.593 14.470 ( 8.949 -2.854 -6.141) 11.222 19.471 ( -10.654 10.148 5.851) 15.834 19.606 ( -12.083 -0.957 4.000) 12.764 19.971 ( -2.430 6.264 -6.087) 9.066 20.135 ( -3.407 -8.320 -7.246) 11.547 21.550 ( 8.036 4.265 -5.357) 10.558 21.661 ( 12.499 -5.838 -5.266) 14.766 21.919 ( 1.430 6.470 4.675) 8.109 22.056 ( 7.242 -6.293 5.701) 11.161 23.834 ( -0.195 1.594 1.112) 1.954 23.858 ( 0.802 -0.543 0.339) 1.026 24.305 ( 0.884 3.326 0.251) 3.451 24.376 ( 3.923 -3.244 0.147) 5.093 ======================= Grid point 201 (111/116) ======================= q-point: ( 0.25 0.43 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.160 ( 8.479 8.931 5.364) 13.432 2.349 ( 5.516 -7.446 2.880) 9.703 2.500 ( 16.776 9.161 -3.288) 19.395 2.575 ( 5.637 6.306 4.722) 9.687 2.694 ( 0.889 0.330 -3.554) 3.678 2.745 ( 10.954 -5.979 1.322) 12.549 3.032 ( -2.061 2.820 1.676) 3.874 3.094 ( 0.095 -2.058 -4.017) 4.514 3.156 ( -3.974 3.383 2.784) 5.915 3.297 ( -6.703 -4.837 5.820) 10.109 3.380 ( -2.213 3.700 2.819) 5.151 3.474 ( 0.129 -3.713 10.901) 11.516 3.746 ( 2.578 5.143 1.321) 5.903 3.796 ( 6.243 0.646 4.871) 7.945 3.945 ( 2.020 4.205 -0.341) 4.678 4.103 ( 2.228 -6.997 -2.007) 7.613 4.195 ( 1.408 0.988 -9.320) 9.477 4.264 ( 0.416 -3.267 -9.433) 9.991 4.442 ( 2.821 4.277 -1.691) 5.395 4.550 ( 1.716 -5.514 -2.777) 6.408 4.924 ( 7.669 6.084 -1.738) 9.942 4.977 ( 8.625 1.217 -2.067) 8.953 5.508 ( 4.764 -0.531 -2.168) 5.260 5.527 ( 4.394 -2.686 -2.818) 5.871 5.759 ( -1.167 1.478 5.921) 6.213 5.833 ( -2.663 -4.711 5.277) 7.559 5.960 ( -2.454 1.330 -1.544) 3.190 6.026 ( -5.052 -4.342 -2.374) 7.072 6.470 ( -0.485 2.896 -2.607) 3.927 6.519 ( 2.431 -1.044 -4.122) 4.898 6.850 ( 0.113 3.591 -0.093) 3.594 6.929 ( 0.322 -2.893 -1.193) 3.146 7.187 ( 2.637 4.049 3.612) 6.033 7.293 ( 1.601 -5.197 1.430) 5.623 7.510 ( 7.565 -0.647 -4.166) 8.660 7.558 ( 5.886 -4.642 -6.793) 10.116 8.328 ( -1.198 2.015 0.405) 2.379 8.348 ( -1.156 0.317 1.811) 2.172 8.723 ( 3.292 1.898 1.883) 4.241 8.761 ( 2.723 -1.416 -0.198) 3.075 9.932 ( 2.076 5.641 6.920) 9.166 9.997 ( 2.185 0.102 8.387) 8.668 10.243 ( 3.611 8.058 -3.244) 9.407 10.356 ( 4.407 -0.123 -3.500) 5.629 10.453 ( -4.713 5.140 -1.332) 7.100 10.558 ( -1.503 -1.953 -5.100) 5.664 10.942 ( -3.627 0.899 1.756) 4.129 10.999 ( -2.701 -3.731 0.624) 4.648 12.171 ( -4.565 1.268 0.638) 4.780 12.236 ( -4.613 -4.928 -2.240) 7.112 12.605 ( 0.807 0.412 0.165) 0.921 12.648 ( 0.422 -2.963 0.843) 3.110 13.038 ( -5.354 1.688 -0.915) 5.688 13.101 ( -2.607 -4.089 0.135) 4.851 13.659 ( -4.886 5.049 1.077) 7.108 13.728 ( -4.313 -1.419 0.983) 4.646 14.088 ( 0.821 5.272 5.985) 8.018 14.229 ( 5.947 -6.960 5.643) 10.754 14.535 ( 4.362 1.232 -3.279) 5.595 14.614 ( 7.395 -5.548 -7.335) 11.801 19.282 ( -9.569 7.677 2.383) 12.497 19.368 ( -12.599 0.700 2.180) 12.805 19.864 ( -6.032 2.906 -2.270) 7.069 19.986 ( -8.869 -8.028 -2.183) 12.160 21.732 ( 11.901 8.552 -7.873) 16.636 21.870 ( 6.764 0.470 0.734) 6.820 22.062 ( 13.862 0.413 -2.832) 14.155 22.229 ( 7.393 -10.826 8.216) 15.471 23.834 ( -0.095 2.285 1.073) 2.526 23.872 ( 0.453 -0.795 -0.206) 0.938 24.348 ( 3.093 5.137 1.059) 6.089 24.453 ( 3.630 -4.449 -0.083) 5.742 ======================= Grid point 202 (112/116) ======================= q-point: ( 0.38 0.43 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.309 ( 6.064 7.512 2.583) 9.994 2.462 ( 5.144 -4.953 0.127) 7.142 2.596 ( -3.364 6.924 8.085) 11.164 2.609 ( -3.841 3.635 1.678) 5.549 2.817 ( 10.799 6.623 -3.775) 13.219 2.926 ( 3.350 -0.538 6.938) 7.723 2.976 ( 0.785 -1.260 -5.213) 5.420 3.038 ( -3.996 -3.675 0.165) 5.431 3.121 ( -1.722 -0.371 -0.589) 1.858 3.196 ( -5.055 -4.721 0.894) 6.974 3.448 ( 7.194 4.014 4.992) 9.633 3.554 ( 3.820 -4.327 10.608) 12.077 3.765 ( -0.442 6.180 1.870) 6.472 3.900 ( 1.727 -3.788 2.920) 5.085 4.019 ( 4.103 3.234 -3.430) 6.249 4.120 ( -0.648 -7.305 -2.929) 7.897 4.189 ( 2.395 1.431 -8.543) 8.987 4.226 ( -0.559 -2.262 -7.396) 7.754 4.566 ( 7.840 3.804 -0.454) 8.726 4.628 ( 5.418 -2.104 -0.567) 5.839 5.023 ( 3.046 7.070 -0.501) 7.715 5.073 ( 2.688 2.640 -3.073) 4.862 5.577 ( 2.826 -2.152 -1.917) 4.037 5.588 ( 2.724 -3.772 -2.317) 5.198 5.757 ( -0.729 1.988 3.220) 3.854 5.806 ( -1.028 -1.892 2.057) 2.978 5.964 ( 1.067 -2.900 1.174) 3.306 5.978 ( 0.770 -3.576 -1.857) 4.102 6.460 ( 0.405 4.800 0.525) 4.845 6.539 ( 0.956 -1.863 -1.086) 2.358 6.788 ( -5.034 3.475 -1.250) 6.243 6.870 ( -4.653 -3.371 -3.189) 6.572 7.253 ( 2.822 2.671 2.655) 4.706 7.327 ( 1.321 -3.879 -0.237) 4.105 7.596 ( 1.816 -0.601 -1.845) 2.658 7.628 ( 3.077 -3.542 -5.856) 7.503 8.316 ( -0.115 1.950 0.960) 2.177 8.337 ( -0.095 0.108 0.152) 0.210 8.780 ( 1.867 1.484 1.551) 2.845 8.803 ( 1.460 -0.509 0.214) 1.561 10.014 ( 3.605 5.780 8.081) 10.569 10.073 ( 2.360 0.823 10.466) 10.760 10.318 ( 4.926 5.792 -3.626) 8.424 10.346 ( -5.027 7.593 -3.216) 9.657 10.420 ( 2.502 -2.850 -1.846) 4.218 10.492 ( -3.233 -4.184 -6.718) 8.549 10.899 ( -0.936 2.928 1.067) 3.254 10.959 ( -1.475 -1.861 -0.902) 2.540 12.104 ( -2.535 0.716 0.869) 2.774 12.158 ( -2.514 -4.417 -2.915) 5.859 12.601 ( -1.155 0.411 1.439) 1.890 12.641 ( -1.131 -3.117 -0.607) 3.370 12.990 ( 0.381 3.101 0.878) 3.245 13.069 ( -1.336 -4.399 0.963) 4.697 13.565 ( -3.968 3.985 0.027) 5.624 13.625 ( -5.792 -1.704 0.125) 6.038 14.160 ( 3.266 8.681 8.657) 12.687 14.340 ( 3.706 -5.405 3.011) 7.212 14.581 ( 1.459 0.461 -2.094) 2.594 14.699 ( 3.869 -8.085 -8.181) 12.135 19.139 ( -5.220 4.645 0.069) 6.988 19.167 ( -8.007 2.485 0.942) 8.437 19.765 ( -3.610 -0.938 0.876) 3.831 19.828 ( -6.437 -6.538 0.058) 9.175 21.919 ( 6.199 10.464 -2.004) 12.327 21.940 ( 3.158 9.207 0.901) 9.775 22.342 ( 11.874 -10.257 -5.004) 16.470 22.357 ( 5.760 -11.083 2.768) 12.793 23.836 ( -0.198 2.854 1.509) 3.235 23.873 ( -0.116 -0.173 -0.678) 0.709 24.416 ( 3.185 4.139 1.540) 5.444 24.503 ( 1.606 -3.694 -1.080) 4.170 ======================= Grid point 203 (113/116) ======================= q-point: (-0.50 0.43 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.392 ( 0.598 6.741 5.458) 8.695 2.431 ( -6.868 4.044 3.590) 8.741 2.584 ( -0.190 4.624 2.196) 5.123 2.631 ( 6.749 0.551 -1.043) 6.851 2.883 ( -2.793 2.543 4.694) 6.025 2.922 ( -3.773 -0.363 1.579) 4.106 2.996 ( -0.914 -0.365 -0.732) 1.227 3.035 ( 4.571 -3.220 -2.954) 6.323 3.103 ( -0.913 -2.183 1.143) 2.628 3.119 ( -1.848 -3.399 0.779) 3.947 3.568 ( 0.333 4.425 6.916) 8.217 3.661 ( 5.636 -2.766 1.749) 6.517 3.778 ( 1.234 3.442 6.117) 7.127 3.889 ( -2.627 -4.542 5.116) 7.328 4.025 ( -0.724 1.056 -12.614) 12.678 4.072 ( -0.910 -2.358 -11.701) 11.971 4.203 ( -0.889 -0.893 1.571) 2.014 4.231 ( 0.866 -2.916 -1.915) 3.594 4.667 ( 1.744 1.836 -0.372) 2.559 4.686 ( -0.170 0.354 -1.925) 1.964 5.034 ( -1.928 6.938 2.043) 7.485 5.083 ( -0.499 3.159 -2.443) 4.025 5.579 ( -2.940 -1.503 1.924) 3.821 5.614 ( -0.532 -4.025 -1.037) 4.190 5.761 ( 0.749 2.382 1.854) 3.110 5.815 ( 2.686 -1.610 -2.634) 4.092 5.970 ( -0.177 -2.037 0.059) 2.046 6.014 ( 2.690 -5.096 -3.689) 6.842 6.498 ( 1.549 4.710 3.659) 6.162 6.548 ( -1.052 1.259 -0.340) 1.676 6.719 ( 0.436 0.676 0.140) 0.817 6.772 ( -2.775 -3.101 -4.120) 5.856 7.302 ( 1.366 0.531 1.804) 2.325 7.335 ( -0.294 -2.306 -1.154) 2.595 7.585 ( -2.249 0.309 0.948) 2.460 7.637 ( -0.486 -4.228 -3.741) 5.666 8.324 ( 0.511 2.469 0.169) 2.527 8.353 ( 2.074 -0.177 -2.577) 3.313 8.803 ( 0.096 0.935 1.494) 1.765 8.814 ( -0.388 0.085 0.467) 0.613 10.090 ( 0.156 5.381 9.755) 11.142 10.128 ( -0.563 3.292 12.999) 13.421 10.258 ( -1.997 6.646 -4.908) 8.499 10.381 ( -3.816 -0.775 -6.582) 7.648 10.399 ( 3.136 -0.059 -1.337) 3.410 10.469 ( 2.905 -3.406 -6.409) 7.818 10.912 ( 1.741 2.661 -0.350) 3.199 10.938 ( 0.095 0.359 -2.686) 2.711 12.076 ( -0.920 0.251 2.178) 2.378 12.120 ( -0.770 -3.876 -2.028) 4.441 12.585 ( -0.927 0.359 2.840) 3.009 12.616 ( -0.975 -2.566 -0.210) 2.753 13.031 ( 2.047 -0.019 1.189) 2.367 13.040 ( -1.319 -0.936 0.310) 1.647 13.533 ( -0.048 0.745 1.135) 1.359 13.538 ( -1.808 0.282 0.646) 1.941 14.238 ( 1.712 8.529 8.744) 12.334 14.379 ( 0.135 -0.175 -1.983) 1.995 14.586 ( -0.619 -2.083 1.036) 2.407 14.716 ( 0.520 -9.687 -8.644) 12.993 19.076 ( -0.970 4.486 1.180) 4.739 19.107 ( 1.809 1.770 -1.857) 3.139 19.723 ( -1.850 -1.983 3.593) 4.501 19.769 ( 0.921 -5.988 -0.891) 6.123 21.896 ( -5.464 12.481 7.343) 15.478 22.040 ( 3.282 5.197 -4.797) 7.797 22.357 ( -3.726 -4.315 4.192) 7.077 22.541 ( 7.775 -15.384 -11.749) 20.860 23.837 ( -0.227 3.132 2.060) 3.756 23.866 ( -0.361 0.647 -0.741) 1.048 24.466 ( 0.986 1.732 1.680) 2.606 24.509 ( -0.121 -2.030 -2.415) 3.157 ======================= Grid point 204 (114/116) ======================= q-point: (-0.38 0.43 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.323 ( -4.901 7.395 3.057) 9.384 2.382 ( -2.835 4.174 8.418) 9.815 2.595 ( -0.593 10.615 1.031) 10.681 2.724 ( -0.948 3.592 -3.614) 5.183 2.764 ( -8.497 -3.748 0.443) 9.297 2.832 ( -5.425 -7.053 5.893) 10.673 2.997 ( -2.185 -1.276 2.541) 3.586 3.032 ( -1.971 -5.807 -0.750) 6.178 3.117 ( 3.381 0.481 0.664) 3.479 3.159 ( 4.742 -3.257 3.062) 6.517 3.536 ( -2.070 9.743 -1.381) 10.056 3.718 ( -1.312 -5.186 -1.150) 5.472 3.821 ( 0.333 4.641 5.498) 7.202 3.884 ( 0.798 1.308 7.360) 7.518 3.981 ( -0.214 0.824 -9.175) 9.215 4.008 ( -2.040 -3.505 -8.229) 9.174 4.153 ( -4.424 -0.472 0.303) 4.459 4.212 ( -1.626 -6.047 -2.365) 6.693 4.587 ( -7.841 3.044 -2.127) 8.676 4.637 ( -4.616 -2.074 -1.615) 5.312 4.986 ( -3.590 6.273 2.997) 7.825 5.035 ( -4.102 2.413 0.533) 4.789 5.510 ( -4.009 -0.123 2.972) 4.992 5.557 ( -4.205 -3.359 1.229) 5.520 5.808 ( 3.643 2.375 -1.376) 4.562 5.872 ( 3.344 -2.643 -3.555) 5.551 5.964 ( 0.145 0.251 -1.549) 1.576 6.044 ( 1.400 -6.538 -5.610) 8.728 6.463 ( -3.563 3.347 0.643) 4.931 6.511 ( -3.548 -0.322 1.484) 3.859 6.780 ( 4.920 1.415 -0.385) 5.134 6.816 ( 5.624 -1.279 1.559) 5.975 7.308 ( -1.823 -0.461 -1.527) 2.422 7.314 ( -0.517 -1.155 0.497) 1.359 7.526 ( -4.609 -0.111 3.282) 5.659 7.589 ( -3.930 -5.212 -1.343) 6.664 8.336 ( 1.052 3.713 -1.784) 4.252 8.388 ( 2.335 -0.867 -3.885) 4.615 8.792 ( -1.634 0.598 1.146) 2.084 8.795 ( -1.629 0.321 0.412) 1.710 10.053 ( -5.135 7.026 6.550) 10.892 10.126 ( -3.618 3.360 10.350) 11.467 10.235 ( -1.635 3.239 -1.827) 4.062 10.293 ( -1.772 0.809 -1.840) 2.679 10.459 ( 4.082 0.656 -6.209) 7.460 10.515 ( 3.461 -2.768 -5.390) 6.978 10.933 ( 1.422 2.119 -1.888) 3.175 10.968 ( 2.880 -0.705 -2.092) 3.628 12.086 ( 1.293 -0.261 3.606) 3.839 12.121 ( 1.594 -3.602 -0.440) 3.963 12.580 ( -1.028 -0.238 3.998) 4.135 12.607 ( -0.307 -2.671 1.805) 3.238 13.005 ( -0.797 2.829 -0.486) 2.979 13.076 ( 1.270 -3.787 0.319) 4.007 13.542 ( 3.048 3.661 2.010) 5.170 13.601 ( 4.950 -1.760 2.218) 5.703 14.264 ( -1.609 6.928 5.386) 8.921 14.344 ( -2.196 3.000 -4.231) 5.632 14.561 ( -2.915 -3.316 3.450) 5.603 14.670 ( -2.582 -10.034 -8.414) 13.347 19.135 ( 6.879 6.587 0.127) 9.525 19.206 ( 8.849 0.495 -2.279) 9.151 19.730 ( 1.599 0.933 3.657) 4.099 19.833 ( 5.206 -8.152 0.047) 9.673 21.771 ( -9.280 11.825 6.526) 16.387 22.001 ( -7.347 -6.512 2.184) 10.057 22.263 ( -5.071 9.094 -4.080) 11.183 22.566 ( -1.510 -16.414 -11.794) 20.268 23.839 ( -0.213 2.664 2.005) 3.340 23.857 ( -0.465 0.965 0.014) 1.071 24.445 ( -2.814 2.149 -0.684) 3.606 24.501 ( -0.610 -3.058 -1.265) 3.365 ======================= Grid point 205 (115/116) ======================= q-point: (-0.25 0.43 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.250 ( -4.224 9.604 -1.193) 10.560 2.332 ( -7.766 10.614 8.828) 15.840 2.423 ( -14.570 1.777 -0.365) 14.682 2.600 ( -9.665 -4.602 2.228) 10.934 2.636 ( -5.415 -2.021 2.998) 6.511 2.727 ( -6.055 -2.009 -0.309) 6.387 2.934 ( -4.733 -1.747 7.633) 9.149 2.993 ( -3.010 -7.206 4.000) 8.774 3.245 ( 8.995 3.158 -1.514) 9.653 3.292 ( 7.184 -1.167 2.723) 7.771 3.513 ( -0.387 10.576 -4.730) 11.592 3.660 ( -2.071 -1.078 -2.303) 3.280 3.812 ( -2.084 4.516 -1.935) 5.337 3.887 ( -3.879 -2.121 -4.367) 6.215 3.907 ( -0.062 4.570 3.266) 5.617 4.022 ( 0.220 -0.355 1.282) 1.349 4.101 ( 1.982 -3.019 0.808) 3.701 4.154 ( -4.357 -6.664 -4.117) 8.964 4.446 ( -4.041 2.027 -1.170) 4.670 4.533 ( -4.412 -5.810 -0.719) 7.331 4.899 ( -6.236 5.440 0.786) 8.312 4.943 ( -5.979 1.096 0.888) 6.143 5.449 ( -3.475 0.258 2.858) 4.507 5.480 ( -4.069 -2.043 1.481) 4.788 5.876 ( 3.423 2.767 -3.365) 5.541 5.919 ( 3.187 -0.858 -4.081) 5.248 5.988 ( 3.400 -0.861 -3.821) 5.187 6.040 ( 0.837 -5.408 -4.148) 6.867 6.419 ( -1.100 0.851 2.189) 2.594 6.443 ( -3.527 -0.870 3.005) 4.715 6.848 ( 0.205 3.299 0.123) 3.308 6.896 ( 0.710 -0.820 1.779) 2.084 7.263 ( -1.621 1.485 -2.290) 3.174 7.300 ( -0.903 -2.309 1.066) 2.699 7.424 ( -6.687 -2.283 4.191) 8.216 7.475 ( -7.225 -5.813 -0.857) 9.312 8.352 ( 1.093 4.251 -2.082) 4.858 8.412 ( 1.320 -1.030 -4.041) 4.374 8.750 ( -3.036 0.248 0.777) 3.144 8.753 ( -2.533 0.090 -0.683) 2.625 9.971 ( -4.563 6.907 4.500) 9.422 10.061 ( -5.065 0.848 5.781) 7.733 10.188 ( -1.239 6.250 -1.498) 6.546 10.282 ( -0.835 0.968 0.359) 1.328 10.516 ( 3.469 1.685 -5.901) 7.050 10.563 ( 2.818 -1.110 -4.700) 5.592 10.973 ( 3.071 0.614 -1.195) 3.352 11.013 ( 2.289 -2.662 -0.836) 3.609 12.155 ( 4.745 -0.126 3.093) 5.666 12.190 ( 5.441 -3.464 1.302) 6.580 12.559 ( -2.334 -0.091 4.505) 5.075 12.605 ( -1.107 -4.104 4.316) 6.057 13.025 ( 3.104 2.799 0.420) 4.200 13.095 ( 1.032 -3.853 0.717) 4.053 13.648 ( 6.425 4.501 1.804) 8.049 13.714 ( 5.299 -1.606 2.066) 5.910 14.208 ( -3.544 5.441 -2.246) 6.871 14.283 ( -3.809 0.303 -0.634) 3.873 14.489 ( -5.605 -1.564 3.547) 6.815 14.570 ( -5.331 -8.208 -6.855) 11.949 19.329 ( 12.957 8.548 -1.860) 15.633 19.416 ( 13.012 1.249 -2.311) 13.274 19.796 ( 3.693 3.416 4.119) 6.502 19.946 ( 5.633 -9.578 1.312) 11.189 21.601 ( -9.213 8.629 4.553) 13.419 21.799 ( -13.045 -9.485 4.505) 16.746 22.149 ( -5.013 12.442 -7.961) 15.598 22.425 ( -9.184 -13.392 -10.262) 19.209 23.837 ( -0.507 1.716 1.019) 2.059 23.850 ( -0.442 0.663 1.560) 1.751 24.378 ( -3.391 3.403 -1.507) 5.035 24.463 ( -2.984 -4.480 -1.075) 5.489 ======================= Grid point 206 (116/116) ======================= q-point: (-0.12 0.43 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 4.63e-04 4.63e-04 4.63e-04 4.63e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.012 ( -17.891 12.274 4.650) 22.189 2.083 ( -12.035 8.062 -4.881) 15.286 2.338 ( 0.333 3.542 1.594) 3.898 2.422 ( -6.678 -9.790 4.447) 12.658 2.557 ( -4.828 -2.290 2.369) 5.845 2.596 ( -7.688 -2.444 -0.316) 8.073 2.877 ( -2.343 3.937 10.327) 11.298 2.980 ( 0.145 -5.322 7.114) 8.886 3.394 ( 5.811 5.522 -4.653) 9.269 3.421 ( 3.712 3.148 4.027) 6.317 3.453 ( -2.643 8.006 -0.205) 8.434 3.631 ( -2.960 -4.708 -4.284) 7.020 3.768 ( 2.166 4.534 -2.896) 5.799 3.841 ( -2.017 -0.236 -0.479) 2.087 3.945 ( -2.096 -0.957 -7.095) 7.459 3.986 ( -2.987 -1.604 6.970) 7.750 4.081 ( 5.918 4.160 -3.041) 7.847 4.227 ( 8.363 -6.731 3.816) 11.393 4.430 ( 1.413 -1.795 -1.560) 2.766 4.485 ( -1.244 -6.141 0.861) 6.324 4.745 ( -9.696 4.778 -2.822) 11.172 4.804 ( -7.125 -0.722 -3.780) 8.098 5.395 ( -2.358 0.105 1.389) 2.739 5.419 ( -2.536 -1.779 0.871) 3.218 5.902 ( -0.135 2.110 -1.105) 2.385 5.951 ( -0.556 -1.831 -3.106) 3.649 6.045 ( 6.336 3.454 -3.334) 7.950 6.124 ( 6.719 -2.214 -2.347) 7.454 6.407 ( 0.101 1.608 2.515) 2.987 6.461 ( 5.167 -3.386 1.525) 6.363 6.746 ( -10.288 4.953 0.261) 11.421 6.827 ( -7.889 -2.359 0.590) 8.256 7.230 ( -2.922 1.797 1.473) 3.733 7.290 ( -1.041 0.521 -1.495) 1.895 7.314 ( -5.574 -6.281 6.338) 10.521 7.369 ( -0.143 -6.629 -4.657) 8.103 8.365 ( 0.822 3.884 -1.165) 4.137 8.414 ( -0.041 -0.339 -3.030) 3.049 8.687 ( -3.468 0.425 0.908) 3.610 8.701 ( -2.075 -0.956 -1.877) 2.957 9.916 ( -2.606 5.744 5.482) 8.357 9.987 ( -3.870 0.331 3.938) 5.531 10.184 ( 1.116 7.047 -1.837) 7.368 10.253 ( -1.651 2.232 -2.020) 3.434 10.554 ( 2.138 2.566 -4.210) 5.374 10.585 ( 0.788 0.411 -3.986) 4.084 11.032 ( 2.666 -1.344 0.041) 2.986 11.053 ( 1.815 -3.124 0.522) 3.651 12.268 ( 5.558 1.199 1.403) 5.857 12.317 ( 6.158 -3.189 0.633) 6.963 12.528 ( -1.877 -0.003 5.131) 5.463 12.586 ( -2.167 -5.013 4.819) 7.283 13.120 ( 4.836 -0.542 3.013) 5.723 13.135 ( 3.409 -2.183 2.880) 4.968 13.734 ( 0.401 3.593 -1.159) 3.796 13.800 ( 3.115 -1.936 0.105) 3.669 14.173 ( 1.048 1.235 -1.652) 2.314 14.203 ( -2.382 -1.208 -0.215) 2.680 14.372 ( -6.946 1.521 1.392) 7.246 14.435 ( -6.423 -4.722 -4.603) 9.205 19.580 ( 11.576 9.391 -1.595) 14.991 19.638 ( 8.601 6.060 -0.828) 10.554 19.895 ( 5.999 1.152 2.375) 6.554 20.030 ( 2.618 -8.907 0.136) 9.285 21.481 ( -3.312 3.714 1.496) 5.196 21.586 ( -8.866 -5.944 1.965) 10.853 22.027 ( -4.944 7.432 -5.651) 10.564 22.182 ( -12.378 -7.134 -6.343) 15.631 23.831 ( -0.286 1.264 1.286) 1.826 23.847 ( -0.412 0.045 1.436) 1.495 24.321 ( -1.654 2.599 -1.179) 3.299 24.388 ( -4.013 -3.566 -1.031) 5.467 =================== 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 3/28224 10.0 800.723 954.064 955.692 0.000 -86.292 0.000 3/28224 20.0 200.191 187.096 201.510 0.000 -21.325 0.000 3/28224 30.0 79.436 70.457 76.883 0.000 -8.063 0.000 3/28224 40.0 43.167 37.549 41.576 0.000 -4.310 0.000 3/28224 50.0 28.040 24.108 26.939 0.000 -2.754 0.000 3/28224 60.0 20.252 17.299 19.417 0.000 -1.960 0.000 3/28224 70.0 15.660 13.337 14.990 0.000 -1.497 0.000 3/28224 80.0 12.688 10.800 12.132 0.000 -1.202 0.000 3/28224 90.0 10.632 9.059 10.158 0.000 -0.999 0.000 3/28224 100.0 9.137 7.799 8.725 0.000 -0.854 0.000 3/28224 110.0 8.007 6.850 7.643 0.000 -0.744 0.000 3/28224 120.0 7.127 6.112 6.801 0.000 -0.659 0.000 3/28224 130.0 6.425 5.522 6.128 0.000 -0.591 0.000 3/28224 140.0 5.853 5.040 5.578 0.000 -0.537 0.000 3/28224 150.0 5.379 4.640 5.122 0.000 -0.491 0.000 3/28224 160.0 4.980 4.302 4.738 0.000 -0.454 0.000 3/28224 170.0 4.640 4.013 4.409 0.000 -0.422 0.000 3/28224 180.0 4.347 3.763 4.125 0.000 -0.394 0.000 3/28224 190.0 4.092 3.544 3.878 0.000 -0.371 0.000 3/28224 200.0 3.867 3.352 3.660 0.000 -0.350 0.000 3/28224 210.0 3.669 3.180 3.466 0.000 -0.332 0.000 3/28224 220.0 3.491 3.027 3.293 0.000 -0.316 0.000 3/28224 230.0 3.332 2.888 3.138 0.000 -0.302 0.000 3/28224 240.0 3.188 2.763 2.997 0.000 -0.289 0.000 3/28224 250.0 3.057 2.649 2.869 0.000 -0.277 0.000 3/28224 260.0 2.937 2.544 2.752 0.000 -0.267 0.000 3/28224 270.0 2.827 2.448 2.645 0.000 -0.257 0.000 3/28224 280.0 2.726 2.359 2.547 0.000 -0.248 0.000 3/28224 290.0 2.632 2.277 2.455 0.000 -0.240 0.000 3/28224 300.0 2.545 2.201 2.371 0.000 -0.232 0.000 3/28224 310.0 2.464 2.130 2.292 0.000 -0.225 0.000 3/28224 320.0 2.389 2.063 2.219 0.000 -0.219 0.000 3/28224 330.0 2.318 2.001 2.150 0.000 -0.213 0.000 3/28224 340.0 2.251 1.943 2.086 0.000 -0.207 0.000 3/28224 350.0 2.189 1.888 2.025 0.000 -0.201 0.000 3/28224 360.0 2.129 1.836 1.968 0.000 -0.196 0.000 3/28224 370.0 2.074 1.787 1.914 0.000 -0.191 0.000 3/28224 380.0 2.021 1.740 1.864 0.000 -0.187 0.000 3/28224 390.0 1.971 1.696 1.816 0.000 -0.183 0.000 3/28224 400.0 1.923 1.655 1.770 0.000 -0.178 0.000 3/28224 410.0 1.878 1.615 1.727 0.000 -0.174 0.000 3/28224 420.0 1.834 1.577 1.685 0.000 -0.171 0.000 3/28224 430.0 1.793 1.541 1.646 0.000 -0.167 0.000 3/28224 440.0 1.754 1.507 1.609 0.000 -0.164 0.000 3/28224 450.0 1.716 1.474 1.573 0.000 -0.160 0.000 3/28224 460.0 1.680 1.442 1.539 0.000 -0.157 0.000 3/28224 470.0 1.646 1.412 1.506 0.000 -0.154 0.000 3/28224 480.0 1.613 1.383 1.475 0.000 -0.151 0.000 3/28224 490.0 1.581 1.356 1.445 0.000 -0.148 0.000 3/28224 500.0 1.550 1.329 1.416 0.000 -0.146 0.000 3/28224 510.0 1.521 1.303 1.389 0.000 -0.143 0.000 3/28224 520.0 1.493 1.279 1.362 0.000 -0.140 0.000 3/28224 530.0 1.466 1.255 1.337 0.000 -0.138 0.000 3/28224 540.0 1.439 1.232 1.312 0.000 -0.136 0.000 3/28224 550.0 1.414 1.210 1.288 0.000 -0.133 0.000 3/28224 560.0 1.390 1.189 1.265 0.000 -0.131 0.000 3/28224 570.0 1.366 1.168 1.243 0.000 -0.129 0.000 3/28224 580.0 1.343 1.149 1.222 0.000 -0.127 0.000 3/28224 590.0 1.321 1.129 1.201 0.000 -0.125 0.000 3/28224 600.0 1.300 1.111 1.182 0.000 -0.123 0.000 3/28224 610.0 1.279 1.093 1.162 0.000 -0.121 0.000 3/28224 620.0 1.259 1.076 1.144 0.000 -0.119 0.000 3/28224 630.0 1.240 1.059 1.126 0.000 -0.118 0.000 3/28224 640.0 1.221 1.043 1.108 0.000 -0.116 0.000 3/28224 650.0 1.202 1.027 1.091 0.000 -0.114 0.000 3/28224 660.0 1.185 1.011 1.075 0.000 -0.113 0.000 3/28224 670.0 1.168 0.997 1.059 0.000 -0.111 0.000 3/28224 680.0 1.151 0.982 1.043 0.000 -0.110 0.000 3/28224 690.0 1.135 0.968 1.028 0.000 -0.108 0.000 3/28224 700.0 1.119 0.954 1.014 0.000 -0.107 0.000 3/28224 710.0 1.103 0.941 1.000 0.000 -0.105 0.000 3/28224 720.0 1.088 0.928 0.986 0.000 -0.104 0.000 3/28224 730.0 1.074 0.916 0.972 0.000 -0.102 0.000 3/28224 740.0 1.060 0.904 0.959 0.000 -0.101 0.000 3/28224 750.0 1.046 0.892 0.947 0.000 -0.100 0.000 3/28224 760.0 1.032 0.880 0.934 0.000 -0.099 0.000 3/28224 770.0 1.019 0.869 0.922 0.000 -0.097 0.000 3/28224 780.0 1.007 0.858 0.910 0.000 -0.096 0.000 3/28224 790.0 0.994 0.847 0.899 0.000 -0.095 0.000 3/28224 800.0 0.982 0.837 0.888 0.000 -0.094 0.000 3/28224 810.0 0.970 0.826 0.877 0.000 -0.093 0.000 3/28224 820.0 0.959 0.816 0.866 0.000 -0.092 0.000 3/28224 830.0 0.947 0.807 0.856 0.000 -0.091 0.000 3/28224 840.0 0.936 0.797 0.846 0.000 -0.090 0.000 3/28224 850.0 0.925 0.788 0.836 0.000 -0.089 0.000 3/28224 860.0 0.915 0.779 0.826 0.000 -0.088 0.000 3/28224 870.0 0.904 0.770 0.817 0.000 -0.087 0.000 3/28224 880.0 0.894 0.761 0.808 0.000 -0.086 0.000 3/28224 890.0 0.885 0.753 0.799 0.000 -0.085 0.000 3/28224 900.0 0.875 0.745 0.790 0.000 -0.084 0.000 3/28224 910.0 0.865 0.737 0.781 0.000 -0.083 0.000 3/28224 920.0 0.856 0.729 0.773 0.000 -0.082 0.000 3/28224 930.0 0.847 0.721 0.764 0.000 -0.081 0.000 3/28224 940.0 0.838 0.713 0.756 0.000 -0.080 0.000 3/28224 950.0 0.830 0.706 0.748 0.000 -0.080 0.000 3/28224 960.0 0.821 0.699 0.741 0.000 -0.079 0.000 3/28224 970.0 0.813 0.691 0.733 0.000 -0.078 0.000 3/28224 980.0 0.805 0.684 0.726 0.000 -0.077 0.000 3/28224 990.0 0.797 0.678 0.718 0.000 -0.077 0.000 3/28224 1000.0 0.789 0.671 0.711 0.000 -0.076 0.000 3/28224 Thermal conductivity related properties were written into "kappa-m877.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 13:37:33]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|